NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
617610 | 5us5 | 30245 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1HT MET 1 -15.359 5.090 31.448 2 H2 MET 1 2HT MET 1 -16.262 5.260 30.024 3 H3 MET 1 3HT MET 1 -15.411 6.572 30.680 4 HA MET 1 HA MET 1 -14.132 4.124 29.726 5 HB2 MET 1 2HB MET 1 -14.413 6.828 28.408 6 HB3 MET 1 1HB MET 1 -13.210 5.657 27.915 7 HG2 MET 1 2HG MET 1 -15.089 5.597 26.424 8 HG3 MET 1 1HG MET 1 -15.011 4.092 27.328 9 HE1 MET 1 1HE MET 1 -18.828 4.595 26.749 10 HE2 MET 1 2HE MET 1 -17.458 3.502 26.563 11 HE3 MET 1 3HE MET 1 -17.520 5.007 25.643 12 H GLY 2 H GLY 2 -11.757 4.821 29.185 13 HA2 GLY 2 2HA GLY 2 -10.684 6.781 30.970 14 HA3 GLY 2 1HA GLY 2 -10.363 5.115 31.451 15 H PHE 3 H PHE 3 -9.916 7.503 28.935 16 HA PHE 3 HA PHE 3 -8.216 5.779 27.410 17 HB2 PHE 3 2HB PHE 3 -8.705 8.759 27.144 18 HB3 PHE 3 1HB PHE 3 -7.762 7.793 26.022 19 HD1 PHE 3 1HD PHE 3 -11.084 8.753 27.112 20 HD2 PHE 3 2HD PHE 3 -8.884 6.138 24.578 21 HE1 PHE 3 1HE PHE 3 -13.132 8.274 25.836 22 HE2 PHE 3 2HE PHE 3 -10.930 5.657 23.296 23 HZ PHE 3 HZ PHE 3 -13.055 6.725 23.924 24 H THR 4 H THR 4 -6.668 5.164 28.791 25 HA THR 4 HA THR 4 -4.934 7.182 29.929 26 HB THR 4 HB THR 4 -3.928 5.181 31.091 27 HG1 THR 4 1HG THR 4 -4.757 3.734 29.472 28 HG21 THR 4 1HG2 THR 4 -5.614 6.598 32.199 29 HG22 THR 4 2HG2 THR 4 -5.815 4.909 32.653 30 HG23 THR 4 3HG2 THR 4 -6.897 5.638 31.466 31 H ASP 5 H ASP 5 -3.522 7.833 28.417 32 HA ASP 5 HA ASP 5 -1.818 5.815 27.236 33 HB2 ASP 5 2HB ASP 5 -3.440 6.148 25.481 34 HB3 ASP 5 1HB ASP 5 -3.272 7.898 25.607 35 H GLU 6 H GLU 6 0.072 6.380 27.886 36 HA GLU 6 HA GLU 6 0.783 9.163 27.520 37 HB2 GLU 6 2HB GLU 6 0.693 8.728 29.919 38 HB3 GLU 6 1HB GLU 6 1.788 7.363 29.730 39 HG2 GLU 6 2HG GLU 6 3.533 8.888 28.925 40 HG3 GLU 6 1HG GLU 6 2.438 10.246 29.152 41 H THR 7 H THR 7 1.615 8.819 25.523 42 HA THR 7 HA THR 7 3.666 6.863 25.286 43 HB THR 7 HB THR 7 3.934 7.759 22.935 44 HG1 THR 7 1HG THR 7 1.538 9.209 23.340 45 HG21 THR 7 1HG2 THR 7 1.129 6.976 23.737 46 HG22 THR 7 2HG2 THR 7 2.455 5.869 23.385 47 HG23 THR 7 3HG2 THR 7 1.788 6.881 22.105 48 H VAL 8 H VAL 8 5.532 7.213 26.102 49 HA VAL 8 HA VAL 8 6.385 9.642 27.184 50 HB VAL 8 HB VAL 8 7.171 7.439 27.975 51 HG11 VAL 8 1HG1 VAL 8 7.463 6.281 25.882 52 HG12 VAL 8 2HG1 VAL 8 8.959 6.242 26.811 53 HG13 VAL 8 3HG1 VAL 8 8.797 7.347 25.448 54 HG21 VAL 8 1HG2 VAL 8 9.517 8.029 28.364 55 HG22 VAL 8 2HG2 VAL 8 8.452 9.425 28.564 56 HG23 VAL 8 3HG2 VAL 8 9.413 9.250 27.099 57 H ARG 9 H ARG 9 6.618 8.368 24.053 58 HA ARG 9 HA ARG 9 7.361 9.114 22.092 59 HB2 ARG 9 2HB ARG 9 8.073 11.669 23.560 60 HB3 ARG 9 1HB ARG 9 8.117 11.462 21.817 61 HG2 ARG 9 2HG ARG 9 5.716 11.111 21.771 62 HG3 ARG 9 1HG ARG 9 5.653 11.230 23.532 63 HD2 ARG 9 2HD ARG 9 6.459 13.505 23.428 64 HD3 ARG 9 1HD ARG 9 6.581 13.419 21.672 65 HE ARG 9 HE ARG 9 3.968 12.794 22.541 66 HH11 ARG 9 1HH1 ARG 9 6.136 15.559 22.205 67 HH12 ARG 9 2HH1 ARG 9 4.886 16.680 21.871 68 HH21 ARG 9 1HH2 ARG 9 2.268 14.333 22.107 69 HH22 ARG 9 2HH2 ARG 9 2.635 15.963 21.815 70 H PHE 10 H PHE 10 8.852 7.677 21.802 71 HA PHE 10 HA PHE 10 11.364 7.717 23.113 72 HB2 PHE 10 2HB PHE 10 10.310 5.636 22.240 73 HB3 PHE 10 1HB PHE 10 10.528 6.245 20.603 74 HD1 PHE 10 1HD PHE 10 12.132 4.757 23.491 75 HD2 PHE 10 2HD PHE 10 12.771 6.391 19.621 76 HE1 PHE 10 1HE PHE 10 14.382 3.773 23.448 77 HE2 PHE 10 2HE PHE 10 15.025 5.409 19.575 78 HZ PHE 10 HZ PHE 10 15.827 4.104 21.482 79 H ASP 11 H ASP 11 10.274 8.361 19.824 80 HA ASP 11 HA ASP 11 11.138 9.423 18.081 81 HB2 ASP 11 2HB ASP 11 12.063 11.313 20.241 82 HB3 ASP 11 1HB ASP 11 12.334 11.639 18.535 83 H PHE 12 H PHE 12 12.380 7.915 17.270 84 HA PHE 12 HA PHE 12 15.098 7.779 18.155 85 HB2 PHE 12 2HB PHE 12 15.369 5.986 16.428 86 HB3 PHE 12 1HB PHE 12 14.146 5.641 17.634 87 HD1 PHE 12 1HD PHE 12 11.874 5.364 17.014 88 HD2 PHE 12 2HD PHE 12 14.755 6.515 14.112 89 HE1 PHE 12 1HE PHE 12 10.270 4.839 15.223 90 HE2 PHE 12 2HE PHE 12 13.168 5.998 12.321 91 HZ PHE 12 HZ PHE 12 10.915 5.157 12.872 92 H ASP 13 H ASP 13 16.819 8.443 17.107 93 HA ASP 13 HA ASP 13 16.384 10.676 15.385 94 HB2 ASP 13 2HB ASP 13 18.190 10.508 17.146 95 HB3 ASP 13 1HB ASP 13 19.004 9.351 16.100 96 H ASP 14 H ASP 14 16.856 10.827 13.191 97 HA ASP 14 HA ASP 14 16.508 8.402 11.806 98 HB2 ASP 14 2HB ASP 14 15.555 10.411 10.834 99 HB3 ASP 14 1HB ASP 14 17.148 11.153 10.706 100 H ASN 15 H ASN 15 17.843 7.072 11.071 101 HA ASN 15 HA ASN 15 20.567 7.701 10.334 102 HB2 ASN 15 2HB ASN 15 20.736 7.497 12.816 103 HB3 ASN 15 1HB ASN 15 20.064 5.882 12.703 104 HD21 ASN 15 1HD2 ASN 15 22.853 7.861 12.110 105 HD22 ASN 15 2HD2 ASN 15 23.969 6.572 11.880 106 H ARG 16 H ARG 16 17.929 5.474 10.828 107 HA ARG 16 HA ARG 16 19.179 3.299 9.442 108 HB2 ARG 16 2HB ARG 16 16.311 3.658 10.345 109 HB3 ARG 16 1HB ARG 16 17.057 2.158 9.820 110 HG2 ARG 16 2HG ARG 16 17.785 3.725 12.282 111 HG3 ARG 16 1HG ARG 16 16.835 2.242 12.244 112 HD2 ARG 16 2HD ARG 16 18.767 1.037 11.348 113 HD3 ARG 16 1HD ARG 16 19.702 2.533 11.346 114 HE ARG 16 HE ARG 16 18.594 1.845 13.891 115 HH11 ARG 16 1HH1 ARG 16 21.388 1.372 11.748 116 HH12 ARG 16 2HH1 ARG 16 22.461 0.991 12.999 117 HH21 ARG 16 1HH2 ARG 16 20.057 1.322 15.598 118 HH22 ARG 16 2HH2 ARG 16 21.688 0.946 15.268 119 H LYS 17 H LYS 17 18.247 2.404 7.534 120 HA LYS 17 HA LYS 17 16.756 4.293 5.865 121 HB2 LYS 17 2HB LYS 17 19.184 2.690 5.070 122 HB3 LYS 17 1HB LYS 17 18.165 3.573 3.944 123 HG2 LYS 17 2HG LYS 17 18.753 5.669 5.042 124 HG3 LYS 17 1HG LYS 17 19.740 4.784 6.203 125 HD2 LYS 17 2HD LYS 17 21.170 4.005 4.402 126 HD3 LYS 17 1HD LYS 17 20.183 4.870 3.224 127 HE2 LYS 17 2HE LYS 17 20.728 6.974 4.286 128 HE3 LYS 17 1HE LYS 17 21.669 6.125 5.516 129 HZ1 LYS 17 1HZ LYS 17 23.055 7.072 3.808 130 HZ2 LYS 17 2HZ LYS 17 22.279 6.147 2.610 131 HZ3 LYS 17 3HZ LYS 17 23.173 5.390 3.821 132 H LYS 18 H LYS 18 15.544 3.240 4.171 133 HA LYS 18 HA LYS 18 14.092 1.652 3.400 134 HB2 LYS 18 2HB LYS 18 16.228 0.432 2.898 135 HB3 LYS 18 1HB LYS 18 16.165 -0.268 4.502 136 HG2 LYS 18 2HG LYS 18 14.133 -1.476 3.892 137 HG3 LYS 18 1HG LYS 18 14.173 -0.738 2.296 138 HD2 LYS 18 2HD LYS 18 15.047 -2.968 2.096 139 HD3 LYS 18 1HD LYS 18 16.374 -1.835 1.912 140 HE2 LYS 18 2HE LYS 18 15.731 -3.332 4.470 141 HE3 LYS 18 1HE LYS 18 16.904 -3.881 3.283 142 HZ1 LYS 18 1HZ LYS 18 18.034 -2.803 5.065 143 HZ2 LYS 18 2HZ LYS 18 17.053 -1.489 5.044 144 HZ3 LYS 18 3HZ LYS 18 18.145 -1.735 3.772 145 H ALA 19 H ALA 19 14.025 2.737 6.058 146 HA ALA 19 HA ALA 19 13.380 0.936 8.102 147 HB1 ALA 19 1HB ALA 19 13.973 3.274 8.454 148 HB2 ALA 19 2HB ALA 19 12.436 2.810 9.230 149 HB3 ALA 19 3HB ALA 19 12.425 3.709 7.706 150 H ILE 20 H ILE 20 11.424 2.394 5.591 151 HA ILE 20 HA ILE 20 8.875 1.888 6.637 152 HB ILE 20 HB ILE 20 9.746 1.897 3.727 153 HG12 ILE 20 2HG1 ILE 20 8.567 4.096 5.440 154 HG13 ILE 20 1HG1 ILE 20 10.244 3.994 4.915 155 HG21 ILE 20 1HG2 ILE 20 6.969 2.176 4.891 156 HG22 ILE 20 2HG2 ILE 20 7.577 0.800 3.968 157 HG23 ILE 20 3HG2 ILE 20 7.391 2.367 3.189 158 HD11 ILE 20 1HD1 ILE 20 9.014 5.585 3.579 159 HD12 ILE 20 2HD1 ILE 20 7.829 4.351 3.154 160 HD13 ILE 20 3HD1 ILE 20 9.494 4.210 2.580 161 H SER 21 H SER 21 11.173 -0.156 5.096 162 HA SER 21 HA SER 21 9.362 -2.270 4.458 163 HB2 SER 21 2HB SER 21 12.369 -2.315 4.722 164 HB3 SER 21 1HB SER 21 11.387 -3.569 3.957 165 HG SER 21 HG SER 21 10.553 -1.706 2.674 166 H GLU 22 H GLU 22 11.521 -1.570 7.144 167 HA GLU 22 HA GLU 22 10.959 -4.006 8.520 168 HB2 GLU 22 2HB GLU 22 12.120 -1.412 9.552 169 HB3 GLU 22 1HB GLU 22 12.117 -2.944 10.413 170 HG2 GLU 22 2HG GLU 22 13.504 -3.917 8.621 171 HG3 GLU 22 1HG GLU 22 13.557 -2.335 7.845 172 H THR 23 H THR 23 9.698 -0.769 8.455 173 HA THR 23 HA THR 23 8.102 -0.787 10.749 174 HB THR 23 HB THR 23 7.625 0.631 8.114 175 HG1 THR 23 1HG THR 23 9.641 1.093 9.291 176 HG21 THR 23 1HG2 THR 23 5.586 0.598 9.473 177 HG22 THR 23 2HG2 THR 23 6.280 2.222 9.439 178 HG23 THR 23 3HG2 THR 23 6.491 1.203 10.859 179 H LEU 24 H LEU 24 7.174 -1.565 7.364 180 HA LEU 24 HA LEU 24 4.613 -2.411 8.211 181 HB2 LEU 24 2HB LEU 24 5.980 -2.603 5.555 182 HB3 LEU 24 1HB LEU 24 4.464 -3.431 5.837 183 HG LEU 24 HG LEU 24 3.405 -1.256 6.373 184 HD11 LEU 24 1HD1 LEU 24 4.502 0.828 5.777 185 HD12 LEU 24 2HD1 LEU 24 6.006 -0.048 5.481 186 HD13 LEU 24 3HD1 LEU 24 5.322 0.006 7.105 187 HD21 LEU 24 1HD2 LEU 24 3.322 -0.435 4.077 188 HD22 LEU 24 2HD2 LEU 24 3.216 -2.193 4.162 189 HD23 LEU 24 3HD2 LEU 24 4.730 -1.423 3.685 190 H GLU 25 H GLU 25 7.596 -4.079 7.779 191 HA GLU 25 HA GLU 25 6.667 -6.720 7.866 192 HB2 GLU 25 2HB GLU 25 9.026 -6.067 7.495 193 HB3 GLU 25 1HB GLU 25 9.122 -5.513 9.157 194 HG2 GLU 25 2HG GLU 25 8.663 -7.822 9.896 195 HG3 GLU 25 1HG GLU 25 8.725 -8.331 8.209 196 H THR 26 H THR 26 7.443 -4.399 10.387 197 HA THR 26 HA THR 26 6.842 -6.016 12.612 198 HB THR 26 HB THR 26 6.864 -2.993 12.379 199 HG1 THR 26 1HG THR 26 8.860 -4.033 11.755 200 HG21 THR 26 1HG2 THR 26 7.291 -3.023 14.779 201 HG22 THR 26 2HG2 THR 26 7.257 -4.788 14.764 202 HG23 THR 26 3HG2 THR 26 5.789 -3.879 14.405 203 H VAL 27 H VAL 27 4.983 -3.479 10.912 204 HA VAL 27 HA VAL 27 2.669 -3.564 12.492 205 HB VAL 27 HB VAL 27 2.876 -2.874 9.535 206 HG11 VAL 27 1HG1 VAL 27 0.575 -3.366 10.173 207 HG12 VAL 27 2HG1 VAL 27 0.784 -1.641 9.857 208 HG13 VAL 27 3HG1 VAL 27 0.699 -2.231 11.519 209 HG21 VAL 27 1HG2 VAL 27 2.888 -1.068 11.959 210 HG22 VAL 27 2HG2 VAL 27 2.938 -0.547 10.274 211 HG23 VAL 27 3HG2 VAL 27 4.284 -1.459 10.955 212 H TYR 28 H TYR 28 3.561 -5.431 9.639 213 HA TYR 28 HA TYR 28 1.126 -6.732 9.248 214 HB2 TYR 28 2HB TYR 28 2.928 -6.806 7.575 215 HB3 TYR 28 1HB TYR 28 3.924 -7.751 8.673 216 HD1 TYR 28 1HD TYR 28 3.469 -10.113 9.043 217 HD2 TYR 28 2HD TYR 28 1.045 -7.826 6.400 218 HE1 TYR 28 1HE TYR 28 2.512 -12.183 8.143 219 HE2 TYR 28 2HE TYR 28 0.087 -9.908 5.481 220 HH TYR 28 HH TYR 28 0.625 -12.956 7.009 221 H ARG 29 H ARG 29 3.970 -7.717 11.125 222 HA ARG 29 HA ARG 29 2.825 -10.139 11.994 223 HB2 ARG 29 2HB ARG 29 5.100 -8.575 13.201 224 HB3 ARG 29 1HB ARG 29 4.657 -10.214 13.652 225 HG2 ARG 29 2HG ARG 29 5.083 -10.933 11.334 226 HG3 ARG 29 1HG ARG 29 5.610 -9.296 10.953 227 HD2 ARG 29 2HD ARG 29 7.528 -10.707 11.392 228 HD3 ARG 29 1HD ARG 29 7.369 -9.488 12.659 229 HE ARG 29 HE ARG 29 6.044 -11.602 13.680 230 HH11 ARG 29 1HH1 ARG 29 9.300 -11.248 12.329 231 HH12 ARG 29 2HH1 ARG 29 9.976 -12.498 13.270 232 HH21 ARG 29 1HH2 ARG 29 7.005 -13.319 15.000 233 HH22 ARG 29 2HH2 ARG 29 8.651 -13.676 14.802 234 H ALA 30 H ALA 30 2.762 -6.914 13.295 235 HA ALA 30 HA ALA 30 1.876 -7.423 15.874 236 HB1 ALA 30 1HB ALA 30 2.536 -5.192 15.080 237 HB2 ALA 30 2HB ALA 30 0.958 -5.160 15.866 238 HB3 ALA 30 3HB ALA 30 1.069 -5.112 14.107 239 H LEU 31 H LEU 31 -0.080 -7.035 12.922 240 HA LEU 31 HA LEU 31 -2.424 -7.601 14.428 241 HB2 LEU 31 2HB LEU 31 -2.122 -7.407 11.452 242 HB3 LEU 31 1HB LEU 31 -3.644 -7.789 12.224 243 HG LEU 31 HG LEU 31 -3.199 -5.570 13.505 244 HD11 LEU 31 1HD1 LEU 31 -1.628 -5.110 11.024 245 HD12 LEU 31 2HD1 LEU 31 -0.992 -5.125 12.685 246 HD13 LEU 31 3HD1 LEU 31 -2.140 -3.872 12.163 247 HD21 LEU 31 1HD2 LEU 31 -4.374 -4.334 11.785 248 HD22 LEU 31 2HD2 LEU 31 -5.080 -5.897 12.155 249 HD23 LEU 31 3HD2 LEU 31 -4.157 -5.684 10.673 250 H GLU 32 H GLU 32 -0.239 -9.565 12.646 251 HA GLU 32 HA GLU 32 -1.766 -11.926 12.495 252 HB2 GLU 32 2HB GLU 32 1.201 -11.557 12.947 253 HB3 GLU 32 1HB GLU 32 0.446 -13.090 12.561 254 HG2 GLU 32 2HG GLU 32 0.324 -10.668 10.784 255 HG3 GLU 32 1HG GLU 32 1.543 -11.929 10.641 256 H GLU 33 H GLU 33 0.227 -10.567 15.043 257 HA GLU 33 HA GLU 33 -0.068 -12.689 16.904 258 HB2 GLU 33 2HB GLU 33 0.587 -9.792 17.424 259 HB3 GLU 33 1HB GLU 33 0.840 -11.121 18.540 260 HG2 GLU 33 2HG GLU 33 2.234 -10.692 15.905 261 HG3 GLU 33 1HG GLU 33 2.921 -10.468 17.512 262 H LYS 34 H LYS 34 -1.798 -9.727 16.295 263 HA LYS 34 HA LYS 34 -3.461 -9.984 18.651 264 HB2 LYS 34 2HB LYS 34 -3.395 -7.981 16.426 265 HB3 LYS 34 1HB LYS 34 -4.592 -7.924 17.711 266 HG2 LYS 34 2HG LYS 34 -1.619 -7.884 18.176 267 HG3 LYS 34 1HG LYS 34 -2.611 -6.435 18.028 268 HD2 LYS 34 2HD LYS 34 -3.109 -8.604 20.079 269 HD3 LYS 34 1HD LYS 34 -2.147 -7.167 20.394 270 HE2 LYS 34 2HE LYS 34 -4.007 -5.756 19.902 271 HE3 LYS 34 1HE LYS 34 -5.034 -7.145 19.504 272 HZ1 LYS 34 1HZ LYS 34 -4.730 -7.882 21.831 273 HZ2 LYS 34 2HZ LYS 34 -5.498 -6.393 21.741 274 HZ3 LYS 34 3HZ LYS 34 -3.873 -6.474 22.163 275 H GLY 35 H GLY 35 -3.640 -11.283 15.582 276 HA2 GLY 35 2HA GLY 35 -5.277 -12.700 14.765 277 HA3 GLY 35 1HA GLY 35 -6.272 -12.302 16.158 278 H TYR 36 H TYR 36 -4.896 -10.025 13.892 279 HA TYR 36 HA TYR 36 -7.619 -9.446 12.929 280 HB2 TYR 36 2HB TYR 36 -5.321 -7.540 13.348 281 HB3 TYR 36 1HB TYR 36 -6.751 -7.132 12.409 282 HD1 TYR 36 1HD TYR 36 -5.254 -7.344 15.645 283 HD2 TYR 36 2HD TYR 36 -8.960 -7.019 13.618 284 HE1 TYR 36 1HE TYR 36 -6.309 -6.513 17.716 285 HE2 TYR 36 2HE TYR 36 -10.031 -6.193 15.673 286 HH TYR 36 HH TYR 36 -9.713 -6.202 18.021 287 H ASN 37 H ASN 37 -7.317 -8.077 10.780 288 HA ASN 37 HA ASN 37 -5.676 -9.756 9.049 289 HB2 ASN 37 2HB ASN 37 -8.034 -7.956 8.449 290 HB3 ASN 37 1HB ASN 37 -7.129 -8.813 7.213 291 HD21 ASN 37 1HD2 ASN 37 -9.934 -8.993 7.938 292 HD22 ASN 37 2HD2 ASN 37 -10.216 -10.635 8.334 293 HA PRO 38 HA PRO 38 -2.896 -6.181 9.357 294 HB2 PRO 38 2HB PRO 38 -1.383 -7.799 7.411 295 HB3 PRO 38 1HB PRO 38 -0.867 -7.093 8.944 296 HG2 PRO 38 2HG PRO 38 -1.302 -9.724 8.654 297 HG3 PRO 38 1HG PRO 38 -1.624 -8.885 10.176 298 HD2 PRO 38 2HD PRO 38 -3.522 -9.893 8.128 299 HD3 PRO 38 1HD PRO 38 -3.716 -9.712 9.884 300 H ILE 39 H ILE 39 -3.738 -7.802 6.328 301 HA ILE 39 HA ILE 39 -2.813 -5.651 4.720 302 HB ILE 39 HB ILE 39 -4.766 -7.846 3.986 303 HG12 ILE 39 2HG1 ILE 39 -2.669 -8.789 4.785 304 HG13 ILE 39 1HG1 ILE 39 -2.793 -9.003 3.046 305 HG21 ILE 39 1HG2 ILE 39 -4.089 -7.407 1.666 306 HG22 ILE 39 2HG2 ILE 39 -3.090 -6.064 2.213 307 HG23 ILE 39 3HG2 ILE 39 -4.841 -5.991 2.403 308 HD11 ILE 39 1HD1 ILE 39 -1.252 -7.154 2.697 309 HD12 ILE 39 2HD1 ILE 39 -0.534 -8.357 3.782 310 HD13 ILE 39 3HD1 ILE 39 -1.181 -6.866 4.433 311 H ASN 40 H ASN 40 -6.054 -6.600 5.949 312 HA ASN 40 HA ASN 40 -7.508 -4.778 4.539 313 HB2 ASN 40 2HB ASN 40 -8.448 -6.746 5.483 314 HB3 ASN 40 1HB ASN 40 -7.845 -6.333 7.080 315 HD21 ASN 40 1HD2 ASN 40 -8.946 -4.877 8.314 316 HD22 ASN 40 2HD2 ASN 40 -10.505 -4.356 7.847 317 H GLN 41 H GLN 41 -5.885 -4.639 7.734 318 HA GLN 41 HA GLN 41 -7.024 -2.103 8.284 319 HB2 GLN 41 2HB GLN 41 -4.779 -3.564 9.649 320 HB3 GLN 41 1HB GLN 41 -5.549 -2.101 10.250 321 HG2 GLN 41 2HG GLN 41 -6.932 -4.749 9.810 322 HG3 GLN 41 1HG GLN 41 -6.407 -4.115 11.361 323 HE21 GLN 41 1HE2 GLN 41 -7.234 -1.409 10.753 324 HE22 GLN 41 2HE2 GLN 41 -8.966 -1.410 10.805 325 H ILE 42 H ILE 42 -3.925 -3.190 6.934 326 HA ILE 42 HA ILE 42 -2.736 -0.625 7.052 327 HB ILE 42 HB ILE 42 -2.023 -2.980 5.268 328 HG12 ILE 42 2HG1 ILE 42 -0.712 -1.906 7.785 329 HG13 ILE 42 1HG1 ILE 42 -1.696 -3.358 7.686 330 HG21 ILE 42 1HG2 ILE 42 -0.482 -0.402 5.702 331 HG22 ILE 42 2HG2 ILE 42 -1.265 -0.905 4.213 332 HG23 ILE 42 3HG2 ILE 42 0.116 -1.813 4.829 333 HD11 ILE 42 1HD1 ILE 42 -0.027 -4.377 6.210 334 HD12 ILE 42 2HD1 ILE 42 0.668 -3.904 7.759 335 HD13 ILE 42 3HD1 ILE 42 0.960 -2.919 6.326 336 H VAL 43 H VAL 43 -4.389 -2.326 4.351 337 HA VAL 43 HA VAL 43 -4.110 -0.190 2.579 338 HB VAL 43 HB VAL 43 -4.825 -2.363 1.690 339 HG11 VAL 43 1HG1 VAL 43 -6.220 -3.132 3.545 340 HG12 VAL 43 2HG1 VAL 43 -7.148 -3.201 2.041 341 HG13 VAL 43 3HG1 VAL 43 -7.413 -1.892 3.188 342 HG21 VAL 43 1HG2 VAL 43 -6.970 -0.284 1.268 343 HG22 VAL 43 2HG2 VAL 43 -6.681 -1.680 0.226 344 HG23 VAL 43 3HG2 VAL 43 -5.454 -0.423 0.377 345 H GLY 44 H GLY 44 -6.614 -0.817 5.003 346 HA2 GLY 44 2HA GLY 44 -8.235 1.381 4.407 347 HA3 GLY 44 1HA GLY 44 -8.123 0.572 5.969 348 H TYR 45 H TYR 45 -5.370 1.069 6.465 349 HA TYR 45 HA TYR 45 -5.571 3.583 7.665 350 HB2 TYR 45 2HB TYR 45 -4.096 1.960 8.668 351 HB3 TYR 45 1HB TYR 45 -3.120 1.875 7.205 352 HD1 TYR 45 1HD TYR 45 -1.170 3.149 7.096 353 HD2 TYR 45 2HD TYR 45 -4.252 4.370 9.742 354 HE1 TYR 45 1HE TYR 45 0.249 4.972 7.894 355 HE2 TYR 45 2HE TYR 45 -2.826 6.196 10.557 356 HH TYR 45 HH TYR 45 -0.496 6.832 10.660 357 H LEU 46 H LEU 46 -3.710 2.653 4.781 358 HA LEU 46 HA LEU 46 -2.677 5.275 4.543 359 HB2 LEU 46 2HB LEU 46 -2.638 3.042 2.559 360 HB3 LEU 46 1HB LEU 46 -1.953 4.604 2.205 361 HG LEU 46 HG LEU 46 -0.424 4.249 4.245 362 HD11 LEU 46 1HD1 LEU 46 -0.005 2.040 5.001 363 HD12 LEU 46 2HD1 LEU 46 -1.300 1.429 3.974 364 HD13 LEU 46 3HD1 LEU 46 -1.685 2.504 5.312 365 HD21 LEU 46 1HD2 LEU 46 0.399 4.076 1.984 366 HD22 LEU 46 2HD2 LEU 46 -0.141 2.398 1.896 367 HD23 LEU 46 3HD2 LEU 46 1.144 2.855 3.015 368 H LEU 47 H LEU 47 -5.519 3.831 3.115 369 HA LEU 47 HA LEU 47 -5.791 6.337 1.687 370 HB2 LEU 47 2HB LEU 47 -7.566 5.180 0.325 371 HB3 LEU 47 1HB LEU 47 -5.921 4.634 0.114 372 HG LEU 47 HG LEU 47 -6.512 2.727 1.674 373 HD11 LEU 47 1HD1 LEU 47 -8.837 2.066 1.826 374 HD12 LEU 47 2HD1 LEU 47 -9.317 3.601 1.098 375 HD13 LEU 47 3HD1 LEU 47 -8.507 3.581 2.669 376 HD21 LEU 47 1HD2 LEU 47 -7.558 1.430 -0.132 377 HD22 LEU 47 2HD2 LEU 47 -6.175 2.394 -0.631 378 HD23 LEU 47 3HD2 LEU 47 -7.809 2.937 -1.033 379 H SER 48 H SER 48 -6.548 5.607 4.563 380 HA SER 48 HA SER 48 -8.981 7.231 4.406 381 HB2 SER 48 2HB SER 48 -9.601 4.945 5.078 382 HB3 SER 48 1HB SER 48 -8.458 5.015 6.410 383 HG SER 48 HG SER 48 -10.459 6.977 6.240 384 H GLY 49 H GLY 49 -5.854 6.696 5.937 385 HA2 GLY 49 2HA GLY 49 -4.528 8.142 7.050 386 HA3 GLY 49 1HA GLY 49 -5.679 9.402 6.677 387 H ASP 50 H ASP 50 -5.761 6.488 8.811 388 HA ASP 50 HA ASP 50 -5.980 8.272 11.087 389 HB2 ASP 50 2HB ASP 50 -8.326 7.981 10.540 390 HB3 ASP 50 1HB ASP 50 -8.117 6.234 10.458 391 HA PRO 51 HA PRO 51 -3.013 5.297 12.591 392 HB2 PRO 51 2HB PRO 51 -3.744 6.467 15.201 393 HB3 PRO 51 1HB PRO 51 -2.162 6.286 14.445 394 HG2 PRO 51 2HG PRO 51 -3.429 8.659 14.587 395 HG3 PRO 51 1HG PRO 51 -2.349 8.224 13.255 396 HD2 PRO 51 2HD PRO 51 -5.307 8.449 13.293 397 HD3 PRO 51 1HD PRO 51 -4.163 8.635 11.957 398 H ALA 52 H ALA 52 -6.304 5.533 13.860 399 HA ALA 52 HA ALA 52 -6.049 3.393 15.685 400 HB1 ALA 52 1HB ALA 52 -8.607 4.497 14.532 401 HB2 ALA 52 2HB ALA 52 -7.770 5.126 15.952 402 HB3 ALA 52 3HB ALA 52 -8.448 3.495 15.974 403 H TYR 53 H TYR 53 -6.198 3.329 12.348 404 HA TYR 53 HA TYR 53 -7.558 0.892 11.995 405 HB2 TYR 53 2HB TYR 53 -5.489 2.275 10.325 406 HB3 TYR 53 1HB TYR 53 -6.102 0.683 9.881 407 HD1 TYR 53 1HD TYR 53 -8.534 0.394 9.577 408 HD2 TYR 53 2HD TYR 53 -6.743 4.210 9.871 409 HE1 TYR 53 1HE TYR 53 -10.497 1.349 8.608 410 HE2 TYR 53 2HE TYR 53 -8.735 5.229 8.874 411 HH TYR 53 HH TYR 53 -10.598 4.668 7.532 412 H ILE 54 H ILE 54 -4.367 1.622 13.170 413 HA ILE 54 HA ILE 54 -3.681 -1.217 13.064 414 HB ILE 54 HB ILE 54 -1.858 1.150 13.658 415 HG12 ILE 54 2HG1 ILE 54 -2.555 1.208 11.319 416 HG13 ILE 54 1HG1 ILE 54 -0.878 0.696 11.433 417 HG21 ILE 54 1HG2 ILE 54 -0.013 -0.452 13.421 418 HG22 ILE 54 2HG2 ILE 54 -1.178 -1.755 13.203 419 HG23 ILE 54 3HG2 ILE 54 -1.097 -0.899 14.742 420 HD11 ILE 54 1HD1 ILE 54 -3.246 -1.111 10.963 421 HD12 ILE 54 2HD1 ILE 54 -1.563 -1.624 11.072 422 HD13 ILE 54 3HD1 ILE 54 -2.083 -0.577 9.752 423 HA PRO 55 HA PRO 55 -5.000 -1.240 17.354 424 HB2 PRO 55 2HB PRO 55 -4.059 -3.761 17.921 425 HB3 PRO 55 1HB PRO 55 -5.601 -3.437 17.120 426 HG2 PRO 55 2HG PRO 55 -2.964 -4.182 15.923 427 HG3 PRO 55 1HG PRO 55 -4.587 -4.764 15.505 428 HD2 PRO 55 2HD PRO 55 -3.326 -2.936 14.032 429 HD3 PRO 55 1HD PRO 55 -5.085 -2.864 14.278 430 H ARG 56 H ARG 56 -4.078 -0.665 19.200 431 HA ARG 56 HA ARG 56 -1.247 -0.257 19.248 432 HB2 ARG 56 2HB ARG 56 -1.650 0.848 21.462 433 HB3 ARG 56 1HB ARG 56 -2.575 1.528 20.131 434 HG2 ARG 56 2HG ARG 56 -4.540 0.188 20.889 435 HG3 ARG 56 1HG ARG 56 -3.593 -0.327 22.278 436 HD2 ARG 56 2HD ARG 56 -3.374 1.954 23.026 437 HD3 ARG 56 1HD ARG 56 -4.215 2.534 21.586 438 HE ARG 56 HE ARG 56 -5.470 0.831 23.638 439 HH11 ARG 56 1HH1 ARG 56 -5.606 3.581 21.403 440 HH12 ARG 56 2HH1 ARG 56 -7.214 3.984 21.741 441 HH21 ARG 56 1HH2 ARG 56 -7.708 1.384 24.114 442 HH22 ARG 56 2HH2 ARG 56 -8.454 2.691 23.307 443 H TYR 57 H TYR 57 -0.818 -2.431 19.032 444 HA TYR 57 HA TYR 57 -0.619 -3.928 21.549 445 HB2 TYR 57 2HB TYR 57 -1.555 -5.249 19.858 446 HB3 TYR 57 1HB TYR 57 -0.429 -4.656 18.655 447 HD1 TYR 57 1HD TYR 57 -0.534 -6.743 21.774 448 HD2 TYR 57 2HD TYR 57 1.423 -5.886 18.101 449 HE1 TYR 57 1HE TYR 57 0.895 -8.712 22.077 450 HE2 TYR 57 2HE TYR 57 2.852 -7.832 18.386 451 HH TYR 57 HH TYR 57 2.236 -10.259 20.566 452 H GLN 58 H GLN 58 1.297 -2.583 18.925 453 HA GLN 58 HA GLN 58 3.731 -3.063 20.474 454 HB2 GLN 58 2HB GLN 58 3.313 -4.851 18.700 455 HB3 GLN 58 1HB GLN 58 3.376 -3.551 17.521 456 HG2 GLN 58 2HG GLN 58 5.693 -3.148 18.035 457 HG3 GLN 58 1HG GLN 58 5.642 -4.382 19.302 458 HE21 GLN 58 1HE2 GLN 58 7.221 -5.633 18.278 459 HE22 GLN 58 2HE2 GLN 58 6.885 -6.537 16.849 460 H ASP 59 H ASP 59 5.493 -1.714 19.541 461 HA ASP 59 HA ASP 59 4.797 0.963 19.252 462 HB2 ASP 59 2HB ASP 59 7.200 1.368 18.698 463 HB3 ASP 59 1HB ASP 59 6.986 0.371 20.125 464 H ALA 60 H ALA 60 4.653 -1.454 17.007 465 HA ALA 60 HA ALA 60 5.194 -0.440 14.512 466 HB1 ALA 60 1HB ALA 60 4.371 -2.717 15.030 467 HB2 ALA 60 2HB ALA 60 3.559 -1.967 13.662 468 HB3 ALA 60 3HB ALA 60 2.752 -2.048 15.229 469 H ARG 61 H ARG 61 2.189 0.113 16.427 470 HA ARG 61 HA ARG 61 0.946 1.640 14.476 471 HB2 ARG 61 2HB ARG 61 -0.471 2.548 16.428 472 HB3 ARG 61 1HB ARG 61 -0.503 0.819 16.148 473 HG2 ARG 61 2HG ARG 61 -0.428 1.239 18.489 474 HG3 ARG 61 1HG ARG 61 1.138 0.555 18.032 475 HD2 ARG 61 2HD ARG 61 1.881 3.004 17.900 476 HD3 ARG 61 1HD ARG 61 0.366 3.343 18.733 477 HE ARG 61 HE ARG 61 1.796 1.355 20.129 478 HH11 ARG 61 1HH1 ARG 61 1.639 4.835 19.577 479 HH12 ARG 61 2HH1 ARG 61 2.686 5.228 20.863 480 HH21 ARG 61 1HH2 ARG 61 3.190 1.892 21.950 481 HH22 ARG 61 2HH2 ARG 61 3.551 3.527 22.254 482 H ASN 62 H ASN 62 3.322 2.585 16.795 483 HA ASN 62 HA ASN 62 3.131 5.396 16.233 484 HB2 ASN 62 2HB ASN 62 3.977 4.882 18.394 485 HB3 ASN 62 1HB ASN 62 5.086 3.680 17.764 486 HD21 ASN 62 1HD2 ASN 62 7.075 4.300 17.075 487 HD22 ASN 62 2HD2 ASN 62 7.737 5.872 17.273 488 H LEU 63 H LEU 63 5.189 2.736 15.232 489 HA LEU 63 HA LEU 63 7.099 4.128 13.736 490 HB2 LEU 63 2HB LEU 63 5.969 1.381 13.184 491 HB3 LEU 63 1HB LEU 63 7.463 2.021 12.537 492 HG LEU 63 HG LEU 63 6.922 1.433 15.445 493 HD11 LEU 63 1HD1 LEU 63 8.594 -0.039 13.409 494 HD12 LEU 63 2HD1 LEU 63 7.104 -0.619 14.160 495 HD13 LEU 63 3HD1 LEU 63 8.543 -0.381 15.135 496 HD21 LEU 63 1HD2 LEU 63 9.441 2.332 14.047 497 HD22 LEU 63 2HD2 LEU 63 9.325 1.831 15.731 498 HD23 LEU 63 3HD2 LEU 63 8.483 3.282 15.186 499 H ILE 64 H ILE 64 4.024 2.721 12.706 500 HA ILE 64 HA ILE 64 4.276 3.408 9.959 501 HB ILE 64 HB ILE 64 2.798 1.587 10.937 502 HG12 ILE 64 2HG1 ILE 64 1.360 3.574 9.160 503 HG13 ILE 64 1HG1 ILE 64 2.564 2.426 8.591 504 HG21 ILE 64 1HG2 ILE 64 1.024 3.949 11.673 505 HG22 ILE 64 2HG2 ILE 64 1.809 2.884 12.784 506 HG23 ILE 64 3HG2 ILE 64 0.517 2.259 11.746 507 HD11 ILE 64 1HD1 ILE 64 1.106 0.577 9.300 508 HD12 ILE 64 2HD1 ILE 64 0.333 1.632 8.121 509 HD13 ILE 64 3HD1 ILE 64 -0.101 1.753 9.826 510 H ARG 65 H ARG 65 3.161 5.023 12.749 511 HA ARG 65 HA ARG 65 1.515 6.977 11.467 512 HB2 ARG 65 2HB ARG 65 1.128 5.996 13.716 513 HB3 ARG 65 1HB ARG 65 2.601 6.738 14.276 514 HG2 ARG 65 2HG ARG 65 0.229 8.267 13.288 515 HG3 ARG 65 1HG ARG 65 0.454 7.768 14.962 516 HD2 ARG 65 2HD ARG 65 2.552 8.998 15.028 517 HD3 ARG 65 1HD ARG 65 2.304 9.522 13.365 518 HE ARG 65 HE ARG 65 0.053 10.257 14.814 519 HH11 ARG 65 1HH1 ARG 65 3.502 11.200 14.704 520 HH12 ARG 65 2HH1 ARG 65 3.212 12.770 15.251 521 HH21 ARG 65 1HH2 ARG 65 -0.295 12.453 15.560 522 HH22 ARG 65 2HH2 ARG 65 1.032 13.505 15.761 523 H ARG 66 H ARG 66 4.832 6.624 12.315 524 HA ARG 66 HA ARG 66 5.359 9.452 12.125 525 HB2 ARG 66 2HB ARG 66 7.232 7.140 12.589 526 HB3 ARG 66 1HB ARG 66 7.739 8.823 12.517 527 HG2 ARG 66 2HG ARG 66 6.169 9.284 14.411 528 HG3 ARG 66 1HG ARG 66 5.903 7.547 14.518 529 HD2 ARG 66 2HD ARG 66 8.231 7.173 14.963 530 HD3 ARG 66 1HD ARG 66 8.584 8.884 14.731 531 HE ARG 66 HE ARG 66 6.994 7.764 16.944 532 HH11 ARG 66 1HH1 ARG 66 8.930 10.397 15.577 533 HH12 ARG 66 2HH1 ARG 66 9.202 11.165 17.081 534 HH21 ARG 66 1HH2 ARG 66 7.389 8.816 19.012 535 HH22 ARG 66 2HH2 ARG 66 8.295 10.264 19.067 536 H HIS 67 H HIS 67 4.651 7.355 9.880 537 HA HIS 67 HA HIS 67 6.434 8.647 7.984 538 HB2 HIS 67 2HB HIS 67 5.550 5.765 7.971 539 HB3 HIS 67 1HB HIS 67 6.170 6.563 6.532 540 HD1 HIS 67 1HD HIS 67 8.674 6.924 6.386 541 HD2 HIS 67 2HD HIS 67 7.462 5.233 9.983 542 HE1 HIS 67 1HE HIS 67 10.779 6.121 7.505 543 HE2 HIS 67 2HE HIS 67 10.016 5.566 9.802 544 H GLU 68 H GLU 68 5.500 9.483 6.231 545 HA GLU 68 HA GLU 68 2.733 9.980 6.281 546 HB2 GLU 68 2HB GLU 68 4.766 10.363 4.093 547 HB3 GLU 68 1HB GLU 68 3.110 10.917 3.972 548 HG2 GLU 68 2HG GLU 68 5.163 11.816 5.976 549 HG3 GLU 68 1HG GLU 68 4.562 12.729 4.596 550 H ARG 69 H ARG 69 1.077 9.088 5.218 551 HA ARG 69 HA ARG 69 1.362 6.418 4.356 552 HB2 ARG 69 2HB ARG 69 -1.066 8.256 4.095 553 HB3 ARG 69 1HB ARG 69 -1.047 6.540 3.734 554 HG2 ARG 69 2HG ARG 69 -1.513 6.125 5.868 555 HG3 ARG 69 1HG ARG 69 0.058 6.786 6.277 556 HD2 ARG 69 2HD ARG 69 -2.531 8.319 6.100 557 HD3 ARG 69 1HD ARG 69 -1.689 7.857 7.572 558 HE ARG 69 HE ARG 69 -0.959 9.928 5.669 559 HH11 ARG 69 1HH1 ARG 69 -0.052 8.205 8.721 560 HH12 ARG 69 2HH1 ARG 69 0.882 9.486 9.277 561 HH21 ARG 69 1HH2 ARG 69 0.341 11.639 6.541 562 HH22 ARG 69 2HH2 ARG 69 1.117 11.484 8.038 563 H ASP 70 H ASP 70 1.492 9.417 2.768 564 HA ASP 70 HA ASP 70 1.264 8.531 0.075 565 HB2 ASP 70 2HB ASP 70 2.866 10.851 1.210 566 HB3 ASP 70 1HB ASP 70 2.509 10.608 -0.494 567 H GLU 71 H GLU 71 4.024 9.169 2.171 568 HA GLU 71 HA GLU 71 6.137 8.422 0.522 569 HB2 GLU 71 2HB GLU 71 6.413 9.618 2.640 570 HB3 GLU 71 1HB GLU 71 5.914 8.187 3.527 571 HG2 GLU 71 2HG GLU 71 7.882 7.000 2.579 572 HG3 GLU 71 1HG GLU 71 8.394 8.526 1.868 573 H ILE 72 H ILE 72 4.396 6.484 2.933 574 HA ILE 72 HA ILE 72 5.816 4.082 2.599 575 HB ILE 72 HB ILE 72 2.944 4.470 3.458 576 HG12 ILE 72 2HG1 ILE 72 5.456 4.173 5.123 577 HG13 ILE 72 1HG1 ILE 72 4.549 5.661 4.883 578 HG21 ILE 72 1HG2 ILE 72 3.319 2.163 2.776 579 HG22 ILE 72 2HG2 ILE 72 3.136 2.254 4.527 580 HG23 ILE 72 3HG2 ILE 72 4.740 2.067 3.816 581 HD11 ILE 72 1HD1 ILE 72 3.537 3.180 6.260 582 HD12 ILE 72 2HD1 ILE 72 2.628 4.673 6.031 583 HD13 ILE 72 3HD1 ILE 72 4.064 4.663 7.051 584 H MET 73 H MET 73 2.902 5.301 1.015 585 HA MET 73 HA MET 73 2.311 2.943 -0.377 586 HB2 MET 73 2HB MET 73 0.760 4.888 0.095 587 HB3 MET 73 1HB MET 73 1.592 5.773 -1.159 588 HG2 MET 73 2HG MET 73 0.065 3.208 -1.566 589 HG3 MET 73 1HG MET 73 -0.570 4.814 -1.876 590 HE1 MET 73 1HE MET 73 -0.188 3.366 -5.432 591 HE2 MET 73 2HE MET 73 -1.209 4.219 -4.262 592 HE3 MET 73 3HE MET 73 -0.723 2.554 -3.946 593 H GLU 74 H GLU 74 4.256 5.799 -1.230 594 HA GLU 74 HA GLU 74 4.872 5.145 -3.885 595 HB2 GLU 74 2HB GLU 74 6.687 6.382 -1.831 596 HB3 GLU 74 1HB GLU 74 6.972 6.403 -3.562 597 HG2 GLU 74 2HG GLU 74 4.940 7.751 -3.830 598 HG3 GLU 74 1HG GLU 74 4.735 7.755 -2.077 599 H GLU 75 H GLU 75 6.383 4.189 -0.870 600 HA GLU 75 HA GLU 75 8.521 2.697 -1.918 601 HB2 GLU 75 2HB GLU 75 8.327 3.519 0.419 602 HB3 GLU 75 1HB GLU 75 7.063 2.338 0.702 603 HG2 GLU 75 2HG GLU 75 9.175 1.602 1.628 604 HG3 GLU 75 1HG GLU 75 8.646 0.539 0.324 605 H LEU 76 H LEU 76 5.226 1.816 -0.987 606 HA LEU 76 HA LEU 76 5.344 -0.965 -1.418 607 HB2 LEU 76 2HB LEU 76 3.008 0.897 -1.858 608 HB3 LEU 76 1HB LEU 76 2.902 -0.846 -1.771 609 HG LEU 76 HG LEU 76 3.680 0.995 0.493 610 HD11 LEU 76 1HD1 LEU 76 1.531 0.335 1.445 611 HD12 LEU 76 2HD1 LEU 76 1.188 -0.630 0.014 612 HD13 LEU 76 3HD1 LEU 76 1.306 1.122 -0.119 613 HD21 LEU 76 1HD2 LEU 76 3.262 -1.987 0.420 614 HD22 LEU 76 2HD2 LEU 76 3.528 -1.017 1.866 615 HD23 LEU 76 3HD2 LEU 76 4.803 -1.159 0.658 616 H THR 77 H THR 77 4.362 1.684 -3.600 617 HA THR 77 HA THR 77 3.861 0.049 -5.788 618 HB THR 77 HB THR 77 4.642 2.980 -5.762 619 HG1 THR 77 1HG THR 77 2.783 2.941 -4.584 620 HG21 THR 77 1HG2 THR 77 4.693 1.938 -8.008 621 HG22 THR 77 2HG2 THR 77 3.358 3.083 -7.851 622 HG23 THR 77 3HG2 THR 77 3.049 1.350 -7.759 623 H LYS 78 H LYS 78 6.838 1.753 -4.779 624 HA LYS 78 HA LYS 78 8.271 1.179 -7.124 625 HB2 LYS 78 2HB LYS 78 9.366 1.603 -4.356 626 HB3 LYS 78 1HB LYS 78 10.357 1.519 -5.801 627 HG2 LYS 78 2HG LYS 78 9.064 3.459 -6.662 628 HG3 LYS 78 1HG LYS 78 8.330 3.610 -5.069 629 HD2 LYS 78 2HD LYS 78 11.276 3.818 -5.741 630 HD3 LYS 78 1HD LYS 78 10.222 5.128 -5.212 631 HE2 LYS 78 2HE LYS 78 9.913 3.983 -3.061 632 HE3 LYS 78 1HE LYS 78 10.978 2.693 -3.651 633 HZ1 LYS 78 1HZ LYS 78 12.785 4.264 -3.774 634 HZ2 LYS 78 2HZ LYS 78 12.158 4.240 -2.216 635 HZ3 LYS 78 3HZ LYS 78 11.786 5.520 -3.250 636 H TYR 79 H TYR 79 8.008 -0.563 -4.135 637 HA TYR 79 HA TYR 79 9.931 -2.537 -4.783 638 HB2 TYR 79 2HB TYR 79 9.177 -2.032 -2.483 639 HB3 TYR 79 1HB TYR 79 7.608 -2.710 -2.883 640 HD1 TYR 79 1HD TYR 79 11.104 -3.436 -2.213 641 HD2 TYR 79 2HD TYR 79 7.298 -5.086 -3.039 642 HE1 TYR 79 1HE TYR 79 11.922 -5.641 -1.499 643 HE2 TYR 79 2HE TYR 79 8.085 -7.304 -2.328 644 HH TYR 79 HH TYR 79 11.007 -7.683 -0.667 645 H TYR 80 H TYR 80 6.496 -2.307 -5.280 646 HA TYR 80 HA TYR 80 5.897 -4.917 -6.004 647 HB2 TYR 80 2HB TYR 80 4.302 -3.043 -5.528 648 HB3 TYR 80 1HB TYR 80 4.687 -2.376 -7.101 649 HD1 TYR 80 1HD TYR 80 3.150 -5.216 -5.355 650 HD2 TYR 80 2HD TYR 80 3.603 -3.216 -9.072 651 HE1 TYR 80 1HE TYR 80 1.308 -6.548 -6.284 652 HE2 TYR 80 2HE TYR 80 1.774 -4.534 -10.016 653 HH TYR 80 HH TYR 80 -0.312 -6.390 -8.060 654 H LEU 81 H LEU 81 6.807 -2.131 -8.101 655 HA LEU 81 HA LEU 81 7.007 -3.776 -10.381 656 HB2 LEU 81 2HB LEU 81 7.817 -0.952 -9.834 657 HB3 LEU 81 1HB LEU 81 8.131 -1.725 -11.373 658 HG LEU 81 HG LEU 81 6.269 -0.352 -11.568 659 HD11 LEU 81 1HD1 LEU 81 5.322 -3.211 -11.444 660 HD12 LEU 81 2HD1 LEU 81 6.101 -2.418 -12.810 661 HD13 LEU 81 3HD1 LEU 81 4.496 -1.911 -12.297 662 HD21 LEU 81 1HD2 LEU 81 5.532 -0.096 -9.306 663 HD22 LEU 81 2HD2 LEU 81 5.018 -1.775 -9.238 664 HD23 LEU 81 3HD2 LEU 81 4.163 -0.631 -10.281 665 H ALA 82 H ALA 82 9.269 -2.868 -7.873 666 HA ALA 82 HA ALA 82 11.596 -3.203 -9.427 667 HB1 ALA 82 1HB ALA 82 11.562 -1.952 -7.323 668 HB2 ALA 82 2HB ALA 82 12.817 -3.193 -7.372 669 HB3 ALA 82 3HB ALA 82 11.339 -3.470 -6.443 670 H ASN 83 H ASN 83 9.954 -5.456 -7.175 671 HA ASN 83 HA ASN 83 11.808 -7.515 -7.853 672 HB2 ASN 83 2HB ASN 83 9.161 -7.708 -6.409 673 HB3 ASN 83 1HB ASN 83 10.324 -9.015 -6.566 674 HD21 ASN 83 1HD2 ASN 83 10.768 -9.243 -4.467 675 HD22 ASN 83 2HD2 ASN 83 11.491 -8.040 -3.472 676 H HIS 84 H HIS 84 9.280 -6.179 -9.398 677 HA HIS 84 HA HIS 84 8.441 -8.550 -10.822 678 HB2 HIS 84 2HB HIS 84 6.798 -6.759 -10.278 679 HB3 HIS 84 1HB HIS 84 7.735 -5.623 -11.232 680 HD1 HIS 84 1HD HIS 84 5.359 -8.556 -11.590 681 HD2 HIS 84 2HD HIS 84 7.211 -5.676 -13.950 682 HE1 HIS 84 1HE HIS 84 4.243 -8.686 -13.819 683 HE2 HIS 84 2HE HIS 84 5.609 -7.125 -15.286 684 H GLY 85 H GLY 85 11.139 -6.735 -10.843 685 HA2 GLY 85 2HA GLY 85 12.895 -7.389 -12.315 686 HA3 GLY 85 1HA GLY 85 11.708 -7.551 -13.595 687 H ILE 86 H ILE 86 11.033 -4.718 -11.975 688 HA ILE 86 HA ILE 86 12.424 -3.262 -14.081 689 HB ILE 86 HB ILE 86 10.034 -2.492 -12.401 690 HG12 ILE 86 2HG1 ILE 86 10.322 -3.095 -15.356 691 HG13 ILE 86 1HG1 ILE 86 9.545 -4.119 -14.157 692 HG21 ILE 86 1HG2 ILE 86 9.908 -0.451 -13.787 693 HG22 ILE 86 2HG2 ILE 86 11.451 -0.871 -14.530 694 HG23 ILE 86 3HG2 ILE 86 11.370 -0.502 -12.810 695 HD11 ILE 86 1HD1 ILE 86 8.649 -1.390 -15.010 696 HD12 ILE 86 2HD1 ILE 86 7.850 -2.409 -13.810 697 HD13 ILE 86 3HD1 ILE 86 7.915 -2.919 -15.504 698 H ASP 87 H ASP 87 14.009 -1.889 -13.608 699 HA ASP 87 HA ASP 87 14.569 -1.403 -10.792 700 HB2 ASP 87 2HB ASP 87 16.750 -0.525 -11.473 701 HB3 ASP 87 1HB ASP 87 16.498 -2.079 -12.246 702 H ILE 88 H ILE 88 13.888 0.308 -9.860 703 HA ILE 88 HA ILE 88 12.726 2.373 -11.500 704 HB ILE 88 HB ILE 88 12.525 1.823 -8.541 705 HG12 ILE 88 2HG1 ILE 88 10.629 1.487 -10.852 706 HG13 ILE 88 1HG1 ILE 88 11.425 0.213 -9.952 707 HG21 ILE 88 1HG2 ILE 88 10.828 3.529 -8.395 708 HG22 ILE 88 2HG2 ILE 88 11.035 3.922 -10.103 709 HG23 ILE 88 3HG2 ILE 88 12.342 4.256 -8.949 710 HD11 ILE 88 1HD1 ILE 88 9.433 2.144 -8.867 711 HD12 ILE 88 2HD1 ILE 88 10.174 0.791 -7.995 712 HD13 ILE 88 3HD1 ILE 88 9.096 0.487 -9.359 713 H LYS 89 H LYS 89 13.319 4.355 -11.553 714 HA LYS 89 HA LYS 89 16.125 4.815 -10.944 715 HB2 LYS 89 2HB LYS 89 14.206 6.490 -12.600 716 HB3 LYS 89 1HB LYS 89 15.912 6.813 -12.412 717 HG2 LYS 89 2HG LYS 89 15.546 5.819 -14.578 718 HG3 LYS 89 1HG LYS 89 16.398 4.651 -13.579 719 HD2 LYS 89 2HD LYS 89 14.301 3.449 -13.182 720 HD3 LYS 89 1HD LYS 89 13.420 4.660 -14.108 721 HE2 LYS 89 2HE LYS 89 13.812 2.643 -15.437 722 HE3 LYS 89 1HE LYS 89 14.659 4.028 -16.114 723 HZ1 LYS 89 1HZ LYS 89 15.956 1.886 -14.453 724 HZ2 LYS 89 2HZ LYS 89 16.721 3.206 -15.183 725 HZ3 LYS 89 3HZ LYS 89 16.002 2.049 -16.124 726 H1 MET 1 H MET 1 -19.536 0.646 19.537 727 HA MET 1 HA MET 1 -21.744 -0.483 19.240 728 HB2 MET 1 2HB MET 1 -21.578 2.532 19.095 729 HB3 MET 1 1HB MET 1 -23.090 1.672 19.343 730 HG2 MET 1 2HG MET 1 -22.205 2.458 21.454 731 HG3 MET 1 1HG MET 1 -22.203 0.702 21.414 732 HE1 MET 1 1HE MET 1 -20.542 0.382 23.387 733 HE2 MET 1 2HE MET 1 -20.665 2.120 23.620 734 HE3 MET 1 3HE MET 1 -19.080 1.350 23.609 735 H GLY 2 H GLY 2 -20.186 0.055 16.711 736 HA2 GLY 2 2HA GLY 2 -22.542 -0.126 14.954 737 HA3 GLY 2 1HA GLY 2 -21.096 0.769 14.467 738 H PHE 3 H PHE 3 -21.754 -2.316 16.000 739 HA PHE 3 HA PHE 3 -19.460 -3.536 14.807 740 HB2 PHE 3 2HB PHE 3 -21.709 -4.818 16.371 741 HB3 PHE 3 1HB PHE 3 -20.158 -5.557 15.995 742 HD1 PHE 3 1HD PHE 3 -21.984 -3.384 18.219 743 HD2 PHE 3 2HD PHE 3 -18.092 -4.643 17.063 744 HE1 PHE 3 1HE PHE 3 -21.073 -2.487 20.324 745 HE2 PHE 3 2HE PHE 3 -17.178 -3.750 19.165 746 HZ PHE 3 HZ PHE 3 -18.670 -2.672 20.796 747 H THR 4 H THR 4 -19.728 -3.528 12.645 748 HA THR 4 HA THR 4 -21.788 -5.310 11.598 749 HB THR 4 HB THR 4 -22.004 -3.744 9.650 750 HG1 THR 4 1HG THR 4 -20.023 -2.604 10.301 751 HG21 THR 4 1HG2 THR 4 -23.537 -2.162 10.772 752 HG22 THR 4 2HG2 THR 4 -22.856 -2.615 12.334 753 HG23 THR 4 3HG2 THR 4 -23.753 -3.801 11.385 754 H ASP 5 H ASP 5 -20.706 -6.882 10.593 755 HA ASP 5 HA ASP 5 -18.069 -6.561 9.522 756 HB2 ASP 5 2HB ASP 5 -18.818 -8.788 10.182 757 HB3 ASP 5 1HB ASP 5 -20.183 -8.683 9.079 758 H GLU 6 H GLU 6 -17.600 -5.647 7.577 759 HA GLU 6 HA GLU 6 -19.869 -5.507 5.790 760 HB2 GLU 6 2HB GLU 6 -19.222 -3.268 6.664 761 HB3 GLU 6 1HB GLU 6 -17.652 -3.461 5.896 762 HG2 GLU 6 2HG GLU 6 -18.744 -3.643 3.711 763 HG3 GLU 6 1HG GLU 6 -20.310 -3.413 4.476 764 H THR 7 H THR 7 -19.196 -7.556 5.086 765 HA THR 7 HA THR 7 -17.078 -7.316 3.156 766 HB THR 7 HB THR 7 -17.565 -9.830 2.801 767 HG1 THR 7 1HG THR 7 -18.706 -9.628 5.388 768 HG21 THR 7 1HG2 THR 7 -16.212 -10.493 4.749 769 HG22 THR 7 2HG2 THR 7 -16.517 -8.923 5.489 770 HG23 THR 7 3HG2 THR 7 -15.584 -9.027 3.995 771 H VAL 8 H VAL 8 -17.844 -6.168 1.647 772 HA VAL 8 HA VAL 8 -20.536 -5.966 0.961 773 HB VAL 8 HB VAL 8 -18.917 -4.156 0.640 774 HG11 VAL 8 1HG1 VAL 8 -17.800 -5.772 -1.621 775 HG12 VAL 8 2HG1 VAL 8 -16.982 -5.321 -0.124 776 HG13 VAL 8 3HG1 VAL 8 -17.423 -4.081 -1.296 777 HG21 VAL 8 1HG2 VAL 8 -20.393 -4.995 -1.835 778 HG22 VAL 8 2HG2 VAL 8 -19.672 -3.401 -1.610 779 HG23 VAL 8 3HG2 VAL 8 -20.956 -3.950 -0.530 780 H ARG 9 H ARG 9 -17.953 -7.898 -0.381 781 HA ARG 9 HA ARG 9 -17.876 -9.578 -1.942 782 HB2 ARG 9 2HB ARG 9 -20.806 -9.900 -1.229 783 HB3 ARG 9 1HB ARG 9 -19.801 -11.103 -2.024 784 HG2 ARG 9 2HG ARG 9 -18.377 -11.197 -0.005 785 HG3 ARG 9 1HG ARG 9 -19.483 -10.073 0.788 786 HD2 ARG 9 2HD ARG 9 -21.314 -11.705 0.401 787 HD3 ARG 9 1HD ARG 9 -20.120 -12.832 -0.241 788 HE ARG 9 HE ARG 9 -19.985 -11.776 2.497 789 HH11 ARG 9 1HH1 ARG 9 -19.724 -14.551 0.274 790 HH12 ARG 9 2HH1 ARG 9 -19.549 -15.680 1.531 791 HH21 ARG 9 1HH2 ARG 9 -19.711 -13.357 4.187 792 HH22 ARG 9 2HH2 ARG 9 -19.514 -14.994 3.796 793 H PHE 10 H PHE 10 -18.206 -7.065 -2.892 794 HA PHE 10 HA PHE 10 -20.235 -6.955 -4.976 795 HB2 PHE 10 2HB PHE 10 -19.646 -4.953 -3.621 796 HB3 PHE 10 1HB PHE 10 -18.000 -5.039 -4.210 797 HD1 PHE 10 1HD PHE 10 -21.511 -4.561 -5.308 798 HD2 PHE 10 2HD PHE 10 -17.399 -3.839 -6.126 799 HE1 PHE 10 1HE PHE 10 -22.140 -3.036 -7.127 800 HE2 PHE 10 2HE PHE 10 -18.022 -2.322 -7.947 801 HZ PHE 10 HZ PHE 10 -20.393 -1.915 -8.449 802 H ASP 11 H ASP 11 -17.707 -8.718 -4.707 803 HA ASP 11 HA ASP 11 -15.746 -8.333 -6.504 804 HB2 ASP 11 2HB ASP 11 -17.133 -10.965 -5.952 805 HB3 ASP 11 1HB ASP 11 -15.557 -10.785 -6.702 806 H PHE 12 H PHE 12 -15.941 -7.669 -8.500 807 HA PHE 12 HA PHE 12 -18.107 -8.550 -10.187 808 HB2 PHE 12 2HB PHE 12 -17.051 -7.058 -11.916 809 HB3 PHE 12 1HB PHE 12 -17.482 -6.224 -10.435 810 HD1 PHE 12 1HD PHE 12 -15.806 -5.181 -9.083 811 HD2 PHE 12 2HD PHE 12 -14.677 -7.533 -12.446 812 HE1 PHE 12 1HE PHE 12 -13.518 -4.298 -8.929 813 HE2 PHE 12 2HE PHE 12 -12.391 -6.656 -12.295 814 HZ PHE 12 HZ PHE 12 -11.804 -5.035 -10.534 815 H ASP 13 H ASP 13 -17.784 -9.694 -12.173 816 HA ASP 13 HA ASP 13 -15.844 -11.729 -11.736 817 HB2 ASP 13 2HB ASP 13 -18.025 -12.352 -12.651 818 HB3 ASP 13 1HB ASP 13 -17.696 -11.395 -14.096 819 H ASP 14 H ASP 14 -13.908 -11.721 -12.283 820 HA ASP 14 HA ASP 14 -13.058 -10.476 -14.776 821 HB2 ASP 14 2HB ASP 14 -12.374 -8.997 -12.913 822 HB3 ASP 14 1HB ASP 14 -11.640 -10.369 -12.095 823 H ASN 15 H ASN 15 -11.605 -11.770 -15.860 824 HA ASN 15 HA ASN 15 -11.588 -14.518 -14.854 825 HB2 ASN 15 2HB ASN 15 -12.577 -14.063 -17.064 826 HB3 ASN 15 1HB ASN 15 -11.044 -13.422 -17.620 827 HD21 ASN 15 1HD2 ASN 15 -12.839 -16.281 -16.827 828 HD22 ASN 15 2HD2 ASN 15 -11.726 -17.397 -17.530 829 H ARG 16 H ARG 16 -9.487 -11.942 -14.793 830 HA ARG 16 HA ARG 16 -7.133 -13.543 -15.499 831 HB2 ARG 16 2HB ARG 16 -7.317 -10.579 -14.986 832 HB3 ARG 16 1HB ARG 16 -5.949 -11.464 -15.639 833 HG2 ARG 16 2HG ARG 16 -8.616 -11.097 -16.983 834 HG3 ARG 16 1HG ARG 16 -7.132 -10.227 -17.362 835 HD2 ARG 16 2HD ARG 16 -7.539 -13.207 -17.622 836 HD3 ARG 16 1HD ARG 16 -7.591 -12.049 -18.943 837 HE ARG 16 HE ARG 16 -5.153 -11.872 -17.525 838 HH11 ARG 16 1HH1 ARG 16 -6.883 -13.806 -19.936 839 HH12 ARG 16 2HH1 ARG 16 -5.486 -14.429 -20.665 840 HH21 ARG 16 1HH2 ARG 16 -3.225 -12.716 -18.510 841 HH22 ARG 16 2HH2 ARG 16 -3.335 -13.803 -19.810 842 H LYS 17 H LYS 17 -5.299 -13.483 -14.107 843 HA LYS 17 HA LYS 17 -5.600 -12.352 -11.477 844 HB2 LYS 17 2HB LYS 17 -4.838 -15.242 -11.975 845 HB3 LYS 17 1HB LYS 17 -4.555 -14.405 -10.454 846 HG2 LYS 17 2HG LYS 17 -7.006 -14.014 -10.297 847 HG3 LYS 17 1HG LYS 17 -7.206 -15.036 -11.722 848 HD2 LYS 17 2HD LYS 17 -6.196 -16.900 -10.554 849 HD3 LYS 17 1HD LYS 17 -5.891 -15.858 -9.159 850 HE2 LYS 17 2HE LYS 17 -8.319 -15.507 -8.927 851 HE3 LYS 17 1HE LYS 17 -8.586 -16.628 -10.260 852 HZ1 LYS 17 1HZ LYS 17 -8.850 -17.676 -8.113 853 HZ2 LYS 17 2HZ LYS 17 -7.243 -17.294 -7.708 854 HZ3 LYS 17 3HZ LYS 17 -7.568 -18.370 -8.971 855 H LYS 18 H LYS 18 -3.640 -11.741 -10.550 856 HA LYS 18 HA LYS 18 -1.568 -10.897 -10.545 857 HB2 LYS 18 2HB LYS 18 -0.789 -13.209 -10.956 858 HB3 LYS 18 1HB LYS 18 -1.012 -12.990 -12.679 859 HG2 LYS 18 2HG LYS 18 0.796 -11.366 -12.715 860 HG3 LYS 18 1HG LYS 18 0.988 -11.527 -10.967 861 HD2 LYS 18 2HD LYS 18 1.553 -13.877 -11.232 862 HD3 LYS 18 1HD LYS 18 1.290 -13.743 -12.972 863 HE2 LYS 18 2HE LYS 18 3.349 -12.191 -11.426 864 HE3 LYS 18 1HE LYS 18 3.666 -13.673 -12.327 865 HZ1 LYS 18 1HZ LYS 18 2.992 -12.566 -14.339 866 HZ2 LYS 18 2HZ LYS 18 4.246 -11.745 -13.621 867 HZ3 LYS 18 3HZ LYS 18 2.698 -11.104 -13.553 868 H ALA 19 H ALA 19 -3.729 -10.393 -12.618 869 HA ALA 19 HA ALA 19 -2.579 -9.226 -14.928 870 HB1 ALA 19 1HB ALA 19 -4.734 -8.235 -15.273 871 HB2 ALA 19 2HB ALA 19 -5.148 -8.615 -13.596 872 HB3 ALA 19 3HB ALA 19 -4.910 -9.932 -14.763 873 H ILE 20 H ILE 20 -3.390 -8.052 -11.745 874 HA ILE 20 HA ILE 20 -3.168 -5.287 -12.232 875 HB ILE 20 HB ILE 20 -2.607 -6.854 -9.693 876 HG12 ILE 20 2HG1 ILE 20 -5.073 -5.350 -10.556 877 HG13 ILE 20 1HG1 ILE 20 -4.905 -7.092 -10.616 878 HG21 ILE 20 1HG2 ILE 20 -1.563 -4.655 -9.576 879 HG22 ILE 20 2HG2 ILE 20 -2.956 -4.737 -8.498 880 HG23 ILE 20 3HG2 ILE 20 -3.085 -3.892 -10.042 881 HD11 ILE 20 1HD1 ILE 20 -6.171 -6.451 -8.707 882 HD12 ILE 20 2HD1 ILE 20 -4.902 -5.352 -8.163 883 HD13 ILE 20 3HD1 ILE 20 -4.627 -7.098 -8.159 884 H SER 21 H SER 21 -0.880 -7.794 -11.693 885 HA SER 21 HA SER 21 1.348 -6.109 -11.109 886 HB2 SER 21 2HB SER 21 1.310 -8.967 -12.090 887 HB3 SER 21 1HB SER 21 2.669 -8.131 -11.328 888 HG SER 21 HG SER 21 0.799 -7.752 -9.655 889 H GLU 22 H GLU 22 -0.022 -7.600 -13.928 890 HA GLU 22 HA GLU 22 2.061 -6.872 -15.728 891 HB2 GLU 22 2HB GLU 22 -0.808 -7.567 -16.348 892 HB3 GLU 22 1HB GLU 22 0.571 -7.711 -17.425 893 HG2 GLU 22 2HG GLU 22 0.026 -9.363 -14.958 894 HG3 GLU 22 1HG GLU 22 -0.102 -9.890 -16.631 895 H THR 23 H THR 23 -1.006 -5.581 -14.676 896 HA THR 23 HA THR 23 -1.353 -3.510 -16.529 897 HB THR 23 HB THR 23 -2.323 -3.686 -13.661 898 HG1 THR 23 1HG THR 23 -2.937 -5.365 -15.266 899 HG21 THR 23 1HG2 THR 23 -4.073 -2.101 -14.371 900 HG22 THR 23 2HG2 THR 23 -3.311 -1.976 -15.957 901 HG23 THR 23 3HG2 THR 23 -2.467 -1.386 -14.526 902 H LEU 24 H LEU 24 0.077 -3.390 -13.235 903 HA LEU 24 HA LEU 24 0.787 -0.695 -13.572 904 HB2 LEU 24 2HB LEU 24 1.630 -2.716 -11.531 905 HB3 LEU 24 1HB LEU 24 2.437 -1.166 -11.612 906 HG LEU 24 HG LEU 24 0.269 -0.034 -11.225 907 HD11 LEU 24 1HD1 LEU 24 -0.827 -2.793 -10.789 908 HD12 LEU 24 2HD1 LEU 24 -1.262 -1.680 -12.086 909 HD13 LEU 24 3HD1 LEU 24 -1.655 -1.282 -10.414 910 HD21 LEU 24 1HD2 LEU 24 0.074 -0.610 -8.855 911 HD22 LEU 24 2HD2 LEU 24 1.751 -0.450 -9.370 912 HD23 LEU 24 3HD2 LEU 24 1.050 -2.052 -9.139 913 H GLU 25 H GLU 25 2.425 -3.605 -14.469 914 HA GLU 25 HA GLU 25 4.947 -2.516 -15.042 915 HB2 GLU 25 2HB GLU 25 4.423 -4.930 -15.169 916 HB3 GLU 25 1HB GLU 25 3.384 -4.627 -16.553 917 HG2 GLU 25 2HG GLU 25 5.378 -3.781 -17.773 918 HG3 GLU 25 1HG GLU 25 6.365 -4.294 -16.402 919 H THR 26 H THR 26 1.964 -2.752 -16.943 920 HA THR 26 HA THR 26 2.851 -1.494 -19.279 921 HB THR 26 HB THR 26 0.038 -1.455 -18.136 922 HG1 THR 26 1HG THR 26 1.526 -3.519 -18.798 923 HG21 THR 26 1HG2 THR 26 0.437 0.033 -20.027 924 HG22 THR 26 2HG2 THR 26 -0.632 -1.296 -20.485 925 HG23 THR 26 3HG2 THR 26 1.072 -1.309 -20.966 926 H VAL 27 H VAL 27 1.155 -0.219 -16.424 927 HA VAL 27 HA VAL 27 0.958 2.464 -17.250 928 HB VAL 27 HB VAL 27 1.136 1.429 -14.398 929 HG11 VAL 27 1HG1 VAL 27 1.500 3.836 -14.523 930 HG12 VAL 27 2HG1 VAL 27 -0.065 3.480 -13.787 931 HG13 VAL 27 3HG1 VAL 27 0.018 4.023 -15.461 932 HG21 VAL 27 1HG2 VAL 27 -1.312 1.947 -16.099 933 HG22 VAL 27 2HG2 VAL 27 -1.310 1.459 -14.404 934 HG23 VAL 27 3HG2 VAL 27 -0.691 0.364 -15.634 935 H TYR 28 H TYR 28 3.499 0.772 -15.521 936 HA TYR 28 HA TYR 28 5.015 3.030 -14.831 937 HB2 TYR 28 2HB TYR 28 5.320 0.688 -13.903 938 HB3 TYR 28 1HB TYR 28 6.105 0.256 -15.416 939 HD1 TYR 28 1HD TYR 28 8.239 1.449 -16.036 940 HD2 TYR 28 2HD TYR 28 6.514 1.744 -12.167 941 HE1 TYR 28 1HE TYR 28 10.397 2.255 -15.122 942 HE2 TYR 28 2HE TYR 28 8.678 2.548 -11.255 943 HH TYR 28 HH TYR 28 11.177 3.603 -13.215 944 H ARG 29 H ARG 29 5.202 0.833 -17.573 945 HA ARG 29 HA ARG 29 7.288 2.008 -19.022 946 HB2 ARG 29 2HB ARG 29 4.867 0.438 -19.896 947 HB3 ARG 29 1HB ARG 29 6.153 0.902 -20.997 948 HG2 ARG 29 2HG ARG 29 6.784 -0.634 -18.505 949 HG3 ARG 29 1HG ARG 29 6.162 -1.465 -19.928 950 HD2 ARG 29 2HD ARG 29 8.626 -1.503 -19.846 951 HD3 ARG 29 1HD ARG 29 8.000 -0.648 -21.246 952 HE ARG 29 HE ARG 29 8.930 0.843 -18.888 953 HH11 ARG 29 1HH1 ARG 29 9.169 0.136 -22.368 954 HH12 ARG 29 2HH1 ARG 29 10.318 1.349 -22.653 955 HH21 ARG 29 1HH2 ARG 29 10.447 2.423 -19.309 956 HH22 ARG 29 2HH2 ARG 29 11.077 2.729 -20.890 957 H ALA 30 H ALA 30 3.860 2.696 -18.958 958 HA ALA 30 HA ALA 30 3.691 4.403 -21.169 959 HB1 ALA 30 1HB ALA 30 2.005 4.501 -18.670 960 HB2 ALA 30 2HB ALA 30 1.725 3.441 -20.049 961 HB3 ALA 30 3HB ALA 30 1.586 5.192 -20.237 962 H LEU 31 H LEU 31 4.325 5.213 -17.759 963 HA LEU 31 HA LEU 31 4.494 7.961 -18.467 964 HB2 LEU 31 2HB LEU 31 5.182 6.656 -15.866 965 HB3 LEU 31 1HB LEU 31 5.471 8.356 -16.149 966 HG LEU 31 HG LEU 31 2.945 8.362 -16.770 967 HD11 LEU 31 1HD1 LEU 31 2.529 6.018 -16.685 968 HD12 LEU 31 2HD1 LEU 31 1.599 6.866 -15.439 969 HD13 LEU 31 3HD1 LEU 31 3.043 5.969 -14.994 970 HD21 LEU 31 1HD2 LEU 31 3.903 9.640 -14.984 971 HD22 LEU 31 2HD2 LEU 31 3.881 8.245 -13.907 972 HD23 LEU 31 3HD2 LEU 31 2.376 8.929 -14.511 973 H GLU 32 H GLU 32 6.859 5.457 -18.301 974 HA GLU 32 HA GLU 32 9.081 7.207 -18.254 975 HB2 GLU 32 2HB GLU 32 8.877 4.437 -19.433 976 HB3 GLU 32 1HB GLU 32 10.376 5.320 -19.200 977 HG2 GLU 32 2HG GLU 32 9.950 5.350 -16.778 978 HG3 GLU 32 1HG GLU 32 8.495 4.388 -17.048 979 H GLU 33 H GLU 33 7.154 5.843 -20.853 980 HA GLU 33 HA GLU 33 8.611 6.895 -23.024 981 HB2 GLU 33 2HB GLU 33 5.678 6.217 -22.773 982 HB3 GLU 33 1HB GLU 33 6.478 6.607 -24.284 983 HG2 GLU 33 2HG GLU 33 7.219 4.294 -22.508 984 HG3 GLU 33 1HG GLU 33 6.169 4.190 -23.922 985 H LYS 34 H LYS 34 6.291 8.267 -20.871 986 HA LYS 34 HA LYS 34 6.014 10.682 -22.480 987 HB2 LYS 34 2HB LYS 34 4.631 9.771 -19.967 988 HB3 LYS 34 1HB LYS 34 4.348 11.339 -20.707 989 HG2 LYS 34 2HG LYS 34 3.920 8.699 -22.097 990 HG3 LYS 34 1HG LYS 34 2.651 9.616 -21.283 991 HD2 LYS 34 2HD LYS 34 4.334 10.761 -23.521 992 HD3 LYS 34 1HD LYS 34 2.802 9.941 -23.792 993 HE2 LYS 34 2HE LYS 34 1.633 11.533 -22.507 994 HE3 LYS 34 1HE LYS 34 3.112 12.331 -21.966 995 HZ1 LYS 34 1HZ LYS 34 3.534 12.976 -24.281 996 HZ2 LYS 34 2HZ LYS 34 2.071 13.584 -23.751 997 HZ3 LYS 34 3HZ LYS 34 2.092 12.265 -24.785 998 H GLY 35 H GLY 35 8.183 9.632 -20.297 999 HA2 GLY 35 2HA GLY 35 9.957 10.752 -19.351 1000 HA3 GLY 35 1HA GLY 35 9.320 12.228 -20.046 1001 H TYR 36 H TYR 36 7.437 10.240 -17.878 1002 HA TYR 36 HA TYR 36 7.738 12.343 -15.823 1003 HB2 TYR 36 2HB TYR 36 5.438 10.411 -16.214 1004 HB3 TYR 36 1HB TYR 36 5.550 11.604 -14.931 1005 HD1 TYR 36 1HD TYR 36 4.116 10.865 -17.988 1006 HD2 TYR 36 2HD TYR 36 5.894 14.102 -15.894 1007 HE1 TYR 36 1HE TYR 36 2.917 12.447 -19.434 1008 HE2 TYR 36 2HE TYR 36 4.695 15.696 -17.343 1009 HH TYR 36 HH TYR 36 3.683 15.731 -19.562 1010 H ASN 37 H ASN 37 7.064 11.258 -13.569 1011 HA ASN 37 HA ASN 37 8.695 8.851 -13.333 1012 HB2 ASN 37 2HB ASN 37 7.814 10.825 -11.207 1013 HB3 ASN 37 1HB ASN 37 8.703 9.348 -10.869 1014 HD21 ASN 37 1HD2 ASN 37 9.450 12.065 -10.321 1015 HD22 ASN 37 2HD2 ASN 37 10.933 12.339 -11.155 1016 HA PRO 38 HA PRO 38 4.761 6.662 -13.533 1017 HB2 PRO 38 2HB PRO 38 6.638 4.661 -12.396 1018 HB3 PRO 38 1HB PRO 38 5.427 4.489 -13.671 1019 HG2 PRO 38 2HG PRO 38 7.997 4.721 -14.300 1020 HG3 PRO 38 1HG PRO 38 6.765 5.536 -15.266 1021 HD2 PRO 38 2HD PRO 38 8.692 6.658 -13.323 1022 HD3 PRO 38 1HD PRO 38 7.967 7.399 -14.759 1023 H ILE 39 H ILE 39 6.920 6.452 -10.725 1024 HA ILE 39 HA ILE 39 4.994 5.256 -9.034 1025 HB ILE 39 HB ILE 39 7.499 6.788 -8.297 1026 HG12 ILE 39 2HG1 ILE 39 7.928 4.872 -9.755 1027 HG13 ILE 39 1HG1 ILE 39 8.555 4.571 -8.144 1028 HG21 ILE 39 1HG2 ILE 39 5.982 6.624 -6.385 1029 HG22 ILE 39 2HG2 ILE 39 7.393 5.592 -6.152 1030 HG23 ILE 39 3HG2 ILE 39 5.852 4.882 -6.628 1031 HD11 ILE 39 1HD1 ILE 39 7.498 2.589 -9.086 1032 HD12 ILE 39 2HD1 ILE 39 6.002 3.484 -9.324 1033 HD13 ILE 39 3HD1 ILE 39 6.589 3.167 -7.691 1034 H ASN 40 H ASN 40 5.990 8.583 -9.500 1035 HA ASN 40 HA ASN 40 4.636 9.772 -7.363 1036 HB2 ASN 40 2HB ASN 40 5.308 10.943 -10.070 1037 HB3 ASN 40 1HB ASN 40 4.701 11.880 -8.718 1038 HD21 ASN 40 1HD2 ASN 40 6.535 13.157 -8.675 1039 HD22 ASN 40 2HD2 ASN 40 8.040 12.587 -8.081 1040 H GLN 41 H GLN 41 3.541 9.167 -10.666 1041 HA GLN 41 HA GLN 41 1.030 10.383 -10.127 1042 HB2 GLN 41 2HB GLN 41 1.959 8.790 -12.488 1043 HB3 GLN 41 1HB GLN 41 0.415 9.638 -12.406 1044 HG2 GLN 41 2HG GLN 41 3.132 10.942 -12.159 1045 HG3 GLN 41 1HG GLN 41 2.130 10.949 -13.607 1046 HE21 GLN 41 1HE2 GLN 41 -0.337 11.320 -12.202 1047 HE22 GLN 41 2HE2 GLN 41 -0.361 12.948 -11.628 1048 H ILE 42 H ILE 42 2.163 7.027 -10.180 1049 HA ILE 42 HA ILE 42 -0.420 5.883 -10.049 1050 HB ILE 42 HB ILE 42 2.213 4.692 -9.092 1051 HG12 ILE 42 2HG1 ILE 42 0.639 4.225 -11.644 1052 HG13 ILE 42 1HG1 ILE 42 2.111 5.180 -11.523 1053 HG21 ILE 42 1HG2 ILE 42 0.334 3.597 -7.971 1054 HG22 ILE 42 2HG2 ILE 42 1.041 2.503 -9.157 1055 HG23 ILE 42 3HG2 ILE 42 -0.468 3.334 -9.511 1056 HD11 ILE 42 1HD1 ILE 42 3.348 3.174 -10.865 1057 HD12 ILE 42 2HD1 ILE 42 2.567 2.972 -12.435 1058 HD13 ILE 42 3HD1 ILE 42 1.869 2.221 -10.998 1059 H VAL 43 H VAL 43 1.897 6.759 -7.465 1060 HA VAL 43 HA VAL 43 0.368 5.772 -5.366 1061 HB VAL 43 HB VAL 43 2.662 6.436 -4.891 1062 HG11 VAL 43 1HG1 VAL 43 2.863 8.339 -6.421 1063 HG12 VAL 43 2HG1 VAL 43 3.353 8.813 -4.792 1064 HG13 VAL 43 3HG1 VAL 43 1.771 9.281 -5.409 1065 HG21 VAL 43 1HG2 VAL 43 0.772 8.218 -3.358 1066 HG22 VAL 43 2HG2 VAL 43 2.393 7.751 -2.838 1067 HG23 VAL 43 3HG2 VAL 43 1.130 6.530 -3.011 1068 H GLY 44 H GLY 44 0.117 8.876 -6.994 1069 HA2 GLY 44 2HA GLY 44 -1.773 9.995 -5.254 1070 HA3 GLY 44 1HA GLY 44 -1.503 10.483 -6.926 1071 H TYR 45 H TYR 45 -2.145 8.010 -8.141 1072 HA TYR 45 HA TYR 45 -4.886 8.341 -8.450 1073 HB2 TYR 45 2HB TYR 45 -3.740 7.304 -10.263 1074 HB3 TYR 45 1HB TYR 45 -3.131 6.011 -9.237 1075 HD1 TYR 45 1HD TYR 45 -4.219 3.957 -9.312 1076 HD2 TYR 45 2HD TYR 45 -6.405 7.451 -10.327 1077 HE1 TYR 45 1HE TYR 45 -6.173 2.574 -9.813 1078 HE2 TYR 45 2HE TYR 45 -8.365 6.077 -10.836 1079 HH TYR 45 HH TYR 45 -8.835 3.711 -11.500 1080 H LEU 46 H LEU 46 -3.230 5.808 -6.622 1081 HA LEU 46 HA LEU 46 -5.687 4.538 -6.021 1082 HB2 LEU 46 2HB LEU 46 -3.006 4.133 -4.793 1083 HB3 LEU 46 1HB LEU 46 -4.395 3.202 -4.317 1084 HG LEU 46 HG LEU 46 -4.545 2.458 -6.795 1085 HD11 LEU 46 1HD1 LEU 46 -2.568 2.516 -8.109 1086 HD12 LEU 46 2HD1 LEU 46 -1.752 3.456 -6.865 1087 HD13 LEU 46 3HD1 LEU 46 -3.114 4.156 -7.727 1088 HD21 LEU 46 1HD2 LEU 46 -2.883 0.722 -6.481 1089 HD22 LEU 46 2HD2 LEU 46 -3.831 0.983 -5.017 1090 HD23 LEU 46 3HD2 LEU 46 -2.190 1.620 -5.136 1091 H LEU 47 H LEU 47 -3.759 6.797 -4.134 1092 HA LEU 47 HA LEU 47 -5.663 6.370 -2.015 1093 HB2 LEU 47 2HB LEU 47 -4.153 7.832 -0.621 1094 HB3 LEU 47 1HB LEU 47 -3.517 6.292 -1.149 1095 HG LEU 47 HG LEU 47 -2.324 7.551 -2.976 1096 HD11 LEU 47 1HD1 LEU 47 -3.573 9.588 -2.986 1097 HD12 LEU 47 2HD1 LEU 47 -1.868 9.900 -2.663 1098 HD13 LEU 47 3HD1 LEU 47 -3.043 9.957 -1.342 1099 HD21 LEU 47 1HD2 LEU 47 -1.189 6.674 -1.100 1100 HD22 LEU 47 2HD2 LEU 47 -1.596 8.079 -0.107 1101 HD23 LEU 47 3HD2 LEU 47 -0.504 8.248 -1.494 1102 H SER 48 H SER 48 -5.585 8.378 -4.580 1103 HA SER 48 HA SER 48 -7.206 10.343 -3.130 1104 HB2 SER 48 2HB SER 48 -5.286 11.289 -4.401 1105 HB3 SER 48 1HB SER 48 -5.953 10.603 -5.877 1106 HG SER 48 HG SER 48 -7.408 12.354 -4.230 1107 H GLY 49 H GLY 49 -7.300 7.827 -5.606 1108 HA2 GLY 49 2HA GLY 49 -9.119 6.788 -6.449 1109 HA3 GLY 49 1HA GLY 49 -10.148 7.870 -5.518 1110 H ASP 50 H ASP 50 -7.697 9.075 -7.652 1111 HA ASP 50 HA ASP 50 -9.838 9.991 -9.425 1112 HB2 ASP 50 2HB ASP 50 -8.963 11.825 -8.076 1113 HB3 ASP 50 1HB ASP 50 -7.335 11.483 -8.651 1114 HA PRO 51 HA PRO 51 -7.562 7.418 -12.349 1115 HB2 PRO 51 2HB PRO 51 -9.528 8.679 -14.180 1116 HB3 PRO 51 1HB PRO 51 -9.145 6.970 -13.942 1117 HG2 PRO 51 2HG PRO 51 -11.394 7.957 -12.960 1118 HG3 PRO 51 1HG PRO 51 -10.425 6.818 -12.008 1119 HD2 PRO 51 2HD PRO 51 -10.625 9.795 -11.763 1120 HD3 PRO 51 1HD PRO 51 -10.605 8.545 -10.494 1121 H ALA 52 H ALA 52 -8.141 10.837 -12.616 1122 HA ALA 52 HA ALA 52 -6.833 11.297 -15.065 1123 HB1 ALA 52 1HB ALA 52 -6.884 13.636 -14.495 1124 HB2 ALA 52 2HB ALA 52 -7.230 13.240 -12.812 1125 HB3 ALA 52 3HB ALA 52 -8.419 12.874 -14.066 1126 H TYR 53 H TYR 53 -5.498 10.477 -12.073 1127 HA TYR 53 HA TYR 53 -3.080 11.889 -12.253 1128 HB2 TYR 53 2HB TYR 53 -3.871 9.480 -10.689 1129 HB3 TYR 53 1HB TYR 53 -2.183 9.984 -10.745 1130 HD1 TYR 53 1HD TYR 53 -1.728 12.442 -10.249 1131 HD2 TYR 53 2HD TYR 53 -5.286 10.446 -9.100 1132 HE1 TYR 53 1HE TYR 53 -2.093 14.129 -8.571 1133 HE2 TYR 53 2HE TYR 53 -5.688 12.153 -7.375 1134 HH TYR 53 HH TYR 53 -4.280 13.790 -6.042 1135 H ILE 54 H ILE 54 -4.117 9.111 -14.003 1136 HA ILE 54 HA ILE 54 -1.337 8.596 -14.725 1137 HB ILE 54 HB ILE 54 -3.809 6.997 -15.554 1138 HG12 ILE 54 2HG1 ILE 54 -3.428 6.815 -13.135 1139 HG13 ILE 54 1HG1 ILE 54 -2.993 5.320 -13.951 1140 HG21 ILE 54 1HG2 ILE 54 -2.240 5.289 -16.280 1141 HG22 ILE 54 2HG2 ILE 54 -0.887 6.338 -15.866 1142 HG23 ILE 54 3HG2 ILE 54 -1.990 6.797 -17.163 1143 HD11 ILE 54 1HD1 ILE 54 -1.402 5.874 -12.204 1144 HD12 ILE 54 2HD1 ILE 54 -1.053 7.416 -12.980 1145 HD13 ILE 54 3HD1 ILE 54 -0.632 5.903 -13.789 1146 HA PRO 55 HA PRO 55 -1.847 11.230 -18.294 1147 HB2 PRO 55 2HB PRO 55 0.370 10.304 -19.656 1148 HB3 PRO 55 1HB PRO 55 0.421 11.547 -18.406 1149 HG2 PRO 55 2HG PRO 55 1.036 8.638 -18.211 1150 HG3 PRO 55 1HG PRO 55 1.838 10.019 -17.442 1151 HD2 PRO 55 2HD PRO 55 0.140 8.420 -16.107 1152 HD3 PRO 55 1HD PRO 55 0.263 10.154 -15.750 1153 H ARG 56 H ARG 56 -2.476 11.012 -20.408 1154 HA ARG 56 HA ARG 56 -3.337 8.313 -20.999 1155 HB2 ARG 56 2HB ARG 56 -5.118 9.207 -22.488 1156 HB3 ARG 56 1HB ARG 56 -5.299 9.717 -20.824 1157 HG2 ARG 56 2HG ARG 56 -4.083 11.457 -22.968 1158 HG3 ARG 56 1HG ARG 56 -5.802 11.448 -22.598 1159 HD2 ARG 56 2HD ARG 56 -5.356 12.219 -20.355 1160 HD3 ARG 56 1HD ARG 56 -3.621 12.104 -20.596 1161 HE ARG 56 HE ARG 56 -4.687 13.742 -22.560 1162 HH11 ARG 56 1HH1 ARG 56 -4.218 13.773 -19.038 1163 HH12 ARG 56 2HH1 ARG 56 -4.018 15.466 -18.958 1164 HH21 ARG 56 1HH2 ARG 56 -4.410 16.091 -22.407 1165 HH22 ARG 56 2HH2 ARG 56 -4.127 16.779 -20.865 1166 H TYR 57 H TYR 57 -1.274 7.918 -21.652 1167 HA TYR 57 HA TYR 57 -0.765 8.675 -24.432 1168 HB2 TYR 57 2HB TYR 57 1.141 8.965 -23.010 1169 HB3 TYR 57 1HB TYR 57 0.984 7.331 -22.380 1170 HD1 TYR 57 1HD TYR 57 1.543 9.144 -25.581 1171 HD2 TYR 57 2HD TYR 57 2.242 5.621 -23.320 1172 HE1 TYR 57 1HE TYR 57 3.042 8.325 -27.340 1173 HE2 TYR 57 2HE TYR 57 3.739 4.782 -25.065 1174 HH TYR 57 HH TYR 57 4.139 5.097 -27.412 1175 H GLN 58 H GLN 58 -0.927 5.819 -22.349 1176 HA GLN 58 HA GLN 58 -1.323 4.184 -24.732 1177 HB2 GLN 58 2HB GLN 58 0.870 3.945 -23.402 1178 HB3 GLN 58 1HB GLN 58 -0.143 3.347 -22.096 1179 HG2 GLN 58 2HG GLN 58 -0.858 1.490 -23.501 1180 HG3 GLN 58 1HG GLN 58 0.170 2.110 -24.800 1181 HE21 GLN 58 1HE2 GLN 58 1.421 0.276 -24.845 1182 HE22 GLN 58 2HE2 GLN 58 2.565 -0.089 -23.601 1183 H ASP 59 H ASP 59 -2.532 2.174 -24.110 1184 HA ASP 59 HA ASP 59 -4.984 2.690 -22.900 1185 HB2 ASP 59 2HB ASP 59 -5.364 0.200 -22.994 1186 HB3 ASP 59 1HB ASP 59 -4.950 0.960 -24.519 1187 H ALA 60 H ALA 60 -2.107 2.117 -21.406 1188 HA ALA 60 HA ALA 60 -2.544 0.695 -19.103 1189 HB1 ALA 60 1HB ALA 60 -0.805 2.003 -18.099 1190 HB2 ALA 60 2HB ALA 60 -1.059 3.298 -19.258 1191 HB3 ALA 60 3HB ALA 60 -0.401 1.759 -19.803 1192 H ARG 61 H ARG 61 -3.378 4.124 -19.681 1193 HA ARG 61 HA ARG 61 -4.363 4.619 -17.123 1194 HB2 ARG 61 2HB ARG 61 -5.569 6.593 -18.183 1195 HB3 ARG 61 1HB ARG 61 -3.841 6.535 -18.439 1196 HG2 ARG 61 2HG ARG 61 -4.865 7.256 -20.465 1197 HG3 ARG 61 1HG ARG 61 -4.293 5.611 -20.740 1198 HD2 ARG 61 2HD ARG 61 -6.675 4.890 -20.236 1199 HD3 ARG 61 1HD ARG 61 -7.103 6.597 -20.294 1200 HE ARG 61 HE ARG 61 -5.682 5.973 -22.608 1201 HH11 ARG 61 1HH1 ARG 61 -8.861 5.345 -21.154 1202 HH12 ARG 61 2HH1 ARG 61 -9.613 4.972 -22.625 1203 HH21 ARG 61 1HH2 ARG 61 -6.750 5.435 -24.650 1204 HH22 ARG 61 2HH2 ARG 61 -8.397 5.021 -24.636 1205 H ASN 62 H ASN 62 -5.895 3.134 -19.847 1206 HA ASN 62 HA ASN 62 -8.556 3.226 -18.728 1207 HB2 ASN 62 2HB ASN 62 -7.931 3.068 -21.225 1208 HB3 ASN 62 1HB ASN 62 -7.514 1.397 -20.910 1209 HD21 ASN 62 1HD2 ASN 62 -9.917 1.200 -18.974 1210 HD22 ASN 62 2HD2 ASN 62 -11.250 1.090 -20.052 1211 H LEU 63 H LEU 63 -5.895 0.939 -19.018 1212 HA LEU 63 HA LEU 63 -7.087 -1.400 -18.044 1213 HB2 LEU 63 2HB LEU 63 -4.236 -0.507 -17.651 1214 HB3 LEU 63 1HB LEU 63 -4.833 -2.145 -17.511 1215 HG LEU 63 HG LEU 63 -4.684 -0.513 -20.038 1216 HD11 LEU 63 1HD1 LEU 63 -2.502 -1.257 -19.231 1217 HD12 LEU 63 2HD1 LEU 63 -2.971 -2.089 -20.700 1218 HD13 LEU 63 3HD1 LEU 63 -3.103 -2.913 -19.142 1219 HD21 LEU 63 1HD2 LEU 63 -5.315 -2.568 -21.159 1220 HD22 LEU 63 2HD2 LEU 63 -6.593 -2.014 -20.079 1221 HD23 LEU 63 3HD2 LEU 63 -5.554 -3.364 -19.605 1222 H ILE 64 H ILE 64 -5.237 1.080 -16.340 1223 HA ILE 64 HA ILE 64 -5.365 -0.137 -13.790 1224 HB ILE 64 HB ILE 64 -3.693 1.612 -14.527 1225 HG12 ILE 64 2HG1 ILE 64 -5.210 2.314 -11.996 1226 HG13 ILE 64 1HG1 ILE 64 -4.031 1.014 -12.125 1227 HG21 ILE 64 1HG2 ILE 64 -4.394 4.024 -14.324 1228 HG22 ILE 64 2HG2 ILE 64 -6.074 3.460 -14.165 1229 HG23 ILE 64 3HG2 ILE 64 -5.206 3.162 -15.630 1230 HD11 ILE 64 1HD1 ILE 64 -2.292 2.671 -12.644 1231 HD12 ILE 64 2HD1 ILE 64 -3.051 2.965 -11.082 1232 HD13 ILE 64 3HD1 ILE 64 -3.488 3.957 -12.472 1233 H ARG 65 H ARG 65 -7.462 1.874 -15.572 1234 HA ARG 65 HA ARG 65 -8.951 2.970 -13.406 1235 HB2 ARG 65 2HB ARG 65 -8.469 4.000 -15.678 1236 HB3 ARG 65 1HB ARG 65 -9.591 2.857 -16.363 1237 HG2 ARG 65 2HG ARG 65 -10.304 4.932 -14.319 1238 HG3 ARG 65 1HG ARG 65 -10.419 5.154 -16.057 1239 HD2 ARG 65 2HD ARG 65 -11.936 3.317 -16.203 1240 HD3 ARG 65 1HD ARG 65 -11.847 3.037 -14.472 1241 HE ARG 65 HE ARG 65 -12.663 5.709 -15.135 1242 HH11 ARG 65 1HH1 ARG 65 -13.887 2.418 -14.593 1243 HH12 ARG 65 2HH1 ARG 65 -15.456 2.907 -14.192 1244 HH21 ARG 65 1HH2 ARG 65 -14.849 6.379 -14.547 1245 HH22 ARG 65 2HH2 ARG 65 -16.023 5.215 -14.186 1246 H ARG 66 H ARG 66 -9.030 0.111 -15.335 1247 HA ARG 66 HA ARG 66 -11.769 -0.607 -14.807 1248 HB2 ARG 66 2HB ARG 66 -9.453 -2.247 -15.852 1249 HB3 ARG 66 1HB ARG 66 -11.110 -2.818 -15.753 1250 HG2 ARG 66 2HG ARG 66 -11.811 -1.159 -17.367 1251 HG3 ARG 66 1HG ARG 66 -10.180 -0.478 -17.412 1252 HD2 ARG 66 2HD ARG 66 -9.319 -2.587 -18.248 1253 HD3 ARG 66 1HD ARG 66 -10.940 -3.289 -18.203 1254 HE ARG 66 HE ARG 66 -11.352 -1.231 -19.790 1255 HH11 ARG 66 1HH1 ARG 66 -8.683 -3.548 -19.824 1256 HH12 ARG 66 2HH1 ARG 66 -8.375 -3.428 -21.490 1257 HH21 ARG 66 1HH2 ARG 66 -10.943 -1.057 -22.118 1258 HH22 ARG 66 2HH2 ARG 66 -9.703 -1.983 -22.818 1259 H HIS 67 H HIS 67 -8.930 -0.679 -13.020 1260 HA HIS 67 HA HIS 67 -9.883 -2.873 -11.313 1261 HB2 HIS 67 2HB HIS 67 -7.168 -1.563 -11.496 1262 HB3 HIS 67 1HB HIS 67 -7.594 -2.781 -10.300 1263 HD1 HIS 67 1HD HIS 67 -7.597 -5.174 -11.070 1264 HD2 HIS 67 2HD HIS 67 -6.788 -2.497 -14.117 1265 HE1 HIS 67 1HE HIS 67 -6.687 -6.565 -12.992 1266 HE2 HIS 67 2HE HIS 67 -6.629 -4.925 -14.891 1267 H GLU 68 H GLU 68 -10.341 -2.448 -9.178 1268 HA GLU 68 HA GLU 68 -10.792 0.304 -8.563 1269 HB2 GLU 68 2HB GLU 68 -11.124 -2.133 -6.796 1270 HB3 GLU 68 1HB GLU 68 -11.638 -0.507 -6.373 1271 HG2 GLU 68 2HG GLU 68 -12.710 -2.199 -8.625 1272 HG3 GLU 68 1HG GLU 68 -13.539 -1.793 -7.125 1273 H ARG 69 H ARG 69 -9.841 1.545 -6.929 1274 HA ARG 69 HA ARG 69 -7.058 1.382 -6.880 1275 HB2 ARG 69 2HB ARG 69 -8.818 2.885 -4.908 1276 HB3 ARG 69 1HB ARG 69 -7.100 3.066 -5.057 1277 HG2 ARG 69 2HG ARG 69 -8.030 4.973 -6.066 1278 HG3 ARG 69 1HG ARG 69 -7.518 3.963 -7.404 1279 HD2 ARG 69 2HD ARG 69 -10.368 3.978 -6.409 1280 HD3 ARG 69 1HD ARG 69 -9.789 5.174 -7.547 1281 HE ARG 69 HE ARG 69 -9.184 3.104 -8.941 1282 HH11 ARG 69 1HH1 ARG 69 -12.027 3.216 -6.795 1283 HH12 ARG 69 2HH1 ARG 69 -12.982 2.247 -7.822 1284 HH21 ARG 69 1HH2 ARG 69 -10.514 1.805 -10.310 1285 HH22 ARG 69 2HH2 ARG 69 -12.112 1.427 -9.848 1286 H ASP 70 H ASP 70 -9.481 0.361 -4.609 1287 HA ASP 70 HA ASP 70 -7.870 -0.376 -2.418 1288 HB2 ASP 70 2HB ASP 70 -10.437 -1.725 -3.291 1289 HB3 ASP 70 1HB ASP 70 -9.741 -1.743 -1.680 1290 H GLU 71 H GLU 71 -9.063 -2.196 -5.159 1291 HA GLU 71 HA GLU 71 -8.178 -4.765 -4.567 1292 HB2 GLU 71 2HB GLU 71 -9.750 -4.215 -6.369 1293 HB3 GLU 71 1HB GLU 71 -8.458 -3.428 -7.259 1294 HG2 GLU 71 2HG GLU 71 -7.284 -5.592 -7.373 1295 HG3 GLU 71 1HG GLU 71 -8.671 -6.350 -6.599 1296 H ILE 72 H ILE 72 -6.591 -2.179 -6.359 1297 HA ILE 72 HA ILE 72 -4.237 -3.673 -6.945 1298 HB ILE 72 HB ILE 72 -4.611 -0.665 -6.920 1299 HG12 ILE 72 2HG1 ILE 72 -4.853 -2.620 -9.222 1300 HG13 ILE 72 1HG1 ILE 72 -6.197 -1.800 -8.435 1301 HG21 ILE 72 1HG2 ILE 72 -2.515 -2.374 -8.279 1302 HG22 ILE 72 2HG2 ILE 72 -2.250 -1.336 -6.882 1303 HG23 ILE 72 3HG2 ILE 72 -2.676 -0.625 -8.441 1304 HD11 ILE 72 1HD1 ILE 72 -5.323 0.353 -9.195 1305 HD12 ILE 72 2HD1 ILE 72 -5.603 -0.735 -10.554 1306 HD13 ILE 72 3HD1 ILE 72 -3.968 -0.466 -9.961 1307 H MET 73 H MET 73 -5.136 -1.300 -4.476 1308 HA MET 73 HA MET 73 -2.594 -0.934 -3.378 1309 HB2 MET 73 2HB MET 73 -4.724 0.475 -3.070 1310 HB3 MET 73 1HB MET 73 -5.192 -0.695 -1.860 1311 HG2 MET 73 2HG MET 73 -2.706 1.008 -1.771 1312 HG3 MET 73 1HG MET 73 -4.197 1.343 -0.909 1313 HE1 MET 73 1HE MET 73 -1.337 1.268 0.436 1314 HE2 MET 73 2HE MET 73 -1.723 0.411 1.934 1315 HE3 MET 73 3HE MET 73 -2.853 1.598 1.267 1316 H GLU 74 H GLU 74 -5.211 -3.211 -2.447 1317 HA GLU 74 HA GLU 74 -3.803 -4.346 -0.280 1318 HB2 GLU 74 2HB GLU 74 -5.836 -5.679 -2.064 1319 HB3 GLU 74 1HB GLU 74 -5.260 -6.313 -0.535 1320 HG2 GLU 74 2HG GLU 74 -6.173 -4.296 0.564 1321 HG3 GLU 74 1HG GLU 74 -6.880 -3.830 -0.988 1322 H GLU 75 H GLU 75 -3.766 -5.001 -3.698 1323 HA GLU 75 HA GLU 75 -2.286 -7.412 -3.601 1324 HB2 GLU 75 2HB GLU 75 -3.589 -6.425 -5.584 1325 HB3 GLU 75 1HB GLU 75 -2.213 -5.373 -5.827 1326 HG2 GLU 75 2HG GLU 75 -2.074 -7.248 -7.326 1327 HG3 GLU 75 1HG GLU 75 -0.776 -7.349 -6.132 1328 H LEU 76 H LEU 76 -1.427 -3.988 -3.877 1329 HA LEU 76 HA LEU 76 1.366 -4.217 -4.126 1330 HB2 LEU 76 2HB LEU 76 -0.174 -2.052 -2.684 1331 HB3 LEU 76 1HB LEU 76 1.483 -1.940 -3.215 1332 HG LEU 76 HG LEU 76 -0.956 -2.071 -4.983 1333 HD11 LEU 76 1HD1 LEU 76 -0.340 0.218 -5.561 1334 HD12 LEU 76 2HD1 LEU 76 0.984 0.150 -4.402 1335 HD13 LEU 76 3HD1 LEU 76 -0.684 0.057 -3.837 1336 HD21 LEU 76 1HD2 LEU 76 0.937 -3.183 -6.035 1337 HD22 LEU 76 2HD2 LEU 76 1.954 -1.783 -5.708 1338 HD23 LEU 76 3HD2 LEU 76 0.592 -1.646 -6.824 1339 H THR 77 H THR 77 -0.713 -3.804 -1.226 1340 HA THR 77 HA THR 77 1.334 -3.798 0.615 1341 HB THR 77 HB THR 77 -1.529 -4.728 0.984 1342 HG1 THR 77 1HG THR 77 -1.677 -2.616 0.296 1343 HG21 THR 77 1HG2 THR 77 -1.198 -4.043 3.317 1344 HG22 THR 77 2HG2 THR 77 0.478 -3.621 2.969 1345 HG23 THR 77 3HG2 THR 77 -0.045 -5.302 2.878 1346 H LYS 78 H LYS 78 -0.583 -6.566 -0.621 1347 HA LYS 78 HA LYS 78 0.660 -8.416 1.117 1348 HB2 LYS 78 2HB LYS 78 -0.697 -8.963 -1.513 1349 HB3 LYS 78 1HB LYS 78 -0.175 -10.207 -0.386 1350 HG2 LYS 78 2HG LYS 78 -1.625 -9.174 1.297 1351 HG3 LYS 78 1HG LYS 78 -2.272 -8.107 0.076 1352 HD2 LYS 78 2HD LYS 78 -2.425 -11.141 0.127 1353 HD3 LYS 78 1HD LYS 78 -3.764 -10.020 0.350 1354 HE2 LYS 78 2HE LYS 78 -3.507 -9.270 -1.976 1355 HE3 LYS 78 1HE LYS 78 -2.152 -10.378 -2.180 1356 HZ1 LYS 78 1HZ LYS 78 -4.972 -11.120 -1.635 1357 HZ2 LYS 78 2HZ LYS 78 -3.704 -12.214 -1.629 1358 HZ3 LYS 78 3HZ LYS 78 -4.102 -11.403 -3.065 1359 H TYR 79 H TYR 79 1.334 -7.515 -2.189 1360 HA TYR 79 HA TYR 79 3.317 -9.457 -2.656 1361 HB2 TYR 79 2HB TYR 79 2.145 -8.180 -4.423 1362 HB3 TYR 79 1HB TYR 79 3.013 -6.741 -3.921 1363 HD1 TYR 79 1HD TYR 79 3.230 -9.932 -5.650 1364 HD2 TYR 79 2HD TYR 79 5.369 -6.460 -4.492 1365 HE1 TYR 79 1HE TYR 79 4.990 -10.497 -7.262 1366 HE2 TYR 79 2HE TYR 79 7.151 -7.006 -6.105 1367 HH TYR 79 HH TYR 79 6.726 -9.417 -8.490 1368 H TYR 80 H TYR 80 3.463 -6.260 -1.273 1369 HA TYR 80 HA TYR 80 6.206 -5.801 -1.296 1370 HB2 TYR 80 2HB TYR 80 4.407 -4.177 -0.659 1371 HB3 TYR 80 1HB TYR 80 4.243 -5.020 0.869 1372 HD1 TYR 80 1HD TYR 80 6.443 -2.936 -1.183 1373 HD2 TYR 80 2HD TYR 80 5.818 -4.600 2.676 1374 HE1 TYR 80 1HE TYR 80 8.164 -1.445 -0.273 1375 HE2 TYR 80 2HE TYR 80 7.545 -3.109 3.599 1376 HH TYR 80 HH TYR 80 8.771 -0.473 1.831 1377 H LEU 81 H LEU 81 4.200 -7.298 1.288 1378 HA LEU 81 HA LEU 81 6.483 -8.097 2.728 1379 HB2 LEU 81 2HB LEU 81 3.595 -8.792 2.968 1380 HB3 LEU 81 1HB LEU 81 4.799 -9.452 4.054 1381 HG LEU 81 HG LEU 81 3.705 -7.758 5.161 1382 HD11 LEU 81 1HD1 LEU 81 6.055 -7.698 5.602 1383 HD12 LEU 81 2HD1 LEU 81 5.416 -6.061 5.655 1384 HD13 LEU 81 3HD1 LEU 81 6.325 -6.603 4.244 1385 HD21 LEU 81 1HD2 LEU 81 2.612 -6.580 3.415 1386 HD22 LEU 81 2HD2 LEU 81 4.139 -5.924 2.827 1387 HD23 LEU 81 3HD2 LEU 81 3.498 -5.412 4.395 1388 H ALA 82 H ALA 82 4.625 -9.543 0.163 1389 HA ALA 82 HA ALA 82 5.141 -12.231 0.815 1390 HB1 ALA 82 1HB ALA 82 4.526 -11.114 -1.904 1391 HB2 ALA 82 2HB ALA 82 3.335 -11.549 -0.669 1392 HB3 ALA 82 3HB ALA 82 4.374 -12.793 -1.377 1393 H ASN 83 H ASN 83 6.799 -10.094 -1.533 1394 HA ASN 83 HA ASN 83 8.730 -12.160 -1.965 1395 HB2 ASN 83 2HB ASN 83 8.659 -9.288 -2.885 1396 HB3 ASN 83 1HB ASN 83 9.876 -10.465 -3.368 1397 HD21 ASN 83 1HD2 ASN 83 9.342 -10.401 -5.509 1398 HD22 ASN 83 2HD2 ASN 83 7.841 -11.004 -6.117 1399 H HIS 84 H HIS 84 8.189 -10.162 0.455 1400 HA HIS 84 HA HIS 84 10.932 -9.600 1.216 1401 HB2 HIS 84 2HB HIS 84 9.046 -8.001 1.671 1402 HB3 HIS 84 1HB HIS 84 8.316 -9.212 2.702 1403 HD1 HIS 84 1HD HIS 84 10.970 -6.612 2.598 1404 HD2 HIS 84 2HD HIS 84 9.486 -9.414 5.272 1405 HE1 HIS 84 1HE HIS 84 11.895 -5.969 4.835 1406 HE2 HIS 84 2HE HIS 84 11.054 -7.743 6.426 1407 H GLY 85 H GLY 85 9.007 -12.255 1.127 1408 HA2 GLY 85 2HA GLY 85 9.888 -14.356 1.852 1409 HA3 GLY 85 1HA GLY 85 10.552 -13.550 3.263 1410 H ILE 86 H ILE 86 7.445 -12.411 2.776 1411 HA ILE 86 HA ILE 86 6.441 -14.253 4.810 1412 HB ILE 86 HB ILE 86 5.541 -11.479 3.988 1413 HG12 ILE 86 2HG1 ILE 86 6.822 -12.489 6.543 1414 HG13 ILE 86 1HG1 ILE 86 7.604 -11.514 5.309 1415 HG21 ILE 86 1HG2 ILE 86 3.933 -11.587 5.841 1416 HG22 ILE 86 2HG2 ILE 86 4.359 -13.276 6.107 1417 HG23 ILE 86 3HG2 ILE 86 3.595 -12.787 4.598 1418 HD11 ILE 86 1HD1 ILE 86 6.988 -10.178 7.238 1419 HD12 ILE 86 2HD1 ILE 86 5.299 -10.662 7.044 1420 HD13 ILE 86 3HD1 ILE 86 6.080 -9.677 5.810 1421 H ASP 87 H ASP 87 4.558 -15.434 4.423 1422 HA ASP 87 HA ASP 87 3.617 -15.298 1.656 1423 HB2 ASP 87 2HB ASP 87 4.419 -17.502 2.369 1424 HB3 ASP 87 1HB ASP 87 3.258 -17.504 3.691 1425 H ILE 88 H ILE 88 1.750 -14.349 1.268 1426 HA ILE 88 HA ILE 88 -0.208 -14.101 3.469 1427 HB ILE 88 HB ILE 88 0.188 -12.051 1.236 1428 HG12 ILE 88 2HG1 ILE 88 1.071 -11.858 4.116 1429 HG13 ILE 88 1HG1 ILE 88 2.155 -12.158 2.759 1430 HG21 ILE 88 1HG2 ILE 88 -1.358 -11.956 3.816 1431 HG22 ILE 88 2HG2 ILE 88 -2.057 -12.119 2.204 1432 HG23 ILE 88 3HG2 ILE 88 -1.204 -10.640 2.658 1433 HD11 ILE 88 1HD1 ILE 88 2.054 -9.795 3.549 1434 HD12 ILE 88 2HD1 ILE 88 0.386 -9.750 2.890 1435 HD13 ILE 88 3HD1 ILE 88 1.741 -10.054 1.837 1436 H LYS 89 H LYS 89 -2.439 -14.217 2.813 1437 HA LYS 89 HA LYS 89 -2.755 -15.778 0.385 1438 HB2 LYS 89 2HB LYS 89 -4.597 -15.414 2.769 1439 HB3 LYS 89 1HB LYS 89 -5.017 -16.336 1.341 1440 HG2 LYS 89 2HG LYS 89 -4.345 -17.829 3.126 1441 HG3 LYS 89 1HG LYS 89 -3.172 -17.908 1.818 1442 HD2 LYS 89 2HD LYS 89 -1.701 -16.381 3.106 1443 HD3 LYS 89 1HD LYS 89 -2.878 -16.393 4.418 1444 HE2 LYS 89 2HE LYS 89 -1.456 -18.813 3.333 1445 HE3 LYS 89 1HE LYS 89 -0.986 -17.942 4.787 1446 HZ1 LYS 89 1HZ LYS 89 -3.593 -19.326 4.385 1447 HZ2 LYS 89 2HZ LYS 89 -3.115 -18.500 5.770 1448 HZ3 LYS 89 3HZ LYS 89 -2.304 -19.897 5.310 Start of MODEL 2 1 H1 MET 1 1HT MET 1 -9.964 3.961 29.704 2 H2 MET 1 2HT MET 1 -10.339 5.194 30.778 3 H3 MET 1 3HT MET 1 -11.556 4.154 30.234 4 HA MET 1 HA MET 1 -10.902 3.657 32.484 5 HB2 MET 1 2HB MET 1 -11.688 1.812 31.062 6 HB3 MET 1 1HB MET 1 -10.056 1.575 30.456 7 HG2 MET 1 2HG MET 1 -9.317 0.945 32.704 8 HG3 MET 1 1HG MET 1 -10.959 1.166 33.305 9 HE1 MET 1 1HE MET 1 -9.707 -2.119 30.289 10 HE2 MET 1 2HE MET 1 -8.592 -0.950 30.992 11 HE3 MET 1 3HE MET 1 -9.816 -0.418 29.838 12 H GLY 2 H GLY 2 -8.243 2.452 30.414 13 HA2 GLY 2 2HA GLY 2 -6.423 2.925 32.616 14 HA3 GLY 2 1HA GLY 2 -6.105 2.014 31.137 15 H PHE 3 H PHE 3 -6.520 5.183 32.478 16 HA PHE 3 HA PHE 3 -5.844 6.558 30.118 17 HB2 PHE 3 2HB PHE 3 -5.688 8.591 31.532 18 HB3 PHE 3 1HB PHE 3 -7.165 7.693 31.786 19 HD1 PHE 3 1HD PHE 3 -4.341 9.206 33.326 20 HD2 PHE 3 2HD PHE 3 -7.279 6.179 33.876 21 HE1 PHE 3 1HE PHE 3 -3.936 9.253 35.748 22 HE2 PHE 3 2HE PHE 3 -6.882 6.231 36.298 23 HZ PHE 3 HZ PHE 3 -5.207 7.765 37.236 24 H THR 4 H THR 4 -4.073 6.302 29.147 25 HA THR 4 HA THR 4 -1.628 6.520 30.680 26 HB THR 4 HB THR 4 -1.751 4.187 30.220 27 HG1 THR 4 1HG THR 4 -0.091 4.490 28.104 28 HG21 THR 4 1HG2 THR 4 -3.461 4.188 28.463 29 HG22 THR 4 2HG2 THR 4 -2.067 3.229 27.964 30 HG23 THR 4 3HG2 THR 4 -2.301 4.855 27.317 31 H ASP 5 H ASP 5 -1.492 8.680 30.152 32 HA ASP 5 HA ASP 5 -1.163 9.331 27.367 33 HB2 ASP 5 2HB ASP 5 -2.039 11.065 28.956 34 HB3 ASP 5 1HB ASP 5 -0.489 11.035 29.792 35 H GLU 6 H GLU 6 0.389 8.191 26.604 36 HA GLU 6 HA GLU 6 2.873 8.060 28.077 37 HB2 GLU 6 2HB GLU 6 3.330 6.059 26.644 38 HB3 GLU 6 1HB GLU 6 1.984 5.913 27.764 39 HG2 GLU 6 2HG GLU 6 0.445 6.436 25.889 40 HG3 GLU 6 1HG GLU 6 1.836 6.392 24.804 41 H THR 7 H THR 7 4.087 9.617 27.545 42 HA THR 7 HA THR 7 5.255 9.608 24.942 43 HB THR 7 HB THR 7 4.141 12.206 26.092 44 HG1 THR 7 1HG THR 7 2.995 10.329 24.585 45 HG21 THR 7 1HG2 THR 7 4.853 13.181 23.939 46 HG22 THR 7 2HG2 THR 7 5.512 11.620 23.454 47 HG23 THR 7 3HG2 THR 7 6.228 12.496 24.808 48 H VAL 8 H VAL 8 6.990 8.791 26.083 49 HA VAL 8 HA VAL 8 8.038 10.361 28.299 50 HB VAL 8 HB VAL 8 9.625 8.509 28.677 51 HG11 VAL 8 1HG1 VAL 8 7.472 8.409 29.776 52 HG12 VAL 8 2HG1 VAL 8 8.014 6.792 29.340 53 HG13 VAL 8 3HG1 VAL 8 6.773 7.592 28.378 54 HG21 VAL 8 1HG2 VAL 8 9.473 6.431 27.411 55 HG22 VAL 8 2HG2 VAL 8 9.892 7.770 26.332 56 HG23 VAL 8 3HG2 VAL 8 8.244 7.139 26.371 57 H ARG 9 H ARG 9 8.280 10.249 25.062 58 HA ARG 9 HA ARG 9 9.575 11.200 23.506 59 HB2 ARG 9 2HB ARG 9 10.781 12.692 25.849 60 HB3 ARG 9 1HB ARG 9 11.020 13.094 24.157 61 HG2 ARG 9 2HG ARG 9 8.585 13.468 23.942 62 HG3 ARG 9 1HG ARG 9 8.432 13.190 25.678 63 HD2 ARG 9 2HD ARG 9 8.527 15.576 25.205 64 HD3 ARG 9 1HD ARG 9 9.963 15.066 26.095 65 HE ARG 9 HE ARG 9 10.626 14.873 23.445 66 HH11 ARG 9 1HH1 ARG 9 9.546 17.493 25.532 67 HH12 ARG 9 2HH1 ARG 9 10.395 18.710 24.716 68 HH21 ARG 9 1HH2 ARG 9 11.798 16.522 22.288 69 HH22 ARG 9 2HH2 ARG 9 11.731 18.140 22.814 70 H PHE 10 H PHE 10 12.259 11.998 23.452 71 HA PHE 10 HA PHE 10 14.304 11.233 23.076 72 HB2 PHE 10 2HB PHE 10 13.679 9.189 25.236 73 HB3 PHE 10 1HB PHE 10 15.267 9.412 24.516 74 HD1 PHE 10 1HD PHE 10 12.914 10.577 26.982 75 HD2 PHE 10 2HD PHE 10 16.452 11.592 24.848 76 HE1 PHE 10 1HE PHE 10 13.427 12.297 28.659 77 HE2 PHE 10 2HE PHE 10 16.969 13.316 26.519 78 HZ PHE 10 HZ PHE 10 15.456 13.673 28.430 79 H ASP 11 H ASP 11 11.796 10.065 21.879 80 HA ASP 11 HA ASP 11 12.736 7.506 20.924 81 HB2 ASP 11 2HB ASP 11 10.273 9.096 20.116 82 HB3 ASP 11 1HB ASP 11 10.683 7.514 19.482 83 H PHE 12 H PHE 12 14.675 8.184 19.975 84 HA PHE 12 HA PHE 12 14.331 9.802 17.574 85 HB2 PHE 12 2HB PHE 12 16.898 9.005 18.974 86 HB3 PHE 12 1HB PHE 12 16.781 10.039 17.560 87 HD1 PHE 12 1HD PHE 12 16.811 9.896 21.113 88 HD2 PHE 12 2HD PHE 12 15.481 12.232 17.818 89 HE1 PHE 12 1HE PHE 12 16.607 11.844 22.588 90 HE2 PHE 12 2HE PHE 12 15.275 14.191 19.291 91 HZ PHE 12 HZ PHE 12 15.840 13.995 21.682 92 H ASP 13 H ASP 13 13.599 8.426 16.095 93 HA ASP 13 HA ASP 13 14.918 5.876 15.814 94 HB2 ASP 13 2HB ASP 13 12.467 5.952 15.605 95 HB3 ASP 13 1HB ASP 13 12.625 7.059 14.243 96 H ASP 14 H ASP 14 16.751 5.924 14.817 97 HA ASP 14 HA ASP 14 17.445 8.095 13.069 98 HB2 ASP 14 2HB ASP 14 19.028 6.990 14.695 99 HB3 ASP 14 1HB ASP 14 19.028 5.589 13.632 100 H ASN 15 H ASN 15 17.075 8.131 10.972 101 HA ASN 15 HA ASN 15 15.689 6.179 9.618 102 HB2 ASN 15 2HB ASN 15 17.308 8.459 8.490 103 HB3 ASN 15 1HB ASN 15 16.327 7.399 7.489 104 HD21 ASN 15 1HD2 ASN 15 16.063 10.249 7.899 105 HD22 ASN 15 2HD2 ASN 15 14.486 10.505 8.550 106 H ARG 16 H ARG 16 16.217 4.268 9.219 107 HA ARG 16 HA ARG 16 18.918 3.611 8.279 108 HB2 ARG 16 2HB ARG 16 18.353 1.296 8.843 109 HB3 ARG 16 1HB ARG 16 18.070 2.327 10.238 110 HG2 ARG 16 2HG ARG 16 15.647 2.333 9.664 111 HG3 ARG 16 1HG ARG 16 16.000 1.214 8.357 112 HD2 ARG 16 2HD ARG 16 16.512 0.698 11.285 113 HD3 ARG 16 1HD ARG 16 15.149 0.081 10.362 114 HE ARG 16 HE ARG 16 17.423 -0.747 9.035 115 HH11 ARG 16 1HH1 ARG 16 15.977 -1.232 12.231 116 HH12 ARG 16 2HH1 ARG 16 16.633 -2.780 12.444 117 HH21 ARG 16 1HH2 ARG 16 18.336 -2.890 9.340 118 HH22 ARG 16 2HH2 ARG 16 17.995 -3.743 10.774 119 H LYS 17 H LYS 17 18.960 2.044 6.460 120 HA LYS 17 HA LYS 17 17.061 2.814 4.447 121 HB2 LYS 17 2HB LYS 17 19.238 0.708 4.382 122 HB3 LYS 17 1HB LYS 17 18.362 1.319 2.982 123 HG2 LYS 17 2HG LYS 17 19.304 3.547 3.372 124 HG3 LYS 17 1HG LYS 17 20.175 2.919 4.770 125 HD2 LYS 17 2HD LYS 17 21.363 1.346 3.281 126 HD3 LYS 17 1HD LYS 17 20.523 2.061 1.907 127 HE2 LYS 17 2HE LYS 17 22.762 3.005 2.144 128 HE3 LYS 17 1HE LYS 17 21.524 4.231 2.394 129 HZ1 LYS 17 1HZ LYS 17 21.852 4.030 4.791 130 HZ2 LYS 17 2HZ LYS 17 23.297 4.386 4.030 131 HZ3 LYS 17 3HZ LYS 17 23.003 2.830 4.568 132 H LYS 18 H LYS 18 15.539 1.422 3.472 133 HA LYS 18 HA LYS 18 13.953 -0.182 3.368 134 HB2 LYS 18 2HB LYS 18 15.922 -1.822 4.979 135 HB3 LYS 18 1HB LYS 18 14.460 -2.469 4.246 136 HG2 LYS 18 2HG LYS 18 15.300 -1.887 2.035 137 HG3 LYS 18 1HG LYS 18 16.750 -1.199 2.763 138 HD2 LYS 18 2HD LYS 18 17.400 -3.355 3.618 139 HD3 LYS 18 1HD LYS 18 15.894 -4.076 3.053 140 HE2 LYS 18 2HE LYS 18 18.032 -2.851 1.310 141 HE3 LYS 18 1HE LYS 18 17.746 -4.577 1.536 142 HZ1 LYS 18 1HZ LYS 18 15.823 -2.650 0.314 143 HZ2 LYS 18 2HZ LYS 18 15.510 -4.254 0.615 144 HZ3 LYS 18 3HZ LYS 18 16.693 -3.838 -0.503 145 H ALA 19 H ALA 19 14.188 1.719 5.631 146 HA ALA 19 HA ALA 19 13.311 0.610 8.072 147 HB1 ALA 19 1HB ALA 19 14.324 2.815 7.827 148 HB2 ALA 19 2HB ALA 19 12.758 2.863 8.683 149 HB3 ALA 19 3HB ALA 19 12.848 3.317 6.981 150 H ILE 20 H ILE 20 11.592 1.983 5.348 151 HA ILE 20 HA ILE 20 9.044 1.945 6.565 152 HB ILE 20 HB ILE 20 9.798 1.934 3.622 153 HG12 ILE 20 2HG1 ILE 20 8.878 4.156 5.466 154 HG13 ILE 20 1HG1 ILE 20 10.517 3.923 4.879 155 HG21 ILE 20 1HG2 ILE 20 7.083 2.410 4.836 156 HG22 ILE 20 2HG2 ILE 20 7.560 1.000 3.891 157 HG23 ILE 20 3HG2 ILE 20 7.518 2.593 3.134 158 HD11 ILE 20 1HD1 ILE 20 9.398 5.702 3.669 159 HD12 ILE 20 2HD1 ILE 20 8.101 4.600 3.210 160 HD13 ILE 20 3HD1 ILE 20 9.729 4.349 2.588 161 H SER 21 H SER 21 10.869 -0.372 4.809 162 HA SER 21 HA SER 21 8.751 -2.292 4.536 163 HB2 SER 21 2HB SER 21 10.712 -2.335 3.036 164 HB3 SER 21 1HB SER 21 11.755 -2.710 4.404 165 HG SER 21 HG SER 21 11.307 -4.649 4.140 166 H GLU 22 H GLU 22 11.428 -1.805 6.755 167 HA GLU 22 HA GLU 22 11.183 -3.959 8.488 168 HB2 GLU 22 2HB GLU 22 12.960 -2.154 8.408 169 HB3 GLU 22 1HB GLU 22 11.817 -1.086 9.198 170 HG2 GLU 22 2HG GLU 22 13.356 -1.925 10.821 171 HG3 GLU 22 1HG GLU 22 11.772 -2.647 11.119 172 H THR 23 H THR 23 9.625 -0.809 8.450 173 HA THR 23 HA THR 23 8.067 -0.989 10.763 174 HB THR 23 HB THR 23 7.537 0.564 8.217 175 HG1 THR 23 1HG THR 23 9.557 1.045 9.194 176 HG21 THR 23 1HG2 THR 23 5.538 0.460 9.635 177 HG22 THR 23 2HG2 THR 23 6.232 2.082 9.667 178 HG23 THR 23 3HG2 THR 23 6.485 0.986 11.026 179 H LEU 24 H LEU 24 7.168 -1.624 7.347 180 HA LEU 24 HA LEU 24 4.496 -2.328 7.884 181 HB2 LEU 24 2HB LEU 24 6.237 -3.100 5.555 182 HB3 LEU 24 1HB LEU 24 4.501 -3.307 5.621 183 HG LEU 24 HG LEU 24 5.956 -0.665 5.679 184 HD11 LEU 24 1HD1 LEU 24 4.334 -1.993 3.526 185 HD12 LEU 24 2HD1 LEU 24 6.079 -1.743 3.515 186 HD13 LEU 24 3HD1 LEU 24 4.988 -0.356 3.460 187 HD21 LEU 24 1HD2 LEU 24 3.873 -0.559 6.953 188 HD22 LEU 24 2HD2 LEU 24 2.998 -1.289 5.602 189 HD23 LEU 24 3HD2 LEU 24 3.717 0.314 5.433 190 H GLU 25 H GLU 25 7.403 -4.274 7.676 191 HA GLU 25 HA GLU 25 6.159 -6.789 7.789 192 HB2 GLU 25 2HB GLU 25 8.510 -6.412 7.135 193 HB3 GLU 25 1HB GLU 25 8.887 -5.937 8.783 194 HG2 GLU 25 2HG GLU 25 8.382 -8.161 9.562 195 HG3 GLU 25 1HG GLU 25 7.913 -8.648 7.934 196 H THR 26 H THR 26 7.266 -4.556 10.260 197 HA THR 26 HA THR 26 6.721 -6.140 12.523 198 HB THR 26 HB THR 26 6.743 -3.123 12.226 199 HG1 THR 26 1HG THR 26 8.757 -3.956 11.655 200 HG21 THR 26 1HG2 THR 26 7.182 -3.079 14.635 201 HG22 THR 26 2HG2 THR 26 7.065 -4.842 14.695 202 HG23 THR 26 3HG2 THR 26 5.648 -3.883 14.289 203 H VAL 27 H VAL 27 4.819 -3.772 10.706 204 HA VAL 27 HA VAL 27 2.566 -3.713 12.374 205 HB VAL 27 HB VAL 27 2.718 -3.180 9.382 206 HG11 VAL 27 1HG1 VAL 27 0.411 -3.601 10.101 207 HG12 VAL 27 2HG1 VAL 27 0.650 -1.899 9.689 208 HG13 VAL 27 3HG1 VAL 27 0.602 -2.399 11.377 209 HG21 VAL 27 1HG2 VAL 27 2.815 -1.281 11.725 210 HG22 VAL 27 2HG2 VAL 27 2.813 -0.822 10.023 211 HG23 VAL 27 3HG2 VAL 27 4.173 -1.723 10.689 212 H TYR 28 H TYR 28 3.420 -5.820 9.679 213 HA TYR 28 HA TYR 28 0.984 -7.199 9.439 214 HB2 TYR 28 2HB TYR 28 2.909 -7.446 7.817 215 HB3 TYR 28 1HB TYR 28 3.773 -8.373 9.033 216 HD1 TYR 28 1HD TYR 28 2.570 -10.557 9.878 217 HD2 TYR 28 2HD TYR 28 1.547 -8.580 6.248 218 HE1 TYR 28 1HE TYR 28 1.498 -12.610 9.071 219 HE2 TYR 28 2HE TYR 28 0.460 -10.648 5.433 220 HH TYR 28 HH TYR 28 0.693 -13.227 5.956 221 H ARG 29 H ARG 29 3.850 -7.901 11.359 222 HA ARG 29 HA ARG 29 2.995 -10.222 12.651 223 HB2 ARG 29 2HB ARG 29 4.869 -8.066 13.625 224 HB3 ARG 29 1HB ARG 29 4.715 -9.670 14.325 225 HG2 ARG 29 2HG ARG 29 5.481 -9.272 11.447 226 HG3 ARG 29 1HG ARG 29 6.671 -9.212 12.733 227 HD2 ARG 29 2HD ARG 29 6.588 -11.420 11.669 228 HD3 ARG 29 1HD ARG 29 6.159 -11.493 13.361 229 HE ARG 29 HE ARG 29 3.838 -11.759 12.669 230 HH11 ARG 29 1HH1 ARG 29 6.254 -12.271 10.105 231 HH12 ARG 29 2HH1 ARG 29 5.363 -13.484 9.310 232 HH21 ARG 29 1HH2 ARG 29 2.637 -13.438 11.567 233 HH22 ARG 29 2HH2 ARG 29 3.251 -14.156 10.153 234 H ALA 30 H ALA 30 2.796 -6.847 13.702 235 HA ALA 30 HA ALA 30 1.641 -7.251 16.213 236 HB1 ALA 30 1HB ALA 30 2.562 -5.096 15.480 237 HB2 ALA 30 2HB ALA 30 0.924 -4.921 16.108 238 HB3 ALA 30 3HB ALA 30 1.209 -4.904 14.369 239 H LEU 31 H LEU 31 0.094 -6.852 13.077 240 HA LEU 31 HA LEU 31 -2.535 -6.902 14.140 241 HB2 LEU 31 2HB LEU 31 -1.519 -7.217 11.336 242 HB3 LEU 31 1HB LEU 31 -3.223 -7.199 11.743 243 HG LEU 31 HG LEU 31 -1.356 -4.988 12.448 244 HD11 LEU 31 1HD1 LEU 31 -3.248 -5.194 10.114 245 HD12 LEU 31 2HD1 LEU 31 -1.473 -5.200 9.999 246 HD13 LEU 31 3HD1 LEU 31 -2.323 -3.755 10.542 247 HD21 LEU 31 1HD2 LEU 31 -3.430 -3.691 12.645 248 HD22 LEU 31 2HD2 LEU 31 -3.343 -5.026 13.788 249 HD23 LEU 31 3HD2 LEU 31 -4.345 -5.159 12.339 250 H GLU 32 H GLU 32 -0.443 -9.419 12.803 251 HA GLU 32 HA GLU 32 -2.635 -11.190 12.895 252 HB2 GLU 32 2HB GLU 32 -1.014 -13.027 12.446 253 HB3 GLU 32 1HB GLU 32 -1.158 -11.793 11.196 254 HG2 GLU 32 2HG GLU 32 1.110 -12.368 11.298 255 HG3 GLU 32 1HG GLU 32 0.996 -10.860 12.184 256 H GLU 33 H GLU 33 -0.186 -10.463 15.133 257 HA GLU 33 HA GLU 33 -0.877 -12.540 16.964 258 HB2 GLU 33 2HB GLU 33 0.337 -9.833 17.583 259 HB3 GLU 33 1HB GLU 33 0.192 -11.151 18.738 260 HG2 GLU 33 2HG GLU 33 1.595 -12.535 17.233 261 HG3 GLU 33 1HG GLU 33 1.829 -11.111 16.225 262 H LYS 34 H LYS 34 -2.293 -9.492 16.239 263 HA LYS 34 HA LYS 34 -4.096 -9.533 18.517 264 HB2 LYS 34 2HB LYS 34 -3.801 -7.696 16.164 265 HB3 LYS 34 1HB LYS 34 -5.113 -7.522 17.308 266 HG2 LYS 34 2HG LYS 34 -2.189 -7.428 18.038 267 HG3 LYS 34 1HG LYS 34 -3.178 -6.009 17.705 268 HD2 LYS 34 2HD LYS 34 -3.688 -8.029 19.901 269 HD3 LYS 34 1HD LYS 34 -2.955 -6.444 20.119 270 HE2 LYS 34 2HE LYS 34 -5.009 -5.396 19.247 271 HE3 LYS 34 1HE LYS 34 -5.750 -6.989 19.114 272 HZ1 LYS 34 1HZ LYS 34 -5.439 -7.205 21.568 273 HZ2 LYS 34 2HZ LYS 34 -6.447 -5.918 21.138 274 HZ3 LYS 34 3HZ LYS 34 -4.867 -5.634 21.593 275 H GLY 35 H GLY 35 -4.044 -10.983 15.515 276 HA2 GLY 35 2HA GLY 35 -5.631 -12.494 14.708 277 HA3 GLY 35 1HA GLY 35 -6.778 -11.868 15.881 278 H TYR 36 H TYR 36 -5.104 -9.627 13.842 279 HA TYR 36 HA TYR 36 -7.621 -9.167 12.400 280 HB2 TYR 36 2HB TYR 36 -5.210 -7.355 12.676 281 HB3 TYR 36 1HB TYR 36 -6.655 -6.979 11.753 282 HD1 TYR 36 1HD TYR 36 -5.013 -6.250 14.637 283 HD2 TYR 36 2HD TYR 36 -8.876 -7.406 13.304 284 HE1 TYR 36 1HE TYR 36 -6.014 -5.258 16.666 285 HE2 TYR 36 2HE TYR 36 -9.883 -6.424 15.304 286 HH TYR 36 HH TYR 36 -9.209 -5.887 17.568 287 H ASN 37 H ASN 37 -7.311 -8.475 10.130 288 HA ASN 37 HA ASN 37 -5.311 -10.151 8.847 289 HB2 ASN 37 2HB ASN 37 -7.625 -10.271 7.986 290 HB3 ASN 37 1HB ASN 37 -7.589 -8.542 7.652 291 HD21 ASN 37 1HD2 ASN 37 -6.481 -11.680 6.648 292 HD22 ASN 37 2HD2 ASN 37 -5.847 -11.165 5.133 293 HA PRO 38 HA PRO 38 -2.560 -6.543 9.008 294 HB2 PRO 38 2HB PRO 38 -1.362 -8.342 6.965 295 HB3 PRO 38 1HB PRO 38 -0.568 -7.391 8.222 296 HG2 PRO 38 2HG PRO 38 -0.982 -9.989 8.569 297 HG3 PRO 38 1HG PRO 38 -1.200 -8.854 9.910 298 HD2 PRO 38 2HD PRO 38 -3.244 -10.336 8.363 299 HD3 PRO 38 1HD PRO 38 -3.272 -9.653 10.014 300 H ILE 39 H ILE 39 -3.647 -8.066 6.014 301 HA ILE 39 HA ILE 39 -2.694 -5.972 4.366 302 HB ILE 39 HB ILE 39 -4.755 -8.084 3.725 303 HG12 ILE 39 2HG1 ILE 39 -2.718 -9.126 4.508 304 HG13 ILE 39 1HG1 ILE 39 -2.833 -9.336 2.768 305 HG21 ILE 39 1HG2 ILE 39 -4.094 -7.705 1.388 306 HG22 ILE 39 2HG2 ILE 39 -3.021 -6.404 1.908 307 HG23 ILE 39 3HG2 ILE 39 -4.763 -6.244 2.120 308 HD11 ILE 39 1HD1 ILE 39 -1.206 -7.513 2.461 309 HD12 ILE 39 2HD1 ILE 39 -0.559 -8.820 3.459 310 HD13 ILE 39 3HD1 ILE 39 -1.104 -7.330 4.213 311 H ASN 40 H ASN 40 -5.907 -6.844 5.560 312 HA ASN 40 HA ASN 40 -7.260 -4.755 4.198 313 HB2 ASN 40 2HB ASN 40 -8.093 -6.363 6.614 314 HB3 ASN 40 1HB ASN 40 -9.110 -5.115 5.915 315 HD21 ASN 40 1HD2 ASN 40 -7.102 -7.275 3.971 316 HD22 ASN 40 2HD2 ASN 40 -8.404 -8.152 3.286 317 H GLN 41 H GLN 41 -5.810 -4.911 7.372 318 HA GLN 41 HA GLN 41 -6.821 -2.378 8.145 319 HB2 GLN 41 2HB GLN 41 -4.517 -3.957 9.270 320 HB3 GLN 41 1HB GLN 41 -5.225 -2.539 10.032 321 HG2 GLN 41 2HG GLN 41 -6.654 -5.146 9.492 322 HG3 GLN 41 1HG GLN 41 -6.031 -4.623 11.052 323 HE21 GLN 41 1HE2 GLN 41 -6.860 -1.858 10.680 324 HE22 GLN 41 2HE2 GLN 41 -8.579 -1.824 10.854 325 H ILE 42 H ILE 42 -3.827 -3.442 6.583 326 HA ILE 42 HA ILE 42 -2.629 -0.872 6.755 327 HB ILE 42 HB ILE 42 -1.906 -3.243 4.996 328 HG12 ILE 42 2HG1 ILE 42 -0.581 -2.096 7.474 329 HG13 ILE 42 1HG1 ILE 42 -1.562 -3.552 7.416 330 HG21 ILE 42 1HG2 ILE 42 -0.384 -0.647 5.347 331 HG22 ILE 42 2HG2 ILE 42 -1.176 -1.193 3.877 332 HG23 ILE 42 3HG2 ILE 42 0.214 -2.078 4.505 333 HD11 ILE 42 1HD1 ILE 42 0.100 -4.605 5.962 334 HD12 ILE 42 2HD1 ILE 42 0.812 -4.076 7.487 335 HD13 ILE 42 3HD1 ILE 42 1.071 -3.135 6.018 336 H VAL 43 H VAL 43 -4.324 -2.547 4.076 337 HA VAL 43 HA VAL 43 -4.079 -0.395 2.289 338 HB VAL 43 HB VAL 43 -4.777 -2.553 1.360 339 HG11 VAL 43 1HG1 VAL 43 -6.068 -3.391 3.251 340 HG12 VAL 43 2HG1 VAL 43 -7.016 -3.497 1.767 341 HG13 VAL 43 3HG1 VAL 43 -7.338 -2.212 2.932 342 HG21 VAL 43 1HG2 VAL 43 -7.025 -0.565 1.065 343 HG22 VAL 43 2HG2 VAL 43 -6.688 -1.910 -0.023 344 HG23 VAL 43 3HG2 VAL 43 -5.529 -0.591 0.136 345 H GLY 44 H GLY 44 -6.495 -1.052 4.755 346 HA2 GLY 44 2HA GLY 44 -8.177 1.140 4.165 347 HA3 GLY 44 1HA GLY 44 -8.072 0.307 5.713 348 H TYR 45 H TYR 45 -5.302 0.779 6.163 349 HA TYR 45 HA TYR 45 -5.456 3.265 7.432 350 HB2 TYR 45 2HB TYR 45 -4.015 1.619 8.410 351 HB3 TYR 45 1HB TYR 45 -3.062 1.496 6.932 352 HD1 TYR 45 1HD TYR 45 -1.226 2.924 6.556 353 HD2 TYR 45 2HD TYR 45 -3.919 3.836 9.722 354 HE1 TYR 45 1HE TYR 45 0.269 4.679 7.319 355 HE2 TYR 45 2HE TYR 45 -2.402 5.592 10.487 356 HH TYR 45 HH TYR 45 0.239 5.954 10.211 357 H LEU 46 H LEU 46 -3.501 2.363 4.559 358 HA LEU 46 HA LEU 46 -2.560 5.027 4.411 359 HB2 LEU 46 2HB LEU 46 -2.358 2.882 2.310 360 HB3 LEU 46 1HB LEU 46 -1.709 4.492 2.087 361 HG LEU 46 HG LEU 46 -0.327 4.006 4.220 362 HD11 LEU 46 1HD1 LEU 46 0.181 1.732 4.713 363 HD12 LEU 46 2HD1 LEU 46 -0.943 1.197 3.475 364 HD13 LEU 46 3HD1 LEU 46 -1.559 2.011 4.904 365 HD21 LEU 46 1HD2 LEU 46 0.651 4.209 2.015 366 HD22 LEU 46 2HD2 LEU 46 0.246 2.528 1.664 367 HD23 LEU 46 3HD2 LEU 46 1.423 2.907 2.921 368 H LEU 47 H LEU 47 -5.285 3.510 2.898 369 HA LEU 47 HA LEU 47 -5.690 5.707 1.126 370 HB2 LEU 47 2HB LEU 47 -7.629 3.560 1.980 371 HB3 LEU 47 1HB LEU 47 -7.886 4.689 0.670 372 HG LEU 47 HG LEU 47 -5.806 2.508 0.785 373 HD11 LEU 47 1HD1 LEU 47 -7.043 1.559 -1.085 374 HD12 LEU 47 2HD1 LEU 47 -8.243 2.847 -0.948 375 HD13 LEU 47 3HD1 LEU 47 -8.037 1.684 0.365 376 HD21 LEU 47 1HD2 LEU 47 -5.250 3.148 -1.524 377 HD22 LEU 47 2HD2 LEU 47 -4.881 4.429 -0.379 378 HD23 LEU 47 3HD2 LEU 47 -6.323 4.541 -1.391 379 H SER 48 H SER 48 -6.555 5.110 4.429 380 HA SER 48 HA SER 48 -8.472 7.333 4.332 381 HB2 SER 48 2HB SER 48 -7.975 5.387 6.589 382 HB3 SER 48 1HB SER 48 -9.296 6.555 6.460 383 HG SER 48 HG SER 48 -8.813 4.207 5.037 384 H GLY 49 H GLY 49 -5.297 6.498 5.557 385 HA2 GLY 49 2HA GLY 49 -3.713 7.705 6.550 386 HA3 GLY 49 1HA GLY 49 -4.647 9.154 6.194 387 H ASP 50 H ASP 50 -5.475 6.362 8.326 388 HA ASP 50 HA ASP 50 -5.329 8.268 10.547 389 HB2 ASP 50 2HB ASP 50 -7.663 8.055 9.672 390 HB3 ASP 50 1HB ASP 50 -7.641 6.386 10.215 391 HA PRO 51 HA PRO 51 -2.986 5.063 12.490 392 HB2 PRO 51 2HB PRO 51 -3.337 5.876 15.089 393 HB3 PRO 51 1HB PRO 51 -2.165 6.570 13.963 394 HG2 PRO 51 2HG PRO 51 -4.902 7.550 14.683 395 HG3 PRO 51 1HG PRO 51 -3.403 8.480 14.496 396 HD2 PRO 51 2HD PRO 51 -5.243 8.451 12.590 397 HD3 PRO 51 1HD PRO 51 -3.515 8.414 12.172 398 H ALA 52 H ALA 52 -6.359 5.585 13.354 399 HA ALA 52 HA ALA 52 -6.654 3.619 15.322 400 HB1 ALA 52 1HB ALA 52 -8.727 4.540 13.359 401 HB2 ALA 52 2HB ALA 52 -8.309 5.345 14.876 402 HB3 ALA 52 3HB ALA 52 -9.017 3.730 14.896 403 H TYR 53 H TYR 53 -6.093 3.148 12.027 404 HA TYR 53 HA TYR 53 -7.420 0.673 11.754 405 HB2 TYR 53 2HB TYR 53 -5.332 2.056 10.143 406 HB3 TYR 53 1HB TYR 53 -5.780 0.381 9.783 407 HD1 TYR 53 1HD TYR 53 -7.879 -0.177 8.924 408 HD2 TYR 53 2HD TYR 53 -7.003 3.841 9.936 409 HE1 TYR 53 1HE TYR 53 -9.884 0.507 7.798 410 HE2 TYR 53 2HE TYR 53 -9.021 4.582 8.789 411 HH TYR 53 HH TYR 53 -10.584 3.868 7.196 412 H ILE 54 H ILE 54 -4.493 1.606 13.289 413 HA ILE 54 HA ILE 54 -3.657 -1.194 13.427 414 HB ILE 54 HB ILE 54 -1.899 1.282 13.732 415 HG12 ILE 54 2HG1 ILE 54 -2.547 1.030 11.390 416 HG13 ILE 54 1HG1 ILE 54 -0.865 0.561 11.600 417 HG21 ILE 54 1HG2 ILE 54 -0.010 -0.263 13.722 418 HG22 ILE 54 2HG2 ILE 54 -1.120 -1.625 13.662 419 HG23 ILE 54 3HG2 ILE 54 -1.092 -0.574 15.081 420 HD11 ILE 54 1HD1 ILE 54 -3.196 -1.321 11.322 421 HD12 ILE 54 2HD1 ILE 54 -1.511 -1.788 11.551 422 HD13 ILE 54 3HD1 ILE 54 -1.999 -0.938 10.083 423 HA PRO 55 HA PRO 55 -4.805 -0.791 17.715 424 HB2 PRO 55 2HB PRO 55 -3.468 -2.995 18.636 425 HB3 PRO 55 1HB PRO 55 -5.024 -3.076 17.804 426 HG2 PRO 55 2HG PRO 55 -2.274 -3.523 16.731 427 HG3 PRO 55 1HG PRO 55 -3.763 -4.433 16.411 428 HD2 PRO 55 2HD PRO 55 -2.801 -2.643 14.677 429 HD3 PRO 55 1HD PRO 55 -4.542 -2.881 14.905 430 H ARG 56 H ARG 56 -3.905 -0.119 19.602 431 HA ARG 56 HA ARG 56 -1.208 0.944 19.455 432 HB2 ARG 56 2HB ARG 56 -3.325 1.185 21.606 433 HB3 ARG 56 1HB ARG 56 -1.790 2.039 21.621 434 HG2 ARG 56 2HG ARG 56 -2.397 3.204 19.571 435 HG3 ARG 56 1HG ARG 56 -3.932 2.329 19.520 436 HD2 ARG 56 2HD ARG 56 -4.534 3.336 21.675 437 HD3 ARG 56 1HD ARG 56 -3.013 4.226 21.672 438 HE ARG 56 HE ARG 56 -4.217 4.900 19.318 439 HH11 ARG 56 1HH1 ARG 56 -5.103 5.106 22.752 440 HH12 ARG 56 2HH1 ARG 56 -6.132 6.446 22.570 441 HH21 ARG 56 1HH2 ARG 56 -5.629 6.785 19.056 442 HH22 ARG 56 2HH2 ARG 56 -6.463 7.421 20.389 443 H TYR 57 H TYR 57 -2.111 -1.909 19.871 444 HA TYR 57 HA TYR 57 -1.259 -3.110 22.207 445 HB2 TYR 57 2HB TYR 57 -2.413 -4.371 20.569 446 HB3 TYR 57 1HB TYR 57 -1.236 -3.984 19.333 447 HD1 TYR 57 1HD TYR 57 -1.659 -5.893 22.510 448 HD2 TYR 57 2HD TYR 57 0.494 -5.468 18.870 449 HE1 TYR 57 1HE TYR 57 -0.540 -8.055 22.912 450 HE2 TYR 57 2HE TYR 57 1.618 -7.602 19.260 451 HH TYR 57 HH TYR 57 2.152 -9.075 21.115 452 H GLN 58 H GLN 58 0.665 -2.010 19.449 453 HA GLN 58 HA GLN 58 3.072 -2.652 20.977 454 HB2 GLN 58 2HB GLN 58 2.466 -4.447 19.187 455 HB3 GLN 58 1HB GLN 58 2.837 -3.171 18.029 456 HG2 GLN 58 2HG GLN 58 5.093 -2.993 19.006 457 HG3 GLN 58 1HG GLN 58 4.682 -4.379 20.025 458 HE21 GLN 58 1HE2 GLN 58 6.695 -3.963 17.999 459 HE22 GLN 58 2HE2 GLN 58 6.498 -5.250 16.867 460 H ASP 59 H ASP 59 4.948 -1.553 19.955 461 HA ASP 59 HA ASP 59 4.656 1.151 19.492 462 HB2 ASP 59 2HB ASP 59 7.029 1.080 18.793 463 HB3 ASP 59 1HB ASP 59 6.744 0.191 20.280 464 H ALA 60 H ALA 60 4.068 -1.391 17.355 465 HA ALA 60 HA ALA 60 4.795 -0.430 14.845 466 HB1 ALA 60 1HB ALA 60 3.935 -2.698 15.256 467 HB2 ALA 60 2HB ALA 60 3.095 -1.903 13.926 468 HB3 ALA 60 3HB ALA 60 2.326 -2.031 15.508 469 H ARG 61 H ARG 61 1.989 0.407 16.804 470 HA ARG 61 HA ARG 61 0.588 1.890 14.845 471 HB2 ARG 61 2HB ARG 61 -0.363 1.027 17.018 472 HB3 ARG 61 1HB ARG 61 0.591 2.216 17.870 473 HG2 ARG 61 2HG ARG 61 -1.580 2.928 15.883 474 HG3 ARG 61 1HG ARG 61 -1.871 2.735 17.602 475 HD2 ARG 61 2HD ARG 61 -0.039 4.764 16.303 476 HD3 ARG 61 1HD ARG 61 -1.632 5.096 16.975 477 HE ARG 61 HE ARG 61 0.053 3.920 18.921 478 HH11 ARG 61 1HH1 ARG 61 -0.581 7.028 17.335 479 HH12 ARG 61 2HH1 ARG 61 0.164 7.950 18.546 480 HH21 ARG 61 1HH2 ARG 61 1.022 5.207 20.602 481 HH22 ARG 61 2HH2 ARG 61 1.072 6.897 20.471 482 H ASN 62 H ASN 62 3.090 2.657 17.160 483 HA ASN 62 HA ASN 62 3.141 5.466 16.723 484 HB2 ASN 62 2HB ASN 62 5.345 3.673 17.810 485 HB3 ASN 62 1HB ASN 62 5.271 5.419 17.956 486 HD21 ASN 62 1HD2 ASN 62 5.335 5.393 20.198 487 HD22 ASN 62 2HD2 ASN 62 4.020 4.830 21.155 488 H LEU 63 H LEU 63 4.939 2.704 15.546 489 HA LEU 63 HA LEU 63 6.892 3.974 13.983 490 HB2 LEU 63 2HB LEU 63 5.576 1.304 13.498 491 HB3 LEU 63 1HB LEU 63 7.055 1.869 12.756 492 HG LEU 63 HG LEU 63 6.681 1.310 15.690 493 HD11 LEU 63 1HD1 LEU 63 8.149 -0.241 13.552 494 HD12 LEU 63 2HD1 LEU 63 6.648 -0.729 14.343 495 HD13 LEU 63 3HD1 LEU 63 8.119 -0.605 15.281 496 HD21 LEU 63 1HD2 LEU 63 9.142 2.040 14.106 497 HD22 LEU 63 2HD2 LEU 63 9.091 1.575 15.808 498 HD23 LEU 63 3HD2 LEU 63 8.325 3.073 15.280 499 H ILE 64 H ILE 64 3.695 2.736 13.060 500 HA ILE 64 HA ILE 64 4.061 3.429 10.339 501 HB ILE 64 HB ILE 64 2.564 1.575 11.224 502 HG12 ILE 64 2HG1 ILE 64 1.203 3.523 9.354 503 HG13 ILE 64 1HG1 ILE 64 2.473 2.404 8.874 504 HG21 ILE 64 1HG2 ILE 64 0.699 3.876 11.801 505 HG22 ILE 64 2HG2 ILE 64 1.437 2.808 12.991 506 HG23 ILE 64 3HG2 ILE 64 0.253 2.173 11.849 507 HD11 ILE 64 1HD1 ILE 64 1.018 0.520 9.489 508 HD12 ILE 64 2HD1 ILE 64 0.291 1.559 8.262 509 HD13 ILE 64 3HD1 ILE 64 -0.249 1.666 9.934 510 H ARG 65 H ARG 65 3.145 5.239 13.074 511 HA ARG 65 HA ARG 65 1.971 7.348 11.440 512 HB2 ARG 65 2HB ARG 65 2.192 7.032 14.423 513 HB3 ARG 65 1HB ARG 65 1.639 8.520 13.662 514 HG2 ARG 65 2HG ARG 65 0.363 5.811 13.361 515 HG3 ARG 65 1HG ARG 65 -0.218 7.119 14.390 516 HD2 ARG 65 2HD ARG 65 0.048 7.249 11.370 517 HD3 ARG 65 1HD ARG 65 -1.454 7.042 12.235 518 HE ARG 65 HE ARG 65 -0.280 9.325 13.229 519 HH11 ARG 65 1HH1 ARG 65 -1.551 8.243 10.082 520 HH12 ARG 65 2HH1 ARG 65 -1.966 9.840 9.606 521 HH21 ARG 65 1HH2 ARG 65 -0.885 11.478 12.484 522 HH22 ARG 65 2HH2 ARG 65 -1.581 11.655 10.949 523 H ARG 66 H ARG 66 4.933 6.362 12.284 524 HA ARG 66 HA ARG 66 6.115 8.994 12.727 525 HB2 ARG 66 2HB ARG 66 6.808 7.082 14.142 526 HB3 ARG 66 1HB ARG 66 7.326 6.216 12.710 527 HG2 ARG 66 2HG ARG 66 9.075 7.852 12.337 528 HG3 ARG 66 1HG ARG 66 8.523 8.776 13.736 529 HD2 ARG 66 2HD ARG 66 9.526 5.935 13.798 530 HD3 ARG 66 1HD ARG 66 10.461 7.355 14.262 531 HE ARG 66 HE ARG 66 8.260 7.548 15.794 532 HH11 ARG 66 1HH1 ARG 66 10.563 4.908 15.281 533 HH12 ARG 66 2HH1 ARG 66 10.436 4.272 16.856 534 HH21 ARG 66 1HH2 ARG 66 8.078 6.678 17.981 535 HH22 ARG 66 2HH2 ARG 66 8.999 5.319 18.431 536 H HIS 67 H HIS 67 5.097 7.241 10.201 537 HA HIS 67 HA HIS 67 7.017 8.459 8.368 538 HB2 HIS 67 2HB HIS 67 5.884 5.649 8.158 539 HB3 HIS 67 1HB HIS 67 6.744 6.462 6.858 540 HD1 HIS 67 1HD HIS 67 9.296 6.452 6.976 541 HD2 HIS 67 2HD HIS 67 7.517 4.800 10.343 542 HE1 HIS 67 1HE HIS 67 11.129 5.297 8.189 543 HE2 HIS 67 2HE HIS 67 10.096 4.574 10.353 544 H GLU 68 H GLU 68 6.028 9.103 6.347 545 HA GLU 68 HA GLU 68 3.206 9.598 6.677 546 HB2 GLU 68 2HB GLU 68 5.116 10.446 4.497 547 HB3 GLU 68 1HB GLU 68 3.467 11.024 4.669 548 HG2 GLU 68 2HG GLU 68 5.732 11.486 6.609 549 HG3 GLU 68 1HG GLU 68 5.072 12.660 5.479 550 H ARG 69 H ARG 69 1.606 8.867 5.304 551 HA ARG 69 HA ARG 69 1.956 6.234 4.377 552 HB2 ARG 69 2HB ARG 69 -0.438 8.077 3.922 553 HB3 ARG 69 1HB ARG 69 -0.389 6.373 3.522 554 HG2 ARG 69 2HG ARG 69 -1.144 5.973 5.552 555 HG3 ARG 69 1HG ARG 69 0.433 6.468 6.139 556 HD2 ARG 69 2HD ARG 69 -1.980 8.230 5.793 557 HD3 ARG 69 1HD ARG 69 -1.327 7.650 7.326 558 HE ARG 69 HE ARG 69 -0.372 9.771 5.628 559 HH11 ARG 69 1HH1 ARG 69 0.502 7.700 8.450 560 HH12 ARG 69 2HH1 ARG 69 1.533 8.900 9.069 561 HH21 ARG 69 1HH2 ARG 69 1.024 11.288 6.570 562 HH22 ARG 69 2HH2 ARG 69 1.858 10.949 8.012 563 H ASP 70 H ASP 70 1.991 9.274 2.730 564 HA ASP 70 HA ASP 70 1.946 8.167 0.138 565 HB2 ASP 70 2HB ASP 70 2.879 10.376 -0.614 566 HB3 ASP 70 1HB ASP 70 1.409 10.497 0.335 567 H GLU 71 H GLU 71 4.600 8.928 2.343 568 HA GLU 71 HA GLU 71 6.696 8.316 0.563 569 HB2 GLU 71 2HB GLU 71 6.620 8.039 3.563 570 HB3 GLU 71 1HB GLU 71 8.070 7.964 2.590 571 HG2 GLU 71 2HG GLU 71 7.692 10.282 1.894 572 HG3 GLU 71 1HG GLU 71 6.277 10.360 2.941 573 H ILE 72 H ILE 72 4.872 6.392 2.842 574 HA ILE 72 HA ILE 72 6.247 3.954 2.556 575 HB ILE 72 HB ILE 72 3.321 4.414 3.224 576 HG12 ILE 72 2HG1 ILE 72 5.706 4.016 5.056 577 HG13 ILE 72 1HG1 ILE 72 4.876 5.538 4.774 578 HG21 ILE 72 1HG2 ILE 72 3.702 2.113 2.517 579 HG22 ILE 72 2HG2 ILE 72 3.374 2.179 4.249 580 HG23 ILE 72 3HG2 ILE 72 5.026 1.962 3.671 581 HD11 ILE 72 1HD1 ILE 72 3.683 3.084 6.055 582 HD12 ILE 72 2HD1 ILE 72 2.847 4.612 5.780 583 HD13 ILE 72 3HD1 ILE 72 4.214 4.545 6.891 584 H MET 73 H MET 73 3.438 5.279 0.933 585 HA MET 73 HA MET 73 2.892 3.089 -0.714 586 HB2 MET 73 2HB MET 73 1.273 4.844 -0.202 587 HB3 MET 73 1HB MET 73 2.235 6.002 -1.105 588 HG2 MET 73 2HG MET 73 0.292 5.222 -2.352 589 HG3 MET 73 1HG MET 73 1.808 4.799 -3.153 590 HE1 MET 73 1HE MET 73 0.451 3.216 -4.669 591 HE2 MET 73 2HE MET 73 -1.040 3.593 -3.797 592 HE3 MET 73 3HE MET 73 -0.583 1.912 -4.070 593 H GLU 74 H GLU 74 5.066 5.837 -1.157 594 HA GLU 74 HA GLU 74 5.730 5.501 -3.855 595 HB2 GLU 74 2HB GLU 74 7.521 6.267 -1.554 596 HB3 GLU 74 1HB GLU 74 7.985 6.374 -3.237 597 HG2 GLU 74 2HG GLU 74 6.247 8.047 -3.600 598 HG3 GLU 74 1HG GLU 74 5.778 7.920 -1.899 599 H GLU 75 H GLU 75 7.114 4.019 -0.971 600 HA GLU 75 HA GLU 75 9.058 2.467 -2.322 601 HB2 GLU 75 2HB GLU 75 9.150 3.072 0.088 602 HB3 GLU 75 1HB GLU 75 7.801 1.980 0.375 603 HG2 GLU 75 2HG GLU 75 9.862 0.910 1.010 604 HG3 GLU 75 1HG GLU 75 9.178 0.105 -0.399 605 H LEU 76 H LEU 76 5.790 1.785 -1.160 606 HA LEU 76 HA LEU 76 5.634 -0.929 -1.802 607 HB2 LEU 76 2HB LEU 76 3.460 1.162 -1.892 608 HB3 LEU 76 1HB LEU 76 3.178 -0.559 -1.998 609 HG LEU 76 HG LEU 76 4.367 0.849 0.396 610 HD11 LEU 76 1HD1 LEU 76 2.226 0.363 1.457 611 HD12 LEU 76 2HD1 LEU 76 1.623 -0.309 -0.057 612 HD13 LEU 76 3HD1 LEU 76 2.009 1.409 0.054 613 HD21 LEU 76 1HD2 LEU 76 3.477 -2.001 -0.015 614 HD22 LEU 76 2HD2 LEU 76 3.990 -1.293 1.510 615 HD23 LEU 76 3HD2 LEU 76 5.142 -1.453 0.189 616 H THR 77 H THR 77 4.791 1.911 -3.784 617 HA THR 77 HA THR 77 4.028 0.461 -6.046 618 HB THR 77 HB THR 77 5.185 3.266 -5.932 619 HG1 THR 77 1HG THR 77 3.397 3.075 -4.519 620 HG21 THR 77 1HG2 THR 77 4.980 2.329 -8.205 621 HG22 THR 77 2HG2 THR 77 3.825 3.632 -7.945 622 HG23 THR 77 3HG2 THR 77 3.288 1.952 -7.892 623 H LYS 78 H LYS 78 7.166 1.901 -5.113 624 HA LYS 78 HA LYS 78 8.472 1.291 -7.523 625 HB2 LYS 78 2HB LYS 78 9.659 1.791 -4.811 626 HB3 LYS 78 1HB LYS 78 10.613 1.607 -6.272 627 HG2 LYS 78 2HG LYS 78 9.319 3.515 -7.220 628 HG3 LYS 78 1HG LYS 78 8.641 3.775 -5.614 629 HD2 LYS 78 2HD LYS 78 11.578 3.836 -6.338 630 HD3 LYS 78 1HD LYS 78 10.579 5.244 -5.989 631 HE2 LYS 78 2HE LYS 78 10.220 4.415 -3.723 632 HE3 LYS 78 1HE LYS 78 11.199 2.995 -4.106 633 HZ1 LYS 78 1HZ LYS 78 13.102 4.401 -4.426 634 HZ2 LYS 78 2HZ LYS 78 12.466 4.683 -2.893 635 HZ3 LYS 78 3HZ LYS 78 12.188 5.795 -4.110 636 H TYR 79 H TYR 79 8.558 -0.434 -4.455 637 HA TYR 79 HA TYR 79 10.384 -2.376 -5.354 638 HB2 TYR 79 2HB TYR 79 9.910 -1.968 -2.973 639 HB3 TYR 79 1HB TYR 79 8.316 -2.678 -3.185 640 HD1 TYR 79 1HD TYR 79 11.909 -3.497 -3.662 641 HD2 TYR 79 2HD TYR 79 8.035 -4.951 -2.700 642 HE1 TYR 79 1HE TYR 79 12.866 -5.692 -3.148 643 HE2 TYR 79 2HE TYR 79 8.991 -7.159 -2.181 644 HH TYR 79 HH TYR 79 12.253 -7.572 -1.697 645 H TYR 80 H TYR 80 6.885 -2.301 -5.414 646 HA TYR 80 HA TYR 80 6.348 -4.917 -6.240 647 HB2 TYR 80 2HB TYR 80 4.694 -3.206 -5.481 648 HB3 TYR 80 1HB TYR 80 4.916 -2.367 -7.003 649 HD1 TYR 80 1HD TYR 80 3.443 -5.251 -5.339 650 HD2 TYR 80 2HD TYR 80 3.933 -3.256 -9.059 651 HE1 TYR 80 1HE TYR 80 1.600 -6.573 -6.282 652 HE2 TYR 80 2HE TYR 80 2.101 -4.570 -10.015 653 HH TYR 80 HH TYR 80 0.001 -6.428 -8.064 654 H LEU 81 H LEU 81 7.037 -1.987 -8.092 655 HA LEU 81 HA LEU 81 6.899 -3.252 -10.637 656 HB2 LEU 81 2HB LEU 81 8.085 -0.630 -9.788 657 HB3 LEU 81 1HB LEU 81 7.897 -1.132 -11.461 658 HG LEU 81 HG LEU 81 5.658 -0.678 -9.491 659 HD11 LEU 81 1HD1 LEU 81 5.116 1.239 -10.926 660 HD12 LEU 81 2HD1 LEU 81 6.591 0.926 -11.847 661 HD13 LEU 81 3HD1 LEU 81 6.700 1.395 -10.154 662 HD21 LEU 81 1HD2 LEU 81 4.212 -0.919 -11.460 663 HD22 LEU 81 2HD2 LEU 81 5.074 -2.412 -11.082 664 HD23 LEU 81 3HD2 LEU 81 5.607 -1.387 -12.417 665 H ALA 82 H ALA 82 9.480 -2.540 -8.384 666 HA ALA 82 HA ALA 82 11.673 -3.091 -10.024 667 HB1 ALA 82 1HB ALA 82 11.860 -2.015 -7.819 668 HB2 ALA 82 2HB ALA 82 12.939 -3.400 -7.964 669 HB3 ALA 82 3HB ALA 82 11.440 -3.544 -7.048 670 H ASN 83 H ASN 83 9.441 -5.205 -8.431 671 HA ASN 83 HA ASN 83 10.939 -7.611 -8.590 672 HB2 ASN 83 2HB ASN 83 7.981 -7.116 -8.415 673 HB3 ASN 83 1HB ASN 83 8.619 -8.740 -8.602 674 HD21 ASN 83 1HD2 ASN 83 10.201 -6.239 -6.632 675 HD22 ASN 83 2HD2 ASN 83 9.844 -7.039 -5.143 676 H HIS 84 H HIS 84 9.524 -5.753 -11.033 677 HA HIS 84 HA HIS 84 9.239 -7.997 -12.873 678 HB2 HIS 84 2HB HIS 84 8.758 -5.028 -13.253 679 HB3 HIS 84 1HB HIS 84 8.616 -6.195 -14.554 680 HD1 HIS 84 1HD HIS 84 6.349 -7.247 -14.843 681 HD2 HIS 84 2HD HIS 84 6.765 -5.408 -11.137 682 HE1 HIS 84 1HE HIS 84 4.125 -7.389 -13.778 683 HE2 HIS 84 2HE HIS 84 4.459 -6.631 -11.475 684 H GLY 85 H GLY 85 11.824 -6.608 -11.675 685 HA2 GLY 85 2HA GLY 85 14.027 -6.719 -12.440 686 HA3 GLY 85 1HA GLY 85 13.420 -7.074 -14.052 687 H ILE 86 H ILE 86 12.013 -4.471 -12.463 688 HA ILE 86 HA ILE 86 13.166 -2.662 -14.412 689 HB ILE 86 HB ILE 86 10.787 -2.355 -12.572 690 HG12 ILE 86 2HG1 ILE 86 10.964 -2.730 -15.570 691 HG13 ILE 86 1HG1 ILE 86 10.444 -3.942 -14.410 692 HG21 ILE 86 1HG2 ILE 86 10.278 -0.288 -13.801 693 HG22 ILE 86 2HG2 ILE 86 11.797 -0.442 -14.679 694 HG23 ILE 86 3HG2 ILE 86 11.811 -0.175 -12.938 695 HD11 ILE 86 1HD1 ILE 86 9.059 -1.341 -15.000 696 HD12 ILE 86 2HD1 ILE 86 8.515 -2.550 -13.836 697 HD13 ILE 86 3HD1 ILE 86 8.552 -2.938 -15.560 698 H ASP 87 H ASP 87 14.484 -1.068 -13.894 699 HA ASP 87 HA ASP 87 15.048 -0.579 -11.057 700 HB2 ASP 87 2HB ASP 87 16.702 0.182 -13.484 701 HB3 ASP 87 1HB ASP 87 17.100 0.592 -11.826 702 H ILE 88 H ILE 88 14.307 1.136 -10.190 703 HA ILE 88 HA ILE 88 13.003 3.086 -11.899 704 HB ILE 88 HB ILE 88 12.748 2.504 -8.954 705 HG12 ILE 88 2HG1 ILE 88 10.907 1.988 -11.289 706 HG13 ILE 88 1HG1 ILE 88 11.872 0.785 -10.456 707 HG21 ILE 88 1HG2 ILE 88 10.871 4.040 -8.902 708 HG22 ILE 88 2HG2 ILE 88 11.112 4.448 -10.610 709 HG23 ILE 88 3HG2 ILE 88 12.319 4.895 -9.390 710 HD11 ILE 88 1HD1 ILE 88 9.678 2.398 -9.224 711 HD12 ILE 88 2HD1 ILE 88 10.589 1.096 -8.465 712 HD13 ILE 88 3HD1 ILE 88 9.536 0.735 -9.828 713 H LYS 89 H LYS 89 13.530 5.105 -11.925 714 HA LYS 89 HA LYS 89 16.009 5.902 -10.525 715 HB2 LYS 89 2HB LYS 89 15.122 6.623 -13.322 716 HB3 LYS 89 1HB LYS 89 16.591 7.191 -12.544 717 HG2 LYS 89 2HG LYS 89 17.455 4.925 -12.448 718 HG3 LYS 89 1HG LYS 89 15.957 4.305 -13.138 719 HD2 LYS 89 2HD LYS 89 16.373 5.586 -15.175 720 HD3 LYS 89 1HD LYS 89 17.881 6.191 -14.487 721 HE2 LYS 89 2HE LYS 89 18.749 3.923 -14.358 722 HE3 LYS 89 1HE LYS 89 17.229 3.290 -14.979 723 HZ1 LYS 89 1HZ LYS 89 18.884 3.427 -16.733 724 HZ2 LYS 89 2HZ LYS 89 19.094 5.075 -16.461 725 HZ3 LYS 89 3HZ LYS 89 17.631 4.492 -17.054 726 H1 MET 1 H MET 1 -21.515 4.371 10.650 727 HA MET 1 HA MET 1 -20.523 5.066 8.422 728 HB2 MET 1 2HB MET 1 -19.436 5.659 10.577 729 HB3 MET 1 1HB MET 1 -18.612 4.111 10.564 730 HG2 MET 1 2HG MET 1 -17.403 4.764 8.542 731 HG3 MET 1 1HG MET 1 -18.238 6.316 8.543 732 HE1 MET 1 1HE MET 1 -15.673 4.008 10.437 733 HE2 MET 1 2HE MET 1 -16.896 4.327 11.663 734 HE3 MET 1 3HE MET 1 -15.276 4.998 11.841 735 H GLY 2 H GLY 2 -20.543 1.892 9.396 736 HA2 GLY 2 2HA GLY 2 -18.610 1.007 7.350 737 HA3 GLY 2 1HA GLY 2 -19.199 0.024 8.688 738 H PHE 3 H PHE 3 -21.537 1.874 7.169 739 HA PHE 3 HA PHE 3 -22.844 -0.456 6.128 740 HB2 PHE 3 2HB PHE 3 -24.688 1.114 5.546 741 HB3 PHE 3 1HB PHE 3 -24.215 1.233 7.230 742 HD1 PHE 3 1HD PHE 3 -24.467 2.975 4.041 743 HD2 PHE 3 2HD PHE 3 -22.975 3.234 8.022 744 HE1 PHE 3 1HE PHE 3 -24.212 5.400 3.782 745 HE2 PHE 3 2HE PHE 3 -22.722 5.671 7.765 746 HZ PHE 3 HZ PHE 3 -23.339 6.754 5.643 747 H THR 4 H THR 4 -22.741 -1.183 4.079 748 HA THR 4 HA THR 4 -22.646 0.455 1.851 749 HB THR 4 HB THR 4 -20.315 0.939 2.475 750 HG1 THR 4 1HG THR 4 -19.336 0.223 0.508 751 HG21 THR 4 1HG2 THR 4 -19.789 -1.121 3.713 752 HG22 THR 4 2HG2 THR 4 -18.589 -0.838 2.450 753 HG23 THR 4 3HG2 THR 4 -19.852 -2.047 2.217 754 H ASP 5 H ASP 5 -23.219 -0.629 0.086 755 HA ASP 5 HA ASP 5 -22.602 -3.385 -0.284 756 HB2 ASP 5 2HB ASP 5 -24.624 -3.626 1.124 757 HB3 ASP 5 1HB ASP 5 -25.524 -2.627 -0.019 758 H GLU 6 H GLU 6 -21.753 -3.040 -2.208 759 HA GLU 6 HA GLU 6 -23.417 -2.671 -4.401 760 HB2 GLU 6 2HB GLU 6 -22.497 -0.582 -5.311 761 HB3 GLU 6 1HB GLU 6 -23.402 -0.317 -3.830 762 HG2 GLU 6 2HG GLU 6 -21.299 -0.149 -2.586 763 HG3 GLU 6 1HG GLU 6 -20.403 -0.418 -4.077 764 H THR 7 H THR 7 -22.549 -3.648 -6.011 765 HA THR 7 HA THR 7 -19.704 -4.281 -6.008 766 HB THR 7 HB THR 7 -21.990 -5.409 -7.673 767 HG1 THR 7 1HG THR 7 -22.409 -6.056 -5.651 768 HG21 THR 7 1HG2 THR 7 -20.422 -7.267 -8.099 769 HG22 THR 7 2HG2 THR 7 -19.188 -6.438 -7.156 770 HG23 THR 7 3HG2 THR 7 -19.758 -5.739 -8.671 771 H VAL 8 H VAL 8 -18.434 -3.455 -7.712 772 HA VAL 8 HA VAL 8 -19.795 -1.371 -9.214 773 HB VAL 8 HB VAL 8 -17.541 -0.460 -9.718 774 HG11 VAL 8 1HG1 VAL 8 -17.071 0.340 -7.448 775 HG12 VAL 8 2HG1 VAL 8 -18.119 -0.919 -6.792 776 HG13 VAL 8 3HG1 VAL 8 -18.798 0.358 -7.800 777 HG21 VAL 8 1HG2 VAL 8 -16.569 -2.621 -7.840 778 HG22 VAL 8 2HG2 VAL 8 -15.590 -1.322 -8.520 779 HG23 VAL 8 3HG2 VAL 8 -16.273 -2.551 -9.583 780 H ARG 9 H ARG 9 -18.978 -4.461 -9.716 781 HA ARG 9 HA ARG 9 -18.994 -5.807 -11.525 782 HB2 ARG 9 2HB ARG 9 -19.742 -3.302 -13.081 783 HB3 ARG 9 1HB ARG 9 -19.625 -4.877 -13.822 784 HG2 ARG 9 2HG ARG 9 -21.919 -4.451 -13.467 785 HG3 ARG 9 1HG ARG 9 -21.449 -5.630 -12.252 786 HD2 ARG 9 2HD ARG 9 -22.901 -3.944 -11.291 787 HD3 ARG 9 1HD ARG 9 -21.283 -3.801 -10.603 788 HE ARG 9 HE ARG 9 -21.270 -2.085 -12.708 789 HH11 ARG 9 1HH1 ARG 9 -23.312 -2.434 -9.834 790 HH12 ARG 9 2HH1 ARG 9 -23.719 -0.791 -9.754 791 HH21 ARG 9 1HH2 ARG 9 -21.838 0.187 -12.593 792 HH22 ARG 9 2HH2 ARG 9 -22.859 0.722 -11.337 793 H PHE 10 H PHE 10 -18.049 -5.504 -14.122 794 HA PHE 10 HA PHE 10 -16.269 -5.374 -15.424 795 HB2 PHE 10 2HB PHE 10 -14.953 -3.597 -13.338 796 HB3 PHE 10 1HB PHE 10 -14.403 -3.820 -14.988 797 HD1 PHE 10 1HD PHE 10 -16.308 -1.800 -12.818 798 HD2 PHE 10 2HD PHE 10 -16.133 -3.126 -16.849 799 HE1 PHE 10 1HE PHE 10 -17.669 0.126 -13.506 800 HE2 PHE 10 2HE PHE 10 -17.486 -1.192 -17.543 801 HZ PHE 10 HZ PHE 10 -18.258 0.432 -15.873 802 H ASP 11 H ASP 11 -16.636 -7.068 -12.944 803 HA ASP 11 HA ASP 11 -13.962 -8.085 -12.451 804 HB2 ASP 11 2HB ASP 11 -16.642 -9.255 -11.644 805 HB3 ASP 11 1HB ASP 11 -15.075 -9.821 -11.102 806 H PHE 12 H PHE 12 -16.785 -8.851 -14.301 807 HA PHE 12 HA PHE 12 -15.305 -11.061 -15.468 808 HB2 PHE 12 2HB PHE 12 -18.270 -10.499 -15.574 809 HB3 PHE 12 1HB PHE 12 -17.485 -11.784 -16.486 810 HD1 PHE 12 1HD PHE 12 -18.690 -10.721 -13.223 811 HD2 PHE 12 2HD PHE 12 -16.460 -13.685 -15.313 812 HE1 PHE 12 1HE PHE 12 -18.871 -12.226 -11.285 813 HE2 PHE 12 2HE PHE 12 -16.643 -15.190 -13.380 814 HZ PHE 12 HZ PHE 12 -17.850 -14.458 -11.362 815 H ASP 13 H ASP 13 -13.991 -9.954 -16.633 816 HA ASP 13 HA ASP 13 -15.009 -8.797 -19.127 817 HB2 ASP 13 2HB ASP 13 -14.245 -6.979 -17.507 818 HB3 ASP 13 1HB ASP 13 -12.678 -7.762 -17.438 819 H ASP 14 H ASP 14 -12.176 -8.492 -19.998 820 HA ASP 14 HA ASP 14 -11.675 -11.278 -20.518 821 HB2 ASP 14 2HB ASP 14 -10.072 -8.829 -21.337 822 HB3 ASP 14 1HB ASP 14 -9.782 -10.473 -21.898 823 H ASN 15 H ASN 15 -11.189 -12.159 -18.633 824 HA ASN 15 HA ASN 15 -9.372 -10.841 -16.895 825 HB2 ASN 15 2HB ASN 15 -10.843 -13.438 -16.558 826 HB3 ASN 15 1HB ASN 15 -9.701 -12.825 -15.363 827 HD21 ASN 15 1HD2 ASN 15 -12.540 -13.265 -15.022 828 HD22 ASN 15 2HD2 ASN 15 -13.205 -11.713 -14.622 829 H ARG 16 H ARG 16 -7.458 -10.917 -16.821 830 HA ARG 16 HA ARG 16 -5.937 -13.149 -17.901 831 HB2 ARG 16 2HB ARG 16 -4.233 -11.354 -18.486 832 HB3 ARG 16 1HB ARG 16 -5.728 -11.253 -19.403 833 HG2 ARG 16 2HG ARG 16 -6.452 -9.517 -17.639 834 HG3 ARG 16 1HG ARG 16 -4.749 -9.466 -17.198 835 HD2 ARG 16 2HD ARG 16 -5.865 -8.920 -19.955 836 HD3 ARG 16 1HD ARG 16 -5.388 -7.691 -18.799 837 HE ARG 16 HE ARG 16 -3.115 -9.055 -19.065 838 HH11 ARG 16 1HH1 ARG 16 -5.383 -7.852 -21.544 839 HH12 ARG 16 2HH1 ARG 16 -4.175 -7.593 -22.707 840 HH21 ARG 16 1HH2 ARG 16 -1.460 -8.690 -20.703 841 HH22 ARG 16 2HH2 ARG 16 -1.903 -8.100 -22.237 842 H LYS 17 H LYS 17 -4.320 -13.896 -16.495 843 HA LYS 17 HA LYS 17 -4.874 -13.050 -13.802 844 HB2 LYS 17 2HB LYS 17 -3.136 -15.319 -14.741 845 HB3 LYS 17 1HB LYS 17 -3.516 -14.959 -13.059 846 HG2 LYS 17 2HG LYS 17 -5.937 -15.212 -13.659 847 HG3 LYS 17 1HG LYS 17 -5.411 -15.809 -15.231 848 HD2 LYS 17 2HD LYS 17 -5.883 -17.681 -13.805 849 HD3 LYS 17 1HD LYS 17 -4.138 -17.585 -14.054 850 HE2 LYS 17 2HE LYS 17 -4.702 -18.073 -11.705 851 HE3 LYS 17 1HE LYS 17 -3.859 -16.541 -11.859 852 HZ1 LYS 17 1HZ LYS 17 -5.981 -15.383 -11.621 853 HZ2 LYS 17 2HZ LYS 17 -5.749 -16.438 -10.337 854 HZ3 LYS 17 3HZ LYS 17 -6.806 -16.859 -11.568 855 H LYS 18 H LYS 18 -3.417 -12.490 -12.219 856 HA LYS 18 HA LYS 18 -1.897 -11.053 -11.391 857 HB2 LYS 18 2HB LYS 18 -0.163 -12.140 -13.634 858 HB3 LYS 18 1HB LYS 18 0.438 -11.134 -12.325 859 HG2 LYS 18 2HG LYS 18 -0.256 -12.857 -10.712 860 HG3 LYS 18 1HG LYS 18 -0.788 -13.872 -12.050 861 HD2 LYS 18 2HD LYS 18 1.499 -13.924 -12.920 862 HD3 LYS 18 1HD LYS 18 2.026 -12.882 -11.597 863 HE2 LYS 18 2HE LYS 18 0.840 -15.644 -11.302 864 HE3 LYS 18 1HE LYS 18 2.546 -15.234 -11.144 865 HZ1 LYS 18 1HZ LYS 18 0.352 -14.240 -9.401 866 HZ2 LYS 18 2HZ LYS 18 1.975 -13.840 -9.243 867 HZ3 LYS 18 3HZ LYS 18 1.471 -15.427 -8.998 868 H ALA 19 H ALA 19 -3.795 -10.257 -13.278 869 HA ALA 19 HA ALA 19 -2.968 -8.533 -15.285 870 HB1 ALA 19 1HB ALA 19 -5.120 -7.539 -15.144 871 HB2 ALA 19 2HB ALA 19 -5.353 -8.273 -13.556 872 HB3 ALA 19 3HB ALA 19 -5.247 -9.311 -14.999 873 H ILE 20 H ILE 20 -3.554 -7.929 -11.857 874 HA ILE 20 HA ILE 20 -3.388 -5.142 -12.018 875 HB ILE 20 HB ILE 20 -2.774 -6.967 -9.665 876 HG12 ILE 20 2HG1 ILE 20 -5.265 -5.390 -10.364 877 HG13 ILE 20 1HG1 ILE 20 -5.083 -7.127 -10.553 878 HG21 ILE 20 1HG2 ILE 20 -1.721 -4.795 -9.319 879 HG22 ILE 20 2HG2 ILE 20 -3.099 -4.991 -8.237 880 HG23 ILE 20 3HG2 ILE 20 -3.246 -3.986 -9.679 881 HD11 ILE 20 1HD1 ILE 20 -6.367 -6.585 -8.565 882 HD12 ILE 20 2HD1 ILE 20 -5.037 -5.602 -7.954 883 HD13 ILE 20 3HD1 ILE 20 -4.837 -7.346 -8.120 884 H SER 21 H SER 21 -1.045 -7.636 -11.727 885 HA SER 21 HA SER 21 1.195 -5.945 -11.099 886 HB2 SER 21 2HB SER 21 1.166 -8.333 -10.429 887 HB3 SER 21 1HB SER 21 1.127 -8.808 -12.120 888 HG SER 21 HG SER 21 3.147 -8.882 -11.881 889 H GLU 22 H GLU 22 0.013 -7.620 -13.929 890 HA GLU 22 HA GLU 22 1.864 -6.693 -15.801 891 HB2 GLU 22 2HB GLU 22 0.581 -8.613 -16.273 892 HB3 GLU 22 1HB GLU 22 -0.929 -7.782 -15.967 893 HG2 GLU 22 2HG GLU 22 -0.780 -6.602 -17.982 894 HG3 GLU 22 1HG GLU 22 0.882 -7.148 -18.285 895 H THR 23 H THR 23 -1.107 -5.311 -14.579 896 HA THR 23 HA THR 23 -1.419 -3.240 -16.453 897 HB THR 23 HB THR 23 -2.240 -3.393 -13.541 898 HG1 THR 23 1HG THR 23 -3.165 -4.921 -14.979 899 HG21 THR 23 1HG2 THR 23 -3.852 -1.584 -14.073 900 HG22 THR 23 2HG2 THR 23 -3.120 -1.442 -15.672 901 HG23 THR 23 3HG2 THR 23 -2.175 -1.055 -14.240 902 H LEU 24 H LEU 24 0.096 -3.265 -13.215 903 HA LEU 24 HA LEU 24 0.878 -0.562 -13.435 904 HB2 LEU 24 2HB LEU 24 1.824 -2.676 -11.514 905 HB3 LEU 24 1HB LEU 24 2.166 -0.960 -11.377 906 HG LEU 24 HG LEU 24 -0.570 -2.225 -11.224 907 HD11 LEU 24 1HD1 LEU 24 0.766 -2.664 -9.267 908 HD12 LEU 24 2HD1 LEU 24 -0.516 -1.507 -8.905 909 HD13 LEU 24 3HD1 LEU 24 1.140 -0.944 -9.121 910 HD21 LEU 24 1HD2 LEU 24 -0.712 -0.015 -12.233 911 HD22 LEU 24 2HD2 LEU 24 0.264 0.665 -10.929 912 HD23 LEU 24 3HD2 LEU 24 -1.343 0.020 -10.595 913 H GLU 25 H GLU 25 2.482 -3.548 -14.213 914 HA GLU 25 HA GLU 25 5.088 -2.696 -14.654 915 HB2 GLU 25 2HB GLU 25 4.320 -5.016 -14.910 916 HB3 GLU 25 1HB GLU 25 3.382 -4.559 -16.319 917 HG2 GLU 25 2HG GLU 25 5.497 -3.930 -17.447 918 HG3 GLU 25 1HG GLU 25 6.371 -4.564 -16.053 919 H THR 26 H THR 26 2.246 -2.650 -16.722 920 HA THR 26 HA THR 26 3.365 -1.417 -18.985 921 HB THR 26 HB THR 26 0.472 -1.669 -18.086 922 HG1 THR 26 1HG THR 26 1.087 -3.677 -18.361 923 HG21 THR 26 1HG2 THR 26 0.838 0.044 -19.833 924 HG22 THR 26 2HG2 THR 26 -0.089 -1.332 -20.444 925 HG23 THR 26 3HG2 THR 26 1.625 -1.163 -20.836 926 H VAL 27 H VAL 27 1.598 -0.194 -16.175 927 HA VAL 27 HA VAL 27 1.180 2.442 -17.075 928 HB VAL 27 HB VAL 27 1.523 1.564 -14.183 929 HG11 VAL 27 1HG1 VAL 27 1.555 4.005 -14.494 930 HG12 VAL 27 2HG1 VAL 27 0.084 3.462 -13.667 931 HG13 VAL 27 3HG1 VAL 27 0.024 3.878 -15.375 932 HG21 VAL 27 1HG2 VAL 27 -1.001 1.723 -15.807 933 HG22 VAL 27 2HG2 VAL 27 -0.867 1.262 -14.115 934 HG23 VAL 27 3HG2 VAL 27 -0.171 0.227 -15.366 935 H TYR 28 H TYR 28 3.864 0.962 -15.345 936 HA TYR 28 HA TYR 28 5.289 3.303 -14.750 937 HB2 TYR 28 2HB TYR 28 5.895 1.139 -13.751 938 HB3 TYR 28 1HB TYR 28 6.409 0.547 -15.324 939 HD1 TYR 28 1HD TYR 28 8.532 1.219 -16.277 940 HD2 TYR 28 2HD TYR 28 7.262 2.825 -12.550 941 HE1 TYR 28 1HE TYR 28 10.794 2.090 -15.887 942 HE2 TYR 28 2HE TYR 28 9.526 3.703 -12.149 943 HH TYR 28 HH TYR 28 11.860 3.853 -14.603 944 H ARG 29 H ARG 29 5.569 1.120 -17.491 945 HA ARG 29 HA ARG 29 7.573 2.426 -18.949 946 HB2 ARG 29 2HB ARG 29 5.203 0.842 -19.922 947 HB3 ARG 29 1HB ARG 29 6.582 1.268 -20.911 948 HG2 ARG 29 2HG ARG 29 6.884 -0.352 -18.401 949 HG3 ARG 29 1HG ARG 29 6.455 -1.095 -19.932 950 HD2 ARG 29 2HD ARG 29 8.852 -1.268 -19.489 951 HD3 ARG 29 1HD ARG 29 8.534 -0.312 -20.922 952 HE ARG 29 HE ARG 29 9.038 1.662 -19.541 953 HH11 ARG 29 1HH1 ARG 29 10.183 -1.495 -18.373 954 HH12 ARG 29 2HH1 ARG 29 11.605 -0.906 -17.693 955 HH21 ARG 29 1HH2 ARG 29 11.087 2.499 -18.598 956 HH22 ARG 29 2HH2 ARG 29 12.119 1.429 -17.794 957 H ALA 30 H ALA 30 4.090 2.820 -18.926 958 HA ALA 30 HA ALA 30 3.804 4.556 -21.076 959 HB1 ALA 30 1HB ALA 30 2.092 4.448 -18.596 960 HB2 ALA 30 2HB ALA 30 1.924 3.405 -20.008 961 HB3 ALA 30 3HB ALA 30 1.633 5.139 -20.153 962 H LEU 31 H LEU 31 4.169 5.413 -17.617 963 HA LEU 31 HA LEU 31 4.128 8.162 -18.335 964 HB2 LEU 31 2HB LEU 31 4.757 6.945 -15.686 965 HB3 LEU 31 1HB LEU 31 4.905 8.661 -15.977 966 HG LEU 31 HG LEU 31 2.445 8.424 -16.758 967 HD11 LEU 31 1HD1 LEU 31 2.313 5.986 -16.563 968 HD12 LEU 31 2HD1 LEU 31 1.168 6.824 -15.495 969 HD13 LEU 31 3HD1 LEU 31 2.645 6.174 -14.824 970 HD21 LEU 31 1HD2 LEU 31 3.172 9.811 -14.971 971 HD22 LEU 31 2HD2 LEU 31 3.257 8.435 -13.876 972 HD23 LEU 31 3HD2 LEU 31 1.705 8.948 -14.525 973 H GLU 32 H GLU 32 6.778 5.960 -17.791 974 HA GLU 32 HA GLU 32 8.504 8.188 -17.697 975 HB2 GLU 32 2HB GLU 32 10.397 6.582 -17.859 976 HB3 GLU 32 1HB GLU 32 9.337 6.361 -16.469 977 HG2 GLU 32 2HG GLU 32 9.750 4.196 -17.102 978 HG3 GLU 32 1HG GLU 32 8.296 4.522 -18.036 979 H GLU 33 H GLU 33 7.450 6.226 -20.251 980 HA GLU 33 HA GLU 33 9.000 7.429 -22.316 981 HB2 GLU 33 2HB GLU 33 6.235 6.236 -22.343 982 HB3 GLU 33 1HB GLU 33 7.025 6.827 -23.794 983 HG2 GLU 33 2HG GLU 33 8.133 4.680 -22.006 984 HG3 GLU 33 1HG GLU 33 7.180 4.373 -23.458 985 H LYS 34 H LYS 34 6.083 8.403 -20.690 986 HA LYS 34 HA LYS 34 5.582 10.683 -22.374 987 HB2 LYS 34 2HB LYS 34 4.341 9.692 -19.833 988 HB3 LYS 34 1HB LYS 34 3.864 11.215 -20.556 989 HG2 LYS 34 2HG LYS 34 3.775 8.586 -22.023 990 HG3 LYS 34 1HG LYS 34 2.419 9.223 -21.089 991 HD2 LYS 34 2HD LYS 34 3.745 10.724 -23.359 992 HD3 LYS 34 1HD LYS 34 2.327 9.700 -23.555 993 HE2 LYS 34 2HE LYS 34 1.067 11.034 -22.040 994 HE3 LYS 34 1HE LYS 34 2.472 12.039 -21.663 995 HZ1 LYS 34 1HZ LYS 34 2.458 12.797 -23.979 996 HZ2 LYS 34 2HZ LYS 34 1.020 13.153 -23.205 997 HZ3 LYS 34 3HZ LYS 34 1.092 11.867 -24.298 998 H GLY 35 H GLY 35 7.777 10.163 -19.958 999 HA2 GLY 35 2HA GLY 35 9.349 11.681 -19.162 1000 HA3 GLY 35 1HA GLY 35 8.411 12.977 -19.884 1001 H TYR 36 H TYR 36 6.519 10.983 -17.923 1002 HA TYR 36 HA TYR 36 6.530 13.050 -15.839 1003 HB2 TYR 36 2HB TYR 36 4.616 10.757 -16.309 1004 HB3 TYR 36 1HB TYR 36 4.478 11.910 -14.992 1005 HD1 TYR 36 1HD TYR 36 3.624 11.139 -18.342 1006 HD2 TYR 36 2HD TYR 36 4.118 14.377 -15.650 1007 HE1 TYR 36 1HE TYR 36 2.228 12.546 -19.789 1008 HE2 TYR 36 2HE TYR 36 2.721 15.804 -17.096 1009 HH TYR 36 HH TYR 36 2.015 15.904 -19.426 1010 H ASN 37 H ASN 37 5.903 11.889 -13.595 1011 HA ASN 37 HA ASN 37 7.990 9.892 -13.172 1012 HB2 ASN 37 2HB ASN 37 6.529 11.641 -11.180 1013 HB3 ASN 37 1HB ASN 37 7.747 10.457 -10.746 1014 HD21 ASN 37 1HD2 ASN 37 9.929 10.891 -11.315 1015 HD22 ASN 37 2HD2 ASN 37 10.449 12.495 -11.654 1016 HA PRO 38 HA PRO 38 4.479 7.032 -13.474 1017 HB2 PRO 38 2HB PRO 38 6.639 5.238 -12.519 1018 HB3 PRO 38 1HB PRO 38 5.493 5.032 -13.848 1019 HG2 PRO 38 2HG PRO 38 8.044 5.677 -14.307 1020 HG3 PRO 38 1HG PRO 38 6.735 6.330 -15.301 1021 HD2 PRO 38 2HD PRO 38 8.372 7.672 -13.221 1022 HD3 PRO 38 1HD PRO 38 7.569 8.330 -14.665 1023 H ILE 39 H ILE 39 6.767 7.052 -10.768 1024 HA ILE 39 HA ILE 39 5.079 5.507 -9.075 1025 HB ILE 39 HB ILE 39 7.395 7.312 -8.319 1026 HG12 ILE 39 2HG1 ILE 39 8.096 5.604 -9.907 1027 HG13 ILE 39 1HG1 ILE 39 8.735 5.234 -8.313 1028 HG21 ILE 39 1HG2 ILE 39 5.989 6.801 -6.392 1029 HG22 ILE 39 2HG2 ILE 39 7.533 5.958 -6.270 1030 HG23 ILE 39 3HG2 ILE 39 6.087 5.080 -6.764 1031 HD11 ILE 39 1HD1 ILE 39 7.946 3.240 -9.467 1032 HD12 ILE 39 2HD1 ILE 39 6.342 3.941 -9.613 1033 HD13 ILE 39 3HD1 ILE 39 6.991 3.549 -8.018 1034 H ASN 40 H ASN 40 5.782 8.921 -9.335 1035 HA ASN 40 HA ASN 40 4.275 9.807 -7.154 1036 HB2 ASN 40 2HB ASN 40 5.100 11.232 -9.665 1037 HB3 ASN 40 1HB ASN 40 4.296 12.033 -8.329 1038 HD21 ASN 40 1HD2 ASN 40 5.414 12.373 -6.433 1039 HD22 ASN 40 2HD2 ASN 40 7.117 12.187 -6.300 1040 H GLN 41 H GLN 41 3.300 9.301 -10.535 1041 HA GLN 41 HA GLN 41 0.775 10.443 -9.971 1042 HB2 GLN 41 2HB GLN 41 1.719 8.891 -12.352 1043 HB3 GLN 41 1HB GLN 41 0.174 9.737 -12.250 1044 HG2 GLN 41 2HG GLN 41 2.887 11.037 -12.002 1045 HG3 GLN 41 1HG GLN 41 1.867 11.069 -13.433 1046 HE21 GLN 41 1HE2 GLN 41 -0.591 11.436 -12.019 1047 HE22 GLN 41 2HE2 GLN 41 -0.580 13.060 -11.416 1048 H ILE 42 H ILE 42 2.029 7.165 -9.939 1049 HA ILE 42 HA ILE 42 -0.532 5.955 -9.737 1050 HB ILE 42 HB ILE 42 2.168 4.871 -8.853 1051 HG12 ILE 42 2HG1 ILE 42 0.503 4.284 -11.317 1052 HG13 ILE 42 1HG1 ILE 42 1.956 5.276 -11.282 1053 HG21 ILE 42 1HG2 ILE 42 0.371 3.755 -7.618 1054 HG22 ILE 42 2HG2 ILE 42 1.069 2.646 -8.797 1055 HG23 ILE 42 3HG2 ILE 42 -0.488 3.424 -9.109 1056 HD11 ILE 42 1HD1 ILE 42 3.265 3.309 -10.626 1057 HD12 ILE 42 2HD1 ILE 42 2.421 3.054 -12.154 1058 HD13 ILE 42 3HD1 ILE 42 1.799 2.330 -10.670 1059 H VAL 43 H VAL 43 1.885 6.874 -7.264 1060 HA VAL 43 HA VAL 43 0.308 6.102 -5.081 1061 HB VAL 43 HB VAL 43 2.662 6.586 -4.623 1062 HG11 VAL 43 1HG1 VAL 43 3.026 8.320 -6.306 1063 HG12 VAL 43 2HG1 VAL 43 3.600 8.847 -4.724 1064 HG13 VAL 43 3HG1 VAL 43 2.071 9.457 -5.358 1065 HG21 VAL 43 1HG2 VAL 43 0.968 8.673 -3.258 1066 HG22 VAL 43 2HG2 VAL 43 2.535 8.092 -2.697 1067 HG23 VAL 43 3HG2 VAL 43 1.155 6.999 -2.748 1068 H GLY 44 H GLY 44 0.340 9.104 -6.895 1069 HA2 GLY 44 2HA GLY 44 -1.533 10.497 -5.320 1070 HA3 GLY 44 1HA GLY 44 -1.206 10.797 -7.023 1071 H TYR 45 H TYR 45 -1.940 8.288 -8.084 1072 HA TYR 45 HA TYR 45 -4.678 8.661 -8.372 1073 HB2 TYR 45 2HB TYR 45 -3.593 7.544 -10.191 1074 HB3 TYR 45 1HB TYR 45 -3.009 6.255 -9.137 1075 HD1 TYR 45 1HD TYR 45 -4.203 4.248 -9.101 1076 HD2 TYR 45 2HD TYR 45 -6.241 7.822 -10.159 1077 HE1 TYR 45 1HE TYR 45 -6.273 2.972 -9.416 1078 HE2 TYR 45 2HE TYR 45 -8.309 6.554 -10.494 1079 HH TYR 45 HH TYR 45 -9.100 4.373 -10.831 1080 H LEU 46 H LEU 46 -3.052 6.082 -6.524 1081 HA LEU 46 HA LEU 46 -5.574 5.053 -5.791 1082 HB2 LEU 46 2HB LEU 46 -2.894 4.403 -4.581 1083 HB3 LEU 46 1HB LEU 46 -4.384 3.652 -4.062 1084 HG LEU 46 HG LEU 46 -4.625 2.888 -6.529 1085 HD11 LEU 46 1HD1 LEU 46 -2.637 2.612 -7.796 1086 HD12 LEU 46 2HD1 LEU 46 -1.726 3.502 -6.580 1087 HD13 LEU 46 3HD1 LEU 46 -2.985 4.319 -7.503 1088 HD21 LEU 46 1HD2 LEU 46 -3.223 0.925 -6.148 1089 HD22 LEU 46 2HD2 LEU 46 -4.168 1.351 -4.722 1090 HD23 LEU 46 3HD2 LEU 46 -2.454 1.750 -4.791 1091 H LEU 47 H LEU 47 -3.539 7.388 -4.220 1092 HA LEU 47 HA LEU 47 -5.059 7.246 -1.803 1093 HB2 LEU 47 2HB LEU 47 -3.159 9.406 -2.710 1094 HB3 LEU 47 1HB LEU 47 -3.813 9.238 -1.097 1095 HG LEU 47 HG LEU 47 -1.869 7.396 -2.473 1096 HD11 LEU 47 1HD1 LEU 47 -0.866 9.417 -1.651 1097 HD12 LEU 47 2HD1 LEU 47 -0.363 8.038 -0.671 1098 HD13 LEU 47 3HD1 LEU 47 -1.577 9.159 -0.058 1099 HD21 LEU 47 1HD2 LEU 47 -3.388 6.037 -1.155 1100 HD22 LEU 47 2HD2 LEU 47 -3.150 7.079 0.253 1101 HD23 LEU 47 3HD2 LEU 47 -1.814 6.111 -0.384 1102 H SER 48 H SER 48 -5.295 9.199 -4.734 1103 HA SER 48 HA SER 48 -7.337 10.839 -3.457 1104 HB2 SER 48 2HB SER 48 -6.146 11.024 -6.215 1105 HB3 SER 48 1HB SER 48 -7.288 12.176 -5.525 1106 HG SER 48 HG SER 48 -5.397 11.976 -3.766 1107 H GLY 49 H GLY 49 -7.171 8.082 -5.654 1108 HA2 GLY 49 2HA GLY 49 -8.778 6.882 -6.602 1109 HA3 GLY 49 1HA GLY 49 -9.969 7.777 -5.658 1110 H ASP 50 H ASP 50 -7.727 9.218 -7.995 1111 HA ASP 50 HA ASP 50 -10.048 9.702 -9.730 1112 HB2 ASP 50 2HB ASP 50 -9.602 11.750 -8.498 1113 HB3 ASP 50 1HB ASP 50 -7.914 11.709 -8.998 1114 HA PRO 51 HA PRO 51 -7.484 7.693 -12.714 1115 HB2 PRO 51 2HB PRO 51 -9.025 8.334 -14.925 1116 HB3 PRO 51 1HB PRO 51 -9.277 6.952 -13.869 1117 HG2 PRO 51 2HG PRO 51 -10.684 9.562 -13.944 1118 HG3 PRO 51 1HG PRO 51 -11.302 7.964 -13.518 1119 HD2 PRO 51 2HD PRO 51 -10.732 9.896 -11.678 1120 HD3 PRO 51 1HD PRO 51 -10.660 8.159 -11.326 1121 H ALA 52 H ALA 52 -8.217 11.117 -12.961 1122 HA ALA 52 HA ALA 52 -6.781 11.660 -15.320 1123 HB1 ALA 52 1HB ALA 52 -6.856 13.999 -14.681 1124 HB2 ALA 52 2HB ALA 52 -7.320 13.555 -13.042 1125 HB3 ALA 52 3HB ALA 52 -8.415 13.231 -14.388 1126 H TYR 53 H TYR 53 -5.597 10.782 -12.298 1127 HA TYR 53 HA TYR 53 -3.128 12.113 -12.293 1128 HB2 TYR 53 2HB TYR 53 -4.078 9.603 -11.005 1129 HB3 TYR 53 1HB TYR 53 -2.380 10.063 -10.928 1130 HD1 TYR 53 1HD TYR 53 -1.745 12.185 -9.935 1131 HD2 TYR 53 2HD TYR 53 -5.703 10.716 -9.691 1132 HE1 TYR 53 1HE TYR 53 -2.153 13.700 -8.132 1133 HE2 TYR 53 2HE TYR 53 -6.166 12.245 -7.847 1134 HH TYR 53 HH TYR 53 -4.840 13.398 -6.083 1135 H ILE 54 H ILE 54 -4.270 9.441 -14.193 1136 HA ILE 54 HA ILE 54 -1.506 8.832 -14.920 1137 HB ILE 54 HB ILE 54 -3.932 7.057 -15.557 1138 HG12 ILE 54 2HG1 ILE 54 -3.528 7.261 -13.099 1139 HG13 ILE 54 1HG1 ILE 54 -3.188 5.653 -13.712 1140 HG21 ILE 54 1HG2 ILE 54 -2.304 5.379 -16.075 1141 HG22 ILE 54 2HG2 ILE 54 -0.998 6.509 -15.742 1142 HG23 ILE 54 3HG2 ILE 54 -2.089 6.802 -17.095 1143 HD11 ILE 54 1HD1 ILE 54 -1.521 6.340 -12.087 1144 HD12 ILE 54 2HD1 ILE 54 -1.156 7.783 -13.034 1145 HD13 ILE 54 3HD1 ILE 54 -0.781 6.183 -13.681 1146 HA PRO 55 HA PRO 55 -2.391 11.084 -18.670 1147 HB2 PRO 55 2HB PRO 55 -0.064 10.412 -19.953 1148 HB3 PRO 55 1HB PRO 55 -0.177 11.703 -18.753 1149 HG2 PRO 55 2HG PRO 55 0.768 8.889 -18.422 1150 HG3 PRO 55 1HG PRO 55 1.450 10.385 -17.758 1151 HD2 PRO 55 2HD PRO 55 -0.057 8.731 -16.285 1152 HD3 PRO 55 1HD PRO 55 -0.115 10.493 -16.057 1153 H ARG 56 H ARG 56 -3.286 10.508 -20.545 1154 HA ARG 56 HA ARG 56 -3.771 7.692 -20.936 1155 HB2 ARG 56 2HB ARG 56 -4.848 10.042 -22.511 1156 HB3 ARG 56 1HB ARG 56 -5.433 8.384 -22.589 1157 HG2 ARG 56 2HG ARG 56 -6.148 8.508 -20.263 1158 HG3 ARG 56 1HG ARG 56 -5.515 10.149 -20.152 1159 HD2 ARG 56 2HD ARG 56 -7.096 10.828 -21.926 1160 HD3 ARG 56 1HD ARG 56 -7.769 9.196 -21.911 1161 HE ARG 56 HE ARG 56 -7.784 10.212 -19.316 1162 HH11 ARG 56 1HH1 ARG 56 -9.428 10.737 -22.405 1163 HH12 ARG 56 2HH1 ARG 56 -10.854 11.371 -21.724 1164 HH21 ARG 56 1HH2 ARG 56 -9.764 11.146 -18.352 1165 HH22 ARG 56 2HH2 ARG 56 -11.041 11.599 -19.380 1166 H TYR 57 H TYR 57 -1.619 7.228 -21.442 1167 HA TYR 57 HA TYR 57 -0.720 7.940 -24.139 1168 HB2 TYR 57 2HB TYR 57 0.943 8.211 -22.429 1169 HB3 TYR 57 1HB TYR 57 0.696 6.568 -21.862 1170 HD1 TYR 57 1HD TYR 57 1.755 8.456 -24.898 1171 HD2 TYR 57 2HD TYR 57 2.095 4.875 -22.640 1172 HE1 TYR 57 1HE TYR 57 3.534 7.717 -26.373 1173 HE2 TYR 57 2HE TYR 57 3.875 4.095 -24.119 1174 HH TYR 57 HH TYR 57 4.683 4.508 -26.361 1175 H GLN 58 H GLN 58 -1.375 5.073 -22.158 1176 HA GLN 58 HA GLN 58 -1.561 3.496 -24.622 1177 HB2 GLN 58 2HB GLN 58 0.688 3.256 -23.250 1178 HB3 GLN 58 1HB GLN 58 -0.340 2.436 -22.080 1179 HG2 GLN 58 2HG GLN 58 -0.956 0.782 -23.836 1180 HG3 GLN 58 1HG GLN 58 0.173 1.622 -24.906 1181 HE21 GLN 58 1HE2 GLN 58 0.038 -1.064 -23.858 1182 HE22 GLN 58 2HE2 GLN 58 1.587 -1.401 -23.164 1183 H ASP 59 H ASP 59 -2.507 1.223 -23.771 1184 HA ASP 59 HA ASP 59 -5.055 1.552 -22.739 1185 HB2 ASP 59 2HB ASP 59 -5.078 -0.934 -22.576 1186 HB3 ASP 59 1HB ASP 59 -4.483 -0.351 -24.125 1187 H ALA 60 H ALA 60 -2.167 1.544 -21.100 1188 HA ALA 60 HA ALA 60 -2.472 0.285 -18.673 1189 HB1 ALA 60 1HB ALA 60 -0.857 1.838 -17.785 1190 HB2 ALA 60 2HB ALA 60 -1.217 2.983 -19.072 1191 HB3 ALA 60 3HB ALA 60 -0.438 1.456 -19.456 1192 H ARG 61 H ARG 61 -3.452 3.668 -19.365 1193 HA ARG 61 HA ARG 61 -4.482 4.248 -16.868 1194 HB2 ARG 61 2HB ARG 61 -3.847 5.915 -18.568 1195 HB3 ARG 61 1HB ARG 61 -5.140 5.382 -19.606 1196 HG2 ARG 61 2HG ARG 61 -5.606 6.648 -16.905 1197 HG3 ARG 61 1HG ARG 61 -5.474 7.578 -18.393 1198 HD2 ARG 61 2HD ARG 61 -7.395 6.320 -19.296 1199 HD3 ARG 61 1HD ARG 61 -7.514 5.450 -17.769 1200 HE ARG 61 HE ARG 61 -7.601 8.129 -17.171 1201 HH11 ARG 61 1HH1 ARG 61 -9.502 5.858 -19.122 1202 HH12 ARG 61 2HH1 ARG 61 -10.977 6.673 -18.857 1203 HH21 ARG 61 1HH2 ARG 61 -9.703 9.226 -16.803 1204 HH22 ARG 61 2HH2 ARG 61 -11.089 8.560 -17.532 1205 H ASN 62 H ASN 62 -6.034 2.716 -19.669 1206 HA ASN 62 HA ASN 62 -8.610 2.716 -18.429 1207 HB2 ASN 62 2HB ASN 62 -7.589 1.300 -20.888 1208 HB3 ASN 62 1HB ASN 62 -9.219 1.056 -20.275 1209 HD21 ASN 62 1HD2 ASN 62 -8.352 2.159 -22.790 1210 HD22 ASN 62 2HD2 ASN 62 -9.023 3.754 -22.878 1211 H LEU 63 H LEU 63 -5.932 0.546 -18.493 1212 HA LEU 63 HA LEU 63 -7.228 -1.760 -17.459 1213 HB2 LEU 63 2HB LEU 63 -4.395 -0.794 -17.102 1214 HB3 LEU 63 1HB LEU 63 -4.951 -2.404 -16.687 1215 HG LEU 63 HG LEU 63 -4.828 -1.231 -19.469 1216 HD11 LEU 63 1HD1 LEU 63 -2.612 -1.661 -18.522 1217 HD12 LEU 63 2HD1 LEU 63 -2.999 -2.794 -19.809 1218 HD13 LEU 63 3HD1 LEU 63 -3.100 -3.312 -18.130 1219 HD21 LEU 63 1HD2 LEU 63 -5.316 -3.501 -20.204 1220 HD22 LEU 63 2HD2 LEU 63 -6.636 -2.869 -19.214 1221 HD23 LEU 63 3HD2 LEU 63 -5.477 -4.016 -18.526 1222 H ILE 64 H ILE 64 -5.526 0.950 -16.010 1223 HA ILE 64 HA ILE 64 -5.861 0.381 -13.328 1224 HB ILE 64 HB ILE 64 -5.648 2.968 -14.848 1225 HG12 ILE 64 2HG1 ILE 64 -3.662 1.394 -13.222 1226 HG13 ILE 64 1HG1 ILE 64 -3.718 1.510 -14.977 1227 HG21 ILE 64 1HG2 ILE 64 -5.107 4.084 -12.762 1228 HG22 ILE 64 2HG2 ILE 64 -5.522 2.607 -11.876 1229 HG23 ILE 64 3HG2 ILE 64 -6.761 3.472 -12.797 1230 HD11 ILE 64 1HD1 ILE 64 -1.992 2.936 -14.076 1231 HD12 ILE 64 2HD1 ILE 64 -3.180 3.744 -13.053 1232 HD13 ILE 64 3HD1 ILE 64 -3.272 3.899 -14.812 1233 H ARG 65 H ARG 65 -8.133 1.729 -15.639 1234 HA ARG 65 HA ARG 65 -9.987 2.132 -13.443 1235 HB2 ARG 65 2HB ARG 65 -10.103 3.183 -16.250 1236 HB3 ARG 65 1HB ARG 65 -11.435 3.330 -15.108 1237 HG2 ARG 65 2HG ARG 65 -8.678 4.505 -14.859 1238 HG3 ARG 65 1HG ARG 65 -10.218 5.361 -15.010 1239 HD2 ARG 65 2HD ARG 65 -9.285 3.698 -12.641 1240 HD3 ARG 65 1HD ARG 65 -9.495 5.420 -12.683 1241 HE ARG 65 HE ARG 65 -11.892 5.031 -12.999 1242 HH11 ARG 65 1HH1 ARG 65 -9.960 2.339 -11.487 1243 HH12 ARG 65 2HH1 ARG 65 -11.324 1.736 -10.685 1244 HH21 ARG 65 1HH2 ARG 65 -13.681 4.066 -11.780 1245 HH22 ARG 65 2HH2 ARG 65 -13.383 2.669 -10.836 1246 H ARG 66 H ARG 66 -9.190 -0.371 -14.874 1247 HA ARG 66 HA ARG 66 -11.919 -1.363 -15.257 1248 HB2 ARG 66 2HB ARG 66 -10.238 -1.684 -17.103 1249 HB3 ARG 66 1HB ARG 66 -9.281 -2.648 -16.000 1250 HG2 ARG 66 2HG ARG 66 -10.994 -4.324 -15.896 1251 HG3 ARG 66 1HG ARG 66 -12.079 -3.333 -16.883 1252 HD2 ARG 66 2HD ARG 66 -9.428 -4.502 -17.714 1253 HD3 ARG 66 1HD ARG 66 -11.031 -5.018 -18.256 1254 HE ARG 66 HE ARG 66 -10.856 -2.346 -18.855 1255 HH11 ARG 66 1HH1 ARG 66 -9.123 -5.272 -19.811 1256 HH12 ARG 66 2HH1 ARG 66 -8.638 -4.661 -21.318 1257 HH21 ARG 66 1HH2 ARG 66 -10.193 -1.483 -20.889 1258 HH22 ARG 66 2HH2 ARG 66 -9.275 -2.409 -21.954 1259 H HIS 67 H HIS 67 -9.763 -0.864 -12.902 1260 HA HIS 67 HA HIS 67 -10.630 -3.120 -11.261 1261 HB2 HIS 67 2HB HIS 67 -7.730 -2.232 -11.562 1262 HB3 HIS 67 1HB HIS 67 -8.301 -3.343 -10.339 1263 HD1 HIS 67 1HD HIS 67 -8.499 -5.787 -11.015 1264 HD2 HIS 67 2HD HIS 67 -7.649 -3.306 -14.227 1265 HE1 HIS 67 1HE HIS 67 -7.829 -7.320 -12.890 1266 HE2 HIS 67 2HE HIS 67 -7.696 -5.801 -14.881 1267 H GLU 68 H GLU 68 -10.469 -2.512 -8.914 1268 HA GLU 68 HA GLU 68 -10.542 0.385 -8.688 1269 HB2 GLU 68 2HB GLU 68 -11.570 -1.751 -6.839 1270 HB3 GLU 68 1HB GLU 68 -11.623 -0.030 -6.475 1271 HG2 GLU 68 2HG GLU 68 -12.963 -1.362 -8.825 1272 HG3 GLU 68 1HG GLU 68 -13.760 -0.867 -7.335 1273 H ARG 69 H ARG 69 -9.686 1.424 -6.802 1274 HA ARG 69 HA ARG 69 -6.901 1.002 -6.709 1275 HB2 ARG 69 2HB ARG 69 -8.501 2.879 -4.884 1276 HB3 ARG 69 1HB ARG 69 -6.801 2.916 -5.286 1277 HG2 ARG 69 2HG ARG 69 -7.172 4.044 -7.106 1278 HG3 ARG 69 1HG ARG 69 -8.398 2.894 -7.643 1279 HD2 ARG 69 2HD ARG 69 -8.781 5.161 -5.719 1280 HD3 ARG 69 1HD ARG 69 -9.415 5.062 -7.376 1281 HE ARG 69 HE ARG 69 -10.318 3.649 -5.009 1282 HH11 ARG 69 1HH1 ARG 69 -10.733 4.142 -8.518 1283 HH12 ARG 69 2HH1 ARG 69 -12.236 3.341 -8.546 1284 HH21 ARG 69 1HH2 ARG 69 -12.412 2.566 -5.130 1285 HH22 ARG 69 2HH2 ARG 69 -13.177 2.451 -6.657 1286 H ASP 70 H ASP 70 -9.449 0.306 -4.340 1287 HA ASP 70 HA ASP 70 -7.684 -0.365 -2.252 1288 HB2 ASP 70 2HB ASP 70 -9.577 -1.360 -1.092 1289 HB3 ASP 70 1HB ASP 70 -10.113 0.115 -1.868 1290 H GLU 71 H GLU 71 -9.087 -2.253 -4.822 1291 HA GLU 71 HA GLU 71 -8.220 -4.790 -3.933 1292 HB2 GLU 71 2HB GLU 71 -8.679 -3.862 -6.768 1293 HB3 GLU 71 1HB GLU 71 -8.630 -5.528 -6.220 1294 HG2 GLU 71 2HG GLU 71 -10.639 -5.141 -4.883 1295 HG3 GLU 71 1HG GLU 71 -10.672 -3.468 -5.439 1296 H ILE 72 H ILE 72 -6.852 -2.438 -6.186 1297 HA ILE 72 HA ILE 72 -4.516 -3.856 -6.876 1298 HB ILE 72 HB ILE 72 -5.009 -0.862 -6.830 1299 HG12 ILE 72 2HG1 ILE 72 -5.165 -2.852 -9.111 1300 HG13 ILE 72 1HG1 ILE 72 -6.539 -2.108 -8.304 1301 HG21 ILE 72 1HG2 ILE 72 -2.791 -2.397 -8.193 1302 HG22 ILE 72 2HG2 ILE 72 -2.615 -1.302 -6.825 1303 HG23 ILE 72 3HG2 ILE 72 -3.115 -0.674 -8.397 1304 HD11 ILE 72 1HD1 ILE 72 -5.830 0.085 -9.126 1305 HD12 ILE 72 2HD1 ILE 72 -6.084 -1.052 -10.450 1306 HD13 ILE 72 3HD1 ILE 72 -4.446 -0.661 -9.924 1307 H MET 73 H MET 73 -5.199 -1.520 -4.334 1308 HA MET 73 HA MET 73 -2.589 -1.275 -3.362 1309 HB2 MET 73 2HB MET 73 -4.376 0.322 -2.861 1310 HB3 MET 73 1HB MET 73 -5.197 -0.901 -1.905 1311 HG2 MET 73 2HG MET 73 -3.990 0.693 -0.513 1312 HG3 MET 73 1HG MET 73 -3.354 -0.943 -0.336 1313 HE1 MET 73 1HE MET 73 -0.219 1.281 0.110 1314 HE2 MET 73 2HE MET 73 -1.227 0.013 0.814 1315 HE3 MET 73 3HE MET 73 -1.866 1.650 0.631 1316 H GLU 74 H GLU 74 -5.171 -3.548 -2.522 1317 HA GLU 74 HA GLU 74 -3.897 -4.835 -0.375 1318 HB2 GLU 74 2HB GLU 74 -5.663 -6.016 -2.503 1319 HB3 GLU 74 1HB GLU 74 -5.193 -6.836 -1.027 1320 HG2 GLU 74 2HG GLU 74 -6.393 -5.185 0.282 1321 HG3 GLU 74 1HG GLU 74 -6.832 -4.329 -1.203 1322 H GLU 75 H GLU 75 -3.836 -5.457 -3.839 1323 HA GLU 75 HA GLU 75 -2.157 -7.697 -3.845 1324 HB2 GLU 75 2HB GLU 75 -3.532 -6.863 -5.768 1325 HB3 GLU 75 1HB GLU 75 -2.383 -5.555 -5.968 1326 HG2 GLU 75 2HG GLU 75 -1.931 -7.264 -7.590 1327 HG3 GLU 75 1HG GLU 75 -0.617 -7.215 -6.417 1328 H LEU 76 H LEU 76 -1.453 -4.235 -4.098 1329 HA LEU 76 HA LEU 76 1.333 -4.350 -4.385 1330 HB2 LEU 76 2HB LEU 76 -0.341 -2.270 -2.979 1331 HB3 LEU 76 1HB LEU 76 1.343 -2.071 -3.407 1332 HG LEU 76 HG LEU 76 -0.925 -2.416 -5.373 1333 HD11 LEU 76 1HD1 LEU 76 -0.513 -0.076 -5.905 1334 HD12 LEU 76 2HD1 LEU 76 0.700 0.003 -4.627 1335 HD13 LEU 76 3HD1 LEU 76 -0.994 -0.268 -4.219 1336 HD21 LEU 76 1HD2 LEU 76 1.161 -3.309 -6.217 1337 HD22 LEU 76 2HD2 LEU 76 1.993 -1.816 -5.775 1338 HD23 LEU 76 3HD2 LEU 76 0.756 -1.803 -7.027 1339 H THR 77 H THR 77 -0.643 -4.056 -1.423 1340 HA THR 77 HA THR 77 1.494 -3.984 0.371 1341 HB THR 77 HB THR 77 -1.320 -5.022 0.825 1342 HG1 THR 77 1HG THR 77 -1.337 -2.883 -0.001 1343 HG21 THR 77 1HG2 THR 77 -0.944 -4.349 3.161 1344 HG22 THR 77 2HG2 THR 77 0.704 -3.860 2.756 1345 HG23 THR 77 3HG2 THR 77 0.234 -5.558 2.660 1346 H LYS 78 H LYS 78 -0.421 -6.692 -0.871 1347 HA LYS 78 HA LYS 78 0.752 -8.639 0.796 1348 HB2 LYS 78 2HB LYS 78 -0.785 -8.963 -1.767 1349 HB3 LYS 78 1HB LYS 78 -0.309 -10.296 -0.717 1350 HG2 LYS 78 2HG LYS 78 -1.565 -9.262 1.100 1351 HG3 LYS 78 1HG LYS 78 -2.092 -8.001 0.011 1352 HD2 LYS 78 2HD LYS 78 -2.665 -10.945 -0.363 1353 HD3 LYS 78 1HD LYS 78 -3.796 -9.787 0.322 1354 HE2 LYS 78 2HE LYS 78 -3.756 -8.534 -1.801 1355 HE3 LYS 78 1HE LYS 78 -2.654 -9.732 -2.475 1356 HZ1 LYS 78 1HZ LYS 78 -5.412 -10.243 -1.517 1357 HZ2 LYS 78 2HZ LYS 78 -4.374 -11.417 -2.132 1358 HZ3 LYS 78 3HZ LYS 78 -4.932 -10.173 -3.131 1359 H TYR 79 H TYR 79 1.297 -7.875 -2.596 1360 HA TYR 79 HA TYR 79 3.181 -9.939 -2.949 1361 HB2 TYR 79 2HB TYR 79 1.887 -8.852 -4.774 1362 HB3 TYR 79 1HB TYR 79 2.870 -7.412 -4.571 1363 HD1 TYR 79 1HD TYR 79 3.418 -11.066 -4.995 1364 HD2 TYR 79 2HD TYR 79 4.511 -7.140 -6.160 1365 HE1 TYR 79 1HE TYR 79 5.012 -12.002 -6.621 1366 HE2 TYR 79 2HE TYR 79 6.103 -8.054 -7.788 1367 HH TYR 79 HH TYR 79 6.089 -11.293 -8.721 1368 H TYR 80 H TYR 80 3.486 -6.629 -1.922 1369 HA TYR 80 HA TYR 80 6.277 -6.308 -2.048 1370 HB2 TYR 80 2HB TYR 80 4.651 -4.482 -1.638 1371 HB3 TYR 80 1HB TYR 80 4.285 -5.173 -0.070 1372 HD1 TYR 80 1HD TYR 80 6.566 -3.127 -1.986 1373 HD2 TYR 80 2HD TYR 80 5.978 -5.037 1.759 1374 HE1 TYR 80 1HE TYR 80 8.309 -1.712 -0.999 1375 HE2 TYR 80 2HE TYR 80 7.717 -3.621 2.765 1376 HH TYR 80 HH TYR 80 8.922 -0.871 1.251 1377 H LEU 81 H LEU 81 4.169 -7.327 0.617 1378 HA LEU 81 HA LEU 81 6.347 -7.898 2.356 1379 HB2 LEU 81 2HB LEU 81 3.424 -8.541 2.577 1380 HB3 LEU 81 1HB LEU 81 4.588 -8.859 3.851 1381 HG LEU 81 HG LEU 81 3.856 -6.133 2.763 1382 HD11 LEU 81 1HD1 LEU 81 3.190 -7.450 5.387 1383 HD12 LEU 81 2HD1 LEU 81 2.059 -7.139 4.071 1384 HD13 LEU 81 3HD1 LEU 81 2.799 -5.792 4.937 1385 HD21 LEU 81 1HD2 LEU 81 5.182 -5.268 4.636 1386 HD22 LEU 81 2HD2 LEU 81 6.182 -6.211 3.539 1387 HD23 LEU 81 3HD2 LEU 81 5.650 -6.911 5.067 1388 H ALA 82 H ALA 82 4.515 -9.807 0.075 1389 HA ALA 82 HA ALA 82 4.992 -12.345 1.081 1390 HB1 ALA 82 1HB ALA 82 4.789 -11.553 -1.821 1391 HB2 ALA 82 2HB ALA 82 3.428 -11.877 -0.742 1392 HB3 ALA 82 3HB ALA 82 4.562 -13.170 -1.148 1393 H ASN 83 H ASN 83 7.117 -10.231 -0.746 1394 HA ASN 83 HA ASN 83 8.975 -12.327 -1.327 1395 HB2 ASN 83 2HB ASN 83 9.298 -9.342 -1.568 1396 HB3 ASN 83 1HB ASN 83 10.616 -10.451 -1.883 1397 HD21 ASN 83 1HD2 ASN 83 7.220 -11.008 -2.730 1398 HD22 ASN 83 2HD2 ASN 83 7.487 -10.942 -4.433 1399 H HIS 84 H HIS 84 8.288 -10.969 1.552 1400 HA HIS 84 HA HIS 84 11.056 -11.170 2.472 1401 HB2 HIS 84 2HB HIS 84 8.586 -10.283 3.996 1402 HB3 HIS 84 1HB HIS 84 10.210 -10.339 4.665 1403 HD1 HIS 84 1HD HIS 84 11.813 -8.943 2.460 1404 HD2 HIS 84 2HD HIS 84 8.074 -7.650 3.738 1405 HE1 HIS 84 1HE HIS 84 11.689 -6.539 1.828 1406 HE2 HIS 84 2HE HIS 84 9.667 -5.727 3.006 1407 H GLY 85 H GLY 85 9.043 -13.362 1.658 1408 HA2 GLY 85 2HA GLY 85 8.959 -15.604 2.202 1409 HA3 GLY 85 1HA GLY 85 9.958 -15.262 3.611 1410 H ILE 86 H ILE 86 7.148 -13.403 3.094 1411 HA ILE 86 HA ILE 86 5.971 -14.528 5.505 1412 HB ILE 86 HB ILE 86 5.312 -11.993 3.979 1413 HG12 ILE 86 2HG1 ILE 86 6.731 -12.406 6.616 1414 HG13 ILE 86 1HG1 ILE 86 7.481 -11.909 5.105 1415 HG21 ILE 86 1HG2 ILE 86 3.903 -11.403 5.903 1416 HG22 ILE 86 2HG2 ILE 86 4.233 -12.980 6.621 1417 HG23 ILE 86 3HG2 ILE 86 3.331 -12.870 5.111 1418 HD11 ILE 86 1HD1 ILE 86 7.156 -10.031 6.606 1419 HD12 ILE 86 2HD1 ILE 86 5.419 -10.373 6.644 1420 HD13 ILE 86 3HD1 ILE 86 6.181 -9.852 5.139 1421 H ASP 87 H ASP 87 4.179 -15.670 5.445 1422 HA ASP 87 HA ASP 87 2.950 -16.209 2.870 1423 HB2 ASP 87 2HB ASP 87 2.546 -17.464 5.587 1424 HB3 ASP 87 1HB ASP 87 1.548 -17.860 4.201 1425 H ILE 88 H ILE 88 1.328 -15.090 2.208 1426 HA ILE 88 HA ILE 88 -0.305 -13.809 4.237 1427 HB ILE 88 HB ILE 88 0.115 -12.984 1.356 1428 HG12 ILE 88 2HG1 ILE 88 1.092 -11.793 3.952 1429 HG13 ILE 88 1HG1 ILE 88 2.069 -12.614 2.754 1430 HG21 ILE 88 1HG2 ILE 88 -1.420 -11.626 3.566 1431 HG22 ILE 88 2HG2 ILE 88 -2.141 -12.440 2.174 1432 HG23 ILE 88 3HG2 ILE 88 -1.157 -10.994 1.942 1433 HD11 ILE 88 1HD1 ILE 88 2.315 -10.209 2.659 1434 HD12 ILE 88 2HD1 ILE 88 0.591 -10.041 2.334 1435 HD13 ILE 88 3HD1 ILE 88 1.628 -10.849 1.160 1436 H LYS 89 H LYS 89 -2.354 -14.148 4.268 1437 HA LYS 89 HA LYS 89 -3.288 -16.509 2.825 1438 HB2 LYS 89 2HB LYS 89 -4.344 -15.167 5.314 1439 HB3 LYS 89 1HB LYS 89 -4.827 -16.739 4.680 1440 HG2 LYS 89 2HG LYS 89 -2.668 -17.662 5.139 1441 HG3 LYS 89 1HG LYS 89 -2.037 -16.077 5.581 1442 HD2 LYS 89 2HD LYS 89 -3.633 -16.020 7.475 1443 HD3 LYS 89 1HD LYS 89 -4.154 -17.650 7.042 1444 HE2 LYS 89 2HE LYS 89 -1.905 -18.494 7.394 1445 HE3 LYS 89 1HE LYS 89 -1.335 -16.866 7.740 1446 HZ1 LYS 89 1HZ LYS 89 -3.302 -18.389 9.364 1447 HZ2 LYS 89 2HZ LYS 89 -2.738 -16.834 9.715 1448 HZ3 LYS 89 3HZ LYS 89 -1.694 -18.146 9.746 Start of MODEL 3 1 H1 MET 1 1HT MET 1 -24.987 9.311 9.313 2 H2 MET 1 2HT MET 1 -25.398 9.265 7.681 3 H3 MET 1 3HT MET 1 -26.093 10.420 8.724 4 HA MET 1 HA MET 1 -23.231 10.238 8.067 5 HB2 MET 1 2HB MET 1 -23.578 12.365 6.875 6 HB3 MET 1 1HB MET 1 -24.503 11.051 6.159 7 HG2 MET 1 2HG MET 1 -26.522 11.861 7.251 8 HG3 MET 1 1HG MET 1 -25.600 13.158 8.011 9 HE1 MET 1 1HE MET 1 -26.893 11.653 4.620 10 HE2 MET 1 2HE MET 1 -25.156 11.798 4.316 11 HE3 MET 1 3HE MET 1 -26.291 12.831 3.457 12 H GLY 2 H GLY 2 -22.009 12.083 8.933 13 HA2 GLY 2 2HA GLY 2 -22.556 14.073 10.489 14 HA3 GLY 2 1HA GLY 2 -23.065 12.758 11.553 15 H PHE 3 H PHE 3 -21.120 14.291 12.497 16 HA PHE 3 HA PHE 3 -18.581 13.308 11.636 17 HB2 PHE 3 2HB PHE 3 -17.569 14.712 13.395 18 HB3 PHE 3 1HB PHE 3 -18.683 15.615 12.397 19 HD1 PHE 3 1HD PHE 3 -20.742 16.499 13.346 20 HD2 PHE 3 2HD PHE 3 -17.997 14.296 15.733 21 HE1 PHE 3 1HE PHE 3 -21.836 17.332 15.376 22 HE2 PHE 3 2HE PHE 3 -19.087 15.132 17.771 23 HZ PHE 3 HZ PHE 3 -21.011 16.650 17.593 24 H THR 4 H THR 4 -17.622 11.565 12.216 25 HA THR 4 HA THR 4 -18.546 10.114 14.548 26 HB THR 4 HB THR 4 -16.484 9.358 12.450 27 HG1 THR 4 1HG THR 4 -19.262 9.322 12.515 28 HG21 THR 4 1HG2 THR 4 -16.357 8.063 14.541 29 HG22 THR 4 2HG2 THR 4 -16.941 7.061 13.209 30 HG23 THR 4 3HG2 THR 4 -18.075 7.685 14.410 31 H ASP 5 H ASP 5 -17.391 10.230 16.430 32 HA ASP 5 HA ASP 5 -15.083 11.886 16.414 33 HB2 ASP 5 2HB ASP 5 -14.995 11.700 18.882 34 HB3 ASP 5 1HB ASP 5 -16.589 12.151 18.319 35 H GLU 6 H GLU 6 -13.669 10.942 15.197 36 HA GLU 6 HA GLU 6 -12.296 8.566 16.227 37 HB2 GLU 6 2HB GLU 6 -12.128 10.002 13.562 38 HB3 GLU 6 1HB GLU 6 -11.197 8.578 13.989 39 HG2 GLU 6 2HG GLU 6 -14.208 8.675 13.827 40 HG3 GLU 6 1HG GLU 6 -13.152 8.110 12.535 41 H THR 7 H THR 7 -10.703 9.187 17.611 42 HA THR 7 HA THR 7 -9.742 11.864 17.448 43 HB THR 7 HB THR 7 -10.186 11.021 19.672 44 HG1 THR 7 1HG THR 7 -8.303 12.429 19.260 45 HG21 THR 7 1HG2 THR 7 -8.826 9.226 20.692 46 HG22 THR 7 2HG2 THR 7 -8.068 8.929 19.130 47 HG23 THR 7 3HG2 THR 7 -9.798 8.638 19.350 48 H VAL 8 H VAL 8 -7.874 12.573 16.761 49 HA VAL 8 HA VAL 8 -6.081 10.633 15.500 50 HB VAL 8 HB VAL 8 -7.111 12.432 14.058 51 HG11 VAL 8 1HG1 VAL 8 -6.303 14.744 14.230 52 HG12 VAL 8 2HG1 VAL 8 -5.486 14.324 15.735 53 HG13 VAL 8 3HG1 VAL 8 -7.244 14.242 15.636 54 HG21 VAL 8 1HG2 VAL 8 -5.016 11.412 13.358 55 HG22 VAL 8 2HG2 VAL 8 -4.104 12.572 14.326 56 HG23 VAL 8 3HG2 VAL 8 -5.027 13.122 12.928 57 H ARG 9 H ARG 9 -3.809 10.951 15.886 58 HA ARG 9 HA ARG 9 -3.313 12.346 18.415 59 HB2 ARG 9 2HB ARG 9 -1.627 10.218 17.040 60 HB3 ARG 9 1HB ARG 9 -1.296 10.946 18.607 61 HG2 ARG 9 2HG ARG 9 -3.725 9.285 17.959 62 HG3 ARG 9 1HG ARG 9 -2.276 8.675 18.750 63 HD2 ARG 9 2HD ARG 9 -4.071 10.873 19.810 64 HD3 ARG 9 1HD ARG 9 -4.086 9.195 20.349 65 HE ARG 9 HE ARG 9 -1.489 10.102 20.629 66 HH11 ARG 9 1HH1 ARG 9 -4.639 10.882 22.029 67 HH12 ARG 9 2HH1 ARG 9 -4.005 11.434 23.506 68 HH21 ARG 9 1HH2 ARG 9 -0.634 10.838 22.653 69 HH22 ARG 9 2HH2 ARG 9 -1.679 11.409 23.874 70 H PHE 10 H PHE 10 -1.120 11.444 15.803 71 HA PHE 10 HA PHE 10 -1.006 13.532 14.200 72 HB2 PHE 10 2HB PHE 10 0.990 14.873 14.848 73 HB3 PHE 10 1HB PHE 10 -0.291 15.065 16.019 74 HD1 PHE 10 1HD PHE 10 0.023 14.371 18.280 75 HD2 PHE 10 2HD PHE 10 3.040 13.635 15.389 76 HE1 PHE 10 1HE PHE 10 1.633 13.879 20.090 77 HE2 PHE 10 2HE PHE 10 4.650 13.134 17.181 78 HZ PHE 10 HZ PHE 10 3.942 13.260 19.534 79 H ASP 11 H ASP 11 0.411 13.078 12.554 80 HA ASP 11 HA ASP 11 1.857 10.560 12.957 81 HB2 ASP 11 2HB ASP 11 1.000 11.825 10.327 82 HB3 ASP 11 1HB ASP 11 1.694 10.230 10.549 83 H PHE 12 H PHE 12 3.920 10.370 11.959 84 HA PHE 12 HA PHE 12 5.385 12.896 12.150 85 HB2 PHE 12 2HB PHE 12 6.420 10.078 12.035 86 HB3 PHE 12 1HB PHE 12 7.384 11.511 12.269 87 HD1 PHE 12 1HD PHE 12 5.032 9.195 13.874 88 HD2 PHE 12 2HD PHE 12 7.411 12.694 14.373 89 HE1 PHE 12 1HE PHE 12 4.777 9.018 16.306 90 HE2 PHE 12 2HE PHE 12 7.157 12.518 16.809 91 HZ PHE 12 HZ PHE 12 5.841 10.679 17.779 92 H ASP 13 H ASP 13 7.543 12.628 10.640 93 HA ASP 13 HA ASP 13 6.574 11.985 7.952 94 HB2 ASP 13 2HB ASP 13 6.647 14.433 8.270 95 HB3 ASP 13 1HB ASP 13 8.325 14.317 8.770 96 H ASP 14 H ASP 14 7.849 10.650 6.861 97 HA ASP 14 HA ASP 14 10.675 10.479 7.317 98 HB2 ASP 14 2HB ASP 14 9.677 9.024 9.138 99 HB3 ASP 14 1HB ASP 14 8.908 8.068 7.881 100 H ASN 15 H ASN 15 11.647 9.433 5.510 101 HA ASN 15 HA ASN 15 9.897 9.633 3.201 102 HB2 ASN 15 2HB ASN 15 12.898 9.587 3.386 103 HB3 ASN 15 1HB ASN 15 11.984 9.779 1.894 104 HD21 ASN 15 1HD2 ASN 15 10.831 11.700 1.561 105 HD22 ASN 15 2HD2 ASN 15 11.137 13.115 2.488 106 H ARG 16 H ARG 16 10.329 8.253 1.251 107 HA ARG 16 HA ARG 16 9.875 5.567 1.964 108 HB2 ARG 16 2HB ARG 16 9.681 5.104 -0.445 109 HB3 ARG 16 1HB ARG 16 8.733 6.509 0.018 110 HG2 ARG 16 2HG ARG 16 10.437 7.966 -0.923 111 HG3 ARG 16 1HG ARG 16 11.432 6.567 -1.324 112 HD2 ARG 16 2HD ARG 16 9.562 5.757 -2.772 113 HD3 ARG 16 1HD ARG 16 8.724 7.278 -2.453 114 HE ARG 16 HE ARG 16 11.259 7.931 -3.339 115 HH11 ARG 16 1HH1 ARG 16 8.353 6.435 -4.700 116 HH12 ARG 16 2HH1 ARG 16 8.797 6.809 -6.314 117 HH21 ARG 16 1HH2 ARG 16 11.811 8.412 -5.530 118 HH22 ARG 16 2HH2 ARG 16 10.764 7.941 -6.786 119 H LYS 17 H LYS 17 11.409 4.442 2.814 120 HA LYS 17 HA LYS 17 13.623 3.642 1.157 121 HB2 LYS 17 2HB LYS 17 14.043 4.742 3.964 122 HB3 LYS 17 1HB LYS 17 15.264 3.866 3.059 123 HG2 LYS 17 2HG LYS 17 15.203 5.620 1.331 124 HG3 LYS 17 1HG LYS 17 14.027 6.499 2.297 125 HD2 LYS 17 2HD LYS 17 15.684 6.693 4.097 126 HD3 LYS 17 1HD LYS 17 16.850 5.817 3.095 127 HE2 LYS 17 2HE LYS 17 16.633 7.549 1.364 128 HE3 LYS 17 1HE LYS 17 15.541 8.441 2.410 129 HZ1 LYS 17 1HZ LYS 17 17.305 8.692 4.015 130 HZ2 LYS 17 2HZ LYS 17 17.794 9.297 2.522 131 HZ3 LYS 17 3HZ LYS 17 18.363 7.800 3.059 132 H LYS 18 H LYS 18 14.817 1.785 2.475 133 HA LYS 18 HA LYS 18 12.805 -0.137 3.089 134 HB2 LYS 18 2HB LYS 18 15.808 -0.328 3.268 135 HB3 LYS 18 1HB LYS 18 14.725 -1.689 3.532 136 HG2 LYS 18 2HG LYS 18 13.853 -1.393 1.234 137 HG3 LYS 18 1HG LYS 18 15.023 -0.102 0.990 138 HD2 LYS 18 2HD LYS 18 15.706 -2.969 1.647 139 HD3 LYS 18 1HD LYS 18 15.751 -2.259 0.037 140 HE2 LYS 18 2HE LYS 18 17.448 -0.655 0.829 141 HE3 LYS 18 1HE LYS 18 17.418 -1.438 2.410 142 HZ1 LYS 18 1HZ LYS 18 18.185 -3.482 1.374 143 HZ2 LYS 18 2HZ LYS 18 19.255 -2.229 1.035 144 HZ3 LYS 18 3HZ LYS 18 18.192 -2.749 -0.141 145 H ALA 19 H ALA 19 13.702 2.221 4.890 146 HA ALA 19 HA ALA 19 13.916 1.038 7.481 147 HB1 ALA 19 1HB ALA 19 14.574 3.335 7.030 148 HB2 ALA 19 2HB ALA 19 13.253 3.273 8.237 149 HB3 ALA 19 3HB ALA 19 12.890 3.657 6.554 150 H ILE 20 H ILE 20 11.426 1.996 5.259 151 HA ILE 20 HA ILE 20 9.203 1.889 7.010 152 HB ILE 20 HB ILE 20 9.321 1.711 3.982 153 HG12 ILE 20 2HG1 ILE 20 8.856 4.083 5.799 154 HG13 ILE 20 1HG1 ILE 20 10.287 3.790 4.820 155 HG21 ILE 20 1HG2 ILE 20 6.972 2.307 5.785 156 HG22 ILE 20 2HG2 ILE 20 7.205 0.855 4.806 157 HG23 ILE 20 3HG2 ILE 20 6.976 2.421 4.025 158 HD11 ILE 20 1HD1 ILE 20 8.854 5.449 3.789 159 HD12 ILE 20 2HD1 ILE 20 7.509 4.311 3.797 160 HD13 ILE 20 3HD1 ILE 20 8.922 3.988 2.796 161 H SER 21 H SER 21 10.917 -0.397 5.061 162 HA SER 21 HA SER 21 8.847 -2.350 4.953 163 HB2 SER 21 2HB SER 21 10.626 -3.953 4.241 164 HB3 SER 21 1HB SER 21 10.606 -2.470 3.293 165 HG SER 21 HG SER 21 12.429 -3.169 5.381 166 H GLU 22 H GLU 22 11.286 -1.607 7.215 167 HA GLU 22 HA GLU 22 11.036 -4.013 8.722 168 HB2 GLU 22 2HB GLU 22 12.113 -1.351 9.644 169 HB3 GLU 22 1HB GLU 22 12.464 -2.938 10.321 170 HG2 GLU 22 2HG GLU 22 13.327 -1.846 7.658 171 HG3 GLU 22 1HG GLU 22 14.342 -2.287 9.032 172 H THR 23 H THR 23 9.581 -0.865 8.671 173 HA THR 23 HA THR 23 8.263 -0.876 11.136 174 HB THR 23 HB THR 23 7.460 0.376 8.507 175 HG1 THR 23 1HG THR 23 9.391 0.949 10.381 176 HG21 THR 23 1HG2 THR 23 5.630 0.375 10.110 177 HG22 THR 23 2HG2 THR 23 6.275 2.002 9.905 178 HG23 THR 23 3HG2 THR 23 6.690 1.063 11.342 179 H LEU 24 H LEU 24 7.134 -1.745 7.864 180 HA LEU 24 HA LEU 24 4.636 -2.646 8.805 181 HB2 LEU 24 2HB LEU 24 5.932 -2.871 6.100 182 HB3 LEU 24 1HB LEU 24 4.416 -3.672 6.443 183 HG LEU 24 HG LEU 24 3.363 -1.488 6.924 184 HD11 LEU 24 1HD1 LEU 24 4.471 0.599 6.341 185 HD12 LEU 24 2HD1 LEU 24 5.979 -0.279 6.090 186 HD13 LEU 24 3HD1 LEU 24 5.253 -0.218 7.695 187 HD21 LEU 24 1HD2 LEU 24 3.330 -0.628 4.632 188 HD22 LEU 24 2HD2 LEU 24 3.188 -2.380 4.685 189 HD23 LEU 24 3HD2 LEU 24 4.726 -1.631 4.243 190 H GLU 25 H GLU 25 7.654 -4.254 8.361 191 HA GLU 25 HA GLU 25 6.856 -6.917 8.431 192 HB2 GLU 25 2HB GLU 25 9.170 -6.025 8.051 193 HB3 GLU 25 1HB GLU 25 9.254 -5.598 9.741 194 HG2 GLU 25 2HG GLU 25 8.998 -8.412 8.696 195 HG3 GLU 25 1HG GLU 25 10.521 -7.633 9.098 196 H THR 26 H THR 26 7.607 -4.626 11.078 197 HA THR 26 HA THR 26 6.947 -6.309 13.217 198 HB THR 26 HB THR 26 6.914 -3.275 13.103 199 HG1 THR 26 1HG THR 26 9.101 -3.686 14.040 200 HG21 THR 26 1HG2 THR 26 7.347 -3.422 15.514 201 HG22 THR 26 2HG2 THR 26 7.273 -5.185 15.418 202 HG23 THR 26 3HG2 THR 26 5.831 -4.227 15.088 203 H VAL 27 H VAL 27 5.074 -3.905 11.410 204 HA VAL 27 HA VAL 27 2.731 -3.951 12.958 205 HB VAL 27 HB VAL 27 2.989 -3.418 9.970 206 HG11 VAL 27 1HG1 VAL 27 0.691 -3.914 10.599 207 HG12 VAL 27 2HG1 VAL 27 0.875 -2.204 10.190 208 HG13 VAL 27 3HG1 VAL 27 0.778 -2.702 11.881 209 HG21 VAL 27 1HG2 VAL 27 2.922 -1.484 12.291 210 HG22 VAL 27 2HG2 VAL 27 2.997 -1.058 10.582 211 HG23 VAL 27 3HG2 VAL 27 4.347 -1.902 11.339 212 H TYR 28 H TYR 28 3.789 -5.994 10.306 213 HA TYR 28 HA TYR 28 1.453 -7.430 9.806 214 HB2 TYR 28 2HB TYR 28 3.472 -7.593 8.383 215 HB3 TYR 28 1HB TYR 28 4.320 -8.431 9.675 216 HD1 TYR 28 1HD TYR 28 3.739 -10.773 10.219 217 HD2 TYR 28 2HD TYR 28 1.856 -8.744 6.993 218 HE1 TYR 28 1HE TYR 28 2.906 -12.918 9.365 219 HE2 TYR 28 2HE TYR 28 1.019 -10.894 6.123 220 HH TYR 28 HH TYR 28 1.112 -13.716 8.009 221 H ARG 29 H ARG 29 4.093 -8.211 12.008 222 HA ARG 29 HA ARG 29 2.898 -10.539 13.023 223 HB2 ARG 29 2HB ARG 29 5.114 -8.817 14.067 224 HB3 ARG 29 1HB ARG 29 4.580 -10.273 14.900 225 HG2 ARG 29 2HG ARG 29 5.137 -11.628 12.974 226 HG3 ARG 29 1HG ARG 29 5.564 -10.187 12.052 227 HD2 ARG 29 2HD ARG 29 6.926 -10.975 14.621 228 HD3 ARG 29 1HD ARG 29 7.493 -11.464 13.023 229 HE ARG 29 HE ARG 29 7.876 -9.211 12.493 230 HH11 ARG 29 1HH1 ARG 29 7.184 -9.715 15.950 231 HH12 ARG 29 2HH1 ARG 29 8.033 -8.350 16.457 232 HH21 ARG 29 1HH2 ARG 29 9.074 -7.401 13.189 233 HH22 ARG 29 2HH2 ARG 29 9.176 -6.969 14.842 234 H ALA 30 H ALA 30 2.705 -7.218 14.111 235 HA ALA 30 HA ALA 30 1.448 -7.707 16.594 236 HB1 ALA 30 1HB ALA 30 2.407 -5.529 15.991 237 HB2 ALA 30 2HB ALA 30 0.721 -5.367 16.481 238 HB3 ALA 30 3HB ALA 30 1.151 -5.317 14.771 239 H LEU 31 H LEU 31 0.196 -7.300 13.355 240 HA LEU 31 HA LEU 31 -2.540 -7.400 14.129 241 HB2 LEU 31 2HB LEU 31 -1.223 -7.663 11.439 242 HB3 LEU 31 1HB LEU 31 -2.960 -7.563 11.680 243 HG LEU 31 HG LEU 31 -1.024 -5.466 12.574 244 HD11 LEU 31 1HD1 LEU 31 -2.850 -5.439 10.193 245 HD12 LEU 31 2HD1 LEU 31 -1.067 -5.558 10.133 246 HD13 LEU 31 3HD1 LEU 31 -1.859 -4.104 10.740 247 HD21 LEU 31 1HD2 LEU 31 -3.061 -4.091 12.713 248 HD22 LEU 31 2HD2 LEU 31 -2.985 -5.407 13.886 249 HD23 LEU 31 3HD2 LEU 31 -4.005 -5.544 12.448 250 H GLU 32 H GLU 32 -0.211 -9.766 13.053 251 HA GLU 32 HA GLU 32 -1.981 -11.919 12.738 252 HB2 GLU 32 2HB GLU 32 0.924 -11.879 13.574 253 HB3 GLU 32 1HB GLU 32 0.037 -13.358 13.244 254 HG2 GLU 32 2HG GLU 32 0.391 -11.145 11.239 255 HG3 GLU 32 1HG GLU 32 1.474 -12.526 11.370 256 H GLU 33 H GLU 33 -0.309 -10.663 15.587 257 HA GLU 33 HA GLU 33 -1.133 -12.597 17.454 258 HB2 GLU 33 2HB GLU 33 -0.592 -9.658 17.875 259 HB3 GLU 33 1HB GLU 33 -0.767 -10.833 19.166 260 HG2 GLU 33 2HG GLU 33 1.383 -10.792 17.061 261 HG3 GLU 33 1HG GLU 33 1.562 -10.316 18.747 262 H LYS 34 H LYS 34 -2.703 -9.713 16.272 263 HA LYS 34 HA LYS 34 -4.941 -9.994 18.087 264 HB2 LYS 34 2HB LYS 34 -4.305 -8.075 15.888 265 HB3 LYS 34 1HB LYS 34 -5.891 -8.112 16.633 266 HG2 LYS 34 2HG LYS 34 -3.304 -7.636 18.102 267 HG3 LYS 34 1HG LYS 34 -4.419 -6.372 17.563 268 HD2 LYS 34 2HD LYS 34 -6.208 -7.543 18.920 269 HD3 LYS 34 1HD LYS 34 -4.905 -8.552 19.558 270 HE2 LYS 34 2HE LYS 34 -3.797 -6.638 20.469 271 HE3 LYS 34 1HE LYS 34 -4.999 -5.563 19.756 272 HZ1 LYS 34 1HZ LYS 34 -5.476 -7.578 21.883 273 HZ2 LYS 34 2HZ LYS 34 -6.684 -6.637 21.142 274 HZ3 LYS 34 3HZ LYS 34 -5.472 -5.896 22.035 275 H GLY 35 H GLY 35 -4.148 -11.414 15.172 276 HA2 GLY 35 2HA GLY 35 -5.368 -12.959 13.986 277 HA3 GLY 35 1HA GLY 35 -6.743 -12.618 15.026 278 H TYR 36 H TYR 36 -5.175 -9.985 13.418 279 HA TYR 36 HA TYR 36 -7.562 -9.580 11.750 280 HB2 TYR 36 2HB TYR 36 -5.122 -7.817 12.137 281 HB3 TYR 36 1HB TYR 36 -6.469 -7.429 11.096 282 HD1 TYR 36 1HD TYR 36 -4.980 -6.715 14.097 283 HD2 TYR 36 2HD TYR 36 -8.822 -7.515 12.481 284 HE1 TYR 36 1HE TYR 36 -6.021 -5.480 15.957 285 HE2 TYR 36 2HE TYR 36 -9.870 -6.288 14.336 286 HH TYR 36 HH TYR 36 -9.340 -5.606 16.609 287 H ASN 37 H ASN 37 -6.916 -8.673 9.498 288 HA ASN 37 HA ASN 37 -4.797 -10.359 8.394 289 HB2 ASN 37 2HB ASN 37 -6.940 -8.732 6.992 290 HB3 ASN 37 1HB ASN 37 -5.659 -9.596 6.161 291 HD21 ASN 37 1HD2 ASN 37 -8.505 -9.846 5.989 292 HD22 ASN 37 2HD2 ASN 37 -8.882 -11.490 6.348 293 HA PRO 38 HA PRO 38 -2.146 -6.821 9.165 294 HB2 PRO 38 2HB PRO 38 -0.769 -8.388 7.032 295 HB3 PRO 38 1HB PRO 38 -0.079 -7.552 8.429 296 HG2 PRO 38 2HG PRO 38 -0.502 -10.175 8.530 297 HG3 PRO 38 1HG PRO 38 -0.826 -9.156 9.936 298 HD2 PRO 38 2HD PRO 38 -2.729 -10.519 8.136 299 HD3 PRO 38 1HD PRO 38 -2.911 -9.944 9.816 300 H ILE 39 H ILE 39 -2.896 -7.979 5.942 301 HA ILE 39 HA ILE 39 -2.044 -5.652 4.586 302 HB ILE 39 HB ILE 39 -3.916 -7.835 3.675 303 HG12 ILE 39 2HG1 ILE 39 -1.748 -8.695 4.324 304 HG13 ILE 39 1HG1 ILE 39 -1.915 -8.741 2.574 305 HG21 ILE 39 1HG2 ILE 39 -3.333 -7.116 1.405 306 HG22 ILE 39 2HG2 ILE 39 -2.398 -5.777 2.073 307 HG23 ILE 39 3HG2 ILE 39 -4.146 -5.831 2.303 308 HD11 ILE 39 1HD1 ILE 39 -0.566 -6.685 2.423 309 HD12 ILE 39 2HD1 ILE 39 0.306 -8.015 3.160 310 HD13 ILE 39 3HD1 ILE 39 -0.333 -6.720 4.171 311 H ASN 40 H ASN 40 -5.265 -6.766 5.580 312 HA ASN 40 HA ASN 40 -6.744 -4.711 4.342 313 HB2 ASN 40 2HB ASN 40 -7.450 -6.260 6.846 314 HB3 ASN 40 1HB ASN 40 -8.558 -5.260 5.929 315 HD21 ASN 40 1HD2 ASN 40 -7.446 -6.249 3.299 316 HD22 ASN 40 2HD2 ASN 40 -8.047 -7.838 3.179 317 H GLN 41 H GLN 41 -5.185 -4.913 7.450 318 HA GLN 41 HA GLN 41 -6.375 -2.522 8.442 319 HB2 GLN 41 2HB GLN 41 -3.904 -3.913 9.451 320 HB3 GLN 41 1HB GLN 41 -4.883 -2.746 10.330 321 HG2 GLN 41 2HG GLN 41 -5.766 -5.485 9.438 322 HG3 GLN 41 1HG GLN 41 -5.352 -5.019 11.080 323 HE21 GLN 41 1HE2 GLN 41 -6.740 -2.428 10.924 324 HE22 GLN 41 2HE2 GLN 41 -8.420 -2.803 10.935 325 H ILE 42 H ILE 42 -3.230 -3.288 6.950 326 HA ILE 42 HA ILE 42 -2.151 -0.704 7.281 327 HB ILE 42 HB ILE 42 -1.427 -2.826 5.228 328 HG12 ILE 42 2HG1 ILE 42 -0.089 -2.058 7.841 329 HG13 ILE 42 1HG1 ILE 42 -1.092 -3.480 7.596 330 HG21 ILE 42 1HG2 ILE 42 0.073 -0.291 5.976 331 HG22 ILE 42 2HG2 ILE 42 -0.707 -0.615 4.442 332 HG23 ILE 42 3HG2 ILE 42 0.692 -1.570 4.929 333 HD11 ILE 42 1HD1 ILE 42 0.543 -4.347 5.996 334 HD12 ILE 42 2HD1 ILE 42 1.273 -4.041 7.571 335 HD13 ILE 42 3HD1 ILE 42 1.540 -2.916 6.238 336 H VAL 43 H VAL 43 -3.792 -2.213 4.479 337 HA VAL 43 HA VAL 43 -3.688 0.086 2.886 338 HB VAL 43 HB VAL 43 -4.261 -2.067 1.825 339 HG11 VAL 43 1HG1 VAL 43 -5.536 -3.074 3.635 340 HG12 VAL 43 2HG1 VAL 43 -6.506 -3.083 2.153 341 HG13 VAL 43 3HG1 VAL 43 -6.827 -1.898 3.417 342 HG21 VAL 43 1HG2 VAL 43 -6.571 -0.132 1.614 343 HG22 VAL 43 2HG2 VAL 43 -6.197 -1.414 0.462 344 HG23 VAL 43 3HG2 VAL 43 -5.069 -0.077 0.696 345 H GLY 44 H GLY 44 -5.959 -0.875 5.391 346 HA2 GLY 44 2HA GLY 44 -7.858 1.148 5.036 347 HA3 GLY 44 1HA GLY 44 -7.512 0.321 6.553 348 H TYR 45 H TYR 45 -4.921 1.055 7.054 349 HA TYR 45 HA TYR 45 -5.240 3.625 8.115 350 HB2 TYR 45 2HB TYR 45 -3.663 2.205 9.243 351 HB3 TYR 45 1HB TYR 45 -2.694 2.010 7.780 352 HD1 TYR 45 1HD TYR 45 -0.684 3.221 7.763 353 HD2 TYR 45 2HD TYR 45 -4.013 4.855 9.822 354 HE1 TYR 45 1HE TYR 45 0.640 5.214 8.331 355 HE2 TYR 45 2HE TYR 45 -2.699 6.835 10.405 356 HH TYR 45 HH TYR 45 -0.346 7.625 10.596 357 H LEU 46 H LEU 46 -3.328 2.642 5.283 358 HA LEU 46 HA LEU 46 -2.485 5.294 4.883 359 HB2 LEU 46 2HB LEU 46 -2.356 2.946 3.040 360 HB3 LEU 46 1HB LEU 46 -1.825 4.532 2.527 361 HG LEU 46 HG LEU 46 -0.176 4.466 4.473 362 HD11 LEU 46 1HD1 LEU 46 0.447 2.367 5.414 363 HD12 LEU 46 2HD1 LEU 46 -0.908 1.590 4.591 364 HD13 LEU 46 3HD1 LEU 46 -1.217 2.814 5.816 365 HD21 LEU 46 1HD2 LEU 46 0.539 4.098 2.198 366 HD22 LEU 46 2HD2 LEU 46 0.102 2.393 2.320 367 HD23 LEU 46 3HD2 LEU 46 1.411 3.039 3.305 368 H LEU 47 H LEU 47 -5.290 3.607 3.609 369 HA LEU 47 HA LEU 47 -5.861 5.734 1.781 370 HB2 LEU 47 2HB LEU 47 -7.652 3.528 2.788 371 HB3 LEU 47 1HB LEU 47 -8.087 4.662 1.534 372 HG LEU 47 HG LEU 47 -5.920 2.568 1.385 373 HD11 LEU 47 1HD1 LEU 47 -7.351 1.570 -0.318 374 HD12 LEU 47 2HD1 LEU 47 -8.564 2.818 -0.032 375 HD13 LEU 47 3HD1 LEU 47 -8.167 1.662 1.242 376 HD21 LEU 47 1HD2 LEU 47 -5.695 3.240 -0.965 377 HD22 LEU 47 2HD2 LEU 47 -5.258 4.546 0.134 378 HD23 LEU 47 3HD2 LEU 47 -6.820 4.570 -0.689 379 H SER 48 H SER 48 -6.961 4.925 5.051 380 HA SER 48 HA SER 48 -8.862 7.114 4.920 381 HB2 SER 48 2HB SER 48 -8.329 5.144 7.137 382 HB3 SER 48 1HB SER 48 -9.660 6.303 7.082 383 HG SER 48 HG SER 48 -9.188 4.057 5.433 384 H GLY 49 H GLY 49 -5.609 6.640 6.108 385 HA2 GLY 49 2HA GLY 49 -4.226 8.171 7.072 386 HA3 GLY 49 1HA GLY 49 -5.536 9.336 7.023 387 H ASP 50 H ASP 50 -6.485 6.507 8.525 388 HA ASP 50 HA ASP 50 -6.306 7.827 11.130 389 HB2 ASP 50 2HB ASP 50 -8.574 7.432 10.491 390 HB3 ASP 50 1HB ASP 50 -8.230 5.756 10.089 391 HA PRO 51 HA PRO 51 -3.193 4.752 12.044 392 HB2 PRO 51 2HB PRO 51 -2.770 5.557 14.645 393 HB3 PRO 51 1HB PRO 51 -1.998 6.277 13.233 394 HG2 PRO 51 2HG PRO 51 -4.351 7.224 14.793 395 HG3 PRO 51 1HG PRO 51 -3.044 8.157 14.058 396 HD2 PRO 51 2HD PRO 51 -5.507 7.974 12.959 397 HD3 PRO 51 1HD PRO 51 -4.043 8.152 11.973 398 H ALA 52 H ALA 52 -6.155 5.197 13.808 399 HA ALA 52 HA ALA 52 -5.919 3.105 15.652 400 HB1 ALA 52 1HB ALA 52 -8.455 4.157 14.425 401 HB2 ALA 52 2HB ALA 52 -7.631 4.851 15.820 402 HB3 ALA 52 3HB ALA 52 -8.327 3.232 15.916 403 H TYR 53 H TYR 53 -6.252 2.887 12.280 404 HA TYR 53 HA TYR 53 -7.556 0.394 12.081 405 HB2 TYR 53 2HB TYR 53 -5.695 1.870 10.273 406 HB3 TYR 53 1HB TYR 53 -6.134 0.203 9.906 407 HD1 TYR 53 1HD TYR 53 -8.476 -0.394 9.622 408 HD2 TYR 53 2HD TYR 53 -7.241 3.645 9.888 409 HE1 TYR 53 1HE TYR 53 -10.562 0.258 8.670 410 HE2 TYR 53 2HE TYR 53 -9.373 4.365 8.908 411 HH TYR 53 HH TYR 53 -11.130 3.395 7.452 412 H ILE 54 H ILE 54 -4.424 1.267 13.157 413 HA ILE 54 HA ILE 54 -3.651 -1.550 13.237 414 HB ILE 54 HB ILE 54 -1.887 0.913 13.573 415 HG12 ILE 54 2HG1 ILE 54 -2.644 0.731 11.243 416 HG13 ILE 54 1HG1 ILE 54 -0.934 0.338 11.376 417 HG21 ILE 54 1HG2 ILE 54 -0.004 -0.658 13.431 418 HG22 ILE 54 2HG2 ILE 54 -1.134 -2.004 13.328 419 HG23 ILE 54 3HG2 ILE 54 -1.052 -1.039 14.800 420 HD11 ILE 54 1HD1 ILE 54 -3.175 -1.655 11.123 421 HD12 ILE 54 2HD1 ILE 54 -1.457 -2.029 11.220 422 HD13 ILE 54 3HD1 ILE 54 -2.093 -1.145 9.829 423 HA PRO 55 HA PRO 55 -5.010 -1.152 17.469 424 HB2 PRO 55 2HB PRO 55 -3.798 -3.426 18.424 425 HB3 PRO 55 1HB PRO 55 -5.328 -3.411 17.541 426 HG2 PRO 55 2HG PRO 55 -2.563 -3.932 16.525 427 HG3 PRO 55 1HG PRO 55 -4.059 -4.809 16.165 428 HD2 PRO 55 2HD PRO 55 -3.065 -3.053 14.463 429 HD3 PRO 55 1HD PRO 55 -4.824 -3.151 14.713 430 H ARG 56 H ARG 56 -4.267 -0.359 19.329 431 HA ARG 56 HA ARG 56 -1.480 0.434 19.531 432 HB2 ARG 56 2HB ARG 56 -2.197 1.691 21.535 433 HB3 ARG 56 1HB ARG 56 -3.131 2.101 20.107 434 HG2 ARG 56 2HG ARG 56 -4.938 0.620 20.925 435 HG3 ARG 56 1HG ARG 56 -3.984 0.331 22.379 436 HD2 ARG 56 2HD ARG 56 -4.066 2.659 22.961 437 HD3 ARG 56 1HD ARG 56 -4.864 3.053 21.440 438 HE ARG 56 HE ARG 56 -6.163 1.163 23.205 439 HH11 ARG 56 1HH1 ARG 56 -6.025 4.490 22.011 440 HH12 ARG 56 2HH1 ARG 56 -7.631 4.863 22.447 441 HH21 ARG 56 1HH2 ARG 56 -8.294 1.638 23.778 442 HH22 ARG 56 2HH2 ARG 56 -8.984 3.185 23.517 443 H TYR 57 H TYR 57 -2.574 -2.308 19.895 444 HA TYR 57 HA TYR 57 -1.820 -3.286 22.407 445 HB2 TYR 57 2HB TYR 57 -3.052 -4.704 20.947 446 HB3 TYR 57 1HB TYR 57 -1.912 -4.473 19.640 447 HD1 TYR 57 1HD TYR 57 -1.449 -5.559 23.205 448 HD2 TYR 57 2HD TYR 57 -1.014 -6.496 19.084 449 HE1 TYR 57 1HE TYR 57 -0.279 -7.632 23.797 450 HE2 TYR 57 2HE TYR 57 0.164 -8.563 19.669 451 HH TYR 57 HH TYR 57 1.441 -9.455 21.499 452 H GLN 58 H GLN 58 -0.006 -2.732 19.417 453 HA GLN 58 HA GLN 58 2.474 -3.018 20.934 454 HB2 GLN 58 2HB GLN 58 1.937 -3.597 18.014 455 HB3 GLN 58 1HB GLN 58 3.529 -3.577 18.748 456 HG2 GLN 58 2HG GLN 58 1.287 -5.449 19.472 457 HG3 GLN 58 1HG GLN 58 2.663 -5.844 18.447 458 HE21 GLN 58 1HE2 GLN 58 4.684 -6.090 19.384 459 HE22 GLN 58 2HE2 GLN 58 4.887 -6.277 21.086 460 H ASP 59 H ASP 59 4.148 -1.655 20.194 461 HA ASP 59 HA ASP 59 3.372 1.028 19.730 462 HB2 ASP 59 2HB ASP 59 5.778 1.561 19.635 463 HB3 ASP 59 1HB ASP 59 5.384 0.583 21.033 464 H ALA 60 H ALA 60 3.761 -1.497 17.663 465 HA ALA 60 HA ALA 60 4.810 -0.554 15.309 466 HB1 ALA 60 1HB ALA 60 4.038 -2.860 15.676 467 HB2 ALA 60 2HB ALA 60 3.423 -2.188 14.165 468 HB3 ALA 60 3HB ALA 60 2.369 -2.304 15.572 469 H ARG 61 H ARG 61 1.619 0.160 16.640 470 HA ARG 61 HA ARG 61 0.687 1.492 14.352 471 HB2 ARG 61 2HB ARG 61 -0.979 2.645 15.932 472 HB3 ARG 61 1HB ARG 61 -1.057 0.903 15.806 473 HG2 ARG 61 2HG ARG 61 -1.387 1.568 18.044 474 HG3 ARG 61 1HG ARG 61 0.174 0.741 17.962 475 HD2 ARG 61 2HD ARG 61 1.198 3.053 17.880 476 HD3 ARG 61 1HD ARG 61 -0.408 3.686 18.231 477 HE ARG 61 HE ARG 61 0.454 1.680 20.082 478 HH11 ARG 61 1HH1 ARG 61 0.580 5.125 19.350 479 HH12 ARG 61 2HH1 ARG 61 0.949 5.588 20.943 480 HH21 ARG 61 1HH2 ARG 61 0.930 2.317 22.255 481 HH22 ARG 61 2HH2 ARG 61 1.138 3.958 22.638 482 H ASN 62 H ASN 62 2.704 2.596 16.929 483 HA ASN 62 HA ASN 62 2.576 5.345 16.136 484 HB2 ASN 62 2HB ASN 62 3.072 4.770 18.474 485 HB3 ASN 62 1HB ASN 62 4.514 3.898 17.972 486 HD21 ASN 62 1HD2 ASN 62 6.387 5.064 17.502 487 HD22 ASN 62 2HD2 ASN 62 6.500 6.755 17.801 488 H LEU 63 H LEU 63 4.482 2.556 15.471 489 HA LEU 63 HA LEU 63 6.639 3.855 14.152 490 HB2 LEU 63 2HB LEU 63 5.686 1.002 13.953 491 HB3 LEU 63 1HB LEU 63 7.204 1.604 13.330 492 HG LEU 63 HG LEU 63 6.445 1.453 16.267 493 HD11 LEU 63 1HD1 LEU 63 8.405 -0.133 14.626 494 HD12 LEU 63 2HD1 LEU 63 6.873 -0.731 15.266 495 HD13 LEU 63 3HD1 LEU 63 8.162 -0.245 16.365 496 HD21 LEU 63 1HD2 LEU 63 9.000 2.290 14.910 497 HD22 LEU 63 2HD2 LEU 63 8.773 2.080 16.643 498 HD23 LEU 63 3HD2 LEU 63 7.908 3.365 15.788 499 H ILE 64 H ILE 64 3.600 2.419 13.046 500 HA ILE 64 HA ILE 64 4.277 2.619 10.295 501 HB ILE 64 HB ILE 64 2.521 1.043 11.156 502 HG12 ILE 64 2HG1 ILE 64 1.526 2.975 9.036 503 HG13 ILE 64 1HG1 ILE 64 2.631 1.640 8.754 504 HG21 ILE 64 1HG2 ILE 64 0.863 3.548 11.444 505 HG22 ILE 64 2HG2 ILE 64 1.460 2.555 12.748 506 HG23 ILE 64 3HG2 ILE 64 0.253 1.898 11.627 507 HD11 ILE 64 1HD1 ILE 64 0.875 0.060 9.409 508 HD12 ILE 64 2HD1 ILE 64 0.378 1.072 8.055 509 HD13 ILE 64 3HD1 ILE 64 -0.229 1.409 9.673 510 H ARG 65 H ARG 65 2.736 4.757 12.569 511 HA ARG 65 HA ARG 65 1.991 6.669 10.526 512 HB2 ARG 65 2HB ARG 65 1.082 8.004 12.352 513 HB3 ARG 65 1HB ARG 65 0.541 6.340 12.499 514 HG2 ARG 65 2HG ARG 65 2.175 5.929 14.197 515 HG3 ARG 65 1HG ARG 65 2.799 7.564 14.047 516 HD2 ARG 65 2HD ARG 65 0.519 8.391 14.708 517 HD3 ARG 65 1HD ARG 65 0.059 6.710 15.006 518 HE ARG 65 HE ARG 65 2.429 7.654 16.358 519 HH11 ARG 65 1HH1 ARG 65 -1.049 6.907 16.707 520 HH12 ARG 65 2HH1 ARG 65 -1.024 7.047 18.396 521 HH21 ARG 65 1HH2 ARG 65 2.426 7.789 18.669 522 HH22 ARG 65 2HH2 ARG 65 0.994 7.585 19.547 523 H ARG 66 H ARG 66 4.813 5.807 11.642 524 HA ARG 66 HA ARG 66 5.982 8.313 12.284 525 HB2 ARG 66 2HB ARG 66 7.002 6.366 13.245 526 HB3 ARG 66 1HB ARG 66 7.161 5.597 11.682 527 HG2 ARG 66 2HG ARG 66 9.320 6.324 12.527 528 HG3 ARG 66 1HG ARG 66 8.899 7.216 11.071 529 HD2 ARG 66 2HD ARG 66 8.167 9.104 12.496 530 HD3 ARG 66 1HD ARG 66 8.686 8.196 13.920 531 HE ARG 66 HE ARG 66 10.893 8.174 12.491 532 HH11 ARG 66 1HH1 ARG 66 8.760 10.886 13.241 533 HH12 ARG 66 2HH1 ARG 66 9.960 12.079 13.100 534 HH21 ARG 66 1HH2 ARG 66 12.564 9.816 12.314 535 HH22 ARG 66 2HH2 ARG 66 12.170 11.445 12.568 536 H HIS 67 H HIS 67 5.012 6.786 9.428 537 HA HIS 67 HA HIS 67 6.838 8.446 7.795 538 HB2 HIS 67 2HB HIS 67 5.657 5.826 6.842 539 HB3 HIS 67 1HB HIS 67 6.981 6.731 6.151 540 HD1 HIS 67 1HD HIS 67 9.423 6.168 7.082 541 HD2 HIS 67 2HD HIS 67 6.303 4.212 9.058 542 HE1 HIS 67 1HE HIS 67 10.477 4.424 8.446 543 HE2 HIS 67 2HE HIS 67 8.629 3.234 9.629 544 H GLU 68 H GLU 68 5.806 9.347 5.934 545 HA GLU 68 HA GLU 68 3.033 9.851 6.177 546 HB2 GLU 68 2HB GLU 68 5.105 10.517 4.145 547 HB3 GLU 68 1HB GLU 68 3.408 10.747 3.745 548 HG2 GLU 68 2HG GLU 68 4.758 11.935 6.147 549 HG3 GLU 68 1HG GLU 68 4.555 12.773 4.604 550 H ARG 69 H ARG 69 1.346 9.169 5.030 551 HA ARG 69 HA ARG 69 1.438 6.445 4.267 552 HB2 ARG 69 2HB ARG 69 -0.898 8.429 4.149 553 HB3 ARG 69 1HB ARG 69 -0.979 6.698 3.889 554 HG2 ARG 69 2HG ARG 69 -0.375 6.197 6.068 555 HG3 ARG 69 1HG ARG 69 0.194 7.832 6.372 556 HD2 ARG 69 2HD ARG 69 -2.670 7.080 5.843 557 HD3 ARG 69 1HD ARG 69 -1.971 7.315 7.445 558 HE ARG 69 HE ARG 69 -2.432 9.373 5.414 559 HH11 ARG 69 1HH1 ARG 69 -1.338 8.598 8.732 560 HH12 ARG 69 2HH1 ARG 69 -1.652 10.135 9.337 561 HH21 ARG 69 1HH2 ARG 69 -2.842 11.479 6.269 562 HH22 ARG 69 2HH2 ARG 69 -2.511 11.834 7.907 563 H ASP 70 H ASP 70 1.265 9.436 2.489 564 HA ASP 70 HA ASP 70 0.943 8.316 -0.101 565 HB2 ASP 70 2HB ASP 70 2.284 10.893 0.774 566 HB3 ASP 70 1HB ASP 70 2.050 10.450 -0.905 567 H GLU 71 H GLU 71 3.694 9.091 1.867 568 HA GLU 71 HA GLU 71 5.788 8.620 0.048 569 HB2 GLU 71 2HB GLU 71 5.794 9.830 2.273 570 HB3 GLU 71 1HB GLU 71 5.829 8.255 3.033 571 HG2 GLU 71 2HG GLU 71 8.008 9.139 3.011 572 HG3 GLU 71 1HG GLU 71 7.960 7.811 1.854 573 H ILE 72 H ILE 72 4.374 6.582 2.626 574 HA ILE 72 HA ILE 72 5.894 4.247 2.231 575 HB ILE 72 HB ILE 72 3.014 4.433 3.170 576 HG12 ILE 72 2HG1 ILE 72 5.557 4.295 4.812 577 HG13 ILE 72 1HG1 ILE 72 4.544 5.723 4.606 578 HG21 ILE 72 1HG2 ILE 72 3.520 2.165 2.485 579 HG22 ILE 72 2HG2 ILE 72 3.388 2.244 4.241 580 HG23 ILE 72 3HG2 ILE 72 4.975 2.156 3.479 581 HD11 ILE 72 1HD1 ILE 72 3.717 3.149 5.935 582 HD12 ILE 72 2HD1 ILE 72 2.699 4.569 5.727 583 HD13 ILE 72 3HD1 ILE 72 4.120 4.645 6.769 584 H MET 73 H MET 73 2.913 5.359 0.752 585 HA MET 73 HA MET 73 2.247 2.956 -0.516 586 HB2 MET 73 2HB MET 73 0.689 4.855 -0.041 587 HB3 MET 73 1HB MET 73 1.451 5.757 -1.333 588 HG2 MET 73 2HG MET 73 -0.007 3.141 -1.692 589 HG3 MET 73 1HG MET 73 -0.730 4.726 -1.921 590 HE1 MET 73 1HE MET 73 -0.457 3.344 -5.540 591 HE2 MET 73 2HE MET 73 -1.512 3.945 -4.248 592 HE3 MET 73 3HE MET 73 -0.731 2.376 -4.089 593 H GLU 74 H GLU 74 4.165 5.735 -1.658 594 HA GLU 74 HA GLU 74 4.563 4.807 -4.285 595 HB2 GLU 74 2HB GLU 74 6.433 6.405 -2.548 596 HB3 GLU 74 1HB GLU 74 6.688 6.089 -4.256 597 HG2 GLU 74 2HG GLU 74 4.563 7.221 -4.714 598 HG3 GLU 74 1HG GLU 74 4.480 7.674 -3.006 599 H GLU 75 H GLU 75 6.238 4.141 -1.315 600 HA GLU 75 HA GLU 75 8.363 2.651 -2.405 601 HB2 GLU 75 2HB GLU 75 8.275 3.691 -0.118 602 HB3 GLU 75 1HB GLU 75 7.114 2.462 0.337 603 HG2 GLU 75 2HG GLU 75 9.336 1.939 1.148 604 HG3 GLU 75 1HG GLU 75 8.748 0.742 -0.011 605 H LEU 76 H LEU 76 5.155 1.809 -1.199 606 HA LEU 76 HA LEU 76 5.291 -0.987 -1.397 607 HB2 LEU 76 2HB LEU 76 2.868 0.757 -1.880 608 HB3 LEU 76 1HB LEU 76 2.842 -0.946 -1.503 609 HG LEU 76 HG LEU 76 3.677 1.282 0.356 610 HD11 LEU 76 1HD1 LEU 76 1.661 0.695 1.577 611 HD12 LEU 76 2HD1 LEU 76 1.267 -0.510 0.355 612 HD13 LEU 76 3HD1 LEU 76 1.284 1.195 -0.073 613 HD21 LEU 76 1HD2 LEU 76 3.429 -1.674 0.862 614 HD22 LEU 76 2HD2 LEU 76 3.754 -0.438 2.077 615 HD23 LEU 76 3HD2 LEU 76 4.934 -0.757 0.806 616 H THR 77 H THR 77 4.138 1.512 -3.740 617 HA THR 77 HA THR 77 3.278 -0.161 -5.743 618 HB THR 77 HB THR 77 4.469 2.615 -5.954 619 HG1 THR 77 1HG THR 77 2.705 2.747 -4.584 620 HG21 THR 77 1HG2 THR 77 4.237 1.523 -8.158 621 HG22 THR 77 2HG2 THR 77 3.076 2.836 -7.954 622 HG23 THR 77 3HG2 THR 77 2.547 1.163 -7.789 623 H LYS 78 H LYS 78 6.549 1.004 -5.086 624 HA LYS 78 HA LYS 78 7.624 0.274 -7.588 625 HB2 LYS 78 2HB LYS 78 9.048 0.626 -4.972 626 HB3 LYS 78 1HB LYS 78 9.857 0.438 -6.530 627 HG2 LYS 78 2HG LYS 78 8.620 2.441 -7.291 628 HG3 LYS 78 1HG LYS 78 8.070 2.680 -5.648 629 HD2 LYS 78 2HD LYS 78 10.971 2.707 -6.570 630 HD3 LYS 78 1HD LYS 78 10.012 4.117 -6.154 631 HE2 LYS 78 2HE LYS 78 11.401 3.697 -4.294 632 HE3 LYS 78 1HE LYS 78 9.805 3.129 -3.828 633 HZ1 LYS 78 1HZ LYS 78 10.648 0.840 -4.502 634 HZ2 LYS 78 2HZ LYS 78 11.305 1.497 -3.109 635 HZ3 LYS 78 3HZ LYS 78 12.178 1.476 -4.569 636 H TYR 79 H TYR 79 7.522 -1.470 -4.565 637 HA TYR 79 HA TYR 79 9.096 -3.664 -5.425 638 HB2 TYR 79 2HB TYR 79 7.128 -3.380 -3.181 639 HB3 TYR 79 1HB TYR 79 7.890 -4.928 -3.521 640 HD1 TYR 79 1HD TYR 79 9.301 -1.488 -3.627 641 HD2 TYR 79 2HD TYR 79 9.346 -5.300 -1.777 642 HE1 TYR 79 1HE TYR 79 11.261 -0.804 -2.284 643 HE2 TYR 79 2HE TYR 79 11.289 -4.655 -0.440 644 HH TYR 79 HH TYR 79 12.328 -1.426 -0.190 645 H TYR 80 H TYR 80 5.739 -3.019 -5.777 646 HA TYR 80 HA TYR 80 4.963 -5.651 -6.560 647 HB2 TYR 80 2HB TYR 80 3.449 -3.836 -5.721 648 HB3 TYR 80 1HB TYR 80 3.671 -3.023 -7.263 649 HD1 TYR 80 1HD TYR 80 2.682 -6.298 -5.877 650 HD2 TYR 80 2HD TYR 80 2.116 -3.437 -8.961 651 HE1 TYR 80 1HE TYR 80 0.860 -7.628 -6.747 652 HE2 TYR 80 2HE TYR 80 0.256 -4.764 -9.852 653 HH TYR 80 HH TYR 80 -1.134 -7.234 -8.046 654 H LEU 81 H LEU 81 6.036 -2.797 -8.274 655 HA LEU 81 HA LEU 81 5.897 -4.038 -10.834 656 HB2 LEU 81 2HB LEU 81 7.209 -1.569 -9.833 657 HB3 LEU 81 1HB LEU 81 7.269 -2.039 -11.534 658 HG LEU 81 HG LEU 81 4.783 -1.406 -9.933 659 HD11 LEU 81 1HD1 LEU 81 4.646 0.564 -11.367 660 HD12 LEU 81 2HD1 LEU 81 6.193 0.134 -12.095 661 HD13 LEU 81 3HD1 LEU 81 6.115 0.569 -10.387 662 HD21 LEU 81 1HD2 LEU 81 3.669 -1.507 -12.124 663 HD22 LEU 81 2HD2 LEU 81 4.313 -3.062 -11.623 664 HD23 LEU 81 3HD2 LEU 81 5.165 -2.103 -12.838 665 H ALA 82 H ALA 82 8.445 -3.560 -8.453 666 HA ALA 82 HA ALA 82 10.705 -4.053 -9.923 667 HB1 ALA 82 1HB ALA 82 10.660 -3.232 -7.612 668 HB2 ALA 82 2HB ALA 82 11.815 -4.540 -7.857 669 HB3 ALA 82 3HB ALA 82 10.272 -4.864 -7.065 670 H ASN 83 H ASN 83 8.582 -6.479 -8.532 671 HA ASN 83 HA ASN 83 10.331 -8.692 -8.966 672 HB2 ASN 83 2HB ASN 83 8.322 -10.161 -8.682 673 HB3 ASN 83 1HB ASN 83 8.492 -8.971 -7.396 674 HD21 ASN 83 1HD2 ASN 83 7.015 -7.369 -7.198 675 HD22 ASN 83 2HD2 ASN 83 5.564 -7.344 -8.118 676 H HIS 84 H HIS 84 8.678 -6.847 -11.216 677 HA HIS 84 HA HIS 84 8.509 -8.970 -13.216 678 HB2 HIS 84 2HB HIS 84 7.659 -6.101 -13.142 679 HB3 HIS 84 1HB HIS 84 7.892 -6.883 -14.696 680 HD1 HIS 84 1HD HIS 84 6.139 -8.370 -11.579 681 HD2 HIS 84 2HD HIS 84 5.367 -7.244 -15.515 682 HE1 HIS 84 1HE HIS 84 3.811 -9.093 -12.055 683 HE2 HIS 84 2HE HIS 84 3.495 -8.650 -14.526 684 H GLY 85 H GLY 85 11.009 -7.531 -11.955 685 HA2 GLY 85 2HA GLY 85 13.185 -7.429 -12.713 686 HA3 GLY 85 1HA GLY 85 12.608 -7.836 -14.325 687 H ILE 86 H ILE 86 11.125 -5.275 -12.642 688 HA ILE 86 HA ILE 86 12.177 -3.421 -14.621 689 HB ILE 86 HB ILE 86 9.882 -3.096 -12.664 690 HG12 ILE 86 2HG1 ILE 86 9.888 -3.556 -15.656 691 HG13 ILE 86 1HG1 ILE 86 9.414 -4.729 -14.433 692 HG21 ILE 86 1HG2 ILE 86 9.332 -1.060 -13.926 693 HG22 ILE 86 2HG2 ILE 86 10.784 -1.275 -14.901 694 HG23 ILE 86 3HG2 ILE 86 10.923 -0.947 -13.174 695 HD11 ILE 86 1HD1 ILE 86 8.054 -2.120 -15.013 696 HD12 ILE 86 2HD1 ILE 86 7.547 -3.289 -13.792 697 HD13 ILE 86 3HD1 ILE 86 7.483 -3.716 -15.507 698 H ASP 87 H ASP 87 13.551 -1.915 -14.126 699 HA ASP 87 HA ASP 87 14.376 -1.564 -11.332 700 HB2 ASP 87 2HB ASP 87 16.129 -1.963 -13.072 701 HB3 ASP 87 1HB ASP 87 15.626 -0.482 -13.877 702 H ILE 88 H ILE 88 13.540 0.119 -10.253 703 HA ILE 88 HA ILE 88 12.215 2.159 -11.863 704 HB ILE 88 HB ILE 88 11.699 1.317 -9.004 705 HG12 ILE 88 2HG1 ILE 88 10.092 0.944 -11.532 706 HG13 ILE 88 1HG1 ILE 88 10.992 -0.310 -10.691 707 HG21 ILE 88 1HG2 ILE 88 9.731 2.798 -9.119 708 HG22 ILE 88 2HG2 ILE 88 10.270 3.367 -10.698 709 HG23 ILE 88 3HG2 ILE 88 11.243 3.697 -9.267 710 HD11 ILE 88 1HD1 ILE 88 8.650 1.207 -9.588 711 HD12 ILE 88 2HD1 ILE 88 9.512 -0.116 -8.791 712 HD13 ILE 88 3HD1 ILE 88 8.622 -0.403 -10.295 713 H LYS 89 H LYS 89 12.559 4.222 -11.565 714 HA LYS 89 HA LYS 89 15.070 5.122 -10.550 715 HB2 LYS 89 2HB LYS 89 12.656 6.670 -11.479 716 HB3 LYS 89 1HB LYS 89 14.232 7.378 -11.188 717 HG2 LYS 89 2HG LYS 89 15.186 6.023 -12.985 718 HG3 LYS 89 1HG LYS 89 13.609 5.261 -13.218 719 HD2 LYS 89 2HD LYS 89 12.638 7.402 -13.851 720 HD3 LYS 89 1HD LYS 89 14.178 8.201 -13.547 721 HE2 LYS 89 2HE LYS 89 13.775 7.797 -15.940 722 HE3 LYS 89 1HE LYS 89 15.218 6.980 -15.353 723 HZ1 LYS 89 1HZ LYS 89 12.577 5.577 -15.714 724 HZ2 LYS 89 2HZ LYS 89 14.050 4.918 -15.332 725 HZ3 LYS 89 3HZ LYS 89 13.843 5.592 -16.829 726 H1 MET 1 H MET 1 -11.066 18.011 21.987 727 HA MET 1 HA MET 1 -8.557 17.041 22.428 728 HB2 MET 1 2HB MET 1 -8.801 14.640 22.028 729 HB3 MET 1 1HB MET 1 -9.648 15.109 23.496 730 HG2 MET 1 2HG MET 1 -11.778 15.058 22.298 731 HG3 MET 1 1HG MET 1 -10.928 14.636 20.816 732 HE1 MET 1 1HE MET 1 -11.154 11.864 24.505 733 HE2 MET 1 2HE MET 1 -11.897 13.463 24.435 734 HE3 MET 1 3HE MET 1 -10.141 13.305 24.449 735 H GLY 2 H GLY 2 -7.846 15.762 20.336 736 HA2 GLY 2 2HA GLY 2 -9.027 17.236 18.130 737 HA3 GLY 2 1HA GLY 2 -7.491 16.372 18.122 738 H PHE 3 H PHE 3 -10.831 16.202 17.433 739 HA PHE 3 HA PHE 3 -10.357 13.481 16.556 740 HB2 PHE 3 2HB PHE 3 -12.745 12.897 16.930 741 HB3 PHE 3 1HB PHE 3 -11.922 13.300 18.418 742 HD1 PHE 3 1HD PHE 3 -14.579 14.193 16.100 743 HD2 PHE 3 2HD PHE 3 -12.484 15.383 19.609 744 HE1 PHE 3 1HE PHE 3 -16.393 15.758 16.651 745 HE2 PHE 3 2HE PHE 3 -14.292 16.950 20.158 746 HZ PHE 3 HZ PHE 3 -16.252 17.138 18.676 747 H THR 4 H THR 4 -10.490 13.130 14.555 748 HA THR 4 HA THR 4 -11.508 15.280 12.859 749 HB THR 4 HB THR 4 -9.527 13.084 12.209 750 HG1 THR 4 1HG THR 4 -9.305 15.481 13.528 751 HG21 THR 4 1HG2 THR 4 -8.974 14.523 10.305 752 HG22 THR 4 2HG2 THR 4 -10.190 15.688 10.822 753 HG23 THR 4 3HG2 THR 4 -10.684 14.087 10.271 754 H ASP 5 H ASP 5 -13.326 14.806 11.761 755 HA ASP 5 HA ASP 5 -14.120 12.045 11.681 756 HB2 ASP 5 2HB ASP 5 -16.358 12.866 10.973 757 HB3 ASP 5 1HB ASP 5 -15.835 13.522 12.512 758 H GLU 6 H GLU 6 -12.976 11.112 10.244 759 HA GLU 6 HA GLU 6 -12.643 12.127 7.563 760 HB2 GLU 6 2HB GLU 6 -11.822 9.567 8.914 761 HB3 GLU 6 1HB GLU 6 -11.483 9.898 7.228 762 HG2 GLU 6 2HG GLU 6 -10.515 11.521 9.568 763 HG3 GLU 6 1HG GLU 6 -9.563 10.340 8.665 764 H THR 7 H THR 7 -12.850 9.999 5.961 765 HA THR 7 HA THR 7 -15.421 8.744 6.333 766 HB THR 7 HB THR 7 -15.922 10.855 5.098 767 HG1 THR 7 1HG THR 7 -16.841 9.906 3.202 768 HG21 THR 7 1HG2 THR 7 -13.951 9.823 3.054 769 HG22 THR 7 2HG2 THR 7 -13.748 11.245 4.075 770 HG23 THR 7 3HG2 THR 7 -15.003 11.221 2.837 771 H VAL 8 H VAL 8 -15.571 7.348 4.080 772 HA VAL 8 HA VAL 8 -12.987 5.998 3.916 773 HB VAL 8 HB VAL 8 -14.989 4.576 4.465 774 HG11 VAL 8 1HG1 VAL 8 -16.649 4.074 2.756 775 HG12 VAL 8 2HG1 VAL 8 -15.947 5.329 1.734 776 HG13 VAL 8 3HG1 VAL 8 -16.693 5.763 3.271 777 HG21 VAL 8 1HG2 VAL 8 -13.111 3.484 3.390 778 HG22 VAL 8 2HG2 VAL 8 -13.717 3.948 1.799 779 HG23 VAL 8 3HG2 VAL 8 -14.618 2.802 2.780 780 H ARG 9 H ARG 9 -12.077 5.603 1.829 781 HA ARG 9 HA ARG 9 -12.320 7.821 0.114 782 HB2 ARG 9 2HB ARG 9 -10.966 5.179 -0.416 783 HB3 ARG 9 1HB ARG 9 -10.837 6.596 -1.443 784 HG2 ARG 9 2HG ARG 9 -9.867 6.349 1.402 785 HG3 ARG 9 1HG ARG 9 -8.874 6.396 -0.052 786 HD2 ARG 9 2HD ARG 9 -10.595 8.619 1.056 787 HD3 ARG 9 1HD ARG 9 -8.836 8.544 1.007 788 HE ARG 9 HE ARG 9 -9.926 8.324 -1.587 789 HH11 ARG 9 1HH1 ARG 9 -9.150 10.683 0.942 790 HH12 ARG 9 2HH1 ARG 9 -9.150 12.028 -0.100 791 HH21 ARG 9 1HH2 ARG 9 -9.926 10.217 -3.057 792 HH22 ARG 9 2HH2 ARG 9 -9.579 11.744 -2.400 793 H PHE 10 H PHE 10 -13.665 4.538 -0.151 794 HA PHE 10 HA PHE 10 -15.807 5.345 -1.757 795 HB2 PHE 10 2HB PHE 10 -15.205 4.254 -3.883 796 HB3 PHE 10 1HB PHE 10 -14.118 5.591 -3.531 797 HD1 PHE 10 1HD PHE 10 -14.390 2.031 -4.135 798 HD2 PHE 10 2HD PHE 10 -11.816 5.090 -2.717 799 HE1 PHE 10 1HE PHE 10 -12.471 0.563 -4.455 800 HE2 PHE 10 2HE PHE 10 -9.881 3.618 -3.037 801 HZ PHE 10 HZ PHE 10 -10.209 1.352 -3.906 802 H ASP 11 H ASP 11 -16.936 3.344 -2.651 803 HA ASP 11 HA ASP 11 -16.137 0.897 -1.280 804 HB2 ASP 11 2HB ASP 11 -18.998 1.925 -1.406 805 HB3 ASP 11 1HB ASP 11 -18.502 0.365 -0.789 806 H PHE 12 H PHE 12 -15.362 0.122 -3.231 807 HA PHE 12 HA PHE 12 -17.451 -0.711 -5.084 808 HB2 PHE 12 2HB PHE 12 -14.815 0.537 -5.933 809 HB3 PHE 12 1HB PHE 12 -15.870 -0.340 -7.028 810 HD1 PHE 12 1HD PHE 12 -15.038 2.853 -5.720 811 HD2 PHE 12 2HD PHE 12 -18.303 0.566 -7.219 812 HE1 PHE 12 1HE PHE 12 -16.251 4.918 -6.207 813 HE2 PHE 12 2HE PHE 12 -19.516 2.645 -7.718 814 HZ PHE 12 HZ PHE 12 -18.494 4.824 -7.210 815 H ASP 13 H ASP 13 -16.037 -2.317 -6.799 816 HA ASP 13 HA ASP 13 -14.524 -4.033 -4.983 817 HB2 ASP 13 2HB ASP 13 -16.819 -4.834 -4.860 818 HB3 ASP 13 1HB ASP 13 -16.872 -4.987 -6.609 819 H ASP 14 H ASP 14 -12.858 -5.013 -5.831 820 HA ASP 14 HA ASP 14 -12.737 -5.617 -8.684 821 HB2 ASP 14 2HB ASP 14 -11.498 -3.475 -8.303 822 HB3 ASP 14 1HB ASP 14 -10.490 -4.299 -7.118 823 H ASN 15 H ASN 15 -11.861 -7.643 -8.972 824 HA ASN 15 HA ASN 15 -11.104 -9.024 -6.503 825 HB2 ASN 15 2HB ASN 15 -11.782 -10.170 -9.232 826 HB3 ASN 15 1HB ASN 15 -11.383 -11.113 -7.811 827 HD21 ASN 15 1HD2 ASN 15 -12.952 -9.375 -5.999 828 HD22 ASN 15 2HD2 ASN 15 -14.593 -9.749 -6.344 829 H ARG 16 H ARG 16 -8.975 -9.106 -6.085 830 HA ARG 16 HA ARG 16 -7.067 -8.443 -7.999 831 HB2 ARG 16 2HB ARG 16 -5.299 -9.206 -6.428 832 HB3 ARG 16 1HB ARG 16 -6.436 -8.084 -5.726 833 HG2 ARG 16 2HG ARG 16 -7.549 -10.005 -4.607 834 HG3 ARG 16 1HG ARG 16 -6.278 -11.058 -5.250 835 HD2 ARG 16 2HD ARG 16 -4.584 -9.782 -4.112 836 HD3 ARG 16 1HD ARG 16 -5.773 -8.612 -3.561 837 HE ARG 16 HE ARG 16 -5.604 -11.410 -2.653 838 HH11 ARG 16 1HH1 ARG 16 -6.618 -8.047 -2.087 839 HH12 ARG 16 2HH1 ARG 16 -6.804 -8.203 -0.418 840 HH21 ARG 16 1HH2 ARG 16 -5.887 -11.659 -0.334 841 HH22 ARG 16 2HH2 ARG 16 -6.411 -10.335 0.618 842 H LYS 17 H LYS 17 -6.001 -9.344 -9.424 843 HA LYS 17 HA LYS 17 -5.856 -12.208 -9.741 844 HB2 LYS 17 2HB LYS 17 -8.069 -11.444 -10.659 845 HB3 LYS 17 1HB LYS 17 -7.224 -10.314 -11.688 846 HG2 LYS 17 2HG LYS 17 -6.222 -12.181 -12.908 847 HG3 LYS 17 1HG LYS 17 -7.056 -13.324 -11.843 848 HD2 LYS 17 2HD LYS 17 -9.219 -12.398 -12.548 849 HD3 LYS 17 1HD LYS 17 -8.389 -11.272 -13.617 850 HE2 LYS 17 2HE LYS 17 -7.510 -13.154 -14.904 851 HE3 LYS 17 1HE LYS 17 -8.328 -14.286 -13.826 852 HZ1 LYS 17 1HZ LYS 17 -9.665 -12.259 -15.547 853 HZ2 LYS 17 2HZ LYS 17 -10.444 -13.342 -14.527 854 HZ3 LYS 17 3HZ LYS 17 -9.593 -13.916 -15.855 855 H LYS 18 H LYS 18 -4.364 -12.566 -11.638 856 HA LYS 18 HA LYS 18 -1.971 -11.205 -11.422 857 HB2 LYS 18 2HB LYS 18 -2.971 -12.739 -13.800 858 HB3 LYS 18 1HB LYS 18 -1.293 -12.303 -13.494 859 HG2 LYS 18 2HG LYS 18 -1.289 -13.670 -11.482 860 HG3 LYS 18 1HG LYS 18 -2.981 -14.090 -11.753 861 HD2 LYS 18 2HD LYS 18 -0.675 -14.741 -13.593 862 HD3 LYS 18 1HD LYS 18 -1.473 -15.876 -12.501 863 HE2 LYS 18 2HE LYS 18 -3.593 -15.490 -13.728 864 HE3 LYS 18 1HE LYS 18 -2.734 -14.439 -14.842 865 HZ1 LYS 18 1HZ LYS 18 -2.162 -17.323 -14.438 866 HZ2 LYS 18 2HZ LYS 18 -1.355 -16.316 -15.497 867 HZ3 LYS 18 3HZ LYS 18 -2.981 -16.643 -15.753 868 H ALA 19 H ALA 19 -4.668 -10.340 -13.314 869 HA ALA 19 HA ALA 19 -3.752 -8.802 -15.399 870 HB1 ALA 19 1HB ALA 19 -5.801 -7.560 -15.171 871 HB2 ALA 19 2HB ALA 19 -5.978 -8.251 -13.551 872 HB3 ALA 19 3HB ALA 19 -6.092 -9.313 -14.967 873 H ILE 20 H ILE 20 -4.166 -7.883 -12.001 874 HA ILE 20 HA ILE 20 -3.848 -5.115 -12.278 875 HB ILE 20 HB ILE 20 -3.112 -6.829 -9.873 876 HG12 ILE 20 2HG1 ILE 20 -5.664 -5.325 -10.518 877 HG13 ILE 20 1HG1 ILE 20 -5.468 -7.072 -10.529 878 HG21 ILE 20 1HG2 ILE 20 -2.056 -4.640 -9.733 879 HG22 ILE 20 2HG2 ILE 20 -3.357 -4.773 -8.552 880 HG23 ILE 20 3HG2 ILE 20 -3.606 -3.856 -10.037 881 HD11 ILE 20 1HD1 ILE 20 -6.610 -6.306 -8.514 882 HD12 ILE 20 2HD1 ILE 20 -5.232 -5.288 -8.106 883 HD13 ILE 20 3HD1 ILE 20 -5.057 -7.039 -8.114 884 H SER 21 H SER 21 -1.530 -7.647 -11.965 885 HA SER 21 HA SER 21 0.644 -5.812 -11.539 886 HB2 SER 21 2HB SER 21 2.177 -7.777 -11.795 887 HB3 SER 21 1HB SER 21 0.946 -7.986 -10.557 888 HG SER 21 HG SER 21 -0.268 -9.104 -12.337 889 H GLU 22 H GLU 22 -0.656 -7.414 -14.335 890 HA GLU 22 HA GLU 22 1.432 -6.534 -16.078 891 HB2 GLU 22 2HB GLU 22 -1.366 -7.469 -16.729 892 HB3 GLU 22 1HB GLU 22 -0.048 -7.295 -17.879 893 HG2 GLU 22 2HG GLU 22 -0.156 -9.221 -15.570 894 HG3 GLU 22 1HG GLU 22 -0.356 -9.617 -17.274 895 H THR 23 H THR 23 -1.555 -5.272 -14.899 896 HA THR 23 HA THR 23 -1.999 -3.217 -16.767 897 HB THR 23 HB THR 23 -2.739 -3.411 -13.839 898 HG1 THR 23 1HG THR 23 -3.600 -4.972 -15.511 899 HG21 THR 23 1HG2 THR 23 -4.451 -1.703 -14.338 900 HG22 THR 23 2HG2 THR 23 -3.787 -1.534 -15.963 901 HG23 THR 23 3HG2 THR 23 -2.816 -1.079 -14.568 902 H LEU 24 H LEU 24 -0.439 -3.129 -13.535 903 HA LEU 24 HA LEU 24 0.335 -0.432 -13.885 904 HB2 LEU 24 2HB LEU 24 1.110 -2.451 -11.785 905 HB3 LEU 24 1HB LEU 24 1.843 -0.864 -11.848 906 HG LEU 24 HG LEU 24 -0.369 0.175 -11.498 907 HD11 LEU 24 1HD1 LEU 24 -1.384 -2.628 -11.118 908 HD12 LEU 24 2HD1 LEU 24 -1.819 -1.525 -12.422 909 HD13 LEU 24 3HD1 LEU 24 -2.274 -1.149 -10.760 910 HD21 LEU 24 1HD2 LEU 24 -0.600 -0.441 -9.141 911 HD22 LEU 24 2HD2 LEU 24 1.087 -0.231 -9.616 912 HD23 LEU 24 3HD2 LEU 24 0.419 -1.851 -9.422 913 H GLU 25 H GLU 25 1.881 -3.429 -14.632 914 HA GLU 25 HA GLU 25 4.516 -2.630 -15.061 915 HB2 GLU 25 2HB GLU 25 3.509 -4.956 -15.225 916 HB3 GLU 25 1HB GLU 25 2.828 -4.495 -16.765 917 HG2 GLU 25 2HG GLU 25 5.772 -4.728 -16.124 918 HG3 GLU 25 1HG GLU 25 4.803 -5.914 -16.980 919 H THR 26 H THR 26 1.676 -2.534 -17.176 920 HA THR 26 HA THR 26 2.907 -1.353 -19.407 921 HB THR 26 HB THR 26 -0.056 -1.251 -18.666 922 HG1 THR 26 1HG THR 26 0.339 -3.367 -18.703 923 HG21 THR 26 1HG2 THR 26 0.746 0.185 -20.518 924 HG22 THR 26 2HG2 THR 26 -0.370 -1.079 -21.073 925 HG23 THR 26 3HG2 THR 26 1.380 -1.234 -21.326 926 H VAL 27 H VAL 27 1.129 -0.035 -16.650 927 HA VAL 27 HA VAL 27 0.981 2.637 -17.507 928 HB VAL 27 HB VAL 27 1.036 1.574 -14.659 929 HG11 VAL 27 1HG1 VAL 27 1.531 3.958 -14.718 930 HG12 VAL 27 2HG1 VAL 27 -0.076 3.672 -14.046 931 HG13 VAL 27 3HG1 VAL 27 0.101 4.241 -15.705 932 HG21 VAL 27 1HG2 VAL 27 -1.309 2.283 -16.417 933 HG22 VAL 27 2HG2 VAL 27 -1.391 1.737 -14.745 934 HG23 VAL 27 3HG2 VAL 27 -0.801 0.642 -15.995 935 H TYR 28 H TYR 28 3.453 0.867 -15.746 936 HA TYR 28 HA TYR 28 4.933 3.111 -14.924 937 HB2 TYR 28 2HB TYR 28 5.313 0.892 -13.908 938 HB3 TYR 28 1HB TYR 28 5.999 0.315 -15.426 939 HD1 TYR 28 1HD TYR 28 8.262 0.828 -16.031 940 HD2 TYR 28 2HD TYR 28 6.517 2.659 -12.619 941 HE1 TYR 28 1HE TYR 28 10.459 1.722 -15.388 942 HE2 TYR 28 2HE TYR 28 8.708 3.553 -11.962 943 HH TYR 28 HH TYR 28 11.300 3.601 -14.124 944 H ARG 29 H ARG 29 5.492 0.956 -17.676 945 HA ARG 29 HA ARG 29 7.614 2.513 -18.670 946 HB2 ARG 29 2HB ARG 29 5.911 0.448 -20.025 947 HB3 ARG 29 1HB ARG 29 7.228 1.274 -20.843 948 HG2 ARG 29 2HG ARG 29 8.813 0.404 -19.206 949 HG3 ARG 29 1HG ARG 29 7.495 -0.404 -18.353 950 HD2 ARG 29 2HD ARG 29 8.261 -0.920 -21.227 951 HD3 ARG 29 1HD ARG 29 8.757 -1.907 -19.854 952 HE ARG 29 HE ARG 29 6.493 -2.474 -19.469 953 HH11 ARG 29 1HH1 ARG 29 7.083 -0.927 -22.620 954 HH12 ARG 29 2HH1 ARG 29 5.717 -1.599 -23.365 955 HH21 ARG 29 1HH2 ARG 29 4.649 -3.376 -20.467 956 HH22 ARG 29 2HH2 ARG 29 4.262 -3.042 -22.112 957 H ALA 30 H ALA 30 4.202 2.798 -19.092 958 HA ALA 30 HA ALA 30 4.110 4.390 -21.375 959 HB1 ALA 30 1HB ALA 30 2.319 4.575 -18.948 960 HB2 ALA 30 2HB ALA 30 2.106 3.463 -20.300 961 HB3 ALA 30 3HB ALA 30 1.957 5.201 -20.555 962 H LEU 31 H LEU 31 4.440 5.409 -17.964 963 HA LEU 31 HA LEU 31 4.795 8.088 -18.832 964 HB2 LEU 31 2HB LEU 31 5.141 6.975 -16.077 965 HB3 LEU 31 1HB LEU 31 5.432 8.658 -16.469 966 HG LEU 31 HG LEU 31 3.007 8.500 -17.399 967 HD11 LEU 31 1HD1 LEU 31 2.651 6.143 -17.039 968 HD12 LEU 31 2HD1 LEU 31 1.549 7.107 -16.045 969 HD13 LEU 31 3HD1 LEU 31 2.962 6.360 -15.314 970 HD21 LEU 31 1HD2 LEU 31 3.653 10.035 -15.731 971 HD22 LEU 31 2HD2 LEU 31 3.684 8.775 -14.492 972 HD23 LEU 31 3HD2 LEU 31 2.164 9.230 -15.248 973 H GLU 32 H GLU 32 6.998 5.532 -18.170 974 HA GLU 32 HA GLU 32 9.338 7.073 -17.940 975 HB2 GLU 32 2HB GLU 32 8.965 4.329 -19.150 976 HB3 GLU 32 1HB GLU 32 10.525 5.039 -18.772 977 HG2 GLU 32 2HG GLU 32 8.363 4.510 -16.750 978 HG3 GLU 32 1HG GLU 32 9.699 3.418 -17.087 979 H GLU 33 H GLU 33 7.628 5.847 -20.765 980 HA GLU 33 HA GLU 33 9.452 6.882 -22.669 981 HB2 GLU 33 2HB GLU 33 6.557 6.084 -22.972 982 HB3 GLU 33 1HB GLU 33 7.615 6.502 -24.313 983 HG2 GLU 33 2HG GLU 33 8.056 4.232 -22.388 984 HG3 GLU 33 1HG GLU 33 7.411 4.084 -24.023 985 H LYS 34 H LYS 34 6.912 8.280 -20.887 986 HA LYS 34 HA LYS 34 6.844 10.700 -22.499 987 HB2 LYS 34 2HB LYS 34 5.304 9.714 -20.144 988 HB3 LYS 34 1HB LYS 34 5.311 11.426 -20.514 989 HG2 LYS 34 2HG LYS 34 4.458 9.279 -22.447 990 HG3 LYS 34 1HG LYS 34 3.354 10.187 -21.408 991 HD2 LYS 34 2HD LYS 34 4.237 12.292 -22.421 992 HD3 LYS 34 1HD LYS 34 5.172 11.314 -23.541 993 HE2 LYS 34 2HE LYS 34 3.142 10.352 -24.448 994 HE3 LYS 34 1HE LYS 34 2.169 11.242 -23.278 995 HZ1 LYS 34 1HZ LYS 34 3.839 12.433 -25.437 996 HZ2 LYS 34 2HZ LYS 34 2.989 13.309 -24.275 997 HZ3 LYS 34 3HZ LYS 34 2.150 12.389 -25.388 998 H GLY 35 H GLY 35 8.752 9.484 -20.056 999 HA2 GLY 35 2HA GLY 35 10.535 10.459 -18.988 1000 HA3 GLY 35 1HA GLY 35 10.090 11.992 -19.720 1001 H TYR 36 H TYR 36 7.530 10.520 -18.067 1002 HA TYR 36 HA TYR 36 7.748 12.542 -15.947 1003 HB2 TYR 36 2HB TYR 36 5.426 10.726 -16.629 1004 HB3 TYR 36 1HB TYR 36 5.401 11.977 -15.403 1005 HD1 TYR 36 1HD TYR 36 3.957 11.268 -18.269 1006 HD2 TYR 36 2HD TYR 36 6.530 14.296 -16.767 1007 HE1 TYR 36 1HE TYR 36 3.094 12.822 -19.955 1008 HE2 TYR 36 2HE TYR 36 5.674 15.866 -18.458 1009 HH TYR 36 HH TYR 36 4.591 15.773 -20.650 1010 H ASN 37 H ASN 37 6.540 11.570 -13.823 1011 HA ASN 37 HA ASN 37 8.130 9.216 -13.135 1012 HB2 ASN 37 2HB ASN 37 6.901 11.351 -11.397 1013 HB3 ASN 37 1HB ASN 37 7.614 9.898 -10.729 1014 HD21 ASN 37 1HD2 ASN 37 8.372 12.576 -10.266 1015 HD22 ASN 37 2HD2 ASN 37 9.999 12.785 -10.785 1016 HA PRO 38 HA PRO 38 4.176 7.122 -13.653 1017 HB2 PRO 38 2HB PRO 38 5.704 4.767 -12.865 1018 HB3 PRO 38 1HB PRO 38 4.822 5.094 -14.358 1019 HG2 PRO 38 2HG PRO 38 7.546 5.045 -14.159 1020 HG3 PRO 38 1HG PRO 38 6.674 5.936 -15.403 1021 HD2 PRO 38 2HD PRO 38 8.086 6.922 -13.004 1022 HD3 PRO 38 1HD PRO 38 7.698 7.740 -14.538 1023 H ILE 39 H ILE 39 6.394 6.532 -10.934 1024 HA ILE 39 HA ILE 39 4.426 5.190 -9.407 1025 HB ILE 39 HB ILE 39 6.949 6.549 -8.396 1026 HG12 ILE 39 2HG1 ILE 39 7.472 4.853 -10.090 1027 HG13 ILE 39 1HG1 ILE 39 7.972 4.313 -8.493 1028 HG21 ILE 39 1HG2 ILE 39 5.381 6.135 -6.598 1029 HG22 ILE 39 2HG2 ILE 39 6.761 5.046 -6.476 1030 HG23 ILE 39 3HG2 ILE 39 5.226 4.452 -7.103 1031 HD11 ILE 39 1HD1 ILE 39 6.986 2.507 -9.770 1032 HD12 ILE 39 2HD1 ILE 39 5.502 3.435 -9.979 1033 HD13 ILE 39 3HD1 ILE 39 5.985 2.894 -8.370 1034 H ASN 40 H ASN 40 5.598 8.517 -9.420 1035 HA ASN 40 HA ASN 40 4.050 9.593 -7.356 1036 HB2 ASN 40 2HB ASN 40 4.950 10.870 -9.943 1037 HB3 ASN 40 1HB ASN 40 4.074 11.760 -8.716 1038 HD21 ASN 40 1HD2 ASN 40 5.431 10.469 -6.466 1039 HD22 ASN 40 2HD2 ASN 40 7.014 11.102 -6.464 1040 H GLN 41 H GLN 41 3.169 9.027 -10.725 1041 HA GLN 41 HA GLN 41 0.652 10.281 -10.377 1042 HB2 GLN 41 2HB GLN 41 1.601 8.513 -12.623 1043 HB3 GLN 41 1HB GLN 41 0.198 9.579 -12.653 1044 HG2 GLN 41 2HG GLN 41 3.069 10.460 -12.351 1045 HG3 GLN 41 1HG GLN 41 2.102 10.591 -13.808 1046 HE21 GLN 41 1HE2 GLN 41 -0.286 11.426 -12.429 1047 HE22 GLN 41 2HE2 GLN 41 0.003 13.046 -11.908 1048 H ILE 42 H ILE 42 1.789 6.942 -10.269 1049 HA ILE 42 HA ILE 42 -0.785 5.763 -10.141 1050 HB ILE 42 HB ILE 42 1.861 4.679 -9.099 1051 HG12 ILE 42 2HG1 ILE 42 0.331 4.076 -11.646 1052 HG13 ILE 42 1HG1 ILE 42 1.784 5.059 -11.540 1053 HG21 ILE 42 1HG2 ILE 42 0.013 3.584 -7.945 1054 HG22 ILE 42 2HG2 ILE 42 0.750 2.461 -9.086 1055 HG23 ILE 42 3HG2 ILE 42 -0.780 3.244 -9.478 1056 HD11 ILE 42 1HD1 ILE 42 3.052 3.096 -10.806 1057 HD12 ILE 42 2HD1 ILE 42 2.281 2.831 -12.368 1058 HD13 ILE 42 3HD1 ILE 42 1.586 2.117 -10.912 1059 H VAL 43 H VAL 43 1.524 6.624 -7.543 1060 HA VAL 43 HA VAL 43 -0.186 5.908 -5.438 1061 HB VAL 43 HB VAL 43 2.180 6.283 -4.936 1062 HG11 VAL 43 1HG1 VAL 43 2.661 8.064 -6.526 1063 HG12 VAL 43 2HG1 VAL 43 3.121 8.597 -4.908 1064 HG13 VAL 43 3HG1 VAL 43 1.625 9.181 -5.631 1065 HG21 VAL 43 1HG2 VAL 43 0.492 8.357 -3.532 1066 HG22 VAL 43 2HG2 VAL 43 2.035 7.724 -2.952 1067 HG23 VAL 43 3HG2 VAL 43 0.634 6.653 -3.098 1068 H GLY 44 H GLY 44 0.047 8.847 -7.307 1069 HA2 GLY 44 2HA GLY 44 -1.769 10.436 -5.859 1070 HA3 GLY 44 1HA GLY 44 -1.420 10.587 -7.573 1071 H TYR 45 H TYR 45 -2.281 8.231 -8.608 1072 HA TYR 45 HA TYR 45 -5.030 8.656 -8.772 1073 HB2 TYR 45 2HB TYR 45 -4.011 7.630 -10.685 1074 HB3 TYR 45 1HB TYR 45 -3.404 6.286 -9.723 1075 HD1 TYR 45 1HD TYR 45 -4.568 4.278 -9.875 1076 HD2 TYR 45 2HD TYR 45 -6.692 7.901 -10.488 1077 HE1 TYR 45 1HE TYR 45 -6.629 3.001 -10.246 1078 HE2 TYR 45 2HE TYR 45 -8.756 6.634 -10.879 1079 HH TYR 45 HH TYR 45 -9.495 4.395 -11.477 1080 H LEU 46 H LEU 46 -3.348 6.000 -7.080 1081 HA LEU 46 HA LEU 46 -5.810 4.890 -6.289 1082 HB2 LEU 46 2HB LEU 46 -3.061 4.378 -5.262 1083 HB3 LEU 46 1HB LEU 46 -4.453 3.598 -4.537 1084 HG LEU 46 HG LEU 46 -4.920 2.631 -6.862 1085 HD11 LEU 46 1HD1 LEU 46 -3.126 2.475 -8.427 1086 HD12 LEU 46 2HD1 LEU 46 -2.143 3.526 -7.408 1087 HD13 LEU 46 3HD1 LEU 46 -3.605 4.156 -8.156 1088 HD21 LEU 46 1HD2 LEU 46 -3.278 0.856 -6.610 1089 HD22 LEU 46 2HD2 LEU 46 -4.009 1.292 -5.066 1090 HD23 LEU 46 3HD2 LEU 46 -2.383 1.850 -5.463 1091 H LEU 47 H LEU 47 -3.791 7.240 -4.661 1092 HA LEU 47 HA LEU 47 -5.396 6.961 -2.310 1093 HB2 LEU 47 2HB LEU 47 -3.251 8.965 -2.955 1094 HB3 LEU 47 1HB LEU 47 -4.083 8.873 -1.415 1095 HG LEU 47 HG LEU 47 -2.280 6.756 -2.604 1096 HD11 LEU 47 1HD1 LEU 47 -1.063 8.654 -1.740 1097 HD12 LEU 47 2HD1 LEU 47 -0.850 7.246 -0.699 1098 HD13 LEU 47 3HD1 LEU 47 -1.939 8.543 -0.214 1099 HD21 LEU 47 1HD2 LEU 47 -4.073 5.689 -1.359 1100 HD22 LEU 47 2HD2 LEU 47 -3.783 6.763 0.013 1101 HD23 LEU 47 3HD2 LEU 47 -2.561 5.589 -0.461 1102 H SER 48 H SER 48 -5.423 9.133 -5.076 1103 HA SER 48 HA SER 48 -7.369 10.778 -3.666 1104 HB2 SER 48 2HB SER 48 -5.580 11.827 -5.021 1105 HB3 SER 48 1HB SER 48 -6.269 11.087 -6.458 1106 HG SER 48 HG SER 48 -6.874 13.366 -5.423 1107 H GLY 49 H GLY 49 -7.309 8.230 -6.074 1108 HA2 GLY 49 2HA GLY 49 -9.092 7.062 -6.960 1109 HA3 GLY 49 1HA GLY 49 -10.155 8.123 -6.040 1110 H ASP 50 H ASP 50 -7.803 9.509 -8.153 1111 HA ASP 50 HA ASP 50 -10.046 10.306 -9.872 1112 HB2 ASP 50 2HB ASP 50 -8.975 12.099 -8.422 1113 HB3 ASP 50 1HB ASP 50 -7.528 11.885 -9.405 1114 HA PRO 51 HA PRO 51 -7.692 7.844 -12.800 1115 HB2 PRO 51 2HB PRO 51 -9.545 9.016 -14.786 1116 HB3 PRO 51 1HB PRO 51 -9.220 7.326 -14.387 1117 HG2 PRO 51 2HG PRO 51 -11.497 8.514 -13.633 1118 HG3 PRO 51 1HG PRO 51 -10.692 7.307 -12.616 1119 HD2 PRO 51 2HD PRO 51 -10.731 10.288 -12.340 1120 HD3 PRO 51 1HD PRO 51 -10.808 9.013 -11.099 1121 H ALA 52 H ALA 52 -8.140 11.290 -13.103 1122 HA ALA 52 HA ALA 52 -6.810 11.711 -15.549 1123 HB1 ALA 52 1HB ALA 52 -6.718 14.051 -14.967 1124 HB2 ALA 52 2HB ALA 52 -7.097 13.670 -13.289 1125 HB3 ALA 52 3HB ALA 52 -8.290 13.367 -14.549 1126 H TYR 53 H TYR 53 -5.457 10.759 -12.649 1127 HA TYR 53 HA TYR 53 -3.038 12.166 -12.746 1128 HB2 TYR 53 2HB TYR 53 -3.867 9.694 -11.323 1129 HB3 TYR 53 1HB TYR 53 -2.177 10.197 -11.317 1130 HD1 TYR 53 1HD TYR 53 -1.572 12.392 -10.462 1131 HD2 TYR 53 2HD TYR 53 -5.487 10.846 -9.994 1132 HE1 TYR 53 1HE TYR 53 -1.976 14.018 -8.743 1133 HE2 TYR 53 2HE TYR 53 -5.928 12.491 -8.224 1134 HH TYR 53 HH TYR 53 -3.802 15.115 -7.660 1135 H ILE 54 H ILE 54 -4.033 9.306 -14.522 1136 HA ILE 54 HA ILE 54 -1.236 8.906 -15.289 1137 HB ILE 54 HB ILE 54 -3.616 7.091 -15.878 1138 HG12 ILE 54 2HG1 ILE 54 -3.068 7.063 -13.487 1139 HG13 ILE 54 1HG1 ILE 54 -2.557 5.565 -14.254 1140 HG21 ILE 54 1HG2 ILE 54 -1.966 5.449 -16.626 1141 HG22 ILE 54 2HG2 ILE 54 -0.673 6.619 -16.351 1142 HG23 ILE 54 3HG2 ILE 54 -1.879 6.923 -17.595 1143 HD11 ILE 54 1HD1 ILE 54 -0.916 6.336 -12.653 1144 HD12 ILE 54 2HD1 ILE 54 -0.758 7.857 -13.524 1145 HD13 ILE 54 3HD1 ILE 54 -0.256 6.348 -14.289 1146 HA PRO 55 HA PRO 55 -2.129 11.250 -18.934 1147 HB2 PRO 55 2HB PRO 55 0.272 10.925 -20.174 1148 HB3 PRO 55 1HB PRO 55 0.033 12.032 -18.817 1149 HG2 PRO 55 2HG PRO 55 1.170 9.267 -18.829 1150 HG3 PRO 55 1HG PRO 55 1.726 10.702 -17.947 1151 HD2 PRO 55 2HD PRO 55 0.266 8.736 -16.792 1152 HD3 PRO 55 1HD PRO 55 0.163 10.430 -16.274 1153 H ARG 56 H ARG 56 -2.626 10.897 -21.069 1154 HA ARG 56 HA ARG 56 -3.019 8.130 -21.705 1155 HB2 ARG 56 2HB ARG 56 -4.423 8.932 -23.602 1156 HB3 ARG 56 1HB ARG 56 -4.969 9.444 -22.016 1157 HG2 ARG 56 2HG ARG 56 -3.964 11.663 -22.422 1158 HG3 ARG 56 1HG ARG 56 -3.476 11.116 -24.027 1159 HD2 ARG 56 2HD ARG 56 -5.800 10.738 -24.616 1160 HD3 ARG 56 1HD ARG 56 -6.299 11.216 -23.000 1161 HE ARG 56 HE ARG 56 -4.882 13.337 -23.935 1162 HH11 ARG 56 1HH1 ARG 56 -7.631 11.505 -25.175 1163 HH12 ARG 56 2HH1 ARG 56 -8.443 12.842 -25.829 1164 HH21 ARG 56 1HH2 ARG 56 -5.973 15.214 -24.891 1165 HH22 ARG 56 2HH2 ARG 56 -7.491 14.985 -25.661 1166 H TYR 57 H TYR 57 -0.850 7.710 -21.923 1167 HA TYR 57 HA TYR 57 0.277 8.331 -24.549 1168 HB2 TYR 57 2HB TYR 57 1.868 8.365 -22.712 1169 HB3 TYR 57 1HB TYR 57 1.378 6.759 -22.199 1170 HD1 TYR 57 1HD TYR 57 2.877 8.520 -25.148 1171 HD2 TYR 57 2HD TYR 57 2.633 4.939 -22.872 1172 HE1 TYR 57 1HE TYR 57 4.652 7.525 -26.529 1173 HE2 TYR 57 2HE TYR 57 4.400 3.934 -24.245 1174 HH TYR 57 HH TYR 57 5.311 4.193 -26.400 1175 H GLN 58 H GLN 58 -1.080 5.730 -22.700 1176 HA GLN 58 HA GLN 58 -1.628 4.194 -25.106 1177 HB2 GLN 58 2HB GLN 58 -0.174 3.127 -22.666 1178 HB3 GLN 58 1HB GLN 58 -0.985 2.088 -23.822 1179 HG2 GLN 58 2HG GLN 58 1.251 3.977 -24.529 1180 HG3 GLN 58 1HG GLN 58 1.483 2.276 -24.129 1181 HE21 GLN 58 1HE2 GLN 58 0.844 0.719 -25.585 1182 HE22 GLN 58 2HE2 GLN 58 0.423 1.071 -27.213 1183 H ASP 59 H ASP 59 -3.021 2.216 -24.289 1184 HA ASP 59 HA ASP 59 -5.317 3.256 -23.056 1185 HB2 ASP 59 2HB ASP 59 -6.189 0.914 -23.166 1186 HB3 ASP 59 1HB ASP 59 -5.597 1.531 -24.698 1187 H ALA 60 H ALA 60 -2.525 2.149 -21.709 1188 HA ALA 60 HA ALA 60 -3.128 0.830 -19.369 1189 HB1 ALA 60 1HB ALA 60 -1.094 1.764 -18.440 1190 HB2 ALA 60 2HB ALA 60 -1.109 3.045 -19.657 1191 HB3 ALA 60 3HB ALA 60 -0.862 1.369 -20.145 1192 H ARG 61 H ARG 61 -3.560 4.265 -20.031 1193 HA ARG 61 HA ARG 61 -4.165 5.012 -17.403 1194 HB2 ARG 61 2HB ARG 61 -5.307 7.045 -18.468 1195 HB3 ARG 61 1HB ARG 61 -3.614 6.814 -18.837 1196 HG2 ARG 61 2HG ARG 61 -4.675 7.522 -20.823 1197 HG3 ARG 61 1HG ARG 61 -4.337 5.809 -21.038 1198 HD2 ARG 61 2HD ARG 61 -6.729 5.386 -20.408 1199 HD3 ARG 61 1HD ARG 61 -6.975 7.132 -20.427 1200 HE ARG 61 HE ARG 61 -5.920 5.802 -22.821 1201 HH11 ARG 61 1HH1 ARG 61 -8.511 7.734 -21.330 1202 HH12 ARG 61 2HH1 ARG 61 -9.380 7.876 -22.778 1203 HH21 ARG 61 1HH2 ARG 61 -7.121 6.028 -24.763 1204 HH22 ARG 61 2HH2 ARG 61 -8.576 6.881 -24.795 1205 H ASN 62 H ASN 62 -6.157 3.597 -19.863 1206 HA ASN 62 HA ASN 62 -8.558 3.884 -18.332 1207 HB2 ASN 62 2HB ASN 62 -8.591 3.732 -20.817 1208 HB3 ASN 62 1HB ASN 62 -8.009 2.073 -20.695 1209 HD21 ASN 62 1HD2 ASN 62 -9.812 1.208 -21.643 1210 HD22 ASN 62 2HD2 ASN 62 -11.349 1.150 -20.864 1211 H LEU 63 H LEU 63 -6.116 1.453 -18.928 1212 HA LEU 63 HA LEU 63 -7.316 -0.785 -17.745 1213 HB2 LEU 63 2HB LEU 63 -4.374 -0.121 -17.827 1214 HB3 LEU 63 1HB LEU 63 -5.069 -1.690 -17.488 1215 HG LEU 63 HG LEU 63 -5.231 -0.239 -20.129 1216 HD11 LEU 63 1HD1 LEU 63 -2.975 -1.119 -19.566 1217 HD12 LEU 63 2HD1 LEU 63 -3.730 -1.986 -20.905 1218 HD13 LEU 63 3HD1 LEU 63 -3.698 -2.697 -19.298 1219 HD21 LEU 63 1HD2 LEU 63 -6.175 -2.313 -20.945 1220 HD22 LEU 63 2HD2 LEU 63 -7.206 -1.633 -19.674 1221 HD23 LEU 63 3HD2 LEU 63 -6.124 -2.988 -19.321 1222 H ILE 64 H ILE 64 -5.336 1.745 -16.293 1223 HA ILE 64 HA ILE 64 -5.103 0.431 -13.800 1224 HB ILE 64 HB ILE 64 -3.531 2.218 -14.558 1225 HG12 ILE 64 2HG1 ILE 64 -4.887 2.842 -11.921 1226 HG13 ILE 64 1HG1 ILE 64 -3.704 1.563 -12.162 1227 HG21 ILE 64 1HG2 ILE 64 -4.201 4.597 -14.283 1228 HG22 ILE 64 2HG2 ILE 64 -5.851 4.054 -13.966 1229 HG23 ILE 64 3HG2 ILE 64 -5.126 3.765 -15.533 1230 HD11 ILE 64 1HD1 ILE 64 -2.024 3.263 -12.742 1231 HD12 ILE 64 2HD1 ILE 64 -2.686 3.500 -11.125 1232 HD13 ILE 64 3HD1 ILE 64 -3.224 4.522 -12.453 1233 H ARG 65 H ARG 65 -7.498 2.560 -15.140 1234 HA ARG 65 HA ARG 65 -8.828 2.874 -12.572 1235 HB2 ARG 65 2HB ARG 65 -10.356 4.394 -13.726 1236 HB3 ARG 65 1HB ARG 65 -8.689 4.837 -14.048 1237 HG2 ARG 65 2HG ARG 65 -8.814 3.767 -16.214 1238 HG3 ARG 65 1HG ARG 65 -10.483 3.306 -15.911 1239 HD2 ARG 65 2HD ARG 65 -11.013 5.736 -15.650 1240 HD3 ARG 65 1HD ARG 65 -9.355 6.088 -16.133 1241 HE ARG 65 HE ARG 65 -10.820 4.434 -17.977 1242 HH11 ARG 65 1HH1 ARG 65 -9.930 7.765 -17.101 1243 HH12 ARG 65 2HH1 ARG 65 -10.299 8.402 -18.624 1244 HH21 ARG 65 1HH2 ARG 65 -11.366 5.350 -20.071 1245 HH22 ARG 65 2HH2 ARG 65 -11.145 7.003 -20.355 1246 H ARG 66 H ARG 66 -8.609 0.500 -14.637 1247 HA ARG 66 HA ARG 66 -11.394 -0.335 -14.790 1248 HB2 ARG 66 2HB ARG 66 -9.821 -0.782 -16.673 1249 HB3 ARG 66 1HB ARG 66 -8.814 -1.718 -15.595 1250 HG2 ARG 66 2HG ARG 66 -10.095 -3.193 -17.012 1251 HG3 ARG 66 1HG ARG 66 -10.644 -3.352 -15.344 1252 HD2 ARG 66 2HD ARG 66 -12.548 -1.882 -15.844 1253 HD3 ARG 66 1HD ARG 66 -11.951 -1.728 -17.502 1254 HE ARG 66 HE ARG 66 -12.252 -4.433 -16.947 1255 HH11 ARG 66 1HH1 ARG 66 -14.352 -1.599 -17.345 1256 HH12 ARG 66 2HH1 ARG 66 -15.673 -2.496 -17.908 1257 HH21 ARG 66 1HH2 ARG 66 -14.063 -5.644 -17.725 1258 HH22 ARG 66 2HH2 ARG 66 -15.517 -4.841 -18.142 1259 H HIS 67 H HIS 67 -8.977 -0.261 -12.537 1260 HA HIS 67 HA HIS 67 -10.017 -2.596 -11.104 1261 HB2 HIS 67 2HB HIS 67 -7.166 -1.616 -11.200 1262 HB3 HIS 67 1HB HIS 67 -7.751 -2.881 -10.119 1263 HD1 HIS 67 1HD HIS 67 -8.579 -5.080 -11.406 1264 HD2 HIS 67 2HD HIS 67 -6.339 -2.385 -13.614 1265 HE1 HIS 67 1HE HIS 67 -7.725 -6.377 -13.402 1266 HE2 HIS 67 2HE HIS 67 -6.564 -4.647 -14.816 1267 H GLU 68 H GLU 68 -10.269 -2.294 -8.903 1268 HA GLU 68 HA GLU 68 -10.373 0.462 -8.196 1269 HB2 GLU 68 2HB GLU 68 -11.478 -1.941 -6.790 1270 HB3 GLU 68 1HB GLU 68 -11.508 -0.324 -6.098 1271 HG2 GLU 68 2HG GLU 68 -12.739 -1.134 -8.715 1272 HG3 GLU 68 1HG GLU 68 -13.609 -0.813 -7.214 1273 H ARG 69 H ARG 69 -9.498 1.456 -6.705 1274 HA ARG 69 HA ARG 69 -6.757 1.018 -6.413 1275 HB2 ARG 69 2HB ARG 69 -8.571 3.103 -5.199 1276 HB3 ARG 69 1HB ARG 69 -6.811 3.152 -5.228 1277 HG2 ARG 69 2HG ARG 69 -6.709 3.473 -7.497 1278 HG3 ARG 69 1HG ARG 69 -8.275 2.728 -7.766 1279 HD2 ARG 69 2HD ARG 69 -7.812 5.417 -6.489 1280 HD3 ARG 69 1HD ARG 69 -8.354 5.134 -8.149 1281 HE ARG 69 HE ARG 69 -9.955 5.211 -5.863 1282 HH11 ARG 69 1HH1 ARG 69 -9.721 3.296 -8.950 1283 HH12 ARG 69 2HH1 ARG 69 -11.291 2.695 -8.801 1284 HH21 ARG 69 1HH2 ARG 69 -12.121 4.379 -5.803 1285 HH22 ARG 69 2HH2 ARG 69 -12.638 3.262 -7.006 1286 H ASP 70 H ASP 70 -9.298 -0.056 -4.330 1287 HA ASP 70 HA ASP 70 -7.596 0.011 -1.993 1288 HB2 ASP 70 2HB ASP 70 -9.456 -1.006 -0.775 1289 HB3 ASP 70 1HB ASP 70 -10.050 0.347 -1.718 1290 H GLU 71 H GLU 71 -8.845 -2.332 -4.268 1291 HA GLU 71 HA GLU 71 -7.657 -4.571 -2.990 1292 HB2 GLU 71 2HB GLU 71 -9.607 -4.774 -4.468 1293 HB3 GLU 71 1HB GLU 71 -8.635 -4.234 -5.830 1294 HG2 GLU 71 2HG GLU 71 -8.933 -6.634 -5.867 1295 HG3 GLU 71 1HG GLU 71 -7.241 -6.206 -5.620 1296 H ILE 72 H ILE 72 -6.729 -2.460 -5.668 1297 HA ILE 72 HA ILE 72 -4.369 -3.778 -6.455 1298 HB ILE 72 HB ILE 72 -4.760 -0.772 -6.359 1299 HG12 ILE 72 2HG1 ILE 72 -5.362 -2.663 -8.648 1300 HG13 ILE 72 1HG1 ILE 72 -6.572 -1.878 -7.635 1301 HG21 ILE 72 1HG2 ILE 72 -2.908 -2.471 -8.039 1302 HG22 ILE 72 2HG2 ILE 72 -2.440 -1.412 -6.708 1303 HG23 ILE 72 3HG2 ILE 72 -3.104 -0.725 -8.194 1304 HD11 ILE 72 1HD1 ILE 72 -5.782 0.310 -8.413 1305 HD12 ILE 72 2HD1 ILE 72 -6.356 -0.697 -9.731 1306 HD13 ILE 72 3HD1 ILE 72 -4.620 -0.493 -9.468 1307 H MET 73 H MET 73 -5.034 -1.432 -3.929 1308 HA MET 73 HA MET 73 -2.358 -0.972 -3.169 1309 HB2 MET 73 2HB MET 73 -4.378 0.506 -2.739 1310 HB3 MET 73 1HB MET 73 -4.835 -0.612 -1.475 1311 HG2 MET 73 2HG MET 73 -2.296 1.014 -1.546 1312 HG3 MET 73 1HG MET 73 -3.740 1.425 -0.642 1313 HE1 MET 73 1HE MET 73 -0.912 1.339 0.682 1314 HE2 MET 73 2HE MET 73 -1.298 0.506 2.197 1315 HE3 MET 73 3HE MET 73 -2.424 1.687 1.512 1316 H GLU 74 H GLU 74 -4.892 -3.193 -1.913 1317 HA GLU 74 HA GLU 74 -3.412 -4.333 0.168 1318 HB2 GLU 74 2HB GLU 74 -5.463 -5.595 -1.647 1319 HB3 GLU 74 1HB GLU 74 -4.740 -6.437 -0.295 1320 HG2 GLU 74 2HG GLU 74 -5.647 -4.665 1.185 1321 HG3 GLU 74 1HG GLU 74 -6.511 -4.012 -0.215 1322 H GLU 75 H GLU 75 -3.613 -5.187 -3.212 1323 HA GLU 75 HA GLU 75 -1.946 -7.417 -3.117 1324 HB2 GLU 75 2HB GLU 75 -3.578 -6.846 -4.895 1325 HB3 GLU 75 1HB GLU 75 -2.521 -5.541 -5.404 1326 HG2 GLU 75 2HG GLU 75 -2.354 -7.513 -6.812 1327 HG3 GLU 75 1HG GLU 75 -0.830 -7.098 -6.015 1328 H LEU 76 H LEU 76 -1.275 -3.988 -3.715 1329 HA LEU 76 HA LEU 76 1.469 -4.131 -4.313 1330 HB2 LEU 76 2HB LEU 76 0.061 -1.958 -2.744 1331 HB3 LEU 76 1HB LEU 76 1.633 -1.817 -3.488 1332 HG LEU 76 HG LEU 76 -1.008 -2.083 -4.926 1333 HD11 LEU 76 1HD1 LEU 76 -0.593 0.217 -5.601 1334 HD12 LEU 76 2HD1 LEU 76 0.879 0.239 -4.638 1335 HD13 LEU 76 3HD1 LEU 76 -0.688 0.080 -3.846 1336 HD21 LEU 76 1HD2 LEU 76 0.795 -3.120 -6.194 1337 HD22 LEU 76 2HD2 LEU 76 1.768 -1.664 -6.013 1338 HD23 LEU 76 3HD2 LEU 76 0.274 -1.615 -6.948 1339 H THR 77 H THR 77 -0.234 -3.700 -1.177 1340 HA THR 77 HA THR 77 1.992 -3.409 0.406 1341 HB THR 77 HB THR 77 -0.704 -4.579 1.140 1342 HG1 THR 77 1HG THR 77 -1.060 -2.522 0.311 1343 HG21 THR 77 1HG2 THR 77 -0.210 -3.714 3.384 1344 HG22 THR 77 2HG2 THR 77 1.381 -3.183 2.839 1345 HG23 THR 77 3HG2 THR 77 1.001 -4.903 2.894 1346 H LYS 78 H LYS 78 0.368 -6.414 -0.608 1347 HA LYS 78 HA LYS 78 1.727 -8.097 1.178 1348 HB2 LYS 78 2HB LYS 78 0.570 -8.799 -1.510 1349 HB3 LYS 78 1HB LYS 78 1.150 -9.997 -0.351 1350 HG2 LYS 78 2HG LYS 78 -0.429 -9.114 1.261 1351 HG3 LYS 78 1HG LYS 78 -1.093 -8.043 0.054 1352 HD2 LYS 78 2HD LYS 78 -1.162 -11.091 0.040 1353 HD3 LYS 78 1HD LYS 78 -2.521 -10.027 0.336 1354 HE2 LYS 78 2HE LYS 78 -2.788 -10.792 -1.874 1355 HE3 LYS 78 1HE LYS 78 -2.166 -9.151 -2.016 1356 HZ1 LYS 78 1HZ LYS 78 -0.709 -11.700 -2.488 1357 HZ2 LYS 78 2HZ LYS 78 0.095 -10.212 -2.339 1358 HZ3 LYS 78 3HZ LYS 78 -0.984 -10.385 -3.550 1359 H TYR 79 H TYR 79 2.549 -7.128 -2.049 1360 HA TYR 79 HA TYR 79 4.857 -8.767 -2.251 1361 HB2 TYR 79 2HB TYR 79 3.912 -6.416 -3.841 1362 HB3 TYR 79 1HB TYR 79 5.486 -7.143 -4.133 1363 HD1 TYR 79 1HD TYR 79 2.403 -8.927 -3.202 1364 HD2 TYR 79 2HD TYR 79 5.171 -8.010 -6.241 1365 HE1 TYR 79 1HE TYR 79 1.346 -10.646 -4.668 1366 HE2 TYR 79 2HE TYR 79 4.210 -9.669 -7.704 1367 HH TYR 79 HH TYR 79 1.172 -11.148 -7.053 1368 H TYR 80 H TYR 80 4.329 -5.613 -1.003 1369 HA TYR 80 HA TYR 80 7.059 -4.896 -0.884 1370 HB2 TYR 80 2HB TYR 80 5.229 -3.253 -0.689 1371 HB3 TYR 80 1HB TYR 80 4.792 -3.951 0.868 1372 HD1 TYR 80 1HD TYR 80 7.714 -2.532 -0.906 1373 HD2 TYR 80 2HD TYR 80 5.683 -2.983 2.790 1374 HE1 TYR 80 1HE TYR 80 9.335 -1.080 0.129 1375 HE2 TYR 80 2HE TYR 80 7.315 -1.504 3.871 1376 HH TYR 80 HH TYR 80 9.513 0.387 2.086 1377 H LEU 81 H LEU 81 4.879 -6.319 1.548 1378 HA LEU 81 HA LEU 81 6.952 -6.598 3.466 1379 HB2 LEU 81 2HB LEU 81 4.221 -7.822 3.290 1380 HB3 LEU 81 1HB LEU 81 5.330 -8.280 4.564 1381 HG LEU 81 HG LEU 81 5.348 -5.898 5.314 1382 HD11 LEU 81 1HD1 LEU 81 4.739 -4.800 3.262 1383 HD12 LEU 81 2HD1 LEU 81 3.606 -4.390 4.550 1384 HD13 LEU 81 3HD1 LEU 81 3.148 -5.557 3.308 1385 HD21 LEU 81 1HD2 LEU 81 3.928 -7.542 6.373 1386 HD22 LEU 81 2HD2 LEU 81 2.650 -7.213 5.203 1387 HD23 LEU 81 3HD2 LEU 81 3.143 -5.959 6.342 1388 H ALA 82 H ALA 82 5.985 -8.549 0.790 1389 HA ALA 82 HA ALA 82 6.880 -11.023 1.500 1390 HB1 ALA 82 1HB ALA 82 7.115 -9.755 -1.213 1391 HB2 ALA 82 2HB ALA 82 5.666 -10.524 -0.546 1392 HB3 ALA 82 3HB ALA 82 7.113 -11.487 -0.858 1393 H ASN 83 H ASN 83 8.874 -8.228 0.925 1394 HA ASN 83 HA ASN 83 11.257 -9.480 0.055 1395 HB2 ASN 83 2HB ASN 83 12.486 -7.500 0.571 1396 HB3 ASN 83 1HB ASN 83 10.887 -6.948 0.103 1397 HD21 ASN 83 1HD2 ASN 83 9.565 -5.961 1.705 1398 HD22 ASN 83 2HD2 ASN 83 10.236 -5.468 3.211 1399 H HIS 84 H HIS 84 9.842 -9.396 3.194 1400 HA HIS 84 HA HIS 84 12.317 -10.240 4.490 1401 HB2 HIS 84 2HB HIS 84 9.603 -9.591 5.570 1402 HB3 HIS 84 1HB HIS 84 10.688 -10.578 6.532 1403 HD1 HIS 84 1HD HIS 84 12.620 -9.414 7.672 1404 HD2 HIS 84 2HD HIS 84 10.389 -6.867 5.268 1405 HE1 HIS 84 1HE HIS 84 13.383 -7.107 8.255 1406 HE2 HIS 84 2HE HIS 84 12.319 -5.643 6.607 1407 H GLY 85 H GLY 85 10.437 -11.868 2.536 1408 HA2 GLY 85 2HA GLY 85 10.378 -14.174 2.188 1409 HA3 GLY 85 1HA GLY 85 11.119 -14.395 3.767 1410 H ILE 86 H ILE 86 8.494 -12.316 3.705 1411 HA ILE 86 HA ILE 86 6.951 -14.065 5.373 1412 HB ILE 86 HB ILE 86 6.327 -11.280 4.355 1413 HG12 ILE 86 2HG1 ILE 86 7.386 -12.204 7.034 1414 HG13 ILE 86 1HG1 ILE 86 8.317 -11.358 5.801 1415 HG21 ILE 86 1HG2 ILE 86 4.633 -11.218 6.133 1416 HG22 ILE 86 2HG2 ILE 86 4.994 -12.899 6.532 1417 HG23 ILE 86 3HG2 ILE 86 4.299 -12.494 4.961 1418 HD11 ILE 86 1HD1 ILE 86 7.620 -9.853 7.588 1419 HD12 ILE 86 2HD1 ILE 86 5.935 -10.287 7.275 1420 HD13 ILE 86 3HD1 ILE 86 6.861 -9.418 6.049 1421 H ASP 87 H ASP 87 5.311 -15.237 4.746 1422 HA ASP 87 HA ASP 87 4.369 -14.963 1.979 1423 HB2 ASP 87 2HB ASP 87 3.979 -17.266 3.891 1424 HB3 ASP 87 1HB ASP 87 3.344 -17.193 2.254 1425 H ILE 88 H ILE 88 2.589 -14.008 1.630 1426 HA ILE 88 HA ILE 88 0.692 -13.762 3.847 1427 HB ILE 88 HB ILE 88 1.035 -11.823 1.531 1428 HG12 ILE 88 2HG1 ILE 88 2.170 -11.634 4.344 1429 HG13 ILE 88 1HG1 ILE 88 3.074 -11.866 2.862 1430 HG21 ILE 88 1HG2 ILE 88 -0.407 -11.605 4.181 1431 HG22 ILE 88 2HG2 ILE 88 -1.168 -11.786 2.598 1432 HG23 ILE 88 3HG2 ILE 88 -0.269 -10.320 2.983 1433 HD11 ILE 88 1HD1 ILE 88 3.210 -9.571 3.580 1434 HD12 ILE 88 2HD1 ILE 88 1.444 -9.467 3.567 1435 HD13 ILE 88 3HD1 ILE 88 2.305 -9.707 2.057 1436 H LYS 89 H LYS 89 -1.527 -13.911 3.254 1437 HA LYS 89 HA LYS 89 -2.038 -15.793 1.165 1438 HB2 LYS 89 2HB LYS 89 -3.993 -14.250 2.883 1439 HB3 LYS 89 1HB LYS 89 -4.345 -15.689 1.941 1440 HG2 LYS 89 2HG LYS 89 -2.833 -16.983 3.354 1441 HG3 LYS 89 1HG LYS 89 -2.498 -15.538 4.312 1442 HD2 LYS 89 2HD LYS 89 -4.918 -15.398 4.844 1443 HD3 LYS 89 1HD LYS 89 -5.162 -16.916 3.983 1444 HE2 LYS 89 2HE LYS 89 -4.993 -17.354 6.362 1445 HE3 LYS 89 1HE LYS 89 -3.591 -18.019 5.529 1446 HZ1 LYS 89 1HZ LYS 89 -2.972 -16.887 7.561 1447 HZ2 LYS 89 2HZ LYS 89 -3.679 -15.467 7.035 1448 HZ3 LYS 89 3HZ LYS 89 -2.309 -16.062 6.247 Start of MODEL 4 1 H1 MET 1 1HT MET 1 -14.359 8.110 27.145 2 H2 MET 1 2HT MET 1 -12.773 8.430 26.608 3 H3 MET 1 3HT MET 1 -13.963 9.583 26.453 4 HA MET 1 HA MET 1 -14.158 9.886 28.776 5 HB2 MET 1 2HB MET 1 -11.973 7.805 28.961 6 HB3 MET 1 1HB MET 1 -12.489 8.841 30.277 7 HG2 MET 1 2HG MET 1 -14.717 7.822 30.183 8 HG3 MET 1 1HG MET 1 -14.164 6.771 28.882 9 HE1 MET 1 1HE MET 1 -12.450 6.612 33.180 10 HE2 MET 1 2HE MET 1 -13.676 7.766 32.668 11 HE3 MET 1 3HE MET 1 -12.025 7.892 32.051 12 H GLY 2 H GLY 2 -12.957 11.487 29.750 13 HA2 GLY 2 2HA GLY 2 -11.189 12.879 30.126 14 HA3 GLY 2 1HA GLY 2 -10.221 11.899 29.039 15 H PHE 3 H PHE 3 -9.894 14.507 28.998 16 HA PHE 3 HA PHE 3 -11.444 15.694 26.861 17 HB2 PHE 3 2HB PHE 3 -10.686 17.027 28.834 18 HB3 PHE 3 1HB PHE 3 -9.021 16.703 28.385 19 HD1 PHE 3 1HD PHE 3 -12.069 18.553 27.540 20 HD2 PHE 3 2HD PHE 3 -7.969 17.929 26.596 21 HE1 PHE 3 1HE PHE 3 -12.071 20.608 26.190 22 HE2 PHE 3 2HE PHE 3 -7.962 19.987 25.247 23 HZ PHE 3 HZ PHE 3 -10.013 21.328 25.044 24 H THR 4 H THR 4 -10.949 14.844 24.901 25 HA THR 4 HA THR 4 -8.118 14.582 24.230 26 HB THR 4 HB THR 4 -8.732 12.594 22.817 27 HG1 THR 4 1HG THR 4 -10.890 12.665 22.596 28 HG21 THR 4 1HG2 THR 4 -7.670 12.274 25.012 29 HG22 THR 4 2HG2 THR 4 -8.836 10.988 24.695 30 HG23 THR 4 3HG2 THR 4 -9.253 12.308 25.785 31 H ASP 5 H ASP 5 -7.535 15.448 22.335 32 HA ASP 5 HA ASP 5 -9.562 16.747 20.728 33 HB2 ASP 5 2HB ASP 5 -7.491 17.966 21.323 34 HB3 ASP 5 1HB ASP 5 -6.540 16.734 20.505 35 H GLU 6 H GLU 6 -10.522 15.429 19.315 36 HA GLU 6 HA GLU 6 -8.897 13.342 18.125 37 HB2 GLU 6 2HB GLU 6 -10.872 12.477 19.209 38 HB3 GLU 6 1HB GLU 6 -11.901 13.569 18.296 39 HG2 GLU 6 2HG GLU 6 -11.340 12.409 16.235 40 HG3 GLU 6 1HG GLU 6 -10.238 11.356 17.114 41 H THR 7 H THR 7 -7.834 14.505 16.628 42 HA THR 7 HA THR 7 -9.395 15.005 14.258 43 HB THR 7 HB THR 7 -7.811 16.935 13.726 44 HG1 THR 7 1HG THR 7 -7.309 17.120 16.524 45 HG21 THR 7 1HG2 THR 7 -9.036 18.615 15.038 46 HG22 THR 7 2HG2 THR 7 -9.641 17.342 16.098 47 HG23 THR 7 3HG2 THR 7 -10.123 17.380 14.402 48 H VAL 8 H VAL 8 -8.429 14.108 12.463 49 HA VAL 8 HA VAL 8 -6.171 12.476 13.047 50 HB VAL 8 HB VAL 8 -7.887 11.495 11.620 51 HG11 VAL 8 1HG1 VAL 8 -8.770 13.432 10.503 52 HG12 VAL 8 2HG1 VAL 8 -8.268 12.243 9.307 53 HG13 VAL 8 3HG1 VAL 8 -7.258 13.652 9.619 54 HG21 VAL 8 1HG2 VAL 8 -5.633 10.679 11.313 55 HG22 VAL 8 2HG2 VAL 8 -5.313 11.934 10.116 56 HG23 VAL 8 3HG2 VAL 8 -6.486 10.664 9.768 57 H ARG 9 H ARG 9 -4.471 13.597 13.434 58 HA ARG 9 HA ARG 9 -3.556 15.442 11.356 59 HB2 ARG 9 2HB ARG 9 -2.752 15.362 14.257 60 HB3 ARG 9 1HB ARG 9 -2.165 16.504 13.061 61 HG2 ARG 9 2HG ARG 9 -4.477 17.331 12.780 62 HG3 ARG 9 1HG ARG 9 -4.982 16.253 14.085 63 HD2 ARG 9 2HD ARG 9 -3.350 17.384 15.564 64 HD3 ARG 9 1HD ARG 9 -2.997 18.507 14.254 65 HE ARG 9 HE ARG 9 -5.692 18.185 15.325 66 HH11 ARG 9 1HH1 ARG 9 -2.945 20.294 14.504 67 HH12 ARG 9 2HH1 ARG 9 -3.722 21.738 14.929 68 HH21 ARG 9 1HH2 ARG 9 -6.773 20.219 15.916 69 HH22 ARG 9 2HH2 ARG 9 -5.955 21.701 15.742 70 H PHE 10 H PHE 10 -2.444 14.182 10.052 71 HA PHE 10 HA PHE 10 -0.270 12.620 11.200 72 HB2 PHE 10 2HB PHE 10 -0.090 11.561 8.949 73 HB3 PHE 10 1HB PHE 10 -1.692 11.354 9.636 74 HD1 PHE 10 1HD PHE 10 -3.603 12.637 8.708 75 HD2 PHE 10 2HD PHE 10 0.263 12.770 6.925 76 HE1 PHE 10 1HE PHE 10 -4.587 13.547 6.646 77 HE2 PHE 10 2HE PHE 10 -0.717 13.681 4.862 78 HZ PHE 10 HZ PHE 10 -3.143 14.072 4.721 79 H ASP 11 H ASP 11 1.846 13.134 10.642 80 HA ASP 11 HA ASP 11 2.046 15.698 9.244 81 HB2 ASP 11 2HB ASP 11 2.618 15.780 11.679 82 HB3 ASP 11 1HB ASP 11 3.956 14.680 11.348 83 H PHE 12 H PHE 12 3.279 15.861 7.542 84 HA PHE 12 HA PHE 12 4.135 13.462 6.314 85 HB2 PHE 12 2HB PHE 12 3.145 15.398 5.095 86 HB3 PHE 12 1HB PHE 12 4.598 16.322 5.441 87 HD1 PHE 12 1HD PHE 12 3.224 13.466 3.582 88 HD2 PHE 12 2HD PHE 12 6.574 16.018 4.145 89 HE1 PHE 12 1HE PHE 12 4.228 12.601 1.513 90 HE2 PHE 12 2HE PHE 12 7.576 15.159 2.077 91 HZ PHE 12 HZ PHE 12 6.412 13.451 0.766 92 H ASP 13 H ASP 13 5.882 12.463 6.826 93 HA ASP 13 HA ASP 13 8.223 13.838 7.932 94 HB2 ASP 13 2HB ASP 13 7.266 11.887 9.159 95 HB3 ASP 13 1HB ASP 13 7.524 10.886 7.745 96 H ASP 14 H ASP 14 10.312 13.493 7.009 97 HA ASP 14 HA ASP 14 10.250 12.866 4.175 98 HB2 ASP 14 2HB ASP 14 11.598 14.842 5.086 99 HB3 ASP 14 1HB ASP 14 12.657 13.671 5.851 100 H ASN 15 H ASN 15 9.660 10.791 4.514 101 HA ASN 15 HA ASN 15 11.037 8.960 6.190 102 HB2 ASN 15 2HB ASN 15 9.006 8.402 4.036 103 HB3 ASN 15 1HB ASN 15 9.606 7.234 5.202 104 HD21 ASN 15 1HD2 ASN 15 7.490 9.922 4.677 105 HD22 ASN 15 2HD2 ASN 15 6.717 9.840 6.202 106 H ARG 16 H ARG 16 12.694 7.698 5.797 107 HA ARG 16 HA ARG 16 13.797 7.524 3.118 108 HB2 ARG 16 2HB ARG 16 14.701 6.287 5.724 109 HB3 ARG 16 1HB ARG 16 15.549 6.128 4.202 110 HG2 ARG 16 2HG ARG 16 15.935 8.557 4.185 111 HG3 ARG 16 1HG ARG 16 15.120 8.676 5.749 112 HD2 ARG 16 2HD ARG 16 17.562 8.586 6.000 113 HD3 ARG 16 1HD ARG 16 16.771 7.199 6.753 114 HE ARG 16 HE ARG 16 17.657 6.804 4.033 115 HH11 ARG 16 1HH1 ARG 16 18.534 6.450 7.457 116 HH12 ARG 16 2HH1 ARG 16 19.715 5.267 7.163 117 HH21 ARG 16 1HH2 ARG 16 19.265 5.135 3.662 118 HH22 ARG 16 2HH2 ARG 16 20.136 4.487 4.962 119 H LYS 17 H LYS 17 13.477 5.830 1.810 120 HA LYS 17 HA LYS 17 11.611 3.880 2.759 121 HB2 LYS 17 2HB LYS 17 12.730 4.316 -0.018 122 HB3 LYS 17 1HB LYS 17 11.568 3.056 0.371 123 HG2 LYS 17 2HG LYS 17 10.386 4.896 -0.643 124 HG3 LYS 17 1HG LYS 17 9.967 4.866 1.065 125 HD2 LYS 17 2HD LYS 17 11.659 6.622 1.465 126 HD3 LYS 17 1HD LYS 17 11.966 6.681 -0.266 127 HE2 LYS 17 2HE LYS 17 9.656 7.364 -0.652 128 HE3 LYS 17 1HE LYS 17 9.334 7.274 1.083 129 HZ1 LYS 17 1HZ LYS 17 9.807 9.558 0.508 130 HZ2 LYS 17 2HZ LYS 17 11.252 9.113 -0.251 131 HZ3 LYS 17 3HZ LYS 17 11.069 8.944 1.406 132 H LYS 18 H LYS 18 12.573 2.706 4.091 133 HA LYS 18 HA LYS 18 13.937 0.376 3.399 134 HB2 LYS 18 2HB LYS 18 15.863 2.069 3.163 135 HB3 LYS 18 1HB LYS 18 15.699 2.396 4.873 136 HG2 LYS 18 2HG LYS 18 16.373 -0.319 3.733 137 HG3 LYS 18 1HG LYS 18 17.588 0.861 4.199 138 HD2 LYS 18 2HD LYS 18 15.534 -0.365 6.062 139 HD3 LYS 18 1HD LYS 18 17.196 -0.923 5.903 140 HE2 LYS 18 2HE LYS 18 17.965 1.342 6.610 141 HE3 LYS 18 1HE LYS 18 16.280 1.790 6.853 142 HZ1 LYS 18 1HZ LYS 18 17.687 -0.395 8.293 143 HZ2 LYS 18 2HZ LYS 18 16.082 0.058 8.516 144 HZ3 LYS 18 3HZ LYS 18 17.313 1.128 8.941 145 H ALA 19 H ALA 19 13.515 2.898 5.797 146 HA ALA 19 HA ALA 19 13.278 1.218 8.077 147 HB1 ALA 19 1HB ALA 19 13.846 3.578 8.224 148 HB2 ALA 19 2HB ALA 19 12.370 3.204 9.142 149 HB3 ALA 19 3HB ALA 19 12.258 3.960 7.544 150 H ILE 20 H ILE 20 11.057 2.562 5.737 151 HA ILE 20 HA ILE 20 8.634 2.072 7.040 152 HB ILE 20 HB ILE 20 9.185 2.070 4.051 153 HG12 ILE 20 2HG1 ILE 20 8.408 4.364 5.870 154 HG13 ILE 20 1HG1 ILE 20 10.000 4.121 5.165 155 HG21 ILE 20 1HG2 ILE 20 6.628 2.576 5.579 156 HG22 ILE 20 2HG2 ILE 20 6.990 1.147 4.611 157 HG23 ILE 20 3HG2 ILE 20 6.826 2.721 3.832 158 HD11 ILE 20 1HD1 ILE 20 8.765 5.809 3.944 159 HD12 ILE 20 2HD1 ILE 20 7.447 4.671 3.667 160 HD13 ILE 20 3HD1 ILE 20 9.025 4.395 2.929 161 H SER 21 H SER 21 10.766 0.105 5.197 162 HA SER 21 HA SER 21 9.098 -2.095 4.596 163 HB2 SER 21 2HB SER 21 12.081 -2.075 5.085 164 HB3 SER 21 1HB SER 21 11.173 -3.275 4.154 165 HG SER 21 HG SER 21 10.572 -0.877 3.211 166 H GLU 22 H GLU 22 11.433 -1.544 7.157 167 HA GLU 22 HA GLU 22 11.055 -3.901 8.635 168 HB2 GLU 22 2HB GLU 22 11.924 -1.165 9.562 169 HB3 GLU 22 1HB GLU 22 12.228 -2.686 10.392 170 HG2 GLU 22 2HG GLU 22 13.662 -3.436 8.632 171 HG3 GLU 22 1HG GLU 22 13.241 -2.039 7.641 172 H THR 23 H THR 23 9.528 -0.765 8.667 173 HA THR 23 HA THR 23 8.003 -1.045 11.011 174 HB THR 23 HB THR 23 7.376 0.572 8.535 175 HG1 THR 23 1HG THR 23 9.434 0.890 9.923 176 HG21 THR 23 1HG2 THR 23 5.416 0.316 9.950 177 HG22 THR 23 2HG2 THR 23 6.041 1.960 10.093 178 HG23 THR 23 3HG2 THR 23 6.351 0.790 11.367 179 H LEU 24 H LEU 24 7.131 -1.573 7.571 180 HA LEU 24 HA LEU 24 4.493 -2.381 8.085 181 HB2 LEU 24 2HB LEU 24 6.249 -2.984 5.713 182 HB3 LEU 24 1HB LEU 24 4.525 -3.284 5.779 183 HG LEU 24 HG LEU 24 5.844 -0.572 5.931 184 HD11 LEU 24 1HD1 LEU 24 4.256 -1.882 3.738 185 HD12 LEU 24 2HD1 LEU 24 5.988 -1.539 3.718 186 HD13 LEU 24 3HD1 LEU 24 4.825 -0.214 3.744 187 HD21 LEU 24 1HD2 LEU 24 3.781 -0.608 7.230 188 HD22 LEU 24 2HD2 LEU 24 2.922 -1.339 5.870 189 HD23 LEU 24 3HD2 LEU 24 3.549 0.301 5.738 190 H GLU 25 H GLU 25 7.464 -4.229 7.841 191 HA GLU 25 HA GLU 25 6.350 -6.772 7.845 192 HB2 GLU 25 2HB GLU 25 8.723 -6.280 7.425 193 HB3 GLU 25 1HB GLU 25 8.934 -5.845 9.113 194 HG2 GLU 25 2HG GLU 25 8.401 -8.125 9.770 195 HG3 GLU 25 1HG GLU 25 8.188 -8.568 8.081 196 H THR 26 H THR 26 7.314 -4.621 10.477 197 HA THR 26 HA THR 26 6.664 -6.291 12.654 198 HB THR 26 HB THR 26 6.806 -3.274 12.520 199 HG1 THR 26 1HG THR 26 8.839 -4.010 11.994 200 HG21 THR 26 1HG2 THR 26 7.249 -3.402 14.946 201 HG22 THR 26 2HG2 THR 26 7.034 -5.155 14.882 202 HG23 THR 26 3HG2 THR 26 5.675 -4.092 14.533 203 H VAL 27 H VAL 27 4.863 -3.719 10.981 204 HA VAL 27 HA VAL 27 2.565 -3.715 12.582 205 HB VAL 27 HB VAL 27 2.812 -3.095 9.612 206 HG11 VAL 27 1HG1 VAL 27 0.493 -3.566 10.229 207 HG12 VAL 27 2HG1 VAL 27 0.722 -1.842 9.893 208 HG13 VAL 27 3HG1 VAL 27 0.626 -2.419 11.561 209 HG21 VAL 27 1HG2 VAL 27 2.794 -1.282 12.025 210 HG22 VAL 27 2HG2 VAL 27 2.856 -0.757 10.344 211 HG23 VAL 27 3HG2 VAL 27 4.197 -1.666 11.030 212 H TYR 28 H TYR 28 3.432 -5.632 9.770 213 HA TYR 28 HA TYR 28 1.044 -7.053 9.470 214 HB2 TYR 28 2HB TYR 28 2.803 -7.063 7.753 215 HB3 TYR 28 1HB TYR 28 3.886 -7.909 8.849 216 HD1 TYR 28 1HD TYR 28 3.531 -10.263 9.355 217 HD2 TYR 28 2HD TYR 28 1.037 -8.236 6.590 218 HE1 TYR 28 1HE TYR 28 2.699 -12.421 8.533 219 HE2 TYR 28 2HE TYR 28 0.194 -10.407 5.751 220 HH TYR 28 HH TYR 28 0.786 -13.329 7.395 221 H ARG 29 H ARG 29 3.983 -7.829 11.280 222 HA ARG 29 HA ARG 29 3.221 -10.289 12.336 223 HB2 ARG 29 2HB ARG 29 5.067 -8.179 13.406 224 HB3 ARG 29 1HB ARG 29 4.803 -9.709 14.222 225 HG2 ARG 29 2HG ARG 29 5.876 -9.369 11.428 226 HG3 ARG 29 1HG ARG 29 6.834 -9.744 12.866 227 HD2 ARG 29 2HD ARG 29 4.692 -11.462 11.599 228 HD3 ARG 29 1HD ARG 29 6.414 -11.793 11.703 229 HE ARG 29 HE ARG 29 5.667 -11.495 14.286 230 HH11 ARG 29 1HH1 ARG 29 4.682 -13.658 11.662 231 HH12 ARG 29 2HH1 ARG 29 4.106 -14.876 12.719 232 HH21 ARG 29 1HH2 ARG 29 4.881 -13.197 15.713 233 HH22 ARG 29 2HH2 ARG 29 4.216 -14.604 15.019 234 H ALA 30 H ALA 30 2.748 -7.104 13.687 235 HA ALA 30 HA ALA 30 1.606 -7.908 16.127 236 HB1 ALA 30 1HB ALA 30 2.389 -5.616 15.715 237 HB2 ALA 30 2HB ALA 30 0.726 -5.635 16.303 238 HB3 ALA 30 3HB ALA 30 1.055 -5.365 14.592 239 H LEU 31 H LEU 31 0.095 -7.100 13.059 240 HA LEU 31 HA LEU 31 -2.538 -7.515 13.985 241 HB2 LEU 31 2HB LEU 31 -1.386 -7.242 11.244 242 HB3 LEU 31 1HB LEU 31 -3.110 -7.446 11.534 243 HG LEU 31 HG LEU 31 -1.521 -5.268 12.809 244 HD11 LEU 31 1HD1 LEU 31 -3.199 -5.120 10.299 245 HD12 LEU 31 2HD1 LEU 31 -1.435 -5.060 10.311 246 HD13 LEU 31 3HD1 LEU 31 -2.370 -3.765 11.062 247 HD21 LEU 31 1HD2 LEU 31 -3.743 -4.240 12.994 248 HD22 LEU 31 2HD2 LEU 31 -3.573 -5.746 13.897 249 HD23 LEU 31 3HD2 LEU 31 -4.440 -5.720 12.357 250 H GLU 32 H GLU 32 -0.215 -9.673 12.565 251 HA GLU 32 HA GLU 32 -1.934 -11.858 12.078 252 HB2 GLU 32 2HB GLU 32 0.972 -11.683 12.823 253 HB3 GLU 32 1HB GLU 32 0.175 -13.227 12.575 254 HG2 GLU 32 2HG GLU 32 0.268 -11.055 10.509 255 HG3 GLU 32 1HG GLU 32 1.478 -12.330 10.640 256 H GLU 33 H GLU 33 -0.083 -10.904 14.938 257 HA GLU 33 HA GLU 33 -1.022 -13.077 16.494 258 HB2 GLU 33 2HB GLU 33 0.300 -10.515 17.374 259 HB3 GLU 33 1HB GLU 33 -0.006 -11.905 18.406 260 HG2 GLU 33 2HG GLU 33 1.404 -13.270 16.872 261 HG3 GLU 33 1HG GLU 33 1.798 -11.784 16.008 262 H LYS 34 H LYS 34 -2.154 -9.857 15.940 263 HA LYS 34 HA LYS 34 -4.109 -10.001 18.075 264 HB2 LYS 34 2HB LYS 34 -3.696 -7.974 15.886 265 HB3 LYS 34 1HB LYS 34 -4.913 -7.839 17.141 266 HG2 LYS 34 2HG LYS 34 -1.943 -7.961 17.621 267 HG3 LYS 34 1HG LYS 34 -2.895 -6.484 17.555 268 HD2 LYS 34 2HD LYS 34 -3.360 -8.734 19.512 269 HD3 LYS 34 1HD LYS 34 -2.417 -7.301 19.868 270 HE2 LYS 34 2HE LYS 34 -4.397 -5.907 19.436 271 HE3 LYS 34 1HE LYS 34 -5.353 -7.364 19.139 272 HZ1 LYS 34 1HZ LYS 34 -4.794 -8.059 21.439 273 HZ2 LYS 34 2HZ LYS 34 -5.672 -6.624 21.415 274 HZ3 LYS 34 3HZ LYS 34 -4.019 -6.598 21.676 275 H GLY 35 H GLY 35 -3.934 -11.149 14.927 276 HA2 GLY 35 2HA GLY 35 -5.429 -12.334 13.686 277 HA3 GLY 35 1HA GLY 35 -6.483 -12.341 15.088 278 H TYR 36 H TYR 36 -5.364 -9.548 13.168 279 HA TYR 36 HA TYR 36 -8.231 -8.963 12.755 280 HB2 TYR 36 2HB TYR 36 -5.926 -7.045 12.802 281 HB3 TYR 36 1HB TYR 36 -7.555 -6.595 12.340 282 HD1 TYR 36 1HD TYR 36 -5.293 -6.440 14.876 283 HD2 TYR 36 2HD TYR 36 -9.352 -7.487 14.220 284 HE1 TYR 36 1HE TYR 36 -5.810 -5.961 17.242 285 HE2 TYR 36 2HE TYR 36 -9.870 -7.011 16.575 286 HH TYR 36 HH TYR 36 -8.709 -6.883 18.699 287 H ASN 37 H ASN 37 -5.915 -10.305 10.984 288 HA ASN 37 HA ASN 37 -5.385 -10.502 8.812 289 HB2 ASN 37 2HB ASN 37 -8.017 -9.043 8.315 290 HB3 ASN 37 1HB ASN 37 -7.054 -9.679 7.017 291 HD21 ASN 37 1HD2 ASN 37 -6.264 -12.102 8.488 292 HD22 ASN 37 2HD2 ASN 37 -7.666 -13.091 8.557 293 HA PRO 38 HA PRO 38 -2.924 -6.702 9.331 294 HB2 PRO 38 2HB PRO 38 -1.408 -8.352 7.390 295 HB3 PRO 38 1HB PRO 38 -0.837 -7.418 8.774 296 HG2 PRO 38 2HG PRO 38 -1.135 -10.084 8.863 297 HG3 PRO 38 1HG PRO 38 -1.387 -9.058 10.276 298 HD2 PRO 38 2HD PRO 38 -3.354 -10.541 8.687 299 HD3 PRO 38 1HD PRO 38 -3.477 -9.843 10.320 300 H ILE 39 H ILE 39 -3.671 -8.304 6.270 301 HA ILE 39 HA ILE 39 -2.685 -6.191 4.682 302 HB ILE 39 HB ILE 39 -4.688 -8.313 3.896 303 HG12 ILE 39 2HG1 ILE 39 -2.702 -9.361 4.825 304 HG13 ILE 39 1HG1 ILE 39 -2.699 -9.572 3.084 305 HG21 ILE 39 1HG2 ILE 39 -3.867 -7.934 1.612 306 HG22 ILE 39 2HG2 ILE 39 -2.832 -6.633 2.204 307 HG23 ILE 39 3HG2 ILE 39 -4.584 -6.475 2.296 308 HD11 ILE 39 1HD1 ILE 39 -1.067 -7.740 2.892 309 HD12 ILE 39 2HD1 ILE 39 -0.481 -9.064 3.903 310 HD13 ILE 39 3HD1 ILE 39 -1.058 -7.582 4.651 311 H ASN 40 H ASN 40 -6.060 -7.079 5.640 312 HA ASN 40 HA ASN 40 -7.375 -5.125 4.278 313 HB2 ASN 40 2HB ASN 40 -8.210 -7.175 5.511 314 HB3 ASN 40 1HB ASN 40 -8.083 -6.206 6.979 315 HD21 ASN 40 1HD2 ASN 40 -9.621 -6.672 4.032 316 HD22 ASN 40 2HD2 ASN 40 -10.966 -5.627 4.299 317 H GLN 41 H GLN 41 -5.966 -5.175 7.494 318 HA GLN 41 HA GLN 41 -6.917 -2.652 8.325 319 HB2 GLN 41 2HB GLN 41 -4.515 -4.194 9.245 320 HB3 GLN 41 1HB GLN 41 -5.197 -2.822 10.099 321 HG2 GLN 41 2HG GLN 41 -6.604 -5.450 9.591 322 HG3 GLN 41 1HG GLN 41 -5.831 -4.984 11.100 323 HE21 GLN 41 1HE2 GLN 41 -6.779 -2.225 10.973 324 HE22 GLN 41 2HE2 GLN 41 -8.475 -2.292 11.311 325 H ILE 42 H ILE 42 -3.916 -3.652 6.710 326 HA ILE 42 HA ILE 42 -2.758 -1.058 6.833 327 HB ILE 42 HB ILE 42 -2.019 -3.402 5.037 328 HG12 ILE 42 2HG1 ILE 42 -0.718 -2.332 7.561 329 HG13 ILE 42 1HG1 ILE 42 -1.703 -3.786 7.461 330 HG21 ILE 42 1HG2 ILE 42 -0.515 -0.812 5.510 331 HG22 ILE 42 2HG2 ILE 42 -1.295 -1.287 4.016 332 HG23 ILE 42 3HG2 ILE 42 0.098 -2.197 4.607 333 HD11 ILE 42 1HD1 ILE 42 -0.037 -4.809 5.997 334 HD12 ILE 42 2HD1 ILE 42 0.676 -4.314 7.532 335 HD13 ILE 42 3HD1 ILE 42 0.944 -3.345 6.082 336 H VAL 43 H VAL 43 -4.470 -2.797 4.206 337 HA VAL 43 HA VAL 43 -4.274 -0.600 2.458 338 HB VAL 43 HB VAL 43 -4.803 -2.754 1.438 339 HG11 VAL 43 1HG1 VAL 43 -6.069 -3.755 3.281 340 HG12 VAL 43 2HG1 VAL 43 -6.980 -3.874 1.775 341 HG13 VAL 43 3HG1 VAL 43 -7.411 -2.654 2.979 342 HG21 VAL 43 1HG2 VAL 43 -7.211 -0.953 1.174 343 HG22 VAL 43 2HG2 VAL 43 -6.707 -2.191 0.024 344 HG23 VAL 43 3HG2 VAL 43 -5.687 -0.779 0.301 345 H GLY 44 H GLY 44 -6.616 -1.393 4.914 346 HA2 GLY 44 2HA GLY 44 -8.416 0.723 4.387 347 HA3 GLY 44 1HA GLY 44 -8.203 -0.078 5.940 348 H TYR 45 H TYR 45 -5.364 0.573 6.111 349 HA TYR 45 HA TYR 45 -5.589 3.055 7.419 350 HB2 TYR 45 2HB TYR 45 -3.981 1.495 8.283 351 HB3 TYR 45 1HB TYR 45 -3.136 1.428 6.742 352 HD1 TYR 45 1HD TYR 45 -1.471 3.067 6.169 353 HD2 TYR 45 2HD TYR 45 -3.833 3.608 9.672 354 HE1 TYR 45 1HE TYR 45 -0.001 4.901 6.867 355 HE2 TYR 45 2HE TYR 45 -2.350 5.435 10.381 356 HH TYR 45 HH TYR 45 -0.010 6.801 8.269 357 H LEU 46 H LEU 46 -3.798 2.222 4.415 358 HA LEU 46 HA LEU 46 -2.876 4.873 4.267 359 HB2 LEU 46 2HB LEU 46 -2.805 2.812 2.089 360 HB3 LEU 46 1HB LEU 46 -2.165 4.427 1.886 361 HG LEU 46 HG LEU 46 -0.716 3.839 3.975 362 HD11 LEU 46 1HD1 LEU 46 -0.125 1.553 4.248 363 HD12 LEU 46 2HD1 LEU 46 -1.365 1.080 3.086 364 HD13 LEU 46 3HD1 LEU 46 -1.835 1.834 4.602 365 HD21 LEU 46 1HD2 LEU 46 0.194 4.263 1.810 366 HD22 LEU 46 2HD2 LEU 46 -0.193 2.625 1.273 367 HD23 LEU 46 3HD2 LEU 46 1.012 2.886 2.542 368 H LEU 47 H LEU 47 -5.714 3.502 2.640 369 HA LEU 47 HA LEU 47 -6.056 5.836 1.105 370 HB2 LEU 47 2HB LEU 47 -7.986 3.642 1.796 371 HB3 LEU 47 1HB LEU 47 -8.387 4.984 0.750 372 HG LEU 47 HG LEU 47 -7.944 3.160 -0.605 373 HD11 LEU 47 1HD1 LEU 47 -7.031 5.225 -1.429 374 HD12 LEU 47 2HD1 LEU 47 -6.054 3.859 -1.974 375 HD13 LEU 47 3HD1 LEU 47 -5.489 4.887 -0.655 376 HD21 LEU 47 1HD2 LEU 47 -6.728 1.735 0.937 377 HD22 LEU 47 2HD2 LEU 47 -5.288 2.745 0.741 378 HD23 LEU 47 3HD2 LEU 47 -5.935 1.856 -0.636 379 H SER 48 H SER 48 -6.693 5.283 4.398 380 HA SER 48 HA SER 48 -8.452 7.636 4.350 381 HB2 SER 48 2HB SER 48 -8.301 5.460 6.446 382 HB3 SER 48 1HB SER 48 -9.398 6.842 6.473 383 HG SER 48 HG SER 48 -9.983 4.600 5.436 384 H GLY 49 H GLY 49 -5.481 6.332 5.581 385 HA2 GLY 49 2HA GLY 49 -3.735 7.298 6.659 386 HA3 GLY 49 1HA GLY 49 -4.496 8.858 6.380 387 H ASP 50 H ASP 50 -5.813 6.094 8.150 388 HA ASP 50 HA ASP 50 -6.028 7.915 10.436 389 HB2 ASP 50 2HB ASP 50 -8.149 7.162 9.244 390 HB3 ASP 50 1HB ASP 50 -7.830 5.576 9.921 391 HA PRO 51 HA PRO 51 -3.257 4.986 12.322 392 HB2 PRO 51 2HB PRO 51 -4.045 6.210 14.875 393 HB3 PRO 51 1HB PRO 51 -2.463 6.121 14.091 394 HG2 PRO 51 2HG PRO 51 -3.859 8.434 14.221 395 HG3 PRO 51 1HG PRO 51 -2.797 8.035 12.863 396 HD2 PRO 51 2HD PRO 51 -5.769 7.927 13.038 397 HD3 PRO 51 1HD PRO 51 -4.698 8.403 11.697 398 H ALA 52 H ALA 52 -6.614 5.283 13.269 399 HA ALA 52 HA ALA 52 -6.652 3.308 15.291 400 HB1 ALA 52 1HB ALA 52 -8.935 4.125 13.515 401 HB2 ALA 52 2HB ALA 52 -8.455 4.949 14.998 402 HB3 ALA 52 3HB ALA 52 -9.056 3.292 15.064 403 H TYR 53 H TYR 53 -6.316 2.940 11.953 404 HA TYR 53 HA TYR 53 -7.457 0.355 11.804 405 HB2 TYR 53 2HB TYR 53 -5.696 1.884 9.934 406 HB3 TYR 53 1HB TYR 53 -6.069 0.182 9.642 407 HD1 TYR 53 1HD TYR 53 -8.418 -0.533 9.512 408 HD2 TYR 53 2HD TYR 53 -7.312 3.562 9.433 409 HE1 TYR 53 1HE TYR 53 -10.580 -0.007 8.605 410 HE2 TYR 53 2HE TYR 53 -9.518 4.138 8.491 411 HH TYR 53 HH TYR 53 -12.105 1.893 8.437 412 H ILE 54 H ILE 54 -4.475 1.522 13.026 413 HA ILE 54 HA ILE 54 -3.503 -1.233 13.128 414 HB ILE 54 HB ILE 54 -1.802 1.263 13.654 415 HG12 ILE 54 2HG1 ILE 54 -2.494 1.260 11.280 416 HG13 ILE 54 1HG1 ILE 54 -0.800 0.815 11.437 417 HG21 ILE 54 1HG2 ILE 54 0.069 -0.260 13.463 418 HG22 ILE 54 2HG2 ILE 54 -1.047 -1.609 13.250 419 HG23 ILE 54 3HG2 ILE 54 -1.022 -0.722 14.772 420 HD11 ILE 54 1HD1 ILE 54 -3.085 -1.089 10.951 421 HD12 ILE 54 2HD1 ILE 54 -1.386 -1.535 11.128 422 HD13 ILE 54 3HD1 ILE 54 -1.902 -0.542 9.767 423 HA PRO 55 HA PRO 55 -5.076 -0.769 17.304 424 HB2 PRO 55 2HB PRO 55 -4.069 -3.504 17.614 425 HB3 PRO 55 1HB PRO 55 -5.717 -2.891 17.764 426 HG2 PRO 55 2HG PRO 55 -4.886 -4.404 15.724 427 HG3 PRO 55 1HG PRO 55 -6.171 -3.187 15.552 428 HD2 PRO 55 2HD PRO 55 -3.318 -3.110 14.709 429 HD3 PRO 55 1HD PRO 55 -4.771 -2.426 13.933 430 H ARG 56 H ARG 56 -4.203 -0.710 19.360 431 HA ARG 56 HA ARG 56 -1.358 -0.324 19.330 432 HB2 ARG 56 2HB ARG 56 -1.633 0.611 21.619 433 HB3 ARG 56 1HB ARG 56 -2.560 1.446 20.383 434 HG2 ARG 56 2HG ARG 56 -4.580 0.283 21.110 435 HG3 ARG 56 1HG ARG 56 -3.646 -0.574 22.334 436 HD2 ARG 56 2HD ARG 56 -3.073 1.560 23.374 437 HD3 ARG 56 1HD ARG 56 -4.024 2.399 22.147 438 HE ARG 56 HE ARG 56 -5.661 0.503 23.326 439 HH11 ARG 56 1HH1 ARG 56 -4.038 3.503 24.248 440 HH12 ARG 56 2HH1 ARG 56 -5.137 3.850 25.508 441 HH21 ARG 56 1HH2 ARG 56 -7.152 1.004 25.020 442 HH22 ARG 56 2HH2 ARG 56 -6.904 2.405 25.968 443 H TYR 57 H TYR 57 -1.153 -2.626 18.948 444 HA TYR 57 HA TYR 57 -1.130 -4.206 21.394 445 HB2 TYR 57 2HB TYR 57 -1.738 -5.408 19.385 446 HB3 TYR 57 1HB TYR 57 -0.249 -4.908 18.591 447 HD1 TYR 57 1HD TYR 57 -1.287 -6.648 21.744 448 HD2 TYR 57 2HD TYR 57 1.479 -6.467 18.511 449 HE1 TYR 57 1HE TYR 57 -0.122 -8.609 22.637 450 HE2 TYR 57 2HE TYR 57 2.657 -8.433 19.407 451 HH TYR 57 HH TYR 57 2.936 -9.504 21.577 452 H GLN 58 H GLN 58 1.111 -2.628 19.241 453 HA GLN 58 HA GLN 58 3.209 -3.008 21.218 454 HB2 GLN 58 2HB GLN 58 3.078 -4.851 19.331 455 HB3 GLN 58 1HB GLN 58 3.732 -3.584 18.314 456 HG2 GLN 58 2HG GLN 58 5.645 -3.408 19.935 457 HG3 GLN 58 1HG GLN 58 5.001 -4.851 20.725 458 HE21 GLN 58 1HE2 GLN 58 6.665 -3.559 18.061 459 HE22 GLN 58 2HE2 GLN 58 7.088 -5.060 17.305 460 H ASP 59 H ASP 59 5.212 -1.778 20.064 461 HA ASP 59 HA ASP 59 4.582 0.928 19.713 462 HB2 ASP 59 2HB ASP 59 6.947 1.211 19.165 463 HB3 ASP 59 1HB ASP 59 6.763 0.124 20.537 464 H ALA 60 H ALA 60 4.324 -1.608 17.588 465 HA ALA 60 HA ALA 60 5.068 -0.761 15.082 466 HB1 ALA 60 1HB ALA 60 4.123 -2.975 15.575 467 HB2 ALA 60 2HB ALA 60 3.352 -2.221 14.178 468 HB3 ALA 60 3HB ALA 60 2.530 -2.245 15.737 469 H ARG 61 H ARG 61 2.035 0.147 16.814 470 HA ARG 61 HA ARG 61 0.961 1.627 14.708 471 HB2 ARG 61 2HB ARG 61 -0.377 0.970 16.675 472 HB3 ARG 61 1HB ARG 61 0.570 2.056 17.683 473 HG2 ARG 61 2HG ARG 61 -0.250 3.979 16.424 474 HG3 ARG 61 1HG ARG 61 -1.162 2.912 15.363 475 HD2 ARG 61 2HD ARG 61 -2.643 3.897 17.000 476 HD3 ARG 61 1HD ARG 61 -2.489 2.168 17.300 477 HE ARG 61 HE ARG 61 -0.636 3.251 18.942 478 HH11 ARG 61 1HH1 ARG 61 -4.100 3.837 18.485 479 HH12 ARG 61 2HH1 ARG 61 -4.366 4.350 20.088 480 HH21 ARG 61 1HH2 ARG 61 -1.022 3.959 21.159 481 HH22 ARG 61 2HH2 ARG 61 -2.588 4.415 21.637 482 H ASN 62 H ASN 62 3.277 2.483 17.215 483 HA ASN 62 HA ASN 62 3.305 5.263 16.561 484 HB2 ASN 62 2HB ASN 62 5.280 3.592 18.129 485 HB3 ASN 62 1HB ASN 62 5.375 5.340 17.953 486 HD21 ASN 62 1HD2 ASN 62 3.886 6.635 19.041 487 HD22 ASN 62 2HD2 ASN 62 2.898 6.022 20.304 488 H LEU 63 H LEU 63 5.094 2.437 15.610 489 HA LEU 63 HA LEU 63 7.138 3.725 14.163 490 HB2 LEU 63 2HB LEU 63 5.911 1.021 13.653 491 HB3 LEU 63 1HB LEU 63 7.416 1.600 12.974 492 HG LEU 63 HG LEU 63 6.865 0.986 15.869 493 HD11 LEU 63 1HD1 LEU 63 8.645 -0.345 13.836 494 HD12 LEU 63 2HD1 LEU 63 7.123 -0.982 14.463 495 HD13 LEU 63 3HD1 LEU 63 8.505 -0.783 15.537 496 HD21 LEU 63 1HD2 LEU 63 9.372 2.013 14.542 497 HD22 LEU 63 2HD2 LEU 63 9.256 1.442 16.204 498 HD23 LEU 63 3HD2 LEU 63 8.379 2.891 15.711 499 H ILE 64 H ILE 64 3.913 2.637 13.215 500 HA ILE 64 HA ILE 64 4.376 3.493 10.517 501 HB ILE 64 HB ILE 64 2.810 1.600 11.103 502 HG12 ILE 64 2HG1 ILE 64 1.481 3.837 9.559 503 HG13 ILE 64 1HG1 ILE 64 2.691 2.737 8.905 504 HG21 ILE 64 1HG2 ILE 64 0.996 3.810 12.036 505 HG22 ILE 64 2HG2 ILE 64 1.755 2.579 13.045 506 HG23 ILE 64 3HG2 ILE 64 0.535 2.120 11.855 507 HD11 ILE 64 1HD1 ILE 64 1.173 0.850 9.318 508 HD12 ILE 64 2HD1 ILE 64 0.471 2.048 8.230 509 HD13 ILE 64 3HD1 ILE 64 -0.042 1.978 9.919 510 H ARG 65 H ARG 65 3.101 4.867 13.412 511 HA ARG 65 HA ARG 65 1.927 7.172 12.296 512 HB2 ARG 65 2HB ARG 65 2.727 6.358 15.034 513 HB3 ARG 65 1HB ARG 65 2.336 8.045 14.734 514 HG2 ARG 65 2HG ARG 65 0.510 5.790 13.977 515 HG3 ARG 65 1HG ARG 65 0.428 6.598 15.543 516 HD2 ARG 65 2HD ARG 65 0.167 7.959 12.850 517 HD3 ARG 65 1HD ARG 65 -1.148 7.579 13.959 518 HE ARG 65 HE ARG 65 -0.061 9.010 15.584 519 HH11 ARG 65 1HH1 ARG 65 0.709 9.563 12.144 520 HH12 ARG 65 2HH1 ARG 65 1.140 11.185 12.369 521 HH21 ARG 65 1HH2 ARG 65 0.536 11.264 15.855 522 HH22 ARG 65 2HH2 ARG 65 1.033 12.172 14.511 523 H ARG 66 H ARG 66 5.222 6.363 12.864 524 HA ARG 66 HA ARG 66 6.013 9.159 12.746 525 HB2 ARG 66 2HB ARG 66 8.330 8.416 12.901 526 HB3 ARG 66 1HB ARG 66 7.382 7.576 14.111 527 HG2 ARG 66 2HG ARG 66 7.329 5.598 12.650 528 HG3 ARG 66 1HG ARG 66 8.341 6.460 11.490 529 HD2 ARG 66 2HD ARG 66 9.082 5.781 14.339 530 HD3 ARG 66 1HD ARG 66 9.672 4.963 12.899 531 HE ARG 66 HE ARG 66 10.194 7.753 12.811 532 HH11 ARG 66 1HH1 ARG 66 11.408 4.694 14.193 533 HH12 ARG 66 2HH1 ARG 66 12.975 5.285 14.467 534 HH21 ARG 66 1HH2 ARG 66 12.367 8.548 13.199 535 HH22 ARG 66 2HH2 ARG 66 13.542 7.513 13.871 536 H HIS 67 H HIS 67 4.733 7.212 10.647 537 HA HIS 67 HA HIS 67 6.139 8.398 8.369 538 HB2 HIS 67 2HB HIS 67 4.573 5.783 8.386 539 HB3 HIS 67 1HB HIS 67 5.430 6.469 7.019 540 HD1 HIS 67 1HD HIS 67 8.203 6.946 8.250 541 HD2 HIS 67 2HD HIS 67 5.934 3.550 8.937 542 HE1 HIS 67 1HE HIS 67 9.840 5.186 8.948 543 HE2 HIS 67 2HE HIS 67 8.418 3.241 9.635 544 H GLU 68 H GLU 68 4.218 8.198 6.449 545 HA GLU 68 HA GLU 68 1.824 9.029 7.788 546 HB2 GLU 68 2HB GLU 68 1.587 10.663 5.687 547 HB3 GLU 68 1HB GLU 68 2.396 11.140 7.167 548 HG2 GLU 68 2HG GLU 68 3.637 11.794 5.130 549 HG3 GLU 68 1HG GLU 68 4.565 10.717 6.172 550 H ARG 69 H ARG 69 2.392 8.583 4.263 551 HA ARG 69 HA ARG 69 1.141 6.129 4.012 552 HB2 ARG 69 2HB ARG 69 -1.114 6.695 3.161 553 HB3 ARG 69 1HB ARG 69 -0.920 7.148 4.843 554 HG2 ARG 69 2HG ARG 69 -0.533 9.453 4.159 555 HG3 ARG 69 1HG ARG 69 -0.800 8.968 2.471 556 HD2 ARG 69 2HD ARG 69 -3.087 8.235 3.081 557 HD3 ARG 69 1HD ARG 69 -2.808 8.787 4.735 558 HE ARG 69 HE ARG 69 -2.353 10.844 2.826 559 HH11 ARG 69 1HH1 ARG 69 -4.998 9.222 4.571 560 HH12 ARG 69 2HH1 ARG 69 -6.041 10.568 4.457 561 HH21 ARG 69 1HH2 ARG 69 -3.843 12.624 2.671 562 HH22 ARG 69 2HH2 ARG 69 -5.391 12.513 3.370 563 H ASP 70 H ASP 70 1.998 9.228 2.547 564 HA ASP 70 HA ASP 70 1.590 8.276 -0.156 565 HB2 ASP 70 2HB ASP 70 1.206 10.667 0.526 566 HB3 ASP 70 1HB ASP 70 2.925 10.805 0.863 567 H GLU 71 H GLU 71 4.244 9.205 1.977 568 HA GLU 71 HA GLU 71 6.363 8.457 0.265 569 HB2 GLU 71 2HB GLU 71 6.274 8.569 3.283 570 HB3 GLU 71 1HB GLU 71 7.739 8.362 2.333 571 HG2 GLU 71 2HG GLU 71 5.908 10.741 2.148 572 HG3 GLU 71 1HG GLU 71 7.368 10.687 3.127 573 H ILE 72 H ILE 72 4.438 6.685 2.534 574 HA ILE 72 HA ILE 72 5.858 4.236 2.493 575 HB ILE 72 HB ILE 72 2.855 4.636 2.820 576 HG12 ILE 72 2HG1 ILE 72 5.052 4.441 4.906 577 HG13 ILE 72 1HG1 ILE 72 4.149 5.889 4.492 578 HG21 ILE 72 1HG2 ILE 72 3.405 2.319 2.269 579 HG22 ILE 72 2HG2 ILE 72 2.883 2.445 3.948 580 HG23 ILE 72 3HG2 ILE 72 4.596 2.276 3.571 581 HD11 ILE 72 1HD1 ILE 72 3.021 3.395 5.752 582 HD12 ILE 72 2HD1 ILE 72 2.096 4.836 5.340 583 HD13 ILE 72 3HD1 ILE 72 3.356 4.919 6.571 584 H MET 73 H MET 73 3.216 5.455 0.454 585 HA MET 73 HA MET 73 3.078 3.295 -1.289 586 HB2 MET 73 2HB MET 73 2.452 6.188 -1.680 587 HB3 MET 73 1HB MET 73 2.183 4.993 -2.940 588 HG2 MET 73 2HG MET 73 0.957 4.992 -0.199 589 HG3 MET 73 1HG MET 73 0.168 5.456 -1.710 590 HE1 MET 73 1HE MET 73 1.281 3.320 -3.803 591 HE2 MET 73 2HE MET 73 -0.405 3.833 -3.674 592 HE3 MET 73 3HE MET 73 -0.000 2.117 -3.675 593 H GLU 74 H GLU 74 5.252 6.058 -1.285 594 HA GLU 74 HA GLU 74 6.476 5.694 -3.774 595 HB2 GLU 74 2HB GLU 74 7.693 6.568 -1.162 596 HB3 GLU 74 1HB GLU 74 8.563 6.443 -2.695 597 HG2 GLU 74 2HG GLU 74 6.132 8.151 -2.340 598 HG3 GLU 74 1HG GLU 74 7.779 8.737 -2.085 599 H GLU 75 H GLU 75 7.114 4.107 -0.701 600 HA GLU 75 HA GLU 75 9.245 2.558 -1.758 601 HB2 GLU 75 2HB GLU 75 9.055 3.053 0.647 602 HB3 GLU 75 1HB GLU 75 7.592 2.077 0.714 603 HG2 GLU 75 2HG GLU 75 8.807 0.101 0.161 604 HG3 GLU 75 1HG GLU 75 10.278 1.027 -0.110 605 H LEU 76 H LEU 76 5.883 1.856 -0.924 606 HA LEU 76 HA LEU 76 5.806 -0.809 -1.674 607 HB2 LEU 76 2HB LEU 76 3.606 1.236 -1.838 608 HB3 LEU 76 1HB LEU 76 3.368 -0.490 -1.984 609 HG LEU 76 HG LEU 76 4.368 0.944 0.479 610 HD11 LEU 76 1HD1 LEU 76 2.209 0.312 1.434 611 HD12 LEU 76 2HD1 LEU 76 1.720 -0.364 -0.119 612 HD13 LEU 76 3HD1 LEU 76 2.013 1.367 0.035 613 HD21 LEU 76 1HD2 LEU 76 3.705 -1.962 0.016 614 HD22 LEU 76 2HD2 LEU 76 4.093 -1.232 1.574 615 HD23 LEU 76 3HD2 LEU 76 5.313 -1.296 0.309 616 H THR 77 H THR 77 5.024 2.053 -3.715 617 HA THR 77 HA THR 77 4.374 0.462 -5.933 618 HB THR 77 HB THR 77 5.243 3.370 -5.926 619 HG1 THR 77 1HG THR 77 3.554 3.271 -4.560 620 HG21 THR 77 1HG2 THR 77 5.099 2.319 -8.162 621 HG22 THR 77 2HG2 THR 77 3.827 3.519 -7.927 622 HG23 THR 77 3HG2 THR 77 3.455 1.800 -7.801 623 H LYS 78 H LYS 78 7.408 2.145 -4.989 624 HA LYS 78 HA LYS 78 8.601 1.465 -7.465 625 HB2 LYS 78 2HB LYS 78 9.985 2.501 -4.985 626 HB3 LYS 78 1HB LYS 78 10.764 2.274 -6.548 627 HG2 LYS 78 2HG LYS 78 8.866 3.789 -7.416 628 HG3 LYS 78 1HG LYS 78 8.649 4.212 -5.762 629 HD2 LYS 78 2HD LYS 78 11.287 4.520 -7.212 630 HD3 LYS 78 1HD LYS 78 10.123 5.817 -6.976 631 HE2 LYS 78 2HE LYS 78 11.509 4.283 -4.791 632 HE3 LYS 78 1HE LYS 78 12.004 5.867 -5.377 633 HZ1 LYS 78 1HZ LYS 78 10.726 6.122 -3.406 634 HZ2 LYS 78 2HZ LYS 78 9.444 5.201 -4.021 635 HZ3 LYS 78 3HZ LYS 78 9.783 6.710 -4.674 636 H TYR 79 H TYR 79 8.729 -0.013 -4.313 637 HA TYR 79 HA TYR 79 10.788 -1.796 -5.191 638 HB2 TYR 79 2HB TYR 79 10.507 -1.272 -2.769 639 HB3 TYR 79 1HB TYR 79 8.999 -2.187 -2.777 640 HD1 TYR 79 1HD TYR 79 12.644 -2.499 -3.401 641 HD2 TYR 79 2HD TYR 79 9.031 -4.552 -2.472 642 HE1 TYR 79 1HE TYR 79 13.914 -4.569 -3.017 643 HE2 TYR 79 2HE TYR 79 10.293 -6.600 -2.098 644 HH TYR 79 HH TYR 79 13.688 -6.641 -1.849 645 H TYR 80 H TYR 80 7.275 -2.021 -4.978 646 HA TYR 80 HA TYR 80 7.018 -4.699 -5.703 647 HB2 TYR 80 2HB TYR 80 5.043 -3.569 -4.972 648 HB3 TYR 80 1HB TYR 80 5.222 -2.311 -6.189 649 HD1 TYR 80 1HD TYR 80 4.156 -5.806 -5.602 650 HD2 TYR 80 2HD TYR 80 4.544 -2.654 -8.433 651 HE1 TYR 80 1HE TYR 80 2.765 -7.046 -7.203 652 HE2 TYR 80 2HE TYR 80 3.163 -3.878 -10.006 653 HH TYR 80 HH TYR 80 1.313 -6.440 -9.187 654 H LEU 81 H LEU 81 7.264 -1.814 -7.759 655 HA LEU 81 HA LEU 81 7.123 -3.322 -10.147 656 HB2 LEU 81 2HB LEU 81 8.069 -0.531 -9.624 657 HB3 LEU 81 1HB LEU 81 7.975 -1.213 -11.242 658 HG LEU 81 HG LEU 81 5.648 -0.770 -9.353 659 HD11 LEU 81 1HD1 LEU 81 4.955 0.925 -10.956 660 HD12 LEU 81 2HD1 LEU 81 6.430 0.640 -11.886 661 HD13 LEU 81 3HD1 LEU 81 6.530 1.303 -10.254 662 HD21 LEU 81 1HD2 LEU 81 4.249 -1.371 -11.283 663 HD22 LEU 81 2HD2 LEU 81 5.266 -2.719 -10.774 664 HD23 LEU 81 3HD2 LEU 81 5.698 -1.778 -12.198 665 H ALA 82 H ALA 82 9.767 -2.351 -8.093 666 HA ALA 82 HA ALA 82 11.864 -2.982 -9.839 667 HB1 ALA 82 1HB ALA 82 12.190 -1.745 -7.731 668 HB2 ALA 82 2HB ALA 82 13.255 -3.147 -7.832 669 HB3 ALA 82 3HB ALA 82 11.811 -3.208 -6.824 670 H ASN 83 H ASN 83 9.826 -4.940 -7.810 671 HA ASN 83 HA ASN 83 11.304 -7.347 -7.986 672 HB2 ASN 83 2HB ASN 83 8.358 -6.938 -7.497 673 HB3 ASN 83 1HB ASN 83 9.176 -8.487 -7.363 674 HD21 ASN 83 1HD2 ASN 83 11.601 -7.248 -6.123 675 HD22 ASN 83 2HD2 ASN 83 11.095 -6.877 -4.525 676 H HIS 84 H HIS 84 9.432 -5.732 -10.324 677 HA HIS 84 HA HIS 84 9.012 -8.161 -11.879 678 HB2 HIS 84 2HB HIS 84 8.340 -5.270 -12.513 679 HB3 HIS 84 1HB HIS 84 8.156 -6.553 -13.695 680 HD1 HIS 84 1HD HIS 84 6.359 -8.476 -12.966 681 HD2 HIS 84 2HD HIS 84 6.145 -4.863 -10.925 682 HE1 HIS 84 1HE HIS 84 4.112 -8.456 -11.878 683 HE2 HIS 84 2HE HIS 84 3.916 -6.239 -10.783 684 H GLY 85 H GLY 85 11.685 -6.691 -11.175 685 HA2 GLY 85 2HA GLY 85 13.761 -6.986 -12.177 686 HA3 GLY 85 1HA GLY 85 12.954 -7.429 -13.680 687 H ILE 86 H ILE 86 11.722 -4.669 -12.267 688 HA ILE 86 HA ILE 86 12.905 -3.013 -14.338 689 HB ILE 86 HB ILE 86 10.635 -2.453 -12.409 690 HG12 ILE 86 2HG1 ILE 86 10.564 -3.164 -15.354 691 HG13 ILE 86 1HG1 ILE 86 10.065 -4.208 -14.029 692 HG21 ILE 86 1HG2 ILE 86 10.159 -0.517 -13.832 693 HG22 ILE 86 2HG2 ILE 86 11.592 -0.877 -14.792 694 HG23 ILE 86 3HG2 ILE 86 11.759 -0.412 -13.100 695 HD11 ILE 86 1HD1 ILE 86 8.810 -1.602 -14.816 696 HD12 ILE 86 2HD1 ILE 86 8.281 -2.631 -13.483 697 HD13 ILE 86 3HD1 ILE 86 8.159 -3.212 -15.151 698 H ASP 87 H ASP 87 14.292 -1.434 -13.865 699 HA ASP 87 HA ASP 87 14.954 -1.020 -11.036 700 HB2 ASP 87 2HB ASP 87 16.865 -1.693 -12.364 701 HB3 ASP 87 1HB ASP 87 16.559 -0.410 -13.525 702 H ILE 88 H ILE 88 14.192 0.747 -10.135 703 HA ILE 88 HA ILE 88 13.289 2.915 -11.906 704 HB ILE 88 HB ILE 88 12.504 2.356 -9.025 705 HG12 ILE 88 2HG1 ILE 88 10.950 1.898 -11.576 706 HG13 ILE 88 1HG1 ILE 88 11.692 0.640 -10.597 707 HG21 ILE 88 1HG2 ILE 88 10.739 4.016 -9.392 708 HG22 ILE 88 2HG2 ILE 88 11.361 4.325 -11.017 709 HG23 ILE 88 3HG2 ILE 88 12.338 4.731 -9.602 710 HD11 ILE 88 1HD1 ILE 88 9.594 2.516 -9.554 711 HD12 ILE 88 2HD1 ILE 88 10.232 1.088 -8.787 712 HD13 ILE 88 3HD1 ILE 88 9.262 0.899 -10.242 713 H LYS 89 H LYS 89 14.020 4.969 -11.585 714 HA LYS 89 HA LYS 89 16.054 5.331 -9.495 715 HB2 LYS 89 2HB LYS 89 16.117 6.543 -12.268 716 HB3 LYS 89 1HB LYS 89 17.329 6.749 -11.013 717 HG2 LYS 89 2HG LYS 89 17.812 4.318 -11.143 718 HG3 LYS 89 1HG LYS 89 16.669 4.201 -12.482 719 HD2 LYS 89 2HD LYS 89 18.018 5.865 -13.714 720 HD3 LYS 89 1HD LYS 89 19.190 5.845 -12.397 721 HE2 LYS 89 2HE LYS 89 18.429 3.564 -14.202 722 HE3 LYS 89 1HE LYS 89 19.964 4.420 -14.176 723 HZ1 LYS 89 1HZ LYS 89 18.875 2.578 -12.127 724 HZ2 LYS 89 2HZ LYS 89 20.250 3.559 -11.836 725 HZ3 LYS 89 3HZ LYS 89 20.226 2.378 -13.043 726 H1 MET 1 H MET 1 -7.195 14.726 7.223 727 HA MET 1 HA MET 1 -8.900 15.729 8.899 728 HB2 MET 1 2HB MET 1 -9.312 17.233 6.302 729 HB3 MET 1 1HB MET 1 -10.463 17.180 7.623 730 HG2 MET 1 2HG MET 1 -8.859 18.292 9.078 731 HG3 MET 1 1HG MET 1 -7.682 18.324 7.771 732 HE1 MET 1 1HE MET 1 -11.588 18.944 7.461 733 HE2 MET 1 2HE MET 1 -11.657 20.690 7.701 734 HE3 MET 1 3HE MET 1 -11.165 19.639 9.029 735 H GLY 2 H GLY 2 -11.330 15.377 8.078 736 HA2 GLY 2 2HA GLY 2 -12.360 14.092 6.115 737 HA3 GLY 2 1HA GLY 2 -11.265 12.824 6.659 738 H PHE 3 H PHE 3 -13.646 11.945 6.761 739 HA PHE 3 HA PHE 3 -14.992 12.671 9.189 740 HB2 PHE 3 2HB PHE 3 -16.295 12.025 7.204 741 HB3 PHE 3 1HB PHE 3 -15.526 10.442 7.206 742 HD1 PHE 3 1HD PHE 3 -17.671 12.664 9.259 743 HD2 PHE 3 2HD PHE 3 -16.525 8.677 8.350 744 HE1 PHE 3 1HE PHE 3 -19.481 11.818 10.700 745 HE2 PHE 3 2HE PHE 3 -18.331 7.826 9.781 746 HZ PHE 3 HZ PHE 3 -19.809 9.393 10.959 747 H THR 4 H THR 4 -13.880 12.160 10.960 748 HA THR 4 HA THR 4 -12.338 9.799 11.143 749 HB THR 4 HB THR 4 -12.101 10.600 13.574 750 HG1 THR 4 1HG THR 4 -13.865 11.898 13.786 751 HG21 THR 4 1HG2 THR 4 -10.416 11.029 11.840 752 HG22 THR 4 2HG2 THR 4 -10.576 12.415 12.915 753 HG23 THR 4 3HG2 THR 4 -11.315 12.454 11.316 754 H ASP 5 H ASP 5 -13.194 7.896 11.363 755 HA ASP 5 HA ASP 5 -15.027 7.266 13.477 756 HB2 ASP 5 2HB ASP 5 -16.663 7.974 11.877 757 HB3 ASP 5 1HB ASP 5 -15.873 7.080 10.592 758 H GLU 6 H GLU 6 -14.311 5.442 14.297 759 HA GLU 6 HA GLU 6 -12.581 3.723 12.734 760 HB2 GLU 6 2HB GLU 6 -12.016 4.278 15.110 761 HB3 GLU 6 1HB GLU 6 -13.481 3.437 15.604 762 HG2 GLU 6 2HG GLU 6 -12.542 1.377 14.487 763 HG3 GLU 6 1HG GLU 6 -11.023 2.251 14.338 764 H THR 7 H THR 7 -13.907 2.693 11.301 765 HA THR 7 HA THR 7 -15.545 0.624 12.487 766 HB THR 7 HB THR 7 -16.985 0.864 10.330 767 HG1 THR 7 1HG THR 7 -16.624 3.580 10.448 768 HG21 THR 7 1HG2 THR 7 -17.866 1.275 12.603 769 HG22 THR 7 2HG2 THR 7 -18.519 2.439 11.449 770 HG23 THR 7 3HG2 THR 7 -17.228 2.916 12.545 771 H VAL 8 H VAL 8 -14.879 -1.302 11.893 772 HA VAL 8 HA VAL 8 -13.902 -1.741 9.262 773 HB VAL 8 HB VAL 8 -11.848 -0.950 10.256 774 HG11 VAL 8 1HG1 VAL 8 -12.163 -3.061 12.372 775 HG12 VAL 8 2HG1 VAL 8 -12.272 -1.317 12.597 776 HG13 VAL 8 3HG1 VAL 8 -10.734 -2.051 12.141 777 HG21 VAL 8 1HG2 VAL 8 -11.774 -3.947 9.908 778 HG22 VAL 8 2HG2 VAL 8 -10.366 -2.884 9.891 779 HG23 VAL 8 3HG2 VAL 8 -11.599 -2.728 8.642 780 H ARG 9 H ARG 9 -15.593 -3.072 9.020 781 HA ARG 9 HA ARG 9 -15.220 -5.746 10.112 782 HB2 ARG 9 2HB ARG 9 -17.894 -4.327 9.846 783 HB3 ARG 9 1HB ARG 9 -17.691 -6.023 10.264 784 HG2 ARG 9 2HG ARG 9 -16.516 -5.402 12.290 785 HG3 ARG 9 1HG ARG 9 -16.669 -3.702 11.878 786 HD2 ARG 9 2HD ARG 9 -19.112 -3.918 12.019 787 HD3 ARG 9 1HD ARG 9 -18.918 -5.618 12.470 788 HE ARG 9 HE ARG 9 -17.484 -3.691 14.058 789 HH11 ARG 9 1HH1 ARG 9 -20.383 -5.688 13.801 790 HH12 ARG 9 2HH1 ARG 9 -20.746 -5.661 15.454 791 HH21 ARG 9 1HH2 ARG 9 -17.975 -3.621 16.353 792 HH22 ARG 9 2HH2 ARG 9 -19.327 -4.420 16.961 793 H PHE 10 H PHE 10 -15.465 -7.332 8.559 794 HA PHE 10 HA PHE 10 -16.384 -6.640 5.921 795 HB2 PHE 10 2HB PHE 10 -14.137 -6.923 4.901 796 HB3 PHE 10 1HB PHE 10 -14.254 -5.478 5.910 797 HD1 PHE 10 1HD PHE 10 -13.100 -5.407 8.101 798 HD2 PHE 10 2HD PHE 10 -12.654 -8.741 5.481 799 HE1 PHE 10 1HE PHE 10 -11.144 -6.155 9.388 800 HE2 PHE 10 2HE PHE 10 -10.688 -9.486 6.781 801 HZ PHE 10 HZ PHE 10 -9.944 -8.193 8.729 802 H ASP 11 H ASP 11 -15.916 -8.416 4.430 803 HA ASP 11 HA ASP 11 -15.333 -10.987 5.708 804 HB2 ASP 11 2HB ASP 11 -17.627 -11.004 4.866 805 HB3 ASP 11 1HB ASP 11 -17.082 -10.392 3.308 806 H PHE 12 H PHE 12 -13.370 -11.563 5.180 807 HA PHE 12 HA PHE 12 -12.125 -10.314 2.907 808 HB2 PHE 12 2HB PHE 12 -10.865 -10.449 4.997 809 HB3 PHE 12 1HB PHE 12 -10.959 -12.200 4.974 810 HD1 PHE 12 1HD PHE 12 -9.551 -9.258 3.232 811 HD2 PHE 12 2HD PHE 12 -9.361 -13.475 3.770 812 HE1 PHE 12 1HE PHE 12 -7.431 -9.320 1.984 813 HE2 PHE 12 2HE PHE 12 -7.243 -13.542 2.528 814 HZ PHE 12 HZ PHE 12 -6.276 -11.459 1.631 815 H ASP 13 H ASP 13 -13.020 -11.161 1.154 816 HA ASP 13 HA ASP 13 -12.456 -14.000 0.622 817 HB2 ASP 13 2HB ASP 13 -14.852 -13.503 0.376 818 HB3 ASP 13 1HB ASP 13 -14.485 -12.148 -0.681 819 H ASP 14 H ASP 14 -10.551 -14.057 -0.300 820 HA ASP 14 HA ASP 14 -9.685 -11.750 -1.750 821 HB2 ASP 14 2HB ASP 14 -8.089 -12.723 -0.219 822 HB3 ASP 14 1HB ASP 14 -8.168 -14.248 -1.100 823 H ASN 15 H ASN 15 -10.537 -11.549 -3.557 824 HA ASN 15 HA ASN 15 -10.506 -13.617 -5.573 825 HB2 ASN 15 2HB ASN 15 -10.889 -10.605 -5.848 826 HB3 ASN 15 1HB ASN 15 -11.236 -11.799 -7.090 827 HD21 ASN 15 1HD2 ASN 15 -12.278 -10.395 -4.100 828 HD22 ASN 15 2HD2 ASN 15 -13.860 -11.058 -4.069 829 H ARG 16 H ARG 16 -8.525 -14.229 -6.180 830 HA ARG 16 HA ARG 16 -6.195 -13.013 -5.452 831 HB2 ARG 16 2HB ARG 16 -6.621 -14.909 -7.727 832 HB3 ARG 16 1HB ARG 16 -5.035 -14.362 -7.215 833 HG2 ARG 16 2HG ARG 16 -5.519 -15.306 -4.961 834 HG3 ARG 16 1HG ARG 16 -7.013 -15.980 -5.625 835 HD2 ARG 16 2HD ARG 16 -5.184 -17.618 -5.644 836 HD3 ARG 16 1HD ARG 16 -5.735 -17.232 -7.279 837 HE ARG 16 HE ARG 16 -3.568 -15.573 -6.460 838 HH11 ARG 16 1HH1 ARG 16 -4.213 -18.831 -7.716 839 HH12 ARG 16 2HH1 ARG 16 -2.707 -18.939 -8.521 840 HH21 ARG 16 1HH2 ARG 16 -1.547 -15.758 -7.514 841 HH22 ARG 16 2HH2 ARG 16 -1.152 -17.171 -8.388 842 H LYS 17 H LYS 17 -5.098 -11.359 -5.957 843 HA LYS 17 HA LYS 17 -5.706 -9.952 -8.380 844 HB2 LYS 17 2HB LYS 17 -3.789 -9.210 -6.139 845 HB3 LYS 17 1HB LYS 17 -4.154 -8.203 -7.523 846 HG2 LYS 17 2HG LYS 17 -5.404 -7.306 -5.721 847 HG3 LYS 17 1HG LYS 17 -6.568 -8.184 -6.708 848 HD2 LYS 17 2HD LYS 17 -6.400 -10.091 -5.152 849 HD3 LYS 17 1HD LYS 17 -5.269 -9.163 -4.163 850 HE2 LYS 17 2HE LYS 17 -7.461 -9.065 -3.183 851 HE3 LYS 17 1HE LYS 17 -7.048 -7.472 -3.810 852 HZ1 LYS 17 1HZ LYS 17 -8.493 -7.854 -5.708 853 HZ2 LYS 17 2HZ LYS 17 -9.321 -8.162 -4.286 854 HZ3 LYS 17 3HZ LYS 17 -8.765 -9.450 -5.219 855 H LYS 18 H LYS 18 -4.551 -10.022 -10.080 856 HA LYS 18 HA LYS 18 -1.773 -10.824 -10.193 857 HB2 LYS 18 2HB LYS 18 -2.983 -13.003 -10.121 858 HB3 LYS 18 1HB LYS 18 -3.955 -12.518 -11.486 859 HG2 LYS 18 2HG LYS 18 -0.951 -12.909 -11.616 860 HG3 LYS 18 1HG LYS 18 -2.111 -14.186 -11.947 861 HD2 LYS 18 2HD LYS 18 -1.839 -11.587 -13.487 862 HD3 LYS 18 1HD LYS 18 -1.241 -13.164 -14.005 863 HE2 LYS 18 2HE LYS 18 -3.554 -14.013 -14.036 864 HE3 LYS 18 1HE LYS 18 -4.140 -12.428 -13.538 865 HZ1 LYS 18 1HZ LYS 18 -4.372 -12.714 -15.908 866 HZ2 LYS 18 2HZ LYS 18 -2.750 -13.060 -16.093 867 HZ3 LYS 18 3HZ LYS 18 -3.236 -11.511 -15.645 868 H ALA 19 H ALA 19 -4.792 -10.012 -11.722 869 HA ALA 19 HA ALA 19 -3.932 -9.248 -14.250 870 HB1 ALA 19 1HB ALA 19 -5.950 -7.929 -14.297 871 HB2 ALA 19 2HB ALA 19 -6.072 -8.136 -12.539 872 HB3 ALA 19 3HB ALA 19 -6.252 -9.543 -13.599 873 H ILE 20 H ILE 20 -3.901 -7.598 -11.176 874 HA ILE 20 HA ILE 20 -3.530 -4.962 -12.125 875 HB ILE 20 HB ILE 20 -2.767 -6.132 -9.433 876 HG12 ILE 20 2HG1 ILE 20 -5.367 -4.880 -10.335 877 HG13 ILE 20 1HG1 ILE 20 -5.110 -6.590 -10.030 878 HG21 ILE 20 1HG2 ILE 20 -1.799 -3.921 -9.846 879 HG22 ILE 20 2HG2 ILE 20 -3.064 -3.825 -8.620 880 HG23 ILE 20 3HG2 ILE 20 -3.393 -3.290 -10.267 881 HD11 ILE 20 1HD1 ILE 20 -6.236 -5.611 -8.199 882 HD12 ILE 20 2HD1 ILE 20 -4.999 -4.360 -8.024 883 HD13 ILE 20 3HD1 ILE 20 -4.619 -6.052 -7.679 884 H SER 21 H SER 21 -1.492 -7.621 -11.392 885 HA SER 21 HA SER 21 1.009 -6.357 -11.179 886 HB2 SER 21 2HB SER 21 0.398 -9.109 -12.272 887 HB3 SER 21 1HB SER 21 1.968 -8.555 -11.694 888 HG SER 21 HG SER 21 0.152 -8.051 -9.816 889 H GLU 22 H GLU 22 -0.830 -7.440 -13.892 890 HA GLU 22 HA GLU 22 1.144 -6.926 -15.887 891 HB2 GLU 22 2HB GLU 22 -1.850 -7.200 -16.144 892 HB3 GLU 22 1HB GLU 22 -0.673 -7.396 -17.438 893 HG2 GLU 22 2HG GLU 22 0.232 -9.372 -16.348 894 HG3 GLU 22 1HG GLU 22 -0.881 -9.161 -15.003 895 H THR 23 H THR 23 -1.714 -5.289 -14.595 896 HA THR 23 HA THR 23 -1.919 -3.127 -16.322 897 HB THR 23 HB THR 23 -2.552 -3.242 -13.370 898 HG1 THR 23 1HG THR 23 -3.848 -4.164 -15.679 899 HG21 THR 23 1HG2 THR 23 -4.219 -1.504 -13.887 900 HG22 THR 23 2HG2 THR 23 -3.631 -1.441 -15.549 901 HG23 THR 23 3HG2 THR 23 -2.580 -0.951 -14.224 902 H LEU 24 H LEU 24 -0.231 -3.287 -13.163 903 HA LEU 24 HA LEU 24 0.587 -0.581 -13.205 904 HB2 LEU 24 2HB LEU 24 1.689 -2.886 -11.617 905 HB3 LEU 24 1HB LEU 24 2.071 -1.204 -11.332 906 HG LEU 24 HG LEU 24 -0.655 -2.463 -11.036 907 HD11 LEU 24 1HD1 LEU 24 0.888 -3.150 -9.292 908 HD12 LEU 24 2HD1 LEU 24 -0.322 -2.044 -8.649 909 HD13 LEU 24 3HD1 LEU 24 1.310 -1.466 -8.986 910 HD21 LEU 24 1HD2 LEU 24 -0.846 -0.136 -11.744 911 HD22 LEU 24 2HD2 LEU 24 0.276 0.356 -10.473 912 HD23 LEU 24 3HD2 LEU 24 -1.302 -0.304 -10.052 913 H GLU 25 H GLU 25 2.104 -3.489 -14.350 914 HA GLU 25 HA GLU 25 4.680 -2.408 -14.685 915 HB2 GLU 25 2HB GLU 25 4.143 -4.825 -14.601 916 HB3 GLU 25 1HB GLU 25 3.343 -4.686 -16.156 917 HG2 GLU 25 2HG GLU 25 5.448 -4.109 -17.206 918 HG3 GLU 25 1HG GLU 25 6.257 -4.179 -15.636 919 H THR 26 H THR 26 1.840 -2.697 -16.782 920 HA THR 26 HA THR 26 2.950 -1.574 -19.114 921 HB THR 26 HB THR 26 0.084 -1.614 -18.167 922 HG1 THR 26 1HG THR 26 1.822 -3.524 -19.160 923 HG21 THR 26 1HG2 THR 26 0.508 -0.089 -20.053 924 HG22 THR 26 2HG2 THR 26 -0.477 -1.467 -20.558 925 HG23 THR 26 3HG2 THR 26 1.243 -1.404 -20.955 926 H VAL 27 H VAL 27 1.122 -0.186 -16.395 927 HA VAL 27 HA VAL 27 0.896 2.442 -17.339 928 HB VAL 27 HB VAL 27 1.118 1.506 -14.449 929 HG11 VAL 27 1HG1 VAL 27 1.579 3.896 -14.654 930 HG12 VAL 27 2HG1 VAL 27 0.019 3.622 -13.867 931 HG13 VAL 27 3HG1 VAL 27 0.082 4.105 -15.565 932 HG21 VAL 27 1HG2 VAL 27 -1.319 2.130 -16.115 933 HG22 VAL 27 2HG2 VAL 27 -1.316 1.650 -14.420 934 HG23 VAL 27 3HG2 VAL 27 -0.775 0.514 -15.661 935 H TYR 28 H TYR 28 3.466 0.838 -15.557 936 HA TYR 28 HA TYR 28 5.083 3.072 -15.093 937 HB2 TYR 28 2HB TYR 28 5.504 0.915 -13.981 938 HB3 TYR 28 1HB TYR 28 5.943 0.195 -15.525 939 HD1 TYR 28 1HD TYR 28 8.066 0.751 -16.583 940 HD2 TYR 28 2HD TYR 28 7.039 2.403 -12.809 941 HE1 TYR 28 1HE TYR 28 10.406 1.441 -16.255 942 HE2 TYR 28 2HE TYR 28 9.378 3.104 -12.464 943 HH TYR 28 HH TYR 28 11.603 3.193 -14.956 944 H ARG 29 H ARG 29 5.097 0.776 -17.773 945 HA ARG 29 HA ARG 29 7.248 1.938 -19.155 946 HB2 ARG 29 2HB ARG 29 4.956 0.302 -20.232 947 HB3 ARG 29 1HB ARG 29 6.397 0.737 -21.145 948 HG2 ARG 29 2HG ARG 29 6.322 -0.944 -18.649 949 HG3 ARG 29 1HG ARG 29 6.557 -1.535 -20.294 950 HD2 ARG 29 2HD ARG 29 8.387 0.311 -18.752 951 HD3 ARG 29 1HD ARG 29 8.688 -1.371 -19.157 952 HE ARG 29 HE ARG 29 8.362 -0.379 -21.566 953 HH11 ARG 29 1HH1 ARG 29 10.242 0.921 -18.842 954 HH12 ARG 29 2HH1 ARG 29 11.386 1.716 -19.804 955 HH21 ARG 29 1HH2 ARG 29 10.036 0.746 -22.931 956 HH22 ARG 29 2HH2 ARG 29 11.276 1.589 -22.137 957 H ALA 30 H ALA 30 3.810 2.485 -19.448 958 HA ALA 30 HA ALA 30 3.884 4.219 -21.664 959 HB1 ALA 30 1HB ALA 30 1.889 4.210 -19.396 960 HB2 ALA 30 2HB ALA 30 1.814 3.189 -20.833 961 HB3 ALA 30 3HB ALA 30 1.651 4.938 -20.986 962 H LEU 31 H LEU 31 4.052 4.908 -18.213 963 HA LEU 31 HA LEU 31 4.206 7.696 -18.650 964 HB2 LEU 31 2HB LEU 31 4.501 6.049 -16.181 965 HB3 LEU 31 1HB LEU 31 4.779 7.784 -16.164 966 HG LEU 31 HG LEU 31 2.208 6.554 -17.129 967 HD11 LEU 31 1HD1 LEU 31 2.600 6.039 -14.715 968 HD12 LEU 31 2HD1 LEU 31 1.257 7.151 -14.977 969 HD13 LEU 31 3HD1 LEU 31 2.813 7.773 -14.435 970 HD21 LEU 31 1HD2 LEU 31 2.626 8.763 -17.949 971 HD22 LEU 31 2HD2 LEU 31 2.987 9.321 -16.305 972 HD23 LEU 31 3HD2 LEU 31 1.361 8.798 -16.725 973 H GLU 32 H GLU 32 6.641 5.250 -18.372 974 HA GLU 32 HA GLU 32 8.851 7.004 -18.082 975 HB2 GLU 32 2HB GLU 32 8.613 4.290 -19.379 976 HB3 GLU 32 1HB GLU 32 10.140 5.144 -19.234 977 HG2 GLU 32 2HG GLU 32 8.399 4.418 -16.903 978 HG3 GLU 32 1HG GLU 32 9.716 3.410 -17.492 979 H GLU 33 H GLU 33 7.109 5.797 -20.880 980 HA GLU 33 HA GLU 33 8.745 7.104 -22.792 981 HB2 GLU 33 2HB GLU 33 5.930 6.022 -23.060 982 HB3 GLU 33 1HB GLU 33 6.961 6.504 -24.404 983 HG2 GLU 33 2HG GLU 33 8.578 4.775 -23.778 984 HG3 GLU 33 1HG GLU 33 7.540 4.290 -22.447 985 H LYS 34 H LYS 34 6.098 8.080 -20.861 986 HA LYS 34 HA LYS 34 5.736 10.566 -22.353 987 HB2 LYS 34 2HB LYS 34 4.351 9.470 -19.920 988 HB3 LYS 34 1HB LYS 34 4.000 11.046 -20.601 989 HG2 LYS 34 2HG LYS 34 3.708 8.430 -22.065 990 HG3 LYS 34 1HG LYS 34 2.395 9.299 -21.274 991 HD2 LYS 34 2HD LYS 34 4.089 10.438 -23.506 992 HD3 LYS 34 1HD LYS 34 2.524 9.684 -23.740 993 HE2 LYS 34 2HE LYS 34 1.494 11.338 -22.302 994 HE3 LYS 34 1HE LYS 34 3.057 12.123 -22.044 995 HZ1 LYS 34 1HZ LYS 34 3.138 12.498 -24.479 996 HZ2 LYS 34 2HZ LYS 34 1.843 13.298 -23.736 997 HZ3 LYS 34 3HZ LYS 34 1.597 11.890 -24.629 998 H GLY 35 H GLY 35 7.693 9.442 -19.876 999 HA2 GLY 35 2HA GLY 35 9.278 10.462 -18.601 1000 HA3 GLY 35 1HA GLY 35 9.033 11.885 -19.592 1001 H TYR 36 H TYR 36 6.629 10.367 -17.461 1002 HA TYR 36 HA TYR 36 6.548 12.931 -15.967 1003 HB2 TYR 36 2HB TYR 36 4.449 10.772 -16.123 1004 HB3 TYR 36 1HB TYR 36 4.335 12.195 -15.114 1005 HD1 TYR 36 1HD TYR 36 3.280 10.764 -18.061 1006 HD2 TYR 36 2HD TYR 36 4.688 14.475 -16.539 1007 HE1 TYR 36 1HE TYR 36 2.143 11.950 -19.890 1008 HE2 TYR 36 2HE TYR 36 3.551 15.664 -18.371 1009 HH TYR 36 HH TYR 36 2.735 15.173 -20.635 1010 H ASN 37 H ASN 37 7.873 9.978 -15.661 1011 HA ASN 37 HA ASN 37 8.490 8.585 -14.056 1012 HB2 ASN 37 2HB ASN 37 8.038 10.938 -12.176 1013 HB3 ASN 37 1HB ASN 37 8.783 9.432 -11.692 1014 HD21 ASN 37 1HD2 ASN 37 10.214 9.161 -14.320 1015 HD22 ASN 37 2HD2 ASN 37 11.495 10.295 -14.230 1016 HA PRO 38 HA PRO 38 4.393 6.876 -13.910 1017 HB2 PRO 38 2HB PRO 38 5.979 4.661 -12.785 1018 HB3 PRO 38 1HB PRO 38 4.772 4.677 -14.076 1019 HG2 PRO 38 2HG PRO 38 7.445 4.561 -14.537 1020 HG3 PRO 38 1HG PRO 38 6.302 5.276 -15.671 1021 HD2 PRO 38 2HD PRO 38 8.307 6.555 -13.981 1022 HD3 PRO 38 1HD PRO 38 7.438 7.181 -15.403 1023 H ILE 39 H ILE 39 6.683 6.552 -11.307 1024 HA ILE 39 HA ILE 39 4.993 5.428 -9.399 1025 HB ILE 39 HB ILE 39 7.362 7.230 -8.881 1026 HG12 ILE 39 2HG1 ILE 39 7.964 5.456 -10.434 1027 HG13 ILE 39 1HG1 ILE 39 8.684 5.139 -8.867 1028 HG21 ILE 39 1HG2 ILE 39 5.998 6.784 -6.887 1029 HG22 ILE 39 2HG2 ILE 39 7.554 5.958 -6.780 1030 HG23 ILE 39 3HG2 ILE 39 6.104 5.051 -7.199 1031 HD11 ILE 39 1HD1 ILE 39 7.800 3.104 -9.894 1032 HD12 ILE 39 2HD1 ILE 39 6.204 3.828 -9.974 1033 HD13 ILE 39 3HD1 ILE 39 6.937 3.489 -8.406 1034 H ASN 40 H ASN 40 5.824 8.898 -9.966 1035 HA ASN 40 HA ASN 40 4.538 10.054 -7.899 1036 HB2 ASN 40 2HB ASN 40 6.089 10.992 -9.649 1037 HB3 ASN 40 1HB ASN 40 4.683 11.079 -10.706 1038 HD21 ASN 40 1HD2 ASN 40 6.242 12.262 -8.000 1039 HD22 ASN 40 2HD2 ASN 40 5.231 13.626 -7.708 1040 H GLN 41 H GLN 41 3.345 9.218 -11.129 1041 HA GLN 41 HA GLN 41 0.813 10.433 -10.723 1042 HB2 GLN 41 2HB GLN 41 1.632 8.443 -12.839 1043 HB3 GLN 41 1HB GLN 41 0.214 9.474 -12.883 1044 HG2 GLN 41 2HG GLN 41 3.089 10.405 -12.962 1045 HG3 GLN 41 1HG GLN 41 1.976 10.345 -14.322 1046 HE21 GLN 41 1HE2 GLN 41 -0.288 11.344 -12.814 1047 HE22 GLN 41 2HE2 GLN 41 -0.002 13.020 -12.515 1048 H ILE 42 H ILE 42 2.084 7.176 -10.383 1049 HA ILE 42 HA ILE 42 -0.446 5.937 -10.041 1050 HB ILE 42 HB ILE 42 2.279 4.961 -9.117 1051 HG12 ILE 42 2HG1 ILE 42 0.617 4.198 -11.540 1052 HG13 ILE 42 1HG1 ILE 42 2.051 5.214 -11.567 1053 HG21 ILE 42 1HG2 ILE 42 0.498 3.908 -7.808 1054 HG22 ILE 42 2HG2 ILE 42 1.203 2.730 -8.912 1055 HG23 ILE 42 3HG2 ILE 42 -0.356 3.465 -9.278 1056 HD11 ILE 42 1HD1 ILE 42 3.403 3.323 -10.811 1057 HD12 ILE 42 2HD1 ILE 42 2.545 2.949 -12.307 1058 HD13 ILE 42 3HD1 ILE 42 1.960 2.309 -10.771 1059 H VAL 43 H VAL 43 2.031 6.945 -7.649 1060 HA VAL 43 HA VAL 43 0.437 6.259 -5.456 1061 HB VAL 43 HB VAL 43 2.799 6.599 -5.007 1062 HG11 VAL 43 1HG1 VAL 43 3.226 8.295 -6.748 1063 HG12 VAL 43 2HG1 VAL 43 3.896 8.750 -5.189 1064 HG13 VAL 43 3HG1 VAL 43 2.399 9.504 -5.760 1065 HG21 VAL 43 1HG2 VAL 43 1.240 8.818 -3.696 1066 HG22 VAL 43 2HG2 VAL 43 2.761 8.146 -3.113 1067 HG23 VAL 43 3HG2 VAL 43 1.305 7.142 -3.161 1068 H GLY 44 H GLY 44 0.645 9.326 -7.213 1069 HA2 GLY 44 2HA GLY 44 -1.130 10.794 -5.627 1070 HA3 GLY 44 1HA GLY 44 -0.870 11.044 -7.348 1071 H TYR 45 H TYR 45 -1.719 8.523 -8.262 1072 HA TYR 45 HA TYR 45 -4.454 8.912 -8.562 1073 HB2 TYR 45 2HB TYR 45 -3.285 7.667 -10.243 1074 HB3 TYR 45 1HB TYR 45 -2.781 6.453 -9.071 1075 HD1 TYR 45 1HD TYR 45 -4.047 4.501 -8.827 1076 HD2 TYR 45 2HD TYR 45 -5.871 7.928 -10.561 1077 HE1 TYR 45 1HE TYR 45 -6.071 3.193 -9.288 1078 HE2 TYR 45 2HE TYR 45 -7.875 6.618 -11.036 1079 HH TYR 45 HH TYR 45 -8.291 3.480 -9.722 1080 H LEU 46 H LEU 46 -2.789 6.493 -6.537 1081 HA LEU 46 HA LEU 46 -5.287 5.526 -5.646 1082 HB2 LEU 46 2HB LEU 46 -2.568 5.007 -4.448 1083 HB3 LEU 46 1HB LEU 46 -4.041 4.289 -3.838 1084 HG LEU 46 HG LEU 46 -4.314 3.308 -6.228 1085 HD11 LEU 46 1HD1 LEU 46 -2.354 2.932 -7.489 1086 HD12 LEU 46 2HD1 LEU 46 -1.425 3.926 -6.371 1087 HD13 LEU 46 3HD1 LEU 46 -2.699 4.659 -7.340 1088 HD21 LEU 46 1HD2 LEU 46 -2.881 1.419 -5.702 1089 HD22 LEU 46 2HD2 LEU 46 -3.830 1.951 -4.314 1090 HD23 LEU 46 3HD2 LEU 46 -2.114 2.357 -4.422 1091 H LEU 47 H LEU 47 -3.061 7.849 -4.145 1092 HA LEU 47 HA LEU 47 -4.606 8.062 -1.826 1093 HB2 LEU 47 2HB LEU 47 -2.558 9.842 -3.072 1094 HB3 LEU 47 1HB LEU 47 -3.458 10.372 -1.671 1095 HG LEU 47 HG LEU 47 -1.279 9.540 -1.074 1096 HD11 LEU 47 1HD1 LEU 47 -3.486 7.714 -0.119 1097 HD12 LEU 47 2HD1 LEU 47 -3.064 9.294 0.545 1098 HD13 LEU 47 3HD1 LEU 47 -1.933 7.948 0.678 1099 HD21 LEU 47 1HD2 LEU 47 -2.157 6.854 -2.131 1100 HD22 LEU 47 2HD2 LEU 47 -0.677 7.196 -1.228 1101 HD23 LEU 47 3HD2 LEU 47 -0.908 7.897 -2.826 1102 H SER 48 H SER 48 -4.953 9.705 -4.928 1103 HA SER 48 HA SER 48 -6.995 11.416 -3.728 1104 HB2 SER 48 2HB SER 48 -5.967 11.303 -6.547 1105 HB3 SER 48 1HB SER 48 -7.070 12.526 -5.914 1106 HG SER 48 HG SER 48 -4.700 12.124 -4.519 1107 H GLY 49 H GLY 49 -6.841 8.476 -5.711 1108 HA2 GLY 49 2HA GLY 49 -8.492 7.138 -6.451 1109 HA3 GLY 49 1HA GLY 49 -9.626 8.063 -5.467 1110 H ASP 50 H ASP 50 -7.529 9.257 -8.045 1111 HA ASP 50 HA ASP 50 -9.947 9.986 -9.542 1112 HB2 ASP 50 2HB ASP 50 -9.054 11.913 -8.258 1113 HB3 ASP 50 1HB ASP 50 -7.542 11.746 -9.136 1114 HA PRO 51 HA PRO 51 -7.800 7.796 -12.747 1115 HB2 PRO 51 2HB PRO 51 -9.380 8.584 -14.819 1116 HB3 PRO 51 1HB PRO 51 -9.863 7.372 -13.623 1117 HG2 PRO 51 2HG PRO 51 -10.495 10.295 -13.722 1118 HG3 PRO 51 1HG PRO 51 -11.592 8.931 -13.434 1119 HD2 PRO 51 2HD PRO 51 -10.666 10.391 -11.419 1120 HD3 PRO 51 1HD PRO 51 -10.835 8.629 -11.255 1121 H ALA 52 H ALA 52 -8.151 11.306 -12.874 1122 HA ALA 52 HA ALA 52 -7.018 11.740 -15.404 1123 HB1 ALA 52 1HB ALA 52 -6.857 14.060 -14.798 1124 HB2 ALA 52 2HB ALA 52 -7.071 13.655 -13.097 1125 HB3 ALA 52 3HB ALA 52 -8.393 13.396 -14.234 1126 H TYR 53 H TYR 53 -5.458 10.719 -12.650 1127 HA TYR 53 HA TYR 53 -2.993 12.021 -12.929 1128 HB2 TYR 53 2HB TYR 53 -3.774 9.495 -11.564 1129 HB3 TYR 53 1HB TYR 53 -2.089 10.011 -11.641 1130 HD1 TYR 53 1HD TYR 53 -1.410 12.103 -10.656 1131 HD2 TYR 53 2HD TYR 53 -5.341 10.626 -10.171 1132 HE1 TYR 53 1HE TYR 53 -1.720 13.627 -8.837 1133 HE2 TYR 53 2HE TYR 53 -5.695 12.160 -8.311 1134 HH TYR 53 HH TYR 53 -4.306 13.324 -6.646 1135 H ILE 54 H ILE 54 -4.353 9.381 -14.745 1136 HA ILE 54 HA ILE 54 -1.683 8.858 -15.863 1137 HB ILE 54 HB ILE 54 -4.100 6.991 -16.160 1138 HG12 ILE 54 2HG1 ILE 54 -3.355 7.056 -13.797 1139 HG13 ILE 54 1HG1 ILE 54 -2.931 5.536 -14.577 1140 HG21 ILE 54 1HG2 ILE 54 -2.504 5.386 -16.982 1141 HG22 ILE 54 2HG2 ILE 54 -1.215 6.583 -16.856 1142 HG23 ILE 54 3HG2 ILE 54 -2.542 6.831 -17.989 1143 HD11 ILE 54 1HD1 ILE 54 -1.151 6.334 -13.134 1144 HD12 ILE 54 2HD1 ILE 54 -1.040 7.823 -14.077 1145 HD13 ILE 54 3HD1 ILE 54 -0.644 6.271 -14.820 1146 HA PRO 55 HA PRO 55 -3.397 10.911 -19.440 1147 HB2 PRO 55 2HB PRO 55 -1.082 11.108 -20.814 1148 HB3 PRO 55 1HB PRO 55 -1.456 12.162 -19.447 1149 HG2 PRO 55 2HG PRO 55 0.309 9.761 -19.553 1150 HG3 PRO 55 1HG PRO 55 0.531 11.285 -18.676 1151 HD2 PRO 55 2HD PRO 55 -0.397 8.936 -17.570 1152 HD3 PRO 55 1HD PRO 55 -0.678 10.552 -16.882 1153 H ARG 56 H ARG 56 -3.989 10.156 -21.500 1154 HA ARG 56 HA ARG 56 -3.514 7.351 -21.714 1155 HB2 ARG 56 2HB ARG 56 -5.283 7.239 -23.428 1156 HB3 ARG 56 1HB ARG 56 -5.808 7.796 -21.852 1157 HG2 ARG 56 2HG ARG 56 -5.839 10.094 -22.717 1158 HG3 ARG 56 1HG ARG 56 -5.342 9.479 -24.301 1159 HD2 ARG 56 2HD ARG 56 -7.330 8.051 -24.357 1160 HD3 ARG 56 1HD ARG 56 -7.819 8.696 -22.797 1161 HE ARG 56 HE ARG 56 -7.472 10.825 -24.537 1162 HH11 ARG 56 1HH1 ARG 56 -9.629 8.088 -24.038 1163 HH12 ARG 56 2HH1 ARG 56 -10.943 8.762 -24.876 1164 HH21 ARG 56 1HH2 ARG 56 -9.262 11.779 -25.675 1165 HH22 ARG 56 2HH2 ARG 56 -10.740 10.934 -25.824 1166 H TYR 57 H TYR 57 -1.389 7.654 -22.201 1167 HA TYR 57 HA TYR 57 -0.726 8.069 -24.979 1168 HB2 TYR 57 2HB TYR 57 0.929 8.578 -23.279 1169 HB3 TYR 57 1HB TYR 57 0.832 6.947 -22.644 1170 HD1 TYR 57 1HD TYR 57 1.962 8.948 -25.558 1171 HD2 TYR 57 2HD TYR 57 2.091 5.184 -23.587 1172 HE1 TYR 57 1HE TYR 57 3.769 8.243 -27.043 1173 HE2 TYR 57 2HE TYR 57 3.866 4.451 -25.050 1174 HH TYR 57 HH TYR 57 4.772 4.981 -27.244 1175 H GLN 58 H GLN 58 -1.701 5.528 -22.876 1176 HA GLN 58 HA GLN 58 -1.674 3.636 -25.074 1177 HB2 GLN 58 2HB GLN 58 0.485 3.567 -23.575 1178 HB3 GLN 58 1HB GLN 58 -0.585 2.836 -22.390 1179 HG2 GLN 58 2HG GLN 58 -1.140 1.094 -24.150 1180 HG3 GLN 58 1HG GLN 58 0.157 1.861 -25.088 1181 HE21 GLN 58 1HE2 GLN 58 -0.053 -0.846 -24.027 1182 HE22 GLN 58 2HE2 GLN 58 1.346 -1.078 -23.065 1183 H ASP 59 H ASP 59 -2.901 1.619 -24.234 1184 HA ASP 59 HA ASP 59 -5.361 2.369 -23.167 1185 HB2 ASP 59 2HB ASP 59 -5.938 -0.036 -23.171 1186 HB3 ASP 59 1HB ASP 59 -5.233 0.485 -24.687 1187 H ALA 60 H ALA 60 -2.551 1.780 -21.558 1188 HA ALA 60 HA ALA 60 -3.177 0.611 -19.136 1189 HB1 ALA 60 1HB ALA 60 -1.341 1.880 -18.175 1190 HB2 ALA 60 2HB ALA 60 -1.392 3.007 -19.531 1191 HB3 ALA 60 3HB ALA 60 -0.921 1.331 -19.799 1192 H ARG 61 H ARG 61 -3.960 3.894 -20.203 1193 HA ARG 61 HA ARG 61 -4.833 5.004 -17.802 1194 HB2 ARG 61 2HB ARG 61 -4.398 6.203 -19.961 1195 HB3 ARG 61 1HB ARG 61 -5.835 5.471 -20.626 1196 HG2 ARG 61 2HG ARG 61 -6.164 7.159 -18.195 1197 HG3 ARG 61 1HG ARG 61 -5.721 7.985 -19.671 1198 HD2 ARG 61 2HD ARG 61 -8.104 8.093 -19.487 1199 HD3 ARG 61 1HD ARG 61 -7.747 6.945 -20.761 1200 HE ARG 61 HE ARG 61 -8.125 5.698 -18.235 1201 HH11 ARG 61 1HH1 ARG 61 -9.908 7.115 -20.974 1202 HH12 ARG 61 2HH1 ARG 61 -11.331 6.252 -20.707 1203 HH21 ARG 61 1HH2 ARG 61 -10.096 4.486 -17.878 1204 HH22 ARG 61 2HH2 ARG 61 -11.457 4.711 -18.886 1205 H ASN 62 H ASN 62 -6.452 2.911 -20.122 1206 HA ASN 62 HA ASN 62 -8.998 2.992 -18.789 1207 HB2 ASN 62 2HB ASN 62 -7.932 0.990 -20.791 1208 HB3 ASN 62 1HB ASN 62 -9.611 1.147 -20.292 1209 HD21 ASN 62 1HD2 ASN 62 -10.795 2.904 -21.049 1210 HD22 ASN 62 2HD2 ASN 62 -10.283 3.827 -22.403 1211 H LEU 63 H LEU 63 -6.250 0.831 -18.974 1212 HA LEU 63 HA LEU 63 -7.212 -1.352 -17.531 1213 HB2 LEU 63 2HB LEU 63 -4.375 -0.343 -17.610 1214 HB3 LEU 63 1HB LEU 63 -4.887 -1.942 -17.134 1215 HG LEU 63 HG LEU 63 -5.078 -0.782 -19.921 1216 HD11 LEU 63 1HD1 LEU 63 -2.798 -1.327 -19.174 1217 HD12 LEU 63 2HD1 LEU 63 -3.352 -2.392 -20.463 1218 HD13 LEU 63 3HD1 LEU 63 -3.321 -2.958 -18.792 1219 HD21 LEU 63 1HD2 LEU 63 -5.766 -3.045 -20.573 1220 HD22 LEU 63 2HD2 LEU 63 -6.928 -2.324 -19.459 1221 HD23 LEU 63 3HD2 LEU 63 -5.783 -3.537 -18.884 1222 H ILE 64 H ILE 64 -5.415 1.488 -16.347 1223 HA ILE 64 HA ILE 64 -5.319 0.548 -13.666 1224 HB ILE 64 HB ILE 64 -3.797 2.357 -14.639 1225 HG12 ILE 64 2HG1 ILE 64 -5.267 3.095 -12.087 1226 HG13 ILE 64 1HG1 ILE 64 -4.003 1.875 -12.195 1227 HG21 ILE 64 1HG2 ILE 64 -4.729 4.754 -14.507 1228 HG22 ILE 64 2HG2 ILE 64 -6.309 4.035 -14.272 1229 HG23 ILE 64 3HG2 ILE 64 -5.462 3.750 -15.767 1230 HD11 ILE 64 1HD1 ILE 64 -2.413 3.620 -12.870 1231 HD12 ILE 64 2HD1 ILE 64 -3.139 3.938 -11.294 1232 HD13 ILE 64 3HD1 ILE 64 -3.695 4.823 -12.711 1233 H ARG 65 H ARG 65 -7.594 2.223 -15.540 1234 HA ARG 65 HA ARG 65 -8.921 3.620 -13.484 1235 HB2 ARG 65 2HB ARG 65 -8.740 4.076 -16.020 1236 HB3 ARG 65 1HB ARG 65 -10.052 2.932 -16.182 1237 HG2 ARG 65 2HG ARG 65 -10.146 5.459 -14.576 1238 HG3 ARG 65 1HG ARG 65 -10.730 5.292 -16.219 1239 HD2 ARG 65 2HD ARG 65 -11.721 3.744 -13.851 1240 HD3 ARG 65 1HD ARG 65 -12.453 5.195 -14.548 1241 HE ARG 65 HE ARG 65 -12.254 3.430 -16.646 1242 HH11 ARG 65 1HH1 ARG 65 -13.871 3.252 -13.492 1243 HH12 ARG 65 2HH1 ARG 65 -15.071 2.187 -14.033 1244 HH21 ARG 65 1HH2 ARG 65 -13.851 2.003 -17.364 1245 HH22 ARG 65 2HH2 ARG 65 -15.075 1.441 -16.320 1246 H ARG 66 H ARG 66 -9.304 0.491 -14.979 1247 HA ARG 66 HA ARG 66 -11.846 0.017 -13.731 1248 HB2 ARG 66 2HB ARG 66 -11.615 -2.329 -14.578 1249 HB3 ARG 66 1HB ARG 66 -11.519 -1.096 -15.822 1250 HG2 ARG 66 2HG ARG 66 -9.104 -1.321 -15.886 1251 HG3 ARG 66 1HG ARG 66 -9.174 -2.510 -14.583 1252 HD2 ARG 66 2HD ARG 66 -10.488 -2.801 -17.273 1253 HD3 ARG 66 1HD ARG 66 -8.947 -3.532 -16.837 1254 HE ARG 66 HE ARG 66 -10.963 -4.190 -14.976 1255 HH11 ARG 66 1HH1 ARG 66 -9.798 -5.019 -18.215 1256 HH12 ARG 66 2HH1 ARG 66 -10.383 -6.599 -18.197 1257 HH21 ARG 66 1HH2 ARG 66 -11.805 -6.338 -14.924 1258 HH22 ARG 66 2HH2 ARG 66 -11.581 -7.383 -16.254 1259 H HIS 67 H HIS 67 -8.634 -0.205 -12.683 1260 HA HIS 67 HA HIS 67 -9.488 -1.872 -10.415 1261 HB2 HIS 67 2HB HIS 67 -6.644 -1.058 -11.156 1262 HB3 HIS 67 1HB HIS 67 -7.102 -2.138 -9.851 1263 HD1 HIS 67 1HD HIS 67 -7.921 -4.599 -10.605 1264 HD2 HIS 67 2HD HIS 67 -6.384 -2.198 -13.628 1265 HE1 HIS 67 1HE HIS 67 -7.433 -6.130 -12.500 1266 HE2 HIS 67 2HE HIS 67 -6.676 -4.618 -14.372 1267 H GLU 68 H GLU 68 -10.587 -0.359 -9.310 1268 HA GLU 68 HA GLU 68 -10.248 2.320 -9.338 1269 HB2 GLU 68 2HB GLU 68 -11.376 0.718 -7.054 1270 HB3 GLU 68 1HB GLU 68 -11.658 2.431 -7.349 1271 HG2 GLU 68 2HG GLU 68 -12.710 1.913 -9.472 1272 HG3 GLU 68 1HG GLU 68 -12.401 0.200 -9.224 1273 H ARG 69 H ARG 69 -9.116 0.463 -6.466 1274 HA ARG 69 HA ARG 69 -6.544 1.420 -6.475 1275 HB2 ARG 69 2HB ARG 69 -6.449 3.239 -4.747 1276 HB3 ARG 69 1HB ARG 69 -7.345 3.694 -6.168 1277 HG2 ARG 69 2HG ARG 69 -9.408 3.366 -5.046 1278 HG3 ARG 69 1HG ARG 69 -8.567 2.820 -3.575 1279 HD2 ARG 69 2HD ARG 69 -7.408 5.034 -3.518 1280 HD3 ARG 69 1HD ARG 69 -8.392 5.543 -4.880 1281 HE ARG 69 HE ARG 69 -10.237 4.817 -3.067 1282 HH11 ARG 69 1HH1 ARG 69 -7.415 6.973 -2.812 1283 HH12 ARG 69 2HH1 ARG 69 -8.148 7.998 -1.659 1284 HH21 ARG 69 1HH2 ARG 69 -11.205 6.266 -1.439 1285 HH22 ARG 69 2HH2 ARG 69 -10.323 7.599 -0.889 1286 H ASP 70 H ASP 70 -9.202 0.496 -4.399 1287 HA ASP 70 HA ASP 70 -7.734 -0.348 -2.149 1288 HB2 ASP 70 2HB ASP 70 -10.194 -0.000 -2.207 1289 HB3 ASP 70 1HB ASP 70 -10.361 -1.413 -3.236 1290 H GLU 71 H GLU 71 -8.877 -2.103 -4.990 1291 HA GLU 71 HA GLU 71 -7.879 -4.655 -4.604 1292 HB2 GLU 71 2HB GLU 71 -8.184 -2.987 -7.084 1293 HB3 GLU 71 1HB GLU 71 -7.575 -4.628 -7.148 1294 HG2 GLU 71 2HG GLU 71 -10.246 -3.842 -6.025 1295 HG3 GLU 71 1HG GLU 71 -9.971 -4.424 -7.664 1296 H ILE 72 H ILE 72 -6.261 -1.854 -5.997 1297 HA ILE 72 HA ILE 72 -3.885 -3.150 -6.765 1298 HB ILE 72 HB ILE 72 -4.263 -0.221 -6.071 1299 HG12 ILE 72 2HG1 ILE 72 -4.507 -1.638 -8.742 1300 HG13 ILE 72 1HG1 ILE 72 -5.846 -0.990 -7.802 1301 HG21 ILE 72 1HG2 ILE 72 -2.171 -1.615 -7.750 1302 HG22 ILE 72 2HG2 ILE 72 -1.909 -0.874 -6.172 1303 HG23 ILE 72 3HG2 ILE 72 -2.317 0.134 -7.562 1304 HD11 ILE 72 1HD1 ILE 72 -4.945 1.268 -8.104 1305 HD12 ILE 72 2HD1 ILE 72 -5.259 0.478 -9.649 1306 HD13 ILE 72 3HD1 ILE 72 -3.608 0.604 -9.043 1307 H MET 73 H MET 73 -4.701 -1.264 -3.893 1308 HA MET 73 HA MET 73 -2.242 -1.452 -2.627 1309 HB2 MET 73 2HB MET 73 -4.976 -1.187 -1.492 1310 HB3 MET 73 1HB MET 73 -3.528 -1.117 -0.490 1311 HG2 MET 73 2HG MET 73 -4.299 0.735 -2.724 1312 HG3 MET 73 1HG MET 73 -4.275 1.076 -0.991 1313 HE1 MET 73 1HE MET 73 -0.482 1.050 -0.148 1314 HE2 MET 73 2HE MET 73 -1.558 -0.347 -0.011 1315 HE3 MET 73 3HE MET 73 -2.104 1.262 0.491 1316 H GLU 74 H GLU 74 -4.932 -3.766 -2.527 1317 HA GLU 74 HA GLU 74 -3.731 -5.352 -0.534 1318 HB2 GLU 74 2HB GLU 74 -5.610 -6.238 -2.707 1319 HB3 GLU 74 1HB GLU 74 -5.072 -7.238 -1.364 1320 HG2 GLU 74 2HG GLU 74 -6.067 -5.574 0.178 1321 HG3 GLU 74 1HG GLU 74 -6.745 -4.754 -1.231 1322 H GLU 75 H GLU 75 -3.426 -5.457 -4.051 1323 HA GLU 75 HA GLU 75 -1.787 -7.768 -4.023 1324 HB2 GLU 75 2HB GLU 75 -2.952 -6.877 -6.080 1325 HB3 GLU 75 1HB GLU 75 -1.759 -5.579 -6.100 1326 HG2 GLU 75 2HG GLU 75 0.039 -7.213 -6.341 1327 HG3 GLU 75 1HG GLU 75 -1.137 -8.518 -6.317 1328 H LEU 76 H LEU 76 -1.123 -4.297 -4.084 1329 HA LEU 76 HA LEU 76 1.655 -4.404 -4.122 1330 HB2 LEU 76 2HB LEU 76 -0.113 -2.376 -2.768 1331 HB3 LEU 76 1HB LEU 76 1.607 -2.188 -3.010 1332 HG LEU 76 HG LEU 76 -0.476 -2.354 -5.187 1333 HD11 LEU 76 1HD1 LEU 76 0.086 -0.000 -5.559 1334 HD12 LEU 76 2HD1 LEU 76 1.167 -0.043 -4.167 1335 HD13 LEU 76 3HD1 LEU 76 -0.567 -0.265 -3.940 1336 HD21 LEU 76 1HD2 LEU 76 1.643 -3.305 -5.919 1337 HD22 LEU 76 2HD2 LEU 76 2.500 -1.873 -5.343 1338 HD23 LEU 76 3HD2 LEU 76 1.366 -1.747 -6.685 1339 H THR 77 H THR 77 -0.541 -4.309 -1.259 1340 HA THR 77 HA THR 77 1.547 -4.320 0.588 1341 HB THR 77 HB THR 77 -1.272 -5.388 0.953 1342 HG1 THR 77 1HG THR 77 -1.361 -3.270 0.246 1343 HG21 THR 77 1HG2 THR 77 -0.926 -4.813 3.313 1344 HG22 THR 77 2HG2 THR 77 0.717 -4.283 2.949 1345 HG23 THR 77 3HG2 THR 77 0.281 -5.982 2.776 1346 H LYS 78 H LYS 78 -0.334 -7.034 -0.793 1347 HA LYS 78 HA LYS 78 0.978 -8.892 0.892 1348 HB2 LYS 78 2HB LYS 78 -0.817 -9.389 -1.462 1349 HB3 LYS 78 1HB LYS 78 -0.162 -10.662 -0.431 1350 HG2 LYS 78 2HG LYS 78 -1.131 -9.415 1.492 1351 HG3 LYS 78 1HG LYS 78 -1.991 -8.431 0.331 1352 HD2 LYS 78 2HD LYS 78 -2.231 -11.437 0.481 1353 HD3 LYS 78 1HD LYS 78 -3.351 -10.323 1.252 1354 HE2 LYS 78 2HE LYS 78 -3.920 -9.397 -0.917 1355 HE3 LYS 78 1HE LYS 78 -2.780 -10.503 -1.693 1356 HZ1 LYS 78 1HZ LYS 78 -5.045 -11.391 -0.022 1357 HZ2 LYS 78 2HZ LYS 78 -4.069 -12.360 -0.945 1358 HZ3 LYS 78 3HZ LYS 78 -5.187 -11.306 -1.670 1359 H TYR 79 H TYR 79 1.446 -8.076 -2.479 1360 HA TYR 79 HA TYR 79 3.320 -10.180 -2.865 1361 HB2 TYR 79 2HB TYR 79 2.149 -9.067 -4.753 1362 HB3 TYR 79 1HB TYR 79 3.066 -7.602 -4.435 1363 HD1 TYR 79 1HD TYR 79 3.101 -10.884 -5.941 1364 HD2 TYR 79 2HD TYR 79 5.487 -7.584 -4.830 1365 HE1 TYR 79 1HE TYR 79 4.886 -11.697 -7.449 1366 HE2 TYR 79 2HE TYR 79 7.290 -8.358 -6.328 1367 HH TYR 79 HH TYR 79 6.795 -10.834 -8.621 1368 H TYR 80 H TYR 80 3.618 -6.796 -1.954 1369 HA TYR 80 HA TYR 80 6.406 -6.572 -1.946 1370 HB2 TYR 80 2HB TYR 80 5.106 -4.574 -1.826 1371 HB3 TYR 80 1HB TYR 80 4.238 -5.139 -0.410 1372 HD1 TYR 80 1HD TYR 80 7.332 -3.592 -1.631 1373 HD2 TYR 80 2HD TYR 80 5.236 -5.038 1.766 1374 HE1 TYR 80 1HE TYR 80 8.926 -2.446 -0.144 1375 HE2 TYR 80 2HE TYR 80 6.805 -3.902 3.240 1376 HH TYR 80 HH TYR 80 8.868 -1.568 2.314 1377 H LEU 81 H LEU 81 4.177 -7.531 0.630 1378 HA LEU 81 HA LEU 81 6.286 -7.895 2.493 1379 HB2 LEU 81 2HB LEU 81 3.426 -8.788 2.534 1380 HB3 LEU 81 1HB LEU 81 4.525 -9.037 3.881 1381 HG LEU 81 HG LEU 81 3.656 -6.360 2.770 1382 HD11 LEU 81 1HD1 LEU 81 2.918 -7.772 5.323 1383 HD12 LEU 81 2HD1 LEU 81 1.861 -7.510 3.934 1384 HD13 LEU 81 3HD1 LEU 81 2.442 -6.133 4.872 1385 HD21 LEU 81 1HD2 LEU 81 4.771 -5.432 4.756 1386 HD22 LEU 81 2HD2 LEU 81 5.908 -6.247 3.691 1387 HD23 LEU 81 3HD2 LEU 81 5.361 -7.042 5.169 1388 H ALA 82 H ALA 82 4.735 -9.983 0.145 1389 HA ALA 82 HA ALA 82 5.364 -12.454 1.270 1390 HB1 ALA 82 1HB ALA 82 5.117 -11.733 -1.640 1391 HB2 ALA 82 2HB ALA 82 3.786 -12.164 -0.570 1392 HB3 ALA 82 3HB ALA 82 5.027 -13.358 -0.972 1393 H ASN 83 H ASN 83 7.240 -10.409 -0.909 1394 HA ASN 83 HA ASN 83 9.303 -12.352 -1.267 1395 HB2 ASN 83 2HB ASN 83 10.635 -10.582 -2.346 1396 HB3 ASN 83 1HB ASN 83 8.995 -10.629 -2.977 1397 HD21 ASN 83 1HD2 ASN 83 7.708 -8.868 -2.760 1398 HD22 ASN 83 2HD2 ASN 83 8.267 -7.409 -2.040 1399 H HIS 84 H HIS 84 8.588 -10.616 1.443 1400 HA HIS 84 HA HIS 84 11.383 -10.340 2.230 1401 HB2 HIS 84 2HB HIS 84 8.875 -9.613 3.775 1402 HB3 HIS 84 1HB HIS 84 10.499 -9.441 4.411 1403 HD1 HIS 84 1HD HIS 84 11.911 -8.002 2.078 1404 HD2 HIS 84 2HD HIS 84 8.085 -7.079 3.426 1405 HE1 HIS 84 1HE HIS 84 11.495 -5.651 1.334 1406 HE2 HIS 84 2HE HIS 84 9.386 -5.025 2.505 1407 H GLY 85 H GLY 85 9.500 -12.843 1.916 1408 HA2 GLY 85 2HA GLY 85 9.878 -14.997 2.758 1409 HA3 GLY 85 1HA GLY 85 10.734 -14.289 4.128 1410 H ILE 86 H ILE 86 7.744 -12.974 3.190 1411 HA ILE 86 HA ILE 86 6.576 -13.995 5.646 1412 HB ILE 86 HB ILE 86 5.809 -11.617 3.948 1413 HG12 ILE 86 2HG1 ILE 86 7.026 -11.812 6.711 1414 HG13 ILE 86 1HG1 ILE 86 7.845 -11.281 5.248 1415 HG21 ILE 86 1HG2 ILE 86 4.181 -11.090 5.704 1416 HG22 ILE 86 2HG2 ILE 86 4.575 -12.604 6.519 1417 HG23 ILE 86 3HG2 ILE 86 3.824 -12.631 4.924 1418 HD11 ILE 86 1HD1 ILE 86 7.224 -9.413 6.645 1419 HD12 ILE 86 2HD1 ILE 86 5.534 -9.932 6.587 1420 HD13 ILE 86 3HD1 ILE 86 6.336 -9.369 5.114 1421 H ASP 87 H ASP 87 5.094 -15.421 5.559 1422 HA ASP 87 HA ASP 87 3.806 -16.098 3.011 1423 HB2 ASP 87 2HB ASP 87 4.878 -17.955 4.248 1424 HB3 ASP 87 1HB ASP 87 3.889 -17.587 5.655 1425 H ILE 88 H ILE 88 1.797 -15.355 2.678 1426 HA ILE 88 HA ILE 88 0.369 -14.230 4.995 1427 HB ILE 88 HB ILE 88 0.216 -13.420 2.072 1428 HG12 ILE 88 2HG1 ILE 88 1.484 -12.008 4.422 1429 HG13 ILE 88 1HG1 ILE 88 2.360 -12.856 3.154 1430 HG21 ILE 88 1HG2 ILE 88 -1.053 -12.116 4.475 1431 HG22 ILE 88 2HG2 ILE 88 -1.902 -13.028 3.226 1432 HG23 ILE 88 3HG2 ILE 88 -1.098 -11.510 2.820 1433 HD11 ILE 88 1HD1 ILE 88 2.392 -10.459 2.838 1434 HD12 ILE 88 2HD1 ILE 88 0.626 -10.426 2.781 1435 HD13 ILE 88 3HD1 ILE 88 1.539 -11.257 1.519 1436 H LYS 89 H LYS 89 -1.808 -14.633 5.263 1437 HA LYS 89 HA LYS 89 -3.067 -16.469 3.393 1438 HB2 LYS 89 2HB LYS 89 -3.332 -16.410 6.406 1439 HB3 LYS 89 1HB LYS 89 -4.472 -17.237 5.364 1440 HG2 LYS 89 2HG LYS 89 -2.684 -18.661 4.528 1441 HG3 LYS 89 1HG LYS 89 -1.532 -17.833 5.578 1442 HD2 LYS 89 2HD LYS 89 -2.717 -18.598 7.538 1443 HD3 LYS 89 1HD LYS 89 -3.982 -19.308 6.534 1444 HE2 LYS 89 2HE LYS 89 -1.080 -20.135 6.548 1445 HE3 LYS 89 1HE LYS 89 -2.389 -20.988 7.370 1446 HZ1 LYS 89 1HZ LYS 89 -2.187 -20.579 4.417 1447 HZ2 LYS 89 2HZ LYS 89 -3.431 -21.372 5.217 1448 HZ3 LYS 89 3HZ LYS 89 -1.898 -22.019 5.231 Start of MODEL 5 1 H1 MET 1 1HT MET 1 -0.151 39.478 34.959 2 H2 MET 1 2HT MET 1 1.195 39.669 35.942 3 H3 MET 1 3HT MET 1 -0.284 39.244 36.631 4 HA MET 1 HA MET 1 1.221 37.372 36.487 5 HB2 MET 1 2HB MET 1 -1.129 37.199 34.585 6 HB3 MET 1 1HB MET 1 -0.241 35.818 35.202 7 HG2 MET 1 2HG MET 1 -2.285 36.055 36.428 8 HG3 MET 1 1HG MET 1 -0.933 36.437 37.486 9 HE1 MET 1 1HE MET 1 -3.736 38.765 38.830 10 HE2 MET 1 2HE MET 1 -2.547 37.531 39.233 11 HE3 MET 1 3HE MET 1 -3.925 37.125 38.207 12 H GLY 2 H GLY 2 2.442 35.918 35.182 13 HA2 GLY 2 2HA GLY 2 3.051 36.957 32.504 14 HA3 GLY 2 1HA GLY 2 4.327 36.592 33.657 15 H PHE 3 H PHE 3 1.528 35.116 32.105 16 HA PHE 3 HA PHE 3 2.841 32.523 32.352 17 HB2 PHE 3 2HB PHE 3 0.002 33.202 31.550 18 HB3 PHE 3 1HB PHE 3 0.653 31.579 31.640 19 HD1 PHE 3 1HD PHE 3 -1.107 34.085 33.372 20 HD2 PHE 3 2HD PHE 3 1.642 30.894 33.966 21 HE1 PHE 3 1HE PHE 3 -1.787 33.939 35.731 22 HE2 PHE 3 2HE PHE 3 0.961 30.739 36.323 23 HZ PHE 3 HZ PHE 3 -0.755 32.266 37.208 24 H THR 4 H THR 4 4.081 32.004 30.733 25 HA THR 4 HA THR 4 3.092 32.198 28.007 26 HB THR 4 HB THR 4 5.855 33.206 28.793 27 HG1 THR 4 1HG THR 4 3.482 34.454 28.776 28 HG21 THR 4 1HG2 THR 4 6.001 33.914 26.435 29 HG22 THR 4 2HG2 THR 4 4.407 33.225 26.132 30 HG23 THR 4 3HG2 THR 4 5.756 32.171 26.556 31 H ASP 5 H ASP 5 3.101 30.062 27.572 32 HA ASP 5 HA ASP 5 5.222 28.397 28.680 33 HB2 ASP 5 2HB ASP 5 2.684 27.639 27.235 34 HB3 ASP 5 1HB ASP 5 3.884 26.486 27.790 35 H GLU 6 H GLU 6 6.974 27.985 27.550 36 HA GLU 6 HA GLU 6 6.711 28.080 24.680 37 HB2 GLU 6 2HB GLU 6 9.212 27.985 24.594 38 HB3 GLU 6 1HB GLU 6 8.620 29.371 25.479 39 HG2 GLU 6 2HG GLU 6 9.687 26.844 26.749 40 HG3 GLU 6 1HG GLU 6 10.635 28.294 26.458 41 H THR 7 H THR 7 5.745 26.293 24.065 42 HA THR 7 HA THR 7 6.284 23.805 25.315 43 HB THR 7 HB THR 7 4.701 24.415 22.802 44 HG1 THR 7 1HG THR 7 4.074 24.356 25.558 45 HG21 THR 7 1HG2 THR 7 3.593 22.267 23.285 46 HG22 THR 7 2HG2 THR 7 4.658 22.022 24.667 47 HG23 THR 7 3HG2 THR 7 5.322 22.032 23.034 48 H VAL 8 H VAL 8 7.879 22.516 24.835 49 HA VAL 8 HA VAL 8 9.128 22.784 22.237 50 HB VAL 8 HB VAL 8 10.716 23.211 24.012 51 HG11 VAL 8 1HG1 VAL 8 10.022 20.500 25.134 52 HG12 VAL 8 2HG1 VAL 8 9.649 22.064 25.862 53 HG13 VAL 8 3HG1 VAL 8 11.325 21.546 25.706 54 HG21 VAL 8 1HG2 VAL 8 11.184 20.496 22.786 55 HG22 VAL 8 2HG2 VAL 8 12.426 21.500 23.534 56 HG23 VAL 8 3HG2 VAL 8 11.602 22.057 22.079 57 H ARG 9 H ARG 9 8.305 21.426 20.860 58 HA ARG 9 HA ARG 9 7.524 18.764 21.738 59 HB2 ARG 9 2HB ARG 9 7.315 20.071 19.016 60 HB3 ARG 9 1HB ARG 9 6.695 18.481 19.426 61 HG2 ARG 9 2HG ARG 9 5.097 19.506 20.960 62 HG3 ARG 9 1HG ARG 9 5.750 21.104 20.577 63 HD2 ARG 9 2HD ARG 9 4.468 19.197 18.629 64 HD3 ARG 9 1HD ARG 9 3.721 20.661 19.275 65 HE ARG 9 HE ARG 9 5.978 21.595 18.210 66 HH11 ARG 9 1HH1 ARG 9 3.456 19.528 16.835 67 HH12 ARG 9 2HH1 ARG 9 3.701 20.023 15.228 68 HH21 ARG 9 1HH2 ARG 9 6.328 22.279 16.021 69 HH22 ARG 9 2HH2 ARG 9 5.375 21.658 14.749 70 H PHE 10 H PHE 10 9.503 17.787 22.129 71 HA PHE 10 HA PHE 10 11.315 17.898 19.898 72 HB2 PHE 10 2HB PHE 10 13.093 16.979 21.387 73 HB3 PHE 10 1HB PHE 10 12.464 18.526 21.909 74 HD1 PHE 10 1HD PHE 10 10.840 18.541 23.878 75 HD2 PHE 10 2HD PHE 10 13.145 15.128 22.790 76 HE1 PHE 10 1HE PHE 10 10.537 17.616 26.134 77 HE2 PHE 10 2HE PHE 10 12.836 14.200 25.039 78 HZ PHE 10 HZ PHE 10 11.538 15.439 26.713 79 H ASP 11 H ASP 11 10.486 16.684 18.498 80 HA ASP 11 HA ASP 11 10.803 13.836 18.910 81 HB2 ASP 11 2HB ASP 11 8.387 14.210 19.065 82 HB3 ASP 11 1HB ASP 11 8.419 15.163 17.584 83 H PHE 12 H PHE 12 11.691 12.885 17.142 84 HA PHE 12 HA PHE 12 12.358 14.753 14.978 85 HB2 PHE 12 2HB PHE 12 14.204 12.682 16.188 86 HB3 PHE 12 1HB PHE 12 14.607 13.852 14.935 87 HD1 PHE 12 1HD PHE 12 14.407 13.216 18.449 88 HD2 PHE 12 2HD PHE 12 14.557 16.307 15.543 89 HE1 PHE 12 1HE PHE 12 15.096 14.804 20.191 90 HE2 PHE 12 2HE PHE 12 15.245 17.907 17.274 91 HZ PHE 12 HZ PHE 12 15.512 17.153 19.609 92 H ASP 13 H ASP 13 12.746 13.734 12.946 93 HA ASP 13 HA ASP 13 11.216 11.373 12.478 94 HB2 ASP 13 2HB ASP 13 13.079 12.923 10.661 95 HB3 ASP 13 1HB ASP 13 12.238 11.473 10.147 96 H ASP 14 H ASP 14 12.004 9.778 13.634 97 HA ASP 14 HA ASP 14 14.792 9.067 13.577 98 HB2 ASP 14 2HB ASP 14 13.438 8.784 15.626 99 HB3 ASP 14 1HB ASP 14 12.396 7.651 14.778 100 H ASN 15 H ASN 15 15.404 8.360 11.582 101 HA ASN 15 HA ASN 15 14.124 5.978 10.554 102 HB2 ASN 15 2HB ASN 15 12.698 7.712 9.636 103 HB3 ASN 15 1HB ASN 15 14.094 8.557 8.988 104 HD21 ASN 15 1HD2 ASN 15 13.249 8.476 6.922 105 HD22 ASN 15 2HD2 ASN 15 13.188 7.031 5.980 106 H ARG 16 H ARG 16 15.799 4.728 10.280 107 HA ARG 16 HA ARG 16 17.543 5.262 8.132 108 HB2 ARG 16 2HB ARG 16 19.673 4.717 9.222 109 HB3 ARG 16 1HB ARG 16 18.983 6.076 10.064 110 HG2 ARG 16 2HG ARG 16 18.922 3.218 11.031 111 HG3 ARG 16 1HG ARG 16 20.096 4.430 11.522 112 HD2 ARG 16 2HD ARG 16 18.190 5.799 12.362 113 HD3 ARG 16 1HD ARG 16 17.136 4.426 12.016 114 HE ARG 16 HE ARG 16 19.308 3.583 13.572 115 HH11 ARG 16 1HH1 ARG 16 16.299 5.310 13.764 116 HH12 ARG 16 2HH1 ARG 16 16.093 5.218 15.427 117 HH21 ARG 16 1HH2 ARG 16 19.124 3.397 15.924 118 HH22 ARG 16 2HH2 ARG 16 17.768 4.073 16.711 119 H LYS 17 H LYS 17 18.956 2.919 8.018 120 HA LYS 17 HA LYS 17 18.619 0.675 7.538 121 HB2 LYS 17 2HB LYS 17 18.138 0.465 10.008 122 HB3 LYS 17 1HB LYS 17 16.482 0.946 9.729 123 HG2 LYS 17 2HG LYS 17 16.297 -1.210 8.330 124 HG3 LYS 17 1HG LYS 17 17.827 -1.665 9.088 125 HD2 LYS 17 2HD LYS 17 15.291 -0.930 10.567 126 HD3 LYS 17 1HD LYS 17 15.850 -2.569 10.277 127 HE2 LYS 17 2HE LYS 17 17.815 -2.169 11.653 128 HE3 LYS 17 1HE LYS 17 17.365 -0.476 11.843 129 HZ1 LYS 17 1HZ LYS 17 16.727 -1.969 13.775 130 HZ2 LYS 17 2HZ LYS 17 15.618 -2.705 12.729 131 HZ3 LYS 17 3HZ LYS 17 15.462 -1.088 13.103 132 H LYS 18 H LYS 18 16.561 -0.785 6.663 133 HA LYS 18 HA LYS 18 14.846 1.102 5.372 134 HB2 LYS 18 2HB LYS 18 15.021 -1.892 5.056 135 HB3 LYS 18 1HB LYS 18 13.709 -0.962 4.346 136 HG2 LYS 18 2HG LYS 18 15.401 0.389 3.127 137 HG3 LYS 18 1HG LYS 18 16.650 -0.685 3.753 138 HD2 LYS 18 2HD LYS 18 15.678 -2.561 2.631 139 HD3 LYS 18 1HD LYS 18 14.283 -1.604 2.138 140 HE2 LYS 18 2HE LYS 18 15.814 -0.164 0.811 141 HE3 LYS 18 1HE LYS 18 17.146 -1.231 1.249 142 HZ1 LYS 18 1HZ LYS 18 15.996 -3.048 0.148 143 HZ2 LYS 18 2HZ LYS 18 16.257 -1.782 -0.926 144 HZ3 LYS 18 3HZ LYS 18 14.721 -2.025 -0.270 145 H ALA 19 H ALA 19 13.946 2.009 7.004 146 HA ALA 19 HA ALA 19 12.646 0.738 9.141 147 HB1 ALA 19 1HB ALA 19 13.406 3.046 9.200 148 HB2 ALA 19 2HB ALA 19 11.680 2.879 9.626 149 HB3 ALA 19 3HB ALA 19 12.136 3.417 8.011 150 H ILE 20 H ILE 20 11.553 1.806 6.018 151 HA ILE 20 HA ILE 20 8.800 1.508 6.440 152 HB ILE 20 HB ILE 20 10.426 1.164 3.899 153 HG12 ILE 20 2HG1 ILE 20 8.755 3.465 4.933 154 HG13 ILE 20 1HG1 ILE 20 10.510 3.409 4.881 155 HG21 ILE 20 1HG2 ILE 20 7.466 1.346 4.241 156 HG22 ILE 20 2HG2 ILE 20 8.352 -0.049 3.618 157 HG23 ILE 20 3HG2 ILE 20 8.280 1.454 2.684 158 HD11 ILE 20 1HD1 ILE 20 9.625 4.771 3.091 159 HD12 ILE 20 2HD1 ILE 20 8.649 3.421 2.517 160 HD13 ILE 20 3HD1 ILE 20 10.409 3.338 2.425 161 H SER 21 H SER 21 11.305 -0.750 5.753 162 HA SER 21 HA SER 21 9.540 -2.979 5.240 163 HB2 SER 21 2HB SER 21 12.490 -2.988 5.930 164 HB3 SER 21 1HB SER 21 11.585 -4.325 5.220 165 HG SER 21 HG SER 21 11.110 -2.422 3.568 166 H GLU 22 H GLU 22 11.676 -1.953 7.847 167 HA GLU 22 HA GLU 22 11.244 -3.882 9.784 168 HB2 GLU 22 2HB GLU 22 12.949 -2.048 9.809 169 HB3 GLU 22 1HB GLU 22 11.667 -0.916 10.188 170 HG2 GLU 22 2HG GLU 22 12.819 -1.417 12.203 171 HG3 GLU 22 1HG GLU 22 11.245 -2.207 12.276 172 H THR 23 H THR 23 9.504 -0.841 9.252 173 HA THR 23 HA THR 23 7.765 -1.037 11.433 174 HB THR 23 HB THR 23 7.335 0.454 8.824 175 HG1 THR 23 1HG THR 23 9.228 1.102 9.815 176 HG21 THR 23 1HG2 THR 23 5.279 0.247 10.173 177 HG22 THR 23 2HG2 THR 23 5.871 1.908 10.150 178 HG23 THR 23 3HG2 THR 23 6.135 0.899 11.571 179 H LEU 24 H LEU 24 7.227 -1.872 7.980 180 HA LEU 24 HA LEU 24 4.561 -2.637 8.405 181 HB2 LEU 24 2HB LEU 24 6.418 -3.369 6.151 182 HB3 LEU 24 1HB LEU 24 4.695 -3.695 6.171 183 HG LEU 24 HG LEU 24 5.988 -0.970 6.181 184 HD11 LEU 24 1HD1 LEU 24 4.427 -2.421 4.065 185 HD12 LEU 24 2HD1 LEU 24 6.160 -2.088 4.045 186 HD13 LEU 24 3HD1 LEU 24 5.006 -0.757 3.965 187 HD21 LEU 24 1HD2 LEU 24 3.912 -0.930 7.457 188 HD22 LEU 24 2HD2 LEU 24 3.065 -1.739 6.141 189 HD23 LEU 24 3HD2 LEU 24 3.698 -0.109 5.912 190 H GLU 25 H GLU 25 7.538 -4.529 8.542 191 HA GLU 25 HA GLU 25 6.392 -7.089 8.710 192 HB2 GLU 25 2HB GLU 25 8.828 -6.649 8.514 193 HB3 GLU 25 1HB GLU 25 8.824 -6.014 10.151 194 HG2 GLU 25 2HG GLU 25 8.036 -8.232 10.939 195 HG3 GLU 25 1HG GLU 25 8.256 -8.837 9.299 196 H THR 26 H THR 26 7.176 -4.692 11.138 197 HA THR 26 HA THR 26 6.408 -6.123 13.418 198 HB THR 26 HB THR 26 6.480 -3.115 13.032 199 HG1 THR 26 1HG THR 26 8.486 -3.917 12.454 200 HG21 THR 26 1HG2 THR 26 6.954 -3.068 15.433 201 HG22 THR 26 2HG2 THR 26 6.870 -4.832 15.480 202 HG23 THR 26 3HG2 THR 26 5.423 -3.892 15.112 203 H VAL 27 H VAL 27 4.674 -3.663 11.485 204 HA VAL 27 HA VAL 27 2.291 -3.649 12.992 205 HB VAL 27 HB VAL 27 2.617 -3.027 10.025 206 HG11 VAL 27 1HG1 VAL 27 0.274 -3.363 10.646 207 HG12 VAL 27 2HG1 VAL 27 0.608 -1.658 10.301 208 HG13 VAL 27 3HG1 VAL 27 0.468 -2.205 11.967 209 HG21 VAL 27 1HG2 VAL 27 2.697 -1.162 12.399 210 HG22 VAL 27 2HG2 VAL 27 2.808 -0.693 10.706 211 HG23 VAL 27 3HG2 VAL 27 4.084 -1.663 11.438 212 H TYR 28 H TYR 28 3.376 -5.641 10.317 213 HA TYR 28 HA TYR 28 0.976 -6.993 9.780 214 HB2 TYR 28 2HB TYR 28 2.918 -7.090 8.254 215 HB3 TYR 28 1HB TYR 28 3.835 -7.973 9.465 216 HD1 TYR 28 1HD TYR 28 3.395 -10.319 9.879 217 HD2 TYR 28 2HD TYR 28 1.157 -8.188 6.968 218 HE1 TYR 28 1HE TYR 28 2.554 -12.451 8.975 219 HE2 TYR 28 2HE TYR 28 0.306 -10.323 6.049 220 HH TYR 28 HH TYR 28 0.658 -13.268 7.726 221 H ARG 29 H ARG 29 3.696 -7.835 11.897 222 HA ARG 29 HA ARG 29 2.667 -10.263 12.855 223 HB2 ARG 29 2HB ARG 29 4.555 -8.335 14.203 224 HB3 ARG 29 1HB ARG 29 4.198 -9.944 14.805 225 HG2 ARG 29 2HG ARG 29 5.517 -9.259 12.188 226 HG3 ARG 29 1HG ARG 29 6.304 -9.946 13.609 227 HD2 ARG 29 2HD ARG 29 4.194 -11.247 11.881 228 HD3 ARG 29 1HD ARG 29 5.886 -11.700 12.026 229 HE ARG 29 HE ARG 29 5.067 -11.973 14.548 230 HH11 ARG 29 1HH1 ARG 29 3.660 -13.153 11.508 231 HH12 ARG 29 2HH1 ARG 29 2.910 -14.485 12.217 232 HH21 ARG 29 1HH2 ARG 29 4.037 -13.834 15.513 233 HH22 ARG 29 2HH2 ARG 29 3.135 -14.902 14.543 234 H ALA 30 H ALA 30 2.227 -7.017 14.023 235 HA ALA 30 HA ALA 30 0.930 -7.604 16.439 236 HB1 ALA 30 1HB ALA 30 1.767 -5.369 15.874 237 HB2 ALA 30 2HB ALA 30 0.069 -5.317 16.350 238 HB3 ALA 30 3HB ALA 30 0.510 -5.215 14.647 239 H LEU 31 H LEU 31 -0.382 -7.093 13.216 240 HA LEU 31 HA LEU 31 -3.075 -7.412 14.069 241 HB2 LEU 31 2HB LEU 31 -1.827 -7.265 11.349 242 HB3 LEU 31 1HB LEU 31 -3.565 -7.411 11.599 243 HG LEU 31 HG LEU 31 -1.956 -5.224 12.848 244 HD11 LEU 31 1HD1 LEU 31 -3.562 -5.070 10.300 245 HD12 LEU 31 2HD1 LEU 31 -1.789 -5.057 10.364 246 HD13 LEU 31 3HD1 LEU 31 -2.711 -3.736 11.075 247 HD21 LEU 31 1HD2 LEU 31 -4.144 -4.136 12.966 248 HD22 LEU 31 2HD2 LEU 31 -4.061 -5.639 13.884 249 HD23 LEU 31 3HD2 LEU 31 -4.872 -5.597 12.318 250 H GLU 32 H GLU 32 -0.705 -9.601 12.784 251 HA GLU 32 HA GLU 32 -2.426 -11.796 12.299 252 HB2 GLU 32 2HB GLU 32 0.474 -11.697 13.138 253 HB3 GLU 32 1HB GLU 32 -0.358 -13.175 12.693 254 HG2 GLU 32 2HG GLU 32 -0.100 -10.804 10.877 255 HG3 GLU 32 1HG GLU 32 1.053 -12.134 10.910 256 H GLU 33 H GLU 33 -0.575 -10.820 15.145 257 HA GLU 33 HA GLU 33 -1.492 -12.946 16.772 258 HB2 GLU 33 2HB GLU 33 -0.121 -10.361 17.491 259 HB3 GLU 33 1HB GLU 33 -0.430 -11.668 18.625 260 HG2 GLU 33 2HG GLU 33 1.264 -11.863 16.140 261 HG3 GLU 33 1HG GLU 33 1.862 -11.724 17.791 262 H LYS 34 H LYS 34 -2.767 -9.848 16.040 263 HA LYS 34 HA LYS 34 -4.676 -9.960 18.229 264 HB2 LYS 34 2HB LYS 34 -4.191 -7.986 16.033 265 HB3 LYS 34 1HB LYS 34 -5.620 -7.883 17.048 266 HG2 LYS 34 2HG LYS 34 -2.824 -7.933 18.147 267 HG3 LYS 34 1HG LYS 34 -3.659 -6.443 17.709 268 HD2 LYS 34 2HD LYS 34 -4.776 -8.455 19.680 269 HD3 LYS 34 1HD LYS 34 -3.795 -7.072 20.157 270 HE2 LYS 34 2HE LYS 34 -5.388 -5.564 19.177 271 HE3 LYS 34 1HE LYS 34 -6.398 -6.912 18.628 272 HZ1 LYS 34 1HZ LYS 34 -6.710 -7.499 20.991 273 HZ2 LYS 34 2HZ LYS 34 -7.310 -5.994 20.601 274 HZ3 LYS 34 3HZ LYS 34 -5.873 -6.103 21.460 275 H GLY 35 H GLY 35 -4.488 -11.282 15.177 276 HA2 GLY 35 2HA GLY 35 -6.006 -12.650 14.123 277 HA3 GLY 35 1HA GLY 35 -7.163 -12.292 15.391 278 H TYR 36 H TYR 36 -5.556 -9.973 13.273 279 HA TYR 36 HA TYR 36 -8.179 -9.420 12.062 280 HB2 TYR 36 2HB TYR 36 -5.901 -7.469 12.523 281 HB3 TYR 36 1HB TYR 36 -7.395 -7.091 11.685 282 HD1 TYR 36 1HD TYR 36 -5.708 -6.709 14.654 283 HD2 TYR 36 2HD TYR 36 -9.578 -7.710 13.207 284 HE1 TYR 36 1HE TYR 36 -6.690 -5.991 16.795 285 HE2 TYR 36 2HE TYR 36 -10.571 -6.991 15.334 286 HH TYR 36 HH TYR 36 -9.931 -6.682 17.629 287 H ASN 37 H ASN 37 -7.581 -8.063 9.888 288 HA ASN 37 HA ASN 37 -5.680 -9.765 8.477 289 HB2 ASN 37 2HB ASN 37 -7.920 -8.017 7.429 290 HB3 ASN 37 1HB ASN 37 -6.775 -8.828 6.382 291 HD21 ASN 37 1HD2 ASN 37 -6.849 -11.100 6.236 292 HD22 ASN 37 2HD2 ASN 37 -8.260 -11.974 6.708 293 HA PRO 38 HA PRO 38 -2.795 -6.402 9.282 294 HB2 PRO 38 2HB PRO 38 -1.428 -8.033 7.211 295 HB3 PRO 38 1HB PRO 38 -0.780 -7.292 8.678 296 HG2 PRO 38 2HG PRO 38 -1.368 -9.880 8.592 297 HG3 PRO 38 1HG PRO 38 -1.661 -8.925 10.050 298 HD2 PRO 38 2HD PRO 38 -3.603 -10.043 8.124 299 HD3 PRO 38 1HD PRO 38 -3.782 -9.565 9.837 300 H ILE 39 H ILE 39 -3.540 -7.550 6.024 301 HA ILE 39 HA ILE 39 -2.321 -5.286 4.833 302 HB ILE 39 HB ILE 39 -4.173 -7.308 3.574 303 HG12 ILE 39 2HG1 ILE 39 -2.187 -8.334 4.540 304 HG13 ILE 39 1HG1 ILE 39 -2.112 -8.357 2.784 305 HG21 ILE 39 1HG2 ILE 39 -3.179 -6.555 1.444 306 HG22 ILE 39 2HG2 ILE 39 -2.273 -5.321 2.316 307 HG23 ILE 39 3HG2 ILE 39 -4.034 -5.247 2.262 308 HD11 ILE 39 1HD1 ILE 39 -0.578 -6.435 2.858 309 HD12 ILE 39 2HD1 ILE 39 0.058 -7.820 3.734 310 HD13 ILE 39 3HD1 ILE 39 -0.634 -6.464 4.621 311 H ASN 40 H ASN 40 -5.679 -6.201 5.399 312 HA ASN 40 HA ASN 40 -6.767 -3.991 4.042 313 HB2 ASN 40 2HB ASN 40 -7.992 -5.623 6.261 314 HB3 ASN 40 1HB ASN 40 -8.869 -4.482 5.242 315 HD21 ASN 40 1HD2 ASN 40 -9.152 -4.984 3.015 316 HD22 ASN 40 2HD2 ASN 40 -8.984 -6.605 2.464 317 H GLN 41 H GLN 41 -5.657 -4.362 7.316 318 HA GLN 41 HA GLN 41 -6.659 -1.826 8.174 319 HB2 GLN 41 2HB GLN 41 -4.436 -3.505 9.332 320 HB3 GLN 41 1HB GLN 41 -5.178 -2.126 10.125 321 HG2 GLN 41 2HG GLN 41 -6.591 -4.693 9.393 322 HG3 GLN 41 1HG GLN 41 -6.009 -4.269 10.997 323 HE21 GLN 41 1HE2 GLN 41 -6.850 -1.464 10.774 324 HE22 GLN 41 2HE2 GLN 41 -8.565 -1.479 10.914 325 H ILE 42 H ILE 42 -3.508 -2.998 6.990 326 HA ILE 42 HA ILE 42 -2.160 -0.540 7.251 327 HB ILE 42 HB ILE 42 -1.541 -2.917 5.467 328 HG12 ILE 42 2HG1 ILE 42 -0.283 -1.981 8.060 329 HG13 ILE 42 1HG1 ILE 42 -1.404 -3.324 7.898 330 HG21 ILE 42 1HG2 ILE 42 0.181 -0.497 6.013 331 HG22 ILE 42 2HG2 ILE 42 -0.539 -0.946 4.465 332 HG23 ILE 42 3HG2 ILE 42 0.712 -1.959 5.183 333 HD11 ILE 42 1HD1 ILE 42 0.220 -4.515 6.521 334 HD12 ILE 42 2HD1 ILE 42 0.898 -4.096 8.094 335 HD13 ILE 42 3HD1 ILE 42 1.342 -3.164 6.662 336 H VAL 43 H VAL 43 -3.722 -1.999 4.371 337 HA VAL 43 HA VAL 43 -3.159 0.156 2.672 338 HB VAL 43 HB VAL 43 -3.932 -1.925 1.639 339 HG11 VAL 43 1HG1 VAL 43 -5.420 -2.681 3.410 340 HG12 VAL 43 2HG1 VAL 43 -6.267 -2.701 1.857 341 HG13 VAL 43 3HG1 VAL 43 -6.573 -1.408 3.022 342 HG21 VAL 43 1HG2 VAL 43 -5.997 0.229 1.213 343 HG22 VAL 43 2HG2 VAL 43 -5.697 -1.137 0.138 344 HG23 VAL 43 3HG2 VAL 43 -4.446 0.078 0.388 345 H GLY 44 H GLY 44 -5.776 -0.332 4.941 346 HA2 GLY 44 2HA GLY 44 -7.328 1.914 4.300 347 HA3 GLY 44 1HA GLY 44 -7.265 1.132 5.877 348 H TYR 45 H TYR 45 -4.559 1.544 6.502 349 HA TYR 45 HA TYR 45 -4.640 4.208 7.456 350 HB2 TYR 45 2HB TYR 45 -3.369 2.572 8.746 351 HB3 TYR 45 1HB TYR 45 -2.283 2.296 7.389 352 HD1 TYR 45 1HD TYR 45 -0.419 3.792 6.963 353 HD2 TYR 45 2HD TYR 45 -3.270 4.781 9.959 354 HE1 TYR 45 1HE TYR 45 1.041 5.583 7.744 355 HE2 TYR 45 2HE TYR 45 -1.798 6.588 10.748 356 HH TYR 45 HH TYR 45 0.899 7.627 8.928 357 H LEU 46 H LEU 46 -2.573 2.720 4.988 358 HA LEU 46 HA LEU 46 -1.328 5.159 4.420 359 HB2 LEU 46 2HB LEU 46 -1.400 2.643 2.818 360 HB3 LEU 46 1HB LEU 46 -0.593 4.079 2.217 361 HG LEU 46 HG LEU 46 0.853 3.985 4.301 362 HD11 LEU 46 1HD1 LEU 46 1.028 1.956 5.526 363 HD12 LEU 46 2HD1 LEU 46 -0.233 1.212 4.542 364 HD13 LEU 46 3HD1 LEU 46 -0.633 2.539 5.625 365 HD21 LEU 46 1HD2 LEU 46 1.681 3.281 2.165 366 HD22 LEU 46 2HD2 LEU 46 0.967 1.680 2.379 367 HD23 LEU 46 3HD2 LEU 46 2.271 2.217 3.437 368 H LEU 47 H LEU 47 -4.241 3.833 3.070 369 HA LEU 47 HA LEU 47 -4.227 5.905 1.075 370 HB2 LEU 47 2HB LEU 47 -6.433 3.999 1.825 371 HB3 LEU 47 1HB LEU 47 -6.457 5.089 0.455 372 HG LEU 47 HG LEU 47 -4.668 2.698 0.854 373 HD11 LEU 47 1HD1 LEU 47 -5.776 1.850 -1.137 374 HD12 LEU 47 2HD1 LEU 47 -6.800 3.287 -1.184 375 HD13 LEU 47 3HD1 LEU 47 -6.920 2.160 0.167 376 HD21 LEU 47 1HD2 LEU 47 -3.773 3.213 -1.394 377 HD22 LEU 47 2HD2 LEU 47 -3.360 4.456 -0.207 378 HD23 LEU 47 3HD2 LEU 47 -4.652 4.727 -1.376 379 H SER 48 H SER 48 -4.817 6.050 4.324 380 HA SER 48 HA SER 48 -6.721 8.270 3.896 381 HB2 SER 48 2HB SER 48 -6.766 6.351 6.218 382 HB3 SER 48 1HB SER 48 -7.885 7.691 5.943 383 HG SER 48 HG SER 48 -7.750 5.214 4.783 384 H GLY 49 H GLY 49 -3.822 7.225 5.576 385 HA2 GLY 49 2HA GLY 49 -2.350 8.343 6.905 386 HA3 GLY 49 1HA GLY 49 -3.175 9.837 6.458 387 H ASP 50 H ASP 50 -4.841 7.140 7.945 388 HA ASP 50 HA ASP 50 -5.291 8.874 10.274 389 HB2 ASP 50 2HB ASP 50 -7.279 8.513 8.837 390 HB3 ASP 50 1HB ASP 50 -7.166 6.790 9.151 391 HA PRO 51 HA PRO 51 -3.017 5.689 12.375 392 HB2 PRO 51 2HB PRO 51 -3.509 6.591 14.924 393 HB3 PRO 51 1HB PRO 51 -2.241 7.194 13.857 394 HG2 PRO 51 2HG PRO 51 -4.929 8.354 14.439 395 HG3 PRO 51 1HG PRO 51 -3.382 9.176 14.186 396 HD2 PRO 51 2HD PRO 51 -5.297 9.058 12.293 397 HD3 PRO 51 1HD PRO 51 -3.567 9.086 11.893 398 H ALA 52 H ALA 52 -6.433 6.227 12.973 399 HA ALA 52 HA ALA 52 -6.768 4.220 14.941 400 HB1 ALA 52 1HB ALA 52 -8.840 5.288 13.032 401 HB2 ALA 52 2HB ALA 52 -8.432 5.984 14.605 402 HB3 ALA 52 3HB ALA 52 -9.159 4.379 14.507 403 H TYR 53 H TYR 53 -6.123 3.924 11.670 404 HA TYR 53 HA TYR 53 -7.458 1.473 11.256 405 HB2 TYR 53 2HB TYR 53 -5.338 2.896 9.723 406 HB3 TYR 53 1HB TYR 53 -5.831 1.256 9.284 407 HD1 TYR 53 1HD TYR 53 -8.142 0.788 8.718 408 HD2 TYR 53 2HD TYR 53 -6.762 4.756 9.246 409 HE1 TYR 53 1HE TYR 53 -10.107 1.577 7.595 410 HE2 TYR 53 2HE TYR 53 -8.761 5.611 8.091 411 HH TYR 53 HH TYR 53 -11.447 3.594 7.436 412 H ILE 54 H ILE 54 -4.541 2.246 12.916 413 HA ILE 54 HA ILE 54 -3.881 -0.598 12.900 414 HB ILE 54 HB ILE 54 -2.015 1.683 13.734 415 HG12 ILE 54 2HG1 ILE 54 -2.441 1.768 11.306 416 HG13 ILE 54 1HG1 ILE 54 -0.809 1.205 11.646 417 HG21 ILE 54 1HG2 ILE 54 -0.274 -0.002 13.721 418 HG22 ILE 54 2HG2 ILE 54 -1.461 -1.244 13.336 419 HG23 ILE 54 3HG2 ILE 54 -1.543 -0.396 14.882 420 HD11 ILE 54 1HD1 ILE 54 -3.147 -0.526 10.857 421 HD12 ILE 54 2HD1 ILE 54 -1.513 -1.093 11.204 422 HD13 ILE 54 3HD1 ILE 54 -1.807 -0.042 9.820 423 HA PRO 55 HA PRO 55 -5.662 -0.433 16.999 424 HB2 PRO 55 2HB PRO 55 -5.104 -3.033 17.643 425 HB3 PRO 55 1HB PRO 55 -6.482 -2.551 16.644 426 HG2 PRO 55 2HG PRO 55 -3.808 -3.588 15.836 427 HG3 PRO 55 1HG PRO 55 -5.410 -3.992 15.190 428 HD2 PRO 55 2HD PRO 55 -3.736 -2.306 13.936 429 HD3 PRO 55 1HD PRO 55 -5.497 -2.088 13.877 430 H ARG 56 H ARG 56 -4.944 -0.822 19.165 431 HA ARG 56 HA ARG 56 -2.109 -0.232 19.322 432 HB2 ARG 56 2HB ARG 56 -2.579 0.776 21.617 433 HB3 ARG 56 1HB ARG 56 -3.232 1.648 20.250 434 HG2 ARG 56 2HG ARG 56 -4.897 -0.249 21.911 435 HG3 ARG 56 1HG ARG 56 -4.707 1.455 22.313 436 HD2 ARG 56 2HD ARG 56 -5.699 2.112 20.221 437 HD3 ARG 56 1HD ARG 56 -5.779 0.457 19.653 438 HE ARG 56 HE ARG 56 -7.174 0.585 22.038 439 HH11 ARG 56 1HH1 ARG 56 -7.427 1.997 18.793 440 HH12 ARG 56 2HH1 ARG 56 -9.122 2.077 18.802 441 HH21 ARG 56 1HH2 ARG 56 -9.526 0.711 22.062 442 HH22 ARG 56 2HH2 ARG 56 -10.347 1.329 20.713 443 H TYR 57 H TYR 57 -1.878 -2.455 19.011 444 HA TYR 57 HA TYR 57 -1.994 -4.058 21.465 445 HB2 TYR 57 2HB TYR 57 -2.797 -5.213 19.549 446 HB3 TYR 57 1HB TYR 57 -1.411 -4.730 18.591 447 HD1 TYR 57 1HD TYR 57 -2.340 -6.803 21.554 448 HD2 TYR 57 2HD TYR 57 0.428 -6.159 18.396 449 HE1 TYR 57 1HE TYR 57 -1.223 -8.905 22.116 450 HE2 TYR 57 2HE TYR 57 1.569 -8.247 18.947 451 HH TYR 57 HH TYR 57 1.829 -9.708 20.821 452 H GLN 58 H GLN 58 0.254 -2.540 19.260 453 HA GLN 58 HA GLN 58 2.483 -3.323 20.979 454 HB2 GLN 58 2HB GLN 58 2.138 -4.922 18.991 455 HB3 GLN 58 1HB GLN 58 2.502 -3.542 17.972 456 HG2 GLN 58 2HG GLN 58 4.726 -3.392 19.025 457 HG3 GLN 58 1HG GLN 58 4.321 -4.841 19.955 458 HE21 GLN 58 1HE2 GLN 58 5.997 -6.000 19.039 459 HE22 GLN 58 2HE2 GLN 58 5.923 -6.571 17.415 460 H ASP 59 H ASP 59 4.424 -1.999 20.282 461 HA ASP 59 HA ASP 59 3.870 0.734 20.088 462 HB2 ASP 59 2HB ASP 59 6.316 1.032 19.828 463 HB3 ASP 59 1HB ASP 59 5.912 -0.042 21.155 464 H ALA 60 H ALA 60 3.842 -1.572 17.725 465 HA ALA 60 HA ALA 60 4.772 -0.485 15.389 466 HB1 ALA 60 1HB ALA 60 3.789 -2.731 15.636 467 HB2 ALA 60 2HB ALA 60 3.141 -1.861 14.245 468 HB3 ALA 60 3HB ALA 60 2.191 -2.003 15.724 469 H ARG 61 H ARG 61 1.605 0.235 16.967 470 HA ARG 61 HA ARG 61 0.688 1.908 14.976 471 HB2 ARG 61 2HB ARG 61 -0.817 2.901 16.793 472 HB3 ARG 61 1HB ARG 61 -0.930 1.171 16.550 473 HG2 ARG 61 2HG ARG 61 -1.017 1.584 18.893 474 HG3 ARG 61 1HG ARG 61 0.560 0.882 18.555 475 HD2 ARG 61 2HD ARG 61 1.468 3.221 18.519 476 HD3 ARG 61 1HD ARG 61 -0.106 3.766 19.090 477 HE ARG 61 HE ARG 61 0.861 1.720 20.753 478 HH11 ARG 61 1HH1 ARG 61 1.385 5.152 20.008 479 HH12 ARG 61 2HH1 ARG 61 2.068 5.513 21.506 480 HH21 ARG 61 1HH2 ARG 61 1.858 2.226 22.806 481 HH22 ARG 61 2HH2 ARG 61 2.350 3.829 23.139 482 H ASN 62 H ASN 62 2.979 2.604 17.505 483 HA ASN 62 HA ASN 62 2.999 5.436 17.009 484 HB2 ASN 62 2HB ASN 62 3.669 4.647 19.222 485 HB3 ASN 62 1HB ASN 62 4.939 3.658 18.520 486 HD21 ASN 62 1HD2 ASN 62 6.900 4.646 17.891 487 HD22 ASN 62 2HD2 ASN 62 7.253 6.272 18.317 488 H LEU 63 H LEU 63 4.973 2.672 16.149 489 HA LEU 63 HA LEU 63 7.079 3.904 14.818 490 HB2 LEU 63 2HB LEU 63 5.753 1.284 14.129 491 HB3 LEU 63 1HB LEU 63 7.337 1.788 13.591 492 HG LEU 63 HG LEU 63 6.537 1.189 16.444 493 HD11 LEU 63 1HD1 LEU 63 8.282 -0.334 14.512 494 HD12 LEU 63 2HD1 LEU 63 6.675 -0.810 15.065 495 HD13 LEU 63 3HD1 LEU 63 8.008 -0.738 16.205 496 HD21 LEU 63 1HD2 LEU 63 9.221 1.944 15.275 497 HD22 LEU 63 2HD2 LEU 63 8.940 1.390 16.919 498 HD23 LEU 63 3HD2 LEU 63 8.244 2.917 16.379 499 H ILE 64 H ILE 64 3.957 2.813 13.535 500 HA ILE 64 HA ILE 64 4.580 3.553 10.888 501 HB ILE 64 HB ILE 64 2.903 1.799 11.545 502 HG12 ILE 64 2HG1 ILE 64 1.767 3.957 9.752 503 HG13 ILE 64 1HG1 ILE 64 2.966 2.767 9.255 504 HG21 ILE 64 1HG2 ILE 64 1.142 4.164 12.203 505 HG22 ILE 64 2HG2 ILE 64 1.784 2.990 13.344 506 HG23 ILE 64 3HG2 ILE 64 0.617 2.484 12.127 507 HD11 ILE 64 1HD1 ILE 64 1.345 0.976 9.731 508 HD12 ILE 64 2HD1 ILE 64 0.757 2.108 8.508 509 HD13 ILE 64 3HD1 ILE 64 0.154 2.195 10.164 510 H ARG 65 H ARG 65 3.195 5.300 13.586 511 HA ARG 65 HA ARG 65 2.177 7.470 12.008 512 HB2 ARG 65 2HB ARG 65 2.670 7.270 14.975 513 HB3 ARG 65 1HB ARG 65 1.986 8.684 14.199 514 HG2 ARG 65 2HG ARG 65 0.095 7.318 13.431 515 HG3 ARG 65 1HG ARG 65 0.790 5.926 14.268 516 HD2 ARG 65 2HD ARG 65 -0.937 6.998 15.639 517 HD3 ARG 65 1HD ARG 65 0.650 7.118 16.396 518 HE ARG 65 HE ARG 65 0.039 9.369 14.763 519 HH11 ARG 65 1HH1 ARG 65 -0.584 8.011 17.976 520 HH12 ARG 65 2HH1 ARG 65 -0.785 9.507 18.748 521 HH21 ARG 65 1HH2 ARG 65 -0.213 11.450 15.813 522 HH22 ARG 65 2HH2 ARG 65 -0.552 11.549 17.467 523 H ARG 66 H ARG 66 5.266 6.627 13.100 524 HA ARG 66 HA ARG 66 6.293 9.321 13.076 525 HB2 ARG 66 2HB ARG 66 7.493 6.641 13.533 526 HB3 ARG 66 1HB ARG 66 8.567 7.898 12.952 527 HG2 ARG 66 2HG ARG 66 8.581 7.604 15.436 528 HG3 ARG 66 1HG ARG 66 8.201 9.233 14.914 529 HD2 ARG 66 2HD ARG 66 6.115 7.203 15.758 530 HD3 ARG 66 1HD ARG 66 6.858 8.345 16.870 531 HE ARG 66 HE ARG 66 5.720 9.650 14.602 532 HH11 ARG 66 1HH1 ARG 66 4.798 8.272 17.757 533 HH12 ARG 66 2HH1 ARG 66 3.424 9.261 17.899 534 HH21 ARG 66 1HH2 ARG 66 3.816 10.915 14.804 535 HH22 ARG 66 2HH2 ARG 66 2.836 10.782 16.201 536 H HIS 67 H HIS 67 5.218 7.466 10.768 537 HA HIS 67 HA HIS 67 6.748 8.947 8.763 538 HB2 HIS 67 2HB HIS 67 5.348 6.253 8.447 539 HB3 HIS 67 1HB HIS 67 6.162 7.125 7.155 540 HD1 HIS 67 1HD HIS 67 8.707 6.686 6.878 541 HD2 HIS 67 2HD HIS 67 7.120 5.147 10.426 542 HE1 HIS 67 1HE HIS 67 10.505 5.327 7.889 543 HE2 HIS 67 2HE HIS 67 9.611 4.613 10.135 544 H GLU 68 H GLU 68 5.250 9.725 7.046 545 HA GLU 68 HA GLU 68 2.816 10.464 8.385 546 HB2 GLU 68 2HB GLU 68 3.819 11.355 5.684 547 HB3 GLU 68 1HB GLU 68 2.415 11.987 6.514 548 HG2 GLU 68 2HG GLU 68 3.777 12.835 8.296 549 HG3 GLU 68 1HG GLU 68 5.220 12.116 7.577 550 H ARG 69 H ARG 69 3.290 9.331 5.030 551 HA ARG 69 HA ARG 69 1.248 7.340 5.223 552 HB2 ARG 69 2HB ARG 69 -0.208 9.248 5.417 553 HB3 ARG 69 1HB ARG 69 0.492 10.030 4.031 554 HG2 ARG 69 2HG ARG 69 -0.370 8.110 2.662 555 HG3 ARG 69 1HG ARG 69 -1.256 7.604 4.106 556 HD2 ARG 69 2HD ARG 69 -2.653 8.990 2.641 557 HD3 ARG 69 1HD ARG 69 -2.377 9.775 4.198 558 HE ARG 69 HE ARG 69 -0.407 10.563 2.303 559 HH11 ARG 69 1HH1 ARG 69 -3.828 11.209 3.044 560 HH12 ARG 69 2HH1 ARG 69 -3.765 12.790 2.473 561 HH21 ARG 69 1HH2 ARG 69 -0.326 12.592 1.540 562 HH22 ARG 69 2HH2 ARG 69 -1.680 13.646 1.552 563 H ASP 70 H ASP 70 2.213 9.763 2.829 564 HA ASP 70 HA ASP 70 1.987 8.220 0.537 565 HB2 ASP 70 2HB ASP 70 3.666 10.680 1.029 566 HB3 ASP 70 1HB ASP 70 3.233 10.044 -0.551 567 H GLU 71 H GLU 71 4.774 8.866 2.530 568 HA GLU 71 HA GLU 71 6.912 8.139 0.941 569 HB2 GLU 71 2HB GLU 71 7.132 9.185 3.097 570 HB3 GLU 71 1HB GLU 71 6.523 7.736 3.892 571 HG2 GLU 71 2HG GLU 71 8.488 6.523 3.018 572 HG3 GLU 71 1HG GLU 71 9.107 8.060 2.407 573 H ILE 72 H ILE 72 5.177 6.074 3.218 574 HA ILE 72 HA ILE 72 6.674 3.728 2.768 575 HB ILE 72 HB ILE 72 3.865 4.070 3.812 576 HG12 ILE 72 2HG1 ILE 72 6.483 3.791 5.303 577 HG13 ILE 72 1HG1 ILE 72 5.552 5.274 5.129 578 HG21 ILE 72 1HG2 ILE 72 4.227 1.762 3.089 579 HG22 ILE 72 2HG2 ILE 72 4.125 1.851 4.847 580 HG23 ILE 72 3HG2 ILE 72 5.685 1.670 4.058 581 HD11 ILE 72 1HD1 ILE 72 4.665 2.781 6.567 582 HD12 ILE 72 2HD1 ILE 72 3.722 4.259 6.387 583 HD13 ILE 72 3HD1 ILE 72 5.222 4.278 7.320 584 H MET 73 H MET 73 3.812 5.064 1.320 585 HA MET 73 HA MET 73 3.000 2.672 0.036 586 HB2 MET 73 2HB MET 73 1.570 4.731 0.688 587 HB3 MET 73 1HB MET 73 2.170 5.445 -0.795 588 HG2 MET 73 2HG MET 73 0.687 2.843 -0.647 589 HG3 MET 73 1HG MET 73 -0.072 4.384 -0.986 590 HE1 MET 73 1HE MET 73 -0.140 2.396 -4.317 591 HE2 MET 73 2HE MET 73 -1.114 3.147 -3.051 592 HE3 MET 73 3HE MET 73 -0.167 1.686 -2.708 593 H GLU 74 H GLU 74 4.897 5.488 -0.988 594 HA GLU 74 HA GLU 74 5.143 4.942 -3.736 595 HB2 GLU 74 2HB GLU 74 7.325 5.977 -1.937 596 HB3 GLU 74 1HB GLU 74 7.257 6.127 -3.676 597 HG2 GLU 74 2HG GLU 74 5.280 7.562 -3.434 598 HG3 GLU 74 1HG GLU 74 5.455 7.445 -1.677 599 H GLU 75 H GLU 75 6.900 3.768 -0.967 600 HA GLU 75 HA GLU 75 8.964 2.430 -2.331 601 HB2 GLU 75 2HB GLU 75 8.830 3.136 0.118 602 HB3 GLU 75 1HB GLU 75 7.868 1.685 0.365 603 HG2 GLU 75 2HG GLU 75 10.166 1.289 0.953 604 HG3 GLU 75 1HG GLU 75 9.731 0.333 -0.469 605 H LEU 76 H LEU 76 5.802 1.447 -1.137 606 HA LEU 76 HA LEU 76 5.952 -1.315 -1.659 607 HB2 LEU 76 2HB LEU 76 3.521 0.472 -1.818 608 HB3 LEU 76 1HB LEU 76 3.503 -1.271 -1.670 609 HG LEU 76 HG LEU 76 4.455 0.680 0.426 610 HD11 LEU 76 1HD1 LEU 76 2.500 -0.070 1.668 611 HD12 LEU 76 2HD1 LEU 76 2.014 -1.071 0.302 612 HD13 LEU 76 3HD1 LEU 76 2.044 0.681 0.139 613 HD21 LEU 76 1HD2 LEU 76 4.219 -2.322 0.510 614 HD22 LEU 76 2HD2 LEU 76 4.601 -1.285 1.882 615 HD23 LEU 76 3HD2 LEU 76 5.721 -1.397 0.525 616 H THR 77 H THR 77 4.684 1.395 -3.628 617 HA THR 77 HA THR 77 3.955 -0.100 -5.839 618 HB THR 77 HB THR 77 4.860 2.796 -5.714 619 HG1 THR 77 1HG THR 77 3.106 2.702 -4.353 620 HG21 THR 77 1HG2 THR 77 4.695 1.920 -8.019 621 HG22 THR 77 2HG2 THR 77 3.413 3.083 -7.686 622 HG23 THR 77 3HG2 THR 77 3.059 1.356 -7.683 623 H LYS 78 H LYS 78 7.058 1.404 -4.990 624 HA LYS 78 HA LYS 78 8.221 0.900 -7.532 625 HB2 LYS 78 2HB LYS 78 9.557 1.528 -4.931 626 HB3 LYS 78 1HB LYS 78 10.407 1.398 -6.463 627 HG2 LYS 78 2HG LYS 78 8.865 3.191 -7.283 628 HG3 LYS 78 1HG LYS 78 8.382 3.426 -5.610 629 HD2 LYS 78 2HD LYS 78 11.193 3.706 -6.712 630 HD3 LYS 78 1HD LYS 78 10.131 5.026 -6.262 631 HE2 LYS 78 2HE LYS 78 11.680 4.784 -4.513 632 HE3 LYS 78 1HE LYS 78 10.160 4.101 -3.926 633 HZ1 LYS 78 1HZ LYS 78 12.607 2.580 -4.785 634 HZ2 LYS 78 2HZ LYS 78 11.155 1.823 -4.412 635 HZ3 LYS 78 3HZ LYS 78 11.932 2.643 -3.248 636 H TYR 79 H TYR 79 8.636 -0.740 -4.421 637 HA TYR 79 HA TYR 79 10.615 -2.513 -5.319 638 HB2 TYR 79 2HB TYR 79 9.985 -2.027 -2.921 639 HB3 TYR 79 1HB TYR 79 8.605 -3.092 -3.160 640 HD1 TYR 79 1HD TYR 79 12.189 -2.893 -2.697 641 HD2 TYR 79 2HD TYR 79 8.949 -5.517 -3.445 642 HE1 TYR 79 1HE TYR 79 13.623 -4.799 -2.098 643 HE2 TYR 79 2HE TYR 79 10.369 -7.454 -2.842 644 HH TYR 79 HH TYR 79 13.367 -7.071 -1.296 645 H TYR 80 H TYR 80 7.160 -2.664 -5.457 646 HA TYR 80 HA TYR 80 6.691 -5.316 -6.168 647 HB2 TYR 80 2HB TYR 80 4.970 -3.655 -5.593 648 HB3 TYR 80 1HB TYR 80 5.306 -2.790 -7.079 649 HD1 TYR 80 1HD TYR 80 3.868 -5.837 -5.646 650 HD2 TYR 80 2HD TYR 80 4.333 -3.510 -9.161 651 HE1 TYR 80 1HE TYR 80 2.105 -7.143 -6.727 652 HE2 TYR 80 2HE TYR 80 2.568 -4.814 -10.265 653 HH TYR 80 HH TYR 80 0.526 -6.886 -8.506 654 H LEU 81 H LEU 81 7.296 -2.475 -8.190 655 HA LEU 81 HA LEU 81 7.313 -3.934 -10.634 656 HB2 LEU 81 2HB LEU 81 8.260 -1.163 -9.986 657 HB3 LEU 81 1HB LEU 81 8.091 -1.795 -11.615 658 HG LEU 81 HG LEU 81 5.832 -1.359 -9.648 659 HD11 LEU 81 1HD1 LEU 81 5.143 0.411 -11.179 660 HD12 LEU 81 2HD1 LEU 81 6.587 0.139 -12.150 661 HD13 LEU 81 3HD1 LEU 81 6.736 0.727 -10.494 662 HD21 LEU 81 1HD2 LEU 81 4.369 -1.858 -11.549 663 HD22 LEU 81 2HD2 LEU 81 5.373 -3.242 -11.125 664 HD23 LEU 81 3HD2 LEU 81 5.778 -2.255 -12.531 665 H ALA 82 H ALA 82 9.751 -2.922 -8.328 666 HA ALA 82 HA ALA 82 12.001 -3.304 -9.985 667 HB1 ALA 82 1HB ALA 82 12.097 -2.057 -7.873 668 HB2 ALA 82 2HB ALA 82 13.295 -3.351 -7.926 669 HB3 ALA 82 3HB ALA 82 11.818 -3.557 -6.982 670 H ASN 83 H ASN 83 10.392 -5.525 -7.598 671 HA ASN 83 HA ASN 83 11.913 -7.700 -7.934 672 HB2 ASN 83 2HB ASN 83 10.173 -7.013 -6.267 673 HB3 ASN 83 1HB ASN 83 8.982 -7.480 -7.478 674 HD21 ASN 83 1HD2 ASN 83 11.561 -8.487 -5.495 675 HD22 ASN 83 2HD2 ASN 83 11.106 -10.134 -5.522 676 H HIS 84 H HIS 84 9.469 -6.283 -9.937 677 HA HIS 84 HA HIS 84 8.972 -8.664 -11.472 678 HB2 HIS 84 2HB HIS 84 7.160 -7.043 -11.080 679 HB3 HIS 84 1HB HIS 84 8.077 -5.793 -11.902 680 HD1 HIS 84 1HD HIS 84 6.096 -8.946 -12.585 681 HD2 HIS 84 2HD HIS 84 7.801 -5.770 -14.666 682 HE1 HIS 84 1HE HIS 84 5.254 -9.136 -14.927 683 HE2 HIS 84 2HE HIS 84 6.177 -7.096 -16.118 684 H GLY 85 H GLY 85 11.496 -6.507 -11.399 685 HA2 GLY 85 2HA GLY 85 13.397 -6.944 -12.798 686 HA3 GLY 85 1HA GLY 85 12.291 -7.357 -14.096 687 H ILE 86 H ILE 86 11.220 -4.614 -12.495 688 HA ILE 86 HA ILE 86 12.258 -2.991 -14.680 689 HB ILE 86 HB ILE 86 9.922 -2.546 -12.811 690 HG12 ILE 86 2HG1 ILE 86 10.019 -3.147 -15.771 691 HG13 ILE 86 1HG1 ILE 86 9.511 -4.259 -14.504 692 HG21 ILE 86 1HG2 ILE 86 9.374 -0.571 -14.185 693 HG22 ILE 86 2HG2 ILE 86 10.881 -0.785 -15.076 694 HG23 ILE 86 3HG2 ILE 86 10.919 -0.390 -13.358 695 HD11 ILE 86 1HD1 ILE 86 8.178 -1.686 -15.239 696 HD12 ILE 86 2HD1 ILE 86 7.630 -2.809 -13.994 697 HD13 ILE 86 3HD1 ILE 86 7.621 -3.306 -15.696 698 H ASP 87 H ASP 87 13.681 -1.462 -14.261 699 HA ASP 87 HA ASP 87 14.269 -0.872 -11.447 700 HB2 ASP 87 2HB ASP 87 16.275 0.289 -12.144 701 HB3 ASP 87 1HB ASP 87 16.227 -1.207 -13.055 702 H ILE 88 H ILE 88 14.129 1.270 -10.685 703 HA ILE 88 HA ILE 88 12.278 2.834 -12.320 704 HB ILE 88 HB ILE 88 12.321 2.463 -9.333 705 HG12 ILE 88 2HG1 ILE 88 10.313 1.708 -11.454 706 HG13 ILE 88 1HG1 ILE 88 11.402 0.608 -10.622 707 HG21 ILE 88 1HG2 ILE 88 10.348 3.896 -9.232 708 HG22 ILE 88 2HG2 ILE 88 10.463 4.193 -10.970 709 HG23 ILE 88 3HG2 ILE 88 11.725 4.795 -9.880 710 HD11 ILE 88 1HD1 ILE 88 9.283 2.243 -9.316 711 HD12 ILE 88 2HD1 ILE 88 10.275 1.009 -8.561 712 HD13 ILE 88 3HD1 ILE 88 9.089 0.563 -9.805 713 H LYS 89 H LYS 89 12.575 4.879 -12.527 714 HA LYS 89 HA LYS 89 15.189 5.965 -12.358 715 HB2 LYS 89 2HB LYS 89 12.595 7.477 -12.744 716 HB3 LYS 89 1HB LYS 89 14.201 8.079 -13.100 717 HG2 LYS 89 2HG LYS 89 12.828 5.782 -14.501 718 HG3 LYS 89 1HG LYS 89 12.998 7.417 -15.126 719 HD2 LYS 89 2HD LYS 89 15.457 7.138 -15.107 720 HD3 LYS 89 1HD LYS 89 15.249 5.485 -14.528 721 HE2 LYS 89 2HE LYS 89 13.924 4.985 -16.598 722 HE3 LYS 89 1HE LYS 89 14.271 6.617 -17.149 723 HZ1 LYS 89 1HZ LYS 89 16.306 4.536 -16.599 724 HZ2 LYS 89 2HZ LYS 89 16.620 6.093 -17.166 725 HZ3 LYS 89 3HZ LYS 89 15.797 5.008 -18.131 726 H1 MET 1 H MET 1 -23.070 3.754 27.255 727 HA MET 1 HA MET 1 -21.290 2.824 28.489 728 HB2 MET 1 2HB MET 1 -21.621 0.514 26.566 729 HB3 MET 1 1HB MET 1 -20.217 0.694 27.601 730 HG2 MET 1 2HG MET 1 -21.774 -0.885 28.557 731 HG3 MET 1 1HG MET 1 -21.657 0.535 29.579 732 HE1 MET 1 1HE MET 1 -23.931 -1.635 29.920 733 HE2 MET 1 2HE MET 1 -25.354 -0.613 30.130 734 HE3 MET 1 3HE MET 1 -23.832 -0.174 30.903 735 H GLY 2 H GLY 2 -21.816 3.169 25.130 736 HA2 GLY 2 2HA GLY 2 -19.976 5.079 24.643 737 HA3 GLY 2 1HA GLY 2 -19.071 3.583 24.437 738 H PHE 3 H PHE 3 -18.818 4.140 22.244 739 HA PHE 3 HA PHE 3 -21.235 3.913 20.614 740 HB2 PHE 3 2HB PHE 3 -18.484 4.954 19.929 741 HB3 PHE 3 1HB PHE 3 -19.780 4.749 18.762 742 HD1 PHE 3 1HD PHE 3 -21.676 6.223 18.742 743 HD2 PHE 3 2HD PHE 3 -18.551 6.721 21.583 744 HE1 PHE 3 1HE PHE 3 -22.512 8.468 19.263 745 HE2 PHE 3 2HE PHE 3 -19.386 8.968 22.108 746 HZ PHE 3 HZ PHE 3 -21.369 9.844 20.947 747 H THR 4 H THR 4 -21.428 2.343 19.080 748 HA THR 4 HA THR 4 -19.410 0.223 19.193 749 HB THR 4 HB THR 4 -22.292 0.032 18.287 750 HG1 THR 4 1HG THR 4 -21.129 -0.524 20.848 751 HG21 THR 4 1HG2 THR 4 -21.927 -2.391 18.624 752 HG22 THR 4 2HG2 THR 4 -20.259 -2.060 19.079 753 HG23 THR 4 3HG2 THR 4 -20.808 -1.721 17.437 754 H ASP 5 H ASP 5 -18.157 0.209 17.381 755 HA ASP 5 HA ASP 5 -19.229 1.423 14.968 756 HB2 ASP 5 2HB ASP 5 -16.418 0.418 15.509 757 HB3 ASP 5 1HB ASP 5 -16.946 1.150 14.001 758 H GLU 6 H GLU 6 -20.743 -0.103 14.541 759 HA GLU 6 HA GLU 6 -19.806 -2.747 13.837 760 HB2 GLU 6 2HB GLU 6 -22.267 -3.232 13.504 761 HB3 GLU 6 1HB GLU 6 -21.793 -2.808 15.140 762 HG2 GLU 6 2HG GLU 6 -22.634 -0.536 14.796 763 HG3 GLU 6 1HG GLU 6 -23.094 -0.959 13.150 764 H THR 7 H THR 7 -18.863 -2.837 11.973 765 HA THR 7 HA THR 7 -20.186 -1.624 9.673 766 HB THR 7 HB THR 7 -17.873 -1.290 8.728 767 HG1 THR 7 1HG THR 7 -17.138 -2.753 10.688 768 HG21 THR 7 1HG2 THR 7 -18.478 0.192 11.305 769 HG22 THR 7 2HG2 THR 7 -19.110 0.604 9.714 770 HG23 THR 7 3HG2 THR 7 -17.382 0.747 10.041 771 H VAL 8 H VAL 8 -20.802 -3.230 8.297 772 HA VAL 8 HA VAL 8 -19.428 -5.743 8.419 773 HB VAL 8 HB VAL 8 -21.860 -5.862 8.099 774 HG11 VAL 8 1HG1 VAL 8 -22.977 -5.147 6.052 775 HG12 VAL 8 2HG1 VAL 8 -21.474 -4.415 5.494 776 HG13 VAL 8 3HG1 VAL 8 -22.280 -3.790 6.935 777 HG21 VAL 8 1HG2 VAL 8 -20.569 -7.683 7.155 778 HG22 VAL 8 2HG2 VAL 8 -20.391 -6.799 5.639 779 HG23 VAL 8 3HG2 VAL 8 -21.983 -7.365 6.147 780 H ARG 9 H ARG 9 -17.520 -5.703 7.733 781 HA ARG 9 HA ARG 9 -16.752 -4.023 5.529 782 HB2 ARG 9 2HB ARG 9 -15.073 -5.691 7.392 783 HB3 ARG 9 1HB ARG 9 -14.446 -4.580 6.181 784 HG2 ARG 9 2HG ARG 9 -15.585 -2.720 7.312 785 HG3 ARG 9 1HG ARG 9 -16.163 -3.842 8.539 786 HD2 ARG 9 2HD ARG 9 -13.275 -3.244 7.927 787 HD3 ARG 9 1HD ARG 9 -14.191 -2.566 9.265 788 HE ARG 9 HE ARG 9 -14.312 -5.358 9.420 789 HH11 ARG 9 1HH1 ARG 9 -11.877 -2.797 9.676 790 HH12 ARG 9 2HH1 ARG 9 -10.939 -3.617 10.839 791 HH21 ARG 9 1HH2 ARG 9 -13.018 -6.467 10.996 792 HH22 ARG 9 2HH2 ARG 9 -11.614 -5.722 11.629 793 H PHE 10 H PHE 10 -16.935 -4.727 3.619 794 HA PHE 10 HA PHE 10 -16.580 -7.563 2.991 795 HB2 PHE 10 2HB PHE 10 -17.668 -6.967 0.818 796 HB3 PHE 10 1HB PHE 10 -18.680 -6.610 2.209 797 HD1 PHE 10 1HD PHE 10 -19.148 -4.292 2.834 798 HD2 PHE 10 2HD PHE 10 -16.790 -5.211 -0.588 799 HE1 PHE 10 1HE PHE 10 -19.429 -1.988 2.022 800 HE2 PHE 10 2HE PHE 10 -17.067 -2.906 -1.399 801 HZ PHE 10 HZ PHE 10 -18.391 -1.295 -0.087 802 H ASP 11 H ASP 11 -14.471 -5.521 3.534 803 HA ASP 11 HA ASP 11 -13.123 -4.935 1.083 804 HB2 ASP 11 2HB ASP 11 -11.998 -5.008 3.894 805 HB3 ASP 11 1HB ASP 11 -11.199 -4.315 2.500 806 H PHE 12 H PHE 12 -12.765 -6.775 -0.075 807 HA PHE 12 HA PHE 12 -10.691 -8.549 0.939 808 HB2 PHE 12 2HB PHE 12 -13.264 -9.552 -0.338 809 HB3 PHE 12 1HB PHE 12 -11.860 -10.547 -0.001 810 HD1 PHE 12 1HD PHE 12 -14.912 -9.166 1.276 811 HD2 PHE 12 2HD PHE 12 -11.203 -10.899 2.422 812 HE1 PHE 12 1HE PHE 12 -15.840 -9.671 3.494 813 HE2 PHE 12 2HE PHE 12 -12.130 -11.412 4.643 814 HZ PHE 12 HZ PHE 12 -14.449 -10.794 5.182 815 H ASP 13 H ASP 13 -9.149 -8.722 -0.614 816 HA ASP 13 HA ASP 13 -9.782 -7.678 -3.241 817 HB2 ASP 13 2HB ASP 13 -7.440 -7.710 -3.751 818 HB3 ASP 13 1HB ASP 13 -7.562 -7.162 -2.090 819 H ASP 14 H ASP 14 -9.894 -8.831 -5.090 820 HA ASP 14 HA ASP 14 -9.242 -11.648 -5.137 821 HB2 ASP 14 2HB ASP 14 -11.583 -11.672 -4.325 822 HB3 ASP 14 1HB ASP 14 -12.068 -10.696 -5.708 823 H ASN 15 H ASN 15 -7.943 -11.589 -6.822 824 HA ASN 15 HA ASN 15 -9.068 -10.852 -9.359 825 HB2 ASN 15 2HB ASN 15 -7.905 -8.751 -8.602 826 HB3 ASN 15 1HB ASN 15 -6.411 -9.669 -8.464 827 HD21 ASN 15 1HD2 ASN 15 -8.764 -8.362 -10.644 828 HD22 ASN 15 2HD2 ASN 15 -7.814 -8.479 -12.088 829 H ARG 16 H ARG 16 -8.959 -12.790 -10.122 830 HA ARG 16 HA ARG 16 -6.665 -14.349 -9.471 831 HB2 ARG 16 2HB ARG 16 -7.892 -16.331 -10.337 832 HB3 ARG 16 1HB ARG 16 -8.644 -15.528 -8.984 833 HG2 ARG 16 2HG ARG 16 -9.546 -15.349 -11.872 834 HG3 ARG 16 1HG ARG 16 -10.257 -16.396 -10.655 835 HD2 ARG 16 2HD ARG 16 -11.769 -14.623 -10.664 836 HD3 ARG 16 1HD ARG 16 -10.665 -14.093 -9.403 837 HE ARG 16 HE ARG 16 -9.970 -13.163 -12.025 838 HH11 ARG 16 1HH1 ARG 16 -11.811 -12.296 -9.030 839 HH12 ARG 16 2HH1 ARG 16 -12.093 -10.726 -9.535 840 HH21 ARG 16 1HH2 ARG 16 -10.375 -10.988 -12.640 841 HH22 ARG 16 2HH2 ARG 16 -11.261 -9.932 -11.630 842 H LYS 17 H LYS 17 -5.243 -13.217 -10.613 843 HA LYS 17 HA LYS 17 -4.047 -14.433 -12.725 844 HB2 LYS 17 2HB LYS 17 -5.980 -13.661 -14.154 845 HB3 LYS 17 1HB LYS 17 -5.659 -12.007 -13.664 846 HG2 LYS 17 2HG LYS 17 -3.442 -12.143 -14.757 847 HG3 LYS 17 1HG LYS 17 -3.836 -13.778 -15.281 848 HD2 LYS 17 2HD LYS 17 -5.396 -11.307 -16.039 849 HD3 LYS 17 1HD LYS 17 -4.157 -12.059 -17.038 850 HE2 LYS 17 2HE LYS 17 -5.494 -14.117 -17.102 851 HE3 LYS 17 1HE LYS 17 -6.740 -13.335 -16.127 852 HZ1 LYS 17 1HZ LYS 17 -7.028 -11.717 -17.890 853 HZ2 LYS 17 2HZ LYS 17 -7.270 -13.273 -18.480 854 HZ3 LYS 17 3HZ LYS 17 -5.821 -12.457 -18.800 855 H LYS 18 H LYS 18 -2.088 -13.147 -13.282 856 HA LYS 18 HA LYS 18 -1.468 -11.096 -11.331 857 HB2 LYS 18 2HB LYS 18 0.151 -12.267 -13.607 858 HB3 LYS 18 1HB LYS 18 0.746 -10.980 -12.576 859 HG2 LYS 18 2HG LYS 18 0.471 -12.499 -10.628 860 HG3 LYS 18 1HG LYS 18 0.046 -13.790 -11.761 861 HD2 LYS 18 2HD LYS 18 2.205 -13.600 -12.847 862 HD3 LYS 18 1HD LYS 18 2.626 -12.226 -11.828 863 HE2 LYS 18 2HE LYS 18 2.491 -13.669 -9.848 864 HE3 LYS 18 1HE LYS 18 2.107 -15.043 -10.883 865 HZ1 LYS 18 1HZ LYS 18 4.271 -14.734 -11.966 866 HZ2 LYS 18 2HZ LYS 18 4.432 -15.039 -10.310 867 HZ3 LYS 18 3HZ LYS 18 4.647 -13.480 -10.926 868 H ALA 19 H ALA 19 -3.570 -10.373 -12.861 869 HA ALA 19 HA ALA 19 -2.994 -8.879 -15.183 870 HB1 ALA 19 1HB ALA 19 -5.178 -7.951 -14.907 871 HB2 ALA 19 2HB ALA 19 -5.242 -8.614 -13.273 872 HB3 ALA 19 3HB ALA 19 -5.194 -9.719 -14.674 873 H ILE 20 H ILE 20 -3.133 -8.052 -11.764 874 HA ILE 20 HA ILE 20 -3.024 -5.245 -12.150 875 HB ILE 20 HB ILE 20 -2.116 -6.887 -9.749 876 HG12 ILE 20 2HG1 ILE 20 -4.721 -5.450 -10.296 877 HG13 ILE 20 1HG1 ILE 20 -4.497 -7.192 -10.304 878 HG21 ILE 20 1HG2 ILE 20 -1.106 -4.666 -9.725 879 HG22 ILE 20 2HG2 ILE 20 -2.333 -4.803 -8.466 880 HG23 ILE 20 3HG2 ILE 20 -2.692 -3.929 -9.955 881 HD11 ILE 20 1HD1 ILE 20 -5.545 -6.535 -8.280 882 HD12 ILE 20 2HD1 ILE 20 -4.278 -5.349 -7.933 883 HD13 ILE 20 3HD1 ILE 20 -3.918 -7.080 -7.908 884 H SER 21 H SER 21 -0.730 -7.790 -12.025 885 HA SER 21 HA SER 21 1.619 -6.182 -11.742 886 HB2 SER 21 2HB SER 21 1.344 -8.953 -12.923 887 HB3 SER 21 1HB SER 21 2.827 -8.208 -12.323 888 HG SER 21 HG SER 21 1.348 -7.977 -10.315 889 H GLU 22 H GLU 22 -0.037 -7.744 -14.429 890 HA GLU 22 HA GLU 22 1.598 -6.904 -16.536 891 HB2 GLU 22 2HB GLU 22 -0.127 -8.714 -16.586 892 HB3 GLU 22 1HB GLU 22 -1.371 -7.480 -16.535 893 HG2 GLU 22 2HG GLU 22 -1.107 -8.293 -18.753 894 HG3 GLU 22 1HG GLU 22 -0.576 -6.613 -18.680 895 H THR 23 H THR 23 -1.362 -5.539 -15.168 896 HA THR 23 HA THR 23 -1.655 -3.368 -16.889 897 HB THR 23 HB THR 23 -2.536 -3.616 -13.999 898 HG1 THR 23 1HG THR 23 -3.395 -5.219 -15.367 899 HG21 THR 23 1HG2 THR 23 -4.228 -1.915 -14.579 900 HG22 THR 23 2HG2 THR 23 -3.505 -1.747 -16.178 901 HG23 THR 23 3HG2 THR 23 -2.592 -1.273 -14.742 902 H LEU 24 H LEU 24 -0.040 -3.486 -13.673 903 HA LEU 24 HA LEU 24 0.631 -0.758 -13.733 904 HB2 LEU 24 2HB LEU 24 1.881 -2.976 -12.105 905 HB3 LEU 24 1HB LEU 24 2.220 -1.270 -11.894 906 HG LEU 24 HG LEU 24 -0.446 -2.613 -11.456 907 HD11 LEU 24 1HD1 LEU 24 1.163 -3.151 -9.736 908 HD12 LEU 24 2HD1 LEU 24 -0.073 -2.055 -9.117 909 HD13 LEU 24 3HD1 LEU 24 1.528 -1.435 -9.517 910 HD21 LEU 24 1HD2 LEU 24 -0.757 -0.327 -12.274 911 HD22 LEU 24 2HD2 LEU 24 0.370 0.271 -11.059 912 HD23 LEU 24 3HD2 LEU 24 -1.163 -0.440 -10.563 913 H GLU 25 H GLU 25 2.252 -3.526 -15.084 914 HA GLU 25 HA GLU 25 4.746 -2.303 -15.572 915 HB2 GLU 25 2HB GLU 25 4.331 -4.729 -15.847 916 HB3 GLU 25 1HB GLU 25 3.286 -4.381 -17.217 917 HG2 GLU 25 2HG GLU 25 5.218 -3.361 -18.370 918 HG3 GLU 25 1HG GLU 25 6.242 -3.866 -17.028 919 H THR 26 H THR 26 1.749 -2.575 -17.463 920 HA THR 26 HA THR 26 2.562 -1.119 -19.713 921 HB THR 26 HB THR 26 -0.253 -1.293 -18.579 922 HG1 THR 26 1HG THR 26 1.310 -3.285 -19.410 923 HG21 THR 26 1HG2 THR 26 0.125 0.340 -20.366 924 HG22 THR 26 2HG2 THR 26 -0.946 -0.966 -20.901 925 HG23 THR 26 3HG2 THR 26 0.755 -0.930 -21.400 926 H VAL 27 H VAL 27 0.903 -0.138 -16.718 927 HA VAL 27 HA VAL 27 0.530 2.576 -17.329 928 HB VAL 27 HB VAL 27 0.943 1.361 -14.570 929 HG11 VAL 27 1HG1 VAL 27 1.185 3.795 -14.551 930 HG12 VAL 27 2HG1 VAL 27 -0.319 3.305 -13.765 931 HG13 VAL 27 3HG1 VAL 27 -0.358 3.949 -15.401 932 HG21 VAL 27 1HG2 VAL 27 -1.624 1.899 -16.072 933 HG22 VAL 27 2HG2 VAL 27 -1.488 1.280 -14.432 934 HG23 VAL 27 3HG2 VAL 27 -0.912 0.308 -15.783 935 H TYR 28 H TYR 28 3.268 0.901 -15.880 936 HA TYR 28 HA TYR 28 4.733 3.232 -15.228 937 HB2 TYR 28 2HB TYR 28 5.277 0.965 -14.289 938 HB3 TYR 28 1HB TYR 28 5.882 0.489 -15.871 939 HD1 TYR 28 1HD TYR 28 7.984 1.459 -16.730 940 HD2 TYR 28 2HD TYR 28 6.567 2.414 -12.844 941 HE1 TYR 28 1HE TYR 28 10.193 2.392 -16.156 942 HE2 TYR 28 2HE TYR 28 8.768 3.353 -12.259 943 HH TYR 28 HH TYR 28 11.092 4.034 -14.610 944 H ARG 29 H ARG 29 4.813 1.106 -18.024 945 HA ARG 29 HA ARG 29 6.803 2.454 -19.474 946 HB2 ARG 29 2HB ARG 29 4.544 0.689 -20.398 947 HB3 ARG 29 1HB ARG 29 5.771 1.333 -21.476 948 HG2 ARG 29 2HG ARG 29 6.295 -0.472 -19.118 949 HG3 ARG 29 1HG ARG 29 6.258 -0.968 -20.813 950 HD2 ARG 29 2HD ARG 29 8.186 0.971 -19.527 951 HD3 ARG 29 1HD ARG 29 8.551 -0.638 -20.155 952 HE ARG 29 HE ARG 29 7.677 0.398 -22.344 953 HH11 ARG 29 1HH1 ARG 29 9.811 1.949 -19.987 954 HH12 ARG 29 2HH1 ARG 29 10.419 3.099 -21.072 955 HH21 ARG 29 1HH2 ARG 29 8.489 1.953 -23.832 956 HH22 ARG 29 2HH2 ARG 29 9.591 3.147 -23.337 957 H ALA 30 H ALA 30 3.407 3.060 -19.191 958 HA ALA 30 HA ALA 30 3.084 4.743 -21.416 959 HB1 ALA 30 1HB ALA 30 1.575 4.860 -18.804 960 HB2 ALA 30 2HB ALA 30 1.193 3.804 -20.163 961 HB3 ALA 30 3HB ALA 30 1.061 5.554 -20.342 962 H LEU 31 H LEU 31 3.858 5.582 -18.041 963 HA LEU 31 HA LEU 31 4.071 8.327 -18.770 964 HB2 LEU 31 2HB LEU 31 4.799 7.017 -16.181 965 HB3 LEU 31 1HB LEU 31 5.009 8.728 -16.472 966 HG LEU 31 HG LEU 31 2.501 8.614 -17.062 967 HD11 LEU 31 1HD1 LEU 31 2.159 6.272 -16.993 968 HD12 LEU 31 2HD1 LEU 31 1.227 7.035 -15.704 969 HD13 LEU 31 3HD1 LEU 31 2.728 6.199 -15.324 970 HD21 LEU 31 1HD2 LEU 31 3.269 9.974 -15.353 971 HD22 LEU 31 2HD2 LEU 31 3.609 8.648 -14.261 972 HD23 LEU 31 3HD2 LEU 31 1.942 9.044 -14.697 973 H GLU 32 H GLU 32 6.355 5.764 -18.546 974 HA GLU 32 HA GLU 32 8.709 7.231 -18.474 975 HB2 GLU 32 2HB GLU 32 8.036 4.646 -19.832 976 HB3 GLU 32 1HB GLU 32 9.644 5.345 -19.895 977 HG2 GLU 32 2HG GLU 32 8.174 4.618 -17.376 978 HG3 GLU 32 1HG GLU 32 9.407 3.630 -18.161 979 H GLU 33 H GLU 33 6.756 6.333 -21.271 980 HA GLU 33 HA GLU 33 8.477 7.609 -23.125 981 HB2 GLU 33 2HB GLU 33 5.596 6.783 -23.446 982 HB3 GLU 33 1HB GLU 33 6.634 7.323 -24.754 983 HG2 GLU 33 2HG GLU 33 6.991 4.854 -23.065 984 HG3 GLU 33 1HG GLU 33 6.510 4.932 -24.759 985 H LYS 34 H LYS 34 5.988 8.769 -21.100 986 HA LYS 34 HA LYS 34 5.664 11.235 -22.613 987 HB2 LYS 34 2HB LYS 34 4.398 10.242 -20.083 988 HB3 LYS 34 1HB LYS 34 4.083 11.833 -20.751 989 HG2 LYS 34 2HG LYS 34 3.554 9.214 -22.136 990 HG3 LYS 34 1HG LYS 34 2.345 10.197 -21.311 991 HD2 LYS 34 2HD LYS 34 3.984 11.111 -23.700 992 HD3 LYS 34 1HD LYS 34 2.332 10.517 -23.757 993 HE2 LYS 34 2HE LYS 34 1.580 12.303 -22.371 994 HE3 LYS 34 1HE LYS 34 3.233 12.920 -22.203 995 HZ1 LYS 34 1HZ LYS 34 3.249 13.311 -24.601 996 HZ2 LYS 34 2HZ LYS 34 2.028 14.176 -23.838 997 HZ3 LYS 34 3HZ LYS 34 1.635 12.797 -24.714 998 H GLY 35 H GLY 35 7.793 10.103 -20.345 999 HA2 GLY 35 2HA GLY 35 9.539 11.222 -19.337 1000 HA3 GLY 35 1HA GLY 35 8.920 12.714 -20.027 1001 H TYR 36 H TYR 36 7.150 10.503 -17.930 1002 HA TYR 36 HA TYR 36 7.286 12.536 -15.804 1003 HB2 TYR 36 2HB TYR 36 4.924 10.754 -16.467 1004 HB3 TYR 36 1HB TYR 36 5.021 11.814 -15.077 1005 HD1 TYR 36 1HD TYR 36 3.814 11.424 -18.318 1006 HD2 TYR 36 2HD TYR 36 5.397 14.381 -15.709 1007 HE1 TYR 36 1HE TYR 36 2.708 13.166 -19.642 1008 HE2 TYR 36 2HE TYR 36 4.278 16.140 -17.025 1009 HH TYR 36 HH TYR 36 3.447 16.427 -19.309 1010 H ASN 37 H ASN 37 6.640 11.436 -13.650 1011 HA ASN 37 HA ASN 37 8.132 8.936 -13.441 1012 HB2 ASN 37 2HB ASN 37 7.117 10.811 -11.274 1013 HB3 ASN 37 1HB ASN 37 8.008 9.324 -10.996 1014 HD21 ASN 37 1HD2 ASN 37 9.867 9.757 -13.249 1015 HD22 ASN 37 2HD2 ASN 37 10.888 11.038 -12.726 1016 HA PRO 38 HA PRO 38 4.068 6.962 -13.721 1017 HB2 PRO 38 2HB PRO 38 5.702 4.651 -12.899 1018 HB3 PRO 38 1HB PRO 38 4.584 4.847 -14.254 1019 HG2 PRO 38 2HG PRO 38 7.249 4.825 -14.603 1020 HG3 PRO 38 1HG PRO 38 6.190 5.797 -15.623 1021 HD2 PRO 38 2HD PRO 38 8.007 6.632 -13.431 1022 HD3 PRO 38 1HD PRO 38 7.463 7.515 -14.878 1023 H ILE 39 H ILE 39 6.379 6.381 -11.154 1024 HA ILE 39 HA ILE 39 4.682 5.079 -9.354 1025 HB ILE 39 HB ILE 39 7.083 6.807 -8.707 1026 HG12 ILE 39 2HG1 ILE 39 7.659 5.061 -10.304 1027 HG13 ILE 39 1HG1 ILE 39 8.341 4.685 -8.728 1028 HG21 ILE 39 1HG2 ILE 39 5.733 6.361 -6.717 1029 HG22 ILE 39 2HG2 ILE 39 7.255 5.470 -6.656 1030 HG23 ILE 39 3HG2 ILE 39 5.763 4.633 -7.075 1031 HD11 ILE 39 1HD1 ILE 39 7.429 2.711 -9.842 1032 HD12 ILE 39 2HD1 ILE 39 5.843 3.464 -9.896 1033 HD13 ILE 39 3HD1 ILE 39 6.571 3.051 -8.341 1034 H ASN 40 H ASN 40 5.412 8.638 -9.665 1035 HA ASN 40 HA ASN 40 4.151 9.509 -7.445 1036 HB2 ASN 40 2HB ASN 40 5.776 10.661 -8.781 1037 HB3 ASN 40 1HB ASN 40 4.702 10.623 -10.165 1038 HD21 ASN 40 1HD2 ASN 40 4.680 12.722 -10.406 1039 HD22 ASN 40 2HD2 ASN 40 3.892 13.768 -9.283 1040 H GLN 41 H GLN 41 3.018 9.013 -10.768 1041 HA GLN 41 HA GLN 41 0.455 10.081 -10.159 1042 HB2 GLN 41 2HB GLN 41 1.397 8.583 -12.597 1043 HB3 GLN 41 1HB GLN 41 -0.145 9.422 -12.463 1044 HG2 GLN 41 2HG GLN 41 2.575 10.724 -12.253 1045 HG3 GLN 41 1HG GLN 41 1.529 10.774 -13.663 1046 HE21 GLN 41 1HE2 GLN 41 -0.912 11.141 -12.147 1047 HE22 GLN 41 2HE2 GLN 41 -0.867 12.759 -11.536 1048 H ILE 42 H ILE 42 1.793 6.828 -10.309 1049 HA ILE 42 HA ILE 42 -0.678 5.462 -10.133 1050 HB ILE 42 HB ILE 42 2.079 4.537 -9.236 1051 HG12 ILE 42 2HG1 ILE 42 0.502 3.904 -11.745 1052 HG13 ILE 42 1HG1 ILE 42 1.873 5.000 -11.660 1053 HG21 ILE 42 1HG2 ILE 42 0.335 3.276 -8.075 1054 HG22 ILE 42 2HG2 ILE 42 1.151 2.256 -9.264 1055 HG23 ILE 42 3HG2 ILE 42 -0.447 2.919 -9.613 1056 HD11 ILE 42 1HD1 ILE 42 3.323 3.130 -11.036 1057 HD12 ILE 42 2HD1 ILE 42 2.517 2.844 -12.579 1058 HD13 ILE 42 3HD1 ILE 42 1.942 2.035 -11.121 1059 H VAL 43 H VAL 43 1.663 6.375 -7.578 1060 HA VAL 43 HA VAL 43 0.061 5.434 -5.468 1061 HB VAL 43 HB VAL 43 2.455 5.902 -5.053 1062 HG11 VAL 43 1HG1 VAL 43 2.744 7.866 -6.479 1063 HG12 VAL 43 2HG1 VAL 43 3.311 8.199 -4.842 1064 HG13 VAL 43 3HG1 VAL 43 1.756 8.826 -5.383 1065 HG21 VAL 43 1HG2 VAL 43 0.720 7.698 -3.366 1066 HG22 VAL 43 2HG2 VAL 43 2.328 7.117 -2.937 1067 HG23 VAL 43 3HG2 VAL 43 0.999 5.973 -3.112 1068 H GLY 44 H GLY 44 0.070 8.455 -7.183 1069 HA2 GLY 44 2HA GLY 44 -1.684 9.921 -5.506 1070 HA3 GLY 44 1HA GLY 44 -1.429 10.215 -7.224 1071 H TYR 45 H TYR 45 -2.256 7.808 -8.280 1072 HA TYR 45 HA TYR 45 -5.046 8.043 -8.402 1073 HB2 TYR 45 2HB TYR 45 -3.863 6.987 -10.243 1074 HB3 TYR 45 1HB TYR 45 -3.231 5.740 -9.180 1075 HD1 TYR 45 1HD TYR 45 -4.529 3.789 -8.658 1076 HD2 TYR 45 2HD TYR 45 -6.300 6.975 -10.832 1077 HE1 TYR 45 1HE TYR 45 -6.463 2.356 -9.163 1078 HE2 TYR 45 2HE TYR 45 -8.238 5.548 -11.341 1079 HH TYR 45 HH TYR 45 -8.799 2.547 -9.790 1080 H LEU 46 H LEU 46 -2.973 5.823 -6.684 1081 HA LEU 46 HA LEU 46 -5.118 4.315 -5.699 1082 HB2 LEU 46 2HB LEU 46 -2.233 4.384 -4.904 1083 HB3 LEU 46 1HB LEU 46 -3.391 3.193 -4.321 1084 HG LEU 46 HG LEU 46 -2.772 3.609 -7.251 1085 HD11 LEU 46 1HD1 LEU 46 -1.511 1.548 -7.141 1086 HD12 LEU 46 2HD1 LEU 46 -1.706 1.517 -5.382 1087 HD13 LEU 46 3HD1 LEU 46 -0.809 2.831 -6.151 1088 HD21 LEU 46 1HD2 LEU 46 -3.874 1.449 -7.518 1089 HD22 LEU 46 2HD2 LEU 46 -4.964 2.651 -6.843 1090 HD23 LEU 46 3HD2 LEU 46 -4.247 1.420 -5.797 1091 H LEU 47 H LEU 47 -3.370 7.031 -4.212 1092 HA LEU 47 HA LEU 47 -4.920 6.708 -1.829 1093 HB2 LEU 47 2HB LEU 47 -3.006 8.818 -2.745 1094 HB3 LEU 47 1HB LEU 47 -4.007 9.072 -1.338 1095 HG LEU 47 HG LEU 47 -2.994 7.094 -0.287 1096 HD11 LEU 47 1HD1 LEU 47 -2.341 5.792 -2.161 1097 HD12 LEU 47 2HD1 LEU 47 -0.938 6.153 -1.157 1098 HD13 LEU 47 3HD1 LEU 47 -1.193 7.030 -2.671 1099 HD21 LEU 47 1HD2 LEU 47 -0.818 8.101 0.191 1100 HD22 LEU 47 2HD2 LEU 47 -2.123 9.286 0.212 1101 HD23 LEU 47 3HD2 LEU 47 -1.037 9.195 -1.175 1102 H SER 48 H SER 48 -5.840 7.820 -4.802 1103 HA SER 48 HA SER 48 -7.802 9.604 -3.513 1104 HB2 SER 48 2HB SER 48 -6.628 9.974 -6.262 1105 HB3 SER 48 1HB SER 48 -7.783 11.045 -5.468 1106 HG SER 48 HG SER 48 -5.101 10.502 -4.788 1107 H GLY 49 H GLY 49 -7.397 6.918 -5.769 1108 HA2 GLY 49 2HA GLY 49 -8.839 5.718 -6.986 1109 HA3 GLY 49 1HA GLY 49 -10.098 6.282 -5.907 1110 H ASP 50 H ASP 50 -8.056 7.842 -8.438 1111 HA ASP 50 HA ASP 50 -10.533 8.470 -9.830 1112 HB2 ASP 50 2HB ASP 50 -9.911 10.439 -8.377 1113 HB3 ASP 50 1HB ASP 50 -8.460 10.614 -9.361 1114 HA PRO 51 HA PRO 51 -8.089 6.743 -13.130 1115 HB2 PRO 51 2HB PRO 51 -10.120 8.188 -14.733 1116 HB3 PRO 51 1HB PRO 51 -9.592 6.501 -14.827 1117 HG2 PRO 51 2HG PRO 51 -11.920 7.102 -13.712 1118 HG3 PRO 51 1HG PRO 51 -10.872 5.864 -12.996 1119 HD2 PRO 51 2HD PRO 51 -11.359 8.673 -12.114 1120 HD3 PRO 51 1HD PRO 51 -11.126 7.189 -11.160 1121 H ALA 52 H ALA 52 -8.791 10.197 -12.920 1122 HA ALA 52 HA ALA 52 -7.411 10.965 -15.274 1123 HB1 ALA 52 1HB ALA 52 -7.547 13.232 -14.442 1124 HB2 ALA 52 2HB ALA 52 -7.991 12.633 -12.842 1125 HB3 ALA 52 3HB ALA 52 -9.081 12.395 -14.206 1126 H TYR 53 H TYR 53 -6.228 9.944 -12.282 1127 HA TYR 53 HA TYR 53 -3.864 11.459 -12.150 1128 HB2 TYR 53 2HB TYR 53 -4.687 8.906 -10.896 1129 HB3 TYR 53 1HB TYR 53 -3.019 9.468 -10.754 1130 HD1 TYR 53 1HD TYR 53 -2.527 11.577 -9.722 1131 HD2 TYR 53 2HD TYR 53 -6.445 9.986 -9.708 1132 HE1 TYR 53 1HE TYR 53 -3.094 13.093 -7.970 1133 HE2 TYR 53 2HE TYR 53 -7.070 11.524 -7.910 1134 HH TYR 53 HH TYR 53 -5.895 12.756 -6.095 1135 H ILE 54 H ILE 54 -4.683 8.791 -14.153 1136 HA ILE 54 HA ILE 54 -1.853 8.361 -14.727 1137 HB ILE 54 HB ILE 54 -4.245 6.680 -15.551 1138 HG12 ILE 54 2HG1 ILE 54 -3.844 6.516 -13.144 1139 HG13 ILE 54 1HG1 ILE 54 -3.371 5.021 -13.942 1140 HG21 ILE 54 1HG2 ILE 54 -2.593 5.012 -16.279 1141 HG22 ILE 54 2HG2 ILE 54 -1.292 6.140 -15.892 1142 HG23 ILE 54 3HG2 ILE 54 -2.429 6.519 -17.182 1143 HD11 ILE 54 1HD1 ILE 54 -1.786 5.627 -12.212 1144 HD12 ILE 54 2HD1 ILE 54 -1.516 7.191 -12.971 1145 HD13 ILE 54 3HD1 ILE 54 -1.016 5.713 -13.797 1146 HA PRO 55 HA PRO 55 -2.186 11.101 -18.292 1147 HB2 PRO 55 2HB PRO 55 0.110 9.279 -18.951 1148 HB3 PRO 55 1HB PRO 55 -0.014 11.025 -19.190 1149 HG2 PRO 55 2HG PRO 55 1.325 10.192 -17.126 1150 HG3 PRO 55 1HG PRO 55 0.124 11.468 -16.891 1151 HD2 PRO 55 2HD PRO 55 -0.088 8.560 -16.212 1152 HD3 PRO 55 1HD PRO 55 -0.645 9.981 -15.299 1153 H ARG 56 H ARG 56 -2.800 10.928 -20.370 1154 HA ARG 56 HA ARG 56 -4.085 8.392 -21.034 1155 HB2 ARG 56 2HB ARG 56 -5.536 9.646 -22.644 1156 HB3 ARG 56 1HB ARG 56 -5.716 10.141 -20.980 1157 HG2 ARG 56 2HG ARG 56 -4.006 11.662 -22.938 1158 HG3 ARG 56 1HG ARG 56 -5.734 11.952 -22.771 1159 HD2 ARG 56 2HD ARG 56 -5.430 12.534 -20.433 1160 HD3 ARG 56 1HD ARG 56 -3.715 12.192 -20.517 1161 HE ARG 56 HE ARG 56 -4.469 14.086 -22.457 1162 HH11 ARG 56 1HH1 ARG 56 -3.857 13.747 -18.964 1163 HH12 ARG 56 2HH1 ARG 56 -3.435 15.378 -18.757 1164 HH21 ARG 56 1HH2 ARG 56 -3.883 16.342 -22.125 1165 HH22 ARG 56 2HH2 ARG 56 -3.435 16.876 -20.586 1166 H TYR 57 H TYR 57 -1.342 8.797 -21.528 1167 HA TYR 57 HA TYR 57 -0.805 9.039 -24.291 1168 HB2 TYR 57 2HB TYR 57 1.010 9.192 -22.734 1169 HB3 TYR 57 1HB TYR 57 0.677 7.586 -22.105 1170 HD1 TYR 57 1HD TYR 57 1.820 9.378 -25.167 1171 HD2 TYR 57 2HD TYR 57 1.697 5.684 -23.063 1172 HE1 TYR 57 1HE TYR 57 3.356 8.444 -26.771 1173 HE2 TYR 57 2HE TYR 57 3.238 4.697 -24.692 1174 HH TYR 57 HH TYR 57 3.898 5.123 -27.068 1175 H GLN 58 H GLN 58 -1.733 6.281 -22.295 1176 HA GLN 58 HA GLN 58 -2.019 4.704 -24.731 1177 HB2 GLN 58 2HB GLN 58 0.274 4.322 -23.711 1178 HB3 GLN 58 1HB GLN 58 -0.557 3.748 -22.268 1179 HG2 GLN 58 2HG GLN 58 -1.477 1.892 -23.508 1180 HG3 GLN 58 1HG GLN 58 -0.729 2.522 -24.982 1181 HE21 GLN 58 1HE2 GLN 58 0.402 0.632 -25.253 1182 HE22 GLN 58 2HE2 GLN 58 1.794 0.246 -24.317 1183 H ASP 59 H ASP 59 -3.166 2.669 -24.191 1184 HA ASP 59 HA ASP 59 -5.562 3.021 -22.883 1185 HB2 ASP 59 2HB ASP 59 -5.858 0.555 -23.091 1186 HB3 ASP 59 1HB ASP 59 -5.409 1.357 -24.589 1187 H ALA 60 H ALA 60 -2.610 2.465 -21.438 1188 HA ALA 60 HA ALA 60 -3.023 0.906 -19.209 1189 HB1 ALA 60 1HB ALA 60 -1.297 2.174 -18.121 1190 HB2 ALA 60 2HB ALA 60 -1.519 3.517 -19.242 1191 HB3 ALA 60 3HB ALA 60 -0.882 1.976 -19.821 1192 H ARG 61 H ARG 61 -3.964 4.287 -19.637 1193 HA ARG 61 HA ARG 61 -4.968 4.624 -17.031 1194 HB2 ARG 61 2HB ARG 61 -6.243 6.624 -17.996 1195 HB3 ARG 61 1HB ARG 61 -4.502 6.658 -18.155 1196 HG2 ARG 61 2HG ARG 61 -5.493 7.500 -20.150 1197 HG3 ARG 61 1HG ARG 61 -4.763 5.940 -20.543 1198 HD2 ARG 61 2HD ARG 61 -7.100 4.989 -20.270 1199 HD3 ARG 61 1HD ARG 61 -7.665 6.656 -20.180 1200 HE ARG 61 HE ARG 61 -6.061 6.281 -22.480 1201 HH11 ARG 61 1HH1 ARG 61 -9.328 5.629 -21.246 1202 HH12 ARG 61 2HH1 ARG 61 -10.011 5.480 -22.796 1203 HH21 ARG 61 1HH2 ARG 61 -7.017 6.085 -24.583 1204 HH22 ARG 61 2HH2 ARG 61 -8.673 5.760 -24.733 1205 H ASN 62 H ASN 62 -6.379 3.283 -19.850 1206 HA ASN 62 HA ASN 62 -9.067 3.187 -18.848 1207 HB2 ASN 62 2HB ASN 62 -8.470 3.235 -21.291 1208 HB3 ASN 62 1HB ASN 62 -7.772 1.633 -21.108 1209 HD21 ASN 62 1HD2 ASN 62 -9.146 0.650 -22.513 1210 HD22 ASN 62 2HD2 ASN 62 -10.816 0.412 -22.187 1211 H LEU 63 H LEU 63 -6.320 1.012 -19.188 1212 HA LEU 63 HA LEU 63 -7.399 -1.434 -18.363 1213 HB2 LEU 63 2HB LEU 63 -4.605 -0.439 -17.859 1214 HB3 LEU 63 1HB LEU 63 -5.128 -2.105 -17.825 1215 HG LEU 63 HG LEU 63 -4.998 -0.327 -20.253 1216 HD11 LEU 63 1HD1 LEU 63 -2.807 -1.010 -19.392 1217 HD12 LEU 63 2HD1 LEU 63 -3.193 -1.767 -20.931 1218 HD13 LEU 63 3HD1 LEU 63 -3.325 -2.693 -19.436 1219 HD21 LEU 63 1HD2 LEU 63 -5.507 -2.360 -21.512 1220 HD22 LEU 63 2HD2 LEU 63 -6.831 -1.931 -20.431 1221 HD23 LEU 63 3HD2 LEU 63 -5.733 -3.244 -20.003 1222 H ILE 64 H ILE 64 -5.818 1.106 -16.458 1223 HA ILE 64 HA ILE 64 -5.826 -0.360 -14.067 1224 HB ILE 64 HB ILE 64 -4.307 1.575 -14.615 1225 HG12 ILE 64 2HG1 ILE 64 -5.807 1.945 -12.013 1226 HG13 ILE 64 1HG1 ILE 64 -4.575 0.716 -12.284 1227 HG21 ILE 64 1HG2 ILE 64 -5.098 3.861 -14.175 1228 HG22 ILE 64 2HG2 ILE 64 -6.734 3.239 -13.974 1229 HG23 ILE 64 3HG2 ILE 64 -5.933 3.112 -15.537 1230 HD11 ILE 64 1HD1 ILE 64 -2.924 2.488 -12.716 1231 HD12 ILE 64 2HD1 ILE 64 -3.638 2.623 -11.104 1232 HD13 ILE 64 3HD1 ILE 64 -4.163 3.699 -12.399 1233 H ARG 65 H ARG 65 -8.282 1.356 -15.688 1234 HA ARG 65 HA ARG 65 -9.963 1.915 -13.422 1235 HB2 ARG 65 2HB ARG 65 -10.557 1.896 -16.369 1236 HB3 ARG 65 1HB ARG 65 -11.660 2.459 -15.127 1237 HG2 ARG 65 2HG ARG 65 -10.092 4.220 -14.528 1238 HG3 ARG 65 1HG ARG 65 -8.970 3.639 -15.762 1239 HD2 ARG 65 2HD ARG 65 -10.275 5.527 -16.590 1240 HD3 ARG 65 1HD ARG 65 -10.638 4.053 -17.487 1241 HE ARG 65 HE ARG 65 -12.362 4.512 -15.266 1242 HH11 ARG 65 1HH1 ARG 65 -11.854 5.260 -18.685 1243 HH12 ARG 65 2HH1 ARG 65 -13.499 5.505 -19.016 1244 HH21 ARG 65 1HH2 ARG 65 -14.628 4.892 -15.723 1245 HH22 ARG 65 2HH2 ARG 65 -15.117 5.313 -17.291 1246 H ARG 66 H ARG 66 -9.170 -0.865 -15.043 1247 HA ARG 66 HA ARG 66 -11.725 -2.210 -14.654 1248 HB2 ARG 66 2HB ARG 66 -9.057 -3.033 -15.755 1249 HB3 ARG 66 1HB ARG 66 -10.159 -4.273 -15.204 1250 HG2 ARG 66 2HG ARG 66 -10.204 -3.912 -17.651 1251 HG3 ARG 66 1HG ARG 66 -11.765 -3.689 -16.899 1252 HD2 ARG 66 2HD ARG 66 -9.912 -1.417 -17.649 1253 HD3 ARG 66 1HD ARG 66 -11.143 -2.051 -18.730 1254 HE ARG 66 HE ARG 66 -11.978 -1.089 -16.099 1255 HH11 ARG 66 1HH1 ARG 66 -11.918 -0.571 -19.608 1256 HH12 ARG 66 2HH1 ARG 66 -13.044 0.712 -19.547 1257 HH21 ARG 66 1HH2 ARG 66 -13.563 0.704 -16.082 1258 HH22 ARG 66 2HH2 ARG 66 -13.972 1.415 -17.570 1259 H HIS 67 H HIS 67 -9.698 -1.027 -12.620 1260 HA HIS 67 HA HIS 67 -10.072 -3.137 -10.657 1261 HB2 HIS 67 2HB HIS 67 -7.611 -1.373 -10.921 1262 HB3 HIS 67 1HB HIS 67 -7.881 -2.589 -9.682 1263 HD1 HIS 67 1HD HIS 67 -7.594 -5.079 -10.403 1264 HD2 HIS 67 2HD HIS 67 -6.659 -2.304 -13.350 1265 HE1 HIS 67 1HE HIS 67 -6.378 -6.366 -12.192 1266 HE2 HIS 67 2HE HIS 67 -6.167 -4.711 -14.077 1267 H GLU 68 H GLU 68 -10.216 -2.111 -8.508 1268 HA GLU 68 HA GLU 68 -11.527 0.454 -8.725 1269 HB2 GLU 68 2HB GLU 68 -11.010 -1.235 -6.277 1270 HB3 GLU 68 1HB GLU 68 -11.962 0.239 -6.309 1271 HG2 GLU 68 2HG GLU 68 -12.584 -2.304 -7.778 1272 HG3 GLU 68 1HG GLU 68 -13.361 -1.735 -6.303 1273 H ARG 69 H ARG 69 -9.339 -0.478 -6.173 1274 HA ARG 69 HA ARG 69 -7.354 1.524 -6.655 1275 HB2 ARG 69 2HB ARG 69 -9.177 2.995 -5.965 1276 HB3 ARG 69 1HB ARG 69 -9.491 2.073 -4.531 1277 HG2 ARG 69 2HG ARG 69 -7.076 2.647 -3.905 1278 HG3 ARG 69 1HG ARG 69 -7.234 3.881 -5.160 1279 HD2 ARG 69 2HD ARG 69 -7.835 4.855 -3.044 1280 HD3 ARG 69 1HD ARG 69 -9.285 4.707 -4.035 1281 HE ARG 69 HE ARG 69 -9.304 2.405 -2.559 1282 HH11 ARG 69 1HH1 ARG 69 -9.171 5.829 -1.672 1283 HH12 ARG 69 2HH1 ARG 69 -9.826 5.568 -0.131 1284 HH21 ARG 69 1HH2 ARG 69 -10.173 2.075 -0.437 1285 HH22 ARG 69 2HH2 ARG 69 -10.415 3.439 0.578 1286 H ASP 70 H ASP 70 -9.127 0.169 -3.913 1287 HA ASP 70 HA ASP 70 -7.082 -0.316 -2.151 1288 HB2 ASP 70 2HB ASP 70 -9.679 -1.846 -2.451 1289 HB3 ASP 70 1HB ASP 70 -8.684 -1.748 -1.007 1290 H GLU 71 H GLU 71 -8.553 -2.465 -4.517 1291 HA GLU 71 HA GLU 71 -7.403 -4.902 -3.980 1292 HB2 GLU 71 2HB GLU 71 -9.141 -4.517 -5.628 1293 HB3 GLU 71 1HB GLU 71 -8.012 -3.640 -6.646 1294 HG2 GLU 71 2HG GLU 71 -6.707 -5.729 -6.867 1295 HG3 GLU 71 1HG GLU 71 -7.981 -6.568 -5.979 1296 H ILE 72 H ILE 72 -6.073 -2.279 -5.967 1297 HA ILE 72 HA ILE 72 -3.756 -3.725 -6.814 1298 HB ILE 72 HB ILE 72 -4.299 -0.742 -6.826 1299 HG12 ILE 72 2HG1 ILE 72 -4.606 -2.794 -9.033 1300 HG13 ILE 72 1HG1 ILE 72 -5.922 -2.024 -8.160 1301 HG21 ILE 72 1HG2 ILE 72 -2.185 -2.328 -8.296 1302 HG22 ILE 72 2HG2 ILE 72 -1.906 -1.197 -6.973 1303 HG23 ILE 72 3HG2 ILE 72 -2.511 -0.609 -8.521 1304 HD11 ILE 72 1HD1 ILE 72 -5.274 0.136 -9.083 1305 HD12 ILE 72 2HD1 ILE 72 -5.590 -1.035 -10.364 1306 HD13 ILE 72 3HD1 ILE 72 -3.930 -0.626 -9.934 1307 H MET 73 H MET 73 -4.481 -1.382 -4.328 1308 HA MET 73 HA MET 73 -1.812 -0.970 -3.487 1309 HB2 MET 73 2HB MET 73 -3.823 0.533 -3.096 1310 HB3 MET 73 1HB MET 73 -4.324 -0.595 -1.849 1311 HG2 MET 73 2HG MET 73 -1.765 1.001 -1.853 1312 HG3 MET 73 1HG MET 73 -3.218 1.392 -0.953 1313 HE1 MET 73 1HE MET 73 -0.304 1.194 0.316 1314 HE2 MET 73 2HE MET 73 -0.722 0.392 1.835 1315 HE3 MET 73 3HE MET 73 -1.785 1.632 1.157 1316 H GLU 74 H GLU 74 -4.440 -3.093 -2.364 1317 HA GLU 74 HA GLU 74 -3.114 -4.299 -0.242 1318 HB2 GLU 74 2HB GLU 74 -5.192 -5.425 -2.118 1319 HB3 GLU 74 1HB GLU 74 -4.629 -6.255 -0.675 1320 HG2 GLU 74 2HG GLU 74 -5.435 -4.407 0.701 1321 HG3 GLU 74 1HG GLU 74 -5.990 -3.569 -0.744 1322 H GLU 75 H GLU 75 -3.121 -5.117 -3.662 1323 HA GLU 75 HA GLU 75 -1.497 -7.401 -3.568 1324 HB2 GLU 75 2HB GLU 75 -2.705 -6.729 -5.583 1325 HB3 GLU 75 1HB GLU 75 -1.745 -5.263 -5.682 1326 HG2 GLU 75 2HG GLU 75 -1.034 -6.911 -7.330 1327 HG3 GLU 75 1HG GLU 75 0.238 -6.556 -6.167 1328 H LEU 76 H LEU 76 -0.649 -3.977 -3.948 1329 HA LEU 76 HA LEU 76 2.126 -4.267 -4.166 1330 HB2 LEU 76 2HB LEU 76 0.606 -1.962 -2.955 1331 HB3 LEU 76 1HB LEU 76 2.271 -1.918 -3.491 1332 HG LEU 76 HG LEU 76 -0.151 -2.275 -5.257 1333 HD11 LEU 76 1HD1 LEU 76 0.449 -0.083 -6.120 1334 HD12 LEU 76 2HD1 LEU 76 1.751 0.027 -4.935 1335 HD13 LEU 76 3HD1 LEU 76 0.071 -0.027 -4.399 1336 HD21 LEU 76 1HD2 LEU 76 1.752 -3.498 -6.149 1337 HD22 LEU 76 2HD2 LEU 76 2.769 -2.068 -5.984 1338 HD23 LEU 76 3HD2 LEU 76 1.424 -2.073 -7.124 1339 H THR 77 H THR 77 0.141 -3.642 -1.212 1340 HA THR 77 HA THR 77 2.318 -3.566 0.537 1341 HB THR 77 HB THR 77 -0.538 -4.403 1.127 1342 HG1 THR 77 1HG THR 77 -0.717 -2.343 0.352 1343 HG21 THR 77 1HG2 THR 77 -0.059 -3.602 3.391 1344 HG22 THR 77 2HG2 THR 77 1.597 -3.219 2.915 1345 HG23 THR 77 3HG2 THR 77 1.055 -4.897 2.955 1346 H LYS 78 H LYS 78 0.301 -6.273 -0.551 1347 HA LYS 78 HA LYS 78 1.407 -8.146 1.235 1348 HB2 LYS 78 2HB LYS 78 -0.096 -8.558 -1.329 1349 HB3 LYS 78 1HB LYS 78 0.424 -9.884 -0.301 1350 HG2 LYS 78 2HG LYS 78 -0.791 -8.955 1.516 1351 HG3 LYS 78 1HG LYS 78 -1.391 -7.640 0.518 1352 HD2 LYS 78 2HD LYS 78 -1.914 -10.601 0.116 1353 HD3 LYS 78 1HD LYS 78 -3.068 -9.443 0.766 1354 HE2 LYS 78 2HE LYS 78 -3.024 -8.241 -1.385 1355 HE3 LYS 78 1HE LYS 78 -1.898 -9.442 -2.016 1356 HZ1 LYS 78 1HZ LYS 78 -4.688 -9.943 -1.128 1357 HZ2 LYS 78 2HZ LYS 78 -3.596 -11.145 -1.590 1358 HZ3 LYS 78 3HZ LYS 78 -4.132 -9.979 -2.691 1359 H TYR 79 H TYR 79 2.058 -7.471 -2.137 1360 HA TYR 79 HA TYR 79 3.889 -9.583 -2.458 1361 HB2 TYR 79 2HB TYR 79 2.640 -8.284 -4.255 1362 HB3 TYR 79 1HB TYR 79 3.872 -7.045 -4.051 1363 HD1 TYR 79 1HD TYR 79 3.469 -10.638 -4.747 1364 HD2 TYR 79 2HD TYR 79 5.830 -7.178 -5.340 1365 HE1 TYR 79 1HE TYR 79 4.855 -11.889 -6.354 1366 HE2 TYR 79 2HE TYR 79 7.237 -8.408 -6.952 1367 HH TYR 79 HH TYR 79 7.831 -10.683 -7.472 1368 H TYR 80 H TYR 80 4.260 -6.278 -1.381 1369 HA TYR 80 HA TYR 80 7.063 -6.066 -1.438 1370 HB2 TYR 80 2HB TYR 80 5.541 -4.165 -1.016 1371 HB3 TYR 80 1HB TYR 80 5.078 -4.878 0.520 1372 HD1 TYR 80 1HD TYR 80 7.793 -3.207 -1.318 1373 HD2 TYR 80 2HD TYR 80 6.470 -4.605 2.471 1374 HE1 TYR 80 1HE TYR 80 9.584 -1.918 -0.224 1375 HE2 TYR 80 2HE TYR 80 8.252 -3.328 3.576 1376 HH TYR 80 HH TYR 80 10.077 -0.947 1.943 1377 H LEU 81 H LEU 81 4.869 -7.109 1.159 1378 HA LEU 81 HA LEU 81 6.975 -7.897 2.910 1379 HB2 LEU 81 2HB LEU 81 4.030 -8.522 2.980 1380 HB3 LEU 81 1HB LEU 81 5.153 -8.909 4.265 1381 HG LEU 81 HG LEU 81 4.442 -6.123 3.332 1382 HD11 LEU 81 1HD1 LEU 81 3.704 -7.612 5.844 1383 HD12 LEU 81 2HD1 LEU 81 2.614 -7.204 4.518 1384 HD13 LEU 81 3HD1 LEU 81 3.336 -5.923 5.495 1385 HD21 LEU 81 1HD2 LEU 81 5.711 -5.389 5.301 1386 HD22 LEU 81 2HD2 LEU 81 6.740 -6.230 4.149 1387 HD23 LEU 81 3HD2 LEU 81 6.193 -7.055 5.611 1388 H ALA 82 H ALA 82 5.248 -9.475 0.362 1389 HA ALA 82 HA ALA 82 5.570 -12.139 1.077 1390 HB1 ALA 82 1HB ALA 82 5.575 -10.959 -1.695 1391 HB2 ALA 82 2HB ALA 82 4.139 -11.382 -0.761 1392 HB3 ALA 82 3HB ALA 82 5.264 -12.643 -1.277 1393 H ASN 83 H ASN 83 7.742 -9.915 -0.449 1394 HA ASN 83 HA ASN 83 9.664 -11.952 -1.066 1395 HB2 ASN 83 2HB ASN 83 9.732 -8.972 -1.364 1396 HB3 ASN 83 1HB ASN 83 11.145 -9.976 -1.701 1397 HD21 ASN 83 1HD2 ASN 83 7.866 -9.158 -2.744 1398 HD22 ASN 83 2HD2 ASN 83 8.023 -9.966 -4.257 1399 H HIS 84 H HIS 84 8.849 -10.768 1.751 1400 HA HIS 84 HA HIS 84 11.556 -10.862 2.827 1401 HB2 HIS 84 2HB HIS 84 10.133 -9.015 3.642 1402 HB3 HIS 84 1HB HIS 84 8.918 -10.165 4.174 1403 HD1 HIS 84 1HD HIS 84 12.652 -9.695 4.879 1404 HD2 HIS 84 2HD HIS 84 9.087 -10.480 6.863 1405 HE1 HIS 84 1HE HIS 84 13.258 -9.932 7.284 1406 HE2 HIS 84 2HE HIS 84 11.037 -9.831 8.385 1407 H GLY 85 H GLY 85 9.261 -12.968 1.907 1408 HA2 GLY 85 2HA GLY 85 9.614 -15.290 2.210 1409 HA3 GLY 85 1HA GLY 85 10.220 -14.962 3.827 1410 H ILE 86 H ILE 86 7.487 -13.141 3.208 1411 HA ILE 86 HA ILE 86 5.851 -15.014 4.766 1412 HB ILE 86 HB ILE 86 5.402 -12.071 4.166 1413 HG12 ILE 86 2HG1 ILE 86 6.351 -13.404 6.714 1414 HG13 ILE 86 1HG1 ILE 86 7.330 -12.408 5.646 1415 HG21 ILE 86 1HG2 ILE 86 3.647 -12.190 5.881 1416 HG22 ILE 86 2HG2 ILE 86 3.924 -13.920 6.047 1417 HG23 ILE 86 3HG2 ILE 86 3.307 -13.267 4.528 1418 HD11 ILE 86 1HD1 ILE 86 6.606 -11.181 7.626 1419 HD12 ILE 86 2HD1 ILE 86 4.932 -11.538 7.193 1420 HD13 ILE 86 3HD1 ILE 86 5.902 -10.499 6.147 1421 H ASP 87 H ASP 87 4.082 -15.932 3.786 1422 HA ASP 87 HA ASP 87 3.443 -14.804 1.164 1423 HB2 ASP 87 2HB ASP 87 2.463 -16.875 0.411 1424 HB3 ASP 87 1HB ASP 87 3.982 -17.302 1.166 1425 H ILE 88 H ILE 88 1.744 -13.632 0.959 1426 HA ILE 88 HA ILE 88 -0.270 -13.821 3.093 1427 HB ILE 88 HB ILE 88 0.304 -11.312 1.427 1428 HG12 ILE 88 2HG1 ILE 88 1.266 -11.958 4.217 1429 HG13 ILE 88 1HG1 ILE 88 2.286 -11.969 2.783 1430 HG21 ILE 88 1HG2 ILE 88 -1.184 -11.742 4.014 1431 HG22 ILE 88 2HG2 ILE 88 -1.914 -11.433 2.434 1432 HG23 ILE 88 3HG2 ILE 88 -0.931 -10.194 3.215 1433 HD11 ILE 88 1HD1 ILE 88 2.569 -9.914 4.044 1434 HD12 ILE 88 2HD1 ILE 88 0.837 -9.602 3.917 1435 HD13 ILE 88 3HD1 ILE 88 1.840 -9.588 2.467 1436 H LYS 89 H LYS 89 -2.496 -13.584 2.396 1437 HA LYS 89 HA LYS 89 -2.788 -14.912 -0.164 1438 HB2 LYS 89 2HB LYS 89 -5.054 -14.241 1.712 1439 HB3 LYS 89 1HB LYS 89 -4.940 -15.553 0.560 1440 HG2 LYS 89 2HG LYS 89 -3.450 -15.328 3.173 1441 HG3 LYS 89 1HG LYS 89 -4.769 -16.427 2.801 1442 HD2 LYS 89 2HD LYS 89 -3.370 -17.603 1.206 1443 HD3 LYS 89 1HD LYS 89 -2.057 -16.445 1.459 1444 HE2 LYS 89 2HE LYS 89 -1.971 -17.108 3.839 1445 HE3 LYS 89 1HE LYS 89 -3.248 -18.278 3.528 1446 HZ1 LYS 89 1HZ LYS 89 -1.749 -19.438 2.020 1447 HZ2 LYS 89 2HZ LYS 89 -1.114 -19.317 3.574 1448 HZ3 LYS 89 3HZ LYS 89 -0.505 -18.342 2.345 Start of MODEL 6 1 H1 MET 1 1HT MET 1 -22.516 16.596 16.019 2 H2 MET 1 2HT MET 1 -22.052 18.169 16.294 3 H3 MET 1 3HT MET 1 -23.479 17.574 17.001 4 HA MET 1 HA MET 1 -21.645 17.729 18.571 5 HB2 MET 1 2HB MET 1 -22.472 14.902 17.846 6 HB3 MET 1 1HB MET 1 -21.659 15.334 19.338 7 HG2 MET 1 2HG MET 1 -24.033 15.054 19.708 8 HG3 MET 1 1HG MET 1 -23.566 16.731 19.982 9 HE1 MET 1 1HE MET 1 -26.105 17.479 19.908 10 HE2 MET 1 2HE MET 1 -26.591 15.801 19.670 11 HE3 MET 1 3HE MET 1 -27.215 17.059 18.603 12 H GLY 2 H GLY 2 -19.573 18.087 18.469 13 HA2 GLY 2 2HA GLY 2 -18.012 17.207 16.286 14 HA3 GLY 2 1HA GLY 2 -17.440 18.094 17.687 15 H PHE 3 H PHE 3 -17.756 15.060 16.158 16 HA PHE 3 HA PHE 3 -16.730 13.499 18.336 17 HB2 PHE 3 2HB PHE 3 -16.759 12.889 15.357 18 HB3 PHE 3 1HB PHE 3 -16.427 11.732 16.639 19 HD1 PHE 3 1HD PHE 3 -18.294 11.179 18.264 20 HD2 PHE 3 2HD PHE 3 -18.940 13.316 14.641 21 HE1 PHE 3 1HE PHE 3 -20.683 10.624 18.368 22 HE2 PHE 3 2HE PHE 3 -21.337 12.765 14.742 23 HZ PHE 3 HZ PHE 3 -22.209 11.417 16.606 24 H THR 4 H THR 4 -14.737 13.977 19.050 25 HA THR 4 HA THR 4 -12.905 14.978 17.058 26 HB THR 4 HB THR 4 -13.375 16.608 18.760 27 HG1 THR 4 1HG THR 4 -11.359 17.174 19.144 28 HG21 THR 4 1HG2 THR 4 -12.704 16.279 21.120 29 HG22 THR 4 2HG2 THR 4 -12.298 14.601 20.753 30 HG23 THR 4 3HG2 THR 4 -13.970 15.151 20.636 31 H ASP 5 H ASP 5 -11.413 13.818 16.366 32 HA ASP 5 HA ASP 5 -9.372 12.685 17.802 33 HB2 ASP 5 2HB ASP 5 -10.938 10.781 18.257 34 HB3 ASP 5 1HB ASP 5 -11.217 10.606 16.529 35 H GLU 6 H GLU 6 -8.495 14.137 16.406 36 HA GLU 6 HA GLU 6 -8.866 13.717 13.566 37 HB2 GLU 6 2HB GLU 6 -7.552 15.737 13.245 38 HB3 GLU 6 1HB GLU 6 -8.845 16.023 14.397 39 HG2 GLU 6 2HG GLU 6 -7.274 15.912 16.239 40 HG3 GLU 6 1HG GLU 6 -5.966 15.495 15.137 41 H THR 7 H THR 7 -7.062 13.516 12.147 42 HA THR 7 HA THR 7 -5.039 11.779 13.037 43 HB THR 7 HB THR 7 -5.251 13.485 10.541 44 HG1 THR 7 1HG THR 7 -6.420 11.071 11.332 45 HG21 THR 7 1HG2 THR 7 -3.612 11.005 11.111 46 HG22 THR 7 2HG2 THR 7 -2.983 12.643 10.931 47 HG23 THR 7 3HG2 THR 7 -3.723 11.830 9.555 48 H VAL 8 H VAL 8 -3.509 12.538 14.384 49 HA VAL 8 HA VAL 8 -2.938 15.306 14.470 50 HB VAL 8 HB VAL 8 -1.243 14.692 16.237 51 HG11 VAL 8 1HG1 VAL 8 -3.535 15.294 16.822 52 HG12 VAL 8 2HG1 VAL 8 -2.934 14.033 17.902 53 HG13 VAL 8 3HG1 VAL 8 -4.044 13.621 16.594 54 HG21 VAL 8 1HG2 VAL 8 -2.350 11.902 15.820 55 HG22 VAL 8 2HG2 VAL 8 -1.277 12.402 17.127 56 HG23 VAL 8 3HG2 VAL 8 -0.703 12.422 15.459 57 H ARG 9 H ARG 9 -1.663 16.335 13.151 58 HA ARG 9 HA ARG 9 0.140 14.778 11.574 59 HB2 ARG 9 2HB ARG 9 -0.689 17.650 11.245 60 HB3 ARG 9 1HB ARG 9 0.700 17.021 10.390 61 HG2 ARG 9 2HG ARG 9 -1.196 16.968 8.923 62 HG3 ARG 9 1HG ARG 9 -0.770 15.316 9.334 63 HD2 ARG 9 2HD ARG 9 -2.596 15.314 11.009 64 HD3 ARG 9 1HD ARG 9 -3.028 16.944 10.495 65 HE ARG 9 HE ARG 9 -2.949 15.039 8.345 66 HH11 ARG 9 1HH1 ARG 9 -5.041 16.376 10.866 67 HH12 ARG 9 2HH1 ARG 9 -6.485 15.995 10.040 68 HH21 ARG 9 1HH2 ARG 9 -4.895 14.504 7.279 69 HH22 ARG 9 2HH2 ARG 9 -6.414 14.890 7.954 70 H PHE 10 H PHE 10 1.316 14.201 13.406 71 HA PHE 10 HA PHE 10 3.547 16.048 13.782 72 HB2 PHE 10 2HB PHE 10 2.881 13.481 15.262 73 HB3 PHE 10 1HB PHE 10 4.342 14.422 15.526 74 HD1 PHE 10 1HD PHE 10 0.851 14.034 16.314 75 HD2 PHE 10 2HD PHE 10 4.139 16.720 16.477 76 HE1 PHE 10 1HE PHE 10 -0.324 15.369 18.025 77 HE2 PHE 10 2HE PHE 10 2.974 18.057 18.183 78 HZ PHE 10 HZ PHE 10 0.739 17.377 18.956 79 H ASP 11 H ASP 11 4.473 15.850 11.854 80 HA ASP 11 HA ASP 11 5.001 13.264 10.723 81 HB2 ASP 11 2HB ASP 11 6.031 14.519 8.866 82 HB3 ASP 11 1HB ASP 11 4.411 15.097 9.223 83 H PHE 12 H PHE 12 6.896 12.269 10.612 84 HA PHE 12 HA PHE 12 8.979 13.395 12.311 85 HB2 PHE 12 2HB PHE 12 8.445 10.496 11.617 86 HB3 PHE 12 1HB PHE 12 9.772 11.070 12.618 87 HD1 PHE 12 1HD PHE 12 6.310 10.144 12.529 88 HD2 PHE 12 2HD PHE 12 9.245 12.224 14.791 89 HE1 PHE 12 1HE PHE 12 4.860 10.023 14.504 90 HE2 PHE 12 2HE PHE 12 7.795 12.105 16.781 91 HZ PHE 12 HZ PHE 12 5.596 10.999 16.630 92 H ASP 13 H ASP 13 11.172 12.095 11.614 93 HA ASP 13 HA ASP 13 11.817 13.264 9.088 94 HB2 ASP 13 2HB ASP 13 13.493 11.416 10.830 95 HB3 ASP 13 1HB ASP 13 14.078 12.306 9.433 96 H ASP 14 H ASP 14 11.285 12.389 7.248 97 HA ASP 14 HA ASP 14 10.361 9.728 7.075 98 HB2 ASP 14 2HB ASP 14 10.052 10.204 4.667 99 HB3 ASP 14 1HB ASP 14 9.363 11.461 5.682 100 H ASN 15 H ASN 15 11.209 7.987 6.049 101 HA ASN 15 HA ASN 15 14.020 8.096 5.323 102 HB2 ASN 15 2HB ASN 15 13.944 7.554 7.753 103 HB3 ASN 15 1HB ASN 15 12.881 6.203 7.418 104 HD21 ASN 15 1HD2 ASN 15 15.446 6.194 8.759 105 HD22 ASN 15 2HD2 ASN 15 16.477 5.167 7.823 106 H ARG 16 H ARG 16 13.582 7.603 3.304 107 HA ARG 16 HA ARG 16 11.713 5.464 2.771 108 HB2 ARG 16 2HB ARG 16 11.728 6.153 0.359 109 HB3 ARG 16 1HB ARG 16 11.139 7.390 1.447 110 HG2 ARG 16 2HG ARG 16 13.965 7.361 0.402 111 HG3 ARG 16 1HG ARG 16 12.642 8.120 -0.474 112 HD2 ARG 16 2HD ARG 16 12.294 9.697 1.302 113 HD3 ARG 16 1HD ARG 16 13.417 8.881 2.371 114 HE ARG 16 HE ARG 16 14.858 9.454 0.158 115 HH11 ARG 16 1HH1 ARG 16 12.966 11.524 2.456 116 HH12 ARG 16 2HH1 ARG 16 14.019 12.821 2.286 117 HH21 ARG 16 1HH2 ARG 16 16.266 11.305 -0.004 118 HH22 ARG 16 2HH2 ARG 16 15.926 12.712 0.888 119 H LYS 17 H LYS 17 12.897 3.859 3.428 120 HA LYS 17 HA LYS 17 14.742 2.722 1.474 121 HB2 LYS 17 2HB LYS 17 15.421 2.961 4.433 122 HB3 LYS 17 1HB LYS 17 16.344 2.088 3.228 123 HG2 LYS 17 2HG LYS 17 16.917 4.168 2.124 124 HG3 LYS 17 1HG LYS 17 15.930 5.065 3.280 125 HD2 LYS 17 2HD LYS 17 17.370 4.222 5.102 126 HD3 LYS 17 1HD LYS 17 18.385 3.424 3.898 127 HE2 LYS 17 2HE LYS 17 18.876 5.580 2.874 128 HE3 LYS 17 1HE LYS 17 17.834 6.375 4.052 129 HZ1 LYS 17 1HZ LYS 17 20.127 6.566 4.701 130 HZ2 LYS 17 2HZ LYS 17 20.332 4.891 4.662 131 HZ3 LYS 17 3HZ LYS 17 19.321 5.582 5.806 132 H LYS 18 H LYS 18 15.422 0.471 2.988 133 HA LYS 18 HA LYS 18 12.915 -0.906 3.126 134 HB2 LYS 18 2HB LYS 18 15.771 -1.834 3.578 135 HB3 LYS 18 1HB LYS 18 14.397 -2.877 3.866 136 HG2 LYS 18 2HG LYS 18 15.432 -3.301 1.683 137 HG3 LYS 18 1HG LYS 18 13.768 -2.765 1.517 138 HD2 LYS 18 2HD LYS 18 14.576 -0.510 0.952 139 HD3 LYS 18 1HD LYS 18 16.240 -1.070 1.132 140 HE2 LYS 18 2HE LYS 18 15.970 -2.609 -0.701 141 HE3 LYS 18 1HE LYS 18 14.259 -2.220 -0.840 142 HZ1 LYS 18 1HZ LYS 18 16.510 -0.337 -1.308 143 HZ2 LYS 18 2HZ LYS 18 14.867 0.033 -1.446 144 HZ3 LYS 18 3HZ LYS 18 15.560 -1.042 -2.516 145 H ALA 19 H ALA 19 14.108 1.161 5.067 146 HA ALA 19 HA ALA 19 13.808 0.146 7.697 147 HB1 ALA 19 1HB ALA 19 14.873 2.281 7.179 148 HB2 ALA 19 2HB ALA 19 13.483 2.526 8.257 149 HB3 ALA 19 3HB ALA 19 13.330 2.854 6.528 150 H ILE 20 H ILE 20 11.712 1.366 5.196 151 HA ILE 20 HA ILE 20 9.313 1.577 6.657 152 HB ILE 20 HB ILE 20 9.790 1.058 3.699 153 HG12 ILE 20 2HG1 ILE 20 9.233 3.632 5.194 154 HG13 ILE 20 1HG1 ILE 20 10.793 3.141 4.556 155 HG21 ILE 20 1HG2 ILE 20 7.278 1.967 5.106 156 HG22 ILE 20 2HG2 ILE 20 7.524 0.411 4.309 157 HG23 ILE 20 3HG2 ILE 20 7.503 1.896 3.357 158 HD11 ILE 20 1HD1 ILE 20 9.710 4.789 3.137 159 HD12 ILE 20 2HD1 ILE 20 8.327 3.719 2.932 160 HD13 ILE 20 3HD1 ILE 20 9.900 3.253 2.290 161 H SER 21 H SER 21 11.031 -1.009 5.148 162 HA SER 21 HA SER 21 8.962 -2.952 5.127 163 HB2 SER 21 2HB SER 21 11.957 -3.351 5.237 164 HB3 SER 21 1HB SER 21 10.770 -4.586 4.824 165 HG SER 21 HG SER 21 10.367 -2.442 3.244 166 H GLU 22 H GLU 22 11.487 -2.081 7.446 167 HA GLU 22 HA GLU 22 11.191 -4.068 9.372 168 HB2 GLU 22 2HB GLU 22 11.622 -1.129 9.906 169 HB3 GLU 22 1HB GLU 22 12.090 -2.454 10.948 170 HG2 GLU 22 2HG GLU 22 13.768 -3.152 9.340 171 HG3 GLU 22 1HG GLU 22 13.254 -1.882 8.226 172 H THR 23 H THR 23 9.592 -0.964 8.999 173 HA THR 23 HA THR 23 7.911 -0.987 11.197 174 HB THR 23 HB THR 23 7.522 0.270 8.480 175 HG1 THR 23 1HG THR 23 8.988 1.014 10.780 176 HG21 THR 23 1HG2 THR 23 5.447 0.265 9.790 177 HG22 THR 23 2HG2 THR 23 6.109 1.894 9.653 178 HG23 THR 23 3HG2 THR 23 6.300 0.986 11.155 179 H LEU 24 H LEU 24 7.199 -1.942 7.813 180 HA LEU 24 HA LEU 24 4.514 -2.629 8.460 181 HB2 LEU 24 2HB LEU 24 6.076 -3.201 5.953 182 HB3 LEU 24 1HB LEU 24 4.348 -3.436 6.153 183 HG LEU 24 HG LEU 24 5.789 -0.789 6.243 184 HD11 LEU 24 1HD1 LEU 24 3.942 -1.987 4.194 185 HD12 LEU 24 2HD1 LEU 24 5.676 -1.719 4.014 186 HD13 LEU 24 3HD1 LEU 24 4.581 -0.346 4.171 187 HD21 LEU 24 1HD2 LEU 24 3.855 -0.771 7.737 188 HD22 LEU 24 2HD2 LEU 24 2.840 -1.427 6.450 189 HD23 LEU 24 3HD2 LEU 24 3.530 0.185 6.294 190 H GLU 25 H GLU 25 7.459 -4.527 8.151 191 HA GLU 25 HA GLU 25 6.289 -7.043 8.071 192 HB2 GLU 25 2HB GLU 25 8.667 -6.523 7.581 193 HB3 GLU 25 1HB GLU 25 8.939 -6.150 9.263 194 HG2 GLU 25 2HG GLU 25 8.082 -8.884 8.376 195 HG3 GLU 25 1HG GLU 25 9.765 -8.385 8.301 196 H THR 26 H THR 26 7.178 -4.879 10.703 197 HA THR 26 HA THR 26 6.490 -6.554 12.885 198 HB THR 26 HB THR 26 6.553 -3.523 12.787 199 HG1 THR 26 1HG THR 26 8.588 -4.168 12.183 200 HG21 THR 26 1HG2 THR 26 7.021 -3.692 15.187 201 HG22 THR 26 2HG2 THR 26 6.944 -5.453 15.078 202 HG23 THR 26 3HG2 THR 26 5.500 -4.498 14.785 203 H VAL 27 H VAL 27 4.736 -3.992 11.115 204 HA VAL 27 HA VAL 27 2.392 -3.982 12.665 205 HB VAL 27 HB VAL 27 2.685 -3.308 9.705 206 HG11 VAL 27 1HG1 VAL 27 0.348 -3.715 10.279 207 HG12 VAL 27 2HG1 VAL 27 0.626 -1.999 9.971 208 HG13 VAL 27 3HG1 VAL 27 0.476 -2.584 11.627 209 HG21 VAL 27 1HG2 VAL 27 2.674 -1.485 12.112 210 HG22 VAL 27 2HG2 VAL 27 2.792 -0.988 10.427 211 HG23 VAL 27 3HG2 VAL 27 4.094 -1.923 11.154 212 H TYR 28 H TYR 28 3.368 -5.970 9.957 213 HA TYR 28 HA TYR 28 0.926 -7.247 9.449 214 HB2 TYR 28 2HB TYR 28 2.955 -7.379 7.990 215 HB3 TYR 28 1HB TYR 28 3.709 -8.422 9.183 216 HD1 TYR 28 1HD TYR 28 3.073 -10.756 9.362 217 HD2 TYR 28 2HD TYR 28 1.085 -8.184 6.628 218 HE1 TYR 28 1HE TYR 28 2.066 -12.717 8.238 219 HE2 TYR 28 2HE TYR 28 0.088 -10.145 5.497 220 HH TYR 28 HH TYR 28 0.189 -13.243 6.861 221 H ARG 29 H ARG 29 3.665 -8.307 11.445 222 HA ARG 29 HA ARG 29 2.410 -10.562 12.540 223 HB2 ARG 29 2HB ARG 29 4.790 -8.969 13.463 224 HB3 ARG 29 1HB ARG 29 4.235 -10.404 14.316 225 HG2 ARG 29 2HG ARG 29 4.978 -10.368 11.406 226 HG3 ARG 29 1HG ARG 29 6.083 -10.808 12.711 227 HD2 ARG 29 2HD ARG 29 3.433 -12.202 12.233 228 HD3 ARG 29 1HD ARG 29 4.967 -12.746 11.572 229 HE ARG 29 HE ARG 29 5.735 -12.845 13.936 230 HH11 ARG 29 1HH1 ARG 29 2.211 -13.197 13.345 231 HH12 ARG 29 2HH1 ARG 29 2.001 -14.335 14.549 232 HH21 ARG 29 1HH2 ARG 29 5.362 -14.434 15.622 233 HH22 ARG 29 2HH2 ARG 29 3.804 -15.066 15.860 234 H ALA 30 H ALA 30 2.279 -7.284 13.477 235 HA ALA 30 HA ALA 30 1.186 -7.718 16.046 236 HB1 ALA 30 1HB ALA 30 2.098 -5.540 15.368 237 HB2 ALA 30 2HB ALA 30 0.437 -5.391 15.942 238 HB3 ALA 30 3HB ALA 30 0.779 -5.347 14.215 239 H LEU 31 H LEU 31 -0.451 -6.942 12.941 240 HA LEU 31 HA LEU 31 -2.944 -7.425 14.222 241 HB2 LEU 31 2HB LEU 31 -2.467 -6.795 11.354 242 HB3 LEU 31 1HB LEU 31 -4.052 -7.129 12.001 243 HG LEU 31 HG LEU 31 -3.486 -5.172 13.630 244 HD11 LEU 31 1HD1 LEU 31 -1.740 -4.543 11.309 245 HD12 LEU 31 2HD1 LEU 31 -1.162 -4.901 12.948 246 HD13 LEU 31 3HD1 LEU 31 -2.135 -3.447 12.625 247 HD21 LEU 31 1HD2 LEU 31 -4.464 -3.621 12.058 248 HD22 LEU 31 2HD2 LEU 31 -5.276 -5.186 12.031 249 HD23 LEU 31 3HD2 LEU 31 -4.153 -4.749 10.746 250 H GLU 32 H GLU 32 -0.975 -9.553 12.250 251 HA GLU 32 HA GLU 32 -3.279 -11.096 11.870 252 HB2 GLU 32 2HB GLU 32 -1.752 -12.974 11.029 253 HB3 GLU 32 1HB GLU 32 -1.959 -11.531 10.046 254 HG2 GLU 32 2HG GLU 32 0.306 -12.189 9.913 255 HG3 GLU 32 1HG GLU 32 0.260 -10.789 10.971 256 H GLU 33 H GLU 33 -0.884 -11.249 14.222 257 HA GLU 33 HA GLU 33 -1.834 -13.522 15.590 258 HB2 GLU 33 2HB GLU 33 -0.613 -10.985 16.659 259 HB3 GLU 33 1HB GLU 33 -1.004 -12.367 17.671 260 HG2 GLU 33 2HG GLU 33 0.872 -12.414 15.330 261 HG3 GLU 33 1HG GLU 33 1.348 -12.294 17.023 262 H LYS 34 H LYS 34 -2.966 -10.237 15.517 263 HA LYS 34 HA LYS 34 -4.954 -10.559 17.587 264 HB2 LYS 34 2HB LYS 34 -4.499 -8.402 15.549 265 HB3 LYS 34 1HB LYS 34 -5.697 -8.304 16.825 266 HG2 LYS 34 2HG LYS 34 -2.731 -8.581 17.253 267 HG3 LYS 34 1HG LYS 34 -3.612 -7.057 17.283 268 HD2 LYS 34 2HD LYS 34 -4.145 -9.393 19.128 269 HD3 LYS 34 1HD LYS 34 -3.163 -7.987 19.518 270 HE2 LYS 34 2HE LYS 34 -5.030 -6.529 19.189 271 HE3 LYS 34 1HE LYS 34 -6.083 -7.887 18.766 272 HZ1 LYS 34 1HZ LYS 34 -5.676 -8.768 21.029 273 HZ2 LYS 34 2HZ LYS 34 -6.406 -7.243 21.061 274 HZ3 LYS 34 3HZ LYS 34 -4.772 -7.392 21.385 275 H GLY 35 H GLY 35 -4.785 -11.458 14.378 276 HA2 GLY 35 2HA GLY 35 -6.326 -12.464 13.016 277 HA3 GLY 35 1HA GLY 35 -7.466 -12.385 14.347 278 H TYR 36 H TYR 36 -6.025 -9.428 13.245 279 HA TYR 36 HA TYR 36 -8.668 -8.600 12.288 280 HB2 TYR 36 2HB TYR 36 -6.177 -6.982 12.795 281 HB3 TYR 36 1HB TYR 36 -7.618 -6.306 12.055 282 HD1 TYR 36 1HD TYR 36 -5.887 -6.813 15.067 283 HD2 TYR 36 2HD TYR 36 -9.814 -6.601 13.478 284 HE1 TYR 36 1HE TYR 36 -6.755 -6.244 17.299 285 HE2 TYR 36 2HE TYR 36 -10.690 -6.022 15.704 286 HH TYR 36 HH TYR 36 -10.066 -6.295 18.011 287 H ASN 37 H ASN 37 -5.978 -9.911 10.990 288 HA ASN 37 HA ASN 37 -5.089 -10.164 8.963 289 HB2 ASN 37 2HB ASN 37 -7.743 -9.066 7.958 290 HB3 ASN 37 1HB ASN 37 -6.532 -9.811 6.923 291 HD21 ASN 37 1HD2 ASN 37 -6.262 -12.071 6.988 292 HD22 ASN 37 2HD2 ASN 37 -7.407 -13.080 7.789 293 HA PRO 38 HA PRO 38 -3.275 -6.074 9.594 294 HB2 PRO 38 2HB PRO 38 -1.046 -6.807 8.024 295 HB3 PRO 38 1HB PRO 38 -1.166 -6.776 9.780 296 HG2 PRO 38 2HG PRO 38 -1.411 -9.067 7.917 297 HG3 PRO 38 1HG PRO 38 -0.912 -9.033 9.613 298 HD2 PRO 38 2HD PRO 38 -3.244 -9.997 8.787 299 HD3 PRO 38 1HD PRO 38 -3.065 -9.215 10.369 300 H ILE 39 H ILE 39 -3.354 -7.555 6.398 301 HA ILE 39 HA ILE 39 -2.491 -5.331 4.951 302 HB ILE 39 HB ILE 39 -4.389 -7.509 4.031 303 HG12 ILE 39 2HG1 ILE 39 -2.245 -8.390 4.848 304 HG13 ILE 39 1HG1 ILE 39 -2.383 -8.590 3.105 305 HG21 ILE 39 1HG2 ILE 39 -3.653 -6.935 1.747 306 HG22 ILE 39 2HG2 ILE 39 -2.732 -5.581 2.398 307 HG23 ILE 39 3HG2 ILE 39 -4.490 -5.591 2.529 308 HD11 ILE 39 1HD1 ILE 39 -0.910 -6.662 2.802 309 HD12 ILE 39 2HD1 ILE 39 -0.148 -7.925 3.765 310 HD13 ILE 39 3HD1 ILE 39 -0.782 -6.484 4.552 311 H ASN 40 H ASN 40 -5.706 -6.165 6.067 312 HA ASN 40 HA ASN 40 -7.123 -4.248 4.528 313 HB2 ASN 40 2HB ASN 40 -7.918 -5.472 7.181 314 HB3 ASN 40 1HB ASN 40 -8.984 -4.539 6.141 315 HD21 ASN 40 1HD2 ASN 40 -7.430 -7.546 6.678 316 HD22 ASN 40 2HD2 ASN 40 -8.240 -8.418 5.419 317 H GLN 41 H GLN 41 -5.723 -4.085 7.796 318 HA GLN 41 HA GLN 41 -6.816 -1.502 8.132 319 HB2 GLN 41 2HB GLN 41 -4.845 -3.019 9.808 320 HB3 GLN 41 1HB GLN 41 -5.606 -1.497 10.270 321 HG2 GLN 41 2HG GLN 41 -7.099 -4.040 9.640 322 HG3 GLN 41 1HG GLN 41 -6.743 -3.452 11.260 323 HE21 GLN 41 1HE2 GLN 41 -7.246 -0.716 10.725 324 HE22 GLN 41 2HE2 GLN 41 -8.947 -0.514 10.514 325 H ILE 42 H ILE 42 -3.753 -2.767 7.051 326 HA ILE 42 HA ILE 42 -2.353 -0.318 7.182 327 HB ILE 42 HB ILE 42 -1.898 -2.642 5.272 328 HG12 ILE 42 2HG1 ILE 42 -0.515 -1.937 7.880 329 HG13 ILE 42 1HG1 ILE 42 -1.692 -3.226 7.679 330 HG21 ILE 42 1HG2 ILE 42 -0.095 -0.291 5.946 331 HG22 ILE 42 2HG2 ILE 42 -0.876 -0.593 4.407 332 HG23 ILE 42 3HG2 ILE 42 0.379 -1.691 4.976 333 HD11 ILE 42 1HD1 ILE 42 -0.159 -4.374 6.158 334 HD12 ILE 42 2HD1 ILE 42 0.581 -4.086 7.732 335 HD13 ILE 42 3HD1 ILE 42 1.012 -3.072 6.355 336 H VAL 43 H VAL 43 -4.112 -1.854 4.446 337 HA VAL 43 HA VAL 43 -3.758 0.317 2.714 338 HB VAL 43 HB VAL 43 -4.498 -1.795 1.730 339 HG11 VAL 43 1HG1 VAL 43 -5.836 -2.652 3.576 340 HG12 VAL 43 2HG1 VAL 43 -6.760 -2.700 2.074 341 HG13 VAL 43 3HG1 VAL 43 -7.077 -1.434 3.265 342 HG21 VAL 43 1HG2 VAL 43 -6.687 0.258 1.436 343 HG22 VAL 43 2HG2 VAL 43 -6.385 -1.084 0.331 344 HG23 VAL 43 3HG2 VAL 43 -5.182 0.198 0.522 345 H GLY 44 H GLY 44 -6.197 -0.266 5.145 346 HA2 GLY 44 2HA GLY 44 -7.838 1.959 4.583 347 HA3 GLY 44 1HA GLY 44 -7.718 1.141 6.135 348 H TYR 45 H TYR 45 -4.934 1.601 6.563 349 HA TYR 45 HA TYR 45 -5.056 4.157 7.751 350 HB2 TYR 45 2HB TYR 45 -3.687 2.453 8.797 351 HB3 TYR 45 1HB TYR 45 -2.677 2.329 7.364 352 HD1 TYR 45 1HD TYR 45 -0.628 3.490 7.379 353 HD2 TYR 45 2HD TYR 45 -3.802 4.925 9.808 354 HE1 TYR 45 1HE TYR 45 0.844 5.248 8.269 355 HE2 TYR 45 2HE TYR 45 -2.328 6.665 10.695 356 HH TYR 45 HH TYR 45 0.681 7.440 9.362 357 H LEU 46 H LEU 46 -3.091 2.988 5.033 358 HA LEU 46 HA LEU 46 -1.963 5.533 4.651 359 HB2 LEU 46 2HB LEU 46 -2.029 3.189 2.789 360 HB3 LEU 46 1HB LEU 46 -1.280 4.700 2.326 361 HG LEU 46 HG LEU 46 0.259 4.405 4.352 362 HD11 LEU 46 1HD1 LEU 46 0.557 2.239 5.290 363 HD12 LEU 46 2HD1 LEU 46 -0.792 1.630 4.335 364 HD13 LEU 46 3HD1 LEU 46 -1.084 2.833 5.587 365 HD21 LEU 46 1HD2 LEU 46 1.014 3.984 2.093 366 HD22 LEU 46 2HD2 LEU 46 0.377 2.340 2.173 367 HD23 LEU 46 3HD2 LEU 46 1.712 2.823 3.219 368 H LEU 47 H LEU 47 -4.885 4.177 3.334 369 HA LEU 47 HA LEU 47 -5.157 6.327 1.458 370 HB2 LEU 47 2HB LEU 47 -7.151 4.236 2.313 371 HB3 LEU 47 1HB LEU 47 -7.414 5.400 1.037 372 HG LEU 47 HG LEU 47 -5.353 3.194 1.036 373 HD11 LEU 47 1HD1 LEU 47 -6.690 2.272 -0.786 374 HD12 LEU 47 2HD1 LEU 47 -7.874 3.565 -0.569 375 HD13 LEU 47 3HD1 LEU 47 -7.607 2.388 0.715 376 HD21 LEU 47 1HD2 LEU 47 -4.921 3.870 -1.294 377 HD22 LEU 47 2HD2 LEU 47 -4.494 5.127 -0.142 378 HD23 LEU 47 3HD2 LEU 47 -5.992 5.259 -1.074 379 H SER 48 H SER 48 -5.519 6.353 4.767 380 HA SER 48 HA SER 48 -7.464 8.565 4.509 381 HB2 SER 48 2HB SER 48 -8.294 7.969 6.759 382 HB3 SER 48 1HB SER 48 -8.552 6.680 5.575 383 HG SER 48 HG SER 48 -7.121 5.461 6.542 384 H GLY 49 H GLY 49 -4.529 7.351 5.963 385 HA2 GLY 49 2HA GLY 49 -2.745 8.603 6.727 386 HA3 GLY 49 1HA GLY 49 -3.766 10.030 6.709 387 H ASP 50 H ASP 50 -5.620 7.862 8.246 388 HA ASP 50 HA ASP 50 -4.973 9.188 10.750 389 HB2 ASP 50 2HB ASP 50 -7.261 9.300 9.819 390 HB3 ASP 50 1HB ASP 50 -7.412 7.567 10.060 391 HA PRO 51 HA PRO 51 -2.812 5.602 12.274 392 HB2 PRO 51 2HB PRO 51 -2.810 6.379 14.917 393 HB3 PRO 51 1HB PRO 51 -1.628 6.845 13.694 394 HG2 PRO 51 2HG PRO 51 -3.980 8.358 14.736 395 HG3 PRO 51 1HG PRO 51 -2.388 8.965 14.259 396 HD2 PRO 51 2HD PRO 51 -4.570 9.247 12.721 397 HD3 PRO 51 1HD PRO 51 -2.949 9.031 12.022 398 H ALA 52 H ALA 52 -5.953 6.474 13.456 399 HA ALA 52 HA ALA 52 -6.318 4.517 15.403 400 HB1 ALA 52 1HB ALA 52 -8.431 5.687 13.611 401 HB2 ALA 52 2HB ALA 52 -7.808 6.433 15.083 402 HB3 ALA 52 3HB ALA 52 -8.684 4.908 15.175 403 H TYR 53 H TYR 53 -5.995 4.021 12.072 404 HA TYR 53 HA TYR 53 -7.594 1.705 11.847 405 HB2 TYR 53 2HB TYR 53 -5.471 2.869 10.125 406 HB3 TYR 53 1HB TYR 53 -6.112 1.258 9.793 407 HD1 TYR 53 1HD TYR 53 -8.387 0.935 9.202 408 HD2 TYR 53 2HD TYR 53 -6.849 4.814 9.865 409 HE1 TYR 53 1HE TYR 53 -10.350 1.852 8.164 410 HE2 TYR 53 2HE TYR 53 -8.802 5.783 8.817 411 HH TYR 53 HH TYR 53 -11.594 3.921 8.148 412 H ILE 54 H ILE 54 -4.386 2.183 13.136 413 HA ILE 54 HA ILE 54 -3.989 -0.707 12.976 414 HB ILE 54 HB ILE 54 -1.925 1.403 13.765 415 HG12 ILE 54 2HG1 ILE 54 -2.523 1.561 11.371 416 HG13 ILE 54 1HG1 ILE 54 -0.905 0.905 11.586 417 HG21 ILE 54 1HG2 ILE 54 -0.300 -0.397 13.600 418 HG22 ILE 54 2HG2 ILE 54 -1.595 -1.540 13.259 419 HG23 ILE 54 3HG2 ILE 54 -1.517 -0.751 14.830 420 HD11 ILE 54 1HD1 ILE 54 -3.382 -0.683 10.942 421 HD12 ILE 54 2HD1 ILE 54 -1.763 -1.345 11.165 422 HD13 ILE 54 3HD1 ILE 54 -2.096 -0.256 9.819 423 HA PRO 55 HA PRO 55 -5.322 -0.812 17.256 424 HB2 PRO 55 2HB PRO 55 -4.716 -3.653 17.134 425 HB3 PRO 55 1HB PRO 55 -6.286 -2.873 17.331 426 HG2 PRO 55 2HG PRO 55 -5.453 -4.217 15.100 427 HG3 PRO 55 1HG PRO 55 -6.739 -2.990 15.106 428 HD2 PRO 55 2HD PRO 55 -3.939 -2.827 14.145 429 HD3 PRO 55 1HD PRO 55 -5.386 -1.935 13.625 430 H ARG 56 H ARG 56 -4.238 -1.059 19.171 431 HA ARG 56 HA ARG 56 -1.408 -1.181 18.750 432 HB2 ARG 56 2HB ARG 56 -1.188 -0.114 21.012 433 HB3 ARG 56 1HB ARG 56 -1.962 0.837 19.759 434 HG2 ARG 56 2HG ARG 56 -4.146 0.311 20.706 435 HG3 ARG 56 1HG ARG 56 -3.356 -0.613 21.990 436 HD2 ARG 56 2HD ARG 56 -2.180 1.358 22.727 437 HD3 ARG 56 1HD ARG 56 -2.850 2.287 21.392 438 HE ARG 56 HE ARG 56 -4.971 1.252 22.803 439 HH11 ARG 56 1HH1 ARG 56 -2.266 3.469 23.336 440 HH12 ARG 56 2HH1 ARG 56 -3.058 4.421 24.489 441 HH21 ARG 56 1HH2 ARG 56 -6.117 2.603 24.390 442 HH22 ARG 56 2HH2 ARG 56 -5.314 3.921 25.089 443 H TYR 57 H TYR 57 -1.570 -3.433 18.475 444 HA TYR 57 HA TYR 57 -1.416 -5.026 20.882 445 HB2 TYR 57 2HB TYR 57 -2.048 -6.174 18.850 446 HB3 TYR 57 1HB TYR 57 -0.604 -5.599 18.022 447 HD1 TYR 57 1HD TYR 57 -1.770 -7.842 20.752 448 HD2 TYR 57 2HD TYR 57 1.431 -6.792 18.156 449 HE1 TYR 57 1HE TYR 57 -0.565 -9.831 21.456 450 HE2 TYR 57 2HE TYR 57 2.676 -8.762 18.868 451 HH TYR 57 HH TYR 57 1.218 -11.296 20.603 452 H GLN 58 H GLN 58 0.793 -3.290 18.830 453 HA GLN 58 HA GLN 58 2.912 -3.710 20.762 454 HB2 GLN 58 2HB GLN 58 2.997 -5.563 19.009 455 HB3 GLN 58 1HB GLN 58 3.290 -4.318 17.808 456 HG2 GLN 58 2HG GLN 58 5.384 -3.718 19.042 457 HG3 GLN 58 1HG GLN 58 5.026 -5.073 20.127 458 HE21 GLN 58 1HE2 GLN 58 4.057 -6.814 17.997 459 HE22 GLN 58 2HE2 GLN 58 5.462 -7.273 17.118 460 H ASP 59 H ASP 59 4.886 -2.330 19.851 461 HA ASP 59 HA ASP 59 4.178 0.371 19.702 462 HB2 ASP 59 2HB ASP 59 6.781 -0.726 18.677 463 HB3 ASP 59 1HB ASP 59 6.468 0.844 19.358 464 H ALA 60 H ALA 60 4.097 -1.931 17.315 465 HA ALA 60 HA ALA 60 5.001 -0.847 14.962 466 HB1 ALA 60 1HB ALA 60 4.096 -3.114 15.236 467 HB2 ALA 60 2HB ALA 60 3.452 -2.289 13.822 468 HB3 ALA 60 3HB ALA 60 2.466 -2.444 15.278 469 H ARG 61 H ARG 61 1.984 -0.047 16.625 470 HA ARG 61 HA ARG 61 0.932 1.454 14.503 471 HB2 ARG 61 2HB ARG 61 -0.701 2.344 16.116 472 HB3 ARG 61 1HB ARG 61 -0.519 0.615 16.292 473 HG2 ARG 61 2HG ARG 61 -0.690 1.389 18.474 474 HG3 ARG 61 1HG ARG 61 1.048 1.192 18.265 475 HD2 ARG 61 2HD ARG 61 0.505 3.297 19.407 476 HD3 ARG 61 1HD ARG 61 1.259 3.600 17.837 477 HE ARG 61 HE ARG 61 -1.597 3.516 17.728 478 HH11 ARG 61 1HH1 ARG 61 1.088 5.677 18.509 479 HH12 ARG 61 2HH1 ARG 61 0.260 7.080 17.981 480 HH21 ARG 61 1HH2 ARG 61 -2.718 5.407 17.109 481 HH22 ARG 61 2HH2 ARG 61 -1.958 6.944 17.203 482 H ASN 62 H ASN 62 3.195 2.271 17.038 483 HA ASN 62 HA ASN 62 3.187 5.082 16.440 484 HB2 ASN 62 2HB ASN 62 3.906 4.032 18.706 485 HB3 ASN 62 1HB ASN 62 5.343 3.531 17.862 486 HD21 ASN 62 1HD2 ASN 62 6.632 4.799 19.233 487 HD22 ASN 62 2HD2 ASN 62 6.730 6.520 19.043 488 H LEU 63 H LEU 63 5.008 2.229 15.572 489 HA LEU 63 HA LEU 63 7.141 3.441 14.188 490 HB2 LEU 63 2HB LEU 63 5.876 0.749 13.656 491 HB3 LEU 63 1HB LEU 63 7.431 1.274 13.058 492 HG LEU 63 HG LEU 63 6.729 0.776 15.955 493 HD11 LEU 63 1HD1 LEU 63 8.505 -0.751 14.055 494 HD12 LEU 63 2HD1 LEU 63 6.930 -1.280 14.634 495 HD13 LEU 63 3HD1 LEU 63 8.272 -1.106 15.764 496 HD21 LEU 63 1HD2 LEU 63 9.360 1.540 14.692 497 HD22 LEU 63 2HD2 LEU 63 9.102 1.131 16.391 498 HD23 LEU 63 3HD2 LEU 63 8.356 2.574 15.707 499 H ILE 64 H ILE 64 3.921 2.468 13.122 500 HA ILE 64 HA ILE 64 4.465 3.049 10.380 501 HB ILE 64 HB ILE 64 2.707 1.391 11.225 502 HG12 ILE 64 2HG1 ILE 64 1.670 3.470 9.286 503 HG13 ILE 64 1HG1 ILE 64 2.784 2.174 8.861 504 HG21 ILE 64 1HG2 ILE 64 1.132 3.912 11.705 505 HG22 ILE 64 2HG2 ILE 64 1.693 2.777 12.932 506 HG23 ILE 64 3HG2 ILE 64 0.478 2.276 11.754 507 HD11 ILE 64 1HD1 ILE 64 1.070 0.521 9.465 508 HD12 ILE 64 2HD1 ILE 64 0.516 1.615 8.201 509 HD13 ILE 64 3HD1 ILE 64 -0.043 1.832 9.861 510 H ARG 65 H ARG 65 3.820 4.955 13.065 511 HA ARG 65 HA ARG 65 2.776 7.219 11.624 512 HB2 ARG 65 2HB ARG 65 3.601 6.771 14.471 513 HB3 ARG 65 1HB ARG 65 3.304 8.387 13.862 514 HG2 ARG 65 2HG ARG 65 1.316 6.125 13.877 515 HG3 ARG 65 1HG ARG 65 1.360 7.485 15.010 516 HD2 ARG 65 2HD ARG 65 0.846 7.608 12.030 517 HD3 ARG 65 1HD ARG 65 -0.260 8.002 13.334 518 HE ARG 65 HE ARG 65 1.855 9.640 13.744 519 HH11 ARG 65 1HH1 ARG 65 -0.429 9.128 11.088 520 HH12 ARG 65 2HH1 ARG 65 -0.286 10.737 10.511 521 HH21 ARG 65 1HH2 ARG 65 2.090 11.745 12.903 522 HH22 ARG 65 2HH2 ARG 65 1.189 12.252 11.539 523 H ARG 66 H ARG 66 5.802 5.847 12.347 524 HA ARG 66 HA ARG 66 7.375 8.255 12.477 525 HB2 ARG 66 2HB ARG 66 8.200 5.394 12.016 526 HB3 ARG 66 1HB ARG 66 9.300 6.734 12.269 527 HG2 ARG 66 2HG ARG 66 7.267 5.762 14.255 528 HG3 ARG 66 1HG ARG 66 8.982 5.347 14.269 529 HD2 ARG 66 2HD ARG 66 9.477 7.791 14.434 530 HD3 ARG 66 1HD ARG 66 7.745 8.072 14.620 531 HE ARG 66 HE ARG 66 8.381 6.188 16.473 532 HH11 ARG 66 1HH1 ARG 66 9.387 9.495 15.822 533 HH12 ARG 66 2HH1 ARG 66 9.817 9.844 17.430 534 HH21 ARG 66 1HH2 ARG 66 8.999 6.639 18.678 535 HH22 ARG 66 2HH2 ARG 66 9.582 8.194 19.084 536 H HIS 67 H HIS 67 6.169 6.243 10.014 537 HA HIS 67 HA HIS 67 7.818 7.664 8.048 538 HB2 HIS 67 2HB HIS 67 6.614 4.887 7.842 539 HB3 HIS 67 1HB HIS 67 7.389 5.732 6.511 540 HD1 HIS 67 1HD HIS 67 9.914 5.734 6.444 541 HD2 HIS 67 2HD HIS 67 8.380 3.942 9.861 542 HE1 HIS 67 1HE HIS 67 11.852 4.487 7.502 543 HE2 HIS 67 2HE HIS 67 10.845 3.286 9.469 544 H GLU 68 H GLU 68 6.769 8.674 6.443 545 HA GLU 68 HA GLU 68 4.055 9.324 7.002 546 HB2 GLU 68 2HB GLU 68 5.850 10.131 4.713 547 HB3 GLU 68 1HB GLU 68 4.235 10.774 4.962 548 HG2 GLU 68 2HG GLU 68 6.527 11.024 6.907 549 HG3 GLU 68 1HG GLU 68 5.993 12.281 5.793 550 H ARG 69 H ARG 69 2.258 9.139 5.552 551 HA ARG 69 HA ARG 69 1.982 6.439 4.769 552 HB2 ARG 69 2HB ARG 69 0.134 8.777 4.264 553 HB3 ARG 69 1HB ARG 69 -0.233 7.139 3.800 554 HG2 ARG 69 2HG ARG 69 -1.456 7.537 5.761 555 HG3 ARG 69 1HG ARG 69 -0.116 6.535 6.251 556 HD2 ARG 69 2HD ARG 69 -0.095 9.545 6.569 557 HD3 ARG 69 1HD ARG 69 -0.767 8.484 7.788 558 HE ARG 69 HE ARG 69 1.735 7.511 7.525 559 HH11 ARG 69 1HH1 ARG 69 0.609 10.862 7.871 560 HH12 ARG 69 2HH1 ARG 69 1.988 11.346 8.741 561 HH21 ARG 69 1HH2 ARG 69 3.616 8.270 8.803 562 HH22 ARG 69 2HH2 ARG 69 3.696 9.906 9.232 563 H ASP 70 H ASP 70 2.282 9.428 2.963 564 HA ASP 70 HA ASP 70 2.168 8.175 0.433 565 HB2 ASP 70 2HB ASP 70 3.072 10.297 -0.506 566 HB3 ASP 70 1HB ASP 70 1.721 10.573 0.573 567 H GLU 71 H GLU 71 4.814 8.967 2.565 568 HA GLU 71 HA GLU 71 7.071 8.299 1.086 569 HB2 GLU 71 2HB GLU 71 7.100 9.213 3.353 570 HB3 GLU 71 1HB GLU 71 6.421 7.726 3.987 571 HG2 GLU 71 2HG GLU 71 8.524 6.592 3.163 572 HG3 GLU 71 1HG GLU 71 9.169 8.210 2.875 573 H ILE 72 H ILE 72 5.119 6.225 3.178 574 HA ILE 72 HA ILE 72 6.369 3.772 2.586 575 HB ILE 72 HB ILE 72 3.545 4.262 3.569 576 HG12 ILE 72 2HG1 ILE 72 6.084 3.667 5.121 577 HG13 ILE 72 1HG1 ILE 72 5.256 5.214 5.056 578 HG21 ILE 72 1HG2 ILE 72 3.772 2.018 2.657 579 HG22 ILE 72 2HG2 ILE 72 3.629 1.951 4.415 580 HG23 ILE 72 3HG2 ILE 72 5.204 1.740 3.648 581 HD11 ILE 72 1HD1 ILE 72 4.135 2.672 6.211 582 HD12 ILE 72 2HD1 ILE 72 3.314 4.231 6.158 583 HD13 ILE 72 3HD1 ILE 72 4.773 4.034 7.132 584 H MET 73 H MET 73 3.459 5.298 1.266 585 HA MET 73 HA MET 73 2.619 3.108 -0.285 586 HB2 MET 73 2HB MET 73 1.291 5.206 0.424 587 HB3 MET 73 1HB MET 73 2.052 5.999 -0.935 588 HG2 MET 73 2HG MET 73 0.268 3.571 -1.117 589 HG3 MET 73 1HG MET 73 -0.243 5.224 -1.408 590 HE1 MET 73 1HE MET 73 -0.392 3.622 -4.953 591 HE2 MET 73 2HE MET 73 -1.258 4.487 -3.679 592 HE3 MET 73 3HE MET 73 -0.755 2.819 -3.422 593 H GLU 74 H GLU 74 4.647 5.929 -1.108 594 HA GLU 74 HA GLU 74 5.047 5.346 -3.808 595 HB2 GLU 74 2HB GLU 74 6.945 6.576 -1.822 596 HB3 GLU 74 1HB GLU 74 7.262 6.486 -3.542 597 HG2 GLU 74 2HG GLU 74 5.308 7.877 -3.959 598 HG3 GLU 74 1HG GLU 74 5.014 7.970 -2.217 599 H GLU 75 H GLU 75 6.806 4.251 -0.950 600 HA GLU 75 HA GLU 75 8.758 2.780 -2.353 601 HB2 GLU 75 2HB GLU 75 8.872 3.493 0.066 602 HB3 GLU 75 1HB GLU 75 7.732 2.199 0.412 603 HG2 GLU 75 2HG GLU 75 9.987 1.470 0.910 604 HG3 GLU 75 1HG GLU 75 9.334 0.560 -0.452 605 H LEU 76 H LEU 76 5.594 1.920 -1.038 606 HA LEU 76 HA LEU 76 5.645 -0.842 -1.538 607 HB2 LEU 76 2HB LEU 76 3.267 1.012 -1.770 608 HB3 LEU 76 1HB LEU 76 3.185 -0.728 -1.664 609 HG LEU 76 HG LEU 76 4.095 1.155 0.510 610 HD11 LEU 76 1HD1 LEU 76 2.072 0.421 1.652 611 HD12 LEU 76 2HD1 LEU 76 1.635 -0.558 0.253 612 HD13 LEU 76 3HD1 LEU 76 1.691 1.197 0.114 613 HD21 LEU 76 1HD2 LEU 76 3.804 -1.846 0.528 614 HD22 LEU 76 2HD2 LEU 76 4.147 -0.837 1.933 615 HD23 LEU 76 3HD2 LEU 76 5.319 -0.946 0.623 616 H THR 77 H THR 77 4.504 1.843 -3.599 617 HA THR 77 HA THR 77 3.832 0.254 -5.790 618 HB THR 77 HB THR 77 4.702 3.161 -5.745 619 HG1 THR 77 1HG THR 77 2.932 3.126 -4.442 620 HG21 THR 77 1HG2 THR 77 4.601 2.184 -8.013 621 HG22 THR 77 2HG2 THR 77 3.311 3.359 -7.765 622 HG23 THR 77 3HG2 THR 77 2.958 1.633 -7.696 623 H LYS 78 H LYS 78 6.820 1.992 -4.982 624 HA LYS 78 HA LYS 78 8.198 1.451 -7.355 625 HB2 LYS 78 2HB LYS 78 9.236 2.064 -4.614 626 HB3 LYS 78 1HB LYS 78 10.271 1.933 -6.031 627 HG2 LYS 78 2HG LYS 78 9.038 3.697 -7.098 628 HG3 LYS 78 1HG LYS 78 8.008 3.872 -5.682 629 HD2 LYS 78 2HD LYS 78 11.005 4.316 -5.746 630 HD3 LYS 78 1HD LYS 78 9.772 5.580 -5.722 631 HE2 LYS 78 2HE LYS 78 8.970 4.723 -3.576 632 HE3 LYS 78 1HE LYS 78 10.245 3.502 -3.636 633 HZ1 LYS 78 1HZ LYS 78 11.888 5.218 -3.534 634 HZ2 LYS 78 2HZ LYS 78 10.832 5.363 -2.238 635 HZ3 LYS 78 3HZ LYS 78 10.698 6.431 -3.536 636 H TYR 79 H TYR 79 8.355 -0.222 -4.271 637 HA TYR 79 HA TYR 79 10.291 -2.079 -5.141 638 HB2 TYR 79 2HB TYR 79 9.827 -1.580 -2.771 639 HB3 TYR 79 1HB TYR 79 8.274 -2.387 -2.923 640 HD1 TYR 79 1HD TYR 79 11.879 -3.020 -3.492 641 HD2 TYR 79 2HD TYR 79 8.138 -4.602 -2.287 642 HE1 TYR 79 1HE TYR 79 12.986 -5.129 -2.868 643 HE2 TYR 79 2HE TYR 79 9.219 -6.720 -1.666 644 HH TYR 79 HH TYR 79 12.607 -6.989 -1.428 645 H TYR 80 H TYR 80 6.801 -2.136 -5.121 646 HA TYR 80 HA TYR 80 6.311 -4.771 -5.891 647 HB2 TYR 80 2HB TYR 80 4.642 -3.085 -5.123 648 HB3 TYR 80 1HB TYR 80 4.827 -2.246 -6.647 649 HD1 TYR 80 1HD TYR 80 3.457 -5.180 -4.968 650 HD2 TYR 80 2HD TYR 80 3.755 -3.092 -8.655 651 HE1 TYR 80 1HE TYR 80 1.587 -6.498 -5.853 652 HE2 TYR 80 2HE TYR 80 1.891 -4.398 -9.557 653 HH TYR 80 HH TYR 80 -0.119 -6.262 -7.574 654 H LEU 81 H LEU 81 6.803 -1.839 -7.815 655 HA LEU 81 HA LEU 81 6.684 -3.174 -10.321 656 HB2 LEU 81 2HB LEU 81 7.627 -0.431 -9.588 657 HB3 LEU 81 1HB LEU 81 7.457 -1.005 -11.241 658 HG LEU 81 HG LEU 81 5.225 -0.715 -9.230 659 HD11 LEU 81 1HD1 LEU 81 4.450 1.078 -10.706 660 HD12 LEU 81 2HD1 LEU 81 5.912 0.878 -11.679 661 HD13 LEU 81 3HD1 LEU 81 6.034 1.427 -10.010 662 HD21 LEU 81 1HD2 LEU 81 3.762 -1.198 -11.146 663 HD22 LEU 81 2HD2 LEU 81 4.799 -2.567 -10.747 664 HD23 LEU 81 3HD2 LEU 81 5.187 -1.543 -12.124 665 H ALA 82 H ALA 82 9.368 -2.205 -8.222 666 HA ALA 82 HA ALA 82 11.424 -2.556 -10.089 667 HB1 ALA 82 1HB ALA 82 11.733 -1.425 -7.933 668 HB2 ALA 82 2HB ALA 82 12.920 -2.709 -8.177 669 HB3 ALA 82 3HB ALA 82 11.546 -2.972 -7.100 670 H ASN 83 H ASN 83 9.627 -4.809 -8.193 671 HA ASN 83 HA ASN 83 11.381 -7.028 -8.668 672 HB2 ASN 83 2HB ASN 83 8.604 -6.845 -7.544 673 HB3 ASN 83 1HB ASN 83 9.363 -8.403 -7.825 674 HD21 ASN 83 1HD2 ASN 83 11.172 -5.592 -6.738 675 HD22 ASN 83 2HD2 ASN 83 11.484 -6.176 -5.144 676 H HIS 84 H HIS 84 9.643 -5.408 -10.829 677 HA HIS 84 HA HIS 84 9.126 -7.819 -12.424 678 HB2 HIS 84 2HB HIS 84 7.910 -5.062 -12.705 679 HB3 HIS 84 1HB HIS 84 7.722 -6.329 -13.915 680 HD1 HIS 84 1HD HIS 84 6.428 -8.518 -13.077 681 HD2 HIS 84 2HD HIS 84 6.159 -5.170 -10.642 682 HE1 HIS 84 1HE HIS 84 4.587 -9.021 -11.460 683 HE2 HIS 84 2HE HIS 84 4.775 -7.186 -9.778 684 H GLY 85 H GLY 85 11.629 -6.244 -11.903 685 HA2 GLY 85 2HA GLY 85 13.552 -5.995 -13.145 686 HA3 GLY 85 1HA GLY 85 12.652 -6.463 -14.580 687 H ILE 86 H ILE 86 11.303 -3.968 -12.755 688 HA ILE 86 HA ILE 86 12.011 -2.037 -14.810 689 HB ILE 86 HB ILE 86 9.948 -1.985 -12.597 690 HG12 ILE 86 2HG1 ILE 86 9.669 -2.088 -15.605 691 HG13 ILE 86 1HG1 ILE 86 9.342 -3.402 -14.484 692 HG21 ILE 86 1HG2 ILE 86 9.171 0.156 -13.493 693 HG22 ILE 86 2HG2 ILE 86 10.512 0.161 -14.631 694 HG23 ILE 86 3HG2 ILE 86 10.829 0.268 -12.899 695 HD11 ILE 86 1HD1 ILE 86 7.873 -0.789 -14.570 696 HD12 ILE 86 2HD1 ILE 86 7.502 -2.172 -13.534 697 HD13 ILE 86 3HD1 ILE 86 7.304 -2.301 -15.287 698 H ASP 87 H ASP 87 13.410 -0.460 -14.436 699 HA ASP 87 HA ASP 87 14.437 -0.283 -11.705 700 HB2 ASP 87 2HB ASP 87 16.125 -0.719 -13.477 701 HB3 ASP 87 1HB ASP 87 15.701 0.827 -14.218 702 H ILE 88 H ILE 88 13.852 1.287 -10.528 703 HA ILE 88 HA ILE 88 12.505 3.588 -11.731 704 HB ILE 88 HB ILE 88 12.455 2.510 -8.898 705 HG12 ILE 88 2HG1 ILE 88 10.408 2.369 -11.112 706 HG13 ILE 88 1HG1 ILE 88 11.416 1.037 -10.564 707 HG21 ILE 88 1HG2 ILE 88 10.615 4.051 -8.488 708 HG22 ILE 88 2HG2 ILE 88 10.739 4.679 -10.131 709 HG23 ILE 88 3HG2 ILE 88 12.051 4.952 -8.976 710 HD11 ILE 88 1HD1 ILE 88 9.366 2.481 -8.936 711 HD12 ILE 88 2HD1 ILE 88 10.325 1.088 -8.417 712 HD13 ILE 88 3HD1 ILE 88 9.148 0.921 -9.723 713 H LYS 89 H LYS 89 13.174 5.639 -11.247 714 HA LYS 89 HA LYS 89 15.938 5.785 -10.277 715 HB2 LYS 89 2HB LYS 89 14.372 7.934 -11.716 716 HB3 LYS 89 1HB LYS 89 16.099 7.900 -11.430 717 HG2 LYS 89 2HG LYS 89 14.548 6.054 -13.241 718 HG3 LYS 89 1HG LYS 89 15.612 7.366 -13.741 719 HD2 LYS 89 2HD LYS 89 17.525 6.172 -12.764 720 HD3 LYS 89 1HD LYS 89 16.443 4.876 -12.239 721 HE2 LYS 89 2HE LYS 89 15.836 4.468 -14.586 722 HE3 LYS 89 1HE LYS 89 16.961 5.727 -15.081 723 HZ1 LYS 89 1HZ LYS 89 17.667 3.218 -13.660 724 HZ2 LYS 89 2HZ LYS 89 18.776 4.405 -14.158 725 HZ3 LYS 89 3HZ LYS 89 17.916 3.526 -15.298 726 H1 MET 1 H MET 1 -6.662 25.177 10.850 727 HA MET 1 HA MET 1 -8.205 25.648 8.629 728 HB2 MET 1 2HB MET 1 -5.240 25.686 8.008 729 HB3 MET 1 1HB MET 1 -6.499 25.445 6.813 730 HG2 MET 1 2HG MET 1 -5.740 27.717 6.701 731 HG3 MET 1 1HG MET 1 -7.379 27.694 7.341 732 HE1 MET 1 1HE MET 1 -7.149 30.201 8.179 733 HE2 MET 1 2HE MET 1 -5.523 30.250 7.498 734 HE3 MET 1 3HE MET 1 -5.799 30.787 9.154 735 H GLY 2 H GLY 2 -9.119 23.738 8.896 736 HA2 GLY 2 2HA GLY 2 -7.455 21.370 9.244 737 HA3 GLY 2 1HA GLY 2 -9.207 21.457 9.436 738 H PHE 3 H PHE 3 -6.607 21.495 7.112 739 HA PHE 3 HA PHE 3 -8.197 21.435 4.791 740 HB2 PHE 3 2HB PHE 3 -5.373 20.435 5.187 741 HB3 PHE 3 1HB PHE 3 -6.157 20.647 3.629 742 HD1 PHE 3 1HD PHE 3 -6.945 23.008 3.031 743 HD2 PHE 3 2HD PHE 3 -4.202 22.177 6.175 744 HE1 PHE 3 1HE PHE 3 -6.149 25.335 2.945 745 HE2 PHE 3 2HE PHE 3 -3.405 24.502 6.100 746 HZ PHE 3 HZ PHE 3 -4.380 26.085 4.480 747 H THR 4 H THR 4 -8.860 19.782 3.495 748 HA THR 4 HA THR 4 -8.550 17.108 4.557 749 HB THR 4 HB THR 4 -10.724 17.763 5.331 750 HG1 THR 4 1HG THR 4 -10.544 15.646 4.322 751 HG21 THR 4 1HG2 THR 4 -11.397 18.566 2.491 752 HG22 THR 4 2HG2 THR 4 -11.150 19.666 3.845 753 HG23 THR 4 3HG2 THR 4 -12.525 18.562 3.847 754 H ASP 5 H ASP 5 -7.291 16.226 3.077 755 HA ASP 5 HA ASP 5 -7.724 16.745 0.267 756 HB2 ASP 5 2HB ASP 5 -5.405 16.336 1.243 757 HB3 ASP 5 1HB ASP 5 -5.891 14.667 1.515 758 H GLU 6 H GLU 6 -9.372 15.847 -0.611 759 HA GLU 6 HA GLU 6 -10.662 13.665 0.719 760 HB2 GLU 6 2HB GLU 6 -12.505 14.109 -0.844 761 HB3 GLU 6 1HB GLU 6 -12.024 15.490 0.129 762 HG2 GLU 6 2HG GLU 6 -10.735 16.349 -1.794 763 HG3 GLU 6 1HG GLU 6 -11.332 14.992 -2.748 764 H THR 7 H THR 7 -11.027 11.698 0.025 765 HA THR 7 HA THR 7 -9.828 10.879 -2.506 766 HB THR 7 HB THR 7 -10.491 9.205 -0.055 767 HG1 THR 7 1HG THR 7 -7.916 10.077 -0.954 768 HG21 THR 7 1HG2 THR 7 -10.430 7.937 -2.173 769 HG22 THR 7 2HG2 THR 7 -9.059 7.515 -1.144 770 HG23 THR 7 3HG2 THR 7 -8.829 8.592 -2.519 771 H VAL 8 H VAL 8 -11.355 10.517 -4.011 772 HA VAL 8 HA VAL 8 -14.092 10.291 -3.199 773 HB VAL 8 HB VAL 8 -14.618 10.209 -5.669 774 HG11 VAL 8 1HG1 VAL 8 -13.997 12.548 -6.084 775 HG12 VAL 8 2HG1 VAL 8 -12.854 12.475 -4.741 776 HG13 VAL 8 3HG1 VAL 8 -14.582 12.319 -4.436 777 HG21 VAL 8 1HG2 VAL 8 -12.532 9.205 -6.442 778 HG22 VAL 8 2HG2 VAL 8 -11.643 10.639 -5.934 779 HG23 VAL 8 3HG2 VAL 8 -12.819 10.751 -7.244 780 H ARG 9 H ARG 9 -15.436 8.590 -3.381 781 HA ARG 9 HA ARG 9 -14.018 6.059 -3.234 782 HB2 ARG 9 2HB ARG 9 -16.904 6.655 -2.514 783 HB3 ARG 9 1HB ARG 9 -16.101 5.125 -2.309 784 HG2 ARG 9 2HG ARG 9 -16.271 6.187 -0.179 785 HG3 ARG 9 1HG ARG 9 -14.576 6.218 -0.657 786 HD2 ARG 9 2HD ARG 9 -14.753 8.536 -1.285 787 HD3 ARG 9 1HD ARG 9 -16.494 8.506 -1.031 788 HE ARG 9 HE ARG 9 -15.257 7.739 1.323 789 HH11 ARG 9 1HH1 ARG 9 -15.450 10.651 -0.693 790 HH12 ARG 9 2HH1 ARG 9 -15.404 11.743 0.611 791 HH21 ARG 9 1HH2 ARG 9 -15.233 9.230 3.114 792 HH22 ARG 9 2HH2 ARG 9 -15.311 10.913 2.842 793 H PHE 10 H PHE 10 -14.078 4.618 -4.769 794 HA PHE 10 HA PHE 10 -16.399 4.431 -6.504 795 HB2 PHE 10 2HB PHE 10 -13.552 4.592 -7.503 796 HB3 PHE 10 1HB PHE 10 -14.888 3.988 -8.459 797 HD1 PHE 10 1HD PHE 10 -16.906 5.650 -8.698 798 HD2 PHE 10 2HD PHE 10 -12.940 6.793 -7.678 799 HE1 PHE 10 1HE PHE 10 -17.364 7.926 -9.495 800 HE2 PHE 10 2HE PHE 10 -13.393 9.067 -8.479 801 HZ PHE 10 HZ PHE 10 -15.597 9.640 -9.386 802 H ASP 11 H ASP 11 -16.876 2.397 -7.070 803 HA ASP 11 HA ASP 11 -14.858 0.380 -6.798 804 HB2 ASP 11 2HB ASP 11 -16.198 -1.172 -5.496 805 HB3 ASP 11 1HB ASP 11 -16.089 0.333 -4.606 806 H PHE 12 H PHE 12 -14.835 -0.688 -8.604 807 HA PHE 12 HA PHE 12 -17.344 -1.155 -10.024 808 HB2 PHE 12 2HB PHE 12 -14.854 -0.015 -11.314 809 HB3 PHE 12 1HB PHE 12 -16.258 -0.599 -12.190 810 HD1 PHE 12 1HD PHE 12 -14.728 2.170 -10.513 811 HD2 PHE 12 2HD PHE 12 -18.448 0.622 -11.864 812 HE1 PHE 12 1HE PHE 12 -15.704 4.422 -10.407 813 HE2 PHE 12 2HE PHE 12 -19.426 2.865 -11.761 814 HZ PHE 12 HZ PHE 12 -18.056 4.774 -11.033 815 H ASP 13 H ASP 13 -13.866 -1.647 -10.539 816 HA ASP 13 HA ASP 13 -14.473 -4.459 -11.053 817 HB2 ASP 13 2HB ASP 13 -12.384 -2.661 -12.245 818 HB3 ASP 13 1HB ASP 13 -12.332 -4.410 -12.399 819 H ASP 14 H ASP 14 -13.367 -6.006 -10.060 820 HA ASP 14 HA ASP 14 -11.054 -5.326 -8.457 821 HB2 ASP 14 2HB ASP 14 -11.976 -6.420 -6.447 822 HB3 ASP 14 1HB ASP 14 -12.994 -5.066 -6.918 823 H ASN 15 H ASN 15 -9.604 -7.021 -8.369 824 HA ASN 15 HA ASN 15 -10.372 -9.728 -8.731 825 HB2 ASN 15 2HB ASN 15 -10.577 -8.829 -11.098 826 HB3 ASN 15 1HB ASN 15 -8.859 -8.472 -11.048 827 HD21 ASN 15 1HD2 ASN 15 -10.243 -10.177 -12.854 828 HD22 ASN 15 2HD2 ASN 15 -9.585 -11.754 -12.684 829 H ARG 16 H ARG 16 -9.101 -9.991 -6.920 830 HA ARG 16 HA ARG 16 -6.435 -8.963 -6.916 831 HB2 ARG 16 2HB ARG 16 -6.026 -9.958 -4.694 832 HB3 ARG 16 1HB ARG 16 -7.485 -9.005 -4.743 833 HG2 ARG 16 2HG ARG 16 -7.469 -12.014 -4.901 834 HG3 ARG 16 1HG ARG 16 -7.565 -11.130 -3.382 835 HD2 ARG 16 2HD ARG 16 -9.651 -10.083 -4.162 836 HD3 ARG 16 1HD ARG 16 -9.526 -10.995 -5.667 837 HE ARG 16 HE ARG 16 -9.527 -12.990 -4.067 838 HH11 ARG 16 1HH1 ARG 16 -11.444 -10.031 -3.570 839 HH12 ARG 16 2HH1 ARG 16 -12.731 -10.827 -2.811 840 HH21 ARG 16 1HH2 ARG 16 -11.336 -14.083 -3.049 841 HH22 ARG 16 2HH2 ARG 16 -12.670 -13.193 -2.510 842 H LYS 17 H LYS 17 -5.422 -9.738 -8.575 843 HA LYS 17 HA LYS 17 -4.128 -12.337 -8.192 844 HB2 LYS 17 2HB LYS 17 -5.379 -11.450 -10.813 845 HB3 LYS 17 1HB LYS 17 -4.294 -12.815 -10.647 846 HG2 LYS 17 2HG LYS 17 -5.932 -13.942 -9.233 847 HG3 LYS 17 1HG LYS 17 -7.005 -12.548 -9.370 848 HD2 LYS 17 2HD LYS 17 -7.079 -12.881 -11.813 849 HD3 LYS 17 1HD LYS 17 -6.076 -14.321 -11.634 850 HE2 LYS 17 2HE LYS 17 -7.795 -15.352 -10.239 851 HE3 LYS 17 1HE LYS 17 -8.777 -13.898 -10.364 852 HZ1 LYS 17 1HZ LYS 17 -9.534 -15.587 -11.869 853 HZ2 LYS 17 2HZ LYS 17 -8.023 -15.701 -12.597 854 HZ3 LYS 17 3HZ LYS 17 -8.932 -14.294 -12.784 855 H LYS 18 H LYS 18 -2.303 -12.444 -10.011 856 HA LYS 18 HA LYS 18 -0.794 -10.048 -9.693 857 HB2 LYS 18 2HB LYS 18 -0.138 -12.691 -11.004 858 HB3 LYS 18 1HB LYS 18 0.947 -11.319 -11.118 859 HG2 LYS 18 2HG LYS 18 1.658 -12.815 -9.335 860 HG3 LYS 18 1HG LYS 18 1.155 -11.267 -8.668 861 HD2 LYS 18 2HD LYS 18 -1.042 -12.293 -8.098 862 HD3 LYS 18 1HD LYS 18 -0.431 -13.840 -8.683 863 HE2 LYS 18 2HE LYS 18 1.347 -13.768 -7.002 864 HE3 LYS 18 1HE LYS 18 0.733 -12.225 -6.413 865 HZ1 LYS 18 1HZ LYS 18 -0.722 -14.810 -6.376 866 HZ2 LYS 18 2HZ LYS 18 -1.356 -13.351 -5.837 867 HZ3 LYS 18 3HZ LYS 18 -0.063 -14.042 -5.031 868 H ALA 19 H ALA 19 -3.205 -10.498 -11.559 869 HA ALA 19 HA ALA 19 -2.432 -9.494 -14.090 870 HB1 ALA 19 1HB ALA 19 -4.798 -8.816 -14.259 871 HB2 ALA 19 2HB ALA 19 -4.974 -9.176 -12.542 872 HB3 ALA 19 3HB ALA 19 -4.628 -10.487 -13.685 873 H ILE 20 H ILE 20 -3.149 -8.124 -10.946 874 HA ILE 20 HA ILE 20 -3.266 -5.378 -11.583 875 HB ILE 20 HB ILE 20 -2.214 -6.701 -9.055 876 HG12 ILE 20 2HG1 ILE 20 -4.996 -5.721 -9.718 877 HG13 ILE 20 1HG1 ILE 20 -4.500 -7.400 -9.588 878 HG21 ILE 20 1HG2 ILE 20 -1.541 -4.365 -9.188 879 HG22 ILE 20 2HG2 ILE 20 -2.771 -4.583 -7.938 880 HG23 ILE 20 3HG2 ILE 20 -3.210 -3.888 -9.498 881 HD11 ILE 20 1HD1 ILE 20 -5.707 -6.628 -7.609 882 HD12 ILE 20 2HD1 ILE 20 -4.483 -5.392 -7.356 883 HD13 ILE 20 3HD1 ILE 20 -4.047 -7.092 -7.216 884 H SER 21 H SER 21 -0.740 -7.654 -11.119 885 HA SER 21 HA SER 21 1.415 -5.846 -10.792 886 HB2 SER 21 2HB SER 21 1.443 -8.713 -11.741 887 HB3 SER 21 1HB SER 21 2.816 -7.802 -11.099 888 HG SER 21 HG SER 21 1.007 -7.529 -9.292 889 H GLU 22 H GLU 22 0.120 -7.677 -13.527 890 HA GLU 22 HA GLU 22 1.920 -6.738 -15.474 891 HB2 GLU 22 2HB GLU 22 -0.939 -7.680 -15.804 892 HB3 GLU 22 1HB GLU 22 0.257 -7.562 -17.086 893 HG2 GLU 22 2HG GLU 22 1.613 -9.251 -16.001 894 HG3 GLU 22 1HG GLU 22 0.459 -9.351 -14.676 895 H THR 23 H THR 23 -1.184 -5.584 -14.301 896 HA THR 23 HA THR 23 -1.692 -3.543 -16.118 897 HB THR 23 HB THR 23 -2.365 -3.783 -13.186 898 HG1 THR 23 1HG THR 23 -3.199 -5.274 -15.003 899 HG21 THR 23 1HG2 THR 23 -4.138 -2.117 -13.598 900 HG22 THR 23 2HG2 THR 23 -3.526 -1.885 -15.237 901 HG23 THR 23 3HG2 THR 23 -2.532 -1.435 -13.851 902 H LEU 24 H LEU 24 -0.025 -3.330 -12.949 903 HA LEU 24 HA LEU 24 0.471 -0.541 -13.278 904 HB2 LEU 24 2HB LEU 24 1.634 -2.467 -11.281 905 HB3 LEU 24 1HB LEU 24 1.791 -0.723 -11.223 906 HG LEU 24 HG LEU 24 -0.786 -2.261 -10.963 907 HD11 LEU 24 1HD1 LEU 24 0.635 -2.492 -9.025 908 HD12 LEU 24 2HD1 LEU 24 -0.745 -1.456 -8.665 909 HD13 LEU 24 3HD1 LEU 24 0.840 -0.740 -8.949 910 HD21 LEU 24 1HD2 LEU 24 -1.165 -0.106 -12.042 911 HD22 LEU 24 2HD2 LEU 24 -0.243 0.705 -10.777 912 HD23 LEU 24 3HD2 LEU 24 -1.771 -0.085 -10.390 913 H GLU 25 H GLU 25 2.341 -3.420 -13.882 914 HA GLU 25 HA GLU 25 4.862 -2.317 -14.204 915 HB2 GLU 25 2HB GLU 25 4.243 -4.758 -14.121 916 HB3 GLU 25 1HB GLU 25 3.563 -4.615 -15.720 917 HG2 GLU 25 2HG GLU 25 6.480 -4.107 -15.171 918 HG3 GLU 25 1HG GLU 25 5.846 -5.717 -15.425 919 H THR 26 H THR 26 2.159 -2.710 -16.412 920 HA THR 26 HA THR 26 3.305 -1.569 -18.726 921 HB THR 26 HB THR 26 0.386 -1.743 -17.944 922 HG1 THR 26 1HG THR 26 1.415 -3.807 -17.883 923 HG21 THR 26 1HG2 THR 26 0.924 -0.293 -19.857 924 HG22 THR 26 2HG2 THR 26 -0.040 -1.695 -20.349 925 HG23 THR 26 3HG2 THR 26 1.705 -1.641 -20.661 926 H VAL 27 H VAL 27 1.300 -0.241 -16.095 927 HA VAL 27 HA VAL 27 0.829 2.330 -17.136 928 HB VAL 27 HB VAL 27 1.034 1.516 -14.209 929 HG11 VAL 27 1HG1 VAL 27 1.255 3.933 -14.472 930 HG12 VAL 27 2HG1 VAL 27 -0.307 3.522 -13.753 931 HG13 VAL 27 3HG1 VAL 27 -0.208 3.959 -15.457 932 HG21 VAL 27 1HG2 VAL 27 -1.388 1.828 -15.979 933 HG22 VAL 27 2HG2 VAL 27 -1.400 1.413 -14.270 934 HG23 VAL 27 3HG2 VAL 27 -0.703 0.294 -15.446 935 H TYR 28 H TYR 28 3.495 1.141 -15.216 936 HA TYR 28 HA TYR 28 4.734 3.618 -14.688 937 HB2 TYR 28 2HB TYR 28 5.363 1.468 -13.573 938 HB3 TYR 28 1HB TYR 28 6.108 0.937 -15.071 939 HD1 TYR 28 1HD TYR 28 8.155 2.193 -15.923 940 HD2 TYR 28 2HD TYR 28 6.543 2.872 -12.046 941 HE1 TYR 28 1HE TYR 28 10.262 3.260 -15.229 942 HE2 TYR 28 2HE TYR 28 8.656 3.936 -11.355 943 HH TYR 28 HH TYR 28 11.060 4.813 -13.596 944 H ARG 29 H ARG 29 5.068 1.357 -17.350 945 HA ARG 29 HA ARG 29 7.204 2.683 -18.642 946 HB2 ARG 29 2HB ARG 29 5.187 0.760 -19.778 947 HB3 ARG 29 1HB ARG 29 6.693 1.226 -20.551 948 HG2 ARG 29 2HG ARG 29 6.398 -0.289 -17.961 949 HG3 ARG 29 1HG ARG 29 6.909 -0.948 -19.512 950 HD2 ARG 29 2HD ARG 29 8.392 1.129 -17.886 951 HD3 ARG 29 1HD ARG 29 8.827 -0.567 -18.034 952 HE ARG 29 HE ARG 29 8.642 0.722 -20.561 953 HH11 ARG 29 1HH1 ARG 29 10.832 0.327 -17.779 954 HH12 ARG 29 2HH1 ARG 29 12.236 0.595 -18.696 955 HH21 ARG 29 1HH2 ARG 29 10.571 1.094 -21.765 956 HH22 ARG 29 2HH2 ARG 29 12.102 1.053 -21.012 957 H ALA 30 H ALA 30 3.758 3.056 -18.803 958 HA ALA 30 HA ALA 30 3.748 4.590 -21.208 959 HB1 ALA 30 1HB ALA 30 1.677 4.502 -19.007 960 HB2 ALA 30 2HB ALA 30 1.730 3.435 -20.408 961 HB3 ALA 30 3HB ALA 30 1.439 5.163 -20.624 962 H LEU 31 H LEU 31 3.972 5.332 -17.816 963 HA LEU 31 HA LEU 31 3.731 8.154 -18.112 964 HB2 LEU 31 2HB LEU 31 4.714 6.490 -15.814 965 HB3 LEU 31 1HB LEU 31 4.464 8.213 -15.747 966 HG LEU 31 HG LEU 31 2.229 6.349 -16.474 967 HD11 LEU 31 1HD1 LEU 31 3.064 5.838 -14.153 968 HD12 LEU 31 2HD1 LEU 31 1.434 6.522 -14.190 969 HD13 LEU 31 3HD1 LEU 31 2.777 7.550 -13.763 970 HD21 LEU 31 1HD2 LEU 31 1.932 8.637 -17.129 971 HD22 LEU 31 2HD2 LEU 31 2.350 9.171 -15.503 972 HD23 LEU 31 3HD2 LEU 31 0.863 8.260 -15.774 973 H GLU 32 H GLU 32 6.482 5.942 -17.989 974 HA GLU 32 HA GLU 32 8.246 8.107 -17.648 975 HB2 GLU 32 2HB GLU 32 10.113 6.453 -18.016 976 HB3 GLU 32 1HB GLU 32 9.060 6.143 -16.648 977 HG2 GLU 32 2HG GLU 32 9.337 4.021 -17.485 978 HG3 GLU 32 1HG GLU 32 7.913 4.535 -18.378 979 H GLU 33 H GLU 33 7.354 6.330 -20.513 980 HA GLU 33 HA GLU 33 8.992 7.836 -22.286 981 HB2 GLU 33 2HB GLU 33 6.399 6.380 -22.751 982 HB3 GLU 33 1HB GLU 33 7.258 7.212 -24.036 983 HG2 GLU 33 2HG GLU 33 8.391 4.989 -22.365 984 HG3 GLU 33 1HG GLU 33 7.691 4.812 -23.978 985 H LYS 34 H LYS 34 6.050 8.577 -20.707 986 HA LYS 34 HA LYS 34 5.503 10.868 -22.384 987 HB2 LYS 34 2HB LYS 34 4.091 9.612 -20.087 988 HB3 LYS 34 1HB LYS 34 3.703 11.256 -20.550 989 HG2 LYS 34 2HG LYS 34 3.564 8.882 -22.393 990 HG3 LYS 34 1HG LYS 34 2.189 9.557 -21.509 991 HD2 LYS 34 2HD LYS 34 2.598 11.735 -22.613 992 HD3 LYS 34 1HD LYS 34 3.882 10.994 -23.560 993 HE2 LYS 34 2HE LYS 34 2.287 9.445 -24.514 994 HE3 LYS 34 1HE LYS 34 0.987 10.170 -23.576 995 HZ1 LYS 34 1HZ LYS 34 2.605 11.527 -25.673 996 HZ2 LYS 34 2HZ LYS 34 1.392 12.262 -24.744 997 HZ3 LYS 34 3HZ LYS 34 1.012 11.022 -25.817 998 H GLY 35 H GLY 35 7.530 10.319 -19.833 999 HA2 GLY 35 2HA GLY 35 8.848 11.788 -18.665 1000 HA3 GLY 35 1HA GLY 35 8.162 13.077 -19.641 1001 H TYR 36 H TYR 36 6.198 10.930 -17.664 1002 HA TYR 36 HA TYR 36 5.576 13.232 -15.957 1003 HB2 TYR 36 2HB TYR 36 4.158 10.553 -16.231 1004 HB3 TYR 36 1HB TYR 36 3.686 11.805 -15.098 1005 HD1 TYR 36 1HD TYR 36 2.908 10.364 -18.138 1006 HD2 TYR 36 2HD TYR 36 3.292 14.200 -16.345 1007 HE1 TYR 36 1HE TYR 36 1.405 11.311 -19.844 1008 HE2 TYR 36 2HE TYR 36 1.779 15.147 -18.049 1009 HH TYR 36 HH TYR 36 1.020 14.672 -20.270 1010 H ASN 37 H ASN 37 4.896 11.959 -13.634 1011 HA ASN 37 HA ASN 37 7.447 10.719 -12.910 1012 HB2 ASN 37 2HB ASN 37 5.348 12.020 -11.173 1013 HB3 ASN 37 1HB ASN 37 6.830 11.282 -10.566 1014 HD21 ASN 37 1HD2 ASN 37 8.797 12.333 -10.977 1015 HD22 ASN 37 2HD2 ASN 37 8.842 14.002 -11.391 1016 HA PRO 38 HA PRO 38 4.616 7.165 -13.538 1017 HB2 PRO 38 2HB PRO 38 6.704 5.426 -12.672 1018 HB3 PRO 38 1HB PRO 38 6.085 5.668 -14.302 1019 HG2 PRO 38 2HG PRO 38 8.480 6.823 -13.020 1020 HG3 PRO 38 1HG PRO 38 8.100 6.608 -14.729 1021 HD2 PRO 38 2HD PRO 38 8.121 9.015 -13.548 1022 HD3 PRO 38 1HD PRO 38 7.023 8.599 -14.884 1023 H ILE 39 H ILE 39 6.673 7.397 -10.651 1024 HA ILE 39 HA ILE 39 4.887 5.645 -9.226 1025 HB ILE 39 HB ILE 39 7.228 7.254 -8.190 1026 HG12 ILE 39 2HG1 ILE 39 7.862 5.601 -9.867 1027 HG13 ILE 39 1HG1 ILE 39 8.457 5.139 -8.281 1028 HG21 ILE 39 1HG2 ILE 39 5.635 6.691 -6.404 1029 HG22 ILE 39 2HG2 ILE 39 7.134 5.782 -6.227 1030 HG23 ILE 39 3HG2 ILE 39 5.696 4.993 -6.880 1031 HD11 ILE 39 1HD1 ILE 39 7.597 3.210 -9.504 1032 HD12 ILE 39 2HD1 ILE 39 6.036 3.996 -9.686 1033 HD13 ILE 39 3HD1 ILE 39 6.605 3.527 -8.083 1034 H ASN 40 H ASN 40 5.707 9.060 -9.136 1035 HA ASN 40 HA ASN 40 4.019 9.772 -7.006 1036 HB2 ASN 40 2HB ASN 40 4.998 11.494 -9.282 1037 HB3 ASN 40 1HB ASN 40 4.068 12.119 -7.934 1038 HD21 ASN 40 1HD2 ASN 40 7.145 10.850 -8.948 1039 HD22 ASN 40 2HD2 ASN 40 8.030 11.322 -7.560 1040 H GLN 41 H GLN 41 3.320 9.441 -10.426 1041 HA GLN 41 HA GLN 41 0.762 10.629 -10.322 1042 HB2 GLN 41 2HB GLN 41 1.743 8.493 -12.222 1043 HB3 GLN 41 1HB GLN 41 0.320 9.489 -12.455 1044 HG2 GLN 41 2HG GLN 41 3.165 10.483 -12.358 1045 HG3 GLN 41 1HG GLN 41 2.208 10.240 -13.811 1046 HE21 GLN 41 1HE2 GLN 41 -0.230 11.325 -12.629 1047 HE22 GLN 41 2HE2 GLN 41 0.012 13.025 -12.537 1048 H ILE 42 H ILE 42 1.880 7.290 -9.843 1049 HA ILE 42 HA ILE 42 -0.768 6.255 -9.645 1050 HB ILE 42 HB ILE 42 1.844 4.953 -8.805 1051 HG12 ILE 42 2HG1 ILE 42 0.183 4.620 -11.325 1052 HG13 ILE 42 1HG1 ILE 42 1.714 5.478 -11.215 1053 HG21 ILE 42 1HG2 ILE 42 -0.062 3.942 -7.648 1054 HG22 ILE 42 2HG2 ILE 42 0.548 2.831 -8.878 1055 HG23 ILE 42 3HG2 ILE 42 -0.921 3.766 -9.166 1056 HD11 ILE 42 1HD1 ILE 42 2.842 3.388 -10.633 1057 HD12 ILE 42 2HD1 ILE 42 2.002 3.263 -12.180 1058 HD13 ILE 42 3HD1 ILE 42 1.306 2.532 -10.734 1059 H VAL 43 H VAL 43 1.730 7.045 -7.219 1060 HA VAL 43 HA VAL 43 0.158 6.232 -5.043 1061 HB VAL 43 HB VAL 43 2.538 6.570 -4.641 1062 HG11 VAL 43 1HG1 VAL 43 2.946 8.367 -6.197 1063 HG12 VAL 43 2HG1 VAL 43 3.553 8.825 -4.597 1064 HG13 VAL 43 3HG1 VAL 43 2.037 9.499 -5.201 1065 HG21 VAL 43 1HG2 VAL 43 0.950 8.601 -3.067 1066 HG22 VAL 43 2HG2 VAL 43 2.514 7.937 -2.596 1067 HG23 VAL 43 3HG2 VAL 43 1.101 6.884 -2.704 1068 H GLY 44 H GLY 44 0.299 9.367 -6.700 1069 HA2 GLY 44 2HA GLY 44 -1.493 10.667 -4.939 1070 HA3 GLY 44 1HA GLY 44 -1.098 11.161 -6.584 1071 H TYR 45 H TYR 45 -1.855 8.736 -7.852 1072 HA TYR 45 HA TYR 45 -4.526 9.135 -8.499 1073 HB2 TYR 45 2HB TYR 45 -2.812 7.939 -9.847 1074 HB3 TYR 45 1HB TYR 45 -2.837 6.631 -8.690 1075 HD1 TYR 45 1HD TYR 45 -5.202 5.562 -8.365 1076 HD2 TYR 45 2HD TYR 45 -4.026 7.769 -11.748 1077 HE1 TYR 45 1HE TYR 45 -6.925 4.439 -9.640 1078 HE2 TYR 45 2HE TYR 45 -5.747 6.638 -13.105 1079 HH TYR 45 HH TYR 45 -6.991 4.549 -13.033 1080 H LEU 46 H LEU 46 -3.135 6.538 -6.473 1081 HA LEU 46 HA LEU 46 -5.701 5.587 -5.778 1082 HB2 LEU 46 2HB LEU 46 -3.013 4.915 -4.619 1083 HB3 LEU 46 1HB LEU 46 -4.484 4.236 -3.964 1084 HG LEU 46 HG LEU 46 -4.920 3.258 -6.276 1085 HD11 LEU 46 1HD1 LEU 46 -3.092 2.951 -7.783 1086 HD12 LEU 46 2HD1 LEU 46 -2.093 4.009 -6.790 1087 HD13 LEU 46 3HD1 LEU 46 -3.514 4.656 -7.601 1088 HD21 LEU 46 1HD2 LEU 46 -3.395 1.384 -5.973 1089 HD22 LEU 46 2HD2 LEU 46 -4.131 1.891 -4.454 1090 HD23 LEU 46 3HD2 LEU 46 -2.462 2.332 -4.814 1091 H LEU 47 H LEU 47 -3.602 7.881 -4.205 1092 HA LEU 47 HA LEU 47 -5.120 7.880 -1.783 1093 HB2 LEU 47 2HB LEU 47 -3.174 9.929 -2.830 1094 HB3 LEU 47 1HB LEU 47 -3.856 9.926 -1.219 1095 HG LEU 47 HG LEU 47 -1.978 7.865 -2.375 1096 HD11 LEU 47 1HD1 LEU 47 -0.889 9.959 -1.852 1097 HD12 LEU 47 2HD1 LEU 47 -0.407 8.703 -0.712 1098 HD13 LEU 47 3HD1 LEU 47 -1.576 9.933 -0.227 1099 HD21 LEU 47 1HD2 LEU 47 -3.545 6.808 -0.851 1100 HD22 LEU 47 2HD2 LEU 47 -3.200 8.024 0.383 1101 HD23 LEU 47 3HD2 LEU 47 -1.941 6.893 -0.129 1102 H SER 48 H SER 48 -5.815 9.182 -4.837 1103 HA SER 48 HA SER 48 -7.574 11.172 -3.579 1104 HB2 SER 48 2HB SER 48 -7.521 12.343 -5.773 1105 HB3 SER 48 1HB SER 48 -5.949 12.238 -4.982 1106 HG SER 48 HG SER 48 -5.282 10.796 -6.396 1107 H GLY 49 H GLY 49 -7.498 8.354 -5.765 1108 HA2 GLY 49 2HA GLY 49 -9.392 7.073 -6.247 1109 HA3 GLY 49 1HA GLY 49 -10.399 8.420 -5.743 1110 H ASP 50 H ASP 50 -7.885 9.471 -7.640 1111 HA ASP 50 HA ASP 50 -9.695 10.295 -9.732 1112 HB2 ASP 50 2HB ASP 50 -7.713 11.611 -8.675 1113 HB3 ASP 50 1HB ASP 50 -6.733 10.586 -9.658 1114 HA PRO 51 HA PRO 51 -8.092 6.960 -12.330 1115 HB2 PRO 51 2HB PRO 51 -9.932 7.069 -14.270 1116 HB3 PRO 51 1HB PRO 51 -10.259 6.342 -12.709 1117 HG2 PRO 51 2HG PRO 51 -11.244 8.917 -13.791 1118 HG3 PRO 51 1HG PRO 51 -11.918 7.921 -12.495 1119 HD2 PRO 51 2HD PRO 51 -10.288 10.289 -12.245 1120 HD3 PRO 51 1HD PRO 51 -10.972 9.280 -10.955 1121 H ALA 52 H ALA 52 -8.452 10.268 -13.200 1122 HA ALA 52 HA ALA 52 -7.759 9.997 -15.955 1123 HB1 ALA 52 1HB ALA 52 -8.052 12.371 -16.100 1124 HB2 ALA 52 2HB ALA 52 -8.134 12.494 -14.337 1125 HB3 ALA 52 3HB ALA 52 -9.384 11.627 -15.223 1126 H TYR 53 H TYR 53 -5.782 10.223 -13.194 1127 HA TYR 53 HA TYR 53 -3.737 11.898 -14.192 1128 HB2 TYR 53 2HB TYR 53 -3.480 9.622 -12.241 1129 HB3 TYR 53 1HB TYR 53 -2.142 10.661 -12.684 1130 HD1 TYR 53 1HD TYR 53 -3.311 13.290 -12.712 1131 HD2 TYR 53 2HD TYR 53 -4.006 10.046 -10.098 1132 HE1 TYR 53 1HE TYR 53 -3.962 14.855 -11.012 1133 HE2 TYR 53 2HE TYR 53 -4.665 11.595 -8.316 1134 HH TYR 53 HH TYR 53 -4.377 13.941 -7.720 1135 H ILE 54 H ILE 54 -4.495 8.614 -14.961 1136 HA ILE 54 HA ILE 54 -1.844 8.150 -16.023 1137 HB ILE 54 HB ILE 54 -4.241 6.273 -16.154 1138 HG12 ILE 54 2HG1 ILE 54 -3.716 6.698 -13.821 1139 HG13 ILE 54 1HG1 ILE 54 -3.145 5.094 -14.261 1140 HG21 ILE 54 1HG2 ILE 54 -2.588 4.525 -16.569 1141 HG22 ILE 54 2HG2 ILE 54 -1.302 5.732 -16.553 1142 HG23 ILE 54 3HG2 ILE 54 -2.528 5.772 -17.818 1143 HD11 ILE 54 1HD1 ILE 54 -1.576 6.260 -12.803 1144 HD12 ILE 54 2HD1 ILE 54 -1.432 7.561 -13.977 1145 HD13 ILE 54 3HD1 ILE 54 -0.851 5.943 -14.380 1146 HA PRO 55 HA PRO 55 -3.088 9.943 -19.849 1147 HB2 PRO 55 2HB PRO 55 -0.818 9.503 -21.216 1148 HB3 PRO 55 1HB PRO 55 -0.910 10.698 -19.917 1149 HG2 PRO 55 2HG PRO 55 0.114 7.893 -19.822 1150 HG3 PRO 55 1HG PRO 55 0.853 9.368 -19.168 1151 HD2 PRO 55 2HD PRO 55 -0.534 7.665 -17.626 1152 HD3 PRO 55 1HD PRO 55 -0.551 9.416 -17.343 1153 H ARG 56 H ARG 56 -3.889 9.304 -21.741 1154 HA ARG 56 HA ARG 56 -3.929 6.490 -22.283 1155 HB2 ARG 56 2HB ARG 56 -5.474 7.109 -24.197 1156 HB3 ARG 56 1HB ARG 56 -6.068 7.504 -22.593 1157 HG2 ARG 56 2HG ARG 56 -5.435 9.831 -22.926 1158 HG3 ARG 56 1HG ARG 56 -4.807 9.438 -24.526 1159 HD2 ARG 56 2HD ARG 56 -7.028 8.770 -25.252 1160 HD3 ARG 56 1HD ARG 56 -7.667 9.074 -23.636 1161 HE ARG 56 HE ARG 56 -6.567 11.416 -24.265 1162 HH11 ARG 56 1HH1 ARG 56 -8.794 9.377 -26.106 1163 HH12 ARG 56 2HH1 ARG 56 -9.569 10.699 -26.857 1164 HH21 ARG 56 1HH2 ARG 56 -7.634 13.185 -25.299 1165 HH22 ARG 56 2HH2 ARG 56 -8.895 12.918 -26.399 1166 H TYR 57 H TYR 57 -1.794 6.368 -22.530 1167 HA TYR 57 HA TYR 57 -0.733 7.106 -25.182 1168 HB2 TYR 57 2HB TYR 57 0.639 7.875 -23.298 1169 HB3 TYR 57 1HB TYR 57 0.687 6.249 -22.642 1170 HD1 TYR 57 1HD TYR 57 1.608 8.091 -25.764 1171 HD2 TYR 57 2HD TYR 57 2.589 4.982 -23.047 1172 HE1 TYR 57 1HE TYR 57 3.700 7.696 -26.988 1173 HE2 TYR 57 2HE TYR 57 4.687 4.572 -24.266 1174 HH TYR 57 HH TYR 57 5.517 4.970 -26.636 1175 H GLN 58 H GLN 58 -1.326 4.537 -22.914 1176 HA GLN 58 HA GLN 58 -1.279 2.590 -25.049 1177 HB2 GLN 58 2HB GLN 58 0.241 2.283 -22.442 1178 HB3 GLN 58 1HB GLN 58 -0.077 0.963 -23.544 1179 HG2 GLN 58 2HG GLN 58 1.232 2.154 -25.274 1180 HG3 GLN 58 1HG GLN 58 1.604 3.401 -24.090 1181 HE21 GLN 58 1HE2 GLN 58 1.878 1.399 -21.887 1182 HE22 GLN 58 2HE2 GLN 58 3.371 0.608 -22.209 1183 H ASP 59 H ASP 59 -2.034 0.449 -23.926 1184 HA ASP 59 HA ASP 59 -4.653 0.800 -22.999 1185 HB2 ASP 59 2HB ASP 59 -2.900 -1.646 -22.949 1186 HB3 ASP 59 1HB ASP 59 -4.578 -1.658 -22.442 1187 H ALA 60 H ALA 60 -1.879 1.126 -21.310 1188 HA ALA 60 HA ALA 60 -2.179 0.045 -18.802 1189 HB1 ALA 60 1HB ALA 60 -0.829 1.846 -17.973 1190 HB2 ALA 60 2HB ALA 60 -1.156 2.801 -19.416 1191 HB3 ALA 60 3HB ALA 60 -0.220 1.309 -19.544 1192 H ARG 61 H ARG 61 -3.674 3.068 -19.991 1193 HA ARG 61 HA ARG 61 -4.787 3.642 -17.468 1194 HB2 ARG 61 2HB ARG 61 -6.114 5.433 -18.542 1195 HB3 ARG 61 1HB ARG 61 -4.428 5.509 -18.973 1196 HG2 ARG 61 2HG ARG 61 -5.683 6.072 -20.907 1197 HG3 ARG 61 1HG ARG 61 -5.056 4.450 -21.181 1198 HD2 ARG 61 2HD ARG 61 -7.406 4.710 -21.899 1199 HD3 ARG 61 1HD ARG 61 -7.223 3.495 -20.634 1200 HE ARG 61 HE ARG 61 -7.802 5.947 -19.425 1201 HH11 ARG 61 1HH1 ARG 61 -9.444 3.562 -21.490 1202 HH12 ARG 61 2HH1 ARG 61 -10.989 3.942 -20.874 1203 HH21 ARG 61 1HH2 ARG 61 -9.906 6.431 -18.621 1204 HH22 ARG 61 2HH2 ARG 61 -11.272 5.598 -19.242 1205 H ASN 62 H ASN 62 -5.889 1.755 -20.112 1206 HA ASN 62 HA ASN 62 -8.626 1.476 -19.329 1207 HB2 ASN 62 2HB ASN 62 -7.594 0.943 -21.630 1208 HB3 ASN 62 1HB ASN 62 -6.890 -0.461 -20.877 1209 HD21 ASN 62 1HD2 ASN 62 -8.740 -0.306 -23.076 1210 HD22 ASN 62 2HD2 ASN 62 -10.120 -1.234 -22.645 1211 H LEU 63 H LEU 63 -5.663 -0.363 -18.965 1212 HA LEU 63 HA LEU 63 -6.642 -2.545 -17.518 1213 HB2 LEU 63 2HB LEU 63 -3.882 -1.348 -17.471 1214 HB3 LEU 63 1HB LEU 63 -4.315 -2.957 -16.929 1215 HG LEU 63 HG LEU 63 -4.469 -1.954 -19.771 1216 HD11 LEU 63 1HD1 LEU 63 -2.191 -2.247 -19.016 1217 HD12 LEU 63 2HD1 LEU 63 -2.635 -3.503 -20.171 1218 HD13 LEU 63 3HD1 LEU 63 -2.568 -3.873 -18.446 1219 HD21 LEU 63 1HD2 LEU 63 -4.941 -4.295 -20.338 1220 HD22 LEU 63 2HD2 LEU 63 -6.204 -3.612 -19.313 1221 HD23 LEU 63 3HD2 LEU 63 -4.997 -4.694 -18.620 1222 H ILE 64 H ILE 64 -5.383 0.589 -16.393 1223 HA ILE 64 HA ILE 64 -5.472 -0.253 -13.659 1224 HB ILE 64 HB ILE 64 -3.920 1.604 -14.545 1225 HG12 ILE 64 2HG1 ILE 64 -5.616 2.330 -12.134 1226 HG13 ILE 64 1HG1 ILE 64 -4.311 1.152 -12.116 1227 HG21 ILE 64 1HG2 ILE 64 -4.830 3.893 -14.616 1228 HG22 ILE 64 2HG2 ILE 64 -6.441 3.266 -14.301 1229 HG23 ILE 64 3HG2 ILE 64 -5.625 2.859 -15.806 1230 HD11 ILE 64 1HD1 ILE 64 -2.730 2.933 -12.710 1231 HD12 ILE 64 2HD1 ILE 64 -3.573 3.256 -11.197 1232 HD13 ILE 64 3HD1 ILE 64 -4.054 4.100 -12.669 1233 H ARG 65 H ARG 65 -7.812 0.696 -15.851 1234 HA ARG 65 HA ARG 65 -9.638 1.370 -13.710 1235 HB2 ARG 65 2HB ARG 65 -9.979 1.618 -16.700 1236 HB3 ARG 65 1HB ARG 65 -11.272 1.906 -15.543 1237 HG2 ARG 65 2HG ARG 65 -8.714 3.454 -15.868 1238 HG3 ARG 65 1HG ARG 65 -10.371 4.024 -16.098 1239 HD2 ARG 65 2HD ARG 65 -9.044 3.250 -13.489 1240 HD3 ARG 65 1HD ARG 65 -9.574 4.842 -13.991 1241 HE ARG 65 HE ARG 65 -11.863 4.013 -13.909 1242 HH11 ARG 65 1HH1 ARG 65 -9.398 2.193 -12.020 1243 HH12 ARG 65 2HH1 ARG 65 -10.556 1.528 -10.968 1244 HH21 ARG 65 1HH2 ARG 65 -13.389 3.038 -12.371 1245 HH22 ARG 65 2HH2 ARG 65 -12.764 1.982 -11.154 1246 H ARG 66 H ARG 66 -8.454 -1.284 -14.869 1247 HA ARG 66 HA ARG 66 -10.965 -2.778 -14.899 1248 HB2 ARG 66 2HB ARG 66 -8.125 -3.664 -15.462 1249 HB3 ARG 66 1HB ARG 66 -9.520 -4.726 -15.506 1250 HG2 ARG 66 2HG ARG 66 -9.050 -2.352 -17.310 1251 HG3 ARG 66 1HG ARG 66 -8.831 -4.046 -17.746 1252 HD2 ARG 66 2HD ARG 66 -11.212 -4.450 -17.336 1253 HD3 ARG 66 1HD ARG 66 -11.428 -2.753 -16.911 1254 HE ARG 66 HE ARG 66 -10.361 -2.646 -19.386 1255 HH11 ARG 66 1HH1 ARG 66 -13.191 -4.306 -18.028 1256 HH12 ARG 66 2HH1 ARG 66 -14.047 -4.311 -19.494 1257 HH21 ARG 66 1HH2 ARG 66 -11.579 -2.676 -21.399 1258 HH22 ARG 66 2HH2 ARG 66 -13.115 -3.403 -21.430 1259 H HIS 67 H HIS 67 -9.051 -1.505 -12.681 1260 HA HIS 67 HA HIS 67 -9.789 -3.448 -10.661 1261 HB2 HIS 67 2HB HIS 67 -6.934 -2.477 -11.017 1262 HB3 HIS 67 1HB HIS 67 -7.536 -3.254 -9.563 1263 HD1 HIS 67 1HD HIS 67 -7.659 -5.799 -9.573 1264 HD2 HIS 67 2HD HIS 67 -6.564 -4.161 -13.244 1265 HE1 HIS 67 1HE HIS 67 -6.905 -7.719 -10.991 1266 HE2 HIS 67 2HE HIS 67 -6.732 -6.721 -13.264 1267 H GLU 68 H GLU 68 -10.058 -2.468 -8.666 1268 HA GLU 68 HA GLU 68 -10.140 0.408 -8.760 1269 HB2 GLU 68 2HB GLU 68 -11.181 -1.594 -6.801 1270 HB3 GLU 68 1HB GLU 68 -11.187 0.125 -6.450 1271 HG2 GLU 68 2HG GLU 68 -12.548 -1.254 -8.735 1272 HG3 GLU 68 1HG GLU 68 -13.318 -0.563 -7.310 1273 H ARG 69 H ARG 69 -9.372 1.682 -7.081 1274 HA ARG 69 HA ARG 69 -6.611 1.356 -6.650 1275 HB2 ARG 69 2HB ARG 69 -8.649 3.260 -5.550 1276 HB3 ARG 69 1HB ARG 69 -6.934 3.376 -5.182 1277 HG2 ARG 69 2HG ARG 69 -6.415 4.181 -7.211 1278 HG3 ARG 69 1HG ARG 69 -7.556 3.112 -8.018 1279 HD2 ARG 69 2HD ARG 69 -8.391 5.470 -6.415 1280 HD3 ARG 69 1HD ARG 69 -8.039 5.594 -8.146 1281 HE ARG 69 HE ARG 69 -10.115 3.837 -6.991 1282 HH11 ARG 69 1HH1 ARG 69 -9.067 6.116 -9.504 1283 HH12 ARG 69 2HH1 ARG 69 -10.425 5.891 -10.488 1284 HH21 ARG 69 1HH2 ARG 69 -11.977 3.439 -8.416 1285 HH22 ARG 69 2HH2 ARG 69 -12.132 4.313 -9.844 1286 H ASP 70 H ASP 70 -9.392 1.004 -4.529 1287 HA ASP 70 HA ASP 70 -8.042 0.481 -2.116 1288 HB2 ASP 70 2HB ASP 70 -10.689 -0.682 -3.035 1289 HB3 ASP 70 1HB ASP 70 -10.117 -0.585 -1.378 1290 H GLU 71 H GLU 71 -8.977 -1.485 -4.805 1291 HA GLU 71 HA GLU 71 -8.473 -4.035 -3.632 1292 HB2 GLU 71 2HB GLU 71 -10.135 -3.366 -5.495 1293 HB3 GLU 71 1HB GLU 71 -8.746 -3.290 -6.550 1294 HG2 GLU 71 2HG GLU 71 -9.530 -5.797 -5.101 1295 HG3 GLU 71 1HG GLU 71 -10.228 -5.343 -6.638 1296 H ILE 72 H ILE 72 -6.838 -2.042 -6.089 1297 HA ILE 72 HA ILE 72 -4.568 -3.594 -6.556 1298 HB ILE 72 HB ILE 72 -4.878 -0.584 -6.640 1299 HG12 ILE 72 2HG1 ILE 72 -4.969 -2.645 -8.860 1300 HG13 ILE 72 1HG1 ILE 72 -6.353 -1.805 -8.172 1301 HG21 ILE 72 1HG2 ILE 72 -2.641 -2.254 -7.777 1302 HG22 ILE 72 2HG2 ILE 72 -2.522 -1.102 -6.448 1303 HG23 ILE 72 3HG2 ILE 72 -2.881 -0.531 -8.077 1304 HD11 ILE 72 1HD1 ILE 72 -5.485 0.317 -8.997 1305 HD12 ILE 72 2HD1 ILE 72 -5.698 -0.841 -10.310 1306 HD13 ILE 72 3HD1 ILE 72 -4.084 -0.512 -9.672 1307 H MET 73 H MET 73 -5.117 -1.119 -4.089 1308 HA MET 73 HA MET 73 -2.471 -0.913 -3.215 1309 HB2 MET 73 2HB MET 73 -4.423 0.679 -2.786 1310 HB3 MET 73 1HB MET 73 -4.912 -0.414 -1.513 1311 HG2 MET 73 2HG MET 73 -2.267 1.033 -1.623 1312 HG3 MET 73 1HG MET 73 -3.667 1.578 -0.722 1313 HE1 MET 73 1HE MET 73 -0.755 1.206 0.506 1314 HE2 MET 73 2HE MET 73 -1.168 0.478 2.061 1315 HE3 MET 73 3HE MET 73 -2.161 1.784 1.393 1316 H GLU 74 H GLU 74 -5.065 -3.125 -2.202 1317 HA GLU 74 HA GLU 74 -3.827 -4.257 0.043 1318 HB2 GLU 74 2HB GLU 74 -5.568 -5.591 -2.022 1319 HB3 GLU 74 1HB GLU 74 -5.111 -6.326 -0.499 1320 HG2 GLU 74 2HG GLU 74 -6.321 -4.534 0.675 1321 HG3 GLU 74 1HG GLU 74 -6.812 -3.878 -0.893 1322 H GLU 75 H GLU 75 -3.568 -5.077 -3.368 1323 HA GLU 75 HA GLU 75 -1.883 -7.333 -3.046 1324 HB2 GLU 75 2HB GLU 75 -3.325 -6.832 -5.029 1325 HB3 GLU 75 1HB GLU 75 -2.206 -5.544 -5.436 1326 HG2 GLU 75 2HG GLU 75 -1.842 -7.571 -6.786 1327 HG3 GLU 75 1HG GLU 75 -0.437 -7.135 -5.818 1328 H LEU 76 H LEU 76 -1.279 -3.913 -3.539 1329 HA LEU 76 HA LEU 76 1.508 -4.009 -3.949 1330 HB2 LEU 76 2HB LEU 76 -0.070 -1.877 -2.498 1331 HB3 LEU 76 1HB LEU 76 1.549 -1.695 -3.122 1332 HG LEU 76 HG LEU 76 -0.953 -2.060 -4.769 1333 HD11 LEU 76 1HD1 LEU 76 -0.557 0.241 -5.457 1334 HD12 LEU 76 2HD1 LEU 76 0.844 0.328 -4.395 1335 HD13 LEU 76 3HD1 LEU 76 -0.768 0.147 -3.706 1336 HD21 LEU 76 1HD2 LEU 76 0.980 -3.084 -5.845 1337 HD22 LEU 76 2HD2 LEU 76 1.899 -1.595 -5.624 1338 HD23 LEU 76 3HD2 LEU 76 0.491 -1.614 -6.682 1339 H THR 77 H THR 77 -0.412 -3.630 -0.966 1340 HA THR 77 HA THR 77 1.779 -3.507 0.764 1341 HB THR 77 HB THR 77 -1.057 -4.410 1.349 1342 HG1 THR 77 1HG THR 77 -1.330 -2.349 0.645 1343 HG21 THR 77 1HG2 THR 77 -0.584 -3.606 3.616 1344 HG22 THR 77 2HG2 THR 77 1.067 -3.204 3.140 1345 HG23 THR 77 3HG2 THR 77 0.543 -4.888 3.169 1346 H LYS 78 H LYS 78 -0.220 -6.245 -0.299 1347 HA LYS 78 HA LYS 78 0.892 -8.189 1.396 1348 HB2 LYS 78 2HB LYS 78 -0.308 -8.507 -1.319 1349 HB3 LYS 78 1HB LYS 78 0.121 -9.859 -0.285 1350 HG2 LYS 78 2HG LYS 78 -1.444 -9.060 1.369 1351 HG3 LYS 78 1HG LYS 78 -1.932 -7.742 0.324 1352 HD2 LYS 78 2HD LYS 78 -2.225 -10.718 -0.221 1353 HD3 LYS 78 1HD LYS 78 -3.534 -9.575 0.099 1354 HE2 LYS 78 2HE LYS 78 -3.070 -8.416 -1.961 1355 HE3 LYS 78 1HE LYS 78 -1.678 -9.453 -2.288 1356 HZ1 LYS 78 1HZ LYS 78 -4.532 -10.216 -2.255 1357 HZ2 LYS 78 2HZ LYS 78 -3.262 -11.326 -2.351 1358 HZ3 LYS 78 3HZ LYS 78 -3.455 -10.143 -3.577 1359 H TYR 79 H TYR 79 1.665 -7.426 -1.988 1360 HA TYR 79 HA TYR 79 3.604 -9.462 -2.172 1361 HB2 TYR 79 2HB TYR 79 2.467 -8.465 -4.139 1362 HB3 TYR 79 1HB TYR 79 3.390 -6.990 -3.892 1363 HD1 TYR 79 1HD TYR 79 3.823 -10.632 -4.468 1364 HD2 TYR 79 2HD TYR 79 5.456 -6.740 -4.958 1365 HE1 TYR 79 1HE TYR 79 5.622 -11.574 -5.849 1366 HE2 TYR 79 2HE TYR 79 7.261 -7.668 -6.339 1367 HH TYR 79 HH TYR 79 7.186 -10.862 -7.549 1368 H TYR 80 H TYR 80 3.830 -6.109 -1.231 1369 HA TYR 80 HA TYR 80 6.609 -5.812 -1.218 1370 HB2 TYR 80 2HB TYR 80 4.981 -3.973 -0.881 1371 HB3 TYR 80 1HB TYR 80 4.545 -4.654 0.673 1372 HD1 TYR 80 1HD TYR 80 7.147 -2.880 -1.210 1373 HD2 TYR 80 2HD TYR 80 5.934 -4.289 2.607 1374 HE1 TYR 80 1HE TYR 80 8.860 -1.469 -0.156 1375 HE2 TYR 80 2HE TYR 80 7.638 -2.889 3.674 1376 HH TYR 80 HH TYR 80 9.297 -0.437 1.994 1377 H LEU 81 H LEU 81 4.405 -6.954 1.299 1378 HA LEU 81 HA LEU 81 6.470 -7.587 3.143 1379 HB2 LEU 81 2HB LEU 81 3.567 -8.346 3.092 1380 HB3 LEU 81 1HB LEU 81 4.649 -8.687 4.429 1381 HG LEU 81 HG LEU 81 3.935 -5.928 3.432 1382 HD11 LEU 81 1HD1 LEU 81 3.077 -7.418 5.899 1383 HD12 LEU 81 2HD1 LEU 81 2.058 -7.007 4.523 1384 HD13 LEU 81 3HD1 LEU 81 2.716 -5.726 5.542 1385 HD21 LEU 81 1HD2 LEU 81 5.090 -5.179 5.468 1386 HD22 LEU 81 2HD2 LEU 81 6.175 -5.992 4.354 1387 HD23 LEU 81 3HD2 LEU 81 5.589 -6.839 5.788 1388 H ALA 82 H ALA 82 4.759 -9.394 0.713 1389 HA ALA 82 HA ALA 82 5.236 -12.006 1.491 1390 HB1 ALA 82 1HB ALA 82 5.144 -10.945 -1.327 1391 HB2 ALA 82 2HB ALA 82 3.739 -11.355 -0.344 1392 HB3 ALA 82 3HB ALA 82 4.873 -12.615 -0.835 1393 H ASN 83 H ASN 83 7.369 -9.776 -0.101 1394 HA ASN 83 HA ASN 83 9.269 -11.779 -0.819 1395 HB2 ASN 83 2HB ASN 83 9.443 -8.783 -0.887 1396 HB3 ASN 83 1HB ASN 83 10.809 -9.809 -1.307 1397 HD21 ASN 83 1HD2 ASN 83 7.623 -8.705 -2.284 1398 HD22 ASN 83 2HD2 ASN 83 7.756 -9.323 -3.877 1399 H HIS 84 H HIS 84 8.545 -10.746 2.147 1400 HA HIS 84 HA HIS 84 11.306 -10.953 3.109 1401 HB2 HIS 84 2HB HIS 84 8.762 -10.262 4.608 1402 HB3 HIS 84 1HB HIS 84 10.307 -10.511 5.403 1403 HD1 HIS 84 1HD HIS 84 12.246 -8.757 4.645 1404 HD2 HIS 84 2HD HIS 84 8.316 -7.719 3.793 1405 HE1 HIS 84 1HE HIS 84 12.316 -6.333 4.079 1406 HE2 HIS 84 2HE HIS 84 10.069 -5.927 3.099 1407 H GLY 85 H GLY 85 9.503 -13.121 1.961 1408 HA2 GLY 85 2HA GLY 85 9.671 -15.415 2.264 1409 HA3 GLY 85 1HA GLY 85 10.331 -15.140 3.874 1410 H ILE 86 H ILE 86 7.603 -13.358 3.165 1411 HA ILE 86 HA ILE 86 6.009 -15.005 4.984 1412 HB ILE 86 HB ILE 86 5.593 -12.148 4.060 1413 HG12 ILE 86 2HG1 ILE 86 6.611 -13.192 6.711 1414 HG13 ILE 86 1HG1 ILE 86 7.582 -12.381 5.486 1415 HG21 ILE 86 1HG2 ILE 86 3.908 -12.027 5.851 1416 HG22 ILE 86 2HG2 ILE 86 4.157 -13.738 6.192 1417 HG23 ILE 86 3HG2 ILE 86 3.490 -13.237 4.640 1418 HD11 ILE 86 1HD1 ILE 86 7.008 -10.862 7.279 1419 HD12 ILE 86 2HD1 ILE 86 5.292 -11.208 7.016 1420 HD13 ILE 86 3HD1 ILE 86 6.219 -10.368 5.772 1421 H ASP 87 H ASP 87 4.214 -15.949 4.218 1422 HA ASP 87 HA ASP 87 3.588 -15.369 1.426 1423 HB2 ASP 87 2HB ASP 87 3.065 -17.849 3.036 1424 HB3 ASP 87 1HB ASP 87 2.185 -17.518 1.553 1425 H ILE 88 H ILE 88 2.057 -14.120 1.029 1426 HA ILE 88 HA ILE 88 -0.377 -14.229 2.661 1427 HB ILE 88 HB ILE 88 0.468 -11.789 1.034 1428 HG12 ILE 88 2HG1 ILE 88 0.893 -12.106 4.007 1429 HG13 ILE 88 1HG1 ILE 88 2.190 -12.230 2.817 1430 HG21 ILE 88 1HG2 ILE 88 -1.457 -12.203 3.301 1431 HG22 ILE 88 2HG2 ILE 88 -1.871 -11.994 1.598 1432 HG23 ILE 88 3HG2 ILE 88 -1.132 -10.668 2.499 1433 HD11 ILE 88 1HD1 ILE 88 2.064 -9.999 3.860 1434 HD12 ILE 88 2HD1 ILE 88 0.437 -9.815 3.203 1435 HD13 ILE 88 3HD1 ILE 88 1.806 -9.953 2.110 1436 H LYS 89 H LYS 89 -2.209 -14.523 1.309 1437 HA LYS 89 HA LYS 89 -1.493 -14.804 -1.517 1438 HB2 LYS 89 2HB LYS 89 -3.686 -16.251 -0.025 1439 HB3 LYS 89 1HB LYS 89 -3.239 -16.499 -1.708 1440 HG2 LYS 89 2HG LYS 89 -1.579 -17.120 0.725 1441 HG3 LYS 89 1HG LYS 89 -2.353 -18.286 -0.346 1442 HD2 LYS 89 2HD LYS 89 -0.898 -17.554 -2.186 1443 HD3 LYS 89 1HD LYS 89 -0.153 -16.361 -1.121 1444 HE2 LYS 89 2HE LYS 89 0.596 -18.194 0.355 1445 HE3 LYS 89 1HE LYS 89 -0.075 -19.354 -0.784 1446 HZ1 LYS 89 1HZ LYS 89 1.466 -18.500 -2.472 1447 HZ2 LYS 89 2HZ LYS 89 2.292 -19.076 -1.124 1448 HZ3 LYS 89 3HZ LYS 89 2.124 -17.431 -1.350 Start of MODEL 7 1 H1 MET 1 1HT MET 1 -8.228 11.600 34.696 2 H2 MET 1 2HT MET 1 -6.795 12.355 35.191 3 H3 MET 1 3HT MET 1 -6.814 11.433 33.802 4 HA MET 1 HA MET 1 -8.209 12.938 32.670 5 HB2 MET 1 2HB MET 1 -8.792 15.101 33.653 6 HB3 MET 1 1HB MET 1 -9.490 13.797 34.596 7 HG2 MET 1 2HG MET 1 -7.785 14.057 36.289 8 HG3 MET 1 1HG MET 1 -6.966 15.277 35.319 9 HE1 MET 1 1HE MET 1 -9.524 18.224 35.387 10 HE2 MET 1 2HE MET 1 -9.471 16.957 34.165 11 HE3 MET 1 3HE MET 1 -7.971 17.661 34.784 12 H GLY 2 H GLY 2 -7.397 15.339 32.073 13 HA2 GLY 2 2HA GLY 2 -5.633 16.634 31.426 14 HA3 GLY 2 1HA GLY 2 -4.679 15.880 32.699 15 H PHE 3 H PHE 3 -6.267 14.701 29.777 16 HA PHE 3 HA PHE 3 -4.234 12.813 29.240 17 HB2 PHE 3 2HB PHE 3 -5.424 12.427 27.108 18 HB3 PHE 3 1HB PHE 3 -6.521 12.420 28.480 19 HD1 PHE 3 1HD PHE 3 -8.082 14.321 28.811 20 HD2 PHE 3 2HD PHE 3 -5.593 14.047 25.366 21 HE1 PHE 3 1HE PHE 3 -9.481 15.988 27.669 22 HE2 PHE 3 2HE PHE 3 -6.990 15.711 24.217 23 HZ PHE 3 HZ PHE 3 -8.938 16.686 25.371 24 H THR 4 H THR 4 -2.774 12.758 27.484 25 HA THR 4 HA THR 4 -2.002 15.408 26.528 26 HB THR 4 HB THR 4 -0.168 13.048 27.091 27 HG1 THR 4 1HG THR 4 -1.048 15.214 28.625 28 HG21 THR 4 1HG2 THR 4 0.665 14.593 25.365 29 HG22 THR 4 2HG2 THR 4 1.627 14.723 26.837 30 HG23 THR 4 3HG2 THR 4 0.421 15.956 26.460 31 H ASP 5 H ASP 5 -3.152 15.210 24.621 32 HA ASP 5 HA ASP 5 -2.798 12.852 22.988 33 HB2 ASP 5 2HB ASP 5 -5.029 13.879 23.140 34 HB3 ASP 5 1HB ASP 5 -4.389 15.369 22.456 35 H GLU 6 H GLU 6 -1.505 12.723 21.265 36 HA GLU 6 HA GLU 6 -0.303 15.207 20.347 37 HB2 GLU 6 2HB GLU 6 1.826 14.003 19.954 38 HB3 GLU 6 1HB GLU 6 1.389 14.137 21.643 39 HG2 GLU 6 2HG GLU 6 0.649 11.829 21.648 40 HG3 GLU 6 1HG GLU 6 1.063 11.683 19.934 41 H THR 7 H THR 7 -2.571 14.159 19.143 42 HA THR 7 HA THR 7 -1.584 12.885 16.783 43 HB THR 7 HB THR 7 -3.899 13.332 15.810 44 HG1 THR 7 1HG THR 7 -4.440 14.239 18.476 45 HG21 THR 7 1HG2 THR 7 -3.786 11.856 18.444 46 HG22 THR 7 2HG2 THR 7 -3.343 11.201 16.869 47 HG23 THR 7 3HG2 THR 7 -5.015 11.641 17.196 48 H VAL 8 H VAL 8 0.024 14.203 16.390 49 HA VAL 8 HA VAL 8 -0.605 16.800 15.196 50 HB VAL 8 HB VAL 8 1.791 17.387 15.718 51 HG11 VAL 8 1HG1 VAL 8 -0.054 18.119 17.164 52 HG12 VAL 8 2HG1 VAL 8 1.393 17.775 18.112 53 HG13 VAL 8 3HG1 VAL 8 0.064 16.617 18.077 54 HG21 VAL 8 1HG2 VAL 8 1.647 14.834 17.316 55 HG22 VAL 8 2HG2 VAL 8 2.947 16.013 17.420 56 HG23 VAL 8 3HG2 VAL 8 2.678 15.117 15.919 57 H ARG 9 H ARG 9 0.782 17.427 13.426 58 HA ARG 9 HA ARG 9 1.379 15.096 11.818 59 HB2 ARG 9 2HB ARG 9 0.630 17.890 11.003 60 HB3 ARG 9 1HB ARG 9 1.164 16.651 9.874 61 HG2 ARG 9 2HG ARG 9 -0.716 15.238 10.543 62 HG3 ARG 9 1HG ARG 9 -1.253 16.491 11.658 63 HD2 ARG 9 2HD ARG 9 -1.608 18.017 9.817 64 HD3 ARG 9 1HD ARG 9 -0.961 16.825 8.686 65 HE ARG 9 HE ARG 9 -3.100 15.706 10.113 66 HH11 ARG 9 1HH1 ARG 9 -2.520 18.116 7.585 67 HH12 ARG 9 2HH1 ARG 9 -3.992 17.848 6.794 68 HH21 ARG 9 1HH2 ARG 9 -5.114 15.339 9.036 69 HH22 ARG 9 2HH2 ARG 9 -5.538 16.222 7.638 70 H PHE 10 H PHE 10 3.313 14.570 11.898 71 HA PHE 10 HA PHE 10 5.419 16.465 11.095 72 HB2 PHE 10 2HB PHE 10 5.627 14.184 13.101 73 HB3 PHE 10 1HB PHE 10 7.023 14.927 12.351 74 HD1 PHE 10 1HD PHE 10 4.408 15.294 14.849 75 HD2 PHE 10 2HD PHE 10 7.710 17.164 12.965 76 HE1 PHE 10 1HE PHE 10 4.515 16.962 16.677 77 HE2 PHE 10 2HE PHE 10 7.817 18.827 14.778 78 HZ PHE 10 HZ PHE 10 6.216 18.720 16.632 79 H ASP 11 H ASP 11 3.479 14.666 9.916 80 HA ASP 11 HA ASP 11 4.297 12.187 9.122 81 HB2 ASP 11 2HB ASP 11 2.546 14.185 7.724 82 HB3 ASP 11 1HB ASP 11 2.703 12.499 7.249 83 H PHE 12 H PHE 12 6.411 12.076 8.525 84 HA PHE 12 HA PHE 12 7.087 11.494 6.052 85 HB2 PHE 12 2HB PHE 12 6.667 13.885 5.317 86 HB3 PHE 12 1HB PHE 12 7.944 14.390 6.412 87 HD1 PHE 12 1HD PHE 12 7.478 11.872 3.691 88 HD2 PHE 12 2HD PHE 12 9.947 14.852 5.431 89 HE1 PHE 12 1HE PHE 12 9.101 11.570 1.875 90 HE2 PHE 12 2HE PHE 12 11.583 14.559 3.625 91 HZ PHE 12 HZ PHE 12 11.164 12.915 1.840 92 H ASP 13 H ASP 13 8.878 10.355 6.342 93 HA ASP 13 HA ASP 13 10.849 11.487 8.172 94 HB2 ASP 13 2HB ASP 13 9.619 9.802 9.485 95 HB3 ASP 13 1HB ASP 13 9.959 8.588 8.261 96 H ASP 14 H ASP 14 12.098 12.112 6.513 97 HA ASP 14 HA ASP 14 12.740 10.258 4.439 98 HB2 ASP 14 2HB ASP 14 12.585 12.628 3.879 99 HB3 ASP 14 1HB ASP 14 13.951 12.974 4.941 100 H ASN 15 H ASN 15 13.815 8.689 4.895 101 HA ASN 15 HA ASN 15 16.538 8.664 5.208 102 HB2 ASN 15 2HB ASN 15 16.074 9.238 7.615 103 HB3 ASN 15 1HB ASN 15 15.034 7.826 7.735 104 HD21 ASN 15 1HD2 ASN 15 18.285 8.998 7.618 105 HD22 ASN 15 2HD2 ASN 15 19.052 7.510 8.007 106 H ARG 16 H ARG 16 16.008 7.456 3.409 107 HA ARG 16 HA ARG 16 14.255 5.252 3.889 108 HB2 ARG 16 2HB ARG 16 13.821 6.601 1.911 109 HB3 ARG 16 1HB ARG 16 15.407 6.202 1.282 110 HG2 ARG 16 2HG ARG 16 14.803 3.928 0.952 111 HG3 ARG 16 1HG ARG 16 13.294 4.136 1.845 112 HD2 ARG 16 2HD ARG 16 12.936 4.123 -0.588 113 HD3 ARG 16 1HD ARG 16 12.470 5.654 0.154 114 HE ARG 16 HE ARG 16 15.074 5.301 -1.118 115 HH11 ARG 16 1HH1 ARG 16 11.960 7.006 -0.941 116 HH12 ARG 16 2HH1 ARG 16 12.439 8.263 -1.991 117 HH21 ARG 16 1HH2 ARG 16 15.696 7.055 -2.589 118 HH22 ARG 16 2HH2 ARG 16 14.568 8.300 -2.914 119 H LYS 17 H LYS 17 14.892 3.655 4.618 120 HA LYS 17 HA LYS 17 17.277 2.234 3.753 121 HB2 LYS 17 2HB LYS 17 17.560 3.627 5.902 122 HB3 LYS 17 1HB LYS 17 16.313 2.622 6.614 123 HG2 LYS 17 2HG LYS 17 17.769 0.662 6.355 124 HG3 LYS 17 1HG LYS 17 19.002 1.697 5.628 125 HD2 LYS 17 2HD LYS 17 17.912 1.920 8.436 126 HD3 LYS 17 1HD LYS 17 19.499 1.303 7.986 127 HE2 LYS 17 2HE LYS 17 18.482 4.140 7.635 128 HE3 LYS 17 1HE LYS 17 19.671 3.581 8.795 129 HZ1 LYS 17 1HZ LYS 17 20.684 4.670 6.918 130 HZ2 LYS 17 2HZ LYS 17 20.038 3.570 5.833 131 HZ3 LYS 17 3HZ LYS 17 21.187 3.070 6.961 132 H LYS 18 H LYS 18 16.610 -0.114 5.208 133 HA LYS 18 HA LYS 18 14.065 -0.647 4.038 134 HB2 LYS 18 2HB LYS 18 14.248 -2.953 4.658 135 HB3 LYS 18 1HB LYS 18 15.846 -2.422 4.204 136 HG2 LYS 18 2HG LYS 18 14.885 -2.749 7.044 137 HG3 LYS 18 1HG LYS 18 15.763 -3.966 6.137 138 HD2 LYS 18 2HD LYS 18 17.671 -2.415 5.971 139 HD3 LYS 18 1HD LYS 18 16.763 -1.238 6.935 140 HE2 LYS 18 2HE LYS 18 16.625 -2.805 8.781 141 HE3 LYS 18 1HE LYS 18 17.429 -4.035 7.814 142 HZ1 LYS 18 1HZ LYS 18 18.961 -3.057 9.320 143 HZ2 LYS 18 2HZ LYS 18 18.647 -1.496 8.779 144 HZ3 LYS 18 3HZ LYS 18 19.393 -2.622 7.762 145 H ALA 19 H ALA 19 14.420 1.211 6.358 146 HA ALA 19 HA ALA 19 13.080 0.453 8.677 147 HB1 ALA 19 1HB ALA 19 14.356 2.505 8.413 148 HB2 ALA 19 2HB ALA 19 12.702 2.820 9.004 149 HB3 ALA 19 3HB ALA 19 13.089 3.073 7.302 150 H ILE 20 H ILE 20 11.829 1.644 5.591 151 HA ILE 20 HA ILE 20 9.152 1.982 6.435 152 HB ILE 20 HB ILE 20 10.305 1.423 3.686 153 HG12 ILE 20 2HG1 ILE 20 9.235 3.952 4.963 154 HG13 ILE 20 1HG1 ILE 20 10.915 3.597 4.587 155 HG21 ILE 20 1HG2 ILE 20 7.449 2.054 4.363 156 HG22 ILE 20 2HG2 ILE 20 8.066 0.562 3.653 157 HG23 ILE 20 3HG2 ILE 20 8.131 2.070 2.737 158 HD11 ILE 20 1HD1 ILE 20 9.959 5.140 2.976 159 HD12 ILE 20 2HD1 ILE 20 8.680 3.983 2.608 160 HD13 ILE 20 3HD1 ILE 20 10.355 3.614 2.187 161 H SER 21 H SER 21 10.993 -0.689 5.328 162 HA SER 21 HA SER 21 8.778 -2.501 5.159 163 HB2 SER 21 2HB SER 21 10.804 -2.920 3.842 164 HB3 SER 21 1HB SER 21 11.743 -3.084 5.332 165 HG SER 21 HG SER 21 10.643 -4.939 5.820 166 H GLU 22 H GLU 22 11.292 -1.748 7.480 167 HA GLU 22 HA GLU 22 10.820 -3.662 9.418 168 HB2 GLU 22 2HB GLU 22 11.576 -0.765 9.817 169 HB3 GLU 22 1HB GLU 22 11.759 -2.030 11.020 170 HG2 GLU 22 2HG GLU 22 13.133 -2.009 8.347 171 HG3 GLU 22 1HG GLU 22 13.856 -1.410 9.829 172 H THR 23 H THR 23 9.333 -0.499 8.982 173 HA THR 23 HA THR 23 7.547 -0.568 11.119 174 HB THR 23 HB THR 23 7.317 0.761 8.410 175 HG1 THR 23 1HG THR 23 8.871 1.209 10.525 176 HG21 THR 23 1HG2 THR 23 5.120 0.650 9.490 177 HG22 THR 23 2HG2 THR 23 5.725 2.307 9.498 178 HG23 THR 23 3HG2 THR 23 5.790 1.334 10.968 179 H LEU 24 H LEU 24 7.037 -1.506 7.710 180 HA LEU 24 HA LEU 24 4.340 -2.233 8.027 181 HB2 LEU 24 2HB LEU 24 6.309 -3.099 5.927 182 HB3 LEU 24 1HB LEU 24 4.576 -3.351 5.858 183 HG LEU 24 HG LEU 24 5.944 -0.667 5.873 184 HD11 LEU 24 1HD1 LEU 24 5.189 -0.536 3.564 185 HD12 LEU 24 2HD1 LEU 24 4.581 -2.188 3.665 186 HD13 LEU 24 3HD1 LEU 24 6.311 -1.877 3.806 187 HD21 LEU 24 1HD2 LEU 24 3.749 -0.567 6.927 188 HD22 LEU 24 2HD2 LEU 24 3.038 -1.418 5.554 189 HD23 LEU 24 3HD2 LEU 24 3.704 0.201 5.345 190 H GLU 25 H GLU 25 7.270 -4.235 8.042 191 HA GLU 25 HA GLU 25 5.952 -6.665 8.210 192 HB2 GLU 25 2HB GLU 25 8.688 -5.889 9.208 193 HB3 GLU 25 1HB GLU 25 8.112 -7.552 9.108 194 HG2 GLU 25 2HG GLU 25 7.820 -7.309 6.701 195 HG3 GLU 25 1HG GLU 25 8.380 -5.641 6.797 196 H THR 26 H THR 26 6.941 -4.343 10.668 197 HA THR 26 HA THR 26 6.352 -5.917 12.957 198 HB THR 26 HB THR 26 6.396 -2.898 12.688 199 HG1 THR 26 1HG THR 26 8.413 -3.367 12.292 200 HG21 THR 26 1HG2 THR 26 6.836 -2.906 15.112 201 HG22 THR 26 2HG2 THR 26 6.703 -4.664 15.129 202 HG23 THR 26 3HG2 THR 26 5.293 -3.680 14.746 203 H VAL 27 H VAL 27 4.485 -3.443 11.162 204 HA VAL 27 HA VAL 27 2.168 -3.516 12.758 205 HB VAL 27 HB VAL 27 2.309 -2.992 9.758 206 HG11 VAL 27 1HG1 VAL 27 0.039 -3.396 10.526 207 HG12 VAL 27 2HG1 VAL 27 0.258 -1.688 10.108 208 HG13 VAL 27 3HG1 VAL 27 0.252 -2.192 11.797 209 HG21 VAL 27 1HG2 VAL 27 2.445 -0.993 12.022 210 HG22 VAL 27 2HG2 VAL 27 2.450 -0.625 10.300 211 HG23 VAL 27 3HG2 VAL 27 3.801 -1.496 11.015 212 H TYR 28 H TYR 28 3.194 -5.405 10.001 213 HA TYR 28 HA TYR 28 0.912 -6.920 9.619 214 HB2 TYR 28 2HB TYR 28 2.676 -6.927 7.967 215 HB3 TYR 28 1HB TYR 28 3.813 -7.614 9.121 216 HD1 TYR 28 1HD TYR 28 3.938 -9.925 9.470 217 HD2 TYR 28 2HD TYR 28 0.778 -8.342 7.123 218 HE1 TYR 28 1HE TYR 28 3.323 -12.188 8.787 219 HE2 TYR 28 2HE TYR 28 0.147 -10.629 6.431 220 HH TYR 28 HH TYR 28 1.367 -13.306 8.067 221 H ARG 29 H ARG 29 3.762 -7.678 11.623 222 HA ARG 29 HA ARG 29 2.788 -10.154 12.571 223 HB2 ARG 29 2HB ARG 29 4.787 -8.284 13.852 224 HB3 ARG 29 1HB ARG 29 4.490 -9.936 14.372 225 HG2 ARG 29 2HG ARG 29 5.572 -9.084 11.691 226 HG3 ARG 29 1HG ARG 29 6.494 -9.795 13.015 227 HD2 ARG 29 2HD ARG 29 5.135 -11.829 12.852 228 HD3 ARG 29 1HD ARG 29 4.233 -11.123 11.511 229 HE ARG 29 HE ARG 29 7.061 -11.191 11.101 230 HH11 ARG 29 1HH1 ARG 29 4.019 -13.009 10.679 231 HH12 ARG 29 2HH1 ARG 29 4.692 -14.066 9.528 232 HH21 ARG 29 1HH2 ARG 29 7.933 -12.645 9.574 233 HH22 ARG 29 2HH2 ARG 29 6.990 -13.895 8.896 234 H ALA 30 H ALA 30 2.361 -6.902 13.712 235 HA ALA 30 HA ALA 30 1.318 -7.418 16.246 236 HB1 ALA 30 1HB ALA 30 1.986 -5.183 15.492 237 HB2 ALA 30 2HB ALA 30 0.345 -5.184 16.140 238 HB3 ALA 30 3HB ALA 30 0.608 -5.143 14.394 239 H LEU 31 H LEU 31 -0.383 -7.135 13.130 240 HA LEU 31 HA LEU 31 -2.830 -7.678 14.448 241 HB2 LEU 31 2HB LEU 31 -2.288 -7.431 11.524 242 HB3 LEU 31 1HB LEU 31 -3.843 -7.979 12.108 243 HG LEU 31 HG LEU 31 -3.853 -5.836 13.479 244 HD11 LEU 31 1HD1 LEU 31 -1.799 -5.048 11.454 245 HD12 LEU 31 2HD1 LEU 31 -1.579 -5.123 13.208 246 HD13 LEU 31 3HD1 LEU 31 -2.675 -3.932 12.492 247 HD21 LEU 31 1HD2 LEU 31 -4.872 -4.581 11.744 248 HD22 LEU 31 2HD2 LEU 31 -5.352 -6.254 11.616 249 HD23 LEU 31 3HD2 LEU 31 -4.165 -5.565 10.488 250 H GLU 32 H GLU 32 -0.525 -9.778 12.973 251 HA GLU 32 HA GLU 32 -2.252 -12.021 12.786 252 HB2 GLU 32 2HB GLU 32 0.704 -12.022 13.408 253 HB3 GLU 32 1HB GLU 32 -0.230 -13.433 12.950 254 HG2 GLU 32 2HG GLU 32 -0.676 -12.325 10.761 255 HG3 GLU 32 1HG GLU 32 0.427 -11.038 11.257 256 H GLU 33 H GLU 33 -0.348 -10.689 15.414 257 HA GLU 33 HA GLU 33 -0.976 -12.748 17.271 258 HB2 GLU 33 2HB GLU 33 0.081 -9.956 17.649 259 HB3 GLU 33 1HB GLU 33 -0.162 -11.081 18.976 260 HG2 GLU 33 2HG GLU 33 1.625 -11.552 16.605 261 HG3 GLU 33 1HG GLU 33 2.151 -11.034 18.209 262 H LYS 34 H LYS 34 -2.626 -9.961 16.207 263 HA LYS 34 HA LYS 34 -4.478 -10.075 18.448 264 HB2 LYS 34 2HB LYS 34 -4.176 -8.134 16.169 265 HB3 LYS 34 1HB LYS 34 -5.479 -8.030 17.344 266 HG2 LYS 34 2HG LYS 34 -2.548 -7.958 18.060 267 HG3 LYS 34 1HG LYS 34 -3.540 -6.524 17.797 268 HD2 LYS 34 2HD LYS 34 -4.222 -8.641 19.855 269 HD3 LYS 34 1HD LYS 34 -3.244 -7.221 20.210 270 HE2 LYS 34 2HE LYS 34 -4.965 -5.768 19.635 271 HE3 LYS 34 1HE LYS 34 -6.014 -7.067 19.036 272 HZ1 LYS 34 1HZ LYS 34 -6.120 -7.906 21.327 273 HZ2 LYS 34 2HZ LYS 34 -6.692 -6.330 21.237 274 HZ3 LYS 34 3HZ LYS 34 -5.156 -6.642 21.869 275 H GLY 35 H GLY 35 -4.139 -11.687 15.670 276 HA2 GLY 35 2HA GLY 35 -5.508 -13.179 14.613 277 HA3 GLY 35 1HA GLY 35 -6.730 -12.808 15.815 278 H TYR 36 H TYR 36 -5.430 -10.284 13.817 279 HA TYR 36 HA TYR 36 -8.038 -10.134 12.436 280 HB2 TYR 36 2HB TYR 36 -5.954 -7.972 12.837 281 HB3 TYR 36 1HB TYR 36 -7.445 -7.768 11.936 282 HD1 TYR 36 1HD TYR 36 -5.867 -7.253 15.000 283 HD2 TYR 36 2HD TYR 36 -9.625 -8.329 13.356 284 HE1 TYR 36 1HE TYR 36 -6.972 -6.504 17.065 285 HE2 TYR 36 2HE TYR 36 -10.745 -7.586 15.412 286 HH TYR 36 HH TYR 36 -10.219 -7.239 17.732 287 H ASN 37 H ASN 37 -7.613 -8.817 10.231 288 HA ASN 37 HA ASN 37 -5.556 -10.313 8.794 289 HB2 ASN 37 2HB ASN 37 -7.914 -8.706 7.752 290 HB3 ASN 37 1HB ASN 37 -6.721 -9.464 6.719 291 HD21 ASN 37 1HD2 ASN 37 -9.579 -9.873 6.875 292 HD22 ASN 37 2HD2 ASN 37 -9.821 -11.540 7.202 293 HA PRO 38 HA PRO 38 -3.010 -6.722 9.679 294 HB2 PRO 38 2HB PRO 38 -1.378 -8.182 7.685 295 HB3 PRO 38 1HB PRO 38 -0.915 -7.468 9.233 296 HG2 PRO 38 2HG PRO 38 -1.251 -10.087 9.000 297 HG3 PRO 38 1HG PRO 38 -1.779 -9.229 10.457 298 HD2 PRO 38 2HD PRO 38 -3.404 -10.343 8.232 299 HD3 PRO 38 1HD PRO 38 -3.783 -10.139 9.961 300 H ILE 39 H ILE 39 -3.561 -7.890 6.369 301 HA ILE 39 HA ILE 39 -2.361 -5.598 5.229 302 HB ILE 39 HB ILE 39 -4.171 -7.627 3.893 303 HG12 ILE 39 2HG1 ILE 39 -2.203 -8.698 4.821 304 HG13 ILE 39 1HG1 ILE 39 -2.020 -8.586 3.075 305 HG21 ILE 39 1HG2 ILE 39 -3.198 -6.833 1.788 306 HG22 ILE 39 2HG2 ILE 39 -2.274 -5.615 2.674 307 HG23 ILE 39 3HG2 ILE 39 -4.031 -5.528 2.633 308 HD11 ILE 39 1HD1 ILE 39 -0.546 -6.637 3.379 309 HD12 ILE 39 2HD1 ILE 39 0.066 -8.074 4.184 310 HD13 ILE 39 3HD1 ILE 39 -0.700 -6.803 5.132 311 H ASN 40 H ASN 40 -5.705 -6.407 5.886 312 HA ASN 40 HA ASN 40 -6.935 -4.351 4.444 313 HB2 ASN 40 2HB ASN 40 -7.834 -5.690 6.983 314 HB3 ASN 40 1HB ASN 40 -8.823 -4.540 6.089 315 HD21 ASN 40 1HD2 ASN 40 -9.698 -5.139 4.139 316 HD22 ASN 40 2HD2 ASN 40 -9.740 -6.775 3.597 317 H GLN 41 H GLN 41 -5.660 -4.281 7.733 318 HA GLN 41 HA GLN 41 -6.685 -1.658 8.102 319 HB2 GLN 41 2HB GLN 41 -4.680 -3.147 9.791 320 HB3 GLN 41 1HB GLN 41 -5.505 -1.660 10.245 321 HG2 GLN 41 2HG GLN 41 -6.772 -4.356 9.774 322 HG3 GLN 41 1HG GLN 41 -6.594 -3.519 11.310 323 HE21 GLN 41 1HE2 GLN 41 -7.935 -1.815 11.769 324 HE22 GLN 41 2HE2 GLN 41 -9.401 -1.506 10.912 325 H ILE 42 H ILE 42 -3.636 -2.971 7.032 326 HA ILE 42 HA ILE 42 -2.225 -0.515 7.204 327 HB ILE 42 HB ILE 42 -1.669 -2.868 5.357 328 HG12 ILE 42 2HG1 ILE 42 -0.447 -2.156 8.040 329 HG13 ILE 42 1HG1 ILE 42 -1.601 -3.454 7.763 330 HG21 ILE 42 1HG2 ILE 42 0.083 -0.521 6.145 331 HG22 ILE 42 2HG2 ILE 42 -0.595 -0.823 4.553 332 HG23 ILE 42 3HG2 ILE 42 0.621 -1.918 5.211 333 HD11 ILE 42 1HD1 ILE 42 0.032 -4.585 6.328 334 HD12 ILE 42 2HD1 ILE 42 0.669 -4.308 7.950 335 HD13 ILE 42 3HD1 ILE 42 1.179 -3.276 6.612 336 H VAL 43 H VAL 43 -3.824 -2.172 4.453 337 HA VAL 43 HA VAL 43 -3.389 -0.072 2.644 338 HB VAL 43 HB VAL 43 -4.020 -2.257 1.743 339 HG11 VAL 43 1HG1 VAL 43 -5.500 -3.015 3.517 340 HG12 VAL 43 2HG1 VAL 43 -6.299 -3.159 1.952 341 HG13 VAL 43 3HG1 VAL 43 -6.715 -1.829 3.037 342 HG21 VAL 43 1HG2 VAL 43 -6.169 -0.227 1.133 343 HG22 VAL 43 2HG2 VAL 43 -5.788 -1.637 0.145 344 HG23 VAL 43 3HG2 VAL 43 -4.595 -0.356 0.348 345 H GLY 44 H GLY 44 -6.026 -0.592 4.958 346 HA2 GLY 44 2HA GLY 44 -7.636 1.544 4.182 347 HA3 GLY 44 1HA GLY 44 -7.537 0.863 5.806 348 H TYR 45 H TYR 45 -4.905 1.397 6.474 349 HA TYR 45 HA TYR 45 -5.093 4.104 7.217 350 HB2 TYR 45 2HB TYR 45 -3.809 2.580 8.618 351 HB3 TYR 45 1HB TYR 45 -2.655 2.311 7.313 352 HD1 TYR 45 1HD TYR 45 -0.777 3.765 7.061 353 HD2 TYR 45 2HD TYR 45 -4.012 4.943 9.525 354 HE1 TYR 45 1HE TYR 45 0.518 5.706 7.833 355 HE2 TYR 45 2HE TYR 45 -2.739 6.877 10.298 356 HH TYR 45 HH TYR 45 0.182 7.847 8.811 357 H LEU 46 H LEU 46 -3.146 2.527 4.714 358 HA LEU 46 HA LEU 46 -2.009 4.994 4.126 359 HB2 LEU 46 2HB LEU 46 -1.815 2.421 2.648 360 HB3 LEU 46 1HB LEU 46 -1.152 3.893 1.954 361 HG LEU 46 HG LEU 46 0.203 4.103 4.119 362 HD11 LEU 46 1HD1 LEU 46 0.675 2.156 5.401 363 HD12 LEU 46 2HD1 LEU 46 -0.537 1.258 4.483 364 HD13 LEU 46 3HD1 LEU 46 -1.038 2.606 5.482 365 HD21 LEU 46 1HD2 LEU 46 1.242 3.480 2.034 366 HD22 LEU 46 2HD2 LEU 46 0.782 1.795 2.282 367 HD23 LEU 46 3HD2 LEU 46 1.944 2.560 3.366 368 H LEU 47 H LEU 47 -4.844 3.514 2.795 369 HA LEU 47 HA LEU 47 -4.962 5.518 0.729 370 HB2 LEU 47 2HB LEU 47 -7.082 3.582 1.641 371 HB3 LEU 47 1HB LEU 47 -7.193 4.618 0.233 372 HG LEU 47 HG LEU 47 -5.290 2.316 0.635 373 HD11 LEU 47 1HD1 LEU 47 -6.488 1.328 -1.232 374 HD12 LEU 47 2HD1 LEU 47 -7.591 2.699 -1.260 375 HD13 LEU 47 3HD1 LEU 47 -7.552 1.628 0.144 376 HD21 LEU 47 1HD2 LEU 47 -4.582 2.742 -1.688 377 HD22 LEU 47 2HD2 LEU 47 -4.162 4.075 -0.611 378 HD23 LEU 47 3HD2 LEU 47 -5.543 4.219 -1.693 379 H SER 48 H SER 48 -6.625 5.001 3.845 380 HA SER 48 HA SER 48 -8.205 7.380 3.374 381 HB2 SER 48 2HB SER 48 -8.179 5.468 5.703 382 HB3 SER 48 1HB SER 48 -9.394 6.709 5.394 383 HG SER 48 HG SER 48 -9.682 5.568 3.312 384 H GLY 49 H GLY 49 -5.271 6.504 5.179 385 HA2 GLY 49 2HA GLY 49 -3.849 7.858 6.261 386 HA3 GLY 49 1HA GLY 49 -4.924 9.212 5.949 387 H ASP 50 H ASP 50 -6.382 6.511 7.467 388 HA ASP 50 HA ASP 50 -6.513 8.076 9.934 389 HB2 ASP 50 2HB ASP 50 -8.330 5.867 8.968 390 HB3 ASP 50 1HB ASP 50 -8.460 6.628 10.547 391 HA PRO 51 HA PRO 51 -3.655 5.126 11.671 392 HB2 PRO 51 2HB PRO 51 -3.609 6.243 14.177 393 HB3 PRO 51 1HB PRO 51 -2.651 6.818 12.808 394 HG2 PRO 51 2HG PRO 51 -5.223 7.869 13.892 395 HG3 PRO 51 1HG PRO 51 -3.813 8.762 13.294 396 HD2 PRO 51 2HD PRO 51 -6.058 8.425 11.841 397 HD3 PRO 51 1HD PRO 51 -4.453 8.523 11.087 398 H ALA 52 H ALA 52 -6.797 5.860 12.792 399 HA ALA 52 HA ALA 52 -7.108 4.228 15.018 400 HB1 ALA 52 1HB ALA 52 -9.201 4.916 12.967 401 HB2 ALA 52 2HB ALA 52 -8.710 5.940 14.316 402 HB3 ALA 52 3HB ALA 52 -9.490 4.388 14.623 403 H TYR 53 H TYR 53 -6.830 3.253 11.702 404 HA TYR 53 HA TYR 53 -8.238 0.832 11.885 405 HB2 TYR 53 2HB TYR 53 -6.034 1.682 10.023 406 HB3 TYR 53 1HB TYR 53 -6.827 0.115 9.918 407 HD1 TYR 53 1HD TYR 53 -9.477 0.322 10.023 408 HD2 TYR 53 2HD TYR 53 -6.829 3.311 8.617 409 HE1 TYR 53 1HE TYR 53 -11.268 1.245 8.720 410 HE2 TYR 53 2HE TYR 53 -8.619 4.278 7.268 411 HH TYR 53 HH TYR 53 -11.901 3.314 7.660 412 H ILE 54 H ILE 54 -4.992 1.750 12.848 413 HA ILE 54 HA ILE 54 -4.152 -1.009 13.030 414 HB ILE 54 HB ILE 54 -2.604 1.477 13.902 415 HG12 ILE 54 2HG1 ILE 54 -3.079 1.580 11.490 416 HG13 ILE 54 1HG1 ILE 54 -1.382 1.220 11.778 417 HG21 ILE 54 1HG2 ILE 54 -0.647 0.048 13.807 418 HG22 ILE 54 2HG2 ILE 54 -1.668 -1.336 13.420 419 HG23 ILE 54 3HG2 ILE 54 -1.825 -0.536 14.983 420 HD11 ILE 54 1HD1 ILE 54 -3.505 -0.764 10.973 421 HD12 ILE 54 2HD1 ILE 54 -1.807 -1.142 11.277 422 HD13 ILE 54 3HD1 ILE 54 -2.255 -0.089 9.935 423 HA PRO 55 HA PRO 55 -5.732 -1.186 17.208 424 HB2 PRO 55 2HB PRO 55 -4.893 -3.737 17.716 425 HB3 PRO 55 1HB PRO 55 -6.358 -3.377 16.797 426 HG2 PRO 55 2HG PRO 55 -3.639 -4.133 15.817 427 HG3 PRO 55 1HG PRO 55 -5.228 -4.651 15.222 428 HD2 PRO 55 2HD PRO 55 -3.735 -2.749 14.002 429 HD3 PRO 55 1HD PRO 55 -5.511 -2.741 13.962 430 H ARG 56 H ARG 56 -4.777 -0.830 19.152 431 HA ARG 56 HA ARG 56 -1.947 -0.387 19.040 432 HB2 ARG 56 2HB ARG 56 -3.987 0.389 21.122 433 HB3 ARG 56 1HB ARG 56 -2.267 0.564 21.413 434 HG2 ARG 56 2HG ARG 56 -3.243 2.676 20.699 435 HG3 ARG 56 1HG ARG 56 -2.099 2.091 19.497 436 HD2 ARG 56 2HD ARG 56 -4.057 2.989 18.395 437 HD3 ARG 56 1HD ARG 56 -4.004 1.244 18.164 438 HE ARG 56 HE ARG 56 -5.555 1.936 20.424 439 HH11 ARG 56 1HH1 ARG 56 -5.717 1.803 16.860 440 HH12 ARG 56 2HH1 ARG 56 -7.420 1.784 16.830 441 HH21 ARG 56 1HH2 ARG 56 -7.860 1.867 20.330 442 HH22 ARG 56 2HH2 ARG 56 -8.654 1.804 18.816 443 H TYR 57 H TYR 57 -1.599 -2.600 18.771 444 HA TYR 57 HA TYR 57 -1.455 -4.171 21.208 445 HB2 TYR 57 2HB TYR 57 -2.090 -5.386 19.242 446 HB3 TYR 57 1HB TYR 57 -0.717 -4.759 18.338 447 HD1 TYR 57 1HD TYR 57 -1.610 -6.945 21.207 448 HD2 TYR 57 2HD TYR 57 1.320 -5.916 18.315 449 HE1 TYR 57 1HE TYR 57 -0.307 -8.868 21.880 450 HE2 TYR 57 2HE TYR 57 2.672 -7.833 18.982 451 HH TYR 57 HH TYR 57 1.493 -10.335 21.007 452 H GLN 58 H GLN 58 0.664 -2.448 18.978 453 HA GLN 58 HA GLN 58 2.866 -2.733 20.860 454 HB2 GLN 58 2HB GLN 58 2.869 -4.676 19.169 455 HB3 GLN 58 1HB GLN 58 3.156 -3.456 17.934 456 HG2 GLN 58 2HG GLN 58 5.268 -2.868 19.032 457 HG3 GLN 58 1HG GLN 58 4.946 -4.117 20.245 458 HE21 GLN 58 1HE2 GLN 58 7.085 -3.732 18.340 459 HE22 GLN 58 2HE2 GLN 58 7.177 -5.208 17.428 460 H ASP 59 H ASP 59 4.811 -1.454 19.718 461 HA ASP 59 HA ASP 59 4.118 1.217 19.414 462 HB2 ASP 59 2HB ASP 59 6.487 1.597 18.850 463 HB3 ASP 59 1HB ASP 59 6.312 0.542 20.243 464 H ALA 60 H ALA 60 3.859 -1.198 17.182 465 HA ALA 60 HA ALA 60 4.512 -0.212 14.703 466 HB1 ALA 60 1HB ALA 60 3.608 -2.453 15.151 467 HB2 ALA 60 2HB ALA 60 2.803 -1.658 13.805 468 HB3 ALA 60 3HB ALA 60 2.009 -1.746 15.377 469 H ARG 61 H ARG 61 1.589 0.632 16.605 470 HA ARG 61 HA ARG 61 0.273 2.137 14.640 471 HB2 ARG 61 2HB ARG 61 -0.658 1.279 16.842 472 HB3 ARG 61 1HB ARG 61 0.220 2.556 17.648 473 HG2 ARG 61 2HG ARG 61 -1.976 3.032 15.615 474 HG3 ARG 61 1HG ARG 61 -2.243 2.942 17.346 475 HD2 ARG 61 2HD ARG 61 -0.718 4.899 17.613 476 HD3 ARG 61 1HD ARG 61 -0.598 4.993 15.858 477 HE ARG 61 HE ARG 61 -3.296 5.001 16.474 478 HH11 ARG 61 1HH1 ARG 61 -0.527 7.117 17.054 479 HH12 ARG 61 2HH1 ARG 61 -1.445 8.530 17.202 480 HH21 ARG 61 1HH2 ARG 61 -4.574 6.934 16.670 481 HH22 ARG 61 2HH2 ARG 61 -3.824 8.423 16.993 482 H ASN 62 H ASN 62 2.874 2.932 16.858 483 HA ASN 62 HA ASN 62 2.879 5.758 16.343 484 HB2 ASN 62 2HB ASN 62 3.765 4.875 18.458 485 HB3 ASN 62 1HB ASN 62 4.968 3.941 17.579 486 HD21 ASN 62 1HD2 ASN 62 4.045 7.066 18.720 487 HD22 ASN 62 2HD2 ASN 62 5.537 7.861 18.391 488 H LEU 63 H LEU 63 4.746 2.964 15.295 489 HA LEU 63 HA LEU 63 6.698 4.198 13.727 490 HB2 LEU 63 2HB LEU 63 5.382 1.522 13.310 491 HB3 LEU 63 1HB LEU 63 6.863 2.056 12.546 492 HG LEU 63 HG LEU 63 6.502 1.634 15.509 493 HD11 LEU 63 1HD1 LEU 63 7.909 -0.034 13.425 494 HD12 LEU 63 2HD1 LEU 63 6.421 -0.475 14.260 495 HD13 LEU 63 3HD1 LEU 63 7.914 -0.325 15.165 496 HD21 LEU 63 1HD2 LEU 63 8.941 2.258 13.843 497 HD22 LEU 63 2HD2 LEU 63 8.944 1.846 15.555 498 HD23 LEU 63 3HD2 LEU 63 8.171 3.334 15.016 499 H ILE 64 H ILE 64 3.442 3.139 12.856 500 HA ILE 64 HA ILE 64 3.851 3.677 10.096 501 HB ILE 64 HB ILE 64 2.274 1.938 11.101 502 HG12 ILE 64 2HG1 ILE 64 1.004 3.804 9.090 503 HG13 ILE 64 1HG1 ILE 64 2.238 2.610 8.701 504 HG21 ILE 64 1HG2 ILE 64 0.521 4.352 11.512 505 HG22 ILE 64 2HG2 ILE 64 1.194 3.314 12.768 506 HG23 ILE 64 3HG2 ILE 64 -0.012 2.677 11.646 507 HD11 ILE 64 1HD1 ILE 64 0.721 0.821 9.424 508 HD12 ILE 64 2HD1 ILE 64 0.015 1.800 8.134 509 HD13 ILE 64 3HD1 ILE 64 -0.507 2.025 9.804 510 H ARG 65 H ARG 65 3.152 5.644 12.758 511 HA ARG 65 HA ARG 65 1.851 7.794 11.297 512 HB2 ARG 65 2HB ARG 65 2.836 7.503 14.136 513 HB3 ARG 65 1HB ARG 65 2.294 9.042 13.500 514 HG2 ARG 65 2HG ARG 65 0.607 6.548 13.652 515 HG3 ARG 65 1HG ARG 65 0.575 7.869 14.822 516 HD2 ARG 65 2HD ARG 65 -0.140 8.031 11.891 517 HD3 ARG 65 1HD ARG 65 -1.228 8.158 13.269 518 HE ARG 65 HE ARG 65 0.001 10.221 13.886 519 HH11 ARG 65 1HH1 ARG 65 -0.068 9.136 10.511 520 HH12 ARG 65 2HH1 ARG 65 0.349 10.704 9.927 521 HH21 ARG 65 1HH2 ARG 65 0.503 12.343 12.979 522 HH22 ARG 65 2HH2 ARG 65 0.676 12.518 11.292 523 H ARG 66 H ARG 66 4.964 6.666 11.803 524 HA ARG 66 HA ARG 66 6.373 9.163 12.046 525 HB2 ARG 66 2HB ARG 66 7.145 6.973 12.970 526 HB3 ARG 66 1HB ARG 66 7.413 6.420 11.336 527 HG2 ARG 66 2HG ARG 66 9.519 7.009 12.243 528 HG3 ARG 66 1HG ARG 66 9.098 8.268 11.083 529 HD2 ARG 66 2HD ARG 66 8.675 8.471 14.066 530 HD3 ARG 66 1HD ARG 66 10.088 9.096 13.231 531 HE ARG 66 HE ARG 66 8.322 10.444 11.946 532 HH11 ARG 66 1HH1 ARG 66 7.973 9.578 15.390 533 HH12 ARG 66 2HH1 ARG 66 7.218 11.051 15.793 534 HH21 ARG 66 1HH2 ARG 66 7.328 12.419 12.550 535 HH22 ARG 66 2HH2 ARG 66 6.839 12.686 14.185 536 H HIS 67 H HIS 67 5.536 6.969 9.446 537 HA HIS 67 HA HIS 67 7.035 8.619 7.486 538 HB2 HIS 67 2HB HIS 67 6.006 5.787 7.230 539 HB3 HIS 67 1HB HIS 67 6.870 6.665 5.978 540 HD1 HIS 67 1HD HIS 67 9.396 6.781 6.182 541 HD2 HIS 67 2HD HIS 67 7.580 4.782 9.329 542 HE1 HIS 67 1HE HIS 67 11.245 5.582 7.374 543 HE2 HIS 67 2HE HIS 67 10.155 4.788 9.472 544 H GLU 68 H GLU 68 5.915 9.183 5.496 545 HA GLU 68 HA GLU 68 3.086 9.636 5.851 546 HB2 GLU 68 2HB GLU 68 4.719 9.907 3.311 547 HB3 GLU 68 1HB GLU 68 3.060 10.403 3.497 548 HG2 GLU 68 2HG GLU 68 3.801 12.039 5.192 549 HG3 GLU 68 1HG GLU 68 5.469 11.577 4.830 550 H ARG 69 H ARG 69 1.412 8.841 4.411 551 HA ARG 69 HA ARG 69 1.634 6.039 3.947 552 HB2 ARG 69 2HB ARG 69 -0.574 7.963 2.983 553 HB3 ARG 69 1HB ARG 69 -0.578 6.236 2.800 554 HG2 ARG 69 2HG ARG 69 -2.081 6.828 4.527 555 HG3 ARG 69 1HG ARG 69 -0.693 6.061 5.302 556 HD2 ARG 69 2HD ARG 69 -1.129 9.027 5.087 557 HD3 ARG 69 1HD ARG 69 -1.741 8.060 6.419 558 HE ARG 69 HE ARG 69 0.950 7.560 6.281 559 HH11 ARG 69 1HH1 ARG 69 -1.121 10.416 6.678 560 HH12 ARG 69 2HH1 ARG 69 -0.016 11.194 7.720 561 HH21 ARG 69 1HH2 ARG 69 2.479 8.746 7.781 562 HH22 ARG 69 2HH2 ARG 69 1.916 10.280 8.312 563 H ASP 70 H ASP 70 1.675 8.943 2.087 564 HA ASP 70 HA ASP 70 1.940 8.147 -0.566 565 HB2 ASP 70 2HB ASP 70 1.714 10.456 0.215 566 HB3 ASP 70 1HB ASP 70 3.306 10.384 0.946 567 H GLU 71 H GLU 71 4.432 8.742 1.825 568 HA GLU 71 HA GLU 71 6.799 8.258 0.459 569 HB2 GLU 71 2HB GLU 71 6.478 9.260 2.726 570 HB3 GLU 71 1HB GLU 71 6.187 7.645 3.351 571 HG2 GLU 71 2HG GLU 71 8.496 7.073 2.559 572 HG3 GLU 71 1HG GLU 71 8.707 8.792 2.214 573 H ILE 72 H ILE 72 4.901 6.027 2.408 574 HA ILE 72 HA ILE 72 6.577 3.773 1.921 575 HB ILE 72 HB ILE 72 3.792 3.960 3.047 576 HG12 ILE 72 2HG1 ILE 72 6.479 3.781 4.445 577 HG13 ILE 72 1HG1 ILE 72 5.417 5.173 4.380 578 HG21 ILE 72 1HG2 ILE 72 4.185 1.715 2.228 579 HG22 ILE 72 2HG2 ILE 72 4.199 1.722 3.992 580 HG23 ILE 72 3HG2 ILE 72 5.718 1.637 3.100 581 HD11 ILE 72 1HD1 ILE 72 4.739 2.554 5.703 582 HD12 ILE 72 2HD1 ILE 72 3.732 3.998 5.672 583 HD13 ILE 72 3HD1 ILE 72 5.274 4.010 6.535 584 H MET 73 H MET 73 3.471 4.890 0.642 585 HA MET 73 HA MET 73 2.835 2.468 -0.631 586 HB2 MET 73 2HB MET 73 1.171 4.196 0.080 587 HB3 MET 73 1HB MET 73 1.698 5.199 -1.251 588 HG2 MET 73 2HG MET 73 0.460 2.459 -1.562 589 HG3 MET 73 1HG MET 73 -0.441 3.964 -1.626 590 HE1 MET 73 1HE MET 73 -0.468 2.671 -5.318 591 HE2 MET 73 2HE MET 73 -1.433 3.112 -3.902 592 HE3 MET 73 3HE MET 73 -0.451 1.652 -3.877 593 H GLU 74 H GLU 74 4.490 5.387 -1.899 594 HA GLU 74 HA GLU 74 4.419 4.452 -4.568 595 HB2 GLU 74 2HB GLU 74 6.218 5.975 -5.120 596 HB3 GLU 74 1HB GLU 74 5.103 6.797 -4.041 597 HG2 GLU 74 2HG GLU 74 6.631 6.701 -2.257 598 HG3 GLU 74 1HG GLU 74 7.632 5.501 -3.078 599 H GLU 75 H GLU 75 6.534 3.807 -1.897 600 HA GLU 75 HA GLU 75 8.547 2.457 -3.334 601 HB2 GLU 75 2HB GLU 75 8.820 3.327 -1.013 602 HB3 GLU 75 1HB GLU 75 7.728 2.069 -0.448 603 HG2 GLU 75 2HG GLU 75 10.046 1.462 -0.053 604 HG3 GLU 75 1HG GLU 75 9.298 0.363 -1.213 605 H LEU 76 H LEU 76 5.660 1.369 -1.642 606 HA LEU 76 HA LEU 76 5.863 -1.391 -2.022 607 HB2 LEU 76 2HB LEU 76 3.348 0.275 -2.162 608 HB3 LEU 76 1HB LEU 76 3.416 -1.449 -1.882 609 HG LEU 76 HG LEU 76 4.439 0.686 -0.014 610 HD11 LEU 76 1HD1 LEU 76 2.591 -0.011 1.415 611 HD12 LEU 76 2HD1 LEU 76 2.049 -1.135 0.170 612 HD13 LEU 76 3HD1 LEU 76 2.010 0.600 -0.134 613 HD21 LEU 76 1HD2 LEU 76 4.297 -2.306 0.305 614 HD22 LEU 76 2HD2 LEU 76 4.732 -1.156 1.565 615 HD23 LEU 76 3HD2 LEU 76 5.767 -1.343 0.149 616 H THR 77 H THR 77 4.426 1.067 -4.106 617 HA THR 77 HA THR 77 3.499 -0.619 -6.125 618 HB THR 77 HB THR 77 4.330 2.282 -6.259 619 HG1 THR 77 1HG THR 77 2.726 2.193 -4.744 620 HG21 THR 77 1HG2 THR 77 4.017 1.267 -8.486 621 HG22 THR 77 2HG2 THR 77 2.749 2.432 -8.110 622 HG23 THR 77 3HG2 THR 77 2.416 0.702 -7.991 623 H LYS 78 H LYS 78 6.506 1.331 -5.976 624 HA LYS 78 HA LYS 78 7.316 0.310 -8.498 625 HB2 LYS 78 2HB LYS 78 9.354 1.663 -8.264 626 HB3 LYS 78 1HB LYS 78 7.907 2.570 -7.874 627 HG2 LYS 78 2HG LYS 78 8.409 2.086 -5.514 628 HG3 LYS 78 1HG LYS 78 9.946 1.450 -6.123 629 HD2 LYS 78 2HD LYS 78 10.543 3.580 -7.099 630 HD3 LYS 78 1HD LYS 78 9.012 4.290 -6.595 631 HE2 LYS 78 2HE LYS 78 9.636 3.873 -4.245 632 HE3 LYS 78 1HE LYS 78 11.189 3.251 -4.818 633 HZ1 LYS 78 1HZ LYS 78 11.582 5.513 -5.791 634 HZ2 LYS 78 2HZ LYS 78 11.490 5.430 -4.130 635 HZ3 LYS 78 3HZ LYS 78 10.171 6.048 -4.981 636 H TYR 79 H TYR 79 8.056 -0.614 -5.207 637 HA TYR 79 HA TYR 79 10.260 -2.289 -5.790 638 HB2 TYR 79 2HB TYR 79 9.598 -1.503 -3.512 639 HB3 TYR 79 1HB TYR 79 8.197 -2.551 -3.594 640 HD1 TYR 79 1HD TYR 79 11.765 -2.341 -3.002 641 HD2 TYR 79 2HD TYR 79 8.491 -5.012 -3.446 642 HE1 TYR 79 1HE TYR 79 13.086 -4.129 -1.953 643 HE2 TYR 79 2HE TYR 79 9.799 -6.799 -2.394 644 HH TYR 79 HH TYR 79 12.664 -6.203 -0.725 645 H TYR 80 H TYR 80 6.781 -2.754 -5.824 646 HA TYR 80 HA TYR 80 6.629 -5.514 -6.213 647 HB2 TYR 80 2HB TYR 80 4.690 -4.026 -5.772 648 HB3 TYR 80 1HB TYR 80 4.875 -3.326 -7.368 649 HD1 TYR 80 1HD TYR 80 3.679 -6.179 -5.452 650 HD2 TYR 80 2HD TYR 80 4.220 -4.615 -9.365 651 HE1 TYR 80 1HE TYR 80 2.144 -7.880 -6.339 652 HE2 TYR 80 2HE TYR 80 2.692 -6.298 -10.262 653 HH TYR 80 HH TYR 80 1.943 -8.606 -9.574 654 H LEU 81 H LEU 81 7.014 -2.871 -8.496 655 HA LEU 81 HA LEU 81 7.123 -4.513 -10.823 656 HB2 LEU 81 2HB LEU 81 8.014 -1.687 -10.369 657 HB3 LEU 81 1HB LEU 81 7.910 -2.450 -11.947 658 HG LEU 81 HG LEU 81 5.599 -1.869 -10.087 659 HD11 LEU 81 1HD1 LEU 81 4.926 -0.268 -11.787 660 HD12 LEU 81 2HD1 LEU 81 6.394 -0.621 -12.702 661 HD13 LEU 81 3HD1 LEU 81 6.504 0.129 -11.110 662 HD21 LEU 81 1HD2 LEU 81 4.194 -2.588 -11.968 663 HD22 LEU 81 2HD2 LEU 81 5.198 -3.907 -11.368 664 HD23 LEU 81 3HD2 LEU 81 5.636 -3.064 -12.855 665 H ALA 82 H ALA 82 9.499 -3.280 -8.572 666 HA ALA 82 HA ALA 82 11.822 -3.716 -10.065 667 HB1 ALA 82 1HB ALA 82 11.787 -2.418 -7.975 668 HB2 ALA 82 2HB ALA 82 13.009 -3.688 -7.928 669 HB3 ALA 82 3HB ALA 82 11.482 -3.902 -7.071 670 H ASN 83 H ASN 83 9.798 -5.903 -8.282 671 HA ASN 83 HA ASN 83 11.578 -8.110 -8.239 672 HB2 ASN 83 2HB ASN 83 8.580 -7.990 -7.996 673 HB3 ASN 83 1HB ASN 83 9.437 -9.523 -8.025 674 HD21 ASN 83 1HD2 ASN 83 8.778 -6.616 -6.183 675 HD22 ASN 83 2HD2 ASN 83 9.393 -7.250 -4.710 676 H HIS 84 H HIS 84 10.127 -6.653 -10.849 677 HA HIS 84 HA HIS 84 10.010 -9.149 -12.356 678 HB2 HIS 84 2HB HIS 84 9.150 -6.382 -13.226 679 HB3 HIS 84 1HB HIS 84 8.945 -7.865 -14.153 680 HD1 HIS 84 1HD HIS 84 7.789 -9.721 -11.997 681 HD2 HIS 84 2HD HIS 84 6.605 -5.771 -12.543 682 HE1 HIS 84 1HE HIS 84 5.571 -9.533 -10.904 683 HE2 HIS 84 2HE HIS 84 4.736 -7.341 -11.695 684 H GLY 85 H GLY 85 12.346 -7.198 -11.474 685 HA2 GLY 85 2HA GLY 85 14.513 -7.091 -12.302 686 HA3 GLY 85 1HA GLY 85 13.941 -7.738 -13.834 687 H ILE 86 H ILE 86 12.105 -5.203 -12.609 688 HA ILE 86 HA ILE 86 13.102 -3.443 -14.685 689 HB ILE 86 HB ILE 86 10.697 -3.178 -12.858 690 HG12 ILE 86 2HG1 ILE 86 10.879 -3.932 -15.783 691 HG13 ILE 86 1HG1 ILE 86 10.493 -5.028 -14.462 692 HG21 ILE 86 1HG2 ILE 86 9.984 -1.350 -14.351 693 HG22 ILE 86 2HG2 ILE 86 11.498 -1.490 -15.240 694 HG23 ILE 86 3HG2 ILE 86 11.512 -0.979 -13.552 695 HD11 ILE 86 1HD1 ILE 86 8.882 -2.662 -15.340 696 HD12 ILE 86 2HD1 ILE 86 8.462 -3.751 -14.013 697 HD13 ILE 86 3HD1 ILE 86 8.499 -4.353 -15.681 698 H ASP 87 H ASP 87 14.297 -1.760 -14.233 699 HA ASP 87 HA ASP 87 14.837 -1.184 -11.418 700 HB2 ASP 87 2HB ASP 87 16.866 -1.638 -12.711 701 HB3 ASP 87 1HB ASP 87 16.426 -0.379 -13.860 702 H ILE 88 H ILE 88 13.993 0.455 -10.528 703 HA ILE 88 HA ILE 88 12.793 2.508 -12.237 704 HB ILE 88 HB ILE 88 11.980 1.564 -9.470 705 HG12 ILE 88 2HG1 ILE 88 10.654 1.234 -12.167 706 HG13 ILE 88 1HG1 ILE 88 11.455 -0.030 -11.243 707 HG21 ILE 88 1HG2 ILE 88 10.007 3.018 -9.747 708 HG22 ILE 88 2HG2 ILE 88 10.697 3.645 -11.244 709 HG23 ILE 88 3HG2 ILE 88 11.509 3.941 -9.702 710 HD11 ILE 88 1HD1 ILE 88 8.994 1.467 -10.392 711 HD12 ILE 88 2HD1 ILE 88 9.749 0.164 -9.505 712 HD13 ILE 88 3HD1 ILE 88 9.027 -0.142 -11.098 713 H LYS 89 H LYS 89 13.036 4.679 -11.654 714 HA LYS 89 HA LYS 89 15.398 5.234 -10.070 715 HB2 LYS 89 2HB LYS 89 15.117 6.254 -12.292 716 HB3 LYS 89 1HB LYS 89 13.640 7.022 -11.746 717 HG2 LYS 89 2HG LYS 89 14.891 8.297 -10.114 718 HG3 LYS 89 1HG LYS 89 16.388 7.525 -10.654 719 HD2 LYS 89 2HD LYS 89 16.026 8.445 -12.901 720 HD3 LYS 89 1HD LYS 89 14.553 9.225 -12.321 721 HE2 LYS 89 2HE LYS 89 15.861 10.543 -10.740 722 HE3 LYS 89 1HE LYS 89 17.339 9.759 -11.298 723 HZ1 LYS 89 1HZ LYS 89 16.935 10.684 -13.495 724 HZ2 LYS 89 2HZ LYS 89 17.075 11.904 -12.356 725 HZ3 LYS 89 3HZ LYS 89 15.557 11.473 -12.946 726 H1 MET 1 H MET 1 -33.971 7.535 19.321 727 HA MET 1 HA MET 1 -33.466 5.106 18.503 728 HB2 MET 1 2HB MET 1 -35.714 4.327 19.109 729 HB3 MET 1 1HB MET 1 -35.098 5.491 20.273 730 HG2 MET 1 2HG MET 1 -36.500 7.222 19.362 731 HG3 MET 1 1HG MET 1 -37.020 6.165 18.053 732 HE1 MET 1 1HE MET 1 -38.640 4.112 18.350 733 HE2 MET 1 2HE MET 1 -39.218 3.537 19.911 734 HE3 MET 1 3HE MET 1 -37.514 3.385 19.498 735 H GLY 2 H GLY 2 -35.180 7.378 16.670 736 HA2 GLY 2 2HA GLY 2 -36.245 5.429 14.785 737 HA3 GLY 2 1HA GLY 2 -36.487 7.169 14.726 738 H PHE 3 H PHE 3 -33.775 4.908 14.581 739 HA PHE 3 HA PHE 3 -33.010 6.024 12.027 740 HB2 PHE 3 2HB PHE 3 -30.681 6.411 12.713 741 HB3 PHE 3 1HB PHE 3 -31.773 7.429 13.642 742 HD1 PHE 3 1HD PHE 3 -32.174 6.898 16.042 743 HD2 PHE 3 2HD PHE 3 -29.299 4.781 13.730 744 HE1 PHE 3 1HE PHE 3 -31.133 6.060 18.107 745 HE2 PHE 3 2HE PHE 3 -28.253 3.942 15.790 746 HZ PHE 3 HZ PHE 3 -29.168 4.582 17.982 747 H THR 4 H THR 4 -31.921 4.546 10.776 748 HA THR 4 HA THR 4 -31.386 1.969 12.029 749 HB THR 4 HB THR 4 -32.205 2.483 9.145 750 HG1 THR 4 1HG THR 4 -34.185 1.644 9.785 751 HG21 THR 4 1HG2 THR 4 -32.475 0.034 9.053 752 HG22 THR 4 2HG2 THR 4 -31.911 -0.094 10.719 753 HG23 THR 4 3HG2 THR 4 -30.812 0.461 9.457 754 H ASP 5 H ASP 5 -29.289 2.269 12.448 755 HA ASP 5 HA ASP 5 -27.567 3.227 10.286 756 HB2 ASP 5 2HB ASP 5 -27.459 4.602 12.288 757 HB3 ASP 5 1HB ASP 5 -27.083 3.189 13.269 758 H GLU 6 H GLU 6 -26.629 1.682 9.223 759 HA GLU 6 HA GLU 6 -25.286 -0.416 10.663 760 HB2 GLU 6 2HB GLU 6 -26.156 -2.123 9.005 761 HB3 GLU 6 1HB GLU 6 -27.315 -1.552 10.189 762 HG2 GLU 6 2HG GLU 6 -28.265 -0.029 8.511 763 HG3 GLU 6 1HG GLU 6 -27.122 -0.654 7.324 764 H THR 7 H THR 7 -23.323 0.386 10.170 765 HA THR 7 HA THR 7 -22.780 1.068 7.447 766 HB THR 7 HB THR 7 -20.479 1.672 8.331 767 HG1 THR 7 1HG THR 7 -20.070 0.967 10.219 768 HG21 THR 7 1HG2 THR 7 -21.277 3.733 9.412 769 HG22 THR 7 2HG2 THR 7 -22.878 3.013 9.585 770 HG23 THR 7 3HG2 THR 7 -22.231 3.345 7.978 771 H VAL 8 H VAL 8 -22.934 -0.791 6.385 772 HA VAL 8 HA VAL 8 -20.774 -2.678 6.873 773 HB VAL 8 HB VAL 8 -22.202 -4.450 5.783 774 HG11 VAL 8 1HG1 VAL 8 -23.659 -4.821 7.721 775 HG12 VAL 8 2HG1 VAL 8 -23.373 -3.161 8.245 776 HG13 VAL 8 3HG1 VAL 8 -22.039 -4.315 8.207 777 HG21 VAL 8 1HG2 VAL 8 -24.631 -4.086 5.612 778 HG22 VAL 8 2HG2 VAL 8 -23.749 -2.996 4.544 779 HG23 VAL 8 3HG2 VAL 8 -24.409 -2.395 6.065 780 H ARG 9 H ARG 9 -19.233 -2.411 5.438 781 HA ARG 9 HA ARG 9 -20.018 -1.532 2.784 782 HB2 ARG 9 2HB ARG 9 -17.313 -1.461 4.110 783 HB3 ARG 9 1HB ARG 9 -17.578 -1.068 2.419 784 HG2 ARG 9 2HG ARG 9 -19.101 0.735 3.112 785 HG3 ARG 9 1HG ARG 9 -18.736 0.362 4.797 786 HD2 ARG 9 2HD ARG 9 -16.380 0.890 4.404 787 HD3 ARG 9 1HD ARG 9 -16.728 1.213 2.707 788 HE ARG 9 HE ARG 9 -18.371 2.749 4.403 789 HH11 ARG 9 1HH1 ARG 9 -15.023 2.644 3.234 790 HH12 ARG 9 2HH1 ARG 9 -14.813 4.327 3.266 791 HH21 ARG 9 1HH2 ARG 9 -18.079 5.060 4.449 792 HH22 ARG 9 2HH2 ARG 9 -16.595 5.749 3.973 793 H PHE 10 H PHE 10 -19.770 -2.684 1.069 794 HA PHE 10 HA PHE 10 -18.510 -5.311 1.360 795 HB2 PHE 10 2HB PHE 10 -20.698 -4.422 -0.540 796 HB3 PHE 10 1HB PHE 10 -19.933 -6.009 -0.563 797 HD1 PHE 10 1HD PHE 10 -22.371 -3.871 1.090 798 HD2 PHE 10 2HD PHE 10 -20.276 -7.573 1.298 799 HE1 PHE 10 1HE PHE 10 -23.974 -4.685 2.759 800 HE2 PHE 10 2HE PHE 10 -21.878 -8.390 2.967 801 HZ PHE 10 HZ PHE 10 -23.729 -6.946 3.701 802 H ASP 11 H ASP 11 -17.681 -2.447 0.513 803 HA ASP 11 HA ASP 11 -16.688 -2.784 -2.147 804 HB2 ASP 11 2HB ASP 11 -16.020 -0.667 -0.085 805 HB3 ASP 11 1HB ASP 11 -15.490 -0.643 -1.761 806 H PHE 12 H PHE 12 -15.530 -4.580 -2.092 807 HA PHE 12 HA PHE 12 -12.802 -4.478 -1.810 808 HB2 PHE 12 2HB PHE 12 -13.198 -4.530 0.650 809 HB3 PHE 12 1HB PHE 12 -14.138 -6.002 0.469 810 HD1 PHE 12 1HD PHE 12 -10.782 -4.545 0.265 811 HD2 PHE 12 2HD PHE 12 -13.058 -8.131 0.225 812 HE1 PHE 12 1HE PHE 12 -8.719 -5.852 0.516 813 HE2 PHE 12 2HE PHE 12 -10.996 -9.447 0.474 814 HZ PHE 12 HZ PHE 12 -8.825 -8.308 0.619 815 H ASP 13 H ASP 13 -12.450 -5.779 -3.484 816 HA ASP 13 HA ASP 13 -14.024 -8.248 -3.612 817 HB2 ASP 13 2HB ASP 13 -14.692 -6.570 -5.358 818 HB3 ASP 13 1HB ASP 13 -13.041 -6.611 -5.958 819 H ASP 14 H ASP 14 -12.816 -9.996 -3.575 820 HA ASP 14 HA ASP 14 -9.996 -9.763 -3.303 821 HB2 ASP 14 2HB ASP 14 -11.684 -12.254 -3.636 822 HB3 ASP 14 1HB ASP 14 -9.969 -12.254 -3.270 823 H ASN 15 H ASN 15 -9.049 -8.979 -5.093 824 HA ASN 15 HA ASN 15 -9.127 -10.822 -7.349 825 HB2 ASN 15 2HB ASN 15 -10.266 -8.632 -7.886 826 HB3 ASN 15 1HB ASN 15 -8.730 -7.831 -7.588 827 HD21 ASN 15 1HD2 ASN 15 -10.503 -9.900 -9.689 828 HD22 ASN 15 2HD2 ASN 15 -9.435 -9.835 -11.042 829 H ARG 16 H ARG 16 -7.417 -11.891 -6.500 830 HA ARG 16 HA ARG 16 -4.928 -10.382 -6.480 831 HB2 ARG 16 2HB ARG 16 -5.365 -11.536 -4.365 832 HB3 ARG 16 1HB ARG 16 -5.591 -13.056 -5.209 833 HG2 ARG 16 2HG ARG 16 -3.239 -13.010 -5.902 834 HG3 ARG 16 1HG ARG 16 -3.028 -11.484 -5.047 835 HD2 ARG 16 2HD ARG 16 -2.234 -13.388 -3.721 836 HD3 ARG 16 1HD ARG 16 -3.577 -12.555 -2.945 837 HE ARG 16 HE ARG 16 -4.596 -14.653 -4.487 838 HH11 ARG 16 1HH1 ARG 16 -2.645 -14.172 -1.619 839 HH12 ARG 16 2HH1 ARG 16 -3.137 -15.544 -0.773 840 HH21 ARG 16 1HH2 ARG 16 -5.352 -16.617 -3.403 841 HH22 ARG 16 2HH2 ARG 16 -4.759 -17.024 -1.872 842 H LYS 17 H LYS 17 -4.478 -10.357 -8.553 843 HA LYS 17 HA LYS 17 -3.869 -12.874 -9.818 844 HB2 LYS 17 2HB LYS 17 -6.226 -12.406 -10.364 845 HB3 LYS 17 1HB LYS 17 -5.766 -10.840 -10.995 846 HG2 LYS 17 2HG LYS 17 -4.480 -11.896 -12.760 847 HG3 LYS 17 1HG LYS 17 -4.860 -13.485 -12.104 848 HD2 LYS 17 2HD LYS 17 -6.886 -11.501 -13.145 849 HD3 LYS 17 1HD LYS 17 -6.272 -12.895 -14.033 850 HE2 LYS 17 2HE LYS 17 -7.177 -14.377 -12.270 851 HE3 LYS 17 1HE LYS 17 -7.837 -12.966 -11.448 852 HZ1 LYS 17 1HZ LYS 17 -9.241 -12.531 -13.345 853 HZ2 LYS 17 2HZ LYS 17 -9.494 -14.095 -12.807 854 HZ3 LYS 17 3HZ LYS 17 -8.566 -13.839 -14.186 855 H LYS 18 H LYS 18 -2.085 -12.630 -11.069 856 HA LYS 18 HA LYS 18 -0.676 -10.202 -10.957 857 HB2 LYS 18 2HB LYS 18 1.085 -11.187 -12.394 858 HB3 LYS 18 1HB LYS 18 0.663 -12.199 -11.036 859 HG2 LYS 18 2HG LYS 18 -0.332 -12.659 -13.848 860 HG3 LYS 18 1HG LYS 18 1.134 -13.386 -13.196 861 HD2 LYS 18 2HD LYS 18 -0.265 -14.449 -11.423 862 HD3 LYS 18 1HD LYS 18 -1.696 -13.787 -12.223 863 HE2 LYS 18 2HE LYS 18 -1.172 -15.031 -14.230 864 HE3 LYS 18 1HE LYS 18 0.292 -15.661 -13.487 865 HZ1 LYS 18 1HZ LYS 18 -1.068 -16.751 -11.819 866 HZ2 LYS 18 2HZ LYS 18 -1.481 -17.272 -13.359 867 HZ3 LYS 18 3HZ LYS 18 -2.478 -16.176 -12.546 868 H ALA 19 H ALA 19 -3.209 -10.678 -12.794 869 HA ALA 19 HA ALA 19 -2.576 -9.372 -15.228 870 HB1 ALA 19 1HB ALA 19 -4.957 -8.809 -15.288 871 HB2 ALA 19 2HB ALA 19 -5.082 -9.321 -13.598 872 HB3 ALA 19 3HB ALA 19 -4.709 -10.515 -14.849 873 H ILE 20 H ILE 20 -3.256 -8.328 -11.960 874 HA ILE 20 HA ILE 20 -3.485 -5.563 -12.374 875 HB ILE 20 HB ILE 20 -2.405 -7.105 -9.988 876 HG12 ILE 20 2HG1 ILE 20 -5.143 -5.905 -10.495 877 HG13 ILE 20 1HG1 ILE 20 -4.748 -7.620 -10.506 878 HG21 ILE 20 1HG2 ILE 20 -1.567 -4.849 -9.891 879 HG22 ILE 20 2HG2 ILE 20 -2.822 -5.065 -8.666 880 HG23 ILE 20 3HG2 ILE 20 -3.182 -4.203 -10.163 881 HD11 ILE 20 1HD1 ILE 20 -5.855 -6.971 -8.433 882 HD12 ILE 20 2HD1 ILE 20 -4.591 -5.783 -8.118 883 HD13 ILE 20 3HD1 ILE 20 -4.204 -7.499 -8.119 884 H SER 21 H SER 21 -0.820 -7.735 -12.217 885 HA SER 21 HA SER 21 1.210 -5.724 -11.920 886 HB2 SER 21 2HB SER 21 1.619 -8.087 -11.250 887 HB3 SER 21 1HB SER 21 1.517 -8.563 -12.944 888 HG SER 21 HG SER 21 3.340 -7.255 -13.372 889 H GLU 22 H GLU 22 -0.166 -7.562 -14.601 890 HA GLU 22 HA GLU 22 1.318 -6.541 -16.715 891 HB2 GLU 22 2HB GLU 22 -1.624 -7.243 -16.605 892 HB3 GLU 22 1HB GLU 22 -0.719 -6.985 -18.087 893 HG2 GLU 22 2HG GLU 22 -0.143 -9.150 -16.070 894 HG3 GLU 22 1HG GLU 22 -1.088 -9.366 -17.543 895 H THR 23 H THR 23 -1.491 -5.261 -15.032 896 HA THR 23 HA THR 23 -1.894 -2.949 -16.565 897 HB THR 23 HB THR 23 -2.476 -3.509 -13.652 898 HG1 THR 23 1HG THR 23 -3.493 -4.614 -15.760 899 HG21 THR 23 1HG2 THR 23 -4.200 -1.703 -13.875 900 HG22 THR 23 2HG2 THR 23 -3.530 -1.327 -15.463 901 HG23 THR 23 3HG2 THR 23 -2.540 -1.113 -14.032 902 H LEU 24 H LEU 24 -0.141 -3.413 -13.482 903 HA LEU 24 HA LEU 24 0.698 -0.769 -13.122 904 HB2 LEU 24 2HB LEU 24 1.997 -3.306 -12.127 905 HB3 LEU 24 1HB LEU 24 2.349 -1.689 -11.553 906 HG LEU 24 HG LEU 24 -0.328 -3.052 -11.309 907 HD11 LEU 24 1HD1 LEU 24 1.824 -2.575 -9.262 908 HD12 LEU 24 2HD1 LEU 24 1.375 -4.135 -9.953 909 HD13 LEU 24 3HD1 LEU 24 0.221 -3.245 -8.958 910 HD21 LEU 24 1HD2 LEU 24 -0.510 -0.631 -11.405 911 HD22 LEU 24 2HD2 LEU 24 0.737 -0.486 -10.155 912 HD23 LEU 24 3HD2 LEU 24 -0.818 -1.224 -9.773 913 H GLU 25 H GLU 25 2.430 -3.485 -14.590 914 HA GLU 25 HA GLU 25 4.809 -2.189 -15.132 915 HB2 GLU 25 2HB GLU 25 3.415 -4.437 -16.584 916 HB3 GLU 25 1HB GLU 25 5.057 -3.924 -16.953 917 HG2 GLU 25 2HG GLU 25 5.791 -4.496 -14.736 918 HG3 GLU 25 1HG GLU 25 4.140 -4.856 -14.243 919 H THR 26 H THR 26 1.810 -2.368 -16.983 920 HA THR 26 HA THR 26 2.674 -0.994 -19.291 921 HB THR 26 HB THR 26 -0.124 -1.256 -18.152 922 HG1 THR 26 1HG THR 26 0.438 -3.265 -18.643 923 HG21 THR 26 1HG2 THR 26 0.111 0.568 -19.796 924 HG22 THR 26 2HG2 THR 26 -0.910 -0.737 -20.405 925 HG23 THR 26 3HG2 THR 26 0.762 -0.575 -20.964 926 H VAL 27 H VAL 27 1.005 0.101 -16.333 927 HA VAL 27 HA VAL 27 0.693 2.789 -17.124 928 HB VAL 27 HB VAL 27 0.959 1.751 -14.277 929 HG11 VAL 27 1HG1 VAL 27 1.216 4.164 -14.413 930 HG12 VAL 27 2HG1 VAL 27 -0.332 3.755 -13.672 931 HG13 VAL 27 3HG1 VAL 27 -0.271 4.282 -15.351 932 HG21 VAL 27 1HG2 VAL 27 -1.538 2.158 -15.933 933 HG22 VAL 27 2HG2 VAL 27 -1.486 1.683 -14.239 934 HG23 VAL 27 3HG2 VAL 27 -0.849 0.603 -15.479 935 H TYR 28 H TYR 28 3.273 1.124 -15.412 936 HA TYR 28 HA TYR 28 4.830 3.324 -14.755 937 HB2 TYR 28 2HB TYR 28 5.350 1.140 -13.848 938 HB3 TYR 28 1HB TYR 28 5.702 0.513 -15.452 939 HD1 TYR 28 1HD TYR 28 7.866 0.686 -16.359 940 HD2 TYR 28 2HD TYR 28 6.858 2.961 -12.919 941 HE1 TYR 28 1HE TYR 28 10.226 1.340 -16.114 942 HE2 TYR 28 2HE TYR 28 9.208 3.627 -12.661 943 HH TYR 28 HH TYR 28 11.565 3.048 -15.100 944 H ARG 29 H ARG 29 5.099 1.256 -17.641 945 HA ARG 29 HA ARG 29 7.080 2.905 -18.781 946 HB2 ARG 29 2HB ARG 29 5.396 0.748 -20.018 947 HB3 ARG 29 1HB ARG 29 6.644 1.614 -20.904 948 HG2 ARG 29 2HG ARG 29 7.073 -0.024 -18.413 949 HG3 ARG 29 1HG ARG 29 7.423 -0.550 -20.059 950 HD2 ARG 29 2HD ARG 29 9.063 1.286 -20.287 951 HD3 ARG 29 1HD ARG 29 8.715 1.799 -18.640 952 HE ARG 29 HE ARG 29 9.411 -0.882 -18.611 953 HH11 ARG 29 1HH1 ARG 29 11.016 2.283 -19.225 954 HH12 ARG 29 2HH1 ARG 29 12.543 1.734 -18.709 955 HH21 ARG 29 1HH2 ARG 29 11.583 -1.571 -17.901 956 HH22 ARG 29 2HH2 ARG 29 12.860 -0.449 -17.938 957 H ALA 30 H ALA 30 3.649 3.037 -18.933 958 HA ALA 30 HA ALA 30 3.319 4.599 -21.225 959 HB1 ALA 30 1HB ALA 30 1.697 4.738 -18.680 960 HB2 ALA 30 2HB ALA 30 1.434 3.603 -20.003 961 HB3 ALA 30 3HB ALA 30 1.192 5.331 -20.261 962 H LEU 31 H LEU 31 3.647 5.738 -17.844 963 HA LEU 31 HA LEU 31 3.938 8.432 -18.755 964 HB2 LEU 31 2HB LEU 31 4.459 7.309 -16.023 965 HB3 LEU 31 1HB LEU 31 4.611 8.999 -16.402 966 HG LEU 31 HG LEU 31 2.117 8.739 -17.145 967 HD11 LEU 31 1HD1 LEU 31 1.971 6.338 -16.889 968 HD12 LEU 31 2HD1 LEU 31 0.866 7.180 -15.788 969 HD13 LEU 31 3HD1 LEU 31 2.373 6.517 -15.172 970 HD21 LEU 31 1HD2 LEU 31 2.869 10.196 -15.399 971 HD22 LEU 31 2HD2 LEU 31 2.977 8.845 -14.276 972 HD23 LEU 31 3HD2 LEU 31 1.411 9.348 -14.904 973 H GLU 32 H GLU 32 6.132 5.862 -18.059 974 HA GLU 32 HA GLU 32 8.508 7.223 -17.656 975 HB2 GLU 32 2HB GLU 32 7.719 4.690 -17.593 976 HB3 GLU 32 1HB GLU 32 8.339 4.689 -19.228 977 HG2 GLU 32 2HG GLU 32 9.869 5.404 -16.771 978 HG3 GLU 32 1HG GLU 32 9.879 3.822 -17.537 979 H GLU 33 H GLU 33 6.989 6.007 -20.678 980 HA GLU 33 HA GLU 33 8.915 7.020 -22.494 981 HB2 GLU 33 2HB GLU 33 5.978 6.443 -22.933 982 HB3 GLU 33 1HB GLU 33 7.143 6.752 -24.205 983 HG2 GLU 33 2HG GLU 33 7.176 4.418 -22.301 984 HG3 GLU 33 1HG GLU 33 6.635 4.385 -23.977 985 H LYS 34 H LYS 34 6.122 8.407 -20.991 986 HA LYS 34 HA LYS 34 6.029 10.729 -22.704 987 HB2 LYS 34 2HB LYS 34 4.501 9.962 -20.243 988 HB3 LYS 34 1HB LYS 34 4.253 11.483 -21.078 989 HG2 LYS 34 2HG LYS 34 3.919 8.766 -22.343 990 HG3 LYS 34 1HG LYS 34 2.604 9.712 -21.643 991 HD2 LYS 34 2HD LYS 34 4.370 10.626 -23.934 992 HD3 LYS 34 1HD LYS 34 2.759 9.935 -24.109 993 HE2 LYS 34 2HE LYS 34 1.815 11.758 -22.798 994 HE3 LYS 34 1HE LYS 34 3.411 12.471 -22.593 995 HZ1 LYS 34 1HZ LYS 34 3.519 12.739 -25.009 996 HZ2 LYS 34 2HZ LYS 34 2.216 13.568 -24.346 997 HZ3 LYS 34 3HZ LYS 34 1.973 12.115 -25.167 998 H GLY 35 H GLY 35 7.943 9.912 -20.112 999 HA2 GLY 35 2HA GLY 35 9.593 11.159 -19.120 1000 HA3 GLY 35 1HA GLY 35 9.015 12.559 -20.006 1001 H TYR 36 H TYR 36 6.778 10.798 -18.059 1002 HA TYR 36 HA TYR 36 6.762 13.032 -16.140 1003 HB2 TYR 36 2HB TYR 36 4.653 10.909 -16.639 1004 HB3 TYR 36 1HB TYR 36 4.506 12.204 -15.469 1005 HD1 TYR 36 1HD TYR 36 3.410 11.119 -18.501 1006 HD2 TYR 36 2HD TYR 36 4.984 14.636 -16.717 1007 HE1 TYR 36 1HE TYR 36 2.334 12.473 -20.244 1008 HE2 TYR 36 2HE TYR 36 3.909 16.006 -18.461 1009 HH TYR 36 HH TYR 36 3.107 15.698 -20.767 1010 H ASN 37 H ASN 37 5.664 11.855 -13.928 1011 HA ASN 37 HA ASN 37 7.733 9.911 -13.206 1012 HB2 ASN 37 2HB ASN 37 6.022 11.687 -11.440 1013 HB3 ASN 37 1HB ASN 37 7.114 10.461 -10.823 1014 HD21 ASN 37 1HD2 ASN 37 8.293 11.981 -9.688 1015 HD22 ASN 37 2HD2 ASN 37 9.364 13.094 -10.465 1016 HA PRO 38 HA PRO 38 4.090 7.223 -13.834 1017 HB2 PRO 38 2HB PRO 38 5.540 4.896 -13.510 1018 HB3 PRO 38 1HB PRO 38 5.275 5.709 -15.050 1019 HG2 PRO 38 2HG PRO 38 7.637 5.781 -13.234 1020 HG3 PRO 38 1HG PRO 38 7.583 5.798 -15.005 1021 HD2 PRO 38 2HD PRO 38 8.079 8.000 -13.574 1022 HD3 PRO 38 1HD PRO 38 7.157 8.065 -15.089 1023 H ILE 39 H ILE 39 6.509 6.626 -11.315 1024 HA ILE 39 HA ILE 39 4.689 5.030 -9.800 1025 HB ILE 39 HB ILE 39 7.262 6.329 -8.852 1026 HG12 ILE 39 2HG1 ILE 39 7.739 4.744 -10.650 1027 HG13 ILE 39 1HG1 ILE 39 8.213 4.043 -9.102 1028 HG21 ILE 39 1HG2 ILE 39 5.750 5.777 -7.027 1029 HG22 ILE 39 2HG2 ILE 39 7.177 4.744 -6.999 1030 HG23 ILE 39 3HG2 ILE 39 5.642 4.113 -7.597 1031 HD11 ILE 39 1HD1 ILE 39 7.143 2.392 -10.517 1032 HD12 ILE 39 2HD1 ILE 39 5.685 3.383 -10.614 1033 HD13 ILE 39 3HD1 ILE 39 6.195 2.697 -9.069 1034 H ASN 40 H ASN 40 5.715 8.360 -9.648 1035 HA ASN 40 HA ASN 40 4.388 8.987 -7.237 1036 HB2 ASN 40 2HB ASN 40 5.286 10.796 -9.480 1037 HB3 ASN 40 1HB ASN 40 4.613 11.382 -7.968 1038 HD21 ASN 40 1HD2 ASN 40 5.909 9.366 -6.301 1039 HD22 ASN 40 2HD2 ASN 40 7.564 9.773 -6.247 1040 H GLN 41 H GLN 41 3.279 8.985 -10.591 1041 HA GLN 41 HA GLN 41 0.854 10.229 -9.847 1042 HB2 GLN 41 2HB GLN 41 1.625 8.745 -12.340 1043 HB3 GLN 41 1HB GLN 41 0.099 9.589 -12.126 1044 HG2 GLN 41 2HG GLN 41 2.838 10.842 -12.056 1045 HG3 GLN 41 1HG GLN 41 1.679 10.943 -13.376 1046 HE21 GLN 41 1HE2 GLN 41 -0.140 12.200 -13.103 1047 HE22 GLN 41 2HE2 GLN 41 -0.265 13.441 -11.907 1048 H ILE 42 H ILE 42 1.881 6.861 -10.261 1049 HA ILE 42 HA ILE 42 -0.666 5.711 -10.011 1050 HB ILE 42 HB ILE 42 1.988 4.514 -9.126 1051 HG12 ILE 42 2HG1 ILE 42 0.418 4.122 -11.684 1052 HG13 ILE 42 1HG1 ILE 42 1.880 5.087 -11.531 1053 HG21 ILE 42 1HG2 ILE 42 0.116 3.377 -8.049 1054 HG22 ILE 42 2HG2 ILE 42 0.813 2.327 -9.280 1055 HG23 ILE 42 3HG2 ILE 42 -0.690 3.186 -9.601 1056 HD11 ILE 42 1HD1 ILE 42 3.139 3.066 -10.941 1057 HD12 ILE 42 2HD1 ILE 42 2.355 2.912 -12.515 1058 HD13 ILE 42 3HD1 ILE 42 1.671 2.107 -11.101 1059 H VAL 43 H VAL 43 1.792 6.317 -7.488 1060 HA VAL 43 HA VAL 43 0.249 5.405 -5.370 1061 HB VAL 43 HB VAL 43 2.605 5.818 -4.951 1062 HG11 VAL 43 1HG1 VAL 43 2.959 7.680 -6.445 1063 HG12 VAL 43 2HG1 VAL 43 3.564 8.074 -4.833 1064 HG13 VAL 43 3HG1 VAL 43 2.030 8.744 -5.393 1065 HG21 VAL 43 1HG2 VAL 43 0.965 7.740 -3.310 1066 HG22 VAL 43 2HG2 VAL 43 2.548 7.095 -2.862 1067 HG23 VAL 43 3HG2 VAL 43 1.152 6.013 -3.016 1068 H GLY 44 H GLY 44 0.363 8.651 -6.739 1069 HA2 GLY 44 2HA GLY 44 -1.415 9.863 -4.932 1070 HA3 GLY 44 1HA GLY 44 -1.094 10.411 -6.570 1071 H TYR 45 H TYR 45 -1.995 7.995 -7.870 1072 HA TYR 45 HA TYR 45 -4.722 8.625 -8.114 1073 HB2 TYR 45 2HB TYR 45 -3.607 7.620 -10.011 1074 HB3 TYR 45 1HB TYR 45 -3.241 6.167 -9.085 1075 HD1 TYR 45 1HD TYR 45 -4.863 4.381 -8.907 1076 HD2 TYR 45 2HD TYR 45 -6.014 8.122 -10.560 1077 HE1 TYR 45 1HE TYR 45 -6.987 3.410 -9.613 1078 HE2 TYR 45 2HE TYR 45 -8.155 7.130 -11.261 1079 HH TYR 45 HH TYR 45 -9.170 4.026 -10.247 1080 H LEU 46 H LEU 46 -3.180 5.785 -6.655 1081 HA LEU 46 HA LEU 46 -5.690 4.723 -5.949 1082 HB2 LEU 46 2HB LEU 46 -2.968 3.948 -4.935 1083 HB3 LEU 46 1HB LEU 46 -4.429 3.127 -4.432 1084 HG LEU 46 HG LEU 46 -4.791 2.580 -6.920 1085 HD11 LEU 46 1HD1 LEU 46 -2.920 2.569 -8.383 1086 HD12 LEU 46 2HD1 LEU 46 -1.928 3.320 -7.141 1087 HD13 LEU 46 3HD1 LEU 46 -3.262 4.219 -7.844 1088 HD21 LEU 46 1HD2 LEU 46 -3.227 0.706 -6.881 1089 HD22 LEU 46 2HD2 LEU 46 -4.108 0.898 -5.370 1090 HD23 LEU 46 3HD2 LEU 46 -2.424 1.420 -5.479 1091 H LEU 47 H LEU 47 -3.541 6.820 -4.203 1092 HA LEU 47 HA LEU 47 -4.582 6.490 -1.646 1093 HB2 LEU 47 2HB LEU 47 -3.472 9.014 -2.855 1094 HB3 LEU 47 1HB LEU 47 -3.775 8.770 -1.152 1095 HG LEU 47 HG LEU 47 -1.732 7.346 -2.842 1096 HD11 LEU 47 1HD1 LEU 47 -1.111 9.607 -2.294 1097 HD12 LEU 47 2HD1 LEU 47 -0.119 8.464 -1.389 1098 HD13 LEU 47 3HD1 LEU 47 -1.440 9.312 -0.586 1099 HD21 LEU 47 1HD2 LEU 47 -2.620 5.784 -1.196 1100 HD22 LEU 47 2HD2 LEU 47 -2.373 6.971 0.089 1101 HD23 LEU 47 3HD2 LEU 47 -0.990 6.286 -0.753 1102 H SER 48 H SER 48 -5.857 8.585 -4.229 1103 HA SER 48 HA SER 48 -8.193 8.995 -2.464 1104 HB2 SER 48 2HB SER 48 -7.052 11.069 -4.313 1105 HB3 SER 48 1HB SER 48 -8.457 11.256 -3.269 1106 HG SER 48 HG SER 48 -6.543 10.430 -1.706 1107 H GLY 49 H GLY 49 -7.275 7.651 -5.382 1108 HA2 GLY 49 2HA GLY 49 -8.455 6.884 -7.120 1109 HA3 GLY 49 1HA GLY 49 -9.920 7.363 -6.282 1110 H ASP 50 H ASP 50 -7.250 9.427 -7.302 1111 HA ASP 50 HA ASP 50 -9.156 10.992 -8.887 1112 HB2 ASP 50 2HB ASP 50 -6.281 11.621 -8.203 1113 HB3 ASP 50 1HB ASP 50 -7.363 12.693 -9.067 1114 HA PRO 51 HA PRO 51 -7.392 8.549 -12.303 1115 HB2 PRO 51 2HB PRO 51 -9.040 9.540 -14.245 1116 HB3 PRO 51 1HB PRO 51 -9.493 8.265 -13.107 1117 HG2 PRO 51 2HG PRO 51 -10.097 11.195 -12.927 1118 HG3 PRO 51 1HG PRO 51 -11.183 9.811 -12.693 1119 HD2 PRO 51 2HD PRO 51 -10.128 11.085 -10.608 1120 HD3 PRO 51 1HD PRO 51 -10.312 9.321 -10.597 1121 H ALA 52 H ALA 52 -7.660 11.974 -12.067 1122 HA ALA 52 HA ALA 52 -6.453 12.848 -14.428 1123 HB1 ALA 52 1HB ALA 52 -6.002 14.923 -13.270 1124 HB2 ALA 52 2HB ALA 52 -6.274 14.128 -11.720 1125 HB3 ALA 52 3HB ALA 52 -7.608 14.319 -12.854 1126 H TYR 53 H TYR 53 -4.939 11.147 -11.908 1127 HA TYR 53 HA TYR 53 -2.371 12.258 -12.163 1128 HB2 TYR 53 2HB TYR 53 -3.378 9.712 -10.994 1129 HB3 TYR 53 1HB TYR 53 -1.649 10.019 -11.124 1130 HD1 TYR 53 1HD TYR 53 -0.681 11.980 -10.032 1131 HD2 TYR 53 2HD TYR 53 -4.676 10.801 -9.333 1132 HE1 TYR 53 1HE TYR 53 -0.695 13.339 -8.060 1133 HE2 TYR 53 2HE TYR 53 -4.722 12.191 -7.295 1134 HH TYR 53 HH TYR 53 -3.181 13.102 -5.688 1135 H ILE 54 H ILE 54 -4.058 9.767 -14.023 1136 HA ILE 54 HA ILE 54 -1.493 9.099 -15.269 1137 HB ILE 54 HB ILE 54 -4.071 7.457 -15.507 1138 HG12 ILE 54 2HG1 ILE 54 -3.232 7.401 -13.185 1139 HG13 ILE 54 1HG1 ILE 54 -2.950 5.870 -14.001 1140 HG21 ILE 54 1HG2 ILE 54 -2.668 5.726 -16.422 1141 HG22 ILE 54 2HG2 ILE 54 -1.272 6.797 -16.347 1142 HG23 ILE 54 3HG2 ILE 54 -2.621 7.185 -17.414 1143 HD11 ILE 54 1HD1 ILE 54 -1.057 6.507 -12.617 1144 HD12 ILE 54 2HD1 ILE 54 -0.882 8.006 -13.526 1145 HD13 ILE 54 3HD1 ILE 54 -0.611 6.454 -14.321 1146 HA PRO 55 HA PRO 55 -2.782 11.439 -18.866 1147 HB2 PRO 55 2HB PRO 55 -0.809 10.432 -20.507 1148 HB3 PRO 55 1HB PRO 55 -0.564 11.792 -19.403 1149 HG2 PRO 55 2HG PRO 55 0.135 8.910 -19.074 1150 HG3 PRO 55 1HG PRO 55 1.059 10.349 -18.605 1151 HD2 PRO 55 2HD PRO 55 -0.309 8.895 -16.835 1152 HD3 PRO 55 1HD PRO 55 -0.174 10.660 -16.675 1153 H ARG 56 H ARG 56 -3.530 10.907 -21.051 1154 HA ARG 56 HA ARG 56 -4.721 8.243 -21.042 1155 HB2 ARG 56 2HB ARG 56 -5.395 10.568 -22.843 1156 HB3 ARG 56 1HB ARG 56 -6.319 9.093 -22.647 1157 HG2 ARG 56 2HG ARG 56 -6.648 9.775 -20.225 1158 HG3 ARG 56 1HG ARG 56 -5.955 11.329 -20.687 1159 HD2 ARG 56 2HD ARG 56 -8.322 11.546 -20.811 1160 HD3 ARG 56 1HD ARG 56 -7.705 11.489 -22.463 1161 HE ARG 56 HE ARG 56 -8.742 9.115 -21.116 1162 HH11 ARG 56 1HH1 ARG 56 -8.833 11.300 -23.904 1163 HH12 ARG 56 2HH1 ARG 56 -9.971 10.362 -24.760 1164 HH21 ARG 56 1HH2 ARG 56 -10.299 7.867 -22.270 1165 HH22 ARG 56 2HH2 ARG 56 -10.838 8.342 -23.803 1166 H TYR 57 H TYR 57 -1.951 9.190 -21.960 1167 HA TYR 57 HA TYR 57 -1.443 8.863 -24.607 1168 HB2 TYR 57 2HB TYR 57 0.359 9.409 -23.187 1169 HB3 TYR 57 1HB TYR 57 0.130 7.974 -22.202 1170 HD1 TYR 57 1HD TYR 57 1.049 8.983 -25.692 1171 HD2 TYR 57 2HD TYR 57 1.479 6.134 -22.564 1172 HE1 TYR 57 1HE TYR 57 2.739 7.780 -27.019 1173 HE2 TYR 57 2HE TYR 57 3.157 4.924 -23.879 1174 HH TYR 57 HH TYR 57 3.793 4.664 -26.119 1175 H GLN 58 H GLN 58 -1.884 6.187 -22.286 1176 HA GLN 58 HA GLN 58 -2.168 4.417 -24.605 1177 HB2 GLN 58 2HB GLN 58 0.168 4.318 -23.426 1178 HB3 GLN 58 1HB GLN 58 -0.732 3.588 -22.099 1179 HG2 GLN 58 2HG GLN 58 -1.439 1.773 -23.537 1180 HG3 GLN 58 1HG GLN 58 -0.571 2.508 -24.887 1181 HE21 GLN 58 1HE2 GLN 58 -0.285 -0.082 -23.631 1182 HE22 GLN 58 2HE2 GLN 58 1.362 -0.198 -23.145 1183 H ASP 59 H ASP 59 -3.057 2.268 -23.746 1184 HA ASP 59 HA ASP 59 -5.524 2.588 -22.537 1185 HB2 ASP 59 2HB ASP 59 -5.583 0.096 -22.435 1186 HB3 ASP 59 1HB ASP 59 -5.140 0.725 -24.011 1187 H ALA 60 H ALA 60 -2.524 2.451 -21.053 1188 HA ALA 60 HA ALA 60 -2.861 1.303 -18.559 1189 HB1 ALA 60 1HB ALA 60 -1.249 2.971 -17.745 1190 HB2 ALA 60 2HB ALA 60 -1.506 3.913 -19.209 1191 HB3 ALA 60 3HB ALA 60 -0.767 2.318 -19.317 1192 H ARG 61 H ARG 61 -3.893 4.514 -19.657 1193 HA ARG 61 HA ARG 61 -4.963 5.622 -17.396 1194 HB2 ARG 61 2HB ARG 61 -4.768 6.845 -19.438 1195 HB3 ARG 61 1HB ARG 61 -5.833 5.734 -20.279 1196 HG2 ARG 61 2HG ARG 61 -7.016 7.770 -19.847 1197 HG3 ARG 61 1HG ARG 61 -7.694 6.499 -18.842 1198 HD2 ARG 61 2HD ARG 61 -6.347 7.345 -16.940 1199 HD3 ARG 61 1HD ARG 61 -5.792 8.670 -17.967 1200 HE ARG 61 HE ARG 61 -8.651 8.277 -17.654 1201 HH11 ARG 61 1HH1 ARG 61 -5.831 10.284 -16.844 1202 HH12 ARG 61 2HH1 ARG 61 -6.808 11.568 -16.273 1203 HH21 ARG 61 1HH2 ARG 61 -9.882 9.985 -16.864 1204 HH22 ARG 61 2HH2 ARG 61 -9.166 11.417 -16.283 1205 H ASN 62 H ASN 62 -6.570 3.466 -19.739 1206 HA ASN 62 HA ASN 62 -9.034 3.503 -18.281 1207 HB2 ASN 62 2HB ASN 62 -8.829 3.189 -20.785 1208 HB3 ASN 62 1HB ASN 62 -8.200 1.577 -20.475 1209 HD21 ASN 62 1HD2 ASN 62 -10.545 2.423 -21.927 1210 HD22 ASN 62 2HD2 ASN 62 -11.909 1.660 -21.201 1211 H LEU 63 H LEU 63 -6.288 1.344 -18.592 1212 HA LEU 63 HA LEU 63 -7.263 -0.917 -17.255 1213 HB2 LEU 63 2HB LEU 63 -4.435 0.130 -17.280 1214 HB3 LEU 63 1HB LEU 63 -4.943 -1.465 -16.761 1215 HG LEU 63 HG LEU 63 -5.191 -0.411 -19.568 1216 HD11 LEU 63 1HD1 LEU 63 -2.870 -0.719 -18.944 1217 HD12 LEU 63 2HD1 LEU 63 -3.382 -1.981 -20.053 1218 HD13 LEU 63 3HD1 LEU 63 -3.219 -2.338 -18.327 1219 HD21 LEU 63 1HD2 LEU 63 -5.715 -2.735 -20.122 1220 HD22 LEU 63 2HD2 LEU 63 -6.898 -2.068 -18.999 1221 HD23 LEU 63 3HD2 LEU 63 -5.648 -3.167 -18.411 1222 H ILE 64 H ILE 64 -5.742 1.996 -15.935 1223 HA ILE 64 HA ILE 64 -5.616 0.871 -13.313 1224 HB ILE 64 HB ILE 64 -4.026 2.654 -14.234 1225 HG12 ILE 64 2HG1 ILE 64 -5.335 3.324 -11.586 1226 HG13 ILE 64 1HG1 ILE 64 -4.169 2.026 -11.819 1227 HG21 ILE 64 1HG2 ILE 64 -4.724 5.017 -13.971 1228 HG22 ILE 64 2HG2 ILE 64 -6.356 4.479 -13.601 1229 HG23 ILE 64 3HG2 ILE 64 -5.675 4.176 -15.193 1230 HD11 ILE 64 1HD1 ILE 64 -2.490 3.685 -12.488 1231 HD12 ILE 64 2HD1 ILE 64 -3.103 3.977 -10.859 1232 HD13 ILE 64 3HD1 ILE 64 -3.667 4.967 -12.205 1233 H ARG 65 H ARG 65 -7.998 2.506 -15.124 1234 HA ARG 65 HA ARG 65 -9.644 3.310 -12.862 1235 HB2 ARG 65 2HB ARG 65 -10.197 3.239 -15.834 1236 HB3 ARG 65 1HB ARG 65 -11.274 3.936 -14.627 1237 HG2 ARG 65 2HG ARG 65 -8.466 4.856 -15.168 1238 HG3 ARG 65 1HG ARG 65 -9.920 5.595 -15.839 1239 HD2 ARG 65 2HD ARG 65 -9.404 5.282 -12.888 1240 HD3 ARG 65 1HD ARG 65 -8.962 6.696 -13.840 1241 HE ARG 65 HE ARG 65 -11.441 6.767 -14.413 1242 HH11 ARG 65 1HH1 ARG 65 -10.342 5.537 -11.259 1243 HH12 ARG 65 2HH1 ARG 65 -11.742 6.088 -10.439 1244 HH21 ARG 65 1HH2 ARG 65 -13.322 7.518 -13.220 1245 HH22 ARG 65 2HH2 ARG 65 -13.438 7.199 -11.547 1246 H ARG 66 H ARG 66 -9.033 0.652 -14.842 1247 HA ARG 66 HA ARG 66 -11.584 -0.642 -14.775 1248 HB2 ARG 66 2HB ARG 66 -9.968 -0.927 -16.627 1249 HB3 ARG 66 1HB ARG 66 -8.856 -1.707 -15.525 1250 HG2 ARG 66 2HG ARG 66 -9.945 -3.369 -16.889 1251 HG3 ARG 66 1HG ARG 66 -10.495 -3.537 -15.224 1252 HD2 ARG 66 2HD ARG 66 -11.992 -2.050 -17.374 1253 HD3 ARG 66 1HD ARG 66 -12.308 -3.732 -16.964 1254 HE ARG 66 HE ARG 66 -12.673 -2.719 -14.625 1255 HH11 ARG 66 1HH1 ARG 66 -13.640 -1.208 -17.703 1256 HH12 ARG 66 2HH1 ARG 66 -14.964 -0.378 -17.020 1257 HH21 ARG 66 1HH2 ARG 66 -14.504 -1.526 -13.715 1258 HH22 ARG 66 2HH2 ARG 66 -15.480 -0.584 -14.722 1259 H HIS 67 H HIS 67 -8.607 -0.762 -12.964 1260 HA HIS 67 HA HIS 67 -9.799 -2.803 -11.237 1261 HB2 HIS 67 2HB HIS 67 -6.921 -2.057 -11.690 1262 HB3 HIS 67 1HB HIS 67 -7.419 -3.010 -10.293 1263 HD1 HIS 67 1HD HIS 67 -8.053 -5.417 -10.699 1264 HD2 HIS 67 2HD HIS 67 -7.040 -3.394 -14.180 1265 HE1 HIS 67 1HE HIS 67 -7.729 -7.205 -12.452 1266 HE2 HIS 67 2HE HIS 67 -7.535 -5.890 -14.587 1267 H GLU 68 H GLU 68 -9.525 -2.563 -8.918 1268 HA GLU 68 HA GLU 68 -10.001 0.159 -8.299 1269 HB2 GLU 68 2HB GLU 68 -10.736 -2.356 -7.082 1270 HB3 GLU 68 1HB GLU 68 -10.405 -1.048 -5.948 1271 HG2 GLU 68 2HG GLU 68 -12.193 -0.744 -8.319 1272 HG3 GLU 68 1HG GLU 68 -12.748 -1.268 -6.725 1273 H ARG 69 H ARG 69 -9.313 1.276 -6.761 1274 HA ARG 69 HA ARG 69 -6.553 1.639 -6.382 1275 HB2 ARG 69 2HB ARG 69 -8.840 2.577 -4.608 1276 HB3 ARG 69 1HB ARG 69 -7.239 3.271 -4.733 1277 HG2 ARG 69 2HG ARG 69 -7.678 4.300 -6.702 1278 HG3 ARG 69 1HG ARG 69 -8.855 3.082 -7.200 1279 HD2 ARG 69 2HD ARG 69 -9.289 5.078 -4.984 1280 HD3 ARG 69 1HD ARG 69 -9.892 5.251 -6.632 1281 HE ARG 69 HE ARG 69 -10.961 2.959 -6.133 1282 HH11 ARG 69 1HH1 ARG 69 -10.708 5.612 -3.776 1283 HH12 ARG 69 2HH1 ARG 69 -12.127 5.210 -2.956 1284 HH21 ARG 69 1HH2 ARG 69 -12.864 2.378 -5.008 1285 HH22 ARG 69 2HH2 ARG 69 -13.402 3.287 -3.661 1286 H ASP 70 H ASP 70 -9.054 0.529 -4.191 1287 HA ASP 70 HA ASP 70 -7.581 -0.261 -1.947 1288 HB2 ASP 70 2HB ASP 70 -10.033 0.080 -2.036 1289 HB3 ASP 70 1HB ASP 70 -10.186 -1.332 -3.068 1290 H GLU 71 H GLU 71 -8.767 -2.053 -4.671 1291 HA GLU 71 HA GLU 71 -8.066 -4.676 -4.139 1292 HB2 GLU 71 2HB GLU 71 -9.576 -3.802 -5.856 1293 HB3 GLU 71 1HB GLU 71 -8.205 -3.203 -6.740 1294 HG2 GLU 71 2HG GLU 71 -7.439 -5.471 -7.128 1295 HG3 GLU 71 1HG GLU 71 -8.814 -6.088 -6.198 1296 H ILE 72 H ILE 72 -6.301 -2.349 -6.180 1297 HA ILE 72 HA ILE 72 -4.116 -4.080 -6.696 1298 HB ILE 72 HB ILE 72 -4.323 -1.077 -6.949 1299 HG12 ILE 72 2HG1 ILE 72 -4.651 -3.261 -9.024 1300 HG13 ILE 72 1HG1 ILE 72 -5.935 -2.273 -8.347 1301 HG21 ILE 72 1HG2 ILE 72 -2.232 -2.923 -8.112 1302 HG22 ILE 72 2HG2 ILE 72 -1.990 -1.734 -6.828 1303 HG23 ILE 72 3HG2 ILE 72 -2.401 -1.200 -8.457 1304 HD11 ILE 72 1HD1 ILE 72 -4.952 -0.280 -9.349 1305 HD12 ILE 72 2HD1 ILE 72 -5.306 -1.505 -10.569 1306 HD13 ILE 72 3HD1 ILE 72 -3.647 -1.260 -10.022 1307 H MET 73 H MET 73 -4.634 -1.474 -4.382 1308 HA MET 73 HA MET 73 -1.924 -1.266 -3.636 1309 HB2 MET 73 2HB MET 73 -3.626 0.554 -3.379 1310 HB3 MET 73 1HB MET 73 -4.335 -0.351 -2.059 1311 HG2 MET 73 2HG MET 73 -1.501 0.661 -2.072 1312 HG3 MET 73 1HG MET 73 -2.852 1.556 -1.400 1313 HE1 MET 73 1HE MET 73 -0.128 0.761 0.104 1314 HE2 MET 73 2HE MET 73 -0.796 0.393 1.701 1315 HE3 MET 73 3HE MET 73 -1.414 1.761 0.768 1316 H GLU 74 H GLU 74 -4.589 -3.180 -2.291 1317 HA GLU 74 HA GLU 74 -3.064 -3.809 -0.025 1318 HB2 GLU 74 2HB GLU 74 -4.789 -5.410 0.600 1319 HB3 GLU 74 1HB GLU 74 -5.502 -3.907 0.075 1320 HG2 GLU 74 2HG GLU 74 -6.910 -5.525 -0.800 1321 HG3 GLU 74 1HG GLU 74 -5.866 -5.136 -2.164 1322 H GLU 75 H GLU 75 -3.350 -5.380 -3.139 1323 HA GLU 75 HA GLU 75 -1.781 -7.645 -2.526 1324 HB2 GLU 75 2HB GLU 75 -3.050 -7.535 -4.611 1325 HB3 GLU 75 1HB GLU 75 -2.122 -6.137 -5.131 1326 HG2 GLU 75 2HG GLU 75 -1.340 -8.072 -6.321 1327 HG3 GLU 75 1HG GLU 75 -0.092 -7.541 -5.208 1328 H LEU 76 H LEU 76 -0.946 -4.427 -3.708 1329 HA LEU 76 HA LEU 76 1.802 -4.716 -4.066 1330 HB2 LEU 76 2HB LEU 76 0.348 -2.295 -2.999 1331 HB3 LEU 76 1HB LEU 76 1.997 -2.296 -3.583 1332 HG LEU 76 HG LEU 76 -0.457 -2.850 -5.250 1333 HD11 LEU 76 1HD1 LEU 76 0.052 -0.703 -6.290 1334 HD12 LEU 76 2HD1 LEU 76 1.384 -0.464 -5.162 1335 HD13 LEU 76 3HD1 LEU 76 -0.276 -0.507 -4.570 1336 HD21 LEU 76 1HD2 LEU 76 1.473 -4.073 -6.086 1337 HD22 LEU 76 2HD2 LEU 76 2.445 -2.601 -6.009 1338 HD23 LEU 76 3HD2 LEU 76 1.102 -2.703 -7.135 1339 H THR 77 H THR 77 0.042 -3.829 -1.111 1340 HA THR 77 HA THR 77 2.281 -3.456 0.510 1341 HB THR 77 HB THR 77 -0.505 -4.338 1.288 1342 HG1 THR 77 1HG THR 77 -0.770 -2.397 0.257 1343 HG21 THR 77 1HG2 THR 77 0.013 -3.265 3.437 1344 HG22 THR 77 2HG2 THR 77 1.641 -2.896 2.865 1345 HG23 THR 77 3HG2 THR 77 1.149 -4.574 3.101 1346 H LYS 78 H LYS 78 0.192 -6.330 0.095 1347 HA LYS 78 HA LYS 78 1.747 -7.751 1.979 1348 HB2 LYS 78 2HB LYS 78 0.295 -9.687 1.523 1349 HB3 LYS 78 1HB LYS 78 -0.559 -8.205 1.919 1350 HG2 LYS 78 2HG LYS 78 -0.857 -7.888 -0.469 1351 HG3 LYS 78 1HG LYS 78 -0.255 -9.537 -0.698 1352 HD2 LYS 78 2HD LYS 78 -2.003 -10.365 0.841 1353 HD3 LYS 78 1HD LYS 78 -2.660 -8.737 0.949 1354 HE2 LYS 78 2HE LYS 78 -3.055 -8.798 -1.509 1355 HE3 LYS 78 1HE LYS 78 -2.522 -10.485 -1.498 1356 HZ1 LYS 78 1HZ LYS 78 -4.867 -9.300 -0.156 1357 HZ2 LYS 78 2HZ LYS 78 -4.359 -10.900 0.136 1358 HZ3 LYS 78 3HZ LYS 78 -4.878 -10.427 -1.401 1359 H TYR 79 H TYR 79 1.806 -7.708 -1.531 1360 HA TYR 79 HA TYR 79 3.471 -9.979 -1.720 1361 HB2 TYR 79 2HB TYR 79 2.268 -9.042 -3.682 1362 HB3 TYR 79 1HB TYR 79 3.305 -7.621 -3.625 1363 HD1 TYR 79 1HD TYR 79 3.407 -11.312 -4.018 1364 HD2 TYR 79 2HD TYR 79 5.343 -7.613 -4.819 1365 HE1 TYR 79 1HE TYR 79 5.031 -12.476 -5.446 1366 HE2 TYR 79 2HE TYR 79 6.973 -8.770 -6.249 1367 HH TYR 79 HH TYR 79 6.504 -11.992 -7.240 1368 H TYR 80 H TYR 80 4.083 -6.570 -1.254 1369 HA TYR 80 HA TYR 80 6.862 -6.436 -1.427 1370 HB2 TYR 80 2HB TYR 80 5.360 -4.494 -1.190 1371 HB3 TYR 80 1HB TYR 80 4.958 -4.996 0.439 1372 HD1 TYR 80 1HD TYR 80 7.476 -3.453 -1.707 1373 HD2 TYR 80 2HD TYR 80 6.517 -4.562 2.279 1374 HE1 TYR 80 1HE TYR 80 9.271 -2.000 -0.880 1375 HE2 TYR 80 2HE TYR 80 8.314 -3.113 3.120 1376 HH TYR 80 HH TYR 80 9.872 -0.829 1.124 1377 H LEU 81 H LEU 81 4.758 -7.303 1.246 1378 HA LEU 81 HA LEU 81 6.857 -7.742 3.113 1379 HB2 LEU 81 2HB LEU 81 3.993 -8.625 3.140 1380 HB3 LEU 81 1HB LEU 81 5.084 -8.779 4.509 1381 HG LEU 81 HG LEU 81 4.147 -6.195 3.253 1382 HD11 LEU 81 1HD1 LEU 81 3.490 -7.461 5.905 1383 HD12 LEU 81 2HD1 LEU 81 2.402 -7.298 4.525 1384 HD13 LEU 81 3HD1 LEU 81 2.976 -5.860 5.371 1385 HD21 LEU 81 1HD2 LEU 81 5.292 -5.109 5.131 1386 HD22 LEU 81 2HD2 LEU 81 6.421 -5.979 4.103 1387 HD23 LEU 81 3HD2 LEU 81 5.922 -6.673 5.646 1388 H ALA 82 H ALA 82 4.988 -9.828 0.973 1389 HA ALA 82 HA ALA 82 5.907 -12.310 1.890 1390 HB1 ALA 82 1HB ALA 82 5.123 -11.543 -0.925 1391 HB2 ALA 82 2HB ALA 82 4.016 -12.042 0.354 1392 HB3 ALA 82 3HB ALA 82 5.205 -13.183 -0.277 1393 H ASN 83 H ASN 83 7.350 -9.944 -0.186 1394 HA ASN 83 HA ASN 83 9.421 -11.529 -1.294 1395 HB2 ASN 83 2HB ASN 83 9.296 -8.542 -0.864 1396 HB3 ASN 83 1HB ASN 83 10.559 -9.357 -1.769 1397 HD21 ASN 83 1HD2 ASN 83 8.651 -11.289 -2.948 1398 HD22 ASN 83 2HD2 ASN 83 7.793 -10.375 -4.132 1399 H HIS 84 H HIS 84 8.983 -10.616 1.879 1400 HA HIS 84 HA HIS 84 11.871 -10.559 2.421 1401 HB2 HIS 84 2HB HIS 84 9.586 -10.115 4.358 1402 HB3 HIS 84 1HB HIS 84 11.293 -9.920 4.720 1403 HD1 HIS 84 1HD HIS 84 12.305 -8.142 2.547 1404 HD2 HIS 84 2HD HIS 84 8.560 -7.642 4.279 1405 HE1 HIS 84 1HE HIS 84 11.624 -5.815 1.996 1406 HE2 HIS 84 2HE HIS 84 9.770 -5.503 3.587 1407 H GLY 85 H GLY 85 9.656 -12.831 1.926 1408 HA2 GLY 85 2HA GLY 85 9.944 -15.122 2.355 1409 HA3 GLY 85 1HA GLY 85 10.986 -14.722 3.719 1410 H ILE 86 H ILE 86 8.139 -12.950 3.468 1411 HA ILE 86 HA ILE 86 7.006 -14.284 5.795 1412 HB ILE 86 HB ILE 86 6.279 -11.694 4.396 1413 HG12 ILE 86 2HG1 ILE 86 7.618 -12.192 7.061 1414 HG13 ILE 86 1HG1 ILE 86 8.412 -11.596 5.610 1415 HG21 ILE 86 1HG2 ILE 86 4.782 -11.241 6.282 1416 HG22 ILE 86 2HG2 ILE 86 5.121 -12.841 6.933 1417 HG23 ILE 86 3HG2 ILE 86 4.285 -12.673 5.390 1418 HD11 ILE 86 1HD1 ILE 86 7.971 -9.798 7.179 1419 HD12 ILE 86 2HD1 ILE 86 6.251 -10.204 7.164 1420 HD13 ILE 86 3HD1 ILE 86 7.024 -9.584 5.702 1421 H ASP 87 H ASP 87 5.152 -15.431 5.668 1422 HA ASP 87 HA ASP 87 3.946 -15.622 3.017 1423 HB2 ASP 87 2HB ASP 87 3.829 -17.576 5.305 1424 HB3 ASP 87 1HB ASP 87 2.840 -17.718 3.857 1425 H ILE 88 H ILE 88 2.192 -14.704 2.639 1426 HA ILE 88 HA ILE 88 0.451 -13.988 4.870 1427 HB ILE 88 HB ILE 88 0.796 -12.584 2.185 1428 HG12 ILE 88 2HG1 ILE 88 1.627 -11.749 4.968 1429 HG13 ILE 88 1HG1 ILE 88 2.706 -12.258 3.675 1430 HG21 ILE 88 1HG2 ILE 88 -0.886 -11.785 4.562 1431 HG22 ILE 88 2HG2 ILE 88 -1.502 -12.386 3.020 1432 HG23 ILE 88 3HG2 ILE 88 -0.658 -10.837 3.093 1433 HD11 ILE 88 1HD1 ILE 88 2.652 -9.831 3.984 1434 HD12 ILE 88 2HD1 ILE 88 0.937 -9.827 3.610 1435 HD13 ILE 88 3HD1 ILE 88 2.069 -10.290 2.370 1436 H LYS 89 H LYS 89 -1.788 -14.272 4.508 1437 HA LYS 89 HA LYS 89 -2.629 -16.559 3.248 1438 HB2 LYS 89 2HB LYS 89 -3.880 -15.385 5.016 1439 HB3 LYS 89 1HB LYS 89 -4.248 -14.090 3.891 1440 HG2 LYS 89 2HG LYS 89 -5.544 -15.606 2.523 1441 HG3 LYS 89 1HG LYS 89 -5.138 -16.945 3.603 1442 HD2 LYS 89 2HD LYS 89 -6.276 -15.781 5.449 1443 HD3 LYS 89 1HD LYS 89 -6.690 -14.462 4.355 1444 HE2 LYS 89 2HE LYS 89 -7.998 -15.993 2.984 1445 HE3 LYS 89 1HE LYS 89 -7.552 -17.331 4.034 1446 HZ1 LYS 89 1HZ LYS 89 -9.755 -16.498 4.573 1447 HZ2 LYS 89 2HZ LYS 89 -9.151 -14.957 4.831 1448 HZ3 LYS 89 3HZ LYS 89 -8.714 -16.189 5.865 Start of MODEL 8 1 H1 MET 1 1HT MET 1 15.839 -12.894 10.741 2 H2 MET 1 2HT MET 1 15.594 -11.335 10.199 3 H3 MET 1 3HT MET 1 15.484 -12.627 9.111 4 HA MET 1 HA MET 1 13.312 -11.756 9.751 5 HB2 MET 1 2HB MET 1 13.948 -14.521 10.820 6 HB3 MET 1 1HB MET 1 12.318 -13.899 10.660 7 HG2 MET 1 2HG MET 1 12.840 -15.379 8.823 8 HG3 MET 1 1HG MET 1 12.633 -13.736 8.227 9 HE1 MET 1 1HE MET 1 13.735 -14.472 5.921 10 HE2 MET 1 2HE MET 1 13.943 -16.113 6.539 11 HE3 MET 1 3HE MET 1 15.305 -15.267 5.801 12 H GLY 2 H GLY 2 11.642 -12.041 11.591 13 HA2 GLY 2 2HA GLY 2 11.067 -11.826 13.804 14 HA3 GLY 2 1HA GLY 2 12.775 -11.778 14.233 15 H PHE 3 H PHE 3 9.987 -9.989 13.821 16 HA PHE 3 HA PHE 3 10.855 -7.514 12.991 17 HB2 PHE 3 2HB PHE 3 8.879 -6.607 14.136 18 HB3 PHE 3 1HB PHE 3 8.488 -8.075 13.264 19 HD1 PHE 3 1HD PHE 3 8.479 -6.402 16.446 20 HD2 PHE 3 2HD PHE 3 8.199 -10.225 14.586 21 HE1 PHE 3 1HE PHE 3 7.462 -7.314 18.481 22 HE2 PHE 3 2HE PHE 3 7.175 -11.141 16.624 23 HZ PHE 3 HZ PHE 3 6.808 -9.682 18.577 24 H THR 4 H THR 4 12.081 -5.993 13.838 25 HA THR 4 HA THR 4 12.407 -5.726 16.687 26 HB THR 4 HB THR 4 14.847 -6.181 14.940 27 HG1 THR 4 1HG THR 4 13.193 -7.905 16.050 28 HG21 THR 4 1HG2 THR 4 15.229 -4.670 16.844 29 HG22 THR 4 2HG2 THR 4 16.049 -6.215 17.091 30 HG23 THR 4 3HG2 THR 4 14.541 -5.874 17.935 31 H ASP 5 H ASP 5 11.820 -3.641 16.738 32 HA ASP 5 HA ASP 5 13.341 -1.812 15.029 33 HB2 ASP 5 2HB ASP 5 10.431 -1.649 15.745 34 HB3 ASP 5 1HB ASP 5 11.347 -0.223 15.283 35 H GLU 6 H GLU 6 14.099 -0.020 15.886 36 HA GLU 6 HA GLU 6 14.299 0.083 18.722 37 HB2 GLU 6 2HB GLU 6 16.147 0.800 17.272 38 HB3 GLU 6 1HB GLU 6 15.126 2.047 16.576 39 HG2 GLU 6 2HG GLU 6 15.012 3.163 18.740 40 HG3 GLU 6 1HG GLU 6 16.030 1.902 19.441 41 H THR 7 H THR 7 12.427 0.535 19.674 42 HA THR 7 HA THR 7 10.632 2.291 18.374 43 HB THR 7 HB THR 7 9.642 0.384 19.435 44 HG1 THR 7 1HG THR 7 8.070 1.510 19.720 45 HG21 THR 7 1HG2 THR 7 10.647 1.490 22.063 46 HG22 THR 7 2HG2 THR 7 11.200 0.011 21.278 47 HG23 THR 7 3HG2 THR 7 9.548 0.122 21.887 48 H VAL 8 H VAL 8 11.489 4.146 18.253 49 HA VAL 8 HA VAL 8 11.406 5.713 20.676 50 HB VAL 8 HB VAL 8 13.768 5.357 20.081 51 HG11 VAL 8 1HG1 VAL 8 13.599 4.912 17.738 52 HG12 VAL 8 2HG1 VAL 8 14.752 6.217 18.019 53 HG13 VAL 8 3HG1 VAL 8 13.133 6.580 17.419 54 HG21 VAL 8 1HG2 VAL 8 14.512 7.700 19.940 55 HG22 VAL 8 2HG2 VAL 8 13.217 7.464 21.111 56 HG23 VAL 8 3HG2 VAL 8 12.860 8.174 19.537 57 H ARG 9 H ARG 9 10.103 7.428 20.478 58 HA ARG 9 HA ARG 9 8.632 7.361 18.033 59 HB2 ARG 9 2HB ARG 9 7.834 8.339 20.735 60 HB3 ARG 9 1HB ARG 9 6.916 8.798 19.313 61 HG2 ARG 9 2HG ARG 9 5.863 6.895 20.341 62 HG3 ARG 9 1HG ARG 9 6.561 6.409 18.810 63 HD2 ARG 9 2HD ARG 9 6.958 4.692 20.459 64 HD3 ARG 9 1HD ARG 9 8.486 5.450 20.023 65 HE ARG 9 HE ARG 9 7.568 6.809 22.225 66 HH11 ARG 9 1HH1 ARG 9 8.445 3.388 21.529 67 HH12 ARG 9 2HH1 ARG 9 8.936 3.098 23.119 68 HH21 ARG 9 1HH2 ARG 9 8.289 6.306 24.401 69 HH22 ARG 9 2HH2 ARG 9 8.850 4.733 24.767 70 H PHE 10 H PHE 10 9.912 8.369 16.696 71 HA PHE 10 HA PHE 10 9.042 11.041 16.344 72 HB2 PHE 10 2HB PHE 10 11.244 12.018 15.877 73 HB3 PHE 10 1HB PHE 10 11.220 11.442 17.533 74 HD1 PHE 10 1HD PHE 10 12.758 9.772 18.244 75 HD2 PHE 10 2HD PHE 10 12.514 10.820 14.139 76 HE1 PHE 10 1HE PHE 10 14.853 8.564 17.805 77 HE2 PHE 10 2HE PHE 10 14.592 9.617 13.693 78 HZ PHE 10 HZ PHE 10 15.775 8.481 15.528 79 H ASP 11 H ASP 11 9.151 11.569 14.095 80 HA ASP 11 HA ASP 11 8.940 9.213 12.529 81 HB2 ASP 11 2HB ASP 11 8.451 10.717 10.622 82 HB3 ASP 11 1HB ASP 11 7.442 11.059 12.016 83 H PHE 12 H PHE 12 10.347 8.245 11.372 84 HA PHE 12 HA PHE 12 13.051 9.309 11.510 85 HB2 PHE 12 2HB PHE 12 12.694 7.093 12.543 86 HB3 PHE 12 1HB PHE 12 12.122 6.464 11.011 87 HD1 PHE 12 1HD PHE 12 15.120 8.046 12.563 88 HD2 PHE 12 2HD PHE 12 13.622 5.352 9.629 89 HE1 PHE 12 1HE PHE 12 17.413 7.355 12.027 90 HE2 PHE 12 2HE PHE 12 15.913 4.660 9.088 91 HZ PHE 12 HZ PHE 12 17.810 5.661 10.284 92 H ASP 13 H ASP 13 12.080 10.729 9.796 93 HA ASP 13 HA ASP 13 12.282 11.569 7.705 94 HB2 ASP 13 2HB ASP 13 14.632 10.871 8.039 95 HB3 ASP 13 1HB ASP 13 14.262 9.283 7.396 96 H ASP 14 H ASP 14 12.180 10.827 5.172 97 HA ASP 14 HA ASP 14 9.803 9.295 4.856 98 HB2 ASP 14 2HB ASP 14 10.143 9.525 2.423 99 HB3 ASP 14 1HB ASP 14 10.441 11.071 3.195 100 H ASN 15 H ASN 15 13.206 8.792 4.630 101 HA ASN 15 HA ASN 15 14.549 7.071 4.627 102 HB2 ASN 15 2HB ASN 15 13.315 6.245 6.546 103 HB3 ASN 15 1HB ASN 15 12.132 5.473 5.498 104 HD21 ASN 15 1HD2 ASN 15 15.409 5.369 6.709 105 HD22 ASN 15 2HD2 ASN 15 15.719 3.740 6.249 106 H ARG 16 H ARG 16 11.590 5.684 3.293 107 HA ARG 16 HA ARG 16 11.300 4.212 1.582 108 HB2 ARG 16 2HB ARG 16 12.740 6.475 0.170 109 HB3 ARG 16 1HB ARG 16 11.836 5.208 -0.656 110 HG2 ARG 16 2HG ARG 16 9.789 5.907 0.482 111 HG3 ARG 16 1HG ARG 16 10.690 7.151 1.345 112 HD2 ARG 16 2HD ARG 16 10.367 7.000 -1.650 113 HD3 ARG 16 1HD ARG 16 9.406 8.021 -0.589 114 HE ARG 16 HE ARG 16 12.084 8.573 -0.117 115 HH11 ARG 16 1HH1 ARG 16 9.566 9.117 -2.577 116 HH12 ARG 16 2HH1 ARG 16 10.401 10.363 -3.374 117 HH21 ARG 16 1HH2 ARG 16 13.238 10.347 -1.230 118 HH22 ARG 16 2HH2 ARG 16 12.521 11.100 -2.577 119 H LYS 17 H LYS 17 12.523 2.581 2.514 120 HA LYS 17 HA LYS 17 14.576 1.480 0.931 121 HB2 LYS 17 2HB LYS 17 15.762 3.404 2.099 122 HB3 LYS 17 1HB LYS 17 15.351 2.660 3.624 123 HG2 LYS 17 2HG LYS 17 16.771 0.751 3.069 124 HG3 LYS 17 1HG LYS 17 17.160 1.503 1.513 125 HD2 LYS 17 2HD LYS 17 18.104 3.414 2.693 126 HD3 LYS 17 1HD LYS 17 17.722 2.657 4.238 127 HE2 LYS 17 2HE LYS 17 19.164 0.777 3.655 128 HE3 LYS 17 1HE LYS 17 19.564 1.562 2.126 129 HZ1 LYS 17 1HZ LYS 17 20.153 2.533 4.845 130 HZ2 LYS 17 2HZ LYS 17 20.460 3.436 3.461 131 HZ3 LYS 17 3HZ LYS 17 21.278 1.970 3.729 132 H LYS 18 H LYS 18 15.600 -0.358 2.573 133 HA LYS 18 HA LYS 18 13.664 -2.211 3.181 134 HB2 LYS 18 2HB LYS 18 16.395 -1.954 4.426 135 HB3 LYS 18 1HB LYS 18 15.380 -3.379 4.542 136 HG2 LYS 18 2HG LYS 18 16.499 -2.219 1.998 137 HG3 LYS 18 1HG LYS 18 17.155 -3.599 2.871 138 HD2 LYS 18 2HD LYS 18 15.048 -4.822 2.498 139 HD3 LYS 18 1HD LYS 18 14.409 -3.442 1.603 140 HE2 LYS 18 2HE LYS 18 16.205 -3.662 -0.036 141 HE3 LYS 18 1HE LYS 18 16.871 -5.021 0.865 142 HZ1 LYS 18 1HZ LYS 18 14.185 -4.990 -0.435 143 HZ2 LYS 18 2HZ LYS 18 14.867 -6.280 0.393 144 HZ3 LYS 18 3HZ LYS 18 15.571 -5.738 -1.027 145 H ALA 19 H ALA 19 14.818 0.327 5.306 146 HA ALA 19 HA ALA 19 13.999 -0.602 7.787 147 HB1 ALA 19 1HB ALA 19 15.256 1.458 7.454 148 HB2 ALA 19 2HB ALA 19 13.778 1.719 8.424 149 HB3 ALA 19 3HB ALA 19 13.804 2.137 6.704 150 H ILE 20 H ILE 20 12.061 0.887 5.241 151 HA ILE 20 HA ILE 20 9.748 1.190 6.834 152 HB ILE 20 HB ILE 20 9.975 0.986 3.809 153 HG12 ILE 20 2HG1 ILE 20 9.730 3.372 5.658 154 HG13 ILE 20 1HG1 ILE 20 11.141 2.919 4.709 155 HG21 ILE 20 1HG2 ILE 20 7.604 1.860 5.468 156 HG22 ILE 20 2HG2 ILE 20 7.713 0.392 4.501 157 HG23 ILE 20 3HG2 ILE 20 7.728 1.969 3.711 158 HD11 ILE 20 1HD1 ILE 20 9.969 4.764 3.662 159 HD12 ILE 20 2HD1 ILE 20 8.480 3.827 3.646 160 HD13 ILE 20 3HD1 ILE 20 9.841 3.317 2.651 161 H SER 21 H SER 21 11.099 -1.392 4.983 162 HA SER 21 HA SER 21 8.669 -2.960 5.042 163 HB2 SER 21 2HB SER 21 9.960 -4.851 4.081 164 HB3 SER 21 1HB SER 21 10.230 -3.373 3.170 165 HG SER 21 HG SER 21 12.148 -3.321 4.868 166 H GLU 22 H GLU 22 11.491 -2.660 6.992 167 HA GLU 22 HA GLU 22 11.096 -4.886 8.686 168 HB2 GLU 22 2HB GLU 22 12.316 -2.187 9.306 169 HB3 GLU 22 1HB GLU 22 12.518 -3.652 10.252 170 HG2 GLU 22 2HG GLU 22 13.476 -3.223 7.437 171 HG3 GLU 22 1HG GLU 22 14.474 -3.195 8.890 172 H THR 23 H THR 23 10.144 -1.532 8.781 173 HA THR 23 HA THR 23 8.755 -1.377 11.166 174 HB THR 23 HB THR 23 8.185 0.024 8.543 175 HG1 THR 23 1HG THR 23 10.342 0.312 9.413 176 HG21 THR 23 1HG2 THR 23 6.302 0.256 10.095 177 HG22 THR 23 2HG2 THR 23 7.161 1.789 9.936 178 HG23 THR 23 3HG2 THR 23 7.406 0.783 11.364 179 H LEU 24 H LEU 24 7.488 -2.120 7.917 180 HA LEU 24 HA LEU 24 4.840 -2.530 8.799 181 HB2 LEU 24 2HB LEU 24 6.164 -3.400 6.234 182 HB3 LEU 24 1HB LEU 24 4.439 -3.481 6.550 183 HG LEU 24 HG LEU 24 6.110 -0.972 6.378 184 HD11 LEU 24 1HD1 LEU 24 4.016 -2.089 4.529 185 HD12 LEU 24 2HD1 LEU 24 5.752 -2.016 4.224 186 HD13 LEU 24 3HD1 LEU 24 4.819 -0.528 4.363 187 HD21 LEU 24 1HD2 LEU 24 4.305 -0.686 7.995 188 HD22 LEU 24 2HD2 LEU 24 3.136 -1.303 6.826 189 HD23 LEU 24 3HD2 LEU 24 3.965 0.221 6.525 190 H GLU 25 H GLU 25 7.564 -4.683 8.598 191 HA GLU 25 HA GLU 25 6.157 -7.112 8.682 192 HB2 GLU 25 2HB GLU 25 8.641 -6.688 8.163 193 HB3 GLU 25 1HB GLU 25 8.889 -6.569 9.888 194 HG2 GLU 25 2HG GLU 25 7.684 -9.023 8.683 195 HG3 GLU 25 1HG GLU 25 9.417 -8.778 8.621 196 H THR 26 H THR 26 7.493 -4.976 11.184 197 HA THR 26 HA THR 26 6.689 -6.348 13.467 198 HB THR 26 HB THR 26 6.990 -3.369 13.035 199 HG1 THR 26 1HG THR 26 9.167 -3.714 13.412 200 HG21 THR 26 1HG2 THR 26 7.557 -3.323 15.439 201 HG22 THR 26 2HG2 THR 26 7.216 -5.056 15.538 202 HG23 THR 26 3HG2 THR 26 5.921 -3.923 15.162 203 H VAL 27 H VAL 27 5.034 -3.900 11.510 204 HA VAL 27 HA VAL 27 2.744 -3.588 13.149 205 HB VAL 27 HB VAL 27 2.965 -3.156 10.144 206 HG11 VAL 27 1HG1 VAL 27 0.642 -3.309 10.858 207 HG12 VAL 27 2HG1 VAL 27 1.047 -1.656 10.399 208 HG13 VAL 27 3HG1 VAL 27 0.934 -2.093 12.103 209 HG21 VAL 27 1HG2 VAL 27 3.291 -1.186 12.412 210 HG22 VAL 27 2HG2 VAL 27 3.332 -0.800 10.693 211 HG23 VAL 27 3HG2 VAL 27 4.585 -1.821 11.399 212 H TYR 28 H TYR 28 3.544 -5.829 10.588 213 HA TYR 28 HA TYR 28 1.025 -6.962 10.131 214 HB2 TYR 28 2HB TYR 28 3.161 -7.322 8.764 215 HB3 TYR 28 1HB TYR 28 3.681 -8.432 10.020 216 HD1 TYR 28 1HD TYR 28 2.009 -10.431 10.514 217 HD2 TYR 28 2HD TYR 28 2.001 -8.132 6.946 218 HE1 TYR 28 1HE TYR 28 0.781 -12.226 9.364 219 HE2 TYR 28 2HE TYR 28 0.766 -9.913 5.788 220 HH TYR 28 HH TYR 28 -0.809 -12.345 7.359 221 H ARG 29 H ARG 29 3.571 -7.699 12.403 222 HA ARG 29 HA ARG 29 2.507 -10.056 13.482 223 HB2 ARG 29 2HB ARG 29 4.396 -8.109 14.781 224 HB3 ARG 29 1HB ARG 29 4.121 -9.776 15.274 225 HG2 ARG 29 2HG ARG 29 5.322 -8.848 12.674 226 HG3 ARG 29 1HG ARG 29 6.154 -9.649 14.008 227 HD2 ARG 29 2HD ARG 29 4.742 -11.632 13.666 228 HD3 ARG 29 1HD ARG 29 3.952 -10.824 12.318 229 HE ARG 29 HE ARG 29 6.662 -10.757 11.843 230 HH11 ARG 29 1HH1 ARG 29 3.921 -12.990 11.837 231 HH12 ARG 29 2HH1 ARG 29 4.739 -14.240 11.006 232 HH21 ARG 29 1HH2 ARG 29 7.788 -12.485 10.671 233 HH22 ARG 29 2HH2 ARG 29 6.985 -13.948 10.315 234 H ALA 30 H ALA 30 2.015 -6.723 14.339 235 HA ALA 30 HA ALA 30 0.745 -7.201 16.829 236 HB1 ALA 30 1HB ALA 30 1.635 -4.993 16.213 237 HB2 ALA 30 2HB ALA 30 -0.069 -4.894 16.657 238 HB3 ALA 30 3HB ALA 30 0.405 -4.852 14.960 239 H LEU 31 H LEU 31 -0.458 -6.841 13.559 240 HA LEU 31 HA LEU 31 -3.169 -7.038 14.359 241 HB2 LEU 31 2HB LEU 31 -1.889 -6.978 11.669 242 HB3 LEU 31 1HB LEU 31 -3.620 -7.164 11.882 243 HG LEU 31 HG LEU 31 -2.134 -4.909 13.139 244 HD11 LEU 31 1HD1 LEU 31 -3.599 -4.882 10.501 245 HD12 LEU 31 2HD1 LEU 31 -1.833 -4.798 10.662 246 HD13 LEU 31 3HD1 LEU 31 -2.847 -3.494 11.278 247 HD21 LEU 31 1HD2 LEU 31 -4.367 -3.874 13.071 248 HD22 LEU 31 2HD2 LEU 31 -4.280 -5.326 14.080 249 HD23 LEU 31 3HD2 LEU 31 -5.009 -5.385 12.468 250 H GLU 32 H GLU 32 -0.867 -9.432 13.243 251 HA GLU 32 HA GLU 32 -2.915 -11.372 12.877 252 HB2 GLU 32 2HB GLU 32 -1.116 -13.100 12.990 253 HB3 GLU 32 1HB GLU 32 -0.793 -11.837 11.812 254 HG2 GLU 32 2HG GLU 32 0.778 -10.828 13.260 255 HG3 GLU 32 1HG GLU 32 0.379 -11.929 14.574 256 H GLU 33 H GLU 33 -0.962 -10.430 15.621 257 HA GLU 33 HA GLU 33 -1.969 -12.358 17.435 258 HB2 GLU 33 2HB GLU 33 -0.854 -9.593 17.924 259 HB3 GLU 33 1HB GLU 33 -1.268 -10.716 19.208 260 HG2 GLU 33 2HG GLU 33 0.786 -11.210 17.062 261 HG3 GLU 33 1HG GLU 33 1.132 -10.677 18.707 262 H LYS 34 H LYS 34 -3.093 -9.227 16.418 263 HA LYS 34 HA LYS 34 -5.277 -9.136 18.258 264 HB2 LYS 34 2HB LYS 34 -4.398 -7.449 15.979 265 HB3 LYS 34 1HB LYS 34 -6.037 -7.282 16.575 266 HG2 LYS 34 2HG LYS 34 -3.594 -7.030 18.307 267 HG3 LYS 34 1HG LYS 34 -4.408 -5.663 17.537 268 HD2 LYS 34 2HD LYS 34 -6.504 -6.302 18.667 269 HD3 LYS 34 1HD LYS 34 -5.651 -7.602 19.494 270 HE2 LYS 34 2HE LYS 34 -4.243 -6.006 20.619 271 HE3 LYS 34 1HE LYS 34 -4.971 -4.680 19.708 272 HZ1 LYS 34 1HZ LYS 34 -6.392 -6.427 21.655 273 HZ2 LYS 34 2HZ LYS 34 -7.077 -5.163 20.761 274 HZ3 LYS 34 3HZ LYS 34 -5.903 -4.826 21.903 275 H GLY 35 H GLY 35 -4.834 -10.879 15.463 276 HA2 GLY 35 2HA GLY 35 -6.299 -12.334 14.456 277 HA3 GLY 35 1HA GLY 35 -7.539 -11.784 15.568 278 H TYR 36 H TYR 36 -5.754 -9.636 13.421 279 HA TYR 36 HA TYR 36 -8.208 -9.323 11.803 280 HB2 TYR 36 2HB TYR 36 -6.087 -7.231 12.381 281 HB3 TYR 36 1HB TYR 36 -7.487 -7.001 11.353 282 HD1 TYR 36 1HD TYR 36 -6.157 -6.310 14.457 283 HD2 TYR 36 2HD TYR 36 -9.801 -7.555 12.654 284 HE1 TYR 36 1HE TYR 36 -7.417 -5.460 16.407 285 HE2 TYR 36 2HE TYR 36 -11.065 -6.702 14.579 286 HH TYR 36 HH TYR 36 -10.697 -6.224 16.898 287 H ASN 37 H ASN 37 -7.502 -8.320 9.562 288 HA ASN 37 HA ASN 37 -5.231 -9.903 8.658 289 HB2 ASN 37 2HB ASN 37 -7.220 -8.293 7.019 290 HB3 ASN 37 1HB ASN 37 -5.968 -9.341 6.380 291 HD21 ASN 37 1HD2 ASN 37 -8.780 -9.412 5.937 292 HD22 ASN 37 2HD2 ASN 37 -9.349 -10.966 6.445 293 HA PRO 38 HA PRO 38 -2.757 -6.218 9.518 294 HB2 PRO 38 2HB PRO 38 -1.040 -7.770 7.656 295 HB3 PRO 38 1HB PRO 38 -0.621 -6.934 9.155 296 HG2 PRO 38 2HG PRO 38 -0.949 -9.591 9.061 297 HG3 PRO 38 1HG PRO 38 -1.402 -8.663 10.492 298 HD2 PRO 38 2HD PRO 38 -3.117 -9.992 8.502 299 HD3 PRO 38 1HD PRO 38 -3.462 -9.447 10.166 300 H ILE 39 H ILE 39 -3.120 -7.648 6.362 301 HA ILE 39 HA ILE 39 -2.058 -5.532 4.851 302 HB ILE 39 HB ILE 39 -4.047 -7.631 3.986 303 HG12 ILE 39 2HG1 ILE 39 -2.104 -8.628 5.065 304 HG13 ILE 39 1HG1 ILE 39 -2.077 -8.950 3.341 305 HG21 ILE 39 1HG2 ILE 39 -3.115 -7.276 1.758 306 HG22 ILE 39 2HG2 ILE 39 -2.055 -6.010 2.392 307 HG23 ILE 39 3HG2 ILE 39 -3.807 -5.784 2.389 308 HD11 ILE 39 1HD1 ILE 39 -0.386 -7.197 3.055 309 HD12 ILE 39 2HD1 ILE 39 0.148 -8.400 4.238 310 HD13 ILE 39 3HD1 ILE 39 -0.457 -6.846 4.779 311 H ASN 40 H ASN 40 -5.399 -6.396 5.661 312 HA ASN 40 HA ASN 40 -6.598 -4.402 4.047 313 HB2 ASN 40 2HB ASN 40 -7.770 -5.787 6.467 314 HB3 ASN 40 1HB ASN 40 -8.675 -4.872 5.276 315 HD21 ASN 40 1HD2 ASN 40 -6.999 -6.079 2.982 316 HD22 ASN 40 2HD2 ASN 40 -7.623 -7.651 2.877 317 H GLN 41 H GLN 41 -5.495 -4.456 7.352 318 HA GLN 41 HA GLN 41 -6.652 -1.935 8.025 319 HB2 GLN 41 2HB GLN 41 -4.386 -3.410 9.353 320 HB3 GLN 41 1HB GLN 41 -5.281 -2.067 10.050 321 HG2 GLN 41 2HG GLN 41 -6.462 -4.755 9.332 322 HG3 GLN 41 1HG GLN 41 -5.993 -4.245 10.949 323 HE21 GLN 41 1HE2 GLN 41 -7.014 -1.536 10.697 324 HE22 GLN 41 2HE2 GLN 41 -8.733 -1.672 10.713 325 H ILE 42 H ILE 42 -3.480 -3.009 6.853 326 HA ILE 42 HA ILE 42 -2.234 -0.479 7.066 327 HB ILE 42 HB ILE 42 -1.488 -2.851 5.316 328 HG12 ILE 42 2HG1 ILE 42 -0.292 -1.815 7.903 329 HG13 ILE 42 1HG1 ILE 42 -1.332 -3.226 7.753 330 HG21 ILE 42 1HG2 ILE 42 0.109 -0.325 5.835 331 HG22 ILE 42 2HG2 ILE 42 -0.594 -0.809 4.301 332 HG23 ILE 42 3HG2 ILE 42 0.708 -1.762 5.009 333 HD11 ILE 42 1HD1 ILE 42 0.373 -4.332 6.395 334 HD12 ILE 42 2HD1 ILE 42 1.008 -3.855 7.969 335 HD13 ILE 42 3HD1 ILE 42 1.408 -2.910 6.534 336 H VAL 43 H VAL 43 -3.757 -2.091 4.250 337 HA VAL 43 HA VAL 43 -3.339 0.045 2.499 338 HB VAL 43 HB VAL 43 -4.072 -2.079 1.534 339 HG11 VAL 43 1HG1 VAL 43 -5.437 -2.845 3.397 340 HG12 VAL 43 2HG1 VAL 43 -6.310 -2.975 1.867 341 HG13 VAL 43 3HG1 VAL 43 -6.682 -1.664 2.993 342 HG21 VAL 43 1HG2 VAL 43 -6.238 -0.010 1.155 343 HG22 VAL 43 2HG2 VAL 43 -5.937 -1.390 0.098 344 HG23 VAL 43 3HG2 VAL 43 -4.722 -0.121 0.259 345 H GLY 44 H GLY 44 -5.921 -0.494 4.804 346 HA2 GLY 44 2HA GLY 44 -7.491 1.747 4.162 347 HA3 GLY 44 1HA GLY 44 -7.430 0.965 5.741 348 H TYR 45 H TYR 45 -4.735 1.370 6.356 349 HA TYR 45 HA TYR 45 -4.825 3.954 7.419 350 HB2 TYR 45 2HB TYR 45 -3.483 2.267 8.535 351 HB3 TYR 45 1HB TYR 45 -2.434 2.122 7.125 352 HD1 TYR 45 1HD TYR 45 -0.440 3.385 7.067 353 HD2 TYR 45 2HD TYR 45 -3.620 4.662 9.573 354 HE1 TYR 45 1HE TYR 45 0.977 5.184 7.939 355 HE2 TYR 45 2HE TYR 45 -2.210 6.458 10.447 356 HH TYR 45 HH TYR 45 0.708 7.388 9.044 357 H LEU 46 H LEU 46 -3.008 2.717 4.636 358 HA LEU 46 HA LEU 46 -1.877 5.257 4.216 359 HB2 LEU 46 2HB LEU 46 -1.913 2.846 2.428 360 HB3 LEU 46 1HB LEU 46 -1.220 4.366 1.901 361 HG LEU 46 HG LEU 46 0.346 4.222 3.899 362 HD11 LEU 46 1HD1 LEU 46 0.743 2.138 4.954 363 HD12 LEU 46 2HD1 LEU 46 -0.622 1.420 4.096 364 HD13 LEU 46 3HD1 LEU 46 -0.895 2.714 5.264 365 HD21 LEU 46 1HD2 LEU 46 1.089 3.677 1.668 366 HD22 LEU 46 2HD2 LEU 46 0.521 2.019 1.866 367 HD23 LEU 46 3HD2 LEU 46 1.844 2.626 2.861 368 H LEU 47 H LEU 47 -4.753 3.766 2.782 369 HA LEU 47 HA LEU 47 -5.096 5.964 1.036 370 HB2 LEU 47 2HB LEU 47 -6.904 3.695 1.785 371 HB3 LEU 47 1HB LEU 47 -7.510 5.045 0.855 372 HG LEU 47 HG LEU 47 -5.836 4.569 -0.891 373 HD11 LEU 47 1HD1 LEU 47 -4.661 2.488 -0.970 374 HD12 LEU 47 2HD1 LEU 47 -5.199 2.088 0.664 375 HD13 LEU 47 3HD1 LEU 47 -4.125 3.470 0.394 376 HD21 LEU 47 1HD2 LEU 47 -7.649 2.271 -0.203 377 HD22 LEU 47 2HD2 LEU 47 -6.918 2.549 -1.780 378 HD23 LEU 47 3HD2 LEU 47 -8.080 3.708 -1.133 379 H SER 48 H SER 48 -6.368 5.338 4.275 380 HA SER 48 HA SER 48 -7.960 7.761 4.049 381 HB2 SER 48 2HB SER 48 -7.623 5.834 6.332 382 HB3 SER 48 1HB SER 48 -8.761 7.183 6.308 383 HG SER 48 HG SER 48 -9.520 6.147 4.295 384 H GLY 49 H GLY 49 -4.837 6.794 5.400 385 HA2 GLY 49 2HA GLY 49 -3.255 7.979 6.429 386 HA3 GLY 49 1HA GLY 49 -4.124 9.430 5.940 387 H ASP 50 H ASP 50 -5.294 6.819 8.013 388 HA ASP 50 HA ASP 50 -5.400 8.779 10.190 389 HB2 ASP 50 2HB ASP 50 -7.637 8.354 9.021 390 HB3 ASP 50 1HB ASP 50 -7.546 6.721 9.667 391 HA PRO 51 HA PRO 51 -2.949 5.513 12.006 392 HB2 PRO 51 2HB PRO 51 -2.976 6.493 14.582 393 HB3 PRO 51 1HB PRO 51 -1.887 7.037 13.299 394 HG2 PRO 51 2HG PRO 51 -4.452 8.260 14.244 395 HG3 PRO 51 1HG PRO 51 -2.925 9.050 13.816 396 HD2 PRO 51 2HD PRO 51 -5.004 9.019 12.138 397 HD3 PRO 51 1HD PRO 51 -3.336 8.888 11.537 398 H ALA 52 H ALA 52 -6.200 6.213 13.056 399 HA ALA 52 HA ALA 52 -6.444 4.316 15.110 400 HB1 ALA 52 1HB ALA 52 -8.611 5.308 13.270 401 HB2 ALA 52 2HB ALA 52 -8.055 6.125 14.730 402 HB3 ALA 52 3HB ALA 52 -8.843 4.549 14.844 403 H TYR 53 H TYR 53 -6.102 3.765 11.780 404 HA TYR 53 HA TYR 53 -7.537 1.368 11.493 405 HB2 TYR 53 2HB TYR 53 -5.275 2.573 9.992 406 HB3 TYR 53 1HB TYR 53 -5.779 0.921 9.646 407 HD1 TYR 53 1HD TYR 53 -7.959 0.448 8.821 408 HD2 TYR 53 2HD TYR 53 -6.685 4.438 9.424 409 HE1 TYR 53 1HE TYR 53 -9.792 1.201 7.471 410 HE2 TYR 53 2HE TYR 53 -8.538 5.245 8.058 411 HH TYR 53 HH TYR 53 -9.985 4.427 6.298 412 H ILE 54 H ILE 54 -4.467 2.065 12.987 413 HA ILE 54 HA ILE 54 -3.999 -0.806 13.233 414 HB ILE 54 HB ILE 54 -2.005 1.448 13.747 415 HG12 ILE 54 2HG1 ILE 54 -2.504 1.284 11.340 416 HG13 ILE 54 1HG1 ILE 54 -0.891 0.681 11.685 417 HG21 ILE 54 1HG2 ILE 54 -0.330 -0.324 13.856 418 HG22 ILE 54 2HG2 ILE 54 -1.598 -1.537 13.666 419 HG23 ILE 54 3HG2 ILE 54 -1.563 -0.517 15.104 420 HD11 ILE 54 1HD1 ILE 54 -3.329 -1.011 11.184 421 HD12 ILE 54 2HD1 ILE 54 -1.702 -1.608 11.524 422 HD13 ILE 54 3HD1 ILE 54 -2.019 -0.702 10.045 423 HA PRO 55 HA PRO 55 -5.623 -0.079 17.354 424 HB2 PRO 55 2HB PRO 55 -5.203 -2.651 18.235 425 HB3 PRO 55 1HB PRO 55 -6.624 -2.150 17.308 426 HG2 PRO 55 2HG PRO 55 -4.141 -3.518 16.390 427 HG3 PRO 55 1HG PRO 55 -5.819 -3.788 15.889 428 HD2 PRO 55 2HD PRO 55 -4.055 -2.401 14.407 429 HD3 PRO 55 1HD PRO 55 -5.790 -2.008 14.411 430 H ARG 56 H ARG 56 -4.742 0.168 19.372 431 HA ARG 56 HA ARG 56 -1.878 0.372 19.313 432 HB2 ARG 56 2HB ARG 56 -3.793 1.283 21.495 433 HB3 ARG 56 1HB ARG 56 -2.073 1.609 21.456 434 HG2 ARG 56 2HG ARG 56 -3.178 3.614 20.773 435 HG3 ARG 56 1HG ARG 56 -2.467 2.912 19.324 436 HD2 ARG 56 2HD ARG 56 -4.670 1.956 18.736 437 HD3 ARG 56 1HD ARG 56 -5.365 2.706 20.169 438 HE ARG 56 HE ARG 56 -4.062 4.540 18.362 439 HH11 ARG 56 1HH1 ARG 56 -7.176 2.990 19.220 440 HH12 ARG 56 2HH1 ARG 56 -8.092 4.142 18.375 441 HH21 ARG 56 1HH2 ARG 56 -5.394 6.075 17.201 442 HH22 ARG 56 2HH2 ARG 56 -7.097 5.895 17.237 443 H TYR 57 H TYR 57 -1.799 -1.913 19.172 444 HA TYR 57 HA TYR 57 -2.002 -3.403 21.685 445 HB2 TYR 57 2HB TYR 57 -2.742 -4.539 19.659 446 HB3 TYR 57 1HB TYR 57 -1.205 -4.224 18.878 447 HD1 TYR 57 1HD TYR 57 -2.545 -5.959 21.929 448 HD2 TYR 57 2HD TYR 57 0.315 -5.956 18.782 449 HE1 TYR 57 1HE TYR 57 -1.738 -8.172 22.657 450 HE2 TYR 57 2HE TYR 57 1.128 -8.158 19.508 451 HH TYR 57 HH TYR 57 -0.586 -10.085 21.676 452 H GLN 58 H GLN 58 0.331 -2.178 19.424 453 HA GLN 58 HA GLN 58 2.416 -2.386 21.434 454 HB2 GLN 58 2HB GLN 58 2.658 -3.392 18.588 455 HB3 GLN 58 1HB GLN 58 4.020 -3.086 19.650 456 HG2 GLN 58 2HG GLN 58 1.829 -5.077 20.181 457 HG3 GLN 58 1HG GLN 58 3.408 -5.463 19.501 458 HE21 GLN 58 1HE2 GLN 58 4.870 -3.586 21.215 459 HE22 GLN 58 2HE2 GLN 58 4.821 -4.272 22.793 460 H ASP 59 H ASP 59 4.422 -1.313 20.334 461 HA ASP 59 HA ASP 59 3.781 1.370 19.822 462 HB2 ASP 59 2HB ASP 59 6.243 1.598 19.553 463 HB3 ASP 59 1HB ASP 59 5.762 0.844 21.065 464 H ALA 60 H ALA 60 3.945 -1.321 17.838 465 HA ALA 60 HA ALA 60 4.885 -0.504 15.410 466 HB1 ALA 60 1HB ALA 60 4.006 -2.751 15.877 467 HB2 ALA 60 2HB ALA 60 3.339 -2.070 14.393 468 HB3 ALA 60 3HB ALA 60 2.367 -2.099 15.864 469 H ARG 61 H ARG 61 1.802 0.458 16.896 470 HA ARG 61 HA ARG 61 0.702 1.747 14.661 471 HB2 ARG 61 2HB ARG 61 -0.634 1.150 16.653 472 HB3 ARG 61 1HB ARG 61 0.307 2.257 17.624 473 HG2 ARG 61 2HG ARG 61 -1.382 3.230 15.326 474 HG3 ARG 61 1HG ARG 61 -2.070 2.943 16.918 475 HD2 ARG 61 2HD ARG 61 0.221 4.822 16.313 476 HD3 ARG 61 1HD ARG 61 -1.451 5.320 16.544 477 HE ARG 61 HE ARG 61 -0.443 3.795 18.747 478 HH11 ARG 61 1HH1 ARG 61 -0.425 7.087 17.391 479 HH12 ARG 61 2HH1 ARG 61 -0.201 7.839 18.888 480 HH21 ARG 61 1HH2 ARG 61 -0.127 4.869 20.813 481 HH22 ARG 61 2HH2 ARG 61 -0.002 6.555 20.865 482 H ASN 62 H ASN 62 3.045 2.768 17.037 483 HA ASN 62 HA ASN 62 3.174 5.520 16.214 484 HB2 ASN 62 2HB ASN 62 5.161 3.809 17.737 485 HB3 ASN 62 1HB ASN 62 5.279 5.543 17.512 486 HD21 ASN 62 1HD2 ASN 62 2.527 6.148 18.001 487 HD22 ASN 62 2HD2 ASN 62 2.255 5.849 19.676 488 H LEU 63 H LEU 63 4.783 2.522 15.495 489 HA LEU 63 HA LEU 63 6.945 3.614 14.040 490 HB2 LEU 63 2HB LEU 63 5.810 0.826 13.915 491 HB3 LEU 63 1HB LEU 63 7.364 1.331 13.284 492 HG LEU 63 HG LEU 63 6.582 1.264 16.210 493 HD11 LEU 63 1HD1 LEU 63 8.489 -0.427 14.620 494 HD12 LEU 63 2HD1 LEU 63 6.928 -0.939 15.262 495 HD13 LEU 63 3HD1 LEU 63 8.236 -0.497 16.362 496 HD21 LEU 63 1HD2 LEU 63 9.211 2.013 14.912 497 HD22 LEU 63 2HD2 LEU 63 8.926 1.828 16.641 498 HD23 LEU 63 3HD2 LEU 63 8.120 3.117 15.752 499 H ILE 64 H ILE 64 3.758 2.478 13.033 500 HA ILE 64 HA ILE 64 4.402 2.749 10.245 501 HB ILE 64 HB ILE 64 2.591 1.207 11.139 502 HG12 ILE 64 2HG1 ILE 64 1.590 3.206 9.095 503 HG13 ILE 64 1HG1 ILE 64 2.696 1.887 8.739 504 HG21 ILE 64 1HG2 ILE 64 1.077 3.791 11.521 505 HG22 ILE 64 2HG2 ILE 64 1.592 2.683 12.785 506 HG23 ILE 64 3HG2 ILE 64 0.367 2.183 11.619 507 HD11 ILE 64 1HD1 ILE 64 0.986 0.277 9.386 508 HD12 ILE 64 2HD1 ILE 64 0.414 1.339 8.095 509 HD13 ILE 64 3HD1 ILE 64 -0.127 1.595 9.754 510 H ARG 65 H ARG 65 3.382 4.762 12.757 511 HA ARG 65 HA ARG 65 2.509 6.998 11.157 512 HB2 ARG 65 2HB ARG 65 2.395 6.157 13.934 513 HB3 ARG 65 1HB ARG 65 2.904 7.832 13.797 514 HG2 ARG 65 2HG ARG 65 0.572 6.967 12.194 515 HG3 ARG 65 1HG ARG 65 0.360 7.121 13.936 516 HD2 ARG 65 2HD ARG 65 -0.164 9.209 12.552 517 HD3 ARG 65 1HD ARG 65 0.909 9.390 13.935 518 HE ARG 65 HE ARG 65 2.547 8.966 11.769 519 HH11 ARG 65 1HH1 ARG 65 0.126 11.382 12.614 520 HH12 ARG 65 2HH1 ARG 65 0.955 12.672 11.871 521 HH21 ARG 65 1HH2 ARG 65 3.728 10.765 10.777 522 HH22 ARG 65 2HH2 ARG 65 3.021 12.302 10.806 523 H ARG 66 H ARG 66 5.380 5.649 11.900 524 HA ARG 66 HA ARG 66 6.951 7.969 12.628 525 HB2 ARG 66 2HB ARG 66 7.313 5.717 13.596 526 HB3 ARG 66 1HB ARG 66 7.751 5.114 12.016 527 HG2 ARG 66 2HG ARG 66 9.730 6.554 12.037 528 HG3 ARG 66 1HG ARG 66 9.268 7.160 13.629 529 HD2 ARG 66 2HD ARG 66 9.364 4.840 14.492 530 HD3 ARG 66 1HD ARG 66 9.942 4.308 12.914 531 HE ARG 66 HE ARG 66 11.480 6.409 14.107 532 HH11 ARG 66 1HH1 ARG 66 11.131 2.861 13.815 533 HH12 ARG 66 2HH1 ARG 66 12.710 2.518 14.307 534 HH21 ARG 66 1HH2 ARG 66 13.729 5.886 14.773 535 HH22 ARG 66 2HH2 ARG 66 14.225 4.276 14.845 536 H HIS 67 H HIS 67 5.685 6.962 9.789 537 HA HIS 67 HA HIS 67 7.575 8.524 8.219 538 HB2 HIS 67 2HB HIS 67 6.663 5.767 7.285 539 HB3 HIS 67 1HB HIS 67 7.673 6.879 6.384 540 HD1 HIS 67 1HD HIS 67 10.220 7.137 7.366 541 HD2 HIS 67 2HD HIS 67 7.942 4.000 8.897 542 HE1 HIS 67 1HE HIS 67 11.855 5.501 8.346 543 HE2 HIS 67 2HE HIS 67 10.455 3.792 9.490 544 H GLU 68 H GLU 68 6.430 9.234 6.143 545 HA GLU 68 HA GLU 68 3.624 9.472 6.751 546 HB2 GLU 68 2HB GLU 68 5.161 10.647 4.434 547 HB3 GLU 68 1HB GLU 68 3.487 10.998 4.825 548 HG2 GLU 68 2HG GLU 68 5.918 11.682 6.444 549 HG3 GLU 68 1HG GLU 68 4.844 12.786 5.600 550 H ARG 69 H ARG 69 1.969 9.236 4.953 551 HA ARG 69 HA ARG 69 2.043 6.454 4.374 552 HB2 ARG 69 2HB ARG 69 -0.087 8.504 3.614 553 HB3 ARG 69 1HB ARG 69 -0.169 6.815 3.219 554 HG2 ARG 69 2HG ARG 69 -1.600 7.170 5.056 555 HG3 ARG 69 1HG ARG 69 -0.193 6.344 5.698 556 HD2 ARG 69 2HD ARG 69 -0.595 9.336 5.859 557 HD3 ARG 69 1HD ARG 69 -1.182 8.229 7.086 558 HE ARG 69 HE ARG 69 1.501 7.710 6.799 559 HH11 ARG 69 1HH1 ARG 69 -0.496 10.500 7.701 560 HH12 ARG 69 2HH1 ARG 69 0.654 11.197 8.715 561 HH21 ARG 69 1HH2 ARG 69 3.118 8.696 8.293 562 HH22 ARG 69 2HH2 ARG 69 2.748 10.200 8.980 563 H ASP 70 H ASP 70 2.367 9.332 2.407 564 HA ASP 70 HA ASP 70 2.116 8.107 -0.113 565 HB2 ASP 70 2HB ASP 70 1.932 10.520 0.170 566 HB3 ASP 70 1HB ASP 70 3.618 10.611 0.660 567 H GLU 71 H GLU 71 5.113 9.094 1.529 568 HA GLU 71 HA GLU 71 6.785 7.807 -0.263 569 HB2 GLU 71 2HB GLU 71 8.459 7.795 1.816 570 HB3 GLU 71 1HB GLU 71 8.086 9.251 0.918 571 HG2 GLU 71 2HG GLU 71 6.560 8.513 3.387 572 HG3 GLU 71 1HG GLU 71 8.125 9.318 3.487 573 H ILE 72 H ILE 72 5.248 6.402 2.552 574 HA ILE 72 HA ILE 72 6.658 3.926 2.433 575 HB ILE 72 HB ILE 72 3.818 4.454 3.396 576 HG12 ILE 72 2HG1 ILE 72 6.377 4.076 4.981 577 HG13 ILE 72 1HG1 ILE 72 5.547 5.609 4.727 578 HG21 ILE 72 1HG2 ILE 72 4.057 2.108 2.787 579 HG22 ILE 72 2HG2 ILE 72 3.936 2.278 4.539 580 HG23 ILE 72 3HG2 ILE 72 5.503 1.975 3.786 581 HD11 ILE 72 1HD1 ILE 72 4.431 3.228 6.203 582 HD12 ILE 72 2HD1 ILE 72 3.611 4.766 5.966 583 HD13 ILE 72 3HD1 ILE 72 5.068 4.688 6.952 584 H MET 73 H MET 73 3.688 5.093 0.955 585 HA MET 73 HA MET 73 2.937 2.684 -0.270 586 HB2 MET 73 2HB MET 73 1.624 4.931 0.214 587 HB3 MET 73 1HB MET 73 2.209 5.362 -1.373 588 HG2 MET 73 2HG MET 73 0.540 2.936 -0.767 589 HG3 MET 73 1HG MET 73 -0.073 4.458 -1.395 590 HE1 MET 73 1HE MET 73 -0.408 1.923 -4.334 591 HE2 MET 73 2HE MET 73 -1.260 3.046 -3.271 592 HE3 MET 73 3HE MET 73 -0.539 1.570 -2.613 593 H GLU 74 H GLU 74 4.913 5.431 -1.359 594 HA GLU 74 HA GLU 74 5.291 4.724 -4.039 595 HB2 GLU 74 2HB GLU 74 7.351 5.855 -2.168 596 HB3 GLU 74 1HB GLU 74 7.520 5.703 -3.899 597 HG2 GLU 74 2HG GLU 74 5.615 7.262 -4.143 598 HG3 GLU 74 1HG GLU 74 5.664 7.494 -2.384 599 H GLU 75 H GLU 75 6.946 3.624 -1.140 600 HA GLU 75 HA GLU 75 8.899 2.177 -2.595 601 HB2 GLU 75 2HB GLU 75 9.093 3.095 -0.216 602 HB3 GLU 75 1HB GLU 75 8.160 1.680 0.274 603 HG2 GLU 75 2HG GLU 75 10.593 1.372 0.530 604 HG3 GLU 75 1HG GLU 75 9.866 0.207 -0.587 605 H LEU 76 H LEU 76 5.796 1.403 -1.184 606 HA LEU 76 HA LEU 76 5.849 -1.393 -1.525 607 HB2 LEU 76 2HB LEU 76 3.469 0.451 -1.849 608 HB3 LEU 76 1HB LEU 76 3.402 -1.270 -1.560 609 HG LEU 76 HG LEU 76 4.346 0.836 0.385 610 HD11 LEU 76 1HD1 LEU 76 2.366 0.206 1.650 611 HD12 LEU 76 2HD1 LEU 76 1.901 -0.917 0.374 612 HD13 LEU 76 3HD1 LEU 76 1.937 0.816 0.052 613 HD21 LEU 76 1HD2 LEU 76 4.092 -2.148 0.744 614 HD22 LEU 76 2HD2 LEU 76 4.466 -0.989 2.014 615 HD23 LEU 76 3HD2 LEU 76 5.597 -1.237 0.689 616 H THR 77 H THR 77 4.779 1.257 -3.648 617 HA THR 77 HA THR 77 4.035 -0.307 -5.830 618 HB THR 77 HB THR 77 5.030 2.558 -5.811 619 HG1 THR 77 1HG THR 77 3.246 2.465 -4.430 620 HG21 THR 77 1HG2 THR 77 4.882 1.575 -8.073 621 HG22 THR 77 2HG2 THR 77 3.642 2.805 -7.829 622 HG23 THR 77 3HG2 THR 77 3.216 1.092 -7.746 623 H LYS 78 H LYS 78 7.167 1.300 -5.090 624 HA LYS 78 HA LYS 78 8.343 0.640 -7.572 625 HB2 LYS 78 2HB LYS 78 9.775 1.241 -4.994 626 HB3 LYS 78 1HB LYS 78 10.553 1.100 -6.558 627 HG2 LYS 78 2HG LYS 78 8.996 2.985 -7.265 628 HG3 LYS 78 1HG LYS 78 8.719 3.246 -5.546 629 HD2 LYS 78 2HD LYS 78 11.373 3.336 -6.999 630 HD3 LYS 78 1HD LYS 78 10.525 4.697 -6.276 631 HE2 LYS 78 2HE LYS 78 11.668 2.331 -4.776 632 HE3 LYS 78 1HE LYS 78 12.432 3.903 -4.927 633 HZ1 LYS 78 1HZ LYS 78 11.251 3.543 -2.825 634 HZ2 LYS 78 2HZ LYS 78 9.808 3.405 -3.668 635 HZ3 LYS 78 3HZ LYS 78 10.633 4.886 -3.691 636 H TYR 79 H TYR 79 8.558 -0.941 -4.441 637 HA TYR 79 HA TYR 79 10.537 -2.769 -5.250 638 HB2 TYR 79 2HB TYR 79 9.864 -2.085 -2.897 639 HB3 TYR 79 1HB TYR 79 8.532 -3.218 -3.076 640 HD1 TYR 79 1HD TYR 79 12.168 -2.940 -3.216 641 HD2 TYR 79 2HD TYR 79 8.867 -5.495 -2.594 642 HE1 TYR 79 1HE TYR 79 13.709 -4.698 -2.446 643 HE2 TYR 79 2HE TYR 79 10.394 -7.294 -1.819 644 HH TYR 79 HH TYR 79 12.810 -7.909 -2.093 645 H TYR 80 H TYR 80 7.055 -2.826 -5.368 646 HA TYR 80 HA TYR 80 6.647 -5.524 -6.033 647 HB2 TYR 80 2HB TYR 80 4.831 -3.993 -5.367 648 HB3 TYR 80 1HB TYR 80 5.086 -3.053 -6.825 649 HD1 TYR 80 1HD TYR 80 3.942 -6.316 -5.548 650 HD2 TYR 80 2HD TYR 80 4.043 -3.677 -8.870 651 HE1 TYR 80 1HE TYR 80 2.277 -7.712 -6.694 652 HE2 TYR 80 2HE TYR 80 2.373 -5.054 -10.025 653 HH TYR 80 HH TYR 80 0.594 -7.474 -8.433 654 H LEU 81 H LEU 81 7.125 -2.639 -8.027 655 HA LEU 81 HA LEU 81 7.073 -4.057 -10.483 656 HB2 LEU 81 2HB LEU 81 8.000 -1.298 -9.803 657 HB3 LEU 81 1HB LEU 81 7.929 -1.910 -11.448 658 HG LEU 81 HG LEU 81 5.579 -1.518 -9.584 659 HD11 LEU 81 1HD1 LEU 81 4.936 0.251 -11.140 660 HD12 LEU 81 2HD1 LEU 81 6.418 -0.014 -12.059 661 HD13 LEU 81 3HD1 LEU 81 6.502 0.581 -10.401 662 HD21 LEU 81 1HD2 LEU 81 4.213 -2.047 -11.555 663 HD22 LEU 81 2HD2 LEU 81 5.205 -3.418 -11.076 664 HD23 LEU 81 3HD2 LEU 81 5.671 -2.429 -12.464 665 H ALA 82 H ALA 82 9.648 -3.199 -8.243 666 HA ALA 82 HA ALA 82 11.792 -3.601 -10.005 667 HB1 ALA 82 1HB ALA 82 12.031 -2.525 -7.828 668 HB2 ALA 82 2HB ALA 82 13.151 -3.877 -8.013 669 HB3 ALA 82 3HB ALA 82 11.698 -4.066 -7.025 670 H ASN 83 H ASN 83 10.006 -5.751 -7.931 671 HA ASN 83 HA ASN 83 11.529 -8.081 -8.662 672 HB2 ASN 83 2HB ASN 83 9.016 -7.675 -7.103 673 HB3 ASN 83 1HB ASN 83 9.591 -9.301 -7.490 674 HD21 ASN 83 1HD2 ASN 83 10.190 -6.368 -5.671 675 HD22 ASN 83 2HD2 ASN 83 11.392 -7.059 -4.644 676 H HIS 84 H HIS 84 9.366 -6.307 -10.287 677 HA HIS 84 HA HIS 84 8.336 -8.572 -11.788 678 HB2 HIS 84 2HB HIS 84 6.655 -6.895 -11.130 679 HB3 HIS 84 1HB HIS 84 7.602 -5.626 -11.886 680 HD1 HIS 84 1HD HIS 84 5.833 -8.830 -12.985 681 HD2 HIS 84 2HD HIS 84 6.752 -5.027 -14.362 682 HE1 HIS 84 1HE HIS 84 4.741 -8.640 -15.244 683 HE2 HIS 84 2HE HIS 84 5.686 -6.456 -16.154 684 H GLY 85 H GLY 85 11.018 -6.795 -11.701 685 HA2 GLY 85 2HA GLY 85 12.746 -7.240 -13.289 686 HA3 GLY 85 1HA GLY 85 11.524 -7.275 -14.545 687 H ILE 86 H ILE 86 10.834 -4.619 -12.616 688 HA ILE 86 HA ILE 86 12.203 -2.922 -14.560 689 HB ILE 86 HB ILE 86 9.949 -2.290 -12.635 690 HG12 ILE 86 2HG1 ILE 86 9.165 -3.691 -14.499 691 HG13 ILE 86 1HG1 ILE 86 8.532 -2.072 -14.620 692 HG21 ILE 86 1HG2 ILE 86 9.770 -0.135 -13.786 693 HG22 ILE 86 2HG2 ILE 86 11.202 -0.537 -14.735 694 HG23 ILE 86 3HG2 ILE 86 11.330 -0.340 -12.985 695 HD11 ILE 86 1HD1 ILE 86 10.187 -1.535 -16.333 696 HD12 ILE 86 2HD1 ILE 86 9.197 -2.914 -16.795 697 HD13 ILE 86 3HD1 ILE 86 10.841 -3.169 -16.208 698 H ASP 87 H ASP 87 14.118 -2.106 -13.865 699 HA ASP 87 HA ASP 87 14.447 -1.608 -11.017 700 HB2 ASP 87 2HB ASP 87 16.398 -2.539 -12.278 701 HB3 ASP 87 1HB ASP 87 16.391 -1.109 -13.309 702 H ILE 88 H ILE 88 13.946 0.256 -10.197 703 HA ILE 88 HA ILE 88 12.846 2.172 -12.055 704 HB ILE 88 HB ILE 88 12.413 1.812 -9.088 705 HG12 ILE 88 2HG1 ILE 88 10.675 1.293 -11.496 706 HG13 ILE 88 1HG1 ILE 88 11.521 0.071 -10.557 707 HG21 ILE 88 1HG2 ILE 88 10.600 3.453 -9.277 708 HG22 ILE 88 2HG2 ILE 88 11.030 3.753 -10.963 709 HG23 ILE 88 3HG2 ILE 88 12.148 4.197 -9.676 710 HD11 ILE 88 1HD1 ILE 88 9.435 1.905 -9.495 711 HD12 ILE 88 2HD1 ILE 88 10.159 0.542 -8.663 712 HD13 ILE 88 3HD1 ILE 88 9.113 0.268 -10.075 713 H LYS 89 H LYS 89 13.202 4.228 -12.127 714 HA LYS 89 HA LYS 89 15.804 5.245 -11.761 715 HB2 LYS 89 2HB LYS 89 14.065 5.841 -13.515 716 HB3 LYS 89 1HB LYS 89 13.221 6.739 -12.283 717 HG2 LYS 89 2HG LYS 89 16.006 7.360 -13.271 718 HG3 LYS 89 1HG LYS 89 14.534 8.121 -13.851 719 HD2 LYS 89 2HD LYS 89 14.135 9.013 -11.607 720 HD3 LYS 89 1HD LYS 89 15.606 8.243 -11.029 721 HE2 LYS 89 2HE LYS 89 15.406 10.401 -13.140 722 HE3 LYS 89 1HE LYS 89 16.013 10.578 -11.496 723 HZ1 LYS 89 1HZ LYS 89 17.807 9.008 -12.073 724 HZ2 LYS 89 2HZ LYS 89 17.837 10.408 -13.012 725 HZ3 LYS 89 3HZ LYS 89 17.253 8.982 -13.671 726 H1 MET 1 H MET 1 -33.542 10.064 -11.944 727 HA MET 1 HA MET 1 -31.354 8.930 -13.478 728 HB2 MET 1 2HB MET 1 -31.106 10.274 -10.773 729 HB3 MET 1 1HB MET 1 -29.840 9.335 -11.537 730 HG2 MET 1 2HG MET 1 -29.319 11.645 -11.817 731 HG3 MET 1 1HG MET 1 -29.812 11.016 -13.380 732 HE1 MET 1 1HE MET 1 -29.563 14.121 -12.701 733 HE2 MET 1 2HE MET 1 -31.018 14.753 -13.471 734 HE3 MET 1 3HE MET 1 -30.062 13.512 -14.279 735 H GLY 2 H GLY 2 -30.254 7.213 -11.967 736 HA2 GLY 2 2HA GLY 2 -32.135 6.024 -10.136 737 HA3 GLY 2 1HA GLY 2 -31.754 5.091 -11.581 738 H PHE 3 H PHE 3 -31.150 4.872 -8.618 739 HA PHE 3 HA PHE 3 -28.355 4.239 -9.031 740 HB2 PHE 3 2HB PHE 3 -27.882 4.959 -6.661 741 HB3 PHE 3 1HB PHE 3 -28.287 6.271 -7.750 742 HD1 PHE 3 1HD PHE 3 -30.592 7.286 -7.611 743 HD2 PHE 3 2HD PHE 3 -29.130 4.552 -4.715 744 HE1 PHE 3 1HE PHE 3 -32.309 8.054 -6.027 745 HE2 PHE 3 2HE PHE 3 -30.849 5.310 -3.129 746 HZ PHE 3 HZ PHE 3 -32.433 7.054 -3.781 747 H THR 4 H THR 4 -28.131 2.145 -8.927 748 HA THR 4 HA THR 4 -29.971 0.581 -7.343 749 HB THR 4 HB THR 4 -28.780 -1.349 -8.437 750 HG1 THR 4 1HG THR 4 -26.862 0.090 -8.773 751 HG21 THR 4 1HG2 THR 4 -29.838 0.762 -10.334 752 HG22 THR 4 2HG2 THR 4 -30.819 -0.415 -9.460 753 HG23 THR 4 3HG2 THR 4 -29.684 -0.959 -10.696 754 H ASP 5 H ASP 5 -29.428 0.392 -5.249 755 HA ASP 5 HA ASP 5 -26.637 0.610 -4.548 756 HB2 ASP 5 2HB ASP 5 -29.067 0.510 -2.759 757 HB3 ASP 5 1HB ASP 5 -27.409 0.622 -2.179 758 H GLU 6 H GLU 6 -25.754 -1.200 -5.184 759 HA GLU 6 HA GLU 6 -26.907 -3.719 -4.420 760 HB2 GLU 6 2HB GLU 6 -25.790 -3.416 -6.628 761 HB3 GLU 6 1HB GLU 6 -24.277 -3.159 -5.782 762 HG2 GLU 6 2HG GLU 6 -24.440 -5.442 -6.617 763 HG3 GLU 6 1HG GLU 6 -24.372 -5.403 -4.855 764 H THR 7 H THR 7 -26.726 -4.156 -2.355 765 HA THR 7 HA THR 7 -24.140 -3.728 -1.167 766 HB THR 7 HB THR 7 -25.829 -2.752 0.210 767 HG1 THR 7 1HG THR 7 -24.383 -3.660 1.523 768 HG21 THR 7 1HG2 THR 7 -27.811 -3.926 -0.612 769 HG22 THR 7 2HG2 THR 7 -27.742 -4.011 1.148 770 HG23 THR 7 3HG2 THR 7 -27.281 -5.410 0.183 771 H VAL 8 H VAL 8 -23.031 -5.303 -2.074 772 HA VAL 8 HA VAL 8 -23.892 -8.014 -1.466 773 HB VAL 8 HB VAL 8 -23.677 -7.583 -3.879 774 HG11 VAL 8 1HG1 VAL 8 -21.513 -7.125 -4.931 775 HG12 VAL 8 2HG1 VAL 8 -20.804 -6.880 -3.333 776 HG13 VAL 8 3HG1 VAL 8 -22.074 -5.801 -3.912 777 HG21 VAL 8 1HG2 VAL 8 -21.545 -9.364 -2.772 778 HG22 VAL 8 2HG2 VAL 8 -22.100 -9.396 -4.448 779 HG23 VAL 8 3HG2 VAL 8 -23.215 -9.797 -3.140 780 H ARG 9 H ARG 9 -22.749 -9.117 -0.014 781 HA ARG 9 HA ARG 9 -20.102 -8.046 0.668 782 HB2 ARG 9 2HB ARG 9 -22.088 -9.224 2.627 783 HB3 ARG 9 1HB ARG 9 -20.472 -8.687 3.012 784 HG2 ARG 9 2HG ARG 9 -21.889 -6.989 3.795 785 HG3 ARG 9 1HG ARG 9 -21.241 -6.361 2.286 786 HD2 ARG 9 2HD ARG 9 -23.639 -5.893 2.461 787 HD3 ARG 9 1HD ARG 9 -23.322 -7.019 1.140 788 HE ARG 9 HE ARG 9 -23.854 -8.694 3.136 789 HH11 ARG 9 1HH1 ARG 9 -25.647 -5.800 2.117 790 HH12 ARG 9 2HH1 ARG 9 -27.144 -6.432 2.624 791 HH21 ARG 9 1HH2 ARG 9 -25.895 -9.509 3.775 792 HH22 ARG 9 2HH2 ARG 9 -27.307 -8.563 3.598 793 H PHE 10 H PHE 10 -18.593 -9.488 0.155 794 HA PHE 10 HA PHE 10 -18.839 -12.101 1.195 795 HB2 PHE 10 2HB PHE 10 -18.480 -13.373 -0.886 796 HB3 PHE 10 1HB PHE 10 -19.993 -12.494 -0.928 797 HD1 PHE 10 1HD PHE 10 -20.005 -10.310 -2.234 798 HD2 PHE 10 2HD PHE 10 -16.950 -13.218 -2.610 799 HE1 PHE 10 1HE PHE 10 -19.408 -9.383 -4.447 800 HE2 PHE 10 2HE PHE 10 -16.331 -12.311 -4.806 801 HZ PHE 10 HZ PHE 10 -17.562 -10.389 -5.729 802 H ASP 11 H ASP 11 -17.093 -12.298 2.203 803 HA ASP 11 HA ASP 11 -14.623 -11.198 1.125 804 HB2 ASP 11 2HB ASP 11 -13.650 -11.674 3.345 805 HB3 ASP 11 1HB ASP 11 -15.101 -10.701 3.496 806 H PHE 12 H PHE 12 -13.087 -12.479 0.277 807 HA PHE 12 HA PHE 12 -13.118 -15.305 0.741 808 HB2 PHE 12 2HB PHE 12 -14.936 -14.971 -0.968 809 HB3 PHE 12 1HB PHE 12 -13.770 -14.187 -2.016 810 HD1 PHE 12 1HD PHE 12 -14.568 -17.408 -0.354 811 HD2 PHE 12 2HD PHE 12 -12.496 -15.470 -3.524 812 HE1 PHE 12 1HE PHE 12 -14.048 -19.597 -1.350 813 HE2 PHE 12 2HE PHE 12 -11.971 -17.655 -4.523 814 HZ PHE 12 HZ PHE 12 -12.750 -19.722 -3.432 815 H ASP 13 H ASP 13 -11.372 -16.263 -0.669 816 HA ASP 13 HA ASP 13 -8.875 -15.139 -0.376 817 HB2 ASP 13 2HB ASP 13 -9.435 -17.508 -0.907 818 HB3 ASP 13 1HB ASP 13 -9.879 -17.026 -2.532 819 H ASP 14 H ASP 14 -7.975 -13.338 -1.320 820 HA ASP 14 HA ASP 14 -9.618 -11.971 -3.219 821 HB2 ASP 14 2HB ASP 14 -8.283 -9.972 -2.901 822 HB3 ASP 14 1HB ASP 14 -8.674 -10.694 -1.354 823 H ASN 15 H ASN 15 -8.385 -10.432 -4.703 824 HA ASN 15 HA ASN 15 -8.182 -11.692 -7.105 825 HB2 ASN 15 2HB ASN 15 -8.686 -9.323 -6.723 826 HB3 ASN 15 1HB ASN 15 -7.022 -9.025 -6.281 827 HD21 ASN 15 1HD2 ASN 15 -8.782 -7.903 -8.291 828 HD22 ASN 15 2HD2 ASN 15 -7.978 -8.043 -9.811 829 H ARG 16 H ARG 16 -5.264 -9.965 -5.983 830 HA ARG 16 HA ARG 16 -3.016 -10.370 -6.212 831 HB2 ARG 16 2HB ARG 16 -3.874 -13.221 -5.786 832 HB3 ARG 16 1HB ARG 16 -2.232 -12.628 -5.632 833 HG2 ARG 16 2HG ARG 16 -2.923 -11.233 -3.749 834 HG3 ARG 16 1HG ARG 16 -4.577 -11.835 -3.920 835 HD2 ARG 16 2HD ARG 16 -2.113 -13.417 -3.202 836 HD3 ARG 16 1HD ARG 16 -3.536 -13.125 -2.195 837 HE ARG 16 HE ARG 16 -3.589 -14.663 -4.686 838 HH11 ARG 16 1HH1 ARG 16 -4.538 -14.414 -1.228 839 HH12 ARG 16 2HH1 ARG 16 -5.634 -15.712 -1.398 840 HH21 ARG 16 1HH2 ARG 16 -5.035 -16.421 -4.756 841 HH22 ARG 16 2HH2 ARG 16 -5.936 -16.843 -3.365 842 H LYS 17 H LYS 17 -4.745 -10.692 -8.724 843 HA LYS 17 HA LYS 17 -3.328 -12.669 -10.254 844 HB2 LYS 17 2HB LYS 17 -5.718 -12.181 -10.670 845 HB3 LYS 17 1HB LYS 17 -5.286 -10.551 -11.148 846 HG2 LYS 17 2HG LYS 17 -4.043 -11.436 -13.066 847 HG3 LYS 17 1HG LYS 17 -4.467 -13.078 -12.572 848 HD2 LYS 17 2HD LYS 17 -6.844 -12.541 -12.839 849 HD3 LYS 17 1HD LYS 17 -6.419 -10.905 -13.339 850 HE2 LYS 17 2HE LYS 17 -5.223 -11.819 -15.280 851 HE3 LYS 17 1HE LYS 17 -5.638 -13.449 -14.763 852 HZ1 LYS 17 1HZ LYS 17 -7.584 -11.347 -15.576 853 HZ2 LYS 17 2HZ LYS 17 -7.978 -12.894 -15.051 854 HZ3 LYS 17 3HZ LYS 17 -7.146 -12.693 -16.484 855 H LYS 18 H LYS 18 -1.648 -12.348 -11.637 856 HA LYS 18 HA LYS 18 -0.121 -9.952 -11.326 857 HB2 LYS 18 2HB LYS 18 0.384 -12.392 -13.042 858 HB3 LYS 18 1HB LYS 18 1.529 -11.075 -12.822 859 HG2 LYS 18 2HG LYS 18 0.467 -12.837 -10.615 860 HG3 LYS 18 1HG LYS 18 2.042 -13.006 -11.387 861 HD2 LYS 18 2HD LYS 18 2.702 -10.798 -10.573 862 HD3 LYS 18 1HD LYS 18 1.102 -10.547 -9.888 863 HE2 LYS 18 2HE LYS 18 2.705 -11.175 -8.163 864 HE3 LYS 18 1HE LYS 18 1.449 -12.394 -8.358 865 HZ1 LYS 18 1HZ LYS 18 2.977 -13.764 -9.583 866 HZ2 LYS 18 2HZ LYS 18 3.656 -13.368 -8.113 867 HZ3 LYS 18 3HZ LYS 18 4.192 -12.614 -9.519 868 H ALA 19 H ALA 19 -2.684 -10.163 -12.958 869 HA ALA 19 HA ALA 19 -2.045 -8.912 -15.458 870 HB1 ALA 19 1HB ALA 19 -4.407 -8.256 -15.405 871 HB2 ALA 19 2HB ALA 19 -4.445 -8.836 -13.739 872 HB3 ALA 19 3HB ALA 19 -4.174 -9.998 -15.065 873 H ILE 20 H ILE 20 -2.534 -8.024 -12.151 874 HA ILE 20 HA ILE 20 -2.871 -5.250 -12.420 875 HB ILE 20 HB ILE 20 -1.746 -6.910 -10.142 876 HG12 ILE 20 2HG1 ILE 20 -4.512 -5.751 -10.569 877 HG13 ILE 20 1HG1 ILE 20 -4.069 -7.442 -10.765 878 HG21 ILE 20 1HG2 ILE 20 -0.986 -4.625 -9.907 879 HG22 ILE 20 2HG2 ILE 20 -2.221 -4.970 -8.696 880 HG23 ILE 20 3HG2 ILE 20 -2.626 -4.026 -10.133 881 HD11 ILE 20 1HD1 ILE 20 -5.208 -7.065 -8.659 882 HD12 ILE 20 2HD1 ILE 20 -3.992 -5.871 -8.197 883 HD13 ILE 20 3HD1 ILE 20 -3.541 -7.568 -8.380 884 H SER 21 H SER 21 -0.107 -7.356 -12.236 885 HA SER 21 HA SER 21 1.742 -5.157 -12.005 886 HB2 SER 21 2HB SER 21 3.520 -6.916 -12.326 887 HB3 SER 21 1HB SER 21 2.433 -7.222 -10.973 888 HG SER 21 HG SER 21 2.778 -9.055 -12.225 889 H GLU 22 H GLU 22 0.567 -7.220 -14.529 890 HA GLU 22 HA GLU 22 2.078 -6.321 -16.710 891 HB2 GLU 22 2HB GLU 22 0.466 -8.213 -16.766 892 HB3 GLU 22 1HB GLU 22 -0.858 -7.077 -16.585 893 HG2 GLU 22 2HG GLU 22 -0.722 -7.770 -18.869 894 HG3 GLU 22 1HG GLU 22 -0.243 -6.079 -18.757 895 H THR 23 H THR 23 -0.889 -5.114 -15.241 896 HA THR 23 HA THR 23 -1.350 -2.918 -16.921 897 HB THR 23 HB THR 23 -2.131 -3.336 -14.027 898 HG1 THR 23 1HG THR 23 -2.943 -4.920 -15.464 899 HG21 THR 23 1HG2 THR 23 -3.931 -1.687 -14.487 900 HG22 THR 23 2HG2 THR 23 -3.228 -1.399 -16.078 901 HG23 THR 23 3HG2 THR 23 -2.323 -0.974 -14.631 902 H LEU 24 H LEU 24 0.222 -3.073 -13.697 903 HA LEU 24 HA LEU 24 0.810 -0.338 -13.602 904 HB2 LEU 24 2HB LEU 24 2.148 -2.597 -12.106 905 HB3 LEU 24 1HB LEU 24 2.371 -0.892 -11.768 906 HG LEU 24 HG LEU 24 -0.193 -2.449 -11.480 907 HD11 LEU 24 1HD1 LEU 24 1.433 -2.992 -9.781 908 HD12 LEU 24 2HD1 LEU 24 0.116 -2.041 -9.095 909 HD13 LEU 24 3HD1 LEU 24 1.668 -1.280 -9.430 910 HD21 LEU 24 1HD2 LEU 24 -0.668 -0.147 -12.138 911 HD22 LEU 24 2HD2 LEU 24 0.399 0.452 -10.867 912 HD23 LEU 24 3HD2 LEU 24 -1.085 -0.403 -10.450 913 H GLU 25 H GLU 25 2.673 -3.005 -14.951 914 HA GLU 25 HA GLU 25 5.096 -1.627 -15.382 915 HB2 GLU 25 2HB GLU 25 4.762 -4.073 -15.719 916 HB3 GLU 25 1HB GLU 25 3.802 -3.709 -17.146 917 HG2 GLU 25 2HG GLU 25 5.806 -2.517 -18.060 918 HG3 GLU 25 1HG GLU 25 6.723 -3.197 -16.715 919 H THR 26 H THR 26 2.210 -2.038 -17.322 920 HA THR 26 HA THR 26 3.013 -0.620 -19.588 921 HB THR 26 HB THR 26 0.194 -1.119 -18.539 922 HG1 THR 26 1HG THR 26 1.146 -3.077 -18.805 923 HG21 THR 26 1HG2 THR 26 0.411 0.596 -20.307 924 HG22 THR 26 2HG2 THR 26 -0.483 -0.835 -20.851 925 HG23 THR 26 3HG2 THR 26 1.202 -0.580 -21.340 926 H VAL 27 H VAL 27 1.226 0.360 -16.697 927 HA VAL 27 HA VAL 27 0.782 3.038 -17.485 928 HB VAL 27 HB VAL 27 0.944 1.895 -14.667 929 HG11 VAL 27 1HG1 VAL 27 1.156 4.320 -14.695 930 HG12 VAL 27 2HG1 VAL 27 -0.402 3.832 -14.023 931 HG13 VAL 27 3HG1 VAL 27 -0.301 4.440 -15.678 932 HG21 VAL 27 1HG2 VAL 27 -1.472 2.357 -16.418 933 HG22 VAL 27 2HG2 VAL 27 -1.486 1.766 -14.756 934 HG23 VAL 27 3HG2 VAL 27 -0.765 0.787 -16.032 935 H TYR 28 H TYR 28 3.371 1.420 -15.744 936 HA TYR 28 HA TYR 28 4.823 3.559 -14.772 937 HB2 TYR 28 2HB TYR 28 5.376 1.238 -14.183 938 HB3 TYR 28 1HB TYR 28 5.876 0.911 -15.833 939 HD1 TYR 28 1HD TYR 28 8.043 1.691 -16.647 940 HD2 TYR 28 2HD TYR 28 6.802 2.518 -12.670 941 HE1 TYR 28 1HE TYR 28 10.338 2.375 -16.085 942 HE2 TYR 28 2HE TYR 28 9.097 3.199 -12.087 943 HH TYR 28 HH TYR 28 11.434 3.838 -14.420 944 H ARG 29 H ARG 29 5.215 1.940 -17.909 945 HA ARG 29 HA ARG 29 7.215 3.770 -18.759 946 HB2 ARG 29 2HB ARG 29 5.568 1.884 -20.435 947 HB3 ARG 29 1HB ARG 29 6.959 2.787 -21.012 948 HG2 ARG 29 2HG ARG 29 8.325 1.605 -19.270 949 HG3 ARG 29 1HG ARG 29 6.914 0.587 -18.964 950 HD2 ARG 29 2HD ARG 29 6.899 -0.081 -21.318 951 HD3 ARG 29 1HD ARG 29 8.322 0.911 -21.610 952 HE ARG 29 HE ARG 29 8.175 -1.616 -20.190 953 HH11 ARG 29 1HH1 ARG 29 10.209 1.146 -21.145 954 HH12 ARG 29 2HH1 ARG 29 11.671 0.266 -21.037 955 HH21 ARG 29 1HH2 ARG 29 10.226 -2.788 -20.068 956 HH22 ARG 29 2HH2 ARG 29 11.684 -1.970 -20.421 957 H ALA 30 H ALA 30 3.751 3.626 -19.237 958 HA ALA 30 HA ALA 30 3.525 5.600 -21.213 959 HB1 ALA 30 1HB ALA 30 1.561 4.991 -19.000 960 HB2 ALA 30 2HB ALA 30 1.658 4.143 -20.544 961 HB3 ALA 30 3HB ALA 30 1.203 5.845 -20.503 962 H LEU 31 H LEU 31 3.825 5.843 -17.753 963 HA LEU 31 HA LEU 31 3.348 8.635 -17.641 964 HB2 LEU 31 2HB LEU 31 4.579 6.753 -15.672 965 HB3 LEU 31 1HB LEU 31 4.268 8.441 -15.330 966 HG LEU 31 HG LEU 31 2.152 6.567 -16.224 967 HD11 LEU 31 1HD1 LEU 31 2.987 5.743 -14.076 968 HD12 LEU 31 2HD1 LEU 31 1.420 6.509 -13.836 969 HD13 LEU 31 3HD1 LEU 31 2.887 7.376 -13.403 970 HD21 LEU 31 1HD2 LEU 31 1.609 8.864 -16.572 971 HD22 LEU 31 2HD2 LEU 31 2.056 9.254 -14.909 972 HD23 LEU 31 3HD2 LEU 31 0.651 8.244 -15.228 973 H GLU 32 H GLU 32 6.346 6.700 -17.613 974 HA GLU 32 HA GLU 32 7.782 9.114 -17.349 975 HB2 GLU 32 2HB GLU 32 9.865 7.771 -17.660 976 HB3 GLU 32 1HB GLU 32 8.879 7.338 -16.267 977 HG2 GLU 32 2HG GLU 32 9.635 5.306 -17.101 978 HG3 GLU 32 1HG GLU 32 8.033 5.448 -17.812 979 H GLU 33 H GLU 33 7.024 7.187 -20.080 980 HA GLU 33 HA GLU 33 8.445 8.693 -21.987 981 HB2 GLU 33 2HB GLU 33 5.873 7.151 -22.196 982 HB3 GLU 33 1HB GLU 33 6.546 8.012 -23.571 983 HG2 GLU 33 2HG GLU 33 7.942 5.841 -22.024 984 HG3 GLU 33 1HG GLU 33 7.123 5.629 -23.575 985 H LYS 34 H LYS 34 5.421 9.378 -20.361 986 HA LYS 34 HA LYS 34 4.977 11.707 -22.032 987 HB2 LYS 34 2HB LYS 34 3.449 10.629 -19.686 988 HB3 LYS 34 1HB LYS 34 3.022 12.132 -20.475 989 HG2 LYS 34 2HG LYS 34 3.040 9.383 -21.719 990 HG3 LYS 34 1HG LYS 34 1.618 10.310 -21.239 991 HD2 LYS 34 2HD LYS 34 3.614 11.076 -23.361 992 HD3 LYS 34 1HD LYS 34 1.989 10.431 -23.627 993 HE2 LYS 34 2HE LYS 34 1.005 12.387 -22.614 994 HE3 LYS 34 1HE LYS 34 2.603 13.033 -22.225 995 HZ1 LYS 34 1HZ LYS 34 3.054 13.158 -24.624 996 HZ2 LYS 34 2HZ LYS 34 1.732 14.085 -24.186 997 HZ3 LYS 34 3HZ LYS 34 1.491 12.620 -24.952 998 H GLY 35 H GLY 35 6.901 11.100 -19.449 999 HA2 GLY 35 2HA GLY 35 8.343 12.665 -18.541 1000 HA3 GLY 35 1HA GLY 35 7.288 13.946 -19.107 1001 H TYR 36 H TYR 36 5.963 11.307 -17.247 1002 HA TYR 36 HA TYR 36 5.589 13.164 -14.984 1003 HB2 TYR 36 2HB TYR 36 4.193 10.529 -15.546 1004 HB3 TYR 36 1HB TYR 36 3.851 11.633 -14.227 1005 HD1 TYR 36 1HD TYR 36 3.119 10.693 -17.581 1006 HD2 TYR 36 2HD TYR 36 2.852 13.907 -14.822 1007 HE1 TYR 36 1HE TYR 36 1.384 11.732 -18.983 1008 HE2 TYR 36 2HE TYR 36 1.095 14.952 -16.194 1009 HH TYR 36 HH TYR 36 0.342 14.925 -18.516 1010 H ASN 37 H ASN 37 5.530 11.840 -12.839 1011 HA ASN 37 HA ASN 37 7.788 9.988 -12.814 1012 HB2 ASN 37 2HB ASN 37 6.331 11.347 -10.523 1013 HB3 ASN 37 1HB ASN 37 7.593 10.148 -10.294 1014 HD21 ASN 37 1HD2 ASN 37 7.519 12.884 -9.396 1015 HD22 ASN 37 2HD2 ASN 37 8.875 13.667 -10.085 1016 HA PRO 38 HA PRO 38 4.706 6.754 -13.493 1017 HB2 PRO 38 2HB PRO 38 7.054 5.310 -12.393 1018 HB3 PRO 38 1HB PRO 38 5.998 4.875 -13.736 1019 HG2 PRO 38 2HG PRO 38 8.409 5.988 -14.116 1020 HG3 PRO 38 1HG PRO 38 7.037 6.295 -15.192 1021 HD2 PRO 38 2HD PRO 38 8.358 8.124 -13.329 1022 HD3 PRO 38 1HD PRO 38 7.202 8.434 -14.659 1023 H ILE 39 H ILE 39 6.714 6.848 -10.582 1024 HA ILE 39 HA ILE 39 4.965 5.058 -9.204 1025 HB ILE 39 HB ILE 39 7.200 6.778 -8.103 1026 HG12 ILE 39 2HG1 ILE 39 7.994 5.261 -9.818 1027 HG13 ILE 39 1HG1 ILE 39 8.539 4.708 -8.242 1028 HG21 ILE 39 1HG2 ILE 39 5.663 6.062 -6.340 1029 HG22 ILE 39 2HG2 ILE 39 7.207 5.210 -6.211 1030 HG23 ILE 39 3HG2 ILE 39 5.804 4.390 -6.892 1031 HD11 ILE 39 1HD1 ILE 39 7.805 2.848 -9.654 1032 HD12 ILE 39 2HD1 ILE 39 6.221 3.580 -9.819 1033 HD13 ILE 39 3HD1 ILE 39 6.766 3.008 -8.240 1034 H ASN 40 H ASN 40 5.539 8.497 -9.116 1035 HA ASN 40 HA ASN 40 3.831 8.982 -6.911 1036 HB2 ASN 40 2HB ASN 40 4.992 10.887 -8.935 1037 HB3 ASN 40 1HB ASN 40 4.105 11.379 -7.498 1038 HD21 ASN 40 1HD2 ASN 40 5.160 9.250 -5.835 1039 HD22 ASN 40 2HD2 ASN 40 6.780 9.608 -5.481 1040 H GLN 41 H GLN 41 3.300 9.032 -10.357 1041 HA GLN 41 HA GLN 41 0.695 10.158 -10.076 1042 HB2 GLN 41 2HB GLN 41 1.933 8.653 -12.374 1043 HB3 GLN 41 1HB GLN 41 0.382 9.475 -12.458 1044 HG2 GLN 41 2HG GLN 41 3.017 10.821 -11.859 1045 HG3 GLN 41 1HG GLN 41 2.217 10.780 -13.432 1046 HE21 GLN 41 1HE2 GLN 41 -0.451 11.132 -12.441 1047 HE22 GLN 41 2HE2 GLN 41 -0.571 12.750 -11.886 1048 H ILE 42 H ILE 42 1.968 6.868 -10.153 1049 HA ILE 42 HA ILE 42 -0.583 5.640 -10.241 1050 HB ILE 42 HB ILE 42 2.099 4.521 -9.339 1051 HG12 ILE 42 2HG1 ILE 42 0.486 4.071 -11.864 1052 HG13 ILE 42 1HG1 ILE 42 1.921 5.077 -11.735 1053 HG21 ILE 42 1HG2 ILE 42 0.313 3.297 -8.213 1054 HG22 ILE 42 2HG2 ILE 42 1.075 2.291 -9.446 1055 HG23 ILE 42 3HG2 ILE 42 -0.494 3.031 -9.756 1056 HD11 ILE 42 1HD1 ILE 42 3.255 3.089 -11.192 1057 HD12 ILE 42 2HD1 ILE 42 2.438 2.928 -12.746 1058 HD13 ILE 42 3HD1 ILE 42 1.806 2.092 -11.329 1059 H VAL 43 H VAL 43 1.648 6.280 -7.504 1060 HA VAL 43 HA VAL 43 -0.147 5.331 -5.555 1061 HB VAL 43 HB VAL 43 2.207 5.608 -4.900 1062 HG11 VAL 43 1HG1 VAL 43 2.751 7.506 -6.281 1063 HG12 VAL 43 2HG1 VAL 43 3.228 7.811 -4.607 1064 HG13 VAL 43 3HG1 VAL 43 1.775 8.569 -5.272 1065 HG21 VAL 43 1HG2 VAL 43 0.459 7.527 -3.369 1066 HG22 VAL 43 2HG2 VAL 43 1.988 6.855 -2.804 1067 HG23 VAL 43 3HG2 VAL 43 0.611 5.792 -3.095 1068 H GLY 44 H GLY 44 0.158 8.484 -7.054 1069 HA2 GLY 44 2HA GLY 44 -1.600 9.910 -5.390 1070 HA3 GLY 44 1HA GLY 44 -1.242 10.296 -7.070 1071 H TYR 45 H TYR 45 -2.112 8.007 -8.314 1072 HA TYR 45 HA TYR 45 -4.886 8.414 -8.519 1073 HB2 TYR 45 2HB TYR 45 -3.655 7.566 -10.422 1074 HB3 TYR 45 1HB TYR 45 -3.141 6.156 -9.508 1075 HD1 TYR 45 1HD TYR 45 -4.475 4.210 -9.436 1076 HD2 TYR 45 2HD TYR 45 -6.119 7.815 -10.936 1077 HE1 TYR 45 1HE TYR 45 -6.456 2.987 -10.185 1078 HE2 TYR 45 2HE TYR 45 -8.112 6.583 -11.688 1079 HH TYR 45 HH TYR 45 -8.808 3.456 -10.744 1080 H LEU 46 H LEU 46 -2.988 5.845 -7.041 1081 HA LEU 46 HA LEU 46 -5.192 4.259 -6.351 1082 HB2 LEU 46 2HB LEU 46 -2.408 4.292 -5.245 1083 HB3 LEU 46 1HB LEU 46 -3.594 3.045 -4.909 1084 HG LEU 46 HG LEU 46 -2.545 3.703 -7.663 1085 HD11 LEU 46 1HD1 LEU 46 -1.331 1.598 -7.488 1086 HD12 LEU 46 2HD1 LEU 46 -1.855 1.443 -5.805 1087 HD13 LEU 46 3HD1 LEU 46 -0.812 2.788 -6.298 1088 HD21 LEU 46 1HD2 LEU 46 -3.606 1.590 -8.298 1089 HD22 LEU 46 2HD2 LEU 46 -4.771 2.778 -7.729 1090 HD23 LEU 46 3HD2 LEU 46 -4.282 1.446 -6.674 1091 H LEU 47 H LEU 47 -3.558 6.799 -4.543 1092 HA LEU 47 HA LEU 47 -5.107 6.183 -2.190 1093 HB2 LEU 47 2HB LEU 47 -3.337 8.556 -2.763 1094 HB3 LEU 47 1HB LEU 47 -4.074 8.204 -1.217 1095 HG LEU 47 HG LEU 47 -1.933 6.595 -2.612 1096 HD11 LEU 47 1HD1 LEU 47 -1.125 8.641 -1.620 1097 HD12 LEU 47 2HD1 LEU 47 -0.552 7.247 -0.703 1098 HD13 LEU 47 3HD1 LEU 47 -1.885 8.224 -0.085 1099 HD21 LEU 47 1HD2 LEU 47 -3.449 5.098 -1.418 1100 HD22 LEU 47 2HD2 LEU 47 -3.279 6.083 0.038 1101 HD23 LEU 47 3HD2 LEU 47 -1.895 5.205 -0.592 1102 H SER 48 H SER 48 -5.449 8.317 -4.919 1103 HA SER 48 HA SER 48 -7.505 9.851 -3.507 1104 HB2 SER 48 2HB SER 48 -6.314 10.336 -6.224 1105 HB3 SER 48 1HB SER 48 -7.325 11.449 -5.304 1106 HG SER 48 HG SER 48 -4.679 10.748 -5.010 1107 H GLY 49 H GLY 49 -7.230 7.386 -5.991 1108 HA2 GLY 49 2HA GLY 49 -8.787 6.242 -7.119 1109 HA3 GLY 49 1HA GLY 49 -10.000 6.959 -6.073 1110 H ASP 50 H ASP 50 -7.839 8.808 -8.214 1111 HA ASP 50 HA ASP 50 -10.249 9.504 -9.749 1112 HB2 ASP 50 2HB ASP 50 -9.486 11.337 -8.238 1113 HB3 ASP 50 1HB ASP 50 -7.972 11.384 -9.130 1114 HA PRO 51 HA PRO 51 -7.945 7.714 -13.136 1115 HB2 PRO 51 2HB PRO 51 -9.588 8.623 -15.135 1116 HB3 PRO 51 1HB PRO 51 -9.892 7.189 -14.148 1117 HG2 PRO 51 2HG PRO 51 -11.009 9.952 -13.854 1118 HG3 PRO 51 1HG PRO 51 -11.824 8.391 -13.675 1119 HD2 PRO 51 2HD PRO 51 -11.066 9.839 -11.560 1120 HD3 PRO 51 1HD PRO 51 -10.994 8.065 -11.536 1121 H ALA 52 H ALA 52 -8.454 11.163 -12.939 1122 HA ALA 52 HA ALA 52 -7.172 11.798 -15.363 1123 HB1 ALA 52 1HB ALA 52 -7.110 14.090 -14.592 1124 HB2 ALA 52 2HB ALA 52 -7.457 13.566 -12.946 1125 HB3 ALA 52 3HB ALA 52 -8.666 13.350 -14.205 1126 H TYR 53 H TYR 53 -5.805 10.629 -12.532 1127 HA TYR 53 HA TYR 53 -3.303 11.924 -12.622 1128 HB2 TYR 53 2HB TYR 53 -4.198 9.374 -11.364 1129 HB3 TYR 53 1HB TYR 53 -2.496 9.837 -11.353 1130 HD1 TYR 53 1HD TYR 53 -1.934 12.111 -10.493 1131 HD2 TYR 53 2HD TYR 53 -5.652 10.236 -9.739 1132 HE1 TYR 53 1HE TYR 53 -2.255 13.580 -8.632 1133 HE2 TYR 53 2HE TYR 53 -6.019 11.732 -7.825 1134 HH TYR 53 HH TYR 53 -4.230 14.507 -7.361 1135 H ILE 54 H ILE 54 -4.597 9.403 -14.608 1136 HA ILE 54 HA ILE 54 -1.889 8.812 -15.547 1137 HB ILE 54 HB ILE 54 -4.380 7.081 -15.844 1138 HG12 ILE 54 2HG1 ILE 54 -3.673 7.107 -13.513 1139 HG13 ILE 54 1HG1 ILE 54 -3.257 5.564 -14.252 1140 HG21 ILE 54 1HG2 ILE 54 -2.875 5.334 -16.629 1141 HG22 ILE 54 2HG2 ILE 54 -1.516 6.447 -16.533 1142 HG23 ILE 54 3HG2 ILE 54 -2.819 6.744 -17.687 1143 HD11 ILE 54 1HD1 ILE 54 -1.488 6.344 -12.785 1144 HD12 ILE 54 2HD1 ILE 54 -1.343 7.832 -13.719 1145 HD13 ILE 54 3HD1 ILE 54 -0.934 6.286 -14.459 1146 HA PRO 55 HA PRO 55 -2.940 11.028 -19.254 1147 HB2 PRO 55 2HB PRO 55 -0.981 9.990 -20.860 1148 HB3 PRO 55 1HB PRO 55 -0.688 11.249 -19.651 1149 HG2 PRO 55 2HG PRO 55 -0.285 8.291 -19.446 1150 HG3 PRO 55 1HG PRO 55 0.806 9.600 -18.946 1151 HD2 PRO 55 2HD PRO 55 -0.705 8.326 -17.174 1152 HD3 PRO 55 1HD PRO 55 -0.444 10.075 -17.048 1153 H ARG 56 H ARG 56 -3.725 10.663 -21.364 1154 HA ARG 56 HA ARG 56 -5.023 8.050 -21.652 1155 HB2 ARG 56 2HB ARG 56 -5.610 10.698 -23.011 1156 HB3 ARG 56 1HB ARG 56 -6.461 9.211 -23.374 1157 HG2 ARG 56 2HG ARG 56 -7.833 10.544 -21.930 1158 HG3 ARG 56 1HG ARG 56 -7.252 9.163 -21.006 1159 HD2 ARG 56 2HD ARG 56 -5.511 10.589 -20.015 1160 HD3 ARG 56 1HD ARG 56 -6.122 11.956 -20.937 1161 HE ARG 56 HE ARG 56 -8.219 10.898 -19.482 1162 HH11 ARG 56 1HH1 ARG 56 -5.123 12.514 -18.893 1163 HH12 ARG 56 2HH1 ARG 56 -5.594 13.275 -17.449 1164 HH21 ARG 56 1HH2 ARG 56 -8.913 11.979 -17.428 1165 HH22 ARG 56 2HH2 ARG 56 -7.809 12.967 -16.634 1166 H TYR 57 H TYR 57 -2.261 9.106 -22.429 1167 HA TYR 57 HA TYR 57 -1.790 8.923 -25.149 1168 HB2 TYR 57 2HB TYR 57 -0.125 9.676 -23.534 1169 HB3 TYR 57 1HB TYR 57 -0.045 8.070 -22.830 1170 HD1 TYR 57 1HD TYR 57 0.428 9.786 -26.100 1171 HD2 TYR 57 2HD TYR 57 1.711 6.699 -23.483 1172 HE1 TYR 57 1HE TYR 57 2.284 9.269 -27.623 1173 HE2 TYR 57 2HE TYR 57 3.565 6.169 -25.007 1174 HH TYR 57 HH TYR 57 4.100 6.443 -27.326 1175 H GLN 58 H GLN 58 -2.286 6.362 -22.782 1176 HA GLN 58 HA GLN 58 -2.487 4.475 -24.960 1177 HB2 GLN 58 2HB GLN 58 -0.834 3.926 -22.474 1178 HB3 GLN 58 1HB GLN 58 -1.274 2.744 -23.700 1179 HG2 GLN 58 2HG GLN 58 -0.048 4.079 -25.363 1180 HG3 GLN 58 1HG GLN 58 0.477 5.148 -24.076 1181 HE21 GLN 58 1HE2 GLN 58 0.819 2.850 -22.193 1182 HE22 GLN 58 2HE2 GLN 58 2.265 2.072 -22.714 1183 H ASP 59 H ASP 59 -3.525 2.475 -24.252 1184 HA ASP 59 HA ASP 59 -5.945 2.943 -22.921 1185 HB2 ASP 59 2HB ASP 59 -6.332 0.494 -23.105 1186 HB3 ASP 59 1HB ASP 59 -5.840 1.218 -24.623 1187 H ALA 60 H ALA 60 -2.971 2.348 -21.641 1188 HA ALA 60 HA ALA 60 -3.284 0.892 -19.331 1189 HB1 ALA 60 1HB ALA 60 -1.427 2.153 -18.424 1190 HB2 ALA 60 2HB ALA 60 -1.702 3.436 -19.598 1191 HB3 ALA 60 3HB ALA 60 -1.166 1.852 -20.142 1192 H ARG 61 H ARG 61 -4.414 4.180 -19.950 1193 HA ARG 61 HA ARG 61 -5.022 4.898 -17.285 1194 HB2 ARG 61 2HB ARG 61 -4.846 6.442 -19.316 1195 HB3 ARG 61 1HB ARG 61 -6.407 5.841 -19.818 1196 HG2 ARG 61 2HG ARG 61 -5.918 7.331 -17.228 1197 HG3 ARG 61 1HG ARG 61 -6.430 8.093 -18.723 1198 HD2 ARG 61 2HD ARG 61 -7.959 5.973 -17.210 1199 HD3 ARG 61 1HD ARG 61 -8.285 7.702 -17.146 1200 HE ARG 61 HE ARG 61 -8.342 6.926 -19.815 1201 HH11 ARG 61 1HH1 ARG 61 -10.191 6.220 -16.889 1202 HH12 ARG 61 2HH1 ARG 61 -11.678 6.009 -17.691 1203 HH21 ARG 61 1HH2 ARG 61 -10.351 6.688 -20.923 1204 HH22 ARG 61 2HH2 ARG 61 -11.774 6.318 -20.072 1205 H ASN 62 H ASN 62 -6.793 3.185 -19.797 1206 HA ASN 62 HA ASN 62 -9.214 2.972 -18.264 1207 HB2 ASN 62 2HB ASN 62 -8.317 1.365 -20.677 1208 HB3 ASN 62 1HB ASN 62 -9.932 1.359 -19.991 1209 HD21 ASN 62 1HD2 ASN 62 -11.252 3.208 -20.274 1210 HD22 ASN 62 2HD2 ASN 62 -10.884 4.352 -21.511 1211 H LEU 63 H LEU 63 -6.389 1.017 -18.870 1212 HA LEU 63 HA LEU 63 -7.223 -1.385 -17.682 1213 HB2 LEU 63 2HB LEU 63 -4.445 -0.224 -17.814 1214 HB3 LEU 63 1HB LEU 63 -4.824 -1.859 -17.329 1215 HG LEU 63 HG LEU 63 -5.295 -0.709 -20.095 1216 HD11 LEU 63 1HD1 LEU 63 -2.916 -1.039 -19.572 1217 HD12 LEU 63 2HD1 LEU 63 -3.507 -2.232 -20.728 1218 HD13 LEU 63 3HD1 LEU 63 -3.276 -2.684 -19.045 1219 HD21 LEU 63 1HD2 LEU 63 -5.791 -3.014 -20.685 1220 HD22 LEU 63 2HD2 LEU 63 -6.939 -2.429 -19.473 1221 HD23 LEU 63 3HD2 LEU 63 -5.603 -3.493 -19.002 1222 H ILE 64 H ILE 64 -5.553 1.388 -16.243 1223 HA ILE 64 HA ILE 64 -5.277 0.221 -13.661 1224 HB ILE 64 HB ILE 64 -3.938 2.188 -14.665 1225 HG12 ILE 64 2HG1 ILE 64 -5.078 2.614 -11.891 1226 HG13 ILE 64 1HG1 ILE 64 -3.812 1.453 -12.265 1227 HG21 ILE 64 1HG2 ILE 64 -4.927 4.487 -14.182 1228 HG22 ILE 64 2HG2 ILE 64 -6.436 3.681 -13.791 1229 HG23 ILE 64 3HG2 ILE 64 -5.801 3.569 -15.412 1230 HD11 ILE 64 1HD1 ILE 64 -2.366 3.303 -12.987 1231 HD12 ILE 64 2HD1 ILE 64 -2.880 3.475 -11.308 1232 HD13 ILE 64 3HD1 ILE 64 -3.642 4.446 -12.567 1233 H ARG 65 H ARG 65 -7.813 1.684 -15.310 1234 HA ARG 65 HA ARG 65 -9.314 2.526 -12.988 1235 HB2 ARG 65 2HB ARG 65 -9.084 3.328 -15.624 1236 HB3 ARG 65 1HB ARG 65 -10.631 2.508 -15.593 1237 HG2 ARG 65 2HG ARG 65 -9.958 4.609 -13.581 1238 HG3 ARG 65 1HG ARG 65 -10.499 5.043 -15.187 1239 HD2 ARG 65 2HD ARG 65 -12.320 5.071 -13.621 1240 HD3 ARG 65 1HD ARG 65 -12.521 3.842 -14.880 1241 HE ARG 65 HE ARG 65 -11.679 2.297 -12.949 1242 HH11 ARG 65 1HH1 ARG 65 -13.846 5.070 -12.557 1243 HH12 ARG 65 2HH1 ARG 65 -14.726 4.394 -11.280 1244 HH21 ARG 65 1HH2 ARG 65 -12.949 1.298 -11.172 1245 HH22 ARG 65 2HH2 ARG 65 -14.191 2.207 -10.499 1246 H ARG 66 H ARG 66 -9.035 -0.068 -15.242 1247 HA ARG 66 HA ARG 66 -11.570 -1.310 -14.707 1248 HB2 ARG 66 2HB ARG 66 -10.412 -1.559 -16.872 1249 HB3 ARG 66 1HB ARG 66 -9.080 -2.359 -16.065 1250 HG2 ARG 66 2HG ARG 66 -10.492 -4.222 -15.498 1251 HG3 ARG 66 1HG ARG 66 -11.895 -3.411 -16.216 1252 HD2 ARG 66 2HD ARG 66 -10.783 -3.423 -18.379 1253 HD3 ARG 66 1HD ARG 66 -9.381 -4.216 -17.663 1254 HE ARG 66 HE ARG 66 -11.576 -5.788 -17.093 1255 HH11 ARG 66 1HH1 ARG 66 -9.926 -4.664 -20.032 1256 HH12 ARG 66 2HH1 ARG 66 -10.259 -6.081 -20.910 1257 HH21 ARG 66 1HH2 ARG 66 -12.027 -7.705 -18.315 1258 HH22 ARG 66 2HH2 ARG 66 -11.457 -7.833 -19.936 1259 H HIS 67 H HIS 67 -8.341 -1.502 -13.472 1260 HA HIS 67 HA HIS 67 -9.152 -3.650 -11.648 1261 HB2 HIS 67 2HB HIS 67 -6.396 -2.460 -12.130 1262 HB3 HIS 67 1HB HIS 67 -6.744 -3.721 -10.956 1263 HD1 HIS 67 1HD HIS 67 -7.108 -6.145 -11.898 1264 HD2 HIS 67 2HD HIS 67 -6.281 -3.289 -14.811 1265 HE1 HIS 67 1HE HIS 67 -6.533 -7.417 -13.950 1266 HE2 HIS 67 2HE HIS 67 -6.172 -5.713 -15.721 1267 H GLU 68 H GLU 68 -10.019 -2.988 -9.834 1268 HA GLU 68 HA GLU 68 -10.135 -0.294 -9.133 1269 HB2 GLU 68 2HB GLU 68 -10.838 -2.720 -7.486 1270 HB3 GLU 68 1HB GLU 68 -11.299 -1.068 -7.102 1271 HG2 GLU 68 2HG GLU 68 -12.087 -2.525 -9.615 1272 HG3 GLU 68 1HG GLU 68 -13.103 -2.359 -8.185 1273 H ARG 69 H ARG 69 -9.460 0.783 -7.184 1274 HA ARG 69 HA ARG 69 -6.662 0.664 -6.983 1275 HB2 ARG 69 2HB ARG 69 -8.620 2.246 -5.236 1276 HB3 ARG 69 1HB ARG 69 -6.889 2.305 -5.055 1277 HG2 ARG 69 2HG ARG 69 -7.608 4.261 -6.195 1278 HG3 ARG 69 1HG ARG 69 -6.763 3.260 -7.357 1279 HD2 ARG 69 2HD ARG 69 -9.768 3.306 -7.125 1280 HD3 ARG 69 1HD ARG 69 -8.884 4.440 -8.132 1281 HE ARG 69 HE ARG 69 -7.988 2.074 -9.002 1282 HH11 ARG 69 1HH1 ARG 69 -11.273 3.325 -8.489 1283 HH12 ARG 69 2HH1 ARG 69 -11.968 2.349 -9.683 1284 HH21 ARG 69 1HH2 ARG 69 -8.974 0.800 -10.742 1285 HH22 ARG 69 2HH2 ARG 69 -10.662 0.877 -10.936 1286 H ASP 70 H ASP 70 -9.174 -0.484 -4.868 1287 HA ASP 70 HA ASP 70 -7.567 -1.309 -2.705 1288 HB2 ASP 70 2HB ASP 70 -9.965 -1.130 -2.477 1289 HB3 ASP 70 1HB ASP 70 -10.205 -2.357 -3.712 1290 H GLU 71 H GLU 71 -8.672 -3.036 -5.566 1291 HA GLU 71 HA GLU 71 -7.698 -5.612 -5.144 1292 HB2 GLU 71 2HB GLU 71 -7.695 -4.049 -7.733 1293 HB3 GLU 71 1HB GLU 71 -7.598 -5.795 -7.592 1294 HG2 GLU 71 2HG GLU 71 -9.918 -4.175 -6.623 1295 HG3 GLU 71 1HG GLU 71 -9.837 -4.863 -8.248 1296 H ILE 72 H ILE 72 -6.142 -2.846 -6.655 1297 HA ILE 72 HA ILE 72 -3.671 -4.108 -7.221 1298 HB ILE 72 HB ILE 72 -4.339 -1.160 -7.029 1299 HG12 ILE 72 2HG1 ILE 72 -4.270 -3.020 -9.424 1300 HG13 ILE 72 1HG1 ILE 72 -5.708 -2.340 -8.682 1301 HG21 ILE 72 1HG2 ILE 72 -1.972 -2.526 -8.319 1302 HG22 ILE 72 2HG2 ILE 72 -1.935 -1.524 -6.869 1303 HG23 ILE 72 3HG2 ILE 72 -2.344 -0.807 -8.427 1304 HD11 ILE 72 1HD1 ILE 72 -5.002 -0.102 -9.335 1305 HD12 ILE 72 2HD1 ILE 72 -5.124 -1.169 -10.733 1306 HD13 ILE 72 3HD1 ILE 72 -3.541 -0.768 -10.064 1307 H MET 73 H MET 73 -4.730 -1.925 -4.636 1308 HA MET 73 HA MET 73 -2.138 -1.621 -3.526 1309 HB2 MET 73 2HB MET 73 -4.322 -0.165 -3.292 1310 HB3 MET 73 1HB MET 73 -4.642 -1.214 -1.928 1311 HG2 MET 73 2HG MET 73 -2.205 0.520 -2.275 1312 HG3 MET 73 1HG MET 73 -3.594 0.907 -1.278 1313 HE1 MET 73 1HE MET 73 -0.590 1.024 -0.250 1314 HE2 MET 73 2HE MET 73 -0.762 0.267 1.331 1315 HE3 MET 73 3HE MET 73 -1.984 1.403 0.756 1316 H GLU 74 H GLU 74 -4.837 -3.820 -2.847 1317 HA GLU 74 HA GLU 74 -3.867 -5.123 -0.588 1318 HB2 GLU 74 2HB GLU 74 -5.525 -6.068 -2.899 1319 HB3 GLU 74 1HB GLU 74 -4.912 -7.185 -1.686 1320 HG2 GLU 74 2HG GLU 74 -6.563 -4.783 -0.995 1321 HG3 GLU 74 1HG GLU 74 -7.243 -6.381 -1.319 1322 H GLU 75 H GLU 75 -3.132 -5.714 -3.992 1323 HA GLU 75 HA GLU 75 -1.436 -7.916 -3.397 1324 HB2 GLU 75 2HB GLU 75 -2.499 -7.688 -5.594 1325 HB3 GLU 75 1HB GLU 75 -1.578 -6.211 -5.865 1326 HG2 GLU 75 2HG GLU 75 -0.590 -8.098 -7.058 1327 HG3 GLU 75 1HG GLU 75 0.491 -7.449 -5.826 1328 H LEU 76 H LEU 76 -0.884 -4.494 -4.084 1329 HA LEU 76 HA LEU 76 1.893 -4.503 -4.140 1330 HB2 LEU 76 2HB LEU 76 0.105 -2.347 -3.015 1331 HB3 LEU 76 1HB LEU 76 1.798 -2.144 -3.407 1332 HG LEU 76 HG LEU 76 -0.436 -2.675 -5.366 1333 HD11 LEU 76 1HD1 LEU 76 0.057 -0.423 -6.160 1334 HD12 LEU 76 2HD1 LEU 76 1.253 -0.238 -4.881 1335 HD13 LEU 76 3HD1 LEU 76 -0.453 -0.418 -4.473 1336 HD21 LEU 76 1HD2 LEU 76 1.627 -3.735 -6.116 1337 HD22 LEU 76 2HD2 LEU 76 2.509 -2.230 -5.860 1338 HD23 LEU 76 3HD2 LEU 76 1.263 -2.321 -7.098 1339 H THR 77 H THR 77 -0.249 -4.170 -1.308 1340 HA THR 77 HA THR 77 1.912 -3.996 0.498 1341 HB THR 77 HB THR 77 -0.964 -4.791 1.048 1342 HG1 THR 77 1HG THR 77 -1.156 -2.737 0.317 1343 HG21 THR 77 1HG2 THR 77 -0.507 -3.969 3.315 1344 HG22 THR 77 2HG2 THR 77 1.160 -3.620 2.864 1345 HG23 THR 77 3HG2 THR 77 0.590 -5.288 2.915 1346 H LYS 78 H LYS 78 -0.047 -6.759 -0.656 1347 HA LYS 78 HA LYS 78 1.085 -8.534 1.249 1348 HB2 LYS 78 2HB LYS 78 -0.509 -9.192 -1.222 1349 HB3 LYS 78 1HB LYS 78 0.054 -10.399 -0.070 1350 HG2 LYS 78 2HG LYS 78 -1.121 -8.994 1.679 1351 HG3 LYS 78 1HG LYS 78 -1.886 -8.184 0.351 1352 HD2 LYS 78 2HD LYS 78 -2.034 -11.179 0.746 1353 HD3 LYS 78 1HD LYS 78 -3.248 -10.055 1.334 1354 HE2 LYS 78 2HE LYS 78 -2.450 -10.383 -1.549 1355 HE3 LYS 78 1HE LYS 78 -3.840 -11.162 -0.792 1356 HZ1 LYS 78 1HZ LYS 78 -4.646 -8.902 -0.228 1357 HZ2 LYS 78 2HZ LYS 78 -4.626 -9.271 -1.865 1358 HZ3 LYS 78 3HZ LYS 78 -3.437 -8.240 -1.191 1359 H TYR 79 H TYR 79 1.798 -7.980 -2.117 1360 HA TYR 79 HA TYR 79 3.710 -10.080 -2.173 1361 HB2 TYR 79 2HB TYR 79 2.610 -9.221 -4.219 1362 HB3 TYR 79 1HB TYR 79 3.505 -7.716 -4.038 1363 HD1 TYR 79 1HD TYR 79 4.063 -11.373 -4.294 1364 HD2 TYR 79 2HD TYR 79 5.537 -7.494 -5.165 1365 HE1 TYR 79 1HE TYR 79 5.897 -12.372 -5.589 1366 HE2 TYR 79 2HE TYR 79 7.371 -8.467 -6.458 1367 HH TYR 79 HH TYR 79 8.610 -10.589 -6.631 1368 H TYR 80 H TYR 80 3.879 -6.687 -1.384 1369 HA TYR 80 HA TYR 80 6.665 -6.352 -1.398 1370 HB2 TYR 80 2HB TYR 80 5.038 -4.498 -1.205 1371 HB3 TYR 80 1HB TYR 80 4.590 -5.066 0.391 1372 HD1 TYR 80 1HD TYR 80 7.243 -3.496 -1.592 1373 HD2 TYR 80 2HD TYR 80 5.930 -4.521 2.308 1374 HE1 TYR 80 1HE TYR 80 8.970 -2.021 -0.630 1375 HE2 TYR 80 2HE TYR 80 7.642 -3.061 3.283 1376 HH TYR 80 HH TYR 80 9.391 -0.811 1.418 1377 H LEU 81 H LEU 81 4.454 -7.229 1.247 1378 HA LEU 81 HA LEU 81 6.585 -7.663 3.080 1379 HB2 LEU 81 2HB LEU 81 3.680 -8.394 3.253 1380 HB3 LEU 81 1HB LEU 81 4.820 -8.578 4.578 1381 HG LEU 81 HG LEU 81 3.988 -5.976 3.288 1382 HD11 LEU 81 1HD1 LEU 81 3.424 -7.091 6.016 1383 HD12 LEU 81 2HD1 LEU 81 2.255 -6.986 4.695 1384 HD13 LEU 81 3HD1 LEU 81 2.919 -5.515 5.419 1385 HD21 LEU 81 1HD2 LEU 81 5.275 -4.917 5.073 1386 HD22 LEU 81 2HD2 LEU 81 6.313 -5.883 4.033 1387 HD23 LEU 81 3HD2 LEU 81 5.839 -6.493 5.620 1388 H ALA 82 H ALA 82 4.958 -9.699 0.790 1389 HA ALA 82 HA ALA 82 5.586 -12.199 1.853 1390 HB1 ALA 82 1HB ALA 82 5.485 -11.389 -1.055 1391 HB2 ALA 82 2HB ALA 82 4.103 -11.880 -0.077 1392 HB3 ALA 82 3HB ALA 82 5.384 -13.039 -0.438 1393 H ASN 83 H ASN 83 7.472 -9.923 0.002 1394 HA ASN 83 HA ASN 83 9.710 -11.700 -0.305 1395 HB2 ASN 83 2HB ASN 83 9.312 -8.809 -0.972 1396 HB3 ASN 83 1HB ASN 83 10.899 -9.564 -1.114 1397 HD21 ASN 83 1HD2 ASN 83 7.636 -9.433 -2.398 1398 HD22 ASN 83 2HD2 ASN 83 8.015 -10.328 -3.826 1399 H HIS 84 H HIS 84 8.624 -10.281 2.355 1400 HA HIS 84 HA HIS 84 11.315 -9.797 3.453 1401 HB2 HIS 84 2HB HIS 84 9.296 -8.235 3.955 1402 HB3 HIS 84 1HB HIS 84 8.663 -9.555 4.924 1403 HD1 HIS 84 1HD HIS 84 11.332 -10.333 6.443 1404 HD2 HIS 84 2HD HIS 84 9.948 -6.455 5.896 1405 HE1 HIS 84 1HE HIS 84 12.466 -8.964 8.177 1406 HE2 HIS 84 2HE HIS 84 12.026 -6.656 7.425 1407 H GLY 85 H GLY 85 9.221 -12.259 2.808 1408 HA2 GLY 85 2HA GLY 85 9.534 -14.480 3.442 1409 HA3 GLY 85 1HA GLY 85 10.344 -13.934 4.906 1410 H ILE 86 H ILE 86 7.359 -12.406 4.026 1411 HA ILE 86 HA ILE 86 6.099 -13.721 6.310 1412 HB ILE 86 HB ILE 86 5.210 -11.254 4.784 1413 HG12 ILE 86 2HG1 ILE 86 7.230 -10.697 5.988 1414 HG13 ILE 86 1HG1 ILE 86 5.865 -10.004 6.812 1415 HG21 ILE 86 1HG2 ILE 86 3.651 -10.905 6.636 1416 HG22 ILE 86 2HG2 ILE 86 4.180 -12.423 7.361 1417 HG23 ILE 86 3HG2 ILE 86 3.352 -12.431 5.803 1418 HD11 ILE 86 1HD1 ILE 86 7.254 -12.536 7.642 1419 HD12 ILE 86 2HD1 ILE 86 5.899 -11.774 8.471 1420 HD13 ILE 86 3HD1 ILE 86 7.462 -10.965 8.398 1421 H ASP 87 H ASP 87 4.749 -15.329 5.876 1422 HA ASP 87 HA ASP 87 3.656 -15.612 3.217 1423 HB2 ASP 87 2HB ASP 87 3.440 -17.332 5.685 1424 HB3 ASP 87 1HB ASP 87 2.518 -17.659 4.221 1425 H ILE 88 H ILE 88 1.900 -14.744 2.610 1426 HA ILE 88 HA ILE 88 -0.092 -13.968 4.624 1427 HB ILE 88 HB ILE 88 0.449 -12.599 1.963 1428 HG12 ILE 88 2HG1 ILE 88 1.251 -11.689 4.735 1429 HG13 ILE 88 1HG1 ILE 88 2.356 -12.354 3.538 1430 HG21 ILE 88 1HG2 ILE 88 -1.190 -11.782 4.369 1431 HG22 ILE 88 2HG2 ILE 88 -1.834 -12.354 2.829 1432 HG23 ILE 88 3HG2 ILE 88 -0.958 -10.824 2.906 1433 HD11 ILE 88 1HD1 ILE 88 2.402 -9.893 3.680 1434 HD12 ILE 88 2HD1 ILE 88 0.715 -9.873 3.096 1435 HD13 ILE 88 3HD1 ILE 88 1.988 -10.506 2.086 1436 H LYS 89 H LYS 89 -2.240 -14.395 4.054 1437 HA LYS 89 HA LYS 89 -2.610 -16.293 1.931 1438 HB2 LYS 89 2HB LYS 89 -3.371 -16.681 4.302 1439 HB3 LYS 89 1HB LYS 89 -4.457 -15.325 4.130 1440 HG2 LYS 89 2HG LYS 89 -4.577 -17.792 2.437 1441 HG3 LYS 89 1HG LYS 89 -5.470 -17.602 3.948 1442 HD2 LYS 89 2HD LYS 89 -6.628 -15.658 2.967 1443 HD3 LYS 89 1HD LYS 89 -5.736 -15.895 1.465 1444 HE2 LYS 89 2HE LYS 89 -7.618 -17.887 2.714 1445 HE3 LYS 89 1HE LYS 89 -8.017 -16.820 1.375 1446 HZ1 LYS 89 1HZ LYS 89 -6.410 -17.874 0.015 1447 HZ2 LYS 89 2HZ LYS 89 -7.398 -19.055 0.663 1448 HZ3 LYS 89 3HZ LYS 89 -5.844 -18.854 1.284 Start of MODEL 9 1 H1 MET 1 1HT MET 1 -12.112 16.838 11.280 2 H2 MET 1 2HT MET 1 -13.757 16.485 11.448 3 H3 MET 1 3HT MET 1 -12.643 15.249 11.106 4 HA MET 1 HA MET 1 -12.713 16.873 13.567 5 HB2 MET 1 2HB MET 1 -13.461 14.874 14.710 6 HB3 MET 1 1HB MET 1 -14.568 15.205 13.392 7 HG2 MET 1 2HG MET 1 -12.376 13.124 13.368 8 HG3 MET 1 1HG MET 1 -14.089 12.808 13.625 9 HE1 MET 1 1HE MET 1 -13.989 10.958 11.712 10 HE2 MET 1 2HE MET 1 -12.279 11.298 11.440 11 HE3 MET 1 3HE MET 1 -13.402 11.267 10.080 12 H GLY 2 H GLY 2 -11.371 15.689 15.259 13 HA2 GLY 2 2HA GLY 2 -9.106 14.267 14.131 14 HA3 GLY 2 1HA GLY 2 -8.797 15.772 14.998 15 H PHE 3 H PHE 3 -9.569 12.452 15.265 16 HA PHE 3 HA PHE 3 -10.481 12.424 17.926 17 HB2 PHE 3 2HB PHE 3 -9.076 10.257 16.349 18 HB3 PHE 3 1HB PHE 3 -9.783 10.010 17.940 19 HD1 PHE 3 1HD PHE 3 -12.195 10.034 18.245 20 HD2 PHE 3 2HD PHE 3 -10.465 10.470 14.385 21 HE1 PHE 3 1HE PHE 3 -14.373 9.540 17.217 22 HE2 PHE 3 2HE PHE 3 -12.639 9.981 13.353 23 HZ PHE 3 HZ PHE 3 -14.598 9.515 14.768 24 H THR 4 H THR 4 -9.529 12.681 19.795 25 HA THR 4 HA THR 4 -6.823 13.451 19.867 26 HB THR 4 HB THR 4 -7.342 13.638 22.365 27 HG1 THR 4 1HG THR 4 -9.234 13.068 23.024 28 HG21 THR 4 1HG2 THR 4 -7.403 15.555 20.825 29 HG22 THR 4 2HG2 THR 4 -8.701 15.667 22.015 30 HG23 THR 4 3HG2 THR 4 -9.054 15.135 20.371 31 H ASP 5 H ASP 5 -5.319 11.975 19.662 32 HA ASP 5 HA ASP 5 -4.985 10.020 21.744 33 HB2 ASP 5 2HB ASP 5 -6.164 8.720 19.979 34 HB3 ASP 5 1HB ASP 5 -4.964 9.244 18.806 35 H GLU 6 H GLU 6 -3.168 11.044 22.454 36 HA GLU 6 HA GLU 6 -1.314 11.963 20.451 37 HB2 GLU 6 2HB GLU 6 -0.111 13.124 22.255 38 HB3 GLU 6 1HB GLU 6 -1.794 13.590 22.172 39 HG2 GLU 6 2HG GLU 6 -0.626 11.668 24.184 40 HG3 GLU 6 1HG GLU 6 -0.931 13.378 24.475 41 H THR 7 H THR 7 0.153 10.859 19.730 42 HA THR 7 HA THR 7 1.098 8.521 21.107 43 HB THR 7 HB THR 7 0.806 8.454 18.648 44 HG1 THR 7 1HG THR 7 3.593 8.302 18.978 45 HG21 THR 7 1HG2 THR 7 1.339 10.784 18.103 46 HG22 THR 7 2HG2 THR 7 2.349 9.687 17.155 47 HG23 THR 7 3HG2 THR 7 3.018 10.517 18.561 48 H VAL 8 H VAL 8 3.293 8.276 21.740 49 HA VAL 8 HA VAL 8 4.323 10.706 22.784 50 HB VAL 8 HB VAL 8 4.392 8.637 24.103 51 HG11 VAL 8 1HG1 VAL 8 4.823 6.979 22.413 52 HG12 VAL 8 2HG1 VAL 8 6.040 6.877 23.682 53 HG13 VAL 8 3HG1 VAL 8 6.434 7.638 22.143 54 HG21 VAL 8 1HG2 VAL 8 6.679 8.854 24.963 55 HG22 VAL 8 2HG2 VAL 8 5.907 10.415 24.667 56 HG23 VAL 8 3HG2 VAL 8 7.101 9.790 23.532 57 H ARG 9 H ARG 9 5.494 12.058 21.746 58 HA ARG 9 HA ARG 9 6.635 11.370 19.188 59 HB2 ARG 9 2HB ARG 9 6.441 14.010 20.651 60 HB3 ARG 9 1HB ARG 9 7.080 13.819 19.028 61 HG2 ARG 9 2HG ARG 9 4.906 13.057 18.233 62 HG3 ARG 9 1HG ARG 9 4.257 13.151 19.870 63 HD2 ARG 9 2HD ARG 9 3.590 15.099 18.522 64 HD3 ARG 9 1HD ARG 9 4.607 15.581 19.878 65 HE ARG 9 HE ARG 9 6.354 15.269 17.817 66 HH11 ARG 9 1HH1 ARG 9 3.404 17.284 18.193 67 HH12 ARG 9 2HH1 ARG 9 3.987 18.475 17.134 68 HH21 ARG 9 1HH2 ARG 9 7.081 16.956 16.411 69 HH22 ARG 9 2HH2 ARG 9 6.078 18.304 16.116 70 H PHE 10 H PHE 10 8.644 10.588 19.051 71 HA PHE 10 HA PHE 10 10.665 11.751 20.820 72 HB2 PHE 10 2HB PHE 10 10.476 8.889 19.903 73 HB3 PHE 10 1HB PHE 10 11.928 9.580 20.598 74 HD1 PHE 10 1HD PHE 10 9.280 7.541 21.294 75 HD2 PHE 10 2HD PHE 10 11.308 10.903 22.907 76 HE1 PHE 10 1HE PHE 10 8.531 6.909 23.544 77 HE2 PHE 10 2HE PHE 10 10.568 10.271 25.166 78 HZ PHE 10 HZ PHE 10 9.174 8.268 25.480 79 H ASP 11 H ASP 11 12.698 12.019 19.967 80 HA ASP 11 HA ASP 11 12.766 12.275 17.041 81 HB2 ASP 11 2HB ASP 11 13.198 14.249 18.688 82 HB3 ASP 11 1HB ASP 11 14.694 13.431 19.099 83 H PHE 12 H PHE 12 15.562 12.150 16.725 84 HA PHE 12 HA PHE 12 17.262 10.712 16.397 85 HB2 PHE 12 2HB PHE 12 16.587 10.022 19.256 86 HB3 PHE 12 1HB PHE 12 18.021 9.422 18.435 87 HD1 PHE 12 1HD PHE 12 16.401 12.357 19.906 88 HD2 PHE 12 2HD PHE 12 19.846 10.904 17.884 89 HE1 PHE 12 1HE PHE 12 17.620 14.411 20.506 90 HE2 PHE 12 2HE PHE 12 21.069 12.950 18.482 91 HZ PHE 12 HZ PHE 12 19.952 14.709 19.797 92 H ASP 13 H ASP 13 14.855 9.741 15.332 93 HA ASP 13 HA ASP 13 14.554 6.971 16.003 94 HB2 ASP 13 2HB ASP 13 13.002 6.802 14.136 95 HB3 ASP 13 1HB ASP 13 12.675 8.299 14.987 96 H ASP 14 H ASP 14 14.701 5.378 13.956 97 HA ASP 14 HA ASP 14 17.545 5.166 13.594 98 HB2 ASP 14 2HB ASP 14 15.334 3.457 12.428 99 HB3 ASP 14 1HB ASP 14 17.048 3.075 12.378 100 H ASN 15 H ASN 15 18.477 4.638 11.404 101 HA ASN 15 HA ASN 15 18.009 6.807 9.626 102 HB2 ASN 15 2HB ASN 15 20.202 5.584 9.718 103 HB3 ASN 15 1HB ASN 15 19.412 4.181 9.012 104 HD21 ASN 15 1HD2 ASN 15 20.608 7.386 8.410 105 HD22 ASN 15 2HD2 ASN 15 20.544 7.323 6.695 106 H ARG 16 H ARG 16 16.617 6.979 7.954 107 HA ARG 16 HA ARG 16 14.682 4.883 7.911 108 HB2 ARG 16 2HB ARG 16 14.560 7.619 6.633 109 HB3 ARG 16 1HB ARG 16 13.237 6.454 6.676 110 HG2 ARG 16 2HG ARG 16 13.240 6.527 9.123 111 HG3 ARG 16 1HG ARG 16 14.565 7.677 9.087 112 HD2 ARG 16 2HD ARG 16 13.094 9.292 7.922 113 HD3 ARG 16 1HD ARG 16 11.770 8.124 8.019 114 HE ARG 16 HE ARG 16 12.907 8.570 10.576 115 HH11 ARG 16 1HH1 ARG 16 10.662 10.095 8.298 116 HH12 ARG 16 2HH1 ARG 16 9.860 11.011 9.480 117 HH21 ARG 16 1HH2 ARG 16 11.852 9.829 12.172 118 HH22 ARG 16 2HH2 ARG 16 10.540 10.847 11.771 119 H LYS 17 H LYS 17 15.995 3.401 6.990 120 HA LYS 17 HA LYS 17 15.760 3.322 4.097 121 HB2 LYS 17 2HB LYS 17 18.098 3.998 4.648 122 HB3 LYS 17 1HB LYS 17 18.245 2.592 5.666 123 HG2 LYS 17 2HG LYS 17 19.438 2.076 3.720 124 HG3 LYS 17 1HG LYS 17 17.928 1.201 3.557 125 HD2 LYS 17 2HD LYS 17 18.440 3.888 2.259 126 HD3 LYS 17 1HD LYS 17 18.842 2.372 1.481 127 HE2 LYS 17 2HE LYS 17 16.469 1.733 1.508 128 HE3 LYS 17 1HE LYS 17 16.062 3.235 2.327 129 HZ1 LYS 17 1HZ LYS 17 16.785 4.478 0.459 130 HZ2 LYS 17 2HZ LYS 17 15.690 3.326 -0.071 131 HZ3 LYS 17 3HZ LYS 17 17.334 3.097 -0.340 132 H LYS 18 H LYS 18 14.378 1.632 3.934 133 HA LYS 18 HA LYS 18 13.361 -0.343 4.163 134 HB2 LYS 18 2HB LYS 18 15.827 -1.271 5.658 135 HB3 LYS 18 1HB LYS 18 14.542 -2.317 5.081 136 HG2 LYS 18 2HG LYS 18 15.141 -1.605 2.747 137 HG3 LYS 18 1HG LYS 18 16.532 -0.765 3.431 138 HD2 LYS 18 2HD LYS 18 15.960 -3.728 3.629 139 HD3 LYS 18 1HD LYS 18 17.198 -2.972 2.630 140 HE2 LYS 18 2HE LYS 18 18.334 -2.169 4.641 141 HE3 LYS 18 1HE LYS 18 17.076 -2.871 5.647 142 HZ1 LYS 18 1HZ LYS 18 17.680 -5.050 4.785 143 HZ2 LYS 18 2HZ LYS 18 18.961 -4.302 5.599 144 HZ3 LYS 18 3HZ LYS 18 18.948 -4.373 3.905 145 H ALA 19 H ALA 19 13.646 1.774 6.297 146 HA ALA 19 HA ALA 19 13.159 0.614 8.847 147 HB1 ALA 19 1HB ALA 19 13.898 2.918 8.524 148 HB2 ALA 19 2HB ALA 19 12.378 2.845 9.446 149 HB3 ALA 19 3HB ALA 19 12.348 3.242 7.723 150 H ILE 20 H ILE 20 11.184 1.814 6.251 151 HA ILE 20 HA ILE 20 8.680 1.520 7.466 152 HB ILE 20 HB ILE 20 9.455 1.513 4.539 153 HG12 ILE 20 2HG1 ILE 20 8.434 3.752 6.297 154 HG13 ILE 20 1HG1 ILE 20 10.108 3.540 5.816 155 HG21 ILE 20 1HG2 ILE 20 6.740 1.901 5.801 156 HG22 ILE 20 2HG2 ILE 20 7.253 0.540 4.805 157 HG23 ILE 20 3HG2 ILE 20 7.121 2.146 4.092 158 HD11 ILE 20 1HD1 ILE 20 9.048 5.229 4.480 159 HD12 ILE 20 2HD1 ILE 20 7.774 4.107 4.005 160 HD13 ILE 20 3HD1 ILE 20 9.433 3.839 3.467 161 H SER 21 H SER 21 10.737 -0.598 5.611 162 HA SER 21 HA SER 21 8.709 -2.564 5.289 163 HB2 SER 21 2HB SER 21 10.567 -4.057 4.430 164 HB3 SER 21 1HB SER 21 10.291 -2.564 3.548 165 HG SER 21 HG SER 21 12.339 -3.125 5.428 166 H GLU 22 H GLU 22 11.325 -2.172 7.562 167 HA GLU 22 HA GLU 22 11.004 -4.653 8.900 168 HB2 GLU 22 2HB GLU 22 11.816 -1.980 10.022 169 HB3 GLU 22 1HB GLU 22 12.139 -3.541 10.767 170 HG2 GLU 22 2HG GLU 22 13.600 -4.104 8.882 171 HG3 GLU 22 1HG GLU 22 13.258 -2.536 8.164 172 H THR 23 H THR 23 9.507 -1.511 9.131 173 HA THR 23 HA THR 23 8.012 -1.888 11.473 174 HB THR 23 HB THR 23 7.563 -0.084 9.098 175 HG1 THR 23 1HG THR 23 9.487 0.331 10.188 176 HG21 THR 23 1HG2 THR 23 5.481 -0.345 10.337 177 HG22 THR 23 2HG2 THR 23 6.161 1.264 10.598 178 HG23 THR 23 3HG2 THR 23 6.314 0.028 11.848 179 H LEU 24 H LEU 24 6.977 -2.121 8.027 180 HA LEU 24 HA LEU 24 4.395 -2.980 8.782 181 HB2 LEU 24 2HB LEU 24 5.745 -2.844 6.122 182 HB3 LEU 24 1HB LEU 24 4.222 -3.688 6.281 183 HG LEU 24 HG LEU 24 3.176 -1.590 7.098 184 HD11 LEU 24 1HD1 LEU 24 4.301 0.537 6.802 185 HD12 LEU 24 2HD1 LEU 24 5.795 -0.307 6.402 186 HD13 LEU 24 3HD1 LEU 24 5.100 -0.465 8.015 187 HD21 LEU 24 1HD2 LEU 24 3.117 -0.463 4.938 188 HD22 LEU 24 2HD2 LEU 24 3.003 -2.213 4.765 189 HD23 LEU 24 3HD2 LEU 24 4.523 -1.390 4.414 190 H GLU 25 H GLU 25 7.274 -4.763 8.041 191 HA GLU 25 HA GLU 25 6.191 -7.285 7.708 192 HB2 GLU 25 2HB GLU 25 8.573 -6.631 7.357 193 HB3 GLU 25 1HB GLU 25 8.771 -6.450 9.083 194 HG2 GLU 25 2HG GLU 25 8.134 -9.065 7.724 195 HG3 GLU 25 1HG GLU 25 9.765 -8.509 8.055 196 H THR 26 H THR 26 7.215 -5.501 10.583 197 HA THR 26 HA THR 26 6.515 -7.429 12.511 198 HB THR 26 HB THR 26 6.798 -4.412 12.915 199 HG1 THR 26 1HG THR 26 8.732 -5.145 12.058 200 HG21 THR 26 1HG2 THR 26 7.306 -5.030 15.217 201 HG22 THR 26 2HG2 THR 26 7.160 -6.741 14.804 202 HG23 THR 26 3HG2 THR 26 5.733 -5.708 14.754 203 H VAL 27 H VAL 27 4.790 -4.622 11.191 204 HA VAL 27 HA VAL 27 2.611 -4.575 12.929 205 HB VAL 27 HB VAL 27 2.687 -3.719 10.006 206 HG11 VAL 27 1HG1 VAL 27 0.387 -4.061 10.767 207 HG12 VAL 27 2HG1 VAL 27 0.750 -2.333 10.566 208 HG13 VAL 27 3HG1 VAL 27 0.734 -3.047 12.177 209 HG21 VAL 27 1HG2 VAL 27 2.964 -2.119 12.547 210 HG22 VAL 27 2HG2 VAL 27 2.973 -1.472 10.907 211 HG23 VAL 27 3HG2 VAL 27 4.274 -2.532 11.444 212 H TYR 28 H TYR 28 3.084 -6.483 9.999 213 HA TYR 28 HA TYR 28 0.447 -7.467 9.780 214 HB2 TYR 28 2HB TYR 28 2.068 -7.715 7.925 215 HB3 TYR 28 1HB TYR 28 3.028 -8.811 8.905 216 HD1 TYR 28 1HD TYR 28 1.947 -11.116 9.532 217 HD2 TYR 28 2HD TYR 28 0.305 -8.571 6.523 218 HE1 TYR 28 1HE TYR 28 0.728 -13.016 8.580 219 HE2 TYR 28 2HE TYR 28 -0.907 -10.500 5.571 220 HH TYR 28 HH TYR 28 -1.206 -13.447 7.231 221 H ARG 29 H ARG 29 3.282 -8.676 11.473 222 HA ARG 29 HA ARG 29 2.038 -11.153 12.213 223 HB2 ARG 29 2HB ARG 29 4.369 -9.982 13.703 224 HB3 ARG 29 1HB ARG 29 3.966 -11.659 13.442 225 HG2 ARG 29 2HG ARG 29 5.303 -9.725 11.568 226 HG3 ARG 29 1HG ARG 29 5.898 -11.260 12.174 227 HD2 ARG 29 2HD ARG 29 3.806 -10.752 10.069 228 HD3 ARG 29 1HD ARG 29 5.371 -11.501 9.861 229 HE ARG 29 HE ARG 29 3.168 -12.761 11.371 230 HH11 ARG 29 1HH1 ARG 29 5.871 -13.095 9.057 231 HH12 ARG 29 2HH1 ARG 29 5.434 -14.691 8.649 232 HH21 ARG 29 1HH2 ARG 29 2.637 -14.854 10.766 233 HH22 ARG 29 2HH2 ARG 29 3.593 -15.723 9.611 234 H ALA 30 H ALA 30 2.367 -8.031 13.698 235 HA ALA 30 HA ALA 30 1.582 -8.694 16.317 236 HB1 ALA 30 1HB ALA 30 2.610 -6.541 15.716 237 HB2 ALA 30 2HB ALA 30 1.095 -6.315 16.589 238 HB3 ALA 30 3HB ALA 30 1.148 -6.093 14.839 239 H LEU 31 H LEU 31 -0.273 -7.740 13.509 240 HA LEU 31 HA LEU 31 -2.759 -7.647 14.845 241 HB2 LEU 31 2HB LEU 31 -2.041 -7.773 11.951 242 HB3 LEU 31 1HB LEU 31 -3.698 -7.608 12.519 243 HG LEU 31 HG LEU 31 -1.523 -5.727 13.290 244 HD11 LEU 31 1HD1 LEU 31 -3.568 -5.450 11.099 245 HD12 LEU 31 2HD1 LEU 31 -1.821 -5.659 10.840 246 HD13 LEU 31 3HD1 LEU 31 -2.442 -4.190 11.593 247 HD21 LEU 31 1HD2 LEU 31 -3.407 -4.236 13.773 248 HD22 LEU 31 2HD2 LEU 31 -3.410 -5.697 14.757 249 HD23 LEU 31 3HD2 LEU 31 -4.511 -5.546 13.384 250 H GLU 32 H GLU 32 -1.043 -10.227 13.260 251 HA GLU 32 HA GLU 32 -3.170 -12.080 12.988 252 HB2 GLU 32 2HB GLU 32 -0.325 -12.645 13.773 253 HB3 GLU 32 1HB GLU 32 -1.493 -13.801 13.184 254 HG2 GLU 32 2HG GLU 32 -1.483 -12.699 11.021 255 HG3 GLU 32 1HG GLU 32 -0.306 -11.522 11.637 256 H GLU 33 H GLU 33 -0.824 -11.479 15.508 257 HA GLU 33 HA GLU 33 -1.691 -13.485 17.288 258 HB2 GLU 33 2HB GLU 33 -0.089 -11.006 17.884 259 HB3 GLU 33 1HB GLU 33 -0.217 -12.433 18.905 260 HG2 GLU 33 2HG GLU 33 1.027 -12.300 16.164 261 HG3 GLU 33 1HG GLU 33 1.876 -12.462 17.701 262 H LYS 34 H LYS 34 -2.705 -10.245 16.771 263 HA LYS 34 HA LYS 34 -4.172 -10.224 19.271 264 HB2 LYS 34 2HB LYS 34 -3.833 -8.090 17.175 265 HB3 LYS 34 1HB LYS 34 -4.809 -7.912 18.627 266 HG2 LYS 34 2HG LYS 34 -1.847 -8.468 18.591 267 HG3 LYS 34 1HG LYS 34 -2.573 -6.880 18.822 268 HD2 LYS 34 2HD LYS 34 -3.070 -9.263 20.614 269 HD3 LYS 34 1HD LYS 34 -1.888 -8.000 20.941 270 HE2 LYS 34 2HE LYS 34 -3.641 -6.341 21.041 271 HE3 LYS 34 1HE LYS 34 -4.864 -7.543 20.621 272 HZ1 LYS 34 1HZ LYS 34 -4.285 -8.731 22.663 273 HZ2 LYS 34 2HZ LYS 34 -4.871 -7.220 23.001 274 HZ3 LYS 34 3HZ LYS 34 -3.213 -7.528 23.114 275 H GLY 35 H GLY 35 -4.753 -11.327 16.202 276 HA2 GLY 35 2HA GLY 35 -6.678 -12.384 15.486 277 HA3 GLY 35 1HA GLY 35 -7.530 -11.713 16.867 278 H TYR 36 H TYR 36 -5.751 -9.909 14.407 279 HA TYR 36 HA TYR 36 -8.330 -8.832 13.466 280 HB2 TYR 36 2HB TYR 36 -5.704 -7.334 13.636 281 HB3 TYR 36 1HB TYR 36 -7.231 -6.684 13.064 282 HD1 TYR 36 1HD TYR 36 -5.058 -6.889 15.757 283 HD2 TYR 36 2HD TYR 36 -9.200 -6.841 14.845 284 HE1 TYR 36 1HE TYR 36 -5.561 -6.162 18.066 285 HE2 TYR 36 2HE TYR 36 -9.708 -6.105 17.137 286 HH TYR 36 HH TYR 36 -8.689 -6.225 19.315 287 H ASN 37 H ASN 37 -7.937 -7.768 11.247 288 HA ASN 37 HA ASN 37 -6.400 -9.673 9.656 289 HB2 ASN 37 2HB ASN 37 -8.549 -7.698 8.838 290 HB3 ASN 37 1HB ASN 37 -7.581 -8.591 7.676 291 HD21 ASN 37 1HD2 ASN 37 -9.373 -9.620 6.811 292 HD22 ASN 37 2HD2 ASN 37 -10.232 -10.854 7.671 293 HA PRO 38 HA PRO 38 -3.139 -6.493 9.564 294 HB2 PRO 38 2HB PRO 38 -2.100 -8.511 7.663 295 HB3 PRO 38 1HB PRO 38 -1.299 -7.736 9.029 296 HG2 PRO 38 2HG PRO 38 -2.119 -10.282 9.128 297 HG3 PRO 38 1HG PRO 38 -2.153 -9.239 10.552 298 HD2 PRO 38 2HD PRO 38 -4.396 -10.206 8.874 299 HD3 PRO 38 1HD PRO 38 -4.337 -9.726 10.593 300 H ILE 39 H ILE 39 -4.655 -8.198 7.011 301 HA ILE 39 HA ILE 39 -3.829 -6.770 4.770 302 HB ILE 39 HB ILE 39 -6.412 -8.225 5.343 303 HG12 ILE 39 2HG1 ILE 39 -4.498 -9.663 5.651 304 HG13 ILE 39 1HG1 ILE 39 -5.340 -10.113 4.172 305 HG21 ILE 39 1HG2 ILE 39 -6.702 -8.464 2.938 306 HG22 ILE 39 2HG2 ILE 39 -5.262 -7.484 2.673 307 HG23 ILE 39 3HG2 ILE 39 -6.686 -6.766 3.413 308 HD11 ILE 39 1HD1 ILE 39 -3.628 -8.994 2.857 309 HD12 ILE 39 2HD1 ILE 39 -2.919 -10.201 3.922 310 HD13 ILE 39 3HD1 ILE 39 -2.794 -8.488 4.321 311 H ASN 40 H ASN 40 -6.759 -6.281 6.893 312 HA ASN 40 HA ASN 40 -7.826 -4.161 5.485 313 HB2 ASN 40 2HB ASN 40 -9.118 -5.683 6.721 314 HB3 ASN 40 1HB ASN 40 -8.127 -5.469 8.146 315 HD21 ASN 40 1HD2 ASN 40 -9.792 -4.984 9.409 316 HD22 ASN 40 2HD2 ASN 40 -10.641 -3.496 9.247 317 H GLN 41 H GLN 41 -6.054 -4.461 8.549 318 HA GLN 41 HA GLN 41 -6.387 -1.812 9.359 319 HB2 GLN 41 2HB GLN 41 -4.273 -3.780 10.164 320 HB3 GLN 41 1HB GLN 41 -4.569 -2.253 10.976 321 HG2 GLN 41 2HG GLN 41 -6.536 -4.532 10.744 322 HG3 GLN 41 1HG GLN 41 -5.590 -4.125 12.175 323 HE21 GLN 41 1HE2 GLN 41 -8.405 -4.240 11.935 324 HE22 GLN 41 2HE2 GLN 41 -9.051 -2.682 12.302 325 H ILE 42 H ILE 42 -3.729 -3.240 7.514 326 HA ILE 42 HA ILE 42 -2.133 -0.900 7.760 327 HB ILE 42 HB ILE 42 -1.838 -3.208 5.815 328 HG12 ILE 42 2HG1 ILE 42 -0.378 -2.533 8.383 329 HG13 ILE 42 1HG1 ILE 42 -1.605 -3.782 8.212 330 HG21 ILE 42 1HG2 ILE 42 0.075 -0.943 6.445 331 HG22 ILE 42 2HG2 ILE 42 -0.777 -1.181 4.925 332 HG23 ILE 42 3HG2 ILE 42 0.453 -2.344 5.433 333 HD11 ILE 42 1HD1 ILE 42 -0.143 -4.999 6.691 334 HD12 ILE 42 2HD1 ILE 42 0.638 -4.713 8.244 335 HD13 ILE 42 3HD1 ILE 42 1.080 -3.735 6.845 336 H VAL 43 H VAL 43 -4.100 -2.150 5.042 337 HA VAL 43 HA VAL 43 -3.525 0.107 3.443 338 HB VAL 43 HB VAL 43 -4.311 -1.955 2.331 339 HG11 VAL 43 1HG1 VAL 43 -5.869 -2.763 4.046 340 HG12 VAL 43 2HG1 VAL 43 -6.651 -2.658 2.463 341 HG13 VAL 43 3HG1 VAL 43 -6.961 -1.421 3.681 342 HG21 VAL 43 1HG2 VAL 43 -6.282 0.293 1.982 343 HG22 VAL 43 2HG2 VAL 43 -5.981 -1.008 0.825 344 HG23 VAL 43 3HG2 VAL 43 -4.710 0.160 1.206 345 H GLY 44 H GLY 44 -6.011 -0.590 5.801 346 HA2 GLY 44 2HA GLY 44 -7.704 1.585 5.386 347 HA3 GLY 44 1HA GLY 44 -7.445 0.767 6.924 348 H TYR 45 H TYR 45 -4.876 1.253 7.519 349 HA TYR 45 HA TYR 45 -4.846 3.873 8.498 350 HB2 TYR 45 2HB TYR 45 -3.451 2.220 9.565 351 HB3 TYR 45 1HB TYR 45 -2.555 1.935 8.076 352 HD1 TYR 45 1HD TYR 45 -0.700 3.340 7.465 353 HD2 TYR 45 2HD TYR 45 -3.152 4.402 10.768 354 HE1 TYR 45 1HE TYR 45 0.916 5.092 8.096 355 HE2 TYR 45 2HE TYR 45 -1.538 6.133 11.413 356 HH TYR 45 HH TYR 45 1.080 7.096 9.397 357 H LEU 46 H LEU 46 -3.182 2.488 5.715 358 HA LEU 46 HA LEU 46 -1.758 4.800 5.064 359 HB2 LEU 46 2HB LEU 46 -2.554 2.471 3.364 360 HB3 LEU 46 1HB LEU 46 -1.399 3.703 2.881 361 HG LEU 46 HG LEU 46 -1.078 1.909 5.282 362 HD11 LEU 46 1HD1 LEU 46 0.650 0.799 3.967 363 HD12 LEU 46 2HD1 LEU 46 0.207 1.795 2.572 364 HD13 LEU 46 3HD1 LEU 46 -0.954 0.648 3.240 365 HD21 LEU 46 1HD2 LEU 46 0.030 4.056 5.541 366 HD22 LEU 46 2HD2 LEU 46 0.797 3.873 3.971 367 HD23 LEU 46 3HD2 LEU 46 1.214 2.777 5.287 368 H LEU 47 H LEU 47 -4.907 3.741 3.930 369 HA LEU 47 HA LEU 47 -5.003 6.005 2.155 370 HB2 LEU 47 2HB LEU 47 -7.138 3.999 2.851 371 HB3 LEU 47 1HB LEU 47 -7.286 5.242 1.624 372 HG LEU 47 HG LEU 47 -5.338 2.932 1.572 373 HD11 LEU 47 1HD1 LEU 47 -6.664 2.159 -0.324 374 HD12 LEU 47 2HD1 LEU 47 -7.808 3.475 -0.052 375 HD13 LEU 47 3HD1 LEU 47 -7.589 2.217 1.172 376 HD21 LEU 47 1HD2 LEU 47 -4.820 3.686 -0.706 377 HD22 LEU 47 2HD2 LEU 47 -4.375 4.901 0.493 378 HD23 LEU 47 3HD2 LEU 47 -5.839 5.103 -0.468 379 H SER 48 H SER 48 -6.123 5.313 5.387 380 HA SER 48 HA SER 48 -7.912 7.626 5.336 381 HB2 SER 48 2HB SER 48 -7.305 5.685 7.536 382 HB3 SER 48 1HB SER 48 -8.611 6.869 7.526 383 HG SER 48 HG SER 48 -8.268 4.530 6.011 384 H GLY 49 H GLY 49 -4.729 6.777 6.565 385 HA2 GLY 49 2HA GLY 49 -3.161 8.054 7.633 386 HA3 GLY 49 1HA GLY 49 -4.175 9.460 7.318 387 H ASP 50 H ASP 50 -5.326 6.640 9.050 388 HA ASP 50 HA ASP 50 -5.505 8.301 11.475 389 HB2 ASP 50 2HB ASP 50 -7.684 7.657 10.354 390 HB3 ASP 50 1HB ASP 50 -7.306 5.986 10.756 391 HA PRO 51 HA PRO 51 -2.636 5.245 12.880 392 HB2 PRO 51 2HB PRO 51 -2.302 6.146 15.382 393 HB3 PRO 51 1HB PRO 51 -1.609 6.939 13.970 394 HG2 PRO 51 2HG PRO 51 -4.087 7.640 15.498 395 HG3 PRO 51 1HG PRO 51 -2.828 8.717 14.870 396 HD2 PRO 51 2HD PRO 51 -5.202 8.336 13.614 397 HD3 PRO 51 1HD PRO 51 -3.700 8.698 12.740 398 H ALA 52 H ALA 52 -5.772 5.609 14.385 399 HA ALA 52 HA ALA 52 -5.504 3.876 16.584 400 HB1 ALA 52 1HB ALA 52 -8.014 4.404 15.002 401 HB2 ALA 52 2HB ALA 52 -7.382 5.432 16.288 402 HB3 ALA 52 3HB ALA 52 -7.927 3.795 16.653 403 H TYR 53 H TYR 53 -5.535 3.053 13.360 404 HA TYR 53 HA TYR 53 -6.752 0.475 13.372 405 HB2 TYR 53 2HB TYR 53 -4.945 1.935 11.475 406 HB3 TYR 53 1HB TYR 53 -5.475 0.268 11.179 407 HD1 TYR 53 1HD TYR 53 -7.630 -0.229 10.544 408 HD2 TYR 53 2HD TYR 53 -6.718 3.720 11.752 409 HE1 TYR 53 1HE TYR 53 -9.815 0.440 9.864 410 HE2 TYR 53 2HE TYR 53 -8.952 4.442 11.080 411 HH TYR 53 HH TYR 53 -10.718 3.667 9.526 412 H ILE 54 H ILE 54 -3.505 1.432 14.310 413 HA ILE 54 HA ILE 54 -2.953 -1.442 14.391 414 HB ILE 54 HB ILE 54 -0.810 0.715 14.806 415 HG12 ILE 54 2HG1 ILE 54 -1.691 0.905 12.510 416 HG13 ILE 54 1HG1 ILE 54 -0.113 0.125 12.501 417 HG21 ILE 54 1HG2 ILE 54 0.742 -1.092 14.420 418 HG22 ILE 54 2HG2 ILE 54 -0.596 -2.229 14.286 419 HG23 ILE 54 3HG2 ILE 54 -0.283 -1.414 15.820 420 HD11 ILE 54 1HD1 ILE 54 -2.764 -1.272 12.233 421 HD12 ILE 54 2HD1 ILE 54 -1.179 -2.049 12.225 422 HD13 ILE 54 3HD1 ILE 54 -1.622 -0.930 10.937 423 HA PRO 55 HA PRO 55 -3.963 -1.097 18.716 424 HB2 PRO 55 2HB PRO 55 -3.235 -3.909 18.883 425 HB3 PRO 55 1HB PRO 55 -4.809 -3.156 19.118 426 HG2 PRO 55 2HG PRO 55 -4.164 -4.705 16.995 427 HG3 PRO 55 1HG PRO 55 -5.411 -3.442 16.947 428 HD2 PRO 55 2HD PRO 55 -2.645 -3.448 15.854 429 HD3 PRO 55 1HD PRO 55 -4.127 -2.655 15.265 430 H ARG 56 H ARG 56 -2.885 -1.004 20.544 431 HA ARG 56 HA ARG 56 -0.032 -1.087 20.270 432 HB2 ARG 56 2HB ARG 56 -0.102 0.073 22.595 433 HB3 ARG 56 1HB ARG 56 -0.550 0.974 21.160 434 HG2 ARG 56 2HG ARG 56 -2.942 0.465 21.681 435 HG3 ARG 56 1HG ARG 56 -2.399 -0.238 23.207 436 HD2 ARG 56 2HD ARG 56 -1.555 1.855 23.956 437 HD3 ARG 56 1HD ARG 56 -1.737 2.572 22.353 438 HE ARG 56 HE ARG 56 -4.199 1.624 23.442 439 HH11 ARG 56 1HH1 ARG 56 -1.958 4.376 23.570 440 HH12 ARG 56 2HH1 ARG 56 -3.182 5.533 23.836 441 HH21 ARG 56 1HH2 ARG 56 -5.856 3.214 23.793 442 HH22 ARG 56 2HH2 ARG 56 -5.435 4.874 23.958 443 H TYR 57 H TYR 57 -0.196 -3.351 20.096 444 HA TYR 57 HA TYR 57 0.137 -4.673 22.701 445 HB2 TYR 57 2HB TYR 57 -1.269 -5.935 21.209 446 HB3 TYR 57 1HB TYR 57 -0.118 -5.773 19.893 447 HD1 TYR 57 1HD TYR 57 -0.168 -7.151 23.396 448 HD2 TYR 57 2HD TYR 57 1.117 -7.645 19.373 449 HE1 TYR 57 1HE TYR 57 0.847 -9.316 23.989 450 HE2 TYR 57 2HE TYR 57 2.133 -9.803 19.954 451 HH TYR 57 HH TYR 57 1.531 -11.406 22.872 452 H GLN 58 H GLN 58 1.863 -3.766 19.805 453 HA GLN 58 HA GLN 58 4.350 -4.388 21.170 454 HB2 GLN 58 2HB GLN 58 3.706 -5.059 18.296 455 HB3 GLN 58 1HB GLN 58 5.330 -5.056 18.959 456 HG2 GLN 58 2HG GLN 58 4.726 -6.829 20.495 457 HG3 GLN 58 1HG GLN 58 3.068 -6.800 19.904 458 HE21 GLN 58 1HE2 GLN 58 6.340 -7.728 19.210 459 HE22 GLN 58 2HE2 GLN 58 5.965 -8.697 17.841 460 H ASP 59 H ASP 59 6.152 -3.306 20.136 461 HA ASP 59 HA ASP 59 5.780 -0.558 19.958 462 HB2 ASP 59 2HB ASP 59 8.202 -0.504 19.237 463 HB3 ASP 59 1HB ASP 59 7.868 -1.337 20.748 464 H ALA 60 H ALA 60 5.324 -2.840 17.539 465 HA ALA 60 HA ALA 60 5.936 -1.486 15.165 466 HB1 ALA 60 1HB ALA 60 5.171 -3.815 15.258 467 HB2 ALA 60 2HB ALA 60 4.236 -2.869 14.100 468 HB3 ALA 60 3HB ALA 60 3.552 -3.265 15.679 469 H ARG 61 H ARG 61 3.212 -1.160 17.322 470 HA ARG 61 HA ARG 61 1.510 0.489 15.917 471 HB2 ARG 61 2HB ARG 61 1.055 -0.765 17.989 472 HB3 ARG 61 1HB ARG 61 2.147 0.267 18.864 473 HG2 ARG 61 2HG ARG 61 -0.340 1.279 17.544 474 HG3 ARG 61 1HG ARG 61 -0.365 0.602 19.156 475 HD2 ARG 61 2HD ARG 61 1.369 2.356 19.763 476 HD3 ARG 61 1HD ARG 61 1.040 3.088 18.192 477 HE ARG 61 HE ARG 61 -1.404 2.718 19.313 478 HH11 ARG 61 1HH1 ARG 61 1.494 4.570 20.234 479 HH12 ARG 61 2HH1 ARG 61 0.626 5.702 21.147 480 HH21 ARG 61 1HH2 ARG 61 -2.566 4.283 20.601 481 HH22 ARG 61 2HH2 ARG 61 -1.705 5.534 21.350 482 H ASN 62 H ASN 62 4.343 1.222 17.903 483 HA ASN 62 HA ASN 62 4.111 4.064 17.565 484 HB2 ASN 62 2HB ASN 62 5.215 3.119 19.557 485 HB3 ASN 62 1HB ASN 62 6.437 2.382 18.533 486 HD21 ASN 62 1HD2 ASN 62 5.292 5.337 19.928 487 HD22 ASN 62 2HD2 ASN 62 6.693 6.283 19.535 488 H LEU 63 H LEU 63 6.036 1.463 16.178 489 HA LEU 63 HA LEU 63 7.835 2.872 14.600 490 HB2 LEU 63 2HB LEU 63 6.509 0.236 13.960 491 HB3 LEU 63 1HB LEU 63 7.908 0.873 13.134 492 HG LEU 63 HG LEU 63 7.804 0.007 16.032 493 HD11 LEU 63 1HD1 LEU 63 9.122 -1.249 13.622 494 HD12 LEU 63 2HD1 LEU 63 7.695 -1.875 14.435 495 HD13 LEU 63 3HD1 LEU 63 9.242 -1.826 15.278 496 HD21 LEU 63 1HD2 LEU 63 10.095 0.918 14.321 497 HD22 LEU 63 2HD2 LEU 63 10.222 0.259 15.950 498 HD23 LEU 63 3HD2 LEU 63 9.411 1.815 15.687 499 H ILE 64 H ILE 64 4.565 1.749 13.721 500 HA ILE 64 HA ILE 64 4.745 2.652 11.056 501 HB ILE 64 HB ILE 64 3.119 0.909 11.847 502 HG12 ILE 64 2HG1 ILE 64 1.816 3.253 10.431 503 HG13 ILE 64 1HG1 ILE 64 2.866 2.075 9.655 504 HG21 ILE 64 1HG2 ILE 64 1.622 3.286 12.972 505 HG22 ILE 64 2HG2 ILE 64 2.352 1.974 13.894 506 HG23 ILE 64 3HG2 ILE 64 0.973 1.660 12.843 507 HD11 ILE 64 1HD1 ILE 64 1.257 0.308 10.203 508 HD12 ILE 64 2HD1 ILE 64 0.548 1.577 9.206 509 HD13 ILE 64 3HD1 ILE 64 0.201 1.516 10.935 510 H ARG 65 H ARG 65 3.915 4.288 13.996 511 HA ARG 65 HA ARG 65 2.626 6.481 12.664 512 HB2 ARG 65 2HB ARG 65 3.577 6.237 15.519 513 HB3 ARG 65 1HB ARG 65 2.679 7.600 14.883 514 HG2 ARG 65 2HG ARG 65 0.801 6.035 14.370 515 HG3 ARG 65 1HG ARG 65 1.721 4.764 15.178 516 HD2 ARG 65 2HD ARG 65 1.749 6.047 17.234 517 HD3 ARG 65 1HD ARG 65 0.902 7.371 16.447 518 HE ARG 65 HE ARG 65 -0.380 4.740 16.611 519 HH11 ARG 65 1HH1 ARG 65 -0.421 8.208 17.441 520 HH12 ARG 65 2HH1 ARG 65 -1.883 8.050 18.354 521 HH21 ARG 65 1HH2 ARG 65 -2.432 4.683 17.809 522 HH22 ARG 65 2HH2 ARG 65 -2.966 6.150 18.555 523 H ARG 66 H ARG 66 5.807 5.585 13.065 524 HA ARG 66 HA ARG 66 6.940 8.221 13.333 525 HB2 ARG 66 2HB ARG 66 8.275 5.638 12.483 526 HB3 ARG 66 1HB ARG 66 9.104 7.124 12.905 527 HG2 ARG 66 2HG ARG 66 8.267 6.933 15.202 528 HG3 ARG 66 1HG ARG 66 7.433 5.441 14.762 529 HD2 ARG 66 2HD ARG 66 9.624 4.443 14.158 530 HD3 ARG 66 1HD ARG 66 10.416 5.918 14.704 531 HE ARG 66 HE ARG 66 8.767 4.924 16.755 532 HH11 ARG 66 1HH1 ARG 66 11.822 4.154 15.185 533 HH12 ARG 66 2HH1 ARG 66 12.471 3.322 16.523 534 HH21 ARG 66 1HH2 ARG 66 9.588 3.799 18.541 535 HH22 ARG 66 2HH2 ARG 66 11.145 3.100 18.513 536 H HIS 67 H HIS 67 5.438 6.611 10.803 537 HA HIS 67 HA HIS 67 6.858 8.256 8.842 538 HB2 HIS 67 2HB HIS 67 5.988 5.385 8.379 539 HB3 HIS 67 1HB HIS 67 6.778 6.431 7.209 540 HD1 HIS 67 1HD HIS 67 9.391 6.810 7.530 541 HD2 HIS 67 2HD HIS 67 7.648 4.210 10.273 542 HE1 HIS 67 1HE HIS 67 11.275 5.643 8.646 543 HE2 HIS 67 2HE HIS 67 10.184 4.449 10.554 544 H GLU 68 H GLU 68 5.503 9.144 7.291 545 HA GLU 68 HA GLU 68 2.730 9.141 7.980 546 HB2 GLU 68 2HB GLU 68 4.128 10.452 5.652 547 HB3 GLU 68 1HB GLU 68 2.448 10.709 6.100 548 HG2 GLU 68 2HG GLU 68 4.887 11.444 7.695 549 HG3 GLU 68 1HG GLU 68 3.766 12.539 6.895 550 H ARG 69 H ARG 69 1.035 8.826 6.404 551 HA ARG 69 HA ARG 69 1.025 6.222 5.406 552 HB2 ARG 69 2HB ARG 69 -1.118 6.827 4.310 553 HB3 ARG 69 1HB ARG 69 -1.056 7.340 5.992 554 HG2 ARG 69 2HG ARG 69 -0.580 9.553 5.360 555 HG3 ARG 69 1HG ARG 69 -0.462 9.102 3.652 556 HD2 ARG 69 2HD ARG 69 -2.883 8.476 3.727 557 HD3 ARG 69 1HD ARG 69 -2.954 9.059 5.392 558 HE ARG 69 HE ARG 69 -1.921 11.133 3.956 559 HH11 ARG 69 1HH1 ARG 69 -4.991 9.305 3.813 560 HH12 ARG 69 2HH1 ARG 69 -5.871 10.609 3.165 561 HH21 ARG 69 1HH2 ARG 69 -3.198 12.922 3.019 562 HH22 ARG 69 2HH2 ARG 69 -4.840 12.678 2.692 563 H ASP 70 H ASP 70 1.594 9.301 3.680 564 HA ASP 70 HA ASP 70 1.659 8.019 1.131 565 HB2 ASP 70 2HB ASP 70 2.355 10.177 0.217 566 HB3 ASP 70 1HB ASP 70 1.001 10.388 1.317 567 H GLU 71 H GLU 71 4.006 8.871 3.537 568 HA GLU 71 HA GLU 71 6.415 8.510 2.148 569 HB2 GLU 71 2HB GLU 71 6.360 9.306 4.453 570 HB3 GLU 71 1HB GLU 71 5.631 7.802 4.986 571 HG2 GLU 71 2HG GLU 71 7.876 7.678 5.638 572 HG3 GLU 71 1HG GLU 71 7.704 6.653 4.229 573 H ILE 72 H ILE 72 4.442 6.220 3.962 574 HA ILE 72 HA ILE 72 5.897 3.902 3.295 575 HB ILE 72 HB ILE 72 3.001 4.174 4.148 576 HG12 ILE 72 2HG1 ILE 72 5.496 3.639 5.790 577 HG13 ILE 72 1HG1 ILE 72 4.604 5.152 5.743 578 HG21 ILE 72 1HG2 ILE 72 3.427 1.998 3.122 579 HG22 ILE 72 2HG2 ILE 72 3.199 1.824 4.863 580 HG23 ILE 72 3HG2 ILE 72 4.820 1.758 4.178 581 HD11 ILE 72 1HD1 ILE 72 3.545 2.522 6.762 582 HD12 ILE 72 2HD1 ILE 72 2.673 4.054 6.744 583 HD13 ILE 72 3HD1 ILE 72 4.107 3.869 7.755 584 H MET 73 H MET 73 2.968 5.364 1.936 585 HA MET 73 HA MET 73 2.316 3.484 0.019 586 HB2 MET 73 2HB MET 73 0.905 5.465 0.581 587 HB3 MET 73 1HB MET 73 2.087 6.474 -0.232 588 HG2 MET 73 2HG MET 73 0.144 6.044 -1.607 589 HG3 MET 73 1HG MET 73 1.633 5.409 -2.314 590 HE1 MET 73 1HE MET 73 0.231 3.950 -3.993 591 HE2 MET 73 2HE MET 73 -1.255 4.593 -3.300 592 HE3 MET 73 3HE MET 73 -1.051 2.852 -3.494 593 H GLU 74 H GLU 74 4.555 6.219 -0.247 594 HA GLU 74 HA GLU 74 5.201 5.795 -2.915 595 HB2 GLU 74 2HB GLU 74 6.663 7.192 -0.703 596 HB3 GLU 74 1HB GLU 74 7.344 7.020 -2.314 597 HG2 GLU 74 2HG GLU 74 4.641 8.254 -1.798 598 HG3 GLU 74 1HG GLU 74 6.132 9.193 -1.885 599 H GLU 75 H GLU 75 6.644 4.426 -0.010 600 HA GLU 75 HA GLU 75 8.731 3.227 -1.519 601 HB2 GLU 75 2HB GLU 75 8.863 3.705 0.949 602 HB3 GLU 75 1HB GLU 75 7.737 2.369 1.188 603 HG2 GLU 75 2HG GLU 75 9.315 0.798 0.305 604 HG3 GLU 75 1HG GLU 75 10.422 2.087 -0.140 605 H LEU 76 H LEU 76 5.531 2.227 -0.513 606 HA LEU 76 HA LEU 76 5.578 -0.465 -1.320 607 HB2 LEU 76 2HB LEU 76 3.289 1.487 -1.651 608 HB3 LEU 76 1HB LEU 76 3.161 -0.255 -1.659 609 HG LEU 76 HG LEU 76 3.836 1.491 0.708 610 HD11 LEU 76 1HD1 LEU 76 1.705 0.715 1.570 611 HD12 LEU 76 2HD1 LEU 76 1.417 -0.176 0.077 612 HD13 LEU 76 3HD1 LEU 76 1.494 1.584 0.049 613 HD21 LEU 76 1HD2 LEU 76 3.515 -1.499 0.548 614 HD22 LEU 76 2HD2 LEU 76 3.710 -0.555 2.025 615 HD23 LEU 76 3HD2 LEU 76 5.020 -0.632 0.851 616 H THR 77 H THR 77 4.752 2.509 -3.084 617 HA THR 77 HA THR 77 4.195 1.367 -5.535 618 HB THR 77 HB THR 77 5.276 4.149 -4.976 619 HG1 THR 77 1HG THR 77 3.385 3.813 -3.758 620 HG21 THR 77 1HG2 THR 77 5.281 3.529 -7.371 621 HG22 THR 77 2HG2 THR 77 4.064 4.761 -7.030 622 HG23 THR 77 3HG2 THR 77 3.582 3.079 -7.252 623 H LYS 78 H LYS 78 7.374 2.730 -4.330 624 HA LYS 78 HA LYS 78 8.773 2.250 -6.688 625 HB2 LYS 78 2HB LYS 78 9.588 2.562 -3.850 626 HB3 LYS 78 1HB LYS 78 10.737 1.844 -4.943 627 HG2 LYS 78 2HG LYS 78 11.242 4.070 -4.642 628 HG3 LYS 78 1HG LYS 78 10.629 3.992 -6.310 629 HD2 LYS 78 2HD LYS 78 9.326 5.065 -3.789 630 HD3 LYS 78 1HD LYS 78 10.072 6.012 -5.063 631 HE2 LYS 78 2HE LYS 78 8.352 5.297 -6.585 632 HE3 LYS 78 1HE LYS 78 7.600 4.355 -5.286 633 HZ1 LYS 78 1HZ LYS 78 8.077 7.266 -5.291 634 HZ2 LYS 78 2HZ LYS 78 7.537 6.420 -3.974 635 HZ3 LYS 78 3HZ LYS 78 6.553 6.573 -5.328 636 H TYR 79 H TYR 79 8.474 0.188 -3.794 637 HA TYR 79 HA TYR 79 10.230 -1.720 -4.837 638 HB2 TYR 79 2HB TYR 79 9.861 -1.521 -2.444 639 HB3 TYR 79 1HB TYR 79 8.204 -2.099 -2.643 640 HD1 TYR 79 1HD TYR 79 11.731 -3.028 -3.067 641 HD2 TYR 79 2HD TYR 79 7.742 -4.401 -2.777 642 HE1 TYR 79 1HE TYR 79 12.553 -5.340 -2.921 643 HE2 TYR 79 2HE TYR 79 8.539 -6.721 -2.625 644 HH TYR 79 HH TYR 79 11.771 -7.509 -2.046 645 H TYR 80 H TYR 80 6.683 -1.585 -4.936 646 HA TYR 80 HA TYR 80 6.398 -4.208 -5.896 647 HB2 TYR 80 2HB TYR 80 4.466 -2.976 -4.996 648 HB3 TYR 80 1HB TYR 80 4.548 -1.842 -6.342 649 HD1 TYR 80 1HD TYR 80 3.635 -5.293 -5.352 650 HD2 TYR 80 2HD TYR 80 3.743 -2.457 -8.540 651 HE1 TYR 80 1HE TYR 80 2.195 -6.748 -6.702 652 HE2 TYR 80 2HE TYR 80 2.296 -3.911 -9.884 653 HH TYR 80 HH TYR 80 0.628 -6.596 -8.645 654 H LEU 81 H LEU 81 6.887 -1.167 -7.583 655 HA LEU 81 HA LEU 81 6.662 -2.367 -10.153 656 HB2 LEU 81 2HB LEU 81 7.881 0.255 -9.364 657 HB3 LEU 81 1HB LEU 81 7.518 -0.262 -11.002 658 HG LEU 81 HG LEU 81 5.485 0.226 -8.819 659 HD11 LEU 81 1HD1 LEU 81 6.083 1.749 -11.319 660 HD12 LEU 81 2HD1 LEU 81 6.486 2.264 -9.677 661 HD13 LEU 81 3HD1 LEU 81 4.794 2.107 -10.171 662 HD21 LEU 81 1HD2 LEU 81 3.830 -0.074 -10.568 663 HD22 LEU 81 2HD2 LEU 81 4.759 -1.552 -10.318 664 HD23 LEU 81 3HD2 LEU 81 5.099 -0.522 -11.713 665 H ALA 82 H ALA 82 9.350 -1.695 -7.977 666 HA ALA 82 HA ALA 82 11.439 -1.867 -9.807 667 HB1 ALA 82 1HB ALA 82 11.670 -0.958 -7.549 668 HB2 ALA 82 2HB ALA 82 12.890 -2.182 -7.909 669 HB3 ALA 82 3HB ALA 82 11.511 -2.588 -6.889 670 H ASN 83 H ASN 83 9.756 -4.422 -8.100 671 HA ASN 83 HA ASN 83 11.749 -6.368 -8.771 672 HB2 ASN 83 2HB ASN 83 10.283 -8.089 -7.824 673 HB3 ASN 83 1HB ASN 83 10.424 -6.713 -6.746 674 HD21 ASN 83 1HD2 ASN 83 8.628 -5.433 -6.363 675 HD22 ASN 83 2HD2 ASN 83 7.056 -5.935 -6.861 676 H HIS 84 H HIS 84 9.688 -4.893 -10.776 677 HA HIS 84 HA HIS 84 9.143 -7.252 -12.424 678 HB2 HIS 84 2HB HIS 84 8.542 -4.314 -12.882 679 HB3 HIS 84 1HB HIS 84 8.222 -5.557 -14.080 680 HD1 HIS 84 1HD HIS 84 6.085 -6.787 -13.862 681 HD2 HIS 84 2HD HIS 84 6.895 -4.437 -10.573 682 HE1 HIS 84 1HE HIS 84 3.999 -6.869 -12.457 683 HE2 HIS 84 2HE HIS 84 4.797 -5.919 -10.307 684 H GLY 85 H GLY 85 11.865 -5.879 -11.731 685 HA2 GLY 85 2HA GLY 85 13.892 -5.815 -12.839 686 HA3 GLY 85 1HA GLY 85 13.067 -6.315 -14.311 687 H ILE 86 H ILE 86 11.879 -3.705 -12.481 688 HA ILE 86 HA ILE 86 12.430 -1.944 -14.718 689 HB ILE 86 HB ILE 86 10.348 -1.790 -12.531 690 HG12 ILE 86 2HG1 ILE 86 10.117 -2.103 -15.530 691 HG13 ILE 86 1HG1 ILE 86 9.849 -3.369 -14.337 692 HG21 ILE 86 1HG2 ILE 86 9.494 0.247 -13.604 693 HG22 ILE 86 2HG2 ILE 86 10.864 0.227 -14.708 694 HG23 ILE 86 3HG2 ILE 86 11.133 0.474 -12.984 695 HD11 ILE 86 1HD1 ILE 86 8.227 -0.859 -14.664 696 HD12 ILE 86 2HD1 ILE 86 7.923 -2.124 -13.475 697 HD13 ILE 86 3HD1 ILE 86 7.752 -2.473 -15.201 698 H ASP 87 H ASP 87 13.746 -0.330 -14.521 699 HA ASP 87 HA ASP 87 14.855 0.324 -11.902 700 HB2 ASP 87 2HB ASP 87 15.642 1.257 -14.675 701 HB3 ASP 87 1HB ASP 87 16.447 1.757 -13.193 702 H ILE 88 H ILE 88 14.238 2.088 -10.837 703 HA ILE 88 HA ILE 88 12.184 3.640 -12.169 704 HB ILE 88 HB ILE 88 12.752 3.367 -9.228 705 HG12 ILE 88 2HG1 ILE 88 10.545 2.217 -10.946 706 HG13 ILE 88 1HG1 ILE 88 11.885 1.313 -10.260 707 HG21 ILE 88 1HG2 ILE 88 10.601 4.527 -8.901 708 HG22 ILE 88 2HG2 ILE 88 10.485 4.776 -10.645 709 HG23 ILE 88 3HG2 ILE 88 11.781 5.542 -9.735 710 HD11 ILE 88 1HD1 ILE 88 9.712 2.711 -8.730 711 HD12 ILE 88 2HD1 ILE 88 11.059 1.818 -8.022 712 HD13 ILE 88 3HD1 ILE 88 9.861 0.973 -9.001 713 H LYS 89 H LYS 89 12.329 5.585 -12.541 714 HA LYS 89 HA LYS 89 14.547 7.224 -11.482 715 HB2 LYS 89 2HB LYS 89 13.415 7.370 -14.307 716 HB3 LYS 89 1HB LYS 89 14.575 8.485 -13.628 717 HG2 LYS 89 2HG LYS 89 15.734 7.010 -15.103 718 HG3 LYS 89 1HG LYS 89 16.191 6.584 -13.461 719 HD2 LYS 89 2HD LYS 89 14.628 4.705 -13.511 720 HD3 LYS 89 1HD LYS 89 14.138 5.153 -15.144 721 HE2 LYS 89 2HE LYS 89 16.921 4.352 -14.316 722 HE3 LYS 89 1HE LYS 89 15.760 3.299 -15.116 723 HZ1 LYS 89 1HZ LYS 89 17.301 4.216 -16.692 724 HZ2 LYS 89 2HZ LYS 89 16.907 5.797 -16.255 725 HZ3 LYS 89 3HZ LYS 89 15.765 4.797 -16.997 726 H1 MET 1 H MET 1 -5.512 13.032 17.550 727 HA MET 1 HA MET 1 -4.650 14.548 19.270 728 HB2 MET 1 2HB MET 1 -2.229 14.916 19.402 729 HB3 MET 1 1HB MET 1 -2.671 13.258 19.782 730 HG2 MET 1 2HG MET 1 -1.960 12.572 17.530 731 HG3 MET 1 1HG MET 1 -1.509 14.237 17.172 732 HE1 MET 1 1HE MET 1 -0.225 15.137 19.993 733 HE2 MET 1 2HE MET 1 0.488 15.521 18.425 734 HE3 MET 1 3HE MET 1 1.476 14.792 19.688 735 H GLY 2 H GLY 2 -4.158 14.015 15.961 736 HA2 GLY 2 2HA GLY 2 -3.896 16.921 15.539 737 HA3 GLY 2 1HA GLY 2 -3.279 15.713 14.423 738 H PHE 3 H PHE 3 -4.408 15.702 12.652 739 HA PHE 3 HA PHE 3 -7.305 16.132 12.748 740 HB2 PHE 3 2HB PHE 3 -6.021 17.748 11.396 741 HB3 PHE 3 1HB PHE 3 -5.304 16.425 10.496 742 HD1 PHE 3 1HD PHE 3 -8.338 18.402 11.044 743 HD2 PHE 3 2HD PHE 3 -6.530 15.319 8.736 744 HE1 PHE 3 1HE PHE 3 -10.146 18.579 9.382 745 HE2 PHE 3 2HE PHE 3 -8.335 15.493 7.082 746 HZ PHE 3 HZ PHE 3 -10.143 17.127 7.405 747 H THR 4 H THR 4 -8.568 14.415 12.185 748 HA THR 4 HA THR 4 -7.177 12.122 11.048 749 HB THR 4 HB THR 4 -9.070 10.769 12.035 750 HG1 THR 4 1HG THR 4 -10.375 12.689 12.278 751 HG21 THR 4 1HG2 THR 4 -7.369 12.344 13.976 752 HG22 THR 4 2HG2 THR 4 -6.868 10.887 13.118 753 HG23 THR 4 3HG2 THR 4 -8.156 10.803 14.320 754 H ASP 5 H ASP 5 -7.533 11.966 8.997 755 HA ASP 5 HA ASP 5 -9.632 13.154 7.522 756 HB2 ASP 5 2HB ASP 5 -7.383 12.514 6.637 757 HB3 ASP 5 1HB ASP 5 -7.803 10.825 6.842 758 H GLU 6 H GLU 6 -11.556 12.107 6.613 759 HA GLU 6 HA GLU 6 -12.568 10.171 8.393 760 HB2 GLU 6 2HB GLU 6 -14.655 10.103 6.924 761 HB3 GLU 6 1HB GLU 6 -14.261 11.648 7.636 762 HG2 GLU 6 2HG GLU 6 -13.616 10.893 4.792 763 HG3 GLU 6 1HG GLU 6 -15.099 11.707 5.278 764 H THR 7 H THR 7 -12.078 8.325 8.538 765 HA THR 7 HA THR 7 -10.455 6.968 6.796 766 HB THR 7 HB THR 7 -10.366 6.621 9.175 767 HG1 THR 7 1HG THR 7 -9.929 4.873 7.551 768 HG21 THR 7 1HG2 THR 7 -13.074 5.300 8.893 769 HG22 THR 7 2HG2 THR 7 -12.746 6.818 9.728 770 HG23 THR 7 3HG2 THR 7 -12.089 5.303 10.354 771 H VAL 8 H VAL 8 -10.614 5.270 5.529 772 HA VAL 8 HA VAL 8 -13.253 4.245 4.844 773 HB VAL 8 HB VAL 8 -12.281 5.576 2.979 774 HG11 VAL 8 1HG1 VAL 8 -10.259 4.854 1.798 775 HG12 VAL 8 2HG1 VAL 8 -9.969 3.659 3.061 776 HG13 VAL 8 3HG1 VAL 8 -9.930 5.378 3.449 777 HG21 VAL 8 1HG2 VAL 8 -12.305 2.614 2.412 778 HG22 VAL 8 2HG2 VAL 8 -12.382 3.881 1.189 779 HG23 VAL 8 3HG2 VAL 8 -13.688 3.708 2.359 780 H ARG 9 H ARG 9 -13.431 1.999 4.950 781 HA ARG 9 HA ARG 9 -10.995 0.596 5.840 782 HB2 ARG 9 2HB ARG 9 -13.834 0.146 6.769 783 HB3 ARG 9 1HB ARG 9 -12.442 -0.811 7.263 784 HG2 ARG 9 2HG ARG 9 -11.435 1.182 8.264 785 HG3 ARG 9 1HG ARG 9 -12.834 2.127 7.769 786 HD2 ARG 9 2HD ARG 9 -12.990 1.524 10.116 787 HD3 ARG 9 1HD ARG 9 -14.269 0.747 9.193 788 HE ARG 9 HE ARG 9 -12.788 -1.281 9.240 789 HH11 ARG 9 1HH1 ARG 9 -12.634 1.132 11.848 790 HH12 ARG 9 2HH1 ARG 9 -12.152 0.010 13.023 791 HH21 ARG 9 1HH2 ARG 9 -12.172 -2.806 10.889 792 HH22 ARG 9 2HH2 ARG 9 -11.891 -2.277 12.476 793 H PHE 10 H PHE 10 -10.595 -1.471 5.126 794 HA PHE 10 HA PHE 10 -12.488 -2.652 3.268 795 HB2 PHE 10 2HB PHE 10 -9.499 -2.392 2.774 796 HB3 PHE 10 1HB PHE 10 -10.614 -3.309 1.769 797 HD1 PHE 10 1HD PHE 10 -12.498 -2.025 0.631 798 HD2 PHE 10 2HD PHE 10 -9.118 -0.123 2.365 799 HE1 PHE 10 1HE PHE 10 -12.935 -0.027 -0.728 800 HE2 PHE 10 2HE PHE 10 -9.560 1.888 1.011 801 HZ PHE 10 HZ PHE 10 -11.464 1.933 -0.536 802 H ASP 11 H ASP 11 -13.089 -4.179 4.678 803 HA ASP 11 HA ASP 11 -11.136 -5.494 6.387 804 HB2 ASP 11 2HB ASP 11 -13.453 -4.658 7.094 805 HB3 ASP 11 1HB ASP 11 -14.101 -6.027 6.219 806 H PHE 12 H PHE 12 -12.032 -8.016 6.680 807 HA PHE 12 HA PHE 12 -11.866 -10.124 5.908 808 HB2 PHE 12 2HB PHE 12 -12.974 -8.937 3.338 809 HB3 PHE 12 1HB PHE 12 -12.870 -10.655 3.678 810 HD1 PHE 12 1HD PHE 12 -14.758 -7.620 4.137 811 HD2 PHE 12 2HD PHE 12 -14.279 -11.621 5.506 812 HE1 PHE 12 1HE PHE 12 -16.995 -7.536 5.150 813 HE2 PHE 12 2HE PHE 12 -16.521 -11.544 6.521 814 HZ PHE 12 HZ PHE 12 -17.880 -9.503 6.346 815 H ASP 13 H ASP 13 -11.176 -11.193 3.499 816 HA ASP 13 HA ASP 13 -8.698 -9.985 2.562 817 HB2 ASP 13 2HB ASP 13 -8.002 -11.592 4.308 818 HB3 ASP 13 1HB ASP 13 -8.994 -12.838 3.567 819 H ASP 14 H ASP 14 -9.041 -9.856 0.434 820 HA ASP 14 HA ASP 14 -11.041 -11.604 -0.693 821 HB2 ASP 14 2HB ASP 14 -9.714 -9.175 -1.887 822 HB3 ASP 14 1HB ASP 14 -10.773 -10.228 -2.814 823 H ASN 15 H ASN 15 -8.346 -10.506 -2.614 824 HA ASN 15 HA ASN 15 -6.866 -12.837 -2.792 825 HB2 ASN 15 2HB ASN 15 -8.952 -13.903 -3.642 826 HB3 ASN 15 1HB ASN 15 -9.058 -12.677 -4.897 827 HD21 ASN 15 1HD2 ASN 15 -7.418 -15.557 -3.823 828 HD22 ASN 15 2HD2 ASN 15 -6.603 -15.872 -5.306 829 H ARG 16 H ARG 16 -5.178 -12.499 -4.187 830 HA ARG 16 HA ARG 16 -4.847 -9.855 -5.219 831 HB2 ARG 16 2HB ARG 16 -3.140 -12.319 -5.343 832 HB3 ARG 16 1HB ARG 16 -2.680 -10.794 -6.076 833 HG2 ARG 16 2HG ARG 16 -2.654 -9.724 -3.916 834 HG3 ARG 16 1HG ARG 16 -3.228 -11.210 -3.147 835 HD2 ARG 16 2HD ARG 16 -0.778 -10.875 -2.955 836 HD3 ARG 16 1HD ARG 16 -1.225 -12.374 -3.768 837 HE ARG 16 HE ARG 16 -0.848 -10.325 -5.680 838 HH11 ARG 16 1HH1 ARG 16 1.020 -12.385 -3.495 839 HH12 ARG 16 2HH1 ARG 16 2.398 -12.442 -4.486 840 HH21 ARG 16 1HH2 ARG 16 0.995 -10.380 -7.034 841 HH22 ARG 16 2HH2 ARG 16 2.402 -11.249 -6.575 842 H LYS 17 H LYS 17 -5.865 -9.312 -7.004 843 HA LYS 17 HA LYS 17 -6.358 -11.190 -9.114 844 HB2 LYS 17 2HB LYS 17 -7.939 -9.386 -8.660 845 HB3 LYS 17 1HB LYS 17 -6.704 -8.184 -8.982 846 HG2 LYS 17 2HG LYS 17 -6.633 -8.816 -11.315 847 HG3 LYS 17 1HG LYS 17 -7.778 -10.124 -11.020 848 HD2 LYS 17 2HD LYS 17 -8.360 -7.197 -10.586 849 HD3 LYS 17 1HD LYS 17 -8.811 -8.116 -12.024 850 HE2 LYS 17 2HE LYS 17 -10.222 -9.581 -10.686 851 HE3 LYS 17 1HE LYS 17 -9.729 -8.767 -9.206 852 HZ1 LYS 17 1HZ LYS 17 -11.185 -7.397 -11.423 853 HZ2 LYS 17 2HZ LYS 17 -10.783 -6.794 -9.910 854 HZ3 LYS 17 3HZ LYS 17 -11.916 -8.026 -10.012 855 H LYS 18 H LYS 18 -4.742 -11.870 -10.285 856 HA LYS 18 HA LYS 18 -2.209 -10.714 -10.176 857 HB2 LYS 18 2HB LYS 18 -3.214 -12.856 -12.011 858 HB3 LYS 18 1HB LYS 18 -1.521 -12.387 -11.882 859 HG2 LYS 18 2HG LYS 18 -1.557 -12.964 -9.496 860 HG3 LYS 18 1HG LYS 18 -3.231 -13.483 -9.660 861 HD2 LYS 18 2HD LYS 18 -0.877 -14.656 -11.133 862 HD3 LYS 18 1HD LYS 18 -1.636 -15.361 -9.709 863 HE2 LYS 18 2HE LYS 18 -3.730 -15.602 -10.958 864 HE3 LYS 18 1HE LYS 18 -2.960 -14.900 -12.384 865 HZ1 LYS 18 1HZ LYS 18 -2.173 -17.431 -11.044 866 HZ2 LYS 18 2HZ LYS 18 -1.413 -16.758 -12.398 867 HZ3 LYS 18 3HZ LYS 18 -3.003 -17.291 -12.495 868 H ALA 19 H ALA 19 -4.698 -9.973 -12.321 869 HA ALA 19 HA ALA 19 -3.303 -9.098 -14.592 870 HB1 ALA 19 1HB ALA 19 -5.168 -7.652 -15.004 871 HB2 ALA 19 2HB ALA 19 -5.700 -7.910 -13.334 872 HB3 ALA 19 3HB ALA 19 -5.722 -9.265 -14.474 873 H ILE 20 H ILE 20 -3.635 -7.648 -11.442 874 HA ILE 20 HA ILE 20 -3.171 -4.945 -11.936 875 HB ILE 20 HB ILE 20 -2.253 -6.628 -9.585 876 HG12 ILE 20 2HG1 ILE 20 -4.737 -4.930 -9.876 877 HG13 ILE 20 1HG1 ILE 20 -4.698 -6.681 -10.053 878 HG21 ILE 20 1HG2 ILE 20 -1.055 -4.506 -9.635 879 HG22 ILE 20 2HG2 ILE 20 -2.215 -4.526 -8.308 880 HG23 ILE 20 3HG2 ILE 20 -2.579 -3.631 -9.784 881 HD11 ILE 20 1HD1 ILE 20 -5.487 -6.032 -7.851 882 HD12 ILE 20 2HD1 ILE 20 -3.987 -5.148 -7.561 883 HD13 ILE 20 3HD1 ILE 20 -3.960 -6.895 -7.748 884 H SER 21 H SER 21 -1.055 -7.635 -11.843 885 HA SER 21 HA SER 21 1.349 -6.118 -11.505 886 HB2 SER 21 2HB SER 21 2.575 -8.228 -12.060 887 HB3 SER 21 1HB SER 21 1.380 -8.431 -10.787 888 HG SER 21 HG SER 21 0.004 -9.393 -12.292 889 H GLU 22 H GLU 22 -0.307 -7.418 -14.293 890 HA GLU 22 HA GLU 22 1.718 -6.687 -16.161 891 HB2 GLU 22 2HB GLU 22 -1.203 -7.298 -16.627 892 HB3 GLU 22 1HB GLU 22 0.057 -7.255 -17.857 893 HG2 GLU 22 2HG GLU 22 1.177 -9.127 -16.758 894 HG3 GLU 22 1HG GLU 22 -0.104 -9.166 -15.549 895 H THR 23 H THR 23 -1.163 -5.217 -14.841 896 HA THR 23 HA THR 23 -1.439 -3.108 -16.669 897 HB THR 23 HB THR 23 -2.198 -3.234 -13.743 898 HG1 THR 23 1HG THR 23 -3.170 -4.453 -15.970 899 HG21 THR 23 1HG2 THR 23 -3.865 -1.531 -14.314 900 HG22 THR 23 2HG2 THR 23 -3.239 -1.459 -15.965 901 HG23 THR 23 3HG2 THR 23 -2.230 -0.940 -14.610 902 H LEU 24 H LEU 24 0.128 -3.183 -13.429 903 HA LEU 24 HA LEU 24 0.972 -0.485 -13.708 904 HB2 LEU 24 2HB LEU 24 1.565 -2.558 -11.631 905 HB3 LEU 24 1HB LEU 24 2.417 -1.033 -11.640 906 HG LEU 24 HG LEU 24 0.259 0.158 -11.374 907 HD11 LEU 24 1HD1 LEU 24 -0.944 -2.581 -11.090 908 HD12 LEU 24 2HD1 LEU 24 -1.252 -1.424 -12.384 909 HD13 LEU 24 3HD1 LEU 24 -1.755 -1.053 -10.736 910 HD21 LEU 24 1HD2 LEU 24 -0.119 -0.460 -9.042 911 HD22 LEU 24 2HD2 LEU 24 1.597 -0.355 -9.429 912 HD23 LEU 24 3HD2 LEU 24 0.820 -1.934 -9.285 913 H GLU 25 H GLU 25 2.520 -3.512 -14.376 914 HA GLU 25 HA GLU 25 5.137 -2.612 -14.613 915 HB2 GLU 25 2HB GLU 25 4.417 -4.989 -14.646 916 HB3 GLU 25 1HB GLU 25 3.700 -4.747 -16.225 917 HG2 GLU 25 2HG GLU 25 5.898 -4.340 -17.178 918 HG3 GLU 25 1HG GLU 25 6.628 -4.500 -15.578 919 H THR 26 H THR 26 2.392 -2.639 -16.856 920 HA THR 26 HA THR 26 3.757 -1.560 -19.105 921 HB THR 26 HB THR 26 0.784 -1.626 -18.542 922 HG1 THR 26 1HG THR 26 1.363 -3.735 -18.556 923 HG21 THR 26 1HG2 THR 26 1.506 -0.142 -20.377 924 HG22 THR 26 2HG2 THR 26 0.555 -1.508 -20.975 925 HG23 THR 26 3HG2 THR 26 2.319 -1.493 -21.144 926 H VAL 27 H VAL 27 1.589 -0.177 -16.616 927 HA VAL 27 HA VAL 27 1.229 2.362 -17.682 928 HB VAL 27 HB VAL 27 1.297 1.575 -14.743 929 HG11 VAL 27 1HG1 VAL 27 1.641 3.989 -14.990 930 HG12 VAL 27 2HG1 VAL 27 0.031 3.645 -14.343 931 HG13 VAL 27 3HG1 VAL 27 0.231 4.075 -16.042 932 HG21 VAL 27 1HG2 VAL 27 -1.008 1.997 -16.648 933 HG22 VAL 27 2HG2 VAL 27 -1.138 1.600 -14.935 934 HG23 VAL 27 3HG2 VAL 27 -0.428 0.440 -16.057 935 H TYR 28 H TYR 28 3.872 1.216 -15.659 936 HA TYR 28 HA TYR 28 5.069 3.718 -15.226 937 HB2 TYR 28 2HB TYR 28 5.694 1.624 -13.975 938 HB3 TYR 28 1HB TYR 28 6.508 1.040 -15.420 939 HD1 TYR 28 1HD TYR 28 8.494 2.346 -16.283 940 HD2 TYR 28 2HD TYR 28 6.799 3.100 -12.468 941 HE1 TYR 28 1HE TYR 28 10.531 3.549 -15.614 942 HE2 TYR 28 2HE TYR 28 8.847 4.299 -11.790 943 HH TYR 28 HH TYR 28 11.099 5.262 -14.087 944 H ARG 29 H ARG 29 5.522 1.329 -17.763 945 HA ARG 29 HA ARG 29 7.658 2.550 -19.148 946 HB2 ARG 29 2HB ARG 29 5.526 0.655 -20.135 947 HB3 ARG 29 1HB ARG 29 6.991 1.070 -21.018 948 HG2 ARG 29 2HG ARG 29 6.950 -0.238 -18.304 949 HG3 ARG 29 1HG ARG 29 7.123 -1.104 -19.832 950 HD2 ARG 29 2HD ARG 29 8.992 1.054 -18.838 951 HD3 ARG 29 1HD ARG 29 9.281 -0.679 -18.717 952 HE ARG 29 HE ARG 29 8.871 -0.475 -21.292 953 HH11 ARG 29 1HH1 ARG 29 10.712 1.826 -19.314 954 HH12 ARG 29 2HH1 ARG 29 11.942 2.034 -20.467 955 HH21 ARG 29 1HH2 ARG 29 10.563 -0.135 -22.891 956 HH22 ARG 29 2HH2 ARG 29 11.855 0.911 -22.524 957 H ALA 30 H ALA 30 4.192 2.842 -19.471 958 HA ALA 30 HA ALA 30 4.165 4.298 -21.896 959 HB1 ALA 30 1HB ALA 30 2.119 4.347 -19.675 960 HB2 ALA 30 2HB ALA 30 2.171 3.181 -21.000 961 HB3 ALA 30 3HB ALA 30 1.861 4.886 -21.334 962 H LEU 31 H LEU 31 4.347 5.304 -18.547 963 HA LEU 31 HA LEU 31 4.163 8.066 -19.172 964 HB2 LEU 31 2HB LEU 31 4.919 6.632 -16.648 965 HB3 LEU 31 1HB LEU 31 4.842 8.384 -16.764 966 HG LEU 31 HG LEU 31 2.533 6.622 -17.448 967 HD11 LEU 31 1HD1 LEU 31 3.058 6.304 -15.059 968 HD12 LEU 31 2HD1 LEU 31 1.572 7.211 -15.277 969 HD13 LEU 31 3HD1 LEU 31 3.044 8.072 -14.842 970 HD21 LEU 31 1HD2 LEU 31 2.413 8.788 -18.418 971 HD22 LEU 31 2HD2 LEU 31 2.754 9.550 -16.857 972 HD23 LEU 31 3HD2 LEU 31 1.247 8.673 -17.109 973 H GLU 32 H GLU 32 6.823 5.837 -18.863 974 HA GLU 32 HA GLU 32 8.883 7.781 -18.824 975 HB2 GLU 32 2HB GLU 32 8.912 5.014 -20.043 976 HB3 GLU 32 1HB GLU 32 10.329 6.019 -19.821 977 HG2 GLU 32 2HG GLU 32 9.900 5.954 -17.378 978 HG3 GLU 32 1HG GLU 32 8.600 4.805 -17.692 979 H GLU 33 H GLU 33 7.232 6.105 -21.440 980 HA GLU 33 HA GLU 33 8.667 7.276 -23.559 981 HB2 GLU 33 2HB GLU 33 5.886 6.127 -23.526 982 HB3 GLU 33 1HB GLU 33 6.774 6.544 -24.981 983 HG2 GLU 33 2HG GLU 33 7.519 4.444 -22.957 984 HG3 GLU 33 1HG GLU 33 6.887 4.171 -24.580 985 H LYS 34 H LYS 34 6.021 8.423 -21.679 986 HA LYS 34 HA LYS 34 5.596 10.626 -23.535 987 HB2 LYS 34 2HB LYS 34 4.041 9.754 -21.121 988 HB3 LYS 34 1HB LYS 34 3.681 11.220 -22.019 989 HG2 LYS 34 2HG LYS 34 3.632 8.412 -23.116 990 HG3 LYS 34 1HG LYS 34 2.220 9.365 -22.657 991 HD2 LYS 34 2HD LYS 34 4.198 10.121 -24.824 992 HD3 LYS 34 1HD LYS 34 2.627 9.375 -25.096 993 HE2 LYS 34 2HE LYS 34 1.513 11.286 -24.153 994 HE3 LYS 34 1HE LYS 34 3.056 12.047 -23.759 995 HZ1 LYS 34 1HZ LYS 34 3.547 12.122 -26.145 996 HZ2 LYS 34 2HZ LYS 34 2.120 12.959 -25.780 997 HZ3 LYS 34 3HZ LYS 34 2.064 11.434 -26.496 998 H GLY 35 H GLY 35 7.671 10.076 -21.111 999 HA2 GLY 35 2HA GLY 35 9.132 11.485 -20.061 1000 HA3 GLY 35 1HA GLY 35 8.449 12.795 -21.004 1001 H TYR 36 H TYR 36 6.552 10.828 -18.808 1002 HA TYR 36 HA TYR 36 6.187 13.222 -17.134 1003 HB2 TYR 36 2HB TYR 36 4.501 10.719 -17.354 1004 HB3 TYR 36 1HB TYR 36 4.176 12.030 -16.231 1005 HD1 TYR 36 1HD TYR 36 3.195 10.636 -19.209 1006 HD2 TYR 36 2HD TYR 36 4.108 14.432 -17.529 1007 HE1 TYR 36 1HE TYR 36 1.815 11.733 -20.934 1008 HE2 TYR 36 2HE TYR 36 2.720 15.530 -19.231 1009 HH TYR 36 HH TYR 36 1.913 15.057 -21.482 1010 H ASN 37 H ASN 37 5.403 12.167 -14.788 1011 HA ASN 37 HA ASN 37 7.714 10.581 -13.953 1012 HB2 ASN 37 2HB ASN 37 5.775 12.248 -12.313 1013 HB3 ASN 37 1HB ASN 37 7.029 11.240 -11.610 1014 HD21 ASN 37 1HD2 ASN 37 7.991 12.990 -10.604 1015 HD22 ASN 37 2HD2 ASN 37 8.875 14.189 -11.456 1016 HA PRO 38 HA PRO 38 4.704 7.191 -14.439 1017 HB2 PRO 38 2HB PRO 38 7.082 5.933 -13.185 1018 HB3 PRO 38 1HB PRO 38 6.048 5.338 -14.485 1019 HG2 PRO 38 2HG PRO 38 8.418 6.415 -15.002 1020 HG3 PRO 38 1HG PRO 38 7.034 6.687 -16.068 1021 HD2 PRO 38 2HD PRO 38 8.357 8.569 -14.215 1022 HD3 PRO 38 1HD PRO 38 7.364 8.846 -15.670 1023 H ILE 39 H ILE 39 6.695 7.768 -11.561 1024 HA ILE 39 HA ILE 39 5.084 6.119 -9.926 1025 HB ILE 39 HB ILE 39 7.080 8.258 -9.084 1026 HG12 ILE 39 2HG1 ILE 39 8.081 6.385 -10.349 1027 HG13 ILE 39 1HG1 ILE 39 8.572 6.379 -8.663 1028 HG21 ILE 39 1HG2 ILE 39 5.428 7.904 -7.389 1029 HG22 ILE 39 2HG2 ILE 39 7.010 7.283 -6.930 1030 HG23 ILE 39 3HG2 ILE 39 5.743 6.170 -7.442 1031 HD11 ILE 39 1HD1 ILE 39 8.127 4.141 -9.455 1032 HD12 ILE 39 2HD1 ILE 39 6.499 4.601 -9.934 1033 HD13 ILE 39 3HD1 ILE 39 6.949 4.593 -8.226 1034 H ASN 40 H ASN 40 5.158 9.683 -10.441 1035 HA ASN 40 HA ASN 40 3.524 10.370 -8.396 1036 HB2 ASN 40 2HB ASN 40 4.892 11.987 -9.389 1037 HB3 ASN 40 1HB ASN 40 4.320 11.589 -11.005 1038 HD21 ASN 40 1HD2 ASN 40 2.495 12.463 -11.742 1039 HD22 ASN 40 2HD2 ASN 40 1.645 13.664 -10.869 1040 H GLN 41 H GLN 41 2.747 9.375 -11.687 1041 HA GLN 41 HA GLN 41 0.029 10.154 -11.355 1042 HB2 GLN 41 2HB GLN 41 1.238 8.379 -13.457 1043 HB3 GLN 41 1HB GLN 41 -0.428 8.910 -13.447 1044 HG2 GLN 41 2HG GLN 41 2.047 10.570 -13.855 1045 HG3 GLN 41 1HG GLN 41 0.734 10.280 -14.989 1046 HE21 GLN 41 1HE2 GLN 41 1.681 12.795 -14.269 1047 HE22 GLN 41 2HE2 GLN 41 0.428 13.656 -13.449 1048 H ILE 42 H ILE 42 1.751 7.130 -10.874 1049 HA ILE 42 HA ILE 42 -0.616 5.571 -10.703 1050 HB ILE 42 HB ILE 42 2.140 4.944 -9.606 1051 HG12 ILE 42 2HG1 ILE 42 0.736 4.023 -12.135 1052 HG13 ILE 42 1HG1 ILE 42 2.021 5.220 -12.074 1053 HG21 ILE 42 1HG2 ILE 42 0.383 3.692 -8.442 1054 HG22 ILE 42 2HG2 ILE 42 1.322 2.600 -9.468 1055 HG23 ILE 42 3HG2 ILE 42 -0.277 3.153 -9.980 1056 HD11 ILE 42 1HD1 ILE 42 3.563 3.514 -11.262 1057 HD12 ILE 42 2HD1 ILE 42 2.844 3.053 -12.805 1058 HD13 ILE 42 3HD1 ILE 42 2.268 2.317 -11.308 1059 H VAL 43 H VAL 43 1.574 6.768 -8.137 1060 HA VAL 43 HA VAL 43 -0.140 5.912 -6.083 1061 HB VAL 43 HB VAL 43 2.216 6.357 -5.513 1062 HG11 VAL 43 1HG1 VAL 43 2.666 8.221 -7.032 1063 HG12 VAL 43 2HG1 VAL 43 3.102 8.609 -5.364 1064 HG13 VAL 43 3HG1 VAL 43 1.614 9.262 -6.053 1065 HG21 VAL 43 1HG2 VAL 43 0.409 8.292 -4.083 1066 HG22 VAL 43 2HG2 VAL 43 1.952 7.680 -3.490 1067 HG23 VAL 43 3HG2 VAL 43 0.599 6.574 -3.720 1068 H GLY 44 H GLY 44 -0.000 8.846 -7.914 1069 HA2 GLY 44 2HA GLY 44 -1.818 10.405 -6.419 1070 HA3 GLY 44 1HA GLY 44 -1.483 10.590 -8.139 1071 H TYR 45 H TYR 45 -2.323 8.198 -9.176 1072 HA TYR 45 HA TYR 45 -5.083 8.496 -9.403 1073 HB2 TYR 45 2HB TYR 45 -3.870 7.351 -11.152 1074 HB3 TYR 45 1HB TYR 45 -3.335 6.104 -10.026 1075 HD1 TYR 45 1HD TYR 45 -4.609 4.152 -9.734 1076 HD2 TYR 45 2HD TYR 45 -6.388 7.532 -11.583 1077 HE1 TYR 45 1HE TYR 45 -6.591 2.818 -10.232 1078 HE2 TYR 45 2HE TYR 45 -8.378 6.220 -12.097 1079 HH TYR 45 HH TYR 45 -8.937 3.142 -10.726 1080 H LEU 46 H LEU 46 -3.231 6.191 -7.514 1081 HA LEU 46 HA LEU 46 -5.475 4.827 -6.526 1082 HB2 LEU 46 2HB LEU 46 -2.700 5.065 -5.402 1083 HB3 LEU 46 1HB LEU 46 -3.894 3.878 -4.902 1084 HG LEU 46 HG LEU 46 -2.811 4.092 -7.714 1085 HD11 LEU 46 1HD1 LEU 46 -1.540 2.090 -7.203 1086 HD12 LEU 46 2HD1 LEU 46 -2.085 2.163 -5.524 1087 HD13 LEU 46 3HD1 LEU 46 -1.062 3.446 -6.184 1088 HD21 LEU 46 1HD2 LEU 46 -3.830 1.888 -7.992 1089 HD22 LEU 46 2HD2 LEU 46 -5.028 3.118 -7.606 1090 HD23 LEU 46 3HD2 LEU 46 -4.490 1.986 -6.361 1091 H LEU 47 H LEU 47 -3.707 7.602 -5.228 1092 HA LEU 47 HA LEU 47 -5.233 7.580 -2.798 1093 HB2 LEU 47 2HB LEU 47 -3.385 9.679 -3.907 1094 HB3 LEU 47 1HB LEU 47 -4.124 9.747 -2.322 1095 HG LEU 47 HG LEU 47 -2.112 7.698 -3.264 1096 HD11 LEU 47 1HD1 LEU 47 -1.135 9.882 -2.883 1097 HD12 LEU 47 2HD1 LEU 47 -0.636 8.747 -1.628 1098 HD13 LEU 47 3HD1 LEU 47 -1.876 9.953 -1.284 1099 HD21 LEU 47 1HD2 LEU 47 -3.681 6.691 -1.682 1100 HD22 LEU 47 2HD2 LEU 47 -3.431 8.035 -0.564 1101 HD23 LEU 47 3HD2 LEU 47 -2.107 6.930 -0.929 1102 H SER 48 H SER 48 -5.363 9.547 -5.769 1103 HA SER 48 HA SER 48 -7.541 11.065 -4.577 1104 HB2 SER 48 2HB SER 48 -6.062 11.491 -7.166 1105 HB3 SER 48 1HB SER 48 -7.262 12.584 -6.475 1106 HG SER 48 HG SER 48 -5.640 12.216 -4.532 1107 H GLY 49 H GLY 49 -7.157 8.529 -7.041 1108 HA2 GLY 49 2HA GLY 49 -8.785 7.324 -8.040 1109 HA3 GLY 49 1HA GLY 49 -9.992 8.280 -7.191 1110 H ASP 50 H ASP 50 -7.465 9.415 -9.418 1111 HA ASP 50 HA ASP 50 -9.631 10.317 -11.169 1112 HB2 ASP 50 2HB ASP 50 -8.507 12.244 -10.208 1113 HB3 ASP 50 1HB ASP 50 -6.941 11.634 -10.741 1114 HA PRO 51 HA PRO 51 -7.746 7.308 -13.868 1115 HB2 PRO 51 2HB PRO 51 -9.610 7.521 -15.846 1116 HB3 PRO 51 1HB PRO 51 -9.852 6.576 -14.374 1117 HG2 PRO 51 2HG PRO 51 -10.817 9.324 -15.040 1118 HG3 PRO 51 1HG PRO 51 -11.675 8.004 -14.227 1119 HD2 PRO 51 2HD PRO 51 -10.588 10.079 -12.896 1120 HD3 PRO 51 1HD PRO 51 -10.684 8.449 -12.194 1121 H ALA 52 H ALA 52 -8.366 10.621 -14.583 1122 HA ALA 52 HA ALA 52 -7.428 10.689 -17.249 1123 HB1 ALA 52 1HB ALA 52 -7.514 13.095 -17.041 1124 HB2 ALA 52 2HB ALA 52 -7.669 12.958 -15.293 1125 HB3 ALA 52 3HB ALA 52 -8.957 12.364 -16.338 1126 H TYR 53 H TYR 53 -5.697 10.370 -14.375 1127 HA TYR 53 HA TYR 53 -3.343 11.911 -14.850 1128 HB2 TYR 53 2HB TYR 53 -3.779 9.381 -13.284 1129 HB3 TYR 53 1HB TYR 53 -2.265 10.266 -13.320 1130 HD1 TYR 53 1HD TYR 53 -3.483 13.076 -13.273 1131 HD2 TYR 53 2HD TYR 53 -4.264 9.579 -11.001 1132 HE1 TYR 53 1HE TYR 53 -4.197 14.460 -11.448 1133 HE2 TYR 53 2HE TYR 53 -5.014 10.970 -9.121 1134 HH TYR 53 HH TYR 53 -5.726 14.209 -9.427 1135 H ILE 54 H ILE 54 -4.311 8.784 -16.101 1136 HA ILE 54 HA ILE 54 -1.595 8.410 -17.108 1137 HB ILE 54 HB ILE 54 -3.934 6.461 -17.323 1138 HG12 ILE 54 2HG1 ILE 54 -3.336 6.790 -14.970 1139 HG13 ILE 54 1HG1 ILE 54 -2.783 5.215 -15.521 1140 HG21 ILE 54 1HG2 ILE 54 -2.232 4.799 -17.871 1141 HG22 ILE 54 2HG2 ILE 54 -0.991 6.049 -17.824 1142 HG23 ILE 54 3HG2 ILE 54 -2.257 6.112 -19.050 1143 HD11 ILE 54 1HD1 ILE 54 -1.134 6.266 -14.098 1144 HD12 ILE 54 2HD1 ILE 54 -1.076 7.665 -15.167 1145 HD13 ILE 54 3HD1 ILE 54 -0.511 6.096 -15.739 1146 HA PRO 55 HA PRO 55 -2.898 10.242 -20.960 1147 HB2 PRO 55 2HB PRO 55 -0.611 9.703 -22.349 1148 HB3 PRO 55 1HB PRO 55 -0.749 11.033 -21.192 1149 HG2 PRO 55 2HG PRO 55 0.409 8.304 -20.823 1150 HG3 PRO 55 1HG PRO 55 1.044 9.865 -20.275 1151 HD2 PRO 55 2HD PRO 55 -0.251 8.195 -18.630 1152 HD3 PRO 55 1HD PRO 55 -0.396 9.961 -18.470 1153 H ARG 56 H ARG 56 -3.632 9.562 -22.900 1154 HA ARG 56 HA ARG 56 -4.153 6.732 -23.138 1155 HB2 ARG 56 2HB ARG 56 -5.667 7.430 -25.007 1156 HB3 ARG 56 1HB ARG 56 -6.052 8.082 -23.429 1157 HG2 ARG 56 2HG ARG 56 -4.906 10.203 -24.141 1158 HG3 ARG 56 1HG ARG 56 -4.776 9.504 -25.754 1159 HD2 ARG 56 2HD ARG 56 -7.166 9.299 -25.926 1160 HD3 ARG 56 1HD ARG 56 -7.356 9.797 -24.249 1161 HE ARG 56 HE ARG 56 -6.032 11.758 -25.811 1162 HH11 ARG 56 1HH1 ARG 56 -9.228 10.425 -25.033 1163 HH12 ARG 56 2HH1 ARG 56 -10.078 11.864 -25.348 1164 HH21 ARG 56 1HH2 ARG 56 -7.210 13.760 -26.269 1165 HH22 ARG 56 2HH2 ARG 56 -8.898 13.799 -26.080 1166 H TYR 57 H TYR 57 -1.519 7.791 -23.710 1167 HA TYR 57 HA TYR 57 -0.725 7.554 -26.359 1168 HB2 TYR 57 2HB TYR 57 0.789 8.366 -24.710 1169 HB3 TYR 57 1HB TYR 57 0.662 6.890 -23.773 1170 HD1 TYR 57 1HD TYR 57 1.923 8.216 -27.024 1171 HD2 TYR 57 2HD TYR 57 2.196 5.160 -24.083 1172 HE1 TYR 57 1HE TYR 57 3.941 7.338 -28.124 1173 HE2 TYR 57 2HE TYR 57 4.207 4.272 -25.175 1174 HH TYR 57 HH TYR 57 5.242 4.297 -27.382 1175 H GLN 58 H GLN 58 -1.278 5.026 -23.945 1176 HA GLN 58 HA GLN 58 -1.187 3.076 -26.125 1177 HB2 GLN 58 2HB GLN 58 0.998 3.295 -24.559 1178 HB3 GLN 58 1HB GLN 58 0.016 2.268 -23.518 1179 HG2 GLN 58 2HG GLN 58 -0.204 0.664 -25.434 1180 HG3 GLN 58 1HG GLN 58 0.924 1.675 -26.320 1181 HE21 GLN 58 1HE2 GLN 58 0.518 -0.659 -23.862 1182 HE22 GLN 58 2HE2 GLN 58 2.200 -0.918 -23.543 1183 H ASP 59 H ASP 59 -1.727 0.818 -24.753 1184 HA ASP 59 HA ASP 59 -4.432 1.092 -24.030 1185 HB2 ASP 59 2HB ASP 59 -4.303 -1.343 -23.681 1186 HB3 ASP 59 1HB ASP 59 -3.616 -0.849 -25.227 1187 H ALA 60 H ALA 60 -1.571 1.380 -22.262 1188 HA ALA 60 HA ALA 60 -2.159 0.312 -19.748 1189 HB1 ALA 60 1HB ALA 60 -0.564 1.898 -18.836 1190 HB2 ALA 60 2HB ALA 60 -0.667 2.877 -20.300 1191 HB3 ALA 60 3HB ALA 60 0.026 1.257 -20.369 1192 H ARG 61 H ARG 61 -3.153 3.318 -21.182 1193 HA ARG 61 HA ARG 61 -4.339 4.586 -18.991 1194 HB2 ARG 61 2HB ARG 61 -3.723 5.644 -21.128 1195 HB3 ARG 61 1HB ARG 61 -4.943 4.709 -21.950 1196 HG2 ARG 61 2HG ARG 61 -5.629 6.713 -19.813 1197 HG3 ARG 61 1HG ARG 61 -5.389 7.190 -21.481 1198 HD2 ARG 61 2HD ARG 61 -7.213 5.568 -22.094 1199 HD3 ARG 61 1HD ARG 61 -7.500 5.345 -20.365 1200 HE ARG 61 HE ARG 61 -7.555 8.029 -20.678 1201 HH11 ARG 61 1HH1 ARG 61 -9.412 5.390 -22.162 1202 HH12 ARG 61 2HH1 ARG 61 -10.752 6.358 -22.529 1203 HH21 ARG 61 1HH2 ARG 61 -9.430 9.346 -21.161 1204 HH22 ARG 61 2HH2 ARG 61 -10.766 8.627 -21.942 1205 H ASN 62 H ASN 62 -5.558 2.273 -21.336 1206 HA ASN 62 HA ASN 62 -8.221 2.253 -20.268 1207 HB2 ASN 62 2HB ASN 62 -7.764 1.735 -22.661 1208 HB3 ASN 62 1HB ASN 62 -6.845 0.323 -22.168 1209 HD21 ASN 62 1HD2 ASN 62 -9.878 1.336 -20.701 1210 HD22 ASN 62 2HD2 ASN 62 -10.798 -0.004 -21.266 1211 H LEU 63 H LEU 63 -5.357 0.220 -20.031 1212 HA LEU 63 HA LEU 63 -6.364 -1.982 -18.659 1213 HB2 LEU 63 2HB LEU 63 -3.645 -0.729 -18.340 1214 HB3 LEU 63 1HB LEU 63 -4.089 -2.332 -17.801 1215 HG LEU 63 HG LEU 63 -3.939 -1.393 -20.661 1216 HD11 LEU 63 1HD1 LEU 63 -1.756 -1.655 -19.629 1217 HD12 LEU 63 2HD1 LEU 63 -2.054 -2.936 -20.798 1218 HD13 LEU 63 3HD1 LEU 63 -2.194 -3.267 -19.071 1219 HD21 LEU 63 1HD2 LEU 63 -4.314 -3.750 -21.225 1220 HD22 LEU 63 2HD2 LEU 63 -5.702 -3.059 -20.386 1221 HD23 LEU 63 3HD2 LEU 63 -4.585 -4.111 -19.522 1222 H ILE 64 H ILE 64 -4.995 0.997 -17.294 1223 HA ILE 64 HA ILE 64 -5.220 0.093 -14.627 1224 HB ILE 64 HB ILE 64 -3.655 1.921 -15.368 1225 HG12 ILE 64 2HG1 ILE 64 -5.525 2.761 -13.139 1226 HG13 ILE 64 1HG1 ILE 64 -4.229 1.582 -12.970 1227 HG21 ILE 64 1HG2 ILE 64 -4.532 4.226 -15.529 1228 HG22 ILE 64 2HG2 ILE 64 -6.166 3.585 -15.451 1229 HG23 ILE 64 3HG2 ILE 64 -5.132 3.186 -16.826 1230 HD11 ILE 64 1HD1 ILE 64 -2.592 3.322 -13.515 1231 HD12 ILE 64 2HD1 ILE 64 -3.559 3.742 -12.099 1232 HD13 ILE 64 3HD1 ILE 64 -3.901 4.495 -13.657 1233 H ARG 65 H ARG 65 -7.464 1.501 -16.797 1234 HA ARG 65 HA ARG 65 -9.308 2.344 -14.745 1235 HB2 ARG 65 2HB ARG 65 -9.599 2.266 -17.747 1236 HB3 ARG 65 1HB ARG 65 -10.786 2.942 -16.643 1237 HG2 ARG 65 2HG ARG 65 -9.081 4.577 -15.887 1238 HG3 ARG 65 1HG ARG 65 -7.977 3.922 -17.089 1239 HD2 ARG 65 2HD ARG 65 -9.513 4.540 -18.869 1240 HD3 ARG 65 1HD ARG 65 -10.665 5.132 -17.677 1241 HE ARG 65 HE ARG 65 -8.008 6.320 -17.768 1242 HH11 ARG 65 1HH1 ARG 65 -11.499 6.650 -18.390 1243 HH12 ARG 65 2HH1 ARG 65 -11.454 8.326 -18.609 1244 HH21 ARG 65 1HH2 ARG 65 -7.968 8.713 -18.100 1245 HH22 ARG 65 2HH2 ARG 65 -9.432 9.500 -18.431 1246 H ARG 66 H ARG 66 -8.473 -0.566 -15.912 1247 HA ARG 66 HA ARG 66 -11.162 -1.719 -15.882 1248 HB2 ARG 66 2HB ARG 66 -8.467 -3.052 -16.230 1249 HB3 ARG 66 1HB ARG 66 -10.027 -3.840 -16.418 1250 HG2 ARG 66 2HG ARG 66 -10.534 -2.356 -18.292 1251 HG3 ARG 66 1HG ARG 66 -8.952 -1.601 -18.108 1252 HD2 ARG 66 2HD ARG 66 -7.879 -3.770 -18.535 1253 HD3 ARG 66 1HD ARG 66 -9.469 -4.499 -18.756 1254 HE ARG 66 HE ARG 66 -9.323 -2.340 -20.463 1255 HH11 ARG 66 1HH1 ARG 66 -7.707 -5.468 -20.084 1256 HH12 ARG 66 2HH1 ARG 66 -7.326 -5.625 -21.725 1257 HH21 ARG 66 1HH2 ARG 66 -8.750 -2.542 -22.717 1258 HH22 ARG 66 2HH2 ARG 66 -7.901 -3.898 -23.277 1259 H HIS 67 H HIS 67 -9.319 -0.549 -13.666 1260 HA HIS 67 HA HIS 67 -9.958 -2.570 -11.645 1261 HB2 HIS 67 2HB HIS 67 -7.441 -0.866 -11.713 1262 HB3 HIS 67 1HB HIS 67 -7.864 -2.058 -10.496 1263 HD1 HIS 67 1HD HIS 67 -7.504 -4.554 -11.127 1264 HD2 HIS 67 2HD HIS 67 -6.293 -1.858 -14.040 1265 HE1 HIS 67 1HE HIS 67 -6.076 -5.874 -12.740 1266 HE2 HIS 67 2HE HIS 67 -5.471 -4.232 -14.560 1267 H GLU 68 H GLU 68 -10.431 -1.497 -9.578 1268 HA GLU 68 HA GLU 68 -11.363 1.192 -9.964 1269 HB2 GLU 68 2HB GLU 68 -11.372 -0.544 -7.485 1270 HB3 GLU 68 1HB GLU 68 -12.123 1.039 -7.606 1271 HG2 GLU 68 2HG GLU 68 -12.871 -1.370 -9.250 1272 HG3 GLU 68 1HG GLU 68 -13.743 -0.791 -7.830 1273 H ARG 69 H ARG 69 -9.653 0.148 -7.078 1274 HA ARG 69 HA ARG 69 -7.167 1.268 -7.629 1275 HB2 ARG 69 2HB ARG 69 -7.126 3.294 -6.184 1276 HB3 ARG 69 1HB ARG 69 -8.197 3.483 -7.556 1277 HG2 ARG 69 2HG ARG 69 -10.117 3.161 -6.165 1278 HG3 ARG 69 1HG ARG 69 -9.093 2.803 -4.769 1279 HD2 ARG 69 2HD ARG 69 -8.152 5.061 -4.901 1280 HD3 ARG 69 1HD ARG 69 -9.190 5.413 -6.283 1281 HE ARG 69 HE ARG 69 -10.971 4.686 -4.469 1282 HH11 ARG 69 1HH1 ARG 69 -8.206 6.866 -4.084 1283 HH12 ARG 69 2HH1 ARG 69 -9.012 7.897 -2.989 1284 HH21 ARG 69 1HH2 ARG 69 -12.043 6.088 -2.935 1285 HH22 ARG 69 2HH2 ARG 69 -11.202 7.438 -2.334 1286 H ASP 70 H ASP 70 -9.531 0.603 -5.093 1287 HA ASP 70 HA ASP 70 -7.755 0.114 -2.986 1288 HB2 ASP 70 2HB ASP 70 -9.615 -1.108 -1.957 1289 HB3 ASP 70 1HB ASP 70 -10.227 0.347 -2.730 1290 H GLU 71 H GLU 71 -9.005 -1.867 -5.526 1291 HA GLU 71 HA GLU 71 -8.070 -4.394 -4.895 1292 HB2 GLU 71 2HB GLU 71 -9.618 -3.892 -6.669 1293 HB3 GLU 71 1HB GLU 71 -8.374 -3.027 -7.555 1294 HG2 GLU 71 2HG GLU 71 -7.163 -5.081 -7.869 1295 HG3 GLU 71 1HG GLU 71 -8.391 -5.971 -6.954 1296 H ILE 72 H ILE 72 -6.481 -1.823 -6.735 1297 HA ILE 72 HA ILE 72 -4.084 -3.244 -7.263 1298 HB ILE 72 HB ILE 72 -4.589 -0.258 -7.209 1299 HG12 ILE 72 2HG1 ILE 72 -4.606 -2.207 -9.532 1300 HG13 ILE 72 1HG1 ILE 72 -6.023 -1.458 -8.810 1301 HG21 ILE 72 1HG2 ILE 72 -2.305 -1.813 -8.438 1302 HG22 ILE 72 2HG2 ILE 72 -2.206 -0.747 -7.038 1303 HG23 ILE 72 3HG2 ILE 72 -2.576 -0.081 -8.628 1304 HD11 ILE 72 1HD1 ILE 72 -5.237 0.735 -9.546 1305 HD12 ILE 72 2HD1 ILE 72 -5.404 -0.378 -10.903 1306 HD13 ILE 72 3HD1 ILE 72 -3.806 -0.012 -10.253 1307 H MET 73 H MET 73 -5.036 -0.838 -4.863 1308 HA MET 73 HA MET 73 -2.617 -0.598 -3.509 1309 HB2 MET 73 2HB MET 73 -4.510 0.939 -3.171 1310 HB3 MET 73 1HB MET 73 -5.423 -0.360 -2.421 1311 HG2 MET 73 2HG MET 73 -4.485 1.172 -0.784 1312 HG3 MET 73 1HG MET 73 -3.855 -0.469 -0.614 1313 HE1 MET 73 1HE MET 73 -0.844 1.758 0.466 1314 HE2 MET 73 2HE MET 73 -1.913 0.444 0.936 1315 HE3 MET 73 3HE MET 73 -2.552 2.075 0.757 1316 H GLU 74 H GLU 74 -5.216 -2.928 -3.164 1317 HA GLU 74 HA GLU 74 -4.287 -4.189 -0.911 1318 HB2 GLU 74 2HB GLU 74 -6.008 -5.151 -3.151 1319 HB3 GLU 74 1HB GLU 74 -5.480 -6.270 -1.894 1320 HG2 GLU 74 2HG GLU 74 -7.003 -3.711 -1.455 1321 HG3 GLU 74 1HG GLU 74 -7.651 -5.359 -1.340 1322 H GLU 75 H GLU 75 -3.471 -4.972 -4.259 1323 HA GLU 75 HA GLU 75 -1.836 -7.079 -3.319 1324 HB2 GLU 75 2HB GLU 75 -2.761 -7.137 -5.580 1325 HB3 GLU 75 1HB GLU 75 -1.760 -5.734 -5.981 1326 HG2 GLU 75 2HG GLU 75 0.236 -6.945 -5.785 1327 HG3 GLU 75 1HG GLU 75 -0.566 -8.290 -4.988 1328 H LEU 76 H LEU 76 -1.249 -3.715 -4.042 1329 HA LEU 76 HA LEU 76 1.544 -3.676 -3.886 1330 HB2 LEU 76 2HB LEU 76 -0.363 -1.627 -2.740 1331 HB3 LEU 76 1HB LEU 76 1.335 -1.372 -3.060 1332 HG LEU 76 HG LEU 76 -0.837 -1.787 -5.110 1333 HD11 LEU 76 1HD1 LEU 76 -0.350 0.518 -5.717 1334 HD12 LEU 76 2HD1 LEU 76 0.829 0.614 -4.413 1335 HD13 LEU 76 3HD1 LEU 76 -0.878 0.400 -4.040 1336 HD21 LEU 76 1HD2 LEU 76 1.252 -2.777 -5.873 1337 HD22 LEU 76 2HD2 LEU 76 2.112 -1.283 -5.494 1338 HD23 LEU 76 3HD2 LEU 76 0.891 -1.302 -6.767 1339 H THR 77 H THR 77 -0.911 -3.428 -1.339 1340 HA THR 77 HA THR 77 0.908 -3.259 0.797 1341 HB THR 77 HB THR 77 -1.984 -4.155 0.764 1342 HG1 THR 77 1HG THR 77 -1.769 -2.039 -0.000 1343 HG21 THR 77 1HG2 THR 77 -2.002 -3.517 3.156 1344 HG22 THR 77 2HG2 THR 77 -0.265 -3.201 3.077 1345 HG23 THR 77 3HG2 THR 77 -0.885 -4.837 2.849 1346 H LYS 78 H LYS 78 -0.994 -6.033 -0.485 1347 HA LYS 78 HA LYS 78 -0.128 -7.907 1.385 1348 HB2 LYS 78 2HB LYS 78 -1.307 -8.126 -1.335 1349 HB3 LYS 78 1HB LYS 78 -0.634 -9.552 -0.590 1350 HG2 LYS 78 2HG LYS 78 -2.962 -9.529 -0.351 1351 HG3 LYS 78 1HG LYS 78 -2.271 -9.344 1.249 1352 HD2 LYS 78 2HD LYS 78 -3.465 -7.073 -0.401 1353 HD3 LYS 78 1HD LYS 78 -4.402 -8.016 0.740 1354 HE2 LYS 78 2HE LYS 78 -2.822 -7.210 2.548 1355 HE3 LYS 78 1HE LYS 78 -2.062 -6.200 1.332 1356 HZ1 LYS 78 1HZ LYS 78 -3.843 -5.001 2.706 1357 HZ2 LYS 78 2HZ LYS 78 -4.989 -5.962 1.921 1358 HZ3 LYS 78 3HZ LYS 78 -4.142 -4.933 1.076 1359 H TYR 79 H TYR 79 1.146 -7.373 -1.925 1360 HA TYR 79 HA TYR 79 3.056 -9.424 -1.658 1361 HB2 TYR 79 2HB TYR 79 2.424 -8.723 -3.886 1362 HB3 TYR 79 1HB TYR 79 3.039 -7.096 -3.592 1363 HD1 TYR 79 1HD TYR 79 4.123 -10.652 -3.766 1364 HD2 TYR 79 2HD TYR 79 5.263 -6.570 -4.113 1365 HE1 TYR 79 1HE TYR 79 6.348 -11.343 -4.560 1366 HE2 TYR 79 2HE TYR 79 7.483 -7.248 -4.910 1367 HH TYR 79 HH TYR 79 8.183 -10.423 -5.859 1368 H TYR 80 H TYR 80 3.232 -6.009 -0.898 1369 HA TYR 80 HA TYR 80 6.005 -5.835 -0.597 1370 HB2 TYR 80 2HB TYR 80 4.586 -3.856 -0.726 1371 HB3 TYR 80 1HB TYR 80 3.805 -4.287 0.787 1372 HD1 TYR 80 1HD TYR 80 6.926 -3.027 -0.744 1373 HD2 TYR 80 2HD TYR 80 4.839 -3.817 2.885 1374 HE1 TYR 80 1HE TYR 80 8.586 -1.705 0.507 1375 HE2 TYR 80 2HE TYR 80 6.490 -2.503 4.122 1376 HH TYR 80 HH TYR 80 8.831 -0.482 2.692 1377 H LEU 81 H LEU 81 3.501 -6.848 1.611 1378 HA LEU 81 HA LEU 81 5.225 -7.134 3.868 1379 HB2 LEU 81 2HB LEU 81 2.610 -8.467 3.294 1380 HB3 LEU 81 1HB LEU 81 3.386 -8.314 4.863 1381 HG LEU 81 HG LEU 81 2.285 -6.026 3.214 1382 HD11 LEU 81 1HD1 LEU 81 0.548 -7.474 4.203 1383 HD12 LEU 81 2HD1 LEU 81 0.579 -5.838 4.850 1384 HD13 LEU 81 3HD1 LEU 81 1.277 -7.158 5.789 1385 HD21 LEU 81 1HD2 LEU 81 2.710 -4.670 5.190 1386 HD22 LEU 81 2HD2 LEU 81 4.206 -5.339 4.540 1387 HD23 LEU 81 3HD2 LEU 81 3.474 -6.048 5.982 1388 H ALA 82 H ALA 82 3.863 -9.331 1.460 1389 HA ALA 82 HA ALA 82 4.597 -11.766 2.523 1390 HB1 ALA 82 1HB ALA 82 4.365 -11.100 -0.402 1391 HB2 ALA 82 2HB ALA 82 3.018 -11.468 0.675 1392 HB3 ALA 82 3HB ALA 82 4.232 -12.700 0.331 1393 H ASN 83 H ASN 83 6.515 -9.685 0.446 1394 HA ASN 83 HA ASN 83 8.511 -11.657 -0.046 1395 HB2 ASN 83 2HB ASN 83 9.913 -9.900 -0.985 1396 HB3 ASN 83 1HB ASN 83 8.263 -9.758 -1.578 1397 HD21 ASN 83 1HD2 ASN 83 7.050 -7.979 -0.993 1398 HD22 ASN 83 2HD2 ASN 83 7.759 -6.624 -0.195 1399 H HIS 84 H HIS 84 7.887 -10.063 2.837 1400 HA HIS 84 HA HIS 84 10.720 -10.109 3.550 1401 HB2 HIS 84 2HB HIS 84 8.371 -8.909 4.993 1402 HB3 HIS 84 1HB HIS 84 9.947 -9.096 5.757 1403 HD1 HIS 84 1HD HIS 84 11.956 -7.806 4.572 1404 HD2 HIS 84 2HD HIS 84 8.129 -6.748 3.397 1405 HE1 HIS 84 1HE HIS 84 12.242 -5.689 3.332 1406 HE2 HIS 84 2HE HIS 84 10.062 -5.425 2.212 1407 H GLY 85 H GLY 85 8.912 -12.471 3.204 1408 HA2 GLY 85 2HA GLY 85 9.400 -14.594 4.113 1409 HA3 GLY 85 1HA GLY 85 9.930 -13.803 5.596 1410 H ILE 86 H ILE 86 7.107 -12.588 4.334 1411 HA ILE 86 HA ILE 86 5.536 -13.926 6.390 1412 HB ILE 86 HB ILE 86 4.970 -11.445 4.745 1413 HG12 ILE 86 2HG1 ILE 86 5.665 -11.754 7.665 1414 HG13 ILE 86 1HG1 ILE 86 6.741 -11.126 6.422 1415 HG21 ILE 86 1HG2 ILE 86 3.040 -11.122 6.212 1416 HG22 ILE 86 2HG2 ILE 86 3.383 -12.665 6.997 1417 HG23 ILE 86 3HG2 ILE 86 2.922 -12.625 5.298 1418 HD11 ILE 86 1HD1 ILE 86 5.742 -9.363 7.787 1419 HD12 ILE 86 2HD1 ILE 86 4.142 -9.924 7.283 1420 HD13 ILE 86 3HD1 ILE 86 5.243 -9.247 6.086 1421 H ASP 87 H ASP 87 3.984 -15.294 5.779 1422 HA ASP 87 HA ASP 87 3.556 -15.564 2.900 1423 HB2 ASP 87 2HB ASP 87 3.018 -17.519 5.138 1424 HB3 ASP 87 1HB ASP 87 2.445 -17.761 3.495 1425 H ILE 88 H ILE 88 1.896 -14.669 2.088 1426 HA ILE 88 HA ILE 88 -0.563 -14.493 3.672 1427 HB ILE 88 HB ILE 88 0.263 -12.598 1.427 1428 HG12 ILE 88 2HG1 ILE 88 0.293 -12.080 4.405 1429 HG13 ILE 88 1HG1 ILE 88 1.717 -12.283 3.392 1430 HG21 ILE 88 1HG2 ILE 88 -1.989 -12.403 3.407 1431 HG22 ILE 88 2HG2 ILE 88 -2.152 -12.869 1.712 1432 HG23 ILE 88 3HG2 ILE 88 -1.612 -11.242 2.143 1433 HD11 ILE 88 1HD1 ILE 88 1.262 -9.939 3.874 1434 HD12 ILE 88 2HD1 ILE 88 -0.323 -10.087 3.116 1435 HD13 ILE 88 3HD1 ILE 88 1.135 -10.276 2.144 1436 H LYS 89 H LYS 89 -2.287 -15.391 2.642 1437 HA LYS 89 HA LYS 89 -1.612 -16.698 0.123 1438 HB2 LYS 89 2HB LYS 89 -3.802 -17.355 2.111 1439 HB3 LYS 89 1HB LYS 89 -3.642 -18.146 0.557 1440 HG2 LYS 89 2HG LYS 89 -2.694 -19.601 2.192 1441 HG3 LYS 89 1HG LYS 89 -1.361 -18.908 1.279 1442 HD2 LYS 89 2HD LYS 89 -1.027 -17.264 3.122 1443 HD3 LYS 89 1HD LYS 89 -2.300 -18.086 4.026 1444 HE2 LYS 89 2HE LYS 89 0.307 -19.293 3.103 1445 HE3 LYS 89 1HE LYS 89 -0.092 -18.831 4.753 1446 HZ1 LYS 89 1HZ LYS 89 -1.474 -20.953 3.184 1447 HZ2 LYS 89 2HZ LYS 89 -1.817 -20.513 4.780 1448 HZ3 LYS 89 3HZ LYS 89 -0.337 -21.203 4.388 Start of MODEL 10 1 H1 MET 1 1HT MET 1 -20.302 14.007 26.420 2 H2 MET 1 2HT MET 1 -21.870 13.560 26.905 3 H3 MET 1 3HT MET 1 -21.282 13.152 25.369 4 HA MET 1 HA MET 1 -20.088 12.175 27.855 5 HB2 MET 1 2HB MET 1 -21.860 10.732 25.849 6 HB3 MET 1 1HB MET 1 -21.005 9.961 27.165 7 HG2 MET 1 2HG MET 1 -23.327 10.193 27.733 8 HG3 MET 1 1HG MET 1 -22.372 11.246 28.771 9 HE1 MET 1 1HE MET 1 -24.622 12.480 29.468 10 HE2 MET 1 2HE MET 1 -25.569 11.464 28.389 11 HE3 MET 1 3HE MET 1 -25.743 13.217 28.323 12 H GLY 2 H GLY 2 -18.769 10.148 27.183 13 HA2 GLY 2 2HA GLY 2 -17.520 9.115 25.417 14 HA3 GLY 2 1HA GLY 2 -17.488 10.673 24.596 15 H PHE 3 H PHE 3 -16.537 12.481 26.087 16 HA PHE 3 HA PHE 3 -14.678 13.387 26.963 17 HB2 PHE 3 2HB PHE 3 -14.640 10.805 28.548 18 HB3 PHE 3 1HB PHE 3 -13.557 12.159 28.863 19 HD1 PHE 3 1HD PHE 3 -14.376 14.205 29.840 20 HD2 PHE 3 2HD PHE 3 -16.991 10.952 29.062 21 HE1 PHE 3 1HE PHE 3 -16.088 15.251 31.261 22 HE2 PHE 3 2HE PHE 3 -18.711 11.987 30.480 23 HZ PHE 3 HZ PHE 3 -18.262 14.134 31.580 24 H THR 4 H THR 4 -14.467 12.093 24.526 25 HA THR 4 HA THR 4 -12.187 10.481 24.313 26 HB THR 4 HB THR 4 -13.475 12.254 22.231 27 HG1 THR 4 1HG THR 4 -13.949 9.506 22.822 28 HG21 THR 4 1HG2 THR 4 -11.268 11.401 21.550 29 HG22 THR 4 2HG2 THR 4 -12.549 10.620 20.627 30 HG23 THR 4 3HG2 THR 4 -11.765 9.759 21.950 31 H ASP 5 H ASP 5 -10.449 11.337 25.294 32 HA ASP 5 HA ASP 5 -9.028 13.398 23.875 33 HB2 ASP 5 2HB ASP 5 -10.167 14.708 25.628 34 HB3 ASP 5 1HB ASP 5 -9.557 13.605 26.855 35 H GLU 6 H GLU 6 -7.501 12.040 23.298 36 HA GLU 6 HA GLU 6 -5.833 10.896 25.373 37 HB2 GLU 6 2HB GLU 6 -7.665 9.230 24.576 38 HB3 GLU 6 1HB GLU 6 -6.835 9.244 23.038 39 HG2 GLU 6 2HG GLU 6 -5.670 8.317 25.662 40 HG3 GLU 6 1HG GLU 6 -6.310 7.280 24.401 41 H THR 7 H THR 7 -4.179 12.215 24.778 42 HA THR 7 HA THR 7 -3.470 12.245 21.945 43 HB THR 7 HB THR 7 -4.144 14.473 22.691 44 HG1 THR 7 1HG THR 7 -2.677 14.957 21.347 45 HG21 THR 7 1HG2 THR 7 -2.886 15.699 24.411 46 HG22 THR 7 2HG2 THR 7 -1.937 14.250 24.750 47 HG23 THR 7 3HG2 THR 7 -3.669 14.268 25.080 48 H VAL 8 H VAL 8 -1.405 11.854 21.363 49 HA VAL 8 HA VAL 8 0.485 11.233 23.481 50 HB VAL 8 HB VAL 8 -0.486 9.102 22.686 51 HG11 VAL 8 1HG1 VAL 8 -1.116 9.729 20.437 52 HG12 VAL 8 2HG1 VAL 8 -0.104 8.282 20.413 53 HG13 VAL 8 3HG1 VAL 8 0.581 9.846 19.975 54 HG21 VAL 8 1HG2 VAL 8 1.604 7.927 22.122 55 HG22 VAL 8 2HG2 VAL 8 1.817 9.072 23.447 56 HG23 VAL 8 3HG2 VAL 8 2.380 9.486 21.829 57 H ARG 9 H ARG 9 2.491 11.970 23.099 58 HA ARG 9 HA ARG 9 2.824 13.634 20.764 59 HB2 ARG 9 2HB ARG 9 4.661 13.207 23.137 60 HB3 ARG 9 1HB ARG 9 5.049 14.244 21.784 61 HG2 ARG 9 2HG ARG 9 4.295 15.626 23.581 62 HG3 ARG 9 1HG ARG 9 3.045 15.623 22.347 63 HD2 ARG 9 2HD ARG 9 1.794 13.938 23.650 64 HD3 ARG 9 1HD ARG 9 3.049 14.002 24.888 65 HE ARG 9 HE ARG 9 2.166 16.574 24.469 66 HH11 ARG 9 1HH1 ARG 9 0.913 13.522 25.755 67 HH12 ARG 9 2HH1 ARG 9 -0.259 14.240 26.752 68 HH21 ARG 9 1HH2 ARG 9 0.540 17.587 25.841 69 HH22 ARG 9 2HH2 ARG 9 -0.482 16.632 26.797 70 H PHE 10 H PHE 10 3.962 13.155 19.033 71 HA PHE 10 HA PHE 10 5.097 10.493 18.920 72 HB2 PHE 10 2HB PHE 10 4.804 12.550 16.713 73 HB3 PHE 10 1HB PHE 10 5.227 10.855 16.513 74 HD1 PHE 10 1HD PHE 10 3.501 9.110 17.067 75 HD2 PHE 10 2HD PHE 10 2.587 13.253 16.805 76 HE1 PHE 10 1HE PHE 10 1.109 8.572 16.834 77 HE2 PHE 10 2HE PHE 10 0.213 12.722 16.578 78 HZ PHE 10 HZ PHE 10 -0.536 10.381 16.590 79 H ASP 11 H ASP 11 6.969 10.648 20.024 80 HA ASP 11 HA ASP 11 8.743 12.862 19.760 81 HB2 ASP 11 2HB ASP 11 8.672 11.332 21.754 82 HB3 ASP 11 1HB ASP 11 9.413 10.087 20.752 83 H PHE 12 H PHE 12 10.514 13.116 18.457 84 HA PHE 12 HA PHE 12 10.300 11.543 16.143 85 HB2 PHE 12 2HB PHE 12 12.038 13.040 15.092 86 HB3 PHE 12 1HB PHE 12 10.551 13.808 15.607 87 HD1 PHE 12 1HD PHE 12 10.558 15.431 17.397 88 HD2 PHE 12 2HD PHE 12 14.155 13.496 16.215 89 HE1 PHE 12 1HE PHE 12 11.863 17.119 18.616 90 HE2 PHE 12 2HE PHE 12 15.466 15.178 17.439 91 HZ PHE 12 HZ PHE 12 14.324 16.992 18.638 92 H ASP 13 H ASP 13 10.776 9.622 16.890 93 HA ASP 13 HA ASP 13 13.570 8.897 17.158 94 HB2 ASP 13 2HB ASP 13 11.989 7.540 18.420 95 HB3 ASP 13 1HB ASP 13 11.040 7.240 16.976 96 H ASP 14 H ASP 14 14.793 8.563 15.467 97 HA ASP 14 HA ASP 14 13.473 8.569 12.870 98 HB2 ASP 14 2HB ASP 14 15.005 10.398 13.254 99 HB3 ASP 14 1HB ASP 14 16.281 9.256 13.650 100 H ASN 15 H ASN 15 13.332 6.787 11.793 101 HA ASN 15 HA ASN 15 14.847 4.447 12.507 102 HB2 ASN 15 2HB ASN 15 12.937 4.930 10.207 103 HB3 ASN 15 1HB ASN 15 13.619 3.371 10.636 104 HD21 ASN 15 1HD2 ASN 15 13.302 3.917 13.533 105 HD22 ASN 15 2HD2 ASN 15 11.633 3.732 13.863 106 H ARG 16 H ARG 16 16.651 3.772 11.577 107 HA ARG 16 HA ARG 16 18.221 5.524 10.110 108 HB2 ARG 16 2HB ARG 16 19.191 3.885 11.549 109 HB3 ARG 16 1HB ARG 16 18.555 2.577 10.568 110 HG2 ARG 16 2HG ARG 16 20.008 3.298 8.724 111 HG3 ARG 16 1HG ARG 16 20.650 4.575 9.759 112 HD2 ARG 16 2HD ARG 16 21.448 2.930 11.331 113 HD3 ARG 16 1HD ARG 16 20.741 1.643 10.360 114 HE ARG 16 HE ARG 16 22.570 3.261 8.907 115 HH11 ARG 16 1HH1 ARG 16 22.279 0.468 11.060 116 HH12 ARG 16 2HH1 ARG 16 23.764 -0.219 10.633 117 HH21 ARG 16 1HH2 ARG 16 24.652 2.282 8.279 118 HH22 ARG 16 2HH2 ARG 16 25.133 0.831 9.044 119 H LYS 17 H LYS 17 17.299 2.316 8.760 120 HA LYS 17 HA LYS 17 16.830 3.575 6.195 121 HB2 LYS 17 2HB LYS 17 19.341 3.207 6.488 122 HB3 LYS 17 1HB LYS 17 19.000 1.487 6.497 123 HG2 LYS 17 2HG LYS 17 19.762 2.162 4.313 124 HG3 LYS 17 1HG LYS 17 18.068 1.699 4.227 125 HD2 LYS 17 2HD LYS 17 17.394 4.029 4.278 126 HD3 LYS 17 1HD LYS 17 19.084 4.522 4.435 127 HE2 LYS 17 2HE LYS 17 19.558 3.502 2.275 128 HE3 LYS 17 1HE LYS 17 17.875 3.034 2.110 129 HZ1 LYS 17 1HZ LYS 17 18.903 5.810 2.288 130 HZ2 LYS 17 2HZ LYS 17 17.284 5.384 2.200 131 HZ3 LYS 17 3HZ LYS 17 18.300 5.056 0.903 132 H LYS 18 H LYS 18 15.783 2.036 4.681 133 HA LYS 18 HA LYS 18 14.191 0.568 4.228 134 HB2 LYS 18 2HB LYS 18 15.844 -1.233 6.016 135 HB3 LYS 18 1HB LYS 18 14.340 -1.785 5.315 136 HG2 LYS 18 2HG LYS 18 16.060 -2.604 3.948 137 HG3 LYS 18 1HG LYS 18 15.315 -1.288 3.057 138 HD2 LYS 18 2HD LYS 18 17.688 -1.134 2.785 139 HD3 LYS 18 1HD LYS 18 17.143 0.173 3.838 140 HE2 LYS 18 2HE LYS 18 19.219 -0.882 4.665 141 HE3 LYS 18 1HE LYS 18 17.894 -1.062 5.810 142 HZ1 LYS 18 1HZ LYS 18 17.547 -3.303 4.992 143 HZ2 LYS 18 2HZ LYS 18 19.130 -3.150 5.523 144 HZ3 LYS 18 3HZ LYS 18 18.757 -3.150 3.872 145 H ALA 19 H ALA 19 13.717 2.427 6.176 146 HA ALA 19 HA ALA 19 12.548 1.466 8.547 147 HB1 ALA 19 1HB ALA 19 13.269 3.744 8.198 148 HB2 ALA 19 2HB ALA 19 11.584 3.603 8.751 149 HB3 ALA 19 3HB ALA 19 11.938 3.935 7.034 150 H ILE 20 H ILE 20 11.182 2.193 5.390 151 HA ILE 20 HA ILE 20 8.468 1.893 6.184 152 HB ILE 20 HB ILE 20 9.727 1.712 3.422 153 HG12 ILE 20 2HG1 ILE 20 8.411 4.051 4.825 154 HG13 ILE 20 1HG1 ILE 20 10.143 3.849 4.610 155 HG21 ILE 20 1HG2 ILE 20 6.845 2.138 4.203 156 HG22 ILE 20 2HG2 ILE 20 7.523 0.683 3.475 157 HG23 ILE 20 3HG2 ILE 20 7.495 2.189 2.561 158 HD11 ILE 20 1HD1 ILE 20 9.230 5.411 3.004 159 HD12 ILE 20 2HD1 ILE 20 8.106 4.183 2.424 160 HD13 ILE 20 3HD1 ILE 20 9.841 3.969 2.189 161 H SER 21 H SER 21 10.927 -0.128 4.940 162 HA SER 21 HA SER 21 9.282 -2.425 4.427 163 HB2 SER 21 2HB SER 21 12.283 -2.265 4.807 164 HB3 SER 21 1HB SER 21 11.393 -3.614 4.099 165 HG SER 21 HG SER 21 10.598 -1.583 2.730 166 H GLU 22 H GLU 22 11.119 -1.197 7.086 167 HA GLU 22 HA GLU 22 11.136 -3.528 8.721 168 HB2 GLU 22 2HB GLU 22 12.730 -1.584 8.802 169 HB3 GLU 22 1HB GLU 22 11.425 -0.632 9.464 170 HG2 GLU 22 2HG GLU 22 12.899 -1.344 11.165 171 HG3 GLU 22 1HG GLU 22 11.310 -2.084 11.389 172 H THR 23 H THR 23 9.317 -0.502 8.685 173 HA THR 23 HA THR 23 7.837 -0.911 11.001 174 HB THR 23 HB THR 23 7.192 0.800 8.599 175 HG1 THR 23 1HG THR 23 9.108 1.435 9.471 176 HG21 THR 23 1HG2 THR 23 5.204 0.489 9.994 177 HG22 THR 23 2HG2 THR 23 5.819 2.127 10.185 178 HG23 THR 23 3HG2 THR 23 6.121 0.914 11.434 179 H LEU 24 H LEU 24 6.825 -1.454 7.603 180 HA LEU 24 HA LEU 24 4.241 -2.342 8.333 181 HB2 LEU 24 2HB LEU 24 5.782 -2.890 5.805 182 HB3 LEU 24 1HB LEU 24 4.071 -3.187 6.037 183 HG LEU 24 HG LEU 24 5.422 -0.494 6.020 184 HD11 LEU 24 1HD1 LEU 24 3.564 -1.828 4.070 185 HD12 LEU 24 2HD1 LEU 24 5.279 -1.494 3.824 186 HD13 LEU 24 3HD1 LEU 24 4.131 -0.165 3.972 187 HD21 LEU 24 1HD2 LEU 24 3.533 -0.498 7.571 188 HD22 LEU 24 2HD2 LEU 24 2.501 -1.211 6.329 189 HD23 LEU 24 3HD2 LEU 24 3.141 0.419 6.121 190 H GLU 25 H GLU 25 7.283 -3.961 8.053 191 HA GLU 25 HA GLU 25 6.291 -6.611 7.964 192 HB2 GLU 25 2HB GLU 25 8.558 -5.901 7.252 193 HB3 GLU 25 1HB GLU 25 8.949 -5.537 8.920 194 HG2 GLU 25 2HG GLU 25 8.690 -7.904 9.488 195 HG3 GLU 25 1HG GLU 25 8.291 -8.238 7.801 196 H THR 26 H THR 26 7.177 -4.361 10.530 197 HA THR 26 HA THR 26 6.815 -6.205 12.674 198 HB THR 26 HB THR 26 6.689 -3.174 12.739 199 HG1 THR 26 1HG THR 26 8.737 -4.778 12.131 200 HG21 THR 26 1HG2 THR 26 7.335 -3.449 15.077 201 HG22 THR 26 2HG2 THR 26 7.359 -5.208 14.870 202 HG23 THR 26 3HG2 THR 26 5.840 -4.335 14.720 203 H VAL 27 H VAL 27 4.814 -3.727 11.128 204 HA VAL 27 HA VAL 27 2.579 -3.897 12.804 205 HB VAL 27 HB VAL 27 2.671 -3.138 9.857 206 HG11 VAL 27 1HG1 VAL 27 0.404 -3.732 10.530 207 HG12 VAL 27 2HG1 VAL 27 0.540 -1.993 10.268 208 HG13 VAL 27 3HG1 VAL 27 0.518 -2.642 11.909 209 HG21 VAL 27 1HG2 VAL 27 2.650 -1.403 12.326 210 HG22 VAL 27 2HG2 VAL 27 2.662 -0.834 10.660 211 HG23 VAL 27 3HG2 VAL 27 4.052 -1.707 11.303 212 H TYR 28 H TYR 28 3.457 -5.746 9.951 213 HA TYR 28 HA TYR 28 1.046 -7.071 9.513 214 HB2 TYR 28 2HB TYR 28 2.974 -7.119 7.929 215 HB3 TYR 28 1HB TYR 28 3.839 -8.169 9.040 216 HD1 TYR 28 1HD TYR 28 3.087 -10.495 9.350 217 HD2 TYR 28 2HD TYR 28 1.260 -7.988 6.457 218 HE1 TYR 28 1HE TYR 28 2.105 -12.469 8.252 219 HE2 TYR 28 2HE TYR 28 0.272 -9.985 5.347 220 HH TYR 28 HH TYR 28 0.243 -13.000 6.857 221 H ARG 29 H ARG 29 3.757 -7.974 11.598 222 HA ARG 29 HA ARG 29 2.694 -10.425 12.518 223 HB2 ARG 29 2HB ARG 29 4.755 -8.572 13.676 224 HB3 ARG 29 1HB ARG 29 4.276 -10.063 14.466 225 HG2 ARG 29 2HG ARG 29 5.427 -9.873 11.692 226 HG3 ARG 29 1HG ARG 29 6.333 -10.302 13.150 227 HD2 ARG 29 2HD ARG 29 3.993 -11.817 11.982 228 HD3 ARG 29 1HD ARG 29 5.678 -12.310 11.951 229 HE ARG 29 HE ARG 29 5.320 -12.061 14.552 230 HH11 ARG 29 1HH1 ARG 29 3.121 -13.518 12.207 231 HH12 ARG 29 2HH1 ARG 29 2.577 -14.750 13.257 232 HH21 ARG 29 1HH2 ARG 29 4.539 -13.723 16.017 233 HH22 ARG 29 2HH2 ARG 29 3.394 -14.859 15.455 234 H ALA 30 H ALA 30 2.272 -7.177 13.583 235 HA ALA 30 HA ALA 30 1.209 -7.697 16.141 236 HB1 ALA 30 1HB ALA 30 1.965 -5.450 15.461 237 HB2 ALA 30 2HB ALA 30 0.316 -5.418 16.083 238 HB3 ALA 30 3HB ALA 30 0.608 -5.335 14.347 239 H LEU 31 H LEU 31 -0.351 -7.342 13.005 240 HA LEU 31 HA LEU 31 -2.928 -7.803 14.122 241 HB2 LEU 31 2HB LEU 31 -2.043 -7.741 11.264 242 HB3 LEU 31 1HB LEU 31 -3.686 -8.122 11.724 243 HG LEU 31 HG LEU 31 -3.710 -5.865 11.083 244 HD11 LEU 31 1HD1 LEU 31 -4.345 -4.656 13.033 245 HD12 LEU 31 2HD1 LEU 31 -3.644 -5.904 14.056 246 HD13 LEU 31 3HD1 LEU 31 -5.008 -6.285 13.005 247 HD21 LEU 31 1HD2 LEU 31 -1.350 -5.374 12.889 248 HD22 LEU 31 2HD2 LEU 31 -2.231 -4.145 11.981 249 HD23 LEU 31 3HD2 LEU 31 -1.321 -5.390 11.126 250 H GLU 32 H GLU 32 -0.499 -9.905 12.758 251 HA GLU 32 HA GLU 32 -2.195 -12.125 12.427 252 HB2 GLU 32 2HB GLU 32 0.750 -12.114 13.094 253 HB3 GLU 32 1HB GLU 32 -0.163 -13.553 12.688 254 HG2 GLU 32 2HG GLU 32 -0.671 -12.512 10.487 255 HG3 GLU 32 1HG GLU 32 0.431 -11.201 10.917 256 H GLU 33 H GLU 33 -0.234 -11.133 15.209 257 HA GLU 33 HA GLU 33 -1.190 -13.319 16.727 258 HB2 GLU 33 2HB GLU 33 0.240 -10.835 17.672 259 HB3 GLU 33 1HB GLU 33 -0.062 -12.261 18.662 260 HG2 GLU 33 2HG GLU 33 1.200 -13.610 16.992 261 HG3 GLU 33 1HG GLU 33 1.616 -12.113 16.171 262 H LYS 34 H LYS 34 -2.419 -10.173 16.161 263 HA LYS 34 HA LYS 34 -4.370 -10.289 18.294 264 HB2 LYS 34 2HB LYS 34 -3.920 -8.463 15.974 265 HB3 LYS 34 1HB LYS 34 -5.457 -8.438 16.809 266 HG2 LYS 34 2HG LYS 34 -2.803 -7.995 18.161 267 HG3 LYS 34 1HG LYS 34 -3.822 -6.700 17.530 268 HD2 LYS 34 2HD LYS 34 -5.672 -7.545 18.993 269 HD3 LYS 34 1HD LYS 34 -4.523 -8.674 19.711 270 HE2 LYS 34 2HE LYS 34 -3.139 -6.818 20.448 271 HE3 LYS 34 1HE LYS 34 -4.237 -5.674 19.688 272 HZ1 LYS 34 1HZ LYS 34 -4.859 -7.442 22.007 273 HZ2 LYS 34 2HZ LYS 34 -5.981 -6.456 21.251 274 HZ3 LYS 34 3HZ LYS 34 -4.655 -5.787 22.030 275 H GLY 35 H GLY 35 -4.113 -11.828 15.309 276 HA2 GLY 35 2HA GLY 35 -5.571 -13.344 14.352 277 HA3 GLY 35 1HA GLY 35 -6.753 -12.928 15.575 278 H TYR 36 H TYR 36 -5.295 -10.519 13.500 279 HA TYR 36 HA TYR 36 -7.900 -10.213 12.138 280 HB2 TYR 36 2HB TYR 36 -5.743 -8.150 12.609 281 HB3 TYR 36 1HB TYR 36 -7.187 -7.863 11.667 282 HD1 TYR 36 1HD TYR 36 -5.671 -7.442 14.751 283 HD2 TYR 36 2HD TYR 36 -9.445 -8.330 13.040 284 HE1 TYR 36 1HE TYR 36 -6.777 -6.649 16.805 285 HE2 TYR 36 2HE TYR 36 -10.566 -7.546 15.078 286 HH TYR 36 HH TYR 36 -10.012 -7.259 17.460 287 H ASN 37 H ASN 37 -7.544 -9.094 9.927 288 HA ASN 37 HA ASN 37 -5.494 -10.531 8.472 289 HB2 ASN 37 2HB ASN 37 -7.805 -10.326 7.520 290 HB3 ASN 37 1HB ASN 37 -7.624 -8.581 7.501 291 HD21 ASN 37 1HD2 ASN 37 -8.164 -10.352 5.290 292 HD22 ASN 37 2HD2 ASN 37 -6.900 -10.140 4.147 293 HA PRO 38 HA PRO 38 -2.886 -7.025 9.496 294 HB2 PRO 38 2HB PRO 38 -1.077 -8.303 7.538 295 HB3 PRO 38 1HB PRO 38 -0.785 -7.846 9.221 296 HG2 PRO 38 2HG PRO 38 -1.084 -10.407 8.524 297 HG3 PRO 38 1HG PRO 38 -1.712 -9.784 10.057 298 HD2 PRO 38 2HD PRO 38 -3.166 -10.424 7.534 299 HD3 PRO 38 1HD PRO 38 -3.654 -10.660 9.229 300 H ILE 39 H ILE 39 -3.379 -8.156 6.209 301 HA ILE 39 HA ILE 39 -2.339 -5.846 4.941 302 HB ILE 39 HB ILE 39 -4.278 -7.916 3.889 303 HG12 ILE 39 2HG1 ILE 39 -2.202 -8.918 4.663 304 HG13 ILE 39 1HG1 ILE 39 -2.289 -8.980 2.908 305 HG21 ILE 39 1HG2 ILE 39 -3.529 -7.218 1.656 306 HG22 ILE 39 2HG2 ILE 39 -2.557 -5.941 2.388 307 HG23 ILE 39 3HG2 ILE 39 -4.314 -5.899 2.523 308 HD11 ILE 39 1HD1 ILE 39 -0.746 -7.087 2.777 309 HD12 ILE 39 2HD1 ILE 39 -0.044 -8.408 3.721 310 HD13 ILE 39 3HD1 ILE 39 -0.696 -7.000 4.534 311 H ASN 40 H ASN 40 -5.699 -6.919 5.667 312 HA ASN 40 HA ASN 40 -7.136 -4.915 4.587 313 HB2 ASN 40 2HB ASN 40 -7.832 -7.084 5.643 314 HB3 ASN 40 1HB ASN 40 -7.619 -6.302 7.204 315 HD21 ASN 40 1HD2 ASN 40 -9.387 -6.454 4.328 316 HD22 ASN 40 2HD2 ASN 40 -10.744 -5.537 4.864 317 H GLN 41 H GLN 41 -5.585 -5.108 7.746 318 HA GLN 41 HA GLN 41 -6.670 -2.648 8.675 319 HB2 GLN 41 2HB GLN 41 -4.338 -4.227 9.747 320 HB3 GLN 41 1HB GLN 41 -5.187 -2.941 10.595 321 HG2 GLN 41 2HG GLN 41 -6.362 -5.583 9.744 322 HG3 GLN 41 1HG GLN 41 -5.902 -5.133 11.380 323 HE21 GLN 41 1HE2 GLN 41 -6.962 -2.409 11.108 324 HE22 GLN 41 2HE2 GLN 41 -8.673 -2.566 11.153 325 H ILE 42 H ILE 42 -3.566 -3.589 7.257 326 HA ILE 42 HA ILE 42 -2.324 -1.083 7.643 327 HB ILE 42 HB ILE 42 -1.697 -3.225 5.580 328 HG12 ILE 42 2HG1 ILE 42 -0.363 -2.536 8.212 329 HG13 ILE 42 1HG1 ILE 42 -1.420 -3.914 7.941 330 HG21 ILE 42 1HG2 ILE 42 -0.080 -0.789 6.364 331 HG22 ILE 42 2HG2 ILE 42 -0.855 -1.071 4.812 332 HG23 ILE 42 3HG2 ILE 42 0.486 -2.098 5.318 333 HD11 ILE 42 1HD1 ILE 42 0.206 -4.833 6.352 334 HD12 ILE 42 2HD1 ILE 42 0.918 -4.578 7.946 335 HD13 ILE 42 3HD1 ILE 42 1.260 -3.448 6.635 336 H VAL 43 H VAL 43 -4.008 -2.427 4.790 337 HA VAL 43 HA VAL 43 -3.702 -0.087 3.253 338 HB VAL 43 HB VAL 43 -4.296 -2.146 2.055 339 HG11 VAL 43 1HG1 VAL 43 -5.659 -3.225 3.781 340 HG12 VAL 43 2HG1 VAL 43 -6.513 -3.184 2.241 341 HG13 VAL 43 3HG1 VAL 43 -6.941 -2.044 3.520 342 HG21 VAL 43 1HG2 VAL 43 -6.602 -0.217 1.875 343 HG22 VAL 43 2HG2 VAL 43 -6.124 -1.375 0.641 344 HG23 VAL 43 3HG2 VAL 43 -5.058 -0.023 1.063 345 H GLY 44 H GLY 44 -6.135 -1.029 5.569 346 HA2 GLY 44 2HA GLY 44 -7.962 1.068 5.146 347 HA3 GLY 44 1HA GLY 44 -7.757 0.178 6.652 348 H TYR 45 H TYR 45 -5.149 0.798 7.286 349 HA TYR 45 HA TYR 45 -5.404 3.357 8.419 350 HB2 TYR 45 2HB TYR 45 -3.916 1.780 9.502 351 HB3 TYR 45 1HB TYR 45 -2.924 1.657 8.050 352 HD1 TYR 45 1HD TYR 45 -1.340 3.377 7.471 353 HD2 TYR 45 2HD TYR 45 -3.789 3.821 10.911 354 HE1 TYR 45 1HE TYR 45 0.051 5.244 8.197 355 HE2 TYR 45 2HE TYR 45 -2.401 5.701 11.657 356 HH TYR 45 HH TYR 45 -0.075 6.503 11.293 357 H LEU 46 H LEU 46 -3.429 2.208 5.745 358 HA LEU 46 HA LEU 46 -2.105 4.567 5.257 359 HB2 LEU 46 2HB LEU 46 -2.739 2.318 3.387 360 HB3 LEU 46 1HB LEU 46 -1.630 3.622 3.006 361 HG LEU 46 HG LEU 46 -1.282 1.735 5.337 362 HD11 LEU 46 1HD1 LEU 46 0.496 0.718 4.005 363 HD12 LEU 46 2HD1 LEU 46 0.051 1.749 2.635 364 HD13 LEU 46 3HD1 LEU 46 -1.088 0.549 3.247 365 HD21 LEU 46 1HD2 LEU 46 -0.210 3.892 5.686 366 HD22 LEU 46 2HD2 LEU 46 0.579 3.769 4.110 367 HD23 LEU 46 3HD2 LEU 46 0.991 2.637 5.397 368 H LEU 47 H LEU 47 -5.255 3.601 4.070 369 HA LEU 47 HA LEU 47 -5.368 5.751 2.193 370 HB2 LEU 47 2HB LEU 47 -7.550 3.964 3.241 371 HB3 LEU 47 1HB LEU 47 -7.746 5.123 1.942 372 HG LEU 47 HG LEU 47 -5.967 2.682 1.888 373 HD11 LEU 47 1HD1 LEU 47 -7.540 1.859 0.213 374 HD12 LEU 47 2HD1 LEU 47 -8.546 3.287 0.458 375 HD13 LEU 47 3HD1 LEU 47 -8.324 2.127 1.769 376 HD21 LEU 47 1HD2 LEU 47 -5.653 3.228 -0.491 377 HD22 LEU 47 2HD2 LEU 47 -4.990 4.482 0.555 378 HD23 LEU 47 3HD2 LEU 47 -6.539 4.733 -0.261 379 H SER 48 H SER 48 -5.883 5.656 5.594 380 HA SER 48 HA SER 48 -7.362 8.197 5.326 381 HB2 SER 48 2HB SER 48 -8.892 6.376 6.002 382 HB3 SER 48 1HB SER 48 -7.912 6.102 7.434 383 HG SER 48 HG SER 48 -8.403 8.466 7.877 384 H GLY 49 H GLY 49 -4.660 6.646 6.821 385 HA2 GLY 49 2HA GLY 49 -3.209 7.259 8.427 386 HA3 GLY 49 1HA GLY 49 -3.651 8.941 8.067 387 H ASP 50 H ASP 50 -5.507 6.251 9.451 388 HA ASP 50 HA ASP 50 -5.702 7.875 11.871 389 HB2 ASP 50 2HB ASP 50 -7.852 7.685 10.675 390 HB3 ASP 50 1HB ASP 50 -7.764 5.932 10.829 391 HA PRO 51 HA PRO 51 -3.312 4.639 13.602 392 HB2 PRO 51 2HB PRO 51 -3.625 5.258 16.236 393 HB3 PRO 51 1HB PRO 51 -2.564 6.123 15.115 394 HG2 PRO 51 2HG PRO 51 -5.345 6.829 15.990 395 HG3 PRO 51 1HG PRO 51 -3.919 7.876 15.864 396 HD2 PRO 51 2HD PRO 51 -5.798 7.844 13.952 397 HD3 PRO 51 1HD PRO 51 -4.078 8.024 13.545 398 H ALA 52 H ALA 52 -6.718 4.938 14.438 399 HA ALA 52 HA ALA 52 -6.813 2.706 16.179 400 HB1 ALA 52 1HB ALA 52 -9.057 3.908 14.567 401 HB2 ALA 52 2HB ALA 52 -8.567 4.407 16.183 402 HB3 ALA 52 3HB ALA 52 -9.240 2.797 15.923 403 H TYR 53 H TYR 53 -6.443 2.852 12.831 404 HA TYR 53 HA TYR 53 -7.652 0.403 12.178 405 HB2 TYR 53 2HB TYR 53 -5.580 2.052 10.800 406 HB3 TYR 53 1HB TYR 53 -6.064 0.477 10.163 407 HD1 TYR 53 1HD TYR 53 -8.469 0.073 9.708 408 HD2 TYR 53 2HD TYR 53 -6.924 3.958 10.410 409 HE1 TYR 53 1HE TYR 53 -10.428 0.995 8.699 410 HE2 TYR 53 2HE TYR 53 -8.924 4.943 9.374 411 HH TYR 53 HH TYR 53 -10.700 4.313 7.795 412 H ILE 54 H ILE 54 -4.569 1.211 13.602 413 HA ILE 54 HA ILE 54 -3.852 -1.623 13.502 414 HB ILE 54 HB ILE 54 -1.945 0.704 14.103 415 HG12 ILE 54 2HG1 ILE 54 -2.658 0.833 11.745 416 HG13 ILE 54 1HG1 ILE 54 -0.996 0.276 11.862 417 HG21 ILE 54 1HG2 ILE 54 -0.184 -0.936 13.834 418 HG22 ILE 54 2HG2 ILE 54 -1.387 -2.204 13.603 419 HG23 ILE 54 3HG2 ILE 54 -1.284 -1.363 15.146 420 HD11 ILE 54 1HD1 ILE 54 -3.404 -1.460 11.342 421 HD12 ILE 54 2HD1 ILE 54 -1.734 -2.019 11.466 422 HD13 ILE 54 3HD1 ILE 54 -2.210 -0.941 10.155 423 HA PRO 55 HA PRO 55 -5.183 -1.212 17.776 424 HB2 PRO 55 2HB PRO 55 -4.801 -3.831 18.450 425 HB3 PRO 55 1HB PRO 55 -6.232 -3.250 17.589 426 HG2 PRO 55 2HG PRO 55 -3.789 -4.587 16.517 427 HG3 PRO 55 1HG PRO 55 -5.485 -4.818 16.060 428 HD2 PRO 55 2HD PRO 55 -3.752 -3.338 14.611 429 HD3 PRO 55 1HD PRO 55 -5.486 -2.971 14.673 430 H ARG 56 H ARG 56 -4.163 -1.074 19.716 431 HA ARG 56 HA ARG 56 -1.325 -0.934 19.553 432 HB2 ARG 56 2HB ARG 56 -1.415 -0.050 21.902 433 HB3 ARG 56 1HB ARG 56 -2.323 0.880 20.722 434 HG2 ARG 56 2HG ARG 56 -4.388 -0.201 21.524 435 HG3 ARG 56 1HG ARG 56 -3.443 -1.055 22.744 436 HD2 ARG 56 2HD ARG 56 -3.638 1.946 22.475 437 HD3 ARG 56 1HD ARG 56 -4.561 0.979 23.616 438 HE ARG 56 HE ARG 56 -1.873 0.404 24.016 439 HH11 ARG 56 1HH1 ARG 56 -3.973 3.257 24.294 440 HH12 ARG 56 2HH1 ARG 56 -3.126 3.932 25.600 441 HH21 ARG 56 1HH2 ARG 56 -0.713 1.349 25.846 442 HH22 ARG 56 2HH2 ARG 56 -1.258 2.813 26.513 443 H TYR 57 H TYR 57 -0.942 -3.036 19.148 444 HA TYR 57 HA TYR 57 -0.950 -4.855 21.459 445 HB2 TYR 57 2HB TYR 57 -1.775 -5.734 19.278 446 HB3 TYR 57 1HB TYR 57 -0.208 -5.388 18.569 447 HD1 TYR 57 1HD TYR 57 -1.581 -7.251 21.520 448 HD2 TYR 57 2HD TYR 57 1.237 -7.187 18.332 449 HE1 TYR 57 1HE TYR 57 -0.818 -9.473 22.163 450 HE2 TYR 57 2HE TYR 57 2.017 -9.430 18.985 451 HH TYR 57 HH TYR 57 0.294 -11.389 21.155 452 H GLN 58 H GLN 58 1.141 -3.269 19.139 453 HA GLN 58 HA GLN 58 3.356 -3.463 20.995 454 HB2 GLN 58 2HB GLN 58 3.589 -4.126 18.032 455 HB3 GLN 58 1HB GLN 58 4.925 -3.985 19.164 456 HG2 GLN 58 2HG GLN 58 4.076 -5.911 20.407 457 HG3 GLN 58 1HG GLN 58 2.747 -6.058 19.269 458 HE21 GLN 58 1HE2 GLN 58 4.557 -5.391 16.961 459 HE22 GLN 58 2HE2 GLN 58 5.464 -6.846 16.722 460 H ASP 59 H ASP 59 5.171 -1.955 19.984 461 HA ASP 59 HA ASP 59 3.955 0.570 19.834 462 HB2 ASP 59 2HB ASP 59 6.162 1.570 19.742 463 HB3 ASP 59 1HB ASP 59 6.125 0.309 20.944 464 H ALA 60 H ALA 60 4.491 -1.622 17.469 465 HA ALA 60 HA ALA 60 5.044 -0.285 15.141 466 HB1 ALA 60 1HB ALA 60 4.580 -2.700 15.302 467 HB2 ALA 60 2HB ALA 60 3.682 -1.936 13.990 468 HB3 ALA 60 3HB ALA 60 2.866 -2.338 15.498 469 H ARG 61 H ARG 61 2.117 -0.107 17.032 470 HA ARG 61 HA ARG 61 0.387 1.225 15.316 471 HB2 ARG 61 2HB ARG 61 -0.126 0.119 17.481 472 HB3 ARG 61 1HB ARG 61 0.730 1.366 18.331 473 HG2 ARG 61 2HG ARG 61 -1.777 1.835 16.724 474 HG3 ARG 61 1HG ARG 61 -1.772 1.422 18.427 475 HD2 ARG 61 2HD ARG 61 -0.418 3.518 18.816 476 HD3 ARG 61 1HD ARG 61 -0.718 3.933 17.122 477 HE ARG 61 HE ARG 61 -3.151 3.294 18.181 478 HH11 ARG 61 1HH1 ARG 61 -0.758 5.889 18.765 479 HH12 ARG 61 2HH1 ARG 61 -1.921 6.922 19.463 480 HH21 ARG 61 1HH2 ARG 61 -4.687 4.785 19.160 481 HH22 ARG 61 2HH2 ARG 61 -4.154 6.307 19.691 482 H ASN 62 H ASN 62 2.896 2.461 17.544 483 HA ASN 62 HA ASN 62 2.539 5.217 16.807 484 HB2 ASN 62 2HB ASN 62 3.499 4.547 19.021 485 HB3 ASN 62 1HB ASN 62 4.905 3.912 18.177 486 HD21 ASN 62 1HD2 ASN 62 6.335 5.295 19.143 487 HD22 ASN 62 2HD2 ASN 62 6.382 6.993 18.845 488 H LEU 63 H LEU 63 4.690 2.597 15.916 489 HA LEU 63 HA LEU 63 6.606 3.951 14.405 490 HB2 LEU 63 2HB LEU 63 5.462 1.205 13.857 491 HB3 LEU 63 1HB LEU 63 6.895 1.857 13.105 492 HG LEU 63 HG LEU 63 6.633 1.207 16.070 493 HD11 LEU 63 1HD1 LEU 63 8.216 -0.114 13.866 494 HD12 LEU 63 2HD1 LEU 63 6.772 -0.798 14.589 495 HD13 LEU 63 3HD1 LEU 63 8.223 -0.563 15.562 496 HD21 LEU 63 1HD2 LEU 63 8.944 2.175 14.409 497 HD22 LEU 63 2HD2 LEU 63 9.013 1.682 16.102 498 HD23 LEU 63 3HD2 LEU 63 8.090 3.111 15.631 499 H ILE 64 H ILE 64 3.523 2.620 13.335 500 HA ILE 64 HA ILE 64 3.896 3.453 10.642 501 HB ILE 64 HB ILE 64 2.469 1.498 11.415 502 HG12 ILE 64 2HG1 ILE 64 1.010 3.490 9.666 503 HG13 ILE 64 1HG1 ILE 64 2.309 2.438 9.114 504 HG21 ILE 64 1HG2 ILE 64 0.502 3.666 12.159 505 HG22 ILE 64 2HG2 ILE 64 1.306 2.559 13.262 506 HG23 ILE 64 3HG2 ILE 64 0.141 1.945 12.091 507 HD11 ILE 64 1HD1 ILE 64 0.940 0.475 9.650 508 HD12 ILE 64 2HD1 ILE 64 0.136 1.541 8.496 509 HD13 ILE 64 3HD1 ILE 64 -0.359 1.540 10.187 510 H ARG 65 H ARG 65 2.681 4.926 13.487 511 HA ARG 65 HA ARG 65 1.233 7.063 12.249 512 HB2 ARG 65 2HB ARG 65 1.771 6.171 14.981 513 HB3 ARG 65 1HB ARG 65 1.659 7.919 14.797 514 HG2 ARG 65 2HG ARG 65 -0.429 6.242 13.518 515 HG3 ARG 65 1HG ARG 65 -0.456 6.433 15.272 516 HD2 ARG 65 2HD ARG 65 -1.811 8.116 13.875 517 HD3 ARG 65 1HD ARG 65 -0.781 8.750 15.146 518 HE ARG 65 HE ARG 65 0.849 9.034 13.098 519 HH11 ARG 65 1HH1 ARG 65 -2.647 9.670 13.091 520 HH12 ARG 65 2HH1 ARG 65 -2.527 11.005 12.065 521 HH21 ARG 65 1HH2 ARG 65 1.000 10.929 11.773 522 HH22 ARG 65 2HH2 ARG 65 -0.408 11.750 11.305 523 H ARG 66 H ARG 66 4.486 6.497 12.858 524 HA ARG 66 HA ARG 66 5.120 9.319 12.812 525 HB2 ARG 66 2HB ARG 66 6.822 6.889 13.289 526 HB3 ARG 66 1HB ARG 66 7.542 8.470 12.998 527 HG2 ARG 66 2HG ARG 66 6.238 9.364 14.923 528 HG3 ARG 66 1HG ARG 66 5.653 7.717 15.201 529 HD2 ARG 66 2HD ARG 66 8.578 8.308 15.113 530 HD3 ARG 66 1HD ARG 66 7.644 8.585 16.576 531 HE ARG 66 HE ARG 66 6.996 6.208 16.363 532 HH11 ARG 66 1HH1 ARG 66 10.017 7.177 14.766 533 HH12 ARG 66 2HH1 ARG 66 10.913 5.874 15.368 534 HH21 ARG 66 1HH2 ARG 66 8.305 4.371 17.187 535 HH22 ARG 66 2HH2 ARG 66 9.916 4.239 16.721 536 H HIS 67 H HIS 67 4.174 7.452 10.537 537 HA HIS 67 HA HIS 67 5.822 8.848 8.586 538 HB2 HIS 67 2HB HIS 67 4.872 5.967 8.366 539 HB3 HIS 67 1HB HIS 67 5.493 6.888 7.001 540 HD1 HIS 67 1HD HIS 67 8.051 6.913 6.703 541 HD2 HIS 67 2HD HIS 67 6.876 5.467 10.437 542 HE1 HIS 67 1HE HIS 67 10.115 6.053 7.771 543 HE2 HIS 67 2HE HIS 67 9.428 5.674 10.133 544 H GLU 68 H GLU 68 4.720 9.728 6.861 545 HA GLU 68 HA GLU 68 1.964 10.305 7.554 546 HB2 GLU 68 2HB GLU 68 3.873 11.582 5.616 547 HB3 GLU 68 1HB GLU 68 2.202 12.098 5.818 548 HG2 GLU 68 2HG GLU 68 4.315 12.091 7.972 549 HG3 GLU 68 1HG GLU 68 3.742 13.508 7.089 550 H ARG 69 H ARG 69 2.728 7.807 6.263 551 HA ARG 69 HA ARG 69 1.848 6.280 4.867 552 HB2 ARG 69 2HB ARG 69 -0.305 8.338 4.216 553 HB3 ARG 69 1HB ARG 69 -0.330 6.729 3.575 554 HG2 ARG 69 2HG ARG 69 -1.779 6.487 5.215 555 HG3 ARG 69 1HG ARG 69 -0.330 6.130 6.158 556 HD2 ARG 69 2HD ARG 69 -1.440 8.889 5.928 557 HD3 ARG 69 1HD ARG 69 -2.140 7.749 7.052 558 HE ARG 69 HE ARG 69 0.528 7.814 7.629 559 HH11 ARG 69 1HH1 ARG 69 -2.055 10.247 7.376 560 HH12 ARG 69 2HH1 ARG 69 -1.373 11.271 8.552 561 HH21 ARG 69 1HH2 ARG 69 1.421 9.219 9.210 562 HH22 ARG 69 2HH2 ARG 69 0.698 10.714 9.581 563 H ASP 70 H ASP 70 2.061 9.445 3.320 564 HA ASP 70 HA ASP 70 2.226 8.758 0.660 565 HB2 ASP 70 2HB ASP 70 3.612 10.945 2.176 566 HB3 ASP 70 1HB ASP 70 3.744 10.787 0.434 567 H GLU 71 H GLU 71 4.919 8.918 2.938 568 HA GLU 71 HA GLU 71 6.999 8.267 1.181 569 HB2 GLU 71 2HB GLU 71 6.856 7.246 4.019 570 HB3 GLU 71 1HB GLU 71 8.290 7.570 3.069 571 HG2 GLU 71 2HG GLU 71 8.235 9.328 4.582 572 HG3 GLU 71 1HG GLU 71 7.488 10.030 3.150 573 H ILE 72 H ILE 72 5.003 6.252 3.179 574 HA ILE 72 HA ILE 72 6.112 3.747 2.560 575 HB ILE 72 HB ILE 72 3.308 4.434 3.453 576 HG12 ILE 72 2HG1 ILE 72 5.746 3.665 5.088 577 HG13 ILE 72 1HG1 ILE 72 5.028 5.265 4.995 578 HG21 ILE 72 1HG2 ILE 72 3.385 2.185 2.541 579 HG22 ILE 72 2HG2 ILE 72 3.209 2.113 4.295 580 HG23 ILE 72 3HG2 ILE 72 4.779 1.803 3.551 581 HD11 ILE 72 1HD1 ILE 72 3.706 2.805 6.127 582 HD12 ILE 72 2HD1 ILE 72 2.999 4.417 6.056 583 HD13 ILE 72 3HD1 ILE 72 4.423 4.123 7.056 584 H MET 73 H MET 73 3.412 5.539 1.240 585 HA MET 73 HA MET 73 2.455 3.542 -0.454 586 HB2 MET 73 2HB MET 73 1.101 5.434 0.237 587 HB3 MET 73 1HB MET 73 2.126 6.525 -0.683 588 HG2 MET 73 2HG MET 73 0.068 6.016 -1.885 589 HG3 MET 73 1HG MET 73 1.505 5.412 -2.726 590 HE1 MET 73 1HE MET 73 -0.035 3.922 -4.240 591 HE2 MET 73 2HE MET 73 -1.461 4.503 -3.380 592 HE3 MET 73 3HE MET 73 -1.202 2.771 -3.593 593 H GLU 74 H GLU 74 4.755 6.212 -1.174 594 HA GLU 74 HA GLU 74 4.875 5.493 -3.918 595 HB2 GLU 74 2HB GLU 74 6.924 6.841 -4.113 596 HB3 GLU 74 1HB GLU 74 5.687 7.725 -3.239 597 HG2 GLU 74 2HG GLU 74 6.810 7.289 -1.149 598 HG3 GLU 74 1HG GLU 74 7.988 6.262 -1.955 599 H GLU 75 H GLU 75 6.612 4.479 -1.089 600 HA GLU 75 HA GLU 75 8.584 2.988 -2.424 601 HB2 GLU 75 2HB GLU 75 8.753 3.726 -0.067 602 HB3 GLU 75 1HB GLU 75 7.494 2.579 0.360 603 HG2 GLU 75 2HG GLU 75 9.687 1.691 0.892 604 HG3 GLU 75 1HG GLU 75 8.902 0.742 -0.376 605 H LEU 76 H LEU 76 5.400 2.123 -1.118 606 HA LEU 76 HA LEU 76 5.414 -0.627 -1.546 607 HB2 LEU 76 2HB LEU 76 3.113 1.281 -1.970 608 HB3 LEU 76 1HB LEU 76 2.960 -0.457 -1.881 609 HG LEU 76 HG LEU 76 3.835 1.362 0.360 610 HD11 LEU 76 1HD1 LEU 76 1.703 0.738 1.371 611 HD12 LEU 76 2HD1 LEU 76 1.287 -0.182 -0.074 612 HD13 LEU 76 3HD1 LEU 76 1.467 1.568 -0.167 613 HD21 LEU 76 1HD2 LEU 76 3.363 -1.618 0.320 614 HD22 LEU 76 2HD2 LEU 76 3.674 -0.643 1.759 615 HD23 LEU 76 3HD2 LEU 76 4.917 -0.805 0.519 616 H THR 77 H THR 77 4.557 1.942 -3.756 617 HA THR 77 HA THR 77 3.947 0.244 -5.936 618 HB THR 77 HB THR 77 4.697 3.181 -5.983 619 HG1 THR 77 1HG THR 77 2.940 2.842 -4.537 620 HG21 THR 77 1HG2 THR 77 4.614 2.097 -8.198 621 HG22 THR 77 2HG2 THR 77 3.284 3.240 -7.992 622 HG23 THR 77 3HG2 THR 77 2.989 1.508 -7.843 623 H LYS 78 H LYS 78 6.877 2.133 -4.992 624 HA LYS 78 HA LYS 78 8.342 1.837 -7.306 625 HB2 LYS 78 2HB LYS 78 8.465 3.338 -5.128 626 HB3 LYS 78 1HB LYS 78 9.541 2.067 -4.587 627 HG2 LYS 78 2HG LYS 78 9.878 3.642 -7.108 628 HG3 LYS 78 1HG LYS 78 10.653 4.039 -5.606 629 HD2 LYS 78 2HD LYS 78 10.978 1.384 -6.903 630 HD3 LYS 78 1HD LYS 78 11.908 2.833 -7.372 631 HE2 LYS 78 2HE LYS 78 13.252 1.516 -5.818 632 HE3 LYS 78 1HE LYS 78 12.639 2.938 -4.973 633 HZ1 LYS 78 1HZ LYS 78 12.572 0.886 -3.705 634 HZ2 LYS 78 2HZ LYS 78 11.486 0.190 -4.715 635 HZ3 LYS 78 3HZ LYS 78 11.055 1.540 -3.768 636 H TYR 79 H TYR 79 8.324 0.053 -4.258 637 HA TYR 79 HA TYR 79 10.451 -1.682 -4.948 638 HB2 TYR 79 2HB TYR 79 9.742 -1.043 -2.659 639 HB3 TYR 79 1HB TYR 79 8.287 -1.993 -2.881 640 HD1 TYR 79 1HD TYR 79 11.742 -1.992 -1.973 641 HD2 TYR 79 2HD TYR 79 8.520 -4.459 -3.137 642 HE1 TYR 79 1HE TYR 79 12.922 -3.927 -1.016 643 HE2 TYR 79 2HE TYR 79 9.672 -6.432 -2.180 644 HH TYR 79 HH TYR 79 11.924 -7.130 -1.611 645 H TYR 80 H TYR 80 6.914 -1.939 -5.088 646 HA TYR 80 HA TYR 80 6.586 -4.630 -5.755 647 HB2 TYR 80 2HB TYR 80 4.767 -3.000 -5.209 648 HB3 TYR 80 1HB TYR 80 5.021 -2.234 -6.759 649 HD1 TYR 80 1HD TYR 80 3.323 -4.797 -4.967 650 HD2 TYR 80 2HD TYR 80 4.480 -3.617 -8.876 651 HE1 TYR 80 1HE TYR 80 1.602 -6.273 -5.912 652 HE2 TYR 80 2HE TYR 80 2.749 -5.087 -9.839 653 HH TYR 80 HH TYR 80 0.301 -6.444 -7.933 654 H LEU 81 H LEU 81 6.956 -1.803 -7.823 655 HA LEU 81 HA LEU 81 6.952 -3.326 -10.194 656 HB2 LEU 81 2HB LEU 81 7.511 -0.432 -9.698 657 HB3 LEU 81 1HB LEU 81 7.471 -1.151 -11.302 658 HG LEU 81 HG LEU 81 5.147 -1.139 -9.366 659 HD11 LEU 81 1HD1 LEU 81 4.142 0.466 -10.898 660 HD12 LEU 81 2HD1 LEU 81 5.639 0.479 -11.838 661 HD13 LEU 81 3HD1 LEU 81 5.632 1.098 -10.188 662 HD21 LEU 81 1HD2 LEU 81 3.867 -1.900 -11.322 663 HD22 LEU 81 2HD2 LEU 81 5.107 -3.064 -10.863 664 HD23 LEU 81 3HD2 LEU 81 5.360 -2.004 -12.243 665 H ALA 82 H ALA 82 9.515 -2.254 -8.105 666 HA ALA 82 HA ALA 82 11.570 -2.400 -10.056 667 HB1 ALA 82 1HB ALA 82 11.868 -1.204 -7.944 668 HB2 ALA 82 2HB ALA 82 13.106 -2.444 -8.173 669 HB3 ALA 82 3HB ALA 82 11.765 -2.735 -7.066 670 H ASN 83 H ASN 83 9.958 -4.710 -8.085 671 HA ASN 83 HA ASN 83 11.893 -6.763 -8.547 672 HB2 ASN 83 2HB ASN 83 9.262 -6.773 -7.135 673 HB3 ASN 83 1HB ASN 83 10.108 -8.277 -7.488 674 HD21 ASN 83 1HD2 ASN 83 10.187 -5.294 -5.652 675 HD22 ASN 83 2HD2 ASN 83 11.454 -5.797 -4.600 676 H HIS 84 H HIS 84 9.843 -5.482 -10.630 677 HA HIS 84 HA HIS 84 9.293 -8.001 -11.996 678 HB2 HIS 84 2HB HIS 84 8.670 -5.140 -12.751 679 HB3 HIS 84 1HB HIS 84 8.538 -6.436 -13.931 680 HD1 HIS 84 1HD HIS 84 6.578 -8.076 -13.658 681 HD2 HIS 84 2HD HIS 84 6.638 -5.041 -10.843 682 HE1 HIS 84 1HE HIS 84 4.374 -8.185 -12.521 683 HE2 HIS 84 2HE HIS 84 4.707 -6.746 -10.552 684 H GLY 85 H GLY 85 11.964 -6.542 -11.391 685 HA2 GLY 85 2HA GLY 85 14.033 -6.844 -12.340 686 HA3 GLY 85 1HA GLY 85 13.264 -7.441 -13.806 687 H ILE 86 H ILE 86 12.023 -4.590 -12.508 688 HA ILE 86 HA ILE 86 13.053 -3.092 -14.783 689 HB ILE 86 HB ILE 86 10.686 -2.592 -12.970 690 HG12 ILE 86 2HG1 ILE 86 10.825 -3.398 -15.884 691 HG13 ILE 86 1HG1 ILE 86 10.337 -4.431 -14.548 692 HG21 ILE 86 1HG2 ILE 86 10.116 -0.734 -14.467 693 HG22 ILE 86 2HG2 ILE 86 11.632 -0.978 -15.338 694 HG23 ILE 86 3HG2 ILE 86 11.652 -0.479 -13.645 695 HD11 ILE 86 1HD1 ILE 86 8.921 -1.957 -15.481 696 HD12 ILE 86 2HD1 ILE 86 8.396 -3.001 -14.161 697 HD13 ILE 86 3HD1 ILE 86 8.425 -3.620 -15.819 698 H ASP 87 H ASP 87 14.356 -1.432 -14.453 699 HA ASP 87 HA ASP 87 14.983 -0.764 -11.685 700 HB2 ASP 87 2HB ASP 87 16.935 -1.262 -13.035 701 HB3 ASP 87 1HB ASP 87 16.457 -0.062 -14.232 702 H ILE 88 H ILE 88 14.152 0.907 -10.798 703 HA ILE 88 HA ILE 88 12.702 2.791 -12.463 704 HB ILE 88 HB ILE 88 12.640 2.398 -9.469 705 HG12 ILE 88 2HG1 ILE 88 10.736 1.483 -11.637 706 HG13 ILE 88 1HG1 ILE 88 11.788 0.451 -10.678 707 HG21 ILE 88 1HG2 ILE 88 10.606 3.780 -9.554 708 HG22 ILE 88 2HG2 ILE 88 10.844 4.005 -11.290 709 HG23 ILE 88 3HG2 ILE 88 12.014 4.670 -10.142 710 HD11 ILE 88 1HD1 ILE 88 9.525 2.110 -9.624 711 HD12 ILE 88 2HD1 ILE 88 10.547 1.038 -8.685 712 HD13 ILE 88 3HD1 ILE 88 9.473 0.372 -9.921 713 H LYS 89 H LYS 89 13.225 4.805 -12.597 714 HA LYS 89 HA LYS 89 15.880 5.573 -11.679 715 HB2 LYS 89 2HB LYS 89 13.990 7.152 -13.422 716 HB3 LYS 89 1HB LYS 89 15.725 7.377 -13.255 717 HG2 LYS 89 2HG LYS 89 14.331 5.031 -14.534 718 HG3 LYS 89 1HG LYS 89 15.231 6.293 -15.363 719 HD2 LYS 89 2HD LYS 89 17.293 5.547 -14.267 720 HD3 LYS 89 1HD LYS 89 16.383 4.314 -13.391 721 HE2 LYS 89 2HE LYS 89 15.735 3.299 -15.530 722 HE3 LYS 89 1HE LYS 89 16.689 4.504 -16.385 723 HZ1 LYS 89 1HZ LYS 89 17.730 2.516 -14.445 724 HZ2 LYS 89 2HZ LYS 89 18.688 3.614 -15.290 725 HZ3 LYS 89 3HZ LYS 89 17.849 2.394 -16.115 726 H1 MET 1 H MET 1 -2.417 12.006 14.262 727 HA MET 1 HA MET 1 -1.601 13.306 16.091 728 HB2 MET 1 2HB MET 1 -1.900 15.623 14.170 729 HB3 MET 1 1HB MET 1 -1.426 15.743 15.858 730 HG2 MET 1 2HG MET 1 0.611 14.486 15.385 731 HG3 MET 1 1HG MET 1 0.128 14.336 13.696 732 HE1 MET 1 1HE MET 1 1.279 16.781 16.551 733 HE2 MET 1 2HE MET 1 -0.261 17.497 16.070 734 HE3 MET 1 3HE MET 1 1.247 18.341 15.732 735 H GLY 2 H GLY 2 -4.175 13.352 13.980 736 HA2 GLY 2 2HA GLY 2 -5.986 14.001 16.185 737 HA3 GLY 2 1HA GLY 2 -6.144 14.910 14.685 738 H PHE 3 H PHE 3 -8.279 14.075 14.503 739 HA PHE 3 HA PHE 3 -8.336 11.275 13.640 740 HB2 PHE 3 2HB PHE 3 -9.812 11.707 15.585 741 HB3 PHE 3 1HB PHE 3 -10.631 12.972 14.685 742 HD1 PHE 3 1HD PHE 3 -12.449 12.447 13.257 743 HD2 PHE 3 2HD PHE 3 -10.007 9.317 14.784 744 HE1 PHE 3 1HE PHE 3 -14.055 10.790 12.419 745 HE2 PHE 3 2HE PHE 3 -11.606 7.657 13.950 746 HZ PHE 3 HZ PHE 3 -13.635 8.385 12.764 747 H THR 4 H THR 4 -7.690 11.619 11.572 748 HA THR 4 HA THR 4 -9.378 13.330 9.936 749 HB THR 4 HB THR 4 -7.559 12.976 8.213 750 HG1 THR 4 1HG THR 4 -6.723 11.059 9.135 751 HG21 THR 4 1HG2 THR 4 -5.943 14.493 9.308 752 HG22 THR 4 2HG2 THR 4 -6.704 14.163 10.865 753 HG23 THR 4 3HG2 THR 4 -7.606 15.002 9.605 754 H ASP 5 H ASP 5 -11.144 12.098 9.509 755 HA ASP 5 HA ASP 5 -10.730 9.345 8.665 756 HB2 ASP 5 2HB ASP 5 -12.546 9.831 10.291 757 HB3 ASP 5 1HB ASP 5 -13.336 10.830 9.079 758 H GLU 6 H GLU 6 -10.260 9.027 6.670 759 HA GLU 6 HA GLU 6 -10.960 10.872 4.596 760 HB2 GLU 6 2HB GLU 6 -8.823 9.677 4.553 761 HB3 GLU 6 1HB GLU 6 -9.666 8.139 4.504 762 HG2 GLU 6 2HG GLU 6 -8.774 8.830 2.324 763 HG3 GLU 6 1HG GLU 6 -10.526 8.623 2.326 764 H THR 7 H THR 7 -12.521 10.621 3.083 765 HA THR 7 HA THR 7 -14.506 8.592 3.798 766 HB THR 7 HB THR 7 -15.279 10.862 4.219 767 HG1 THR 7 1HG THR 7 -16.471 9.393 2.129 768 HG21 THR 7 1HG2 THR 7 -13.898 12.054 2.589 769 HG22 THR 7 2HG2 THR 7 -15.601 12.462 2.374 770 HG23 THR 7 3HG2 THR 7 -14.818 11.331 1.271 771 H VAL 8 H VAL 8 -12.249 9.159 1.451 772 HA VAL 8 HA VAL 8 -13.981 8.462 -0.700 773 HB VAL 8 HB VAL 8 -12.092 9.943 -1.226 774 HG11 VAL 8 1HG1 VAL 8 -10.286 7.622 -0.630 775 HG12 VAL 8 2HG1 VAL 8 -10.396 9.147 0.247 776 HG13 VAL 8 3HG1 VAL 8 -9.798 9.129 -1.411 777 HG21 VAL 8 1HG2 VAL 8 -11.942 7.316 -2.690 778 HG22 VAL 8 2HG2 VAL 8 -11.297 8.849 -3.279 779 HG23 VAL 8 3HG2 VAL 8 -13.035 8.655 -3.043 780 H ARG 9 H ARG 9 -14.924 6.620 -0.225 781 HA ARG 9 HA ARG 9 -13.212 4.242 -0.328 782 HB2 ARG 9 2HB ARG 9 -16.126 4.452 0.520 783 HB3 ARG 9 1HB ARG 9 -15.294 2.931 0.296 784 HG2 ARG 9 2HG ARG 9 -15.414 3.368 2.630 785 HG3 ARG 9 1HG ARG 9 -13.741 3.606 2.154 786 HD2 ARG 9 2HD ARG 9 -14.140 6.029 2.080 787 HD3 ARG 9 1HD ARG 9 -15.804 5.760 2.583 788 HE ARG 9 HE ARG 9 -13.572 4.881 4.260 789 HH11 ARG 9 1HH1 ARG 9 -16.546 6.772 3.866 790 HH12 ARG 9 2HH1 ARG 9 -16.486 7.468 5.413 791 HH21 ARG 9 1HH2 ARG 9 -13.514 5.830 6.425 792 HH22 ARG 9 2HH2 ARG 9 -14.698 6.942 6.925 793 H PHE 10 H PHE 10 -13.174 3.075 -2.124 794 HA PHE 10 HA PHE 10 -14.829 4.011 -4.320 795 HB2 PHE 10 2HB PHE 10 -12.569 1.998 -4.293 796 HB3 PHE 10 1HB PHE 10 -13.348 2.667 -5.721 797 HD1 PHE 10 1HD PHE 10 -13.075 5.102 -6.225 798 HD2 PHE 10 2HD PHE 10 -10.804 3.140 -3.212 799 HE1 PHE 10 1HE PHE 10 -11.436 6.934 -6.275 800 HE2 PHE 10 2HE PHE 10 -9.162 4.971 -3.250 801 HZ PHE 10 HZ PHE 10 -9.475 6.869 -4.785 802 H ASP 11 H ASP 11 -15.223 1.880 -5.893 803 HA ASP 11 HA ASP 11 -17.136 0.324 -4.353 804 HB2 ASP 11 2HB ASP 11 -17.792 1.333 -6.556 805 HB3 ASP 11 1HB ASP 11 -16.582 0.357 -7.362 806 H PHE 12 H PHE 12 -17.131 -2.161 -5.482 807 HA PHE 12 HA PHE 12 -14.479 -3.073 -4.738 808 HB2 PHE 12 2HB PHE 12 -15.546 -5.266 -4.237 809 HB3 PHE 12 1HB PHE 12 -16.152 -3.955 -3.245 810 HD1 PHE 12 1HD PHE 12 -18.426 -3.077 -3.621 811 HD2 PHE 12 2HD PHE 12 -16.946 -6.448 -5.748 812 HE1 PHE 12 1HE PHE 12 -20.719 -3.677 -4.255 813 HE2 PHE 12 2HE PHE 12 -19.233 -7.055 -6.392 814 HZ PHE 12 HZ PHE 12 -21.128 -5.667 -5.643 815 H ASP 13 H ASP 13 -13.324 -4.421 -6.043 816 HA ASP 13 HA ASP 13 -14.538 -5.334 -8.528 817 HB2 ASP 13 2HB ASP 13 -13.499 -3.115 -9.029 818 HB3 ASP 13 1HB ASP 13 -11.967 -3.712 -8.413 819 H ASP 14 H ASP 14 -13.930 -7.365 -8.956 820 HA ASP 14 HA ASP 14 -11.826 -8.530 -7.281 821 HB2 ASP 14 2HB ASP 14 -13.982 -9.705 -7.271 822 HB3 ASP 14 1HB ASP 14 -13.898 -9.861 -9.023 823 H ASN 15 H ASN 15 -9.922 -9.231 -8.112 824 HA ASN 15 HA ASN 15 -9.703 -8.813 -10.987 825 HB2 ASN 15 2HB ASN 15 -7.561 -8.382 -8.914 826 HB3 ASN 15 1HB ASN 15 -7.319 -8.260 -10.653 827 HD21 ASN 15 1HD2 ASN 15 -10.043 -7.124 -10.924 828 HD22 ASN 15 2HD2 ASN 15 -9.966 -5.501 -10.418 829 H ARG 16 H ARG 16 -8.524 -10.037 -12.220 830 HA ARG 16 HA ARG 16 -8.431 -12.800 -11.679 831 HB2 ARG 16 2HB ARG 16 -8.703 -11.849 -13.917 832 HB3 ARG 16 1HB ARG 16 -7.127 -11.109 -13.837 833 HG2 ARG 16 2HG ARG 16 -6.142 -13.394 -13.722 834 HG3 ARG 16 1HG ARG 16 -7.768 -14.035 -13.972 835 HD2 ARG 16 2HD ARG 16 -7.931 -12.833 -16.079 836 HD3 ARG 16 1HD ARG 16 -6.322 -12.168 -15.816 837 HE ARG 16 HE ARG 16 -6.596 -15.040 -15.846 838 HH11 ARG 16 1HH1 ARG 16 -5.561 -12.123 -17.544 839 HH12 ARG 16 2HH1 ARG 16 -4.651 -12.943 -18.725 840 HH21 ARG 16 1HH2 ARG 16 -5.350 -16.177 -17.427 841 HH22 ARG 16 2HH2 ARG 16 -4.533 -15.330 -18.649 842 H LYS 17 H LYS 17 -6.473 -14.113 -11.485 843 HA LYS 17 HA LYS 17 -4.646 -12.978 -9.660 844 HB2 LYS 17 2HB LYS 17 -5.381 -15.428 -9.790 845 HB3 LYS 17 1HB LYS 17 -4.307 -15.586 -11.169 846 HG2 LYS 17 2HG LYS 17 -3.268 -16.450 -9.169 847 HG3 LYS 17 1HG LYS 17 -2.390 -15.034 -9.724 848 HD2 LYS 17 2HD LYS 17 -3.640 -13.669 -8.042 849 HD3 LYS 17 1HD LYS 17 -4.405 -15.149 -7.473 850 HE2 LYS 17 2HE LYS 17 -2.178 -16.051 -6.911 851 HE3 LYS 17 1HE LYS 17 -1.453 -14.539 -7.449 852 HZ1 LYS 17 1HZ LYS 17 -3.370 -14.838 -5.204 853 HZ2 LYS 17 2HZ LYS 17 -2.690 -13.378 -5.692 854 HZ3 LYS 17 3HZ LYS 17 -1.721 -14.590 -5.047 855 H LYS 18 H LYS 18 -2.734 -12.012 -9.986 856 HA LYS 18 HA LYS 18 -0.982 -11.001 -10.898 857 HB2 LYS 18 2HB LYS 18 -1.249 -12.928 -13.212 858 HB3 LYS 18 1HB LYS 18 -0.059 -11.659 -13.178 859 HG2 LYS 18 2HG LYS 18 1.055 -13.635 -12.545 860 HG3 LYS 18 1HG LYS 18 0.847 -12.697 -11.072 861 HD2 LYS 18 2HD LYS 18 0.397 -15.028 -10.642 862 HD3 LYS 18 1HD LYS 18 -1.080 -14.057 -10.528 863 HE2 LYS 18 2HE LYS 18 -1.433 -16.219 -11.736 864 HE3 LYS 18 1HE LYS 18 -1.819 -14.814 -12.714 865 HZ1 LYS 18 1HZ LYS 18 -0.529 -16.492 -13.944 866 HZ2 LYS 18 2HZ LYS 18 0.728 -16.346 -12.842 867 HZ3 LYS 18 3HZ LYS 18 0.325 -15.046 -13.826 868 H ALA 19 H ALA 19 -3.943 -10.454 -11.800 869 HA ALA 19 HA ALA 19 -3.632 -9.069 -14.268 870 HB1 ALA 19 1HB ALA 19 -5.753 -8.098 -13.830 871 HB2 ALA 19 2HB ALA 19 -5.664 -8.652 -12.140 872 HB3 ALA 19 3HB ALA 19 -5.773 -9.835 -13.456 873 H ILE 20 H ILE 20 -3.579 -8.063 -10.918 874 HA ILE 20 HA ILE 20 -3.322 -5.287 -11.456 875 HB ILE 20 HB ILE 20 -2.507 -6.875 -9.000 876 HG12 ILE 20 2HG1 ILE 20 -5.026 -5.314 -9.593 877 HG13 ILE 20 1HG1 ILE 20 -4.893 -7.066 -9.589 878 HG21 ILE 20 1HG2 ILE 20 -1.382 -4.703 -9.073 879 HG22 ILE 20 2HG2 ILE 20 -2.594 -4.738 -7.801 880 HG23 ILE 20 3HG2 ILE 20 -2.932 -3.897 -9.317 881 HD11 ILE 20 1HD1 ILE 20 -5.920 -6.265 -7.558 882 HD12 ILE 20 2HD1 ILE 20 -4.519 -5.247 -7.224 883 HD13 ILE 20 3HD1 ILE 20 -4.357 -7.002 -7.206 884 H SER 21 H SER 21 -1.173 -7.942 -11.082 885 HA SER 21 HA SER 21 1.271 -6.500 -10.963 886 HB2 SER 21 2HB SER 21 0.728 -9.326 -11.894 887 HB3 SER 21 1HB SER 21 2.303 -8.685 -11.419 888 HG SER 21 HG SER 21 0.973 -8.087 -9.409 889 H GLU 22 H GLU 22 -0.646 -7.877 -13.534 890 HA GLU 22 HA GLU 22 1.064 -7.353 -15.722 891 HB2 GLU 22 2HB GLU 22 -0.841 -8.968 -15.636 892 HB3 GLU 22 1HB GLU 22 -1.942 -7.605 -15.598 893 HG2 GLU 22 2HG GLU 22 -1.845 -8.548 -17.770 894 HG3 GLU 22 1HG GLU 22 -1.160 -6.923 -17.802 895 H THR 23 H THR 23 -1.726 -5.702 -14.334 896 HA THR 23 HA THR 23 -1.920 -3.583 -16.135 897 HB THR 23 HB THR 23 -2.751 -3.624 -13.220 898 HG1 THR 23 1HG THR 23 -3.727 -5.310 -14.307 899 HG21 THR 23 1HG2 THR 23 -4.419 -1.944 -13.918 900 HG22 THR 23 2HG2 THR 23 -3.742 -1.952 -15.546 901 HG23 THR 23 3HG2 THR 23 -2.780 -1.357 -14.196 902 H LEU 24 H LEU 24 -0.331 -3.644 -12.903 903 HA LEU 24 HA LEU 24 0.463 -0.946 -13.049 904 HB2 LEU 24 2HB LEU 24 1.634 -3.157 -11.366 905 HB3 LEU 24 1HB LEU 24 1.950 -1.446 -11.172 906 HG LEU 24 HG LEU 24 -0.714 -2.789 -10.781 907 HD11 LEU 24 1HD1 LEU 24 0.902 -3.313 -9.047 908 HD12 LEU 24 2HD1 LEU 24 -0.353 -2.245 -8.427 909 HD13 LEU 24 3HD1 LEU 24 1.237 -1.599 -8.828 910 HD21 LEU 24 1HD2 LEU 24 -0.977 -0.509 -11.626 911 HD22 LEU 24 2HD2 LEU 24 0.118 0.091 -10.381 912 HD23 LEU 24 3HD2 LEU 24 -1.436 -0.604 -9.929 913 H GLU 25 H GLU 25 2.079 -3.896 -14.054 914 HA GLU 25 HA GLU 25 4.596 -2.810 -14.539 915 HB2 GLU 25 2HB GLU 25 4.082 -5.224 -14.571 916 HB3 GLU 25 1HB GLU 25 3.152 -5.003 -16.046 917 HG2 GLU 25 2HG GLU 25 5.197 -4.280 -17.199 918 HG3 GLU 25 1HG GLU 25 6.109 -4.579 -15.719 919 H THR 26 H THR 26 1.645 -3.051 -16.466 920 HA THR 26 HA THR 26 2.631 -1.948 -18.874 921 HB THR 26 HB THR 26 -0.221 -2.084 -17.854 922 HG1 THR 26 1HG THR 26 0.847 -4.172 -17.993 923 HG21 THR 26 1HG2 THR 26 0.106 -0.567 -19.749 924 HG22 THR 26 2HG2 THR 26 -0.842 -1.982 -20.230 925 HG23 THR 26 3HG2 THR 26 0.870 -1.858 -20.662 926 H VAL 27 H VAL 27 0.859 -0.578 -16.114 927 HA VAL 27 HA VAL 27 0.550 2.023 -17.140 928 HB VAL 27 HB VAL 27 0.705 1.174 -14.220 929 HG11 VAL 27 1HG1 VAL 27 1.055 3.579 -14.482 930 HG12 VAL 27 2HG1 VAL 27 -0.515 3.245 -13.744 931 HG13 VAL 27 3HG1 VAL 27 -0.416 3.689 -15.449 932 HG21 VAL 27 1HG2 VAL 27 -1.704 1.607 -15.986 933 HG22 VAL 27 2HG2 VAL 27 -1.732 1.197 -14.275 934 HG23 VAL 27 3HG2 VAL 27 -1.092 0.043 -15.447 935 H TYR 28 H TYR 28 3.143 0.520 -15.313 936 HA TYR 28 HA TYR 28 4.641 2.820 -14.777 937 HB2 TYR 28 2HB TYR 28 5.104 0.597 -13.754 938 HB3 TYR 28 1HB TYR 28 5.671 0.015 -15.311 939 HD1 TYR 28 1HD TYR 28 7.812 0.688 -16.183 940 HD2 TYR 28 2HD TYR 28 6.468 2.183 -12.453 941 HE1 TYR 28 1HE TYR 28 10.074 1.518 -15.699 942 HE2 TYR 28 2HE TYR 28 8.722 3.015 -11.961 943 HH TYR 28 HH TYR 28 11.131 3.237 -14.342 944 H ARG 29 H ARG 29 4.710 0.590 -17.494 945 HA ARG 29 HA ARG 29 6.763 1.768 -18.999 946 HB2 ARG 29 2HB ARG 29 4.373 0.147 -19.845 947 HB3 ARG 29 1HB ARG 29 5.664 0.614 -20.941 948 HG2 ARG 29 2HG ARG 29 6.048 -1.040 -18.452 949 HG3 ARG 29 1HG ARG 29 5.887 -1.694 -20.087 950 HD2 ARG 29 2HD ARG 29 8.035 0.205 -19.134 951 HD3 ARG 29 1HD ARG 29 8.229 -1.518 -19.430 952 HE ARG 29 HE ARG 29 7.461 -0.911 -21.783 953 HH11 ARG 29 1HH1 ARG 29 9.410 1.260 -19.769 954 HH12 ARG 29 2HH1 ARG 29 10.250 1.916 -21.094 955 HH21 ARG 29 1HH2 ARG 29 8.639 0.075 -23.599 956 HH22 ARG 29 2HH2 ARG 29 9.802 1.272 -23.266 957 H ALA 30 H ALA 30 3.375 2.479 -18.785 958 HA ALA 30 HA ALA 30 3.101 4.091 -21.062 959 HB1 ALA 30 1HB ALA 30 1.580 4.338 -18.466 960 HB2 ALA 30 2HB ALA 30 1.177 3.245 -19.791 961 HB3 ALA 30 3HB ALA 30 1.088 4.990 -20.030 962 H LEU 31 H LEU 31 3.995 4.980 -17.747 963 HA LEU 31 HA LEU 31 4.223 7.722 -18.482 964 HB2 LEU 31 2HB LEU 31 5.109 6.323 -15.981 965 HB3 LEU 31 1HB LEU 31 5.434 8.014 -16.259 966 HG LEU 31 HG LEU 31 3.564 7.938 -14.841 967 HD11 LEU 31 1HD1 LEU 31 2.512 8.500 -17.554 968 HD12 LEU 31 2HD1 LEU 31 3.375 9.593 -16.461 969 HD13 LEU 31 3HD1 LEU 31 1.806 8.959 -16.000 970 HD21 LEU 31 1HD2 LEU 31 1.536 6.689 -15.270 971 HD22 LEU 31 2HD2 LEU 31 2.921 5.609 -15.127 972 HD23 LEU 31 3HD2 LEU 31 2.255 5.982 -16.722 973 H GLU 32 H GLU 32 6.469 5.073 -18.492 974 HA GLU 32 HA GLU 32 8.807 6.669 -18.647 975 HB2 GLU 32 2HB GLU 32 8.338 3.936 -19.821 976 HB3 GLU 32 1HB GLU 32 9.898 4.718 -19.662 977 HG2 GLU 32 2HG GLU 32 9.545 4.740 -17.204 978 HG3 GLU 32 1HG GLU 32 8.092 3.772 -17.466 979 H GLU 33 H GLU 33 6.669 5.317 -21.084 980 HA GLU 33 HA GLU 33 8.136 6.307 -23.281 981 HB2 GLU 33 2HB GLU 33 5.238 5.486 -23.105 982 HB3 GLU 33 1HB GLU 33 6.106 5.789 -24.602 983 HG2 GLU 33 2HG GLU 33 7.656 3.946 -24.028 984 HG3 GLU 33 1HG GLU 33 6.687 3.625 -22.596 985 H LYS 34 H LYS 34 5.865 7.702 -21.156 986 HA LYS 34 HA LYS 34 5.449 9.998 -22.881 987 HB2 LYS 34 2HB LYS 34 4.286 9.227 -20.229 988 HB3 LYS 34 1HB LYS 34 3.973 10.787 -20.976 989 HG2 LYS 34 2HG LYS 34 3.394 8.136 -22.286 990 HG3 LYS 34 1HG LYS 34 2.205 9.082 -21.385 991 HD2 LYS 34 2HD LYS 34 3.726 10.146 -23.781 992 HD3 LYS 34 1HD LYS 34 2.147 9.393 -23.889 993 HE2 LYS 34 2HE LYS 34 1.191 11.033 -22.473 994 HE3 LYS 34 1HE LYS 34 2.755 11.801 -22.171 995 HZ1 LYS 34 1HZ LYS 34 2.831 12.357 -24.553 996 HZ2 LYS 34 2HZ LYS 34 1.479 13.012 -23.779 997 HZ3 LYS 34 3HZ LYS 34 1.301 11.658 -24.758 998 H GLY 35 H GLY 35 7.718 9.098 -20.644 999 HA2 GLY 35 2HA GLY 35 9.586 10.297 -20.004 1000 HA3 GLY 35 1HA GLY 35 8.897 11.719 -20.761 1001 H TYR 36 H TYR 36 7.431 9.763 -18.214 1002 HA TYR 36 HA TYR 36 7.830 12.038 -16.381 1003 HB2 TYR 36 2HB TYR 36 5.421 10.204 -16.495 1004 HB3 TYR 36 1HB TYR 36 5.684 11.470 -15.311 1005 HD1 TYR 36 1HD TYR 36 4.139 10.624 -18.329 1006 HD2 TYR 36 2HD TYR 36 5.976 13.876 -16.321 1007 HE1 TYR 36 1HE TYR 36 2.949 12.203 -19.810 1008 HE2 TYR 36 2HE TYR 36 4.799 15.458 -17.783 1009 HH TYR 36 HH TYR 36 2.213 14.570 -19.766 1010 H ASN 37 H ASN 37 7.570 11.301 -14.083 1011 HA ASN 37 HA ASN 37 9.014 8.836 -13.631 1012 HB2 ASN 37 2HB ASN 37 9.448 10.844 -12.224 1013 HB3 ASN 37 1HB ASN 37 7.791 10.768 -11.645 1014 HD21 ASN 37 1HD2 ASN 37 10.940 9.349 -11.472 1015 HD22 ASN 37 2HD2 ASN 37 10.604 8.317 -10.129 1016 HA PRO 38 HA PRO 38 4.991 6.861 -13.800 1017 HB2 PRO 38 2HB PRO 38 6.518 4.473 -12.985 1018 HB3 PRO 38 1HB PRO 38 5.484 4.724 -14.396 1019 HG2 PRO 38 2HG PRO 38 8.136 4.622 -14.656 1020 HG3 PRO 38 1HG PRO 38 7.169 5.752 -15.615 1021 HD2 PRO 38 2HD PRO 38 8.806 6.267 -13.168 1022 HD3 PRO 38 1HD PRO 38 8.644 7.227 -14.662 1023 H ILE 39 H ILE 39 7.234 6.259 -11.131 1024 HA ILE 39 HA ILE 39 5.315 5.094 -9.439 1025 HB ILE 39 HB ILE 39 7.961 6.422 -8.677 1026 HG12 ILE 39 2HG1 ILE 39 8.203 4.537 -10.191 1027 HG13 ILE 39 1HG1 ILE 39 8.775 4.124 -8.585 1028 HG21 ILE 39 1HG2 ILE 39 6.460 6.357 -6.754 1029 HG22 ILE 39 2HG2 ILE 39 7.800 5.225 -6.576 1030 HG23 ILE 39 3HG2 ILE 39 6.198 4.635 -7.012 1031 HD11 ILE 39 1HD1 ILE 39 7.548 2.276 -9.554 1032 HD12 ILE 39 2HD1 ILE 39 6.156 3.307 -9.820 1033 HD13 ILE 39 3HD1 ILE 39 6.669 2.927 -8.171 1034 H ASN 40 H ASN 40 6.493 8.411 -9.627 1035 HA ASN 40 HA ASN 40 4.792 9.329 -7.578 1036 HB2 ASN 40 2HB ASN 40 6.330 10.801 -9.686 1037 HB3 ASN 40 1HB ASN 40 5.200 11.653 -8.639 1038 HD21 ASN 40 1HD2 ASN 40 8.199 9.868 -8.766 1039 HD22 ASN 40 2HD2 ASN 40 8.775 10.348 -7.230 1040 H GLN 41 H GLN 41 4.239 8.959 -11.023 1041 HA GLN 41 HA GLN 41 1.831 10.440 -10.950 1042 HB2 GLN 41 2HB GLN 41 2.851 8.401 -12.919 1043 HB3 GLN 41 1HB GLN 41 1.386 9.349 -13.158 1044 HG2 GLN 41 2HG GLN 41 4.159 10.480 -12.819 1045 HG3 GLN 41 1HG GLN 41 3.311 10.294 -14.353 1046 HE21 GLN 41 1HE2 GLN 41 0.713 11.076 -13.287 1047 HE22 GLN 41 2HE2 GLN 41 0.808 12.768 -13.005 1048 H ILE 42 H ILE 42 2.623 7.031 -10.568 1049 HA ILE 42 HA ILE 42 -0.071 6.183 -10.499 1050 HB ILE 42 HB ILE 42 2.402 4.779 -9.428 1051 HG12 ILE 42 2HG1 ILE 42 0.883 4.416 -12.026 1052 HG13 ILE 42 1HG1 ILE 42 2.434 5.224 -11.858 1053 HG21 ILE 42 1HG2 ILE 42 0.385 3.907 -8.365 1054 HG22 ILE 42 2HG2 ILE 42 1.033 2.727 -9.507 1055 HG23 ILE 42 3HG2 ILE 42 -0.374 3.702 -9.943 1056 HD11 ILE 42 1HD1 ILE 42 3.451 3.121 -11.137 1057 HD12 ILE 42 2HD1 ILE 42 2.693 2.965 -12.723 1058 HD13 ILE 42 3HD1 ILE 42 1.892 2.312 -11.294 1059 H VAL 43 H VAL 43 2.246 6.886 -7.852 1060 HA VAL 43 HA VAL 43 0.488 6.247 -5.761 1061 HB VAL 43 HB VAL 43 2.833 6.555 -5.162 1062 HG11 VAL 43 1HG1 VAL 43 3.407 8.216 -6.823 1063 HG12 VAL 43 2HG1 VAL 43 3.950 8.729 -5.224 1064 HG13 VAL 43 3HG1 VAL 43 2.503 9.448 -5.940 1065 HG21 VAL 43 1HG2 VAL 43 1.306 8.823 -3.911 1066 HG22 VAL 43 2HG2 VAL 43 2.698 8.003 -3.226 1067 HG23 VAL 43 3HG2 VAL 43 1.147 7.154 -3.416 1068 H GLY 44 H GLY 44 0.924 9.291 -7.389 1069 HA2 GLY 44 2HA GLY 44 -0.863 10.784 -5.735 1070 HA3 GLY 44 1HA GLY 44 -0.322 11.266 -7.343 1071 H TYR 45 H TYR 45 -1.189 9.026 -8.714 1072 HA TYR 45 HA TYR 45 -3.802 9.649 -9.423 1073 HB2 TYR 45 2HB TYR 45 -2.243 8.437 -10.884 1074 HB3 TYR 45 1HB TYR 45 -2.243 7.076 -9.778 1075 HD1 TYR 45 1HD TYR 45 -4.355 5.793 -9.473 1076 HD2 TYR 45 2HD TYR 45 -3.874 8.633 -12.547 1077 HE1 TYR 45 1HE TYR 45 -6.212 4.806 -10.624 1078 HE2 TYR 45 2HE TYR 45 -5.750 7.665 -13.764 1079 HH TYR 45 HH TYR 45 -6.970 5.542 -13.858 1080 H LEU 46 H LEU 46 -2.541 6.948 -7.528 1081 HA LEU 46 HA LEU 46 -5.012 5.717 -7.037 1082 HB2 LEU 46 2HB LEU 46 -2.397 5.464 -5.589 1083 HB3 LEU 46 1HB LEU 46 -3.765 4.393 -5.372 1084 HG LEU 46 HG LEU 46 -2.308 4.772 -7.988 1085 HD11 LEU 46 1HD1 LEU 46 -1.336 2.585 -7.547 1086 HD12 LEU 46 2HD1 LEU 46 -2.070 2.582 -5.935 1087 HD13 LEU 46 3HD1 LEU 46 -0.858 3.801 -6.365 1088 HD21 LEU 46 1HD2 LEU 46 -3.503 2.746 -8.657 1089 HD22 LEU 46 2HD2 LEU 46 -4.627 4.041 -8.250 1090 HD23 LEU 46 3HD2 LEU 46 -4.343 2.725 -7.107 1091 H LEU 47 H LEU 47 -3.138 7.990 -5.076 1092 HA LEU 47 HA LEU 47 -4.560 7.715 -2.692 1093 HB2 LEU 47 2HB LEU 47 -3.120 10.128 -3.763 1094 HB3 LEU 47 1HB LEU 47 -3.741 10.009 -2.134 1095 HG LEU 47 HG LEU 47 -1.579 8.268 -3.328 1096 HD11 LEU 47 1HD1 LEU 47 -0.834 10.545 -2.929 1097 HD12 LEU 47 2HD1 LEU 47 -0.110 9.441 -1.761 1098 HD13 LEU 47 3HD1 LEU 47 -1.452 10.475 -1.280 1099 HD21 LEU 47 1HD2 LEU 47 -2.867 7.023 -1.676 1100 HD22 LEU 47 2HD2 LEU 47 -2.717 8.360 -0.531 1101 HD23 LEU 47 3HD2 LEU 47 -1.289 7.455 -1.019 1102 H SER 48 H SER 48 -5.541 9.389 -5.559 1103 HA SER 48 HA SER 48 -7.873 10.332 -4.040 1104 HB2 SER 48 2HB SER 48 -6.375 12.199 -4.646 1105 HB3 SER 48 1HB SER 48 -6.565 11.778 -6.347 1106 HG SER 48 HG SER 48 -8.605 12.472 -6.315 1107 H GLY 49 H GLY 49 -6.931 8.156 -6.380 1108 HA2 GLY 49 2HA GLY 49 -7.971 7.101 -8.065 1109 HA3 GLY 49 1HA GLY 49 -9.479 7.635 -7.329 1110 H ASP 50 H ASP 50 -6.852 9.512 -8.760 1111 HA ASP 50 HA ASP 50 -8.864 11.017 -10.286 1112 HB2 ASP 50 2HB ASP 50 -7.009 12.102 -8.866 1113 HB3 ASP 50 1HB ASP 50 -5.930 11.574 -10.121 1114 HA PRO 51 HA PRO 51 -7.536 8.229 -13.514 1115 HB2 PRO 51 2HB PRO 51 -9.249 9.037 -15.468 1116 HB3 PRO 51 1HB PRO 51 -9.629 7.884 -14.189 1117 HG2 PRO 51 2HG PRO 51 -10.305 10.796 -14.370 1118 HG3 PRO 51 1HG PRO 51 -11.283 9.465 -13.722 1119 HD2 PRO 51 2HD PRO 51 -9.895 11.230 -12.156 1120 HD3 PRO 51 1HD PRO 51 -10.258 9.566 -11.662 1121 H ALA 52 H ALA 52 -7.565 11.690 -13.787 1122 HA ALA 52 HA ALA 52 -6.447 11.791 -16.410 1123 HB1 ALA 52 1HB ALA 52 -6.264 14.182 -16.024 1124 HB2 ALA 52 2HB ALA 52 -6.648 13.927 -14.318 1125 HB3 ALA 52 3HB ALA 52 -7.854 13.577 -15.553 1126 H TYR 53 H TYR 53 -5.116 11.190 -13.346 1127 HA TYR 53 HA TYR 53 -2.631 12.409 -13.814 1128 HB2 TYR 53 2HB TYR 53 -3.479 10.359 -11.801 1129 HB3 TYR 53 1HB TYR 53 -1.772 10.761 -11.987 1130 HD1 TYR 53 1HD TYR 53 -3.981 13.507 -12.665 1131 HD2 TYR 53 2HD TYR 53 -2.038 11.391 -9.542 1132 HE1 TYR 53 1HE TYR 53 -4.280 15.427 -11.201 1133 HE2 TYR 53 2HE TYR 53 -2.337 13.310 -8.048 1134 HH TYR 53 HH TYR 53 -2.653 15.681 -8.224 1135 H ILE 54 H ILE 54 -3.898 9.406 -14.958 1136 HA ILE 54 HA ILE 54 -1.252 8.795 -16.058 1137 HB ILE 54 HB ILE 54 -3.785 7.064 -16.310 1138 HG12 ILE 54 2HG1 ILE 54 -3.075 7.153 -13.947 1139 HG13 ILE 54 1HG1 ILE 54 -2.753 5.574 -14.651 1140 HG21 ILE 54 1HG2 ILE 54 -2.295 5.315 -17.047 1141 HG22 ILE 54 2HG2 ILE 54 -0.929 6.426 -16.957 1142 HG23 ILE 54 3HG2 ILE 54 -2.230 6.722 -18.110 1143 HD11 ILE 54 1HD1 ILE 54 -0.937 6.298 -13.210 1144 HD12 ILE 54 2HD1 ILE 54 -0.719 7.752 -14.187 1145 HD13 ILE 54 3HD1 ILE 54 -0.401 6.159 -14.882 1146 HA PRO 55 HA PRO 55 -2.817 11.017 -19.599 1147 HB2 PRO 55 2HB PRO 55 -0.661 10.641 -21.219 1148 HB3 PRO 55 1HB PRO 55 -0.670 11.822 -19.906 1149 HG2 PRO 55 2HG PRO 55 0.511 9.079 -19.975 1150 HG3 PRO 55 1HG PRO 55 1.173 10.561 -19.265 1151 HD2 PRO 55 2HD PRO 55 -0.039 8.601 -17.826 1152 HD3 PRO 55 1HD PRO 55 -0.043 10.295 -17.317 1153 H ARG 56 H ARG 56 -3.874 10.423 -21.449 1154 HA ARG 56 HA ARG 56 -4.054 7.590 -21.824 1155 HB2 ARG 56 2HB ARG 56 -5.982 8.086 -23.393 1156 HB3 ARG 56 1HB ARG 56 -6.194 8.547 -21.716 1157 HG2 ARG 56 2HG ARG 56 -5.622 10.876 -22.342 1158 HG3 ARG 56 1HG ARG 56 -5.559 10.361 -24.032 1159 HD2 ARG 56 2HD ARG 56 -7.936 10.087 -22.209 1160 HD3 ARG 56 1HD ARG 56 -7.742 11.360 -23.406 1161 HE ARG 56 HE ARG 56 -7.509 9.277 -24.952 1162 HH11 ARG 56 1HH1 ARG 56 -9.817 9.768 -22.306 1163 HH12 ARG 56 2HH1 ARG 56 -11.047 8.827 -23.005 1164 HH21 ARG 56 1HH2 ARG 56 -9.203 8.013 -25.922 1165 HH22 ARG 56 2HH2 ARG 56 -10.696 7.802 -25.140 1166 H TYR 57 H TYR 57 -1.953 7.570 -22.451 1167 HA TYR 57 HA TYR 57 -1.413 7.907 -25.314 1168 HB2 TYR 57 2HB TYR 57 0.246 8.824 -23.939 1169 HB3 TYR 57 1HB TYR 57 0.263 7.432 -22.875 1170 HD1 TYR 57 1HD TYR 57 1.355 8.698 -26.174 1171 HD2 TYR 57 2HD TYR 57 1.604 5.537 -23.349 1172 HE1 TYR 57 1HE TYR 57 3.284 7.775 -27.379 1173 HE2 TYR 57 2HE TYR 57 3.505 4.595 -24.526 1174 HH TYR 57 HH TYR 57 4.577 4.633 -26.643 1175 H GLN 58 H GLN 58 -1.823 5.497 -22.805 1176 HA GLN 58 HA GLN 58 -1.525 3.412 -24.820 1177 HB2 GLN 58 2HB GLN 58 0.585 3.708 -23.308 1178 HB3 GLN 58 1HB GLN 58 -0.469 3.158 -22.010 1179 HG2 GLN 58 2HG GLN 58 -0.771 1.024 -23.064 1180 HG3 GLN 58 1HG GLN 58 0.126 1.598 -24.475 1181 HE21 GLN 58 1HE2 GLN 58 2.162 2.975 -22.979 1182 HE22 GLN 58 2HE2 GLN 58 3.187 1.787 -22.311 1183 H ASP 59 H ASP 59 -2.634 1.442 -24.089 1184 HA ASP 59 HA ASP 59 -5.203 1.975 -23.185 1185 HB2 ASP 59 2HB ASP 59 -5.495 -0.510 -23.133 1186 HB3 ASP 59 1HB ASP 59 -4.834 0.100 -24.642 1187 H ALA 60 H ALA 60 -2.426 1.561 -21.417 1188 HA ALA 60 HA ALA 60 -3.150 0.448 -18.988 1189 HB1 ALA 60 1HB ALA 60 -1.367 1.747 -18.006 1190 HB2 ALA 60 2HB ALA 60 -1.378 2.845 -19.381 1191 HB3 ALA 60 3HB ALA 60 -0.869 1.173 -19.597 1192 H ARG 61 H ARG 61 -3.771 3.728 -20.148 1193 HA ARG 61 HA ARG 61 -4.769 4.788 -17.761 1194 HB2 ARG 61 2HB ARG 61 -4.000 6.052 -19.798 1195 HB3 ARG 61 1HB ARG 61 -5.443 5.529 -20.630 1196 HG2 ARG 61 2HG ARG 61 -5.481 7.245 -18.148 1197 HG3 ARG 61 1HG ARG 61 -5.410 7.907 -19.772 1198 HD2 ARG 61 2HD ARG 61 -7.547 6.794 -20.272 1199 HD3 ARG 61 1HD ARG 61 -7.614 6.201 -18.608 1200 HE ARG 61 HE ARG 61 -7.273 8.926 -18.454 1201 HH11 ARG 61 1HH1 ARG 61 -9.708 6.783 -19.893 1202 HH12 ARG 61 2HH1 ARG 61 -11.000 7.858 -19.597 1203 HH21 ARG 61 1HH2 ARG 61 -9.090 10.413 -18.105 1204 HH22 ARG 61 2HH2 ARG 61 -10.637 9.929 -18.613 1205 H ASN 62 H ASN 62 -6.310 2.982 -20.382 1206 HA ASN 62 HA ASN 62 -8.937 3.187 -19.239 1207 HB2 ASN 62 2HB ASN 62 -8.641 2.898 -21.686 1208 HB3 ASN 62 1HB ASN 62 -7.923 1.321 -21.408 1209 HD21 ASN 62 1HD2 ASN 62 -9.277 -0.439 -20.973 1210 HD22 ASN 62 2HD2 ASN 62 -10.988 -0.334 -21.092 1211 H LEU 63 H LEU 63 -6.328 0.848 -19.236 1212 HA LEU 63 HA LEU 63 -7.546 -1.369 -18.035 1213 HB2 LEU 63 2HB LEU 63 -4.731 -0.378 -17.569 1214 HB3 LEU 63 1HB LEU 63 -5.314 -1.993 -17.246 1215 HG LEU 63 HG LEU 63 -4.985 -0.712 -19.949 1216 HD11 LEU 63 1HD1 LEU 63 -2.849 -1.367 -18.906 1217 HD12 LEU 63 2HD1 LEU 63 -3.256 -2.366 -20.292 1218 HD13 LEU 63 3HD1 LEU 63 -3.481 -2.989 -18.659 1219 HD21 LEU 63 1HD2 LEU 63 -5.597 -2.851 -20.861 1220 HD22 LEU 63 2HD2 LEU 63 -6.901 -2.185 -19.875 1221 HD23 LEU 63 3HD2 LEU 63 -5.898 -3.493 -19.245 1222 H ILE 64 H ILE 64 -5.880 1.365 -16.573 1223 HA ILE 64 HA ILE 64 -6.250 0.432 -13.925 1224 HB ILE 64 HB ILE 64 -4.377 1.934 -14.754 1225 HG12 ILE 64 2HG1 ILE 64 -5.858 3.048 -12.362 1226 HG13 ILE 64 1HG1 ILE 64 -4.885 1.582 -12.321 1227 HG21 ILE 64 1HG2 ILE 64 -4.794 4.385 -14.774 1228 HG22 ILE 64 2HG2 ILE 64 -6.514 4.064 -14.601 1229 HG23 ILE 64 3HG2 ILE 64 -5.667 3.524 -16.042 1230 HD11 ILE 64 1HD1 ILE 64 -2.899 2.890 -12.932 1231 HD12 ILE 64 2HD1 ILE 64 -3.647 3.485 -11.448 1232 HD13 ILE 64 3HD1 ILE 64 -3.881 4.353 -12.963 1233 H ARG 65 H ARG 65 -8.285 2.018 -16.111 1234 HA ARG 65 HA ARG 65 -9.969 3.021 -14.019 1235 HB2 ARG 65 2HB ARG 65 -9.792 3.613 -16.880 1236 HB3 ARG 65 1HB ARG 65 -11.427 3.583 -16.228 1237 HG2 ARG 65 2HG ARG 65 -9.200 5.183 -14.985 1238 HG3 ARG 65 1HG ARG 65 -10.284 5.830 -16.216 1239 HD2 ARG 65 2HD ARG 65 -11.074 6.445 -13.960 1240 HD3 ARG 65 1HD ARG 65 -12.220 5.397 -14.770 1241 HE ARG 65 HE ARG 65 -10.339 4.152 -12.906 1242 HH11 ARG 65 1HH1 ARG 65 -13.630 5.365 -13.430 1243 HH12 ARG 65 2HH1 ARG 65 -14.328 4.424 -12.206 1244 HH21 ARG 65 1HH2 ARG 65 -11.355 2.789 -11.178 1245 HH22 ARG 65 2HH2 ARG 65 -12.997 2.932 -10.893 1246 H ARG 66 H ARG 66 -9.587 0.112 -15.303 1247 HA ARG 66 HA ARG 66 -12.410 -0.465 -14.894 1248 HB2 ARG 66 2HB ARG 66 -10.234 -2.206 -16.076 1249 HB3 ARG 66 1HB ARG 66 -11.845 -2.797 -15.703 1250 HG2 ARG 66 2HG ARG 66 -12.760 -1.047 -17.237 1251 HG3 ARG 66 1HG ARG 66 -11.101 -0.677 -17.705 1252 HD2 ARG 66 2HD ARG 66 -12.415 -3.379 -17.961 1253 HD3 ARG 66 1HD ARG 66 -12.260 -2.214 -19.269 1254 HE ARG 66 HE ARG 66 -9.825 -2.462 -19.004 1255 HH11 ARG 66 1HH1 ARG 66 -11.905 -5.099 -17.778 1256 HH12 ARG 66 2HH1 ARG 66 -10.777 -6.310 -18.138 1257 HH21 ARG 66 1HH2 ARG 66 -8.307 -4.171 -19.500 1258 HH22 ARG 66 2HH2 ARG 66 -8.688 -5.783 -19.119 1259 H HIS 67 H HIS 67 -10.058 0.110 -13.016 1260 HA HIS 67 HA HIS 67 -10.725 -2.006 -11.090 1261 HB2 HIS 67 2HB HIS 67 -8.059 -0.595 -11.448 1262 HB3 HIS 67 1HB HIS 67 -8.460 -1.628 -10.086 1263 HD1 HIS 67 1HD HIS 67 -7.990 -4.092 -10.379 1264 HD2 HIS 67 2HD HIS 67 -7.947 -2.017 -13.981 1265 HE1 HIS 67 1HE HIS 67 -7.101 -5.693 -12.080 1266 HE2 HIS 67 2HE HIS 67 -7.528 -4.525 -14.249 1267 H GLU 68 H GLU 68 -10.894 -1.276 -8.901 1268 HA GLU 68 HA GLU 68 -11.624 1.519 -8.787 1269 HB2 GLU 68 2HB GLU 68 -12.397 -0.836 -7.124 1270 HB3 GLU 68 1HB GLU 68 -12.700 0.810 -6.582 1271 HG2 GLU 68 2HG GLU 68 -13.676 -0.358 -9.173 1272 HG3 GLU 68 1HG GLU 68 -14.631 -0.221 -7.698 1273 H ARG 69 H ARG 69 -9.013 -0.248 -8.129 1274 HA ARG 69 HA ARG 69 -6.970 0.642 -7.554 1275 HB2 ARG 69 2HB ARG 69 -8.433 2.994 -6.259 1276 HB3 ARG 69 1HB ARG 69 -6.711 2.849 -6.534 1277 HG2 ARG 69 2HG ARG 69 -6.885 3.069 -8.796 1278 HG3 ARG 69 1HG ARG 69 -8.562 2.533 -8.824 1279 HD2 ARG 69 2HD ARG 69 -9.225 4.610 -7.720 1280 HD3 ARG 69 1HD ARG 69 -7.533 5.132 -7.739 1281 HE ARG 69 HE ARG 69 -7.661 4.981 -10.169 1282 HH11 ARG 69 1HH1 ARG 69 -10.794 5.298 -8.486 1283 HH12 ARG 69 2HH1 ARG 69 -11.503 6.134 -9.758 1284 HH21 ARG 69 1HH2 ARG 69 -8.670 6.141 -11.889 1285 HH22 ARG 69 2HH2 ARG 69 -10.301 6.646 -11.685 1286 H ASP 70 H ASP 70 -9.427 0.187 -5.152 1287 HA ASP 70 HA ASP 70 -7.735 0.008 -2.888 1288 HB2 ASP 70 2HB ASP 70 -10.379 -1.316 -3.464 1289 HB3 ASP 70 1HB ASP 70 -9.520 -1.567 -1.960 1290 H GLU 71 H GLU 71 -8.718 -2.279 -5.284 1291 HA GLU 71 HA GLU 71 -7.698 -4.688 -4.267 1292 HB2 GLU 71 2HB GLU 71 -7.339 -4.043 -7.175 1293 HB3 GLU 71 1HB GLU 71 -7.785 -5.564 -6.437 1294 HG2 GLU 71 2HG GLU 71 -9.659 -4.840 -7.629 1295 HG3 GLU 71 1HG GLU 71 -10.024 -4.467 -5.942 1296 H ILE 72 H ILE 72 -6.303 -2.243 -6.286 1297 HA ILE 72 HA ILE 72 -3.770 -3.345 -6.740 1298 HB ILE 72 HB ILE 72 -4.598 -0.429 -6.680 1299 HG12 ILE 72 2HG1 ILE 72 -4.479 -2.402 -8.982 1300 HG13 ILE 72 1HG1 ILE 72 -5.940 -1.772 -8.239 1301 HG21 ILE 72 1HG2 ILE 72 -2.219 -1.733 -7.980 1302 HG22 ILE 72 2HG2 ILE 72 -2.167 -0.686 -6.558 1303 HG23 ILE 72 3HG2 ILE 72 -2.661 -0.034 -8.126 1304 HD11 ILE 72 1HD1 ILE 72 -5.354 0.477 -9.025 1305 HD12 ILE 72 2HD1 ILE 72 -5.486 -0.674 -10.351 1306 HD13 ILE 72 3HD1 ILE 72 -3.896 -0.177 -9.772 1307 H MET 73 H MET 73 -4.922 -1.043 -4.356 1308 HA MET 73 HA MET 73 -2.487 -0.485 -3.122 1309 HB2 MET 73 2HB MET 73 -4.495 0.879 -2.864 1310 HB3 MET 73 1HB MET 73 -5.259 -0.411 -1.946 1311 HG2 MET 73 2HG MET 73 -4.408 1.334 -0.489 1312 HG3 MET 73 1HG MET 73 -3.573 -0.207 -0.233 1313 HE1 MET 73 1HE MET 73 -0.817 2.457 0.428 1314 HE2 MET 73 2HE MET 73 -1.701 1.086 1.094 1315 HE3 MET 73 3HE MET 73 -2.534 2.613 0.795 1316 H GLU 74 H GLU 74 -4.936 -2.918 -2.239 1317 HA GLU 74 HA GLU 74 -3.401 -3.819 -0.015 1318 HB2 GLU 74 2HB GLU 74 -5.008 -5.725 0.068 1319 HB3 GLU 74 1HB GLU 74 -5.779 -4.149 0.061 1320 HG2 GLU 74 2HG GLU 74 -6.257 -4.394 -2.314 1321 HG3 GLU 74 1HG GLU 74 -5.475 -5.973 -2.299 1322 H GLU 75 H GLU 75 -3.537 -4.706 -3.383 1323 HA GLU 75 HA GLU 75 -2.069 -7.115 -3.127 1324 HB2 GLU 75 2HB GLU 75 -3.432 -6.503 -5.125 1325 HB3 GLU 75 1HB GLU 75 -2.246 -5.267 -5.516 1326 HG2 GLU 75 2HG GLU 75 -1.981 -7.305 -6.862 1327 HG3 GLU 75 1HG GLU 75 -0.555 -6.951 -5.883 1328 H LEU 76 H LEU 76 -1.179 -3.746 -3.730 1329 HA LEU 76 HA LEU 76 1.582 -3.967 -3.998 1330 HB2 LEU 76 2HB LEU 76 0.009 -1.824 -2.555 1331 HB3 LEU 76 1HB LEU 76 1.697 -1.698 -2.979 1332 HG LEU 76 HG LEU 76 -0.577 -1.885 -4.959 1333 HD11 LEU 76 1HD1 LEU 76 -0.090 0.467 -5.392 1334 HD12 LEU 76 2HD1 LEU 76 1.119 0.460 -4.108 1335 HD13 LEU 76 3HD1 LEU 76 -0.582 0.224 -3.715 1336 HD21 LEU 76 1HD2 LEU 76 1.507 -2.807 -5.828 1337 HD22 LEU 76 2HD2 LEU 76 2.364 -1.342 -5.341 1338 HD23 LEU 76 3HD2 LEU 76 1.127 -1.268 -6.594 1339 H THR 77 H THR 77 -0.400 -3.597 -1.069 1340 HA THR 77 HA THR 77 1.645 -3.610 0.787 1341 HB THR 77 HB THR 77 -1.183 -4.663 1.133 1342 HG1 THR 77 1HG THR 77 -1.148 -2.467 0.308 1343 HG21 THR 77 1HG2 THR 77 -0.882 -3.990 3.479 1344 HG22 THR 77 2HG2 THR 77 0.770 -3.484 3.127 1345 HG23 THR 77 3HG2 THR 77 0.327 -5.186 3.014 1346 H LYS 78 H LYS 78 -0.237 -6.371 -0.536 1347 HA LYS 78 HA LYS 78 0.994 -8.319 1.096 1348 HB2 LYS 78 2HB LYS 78 -0.338 -8.706 -1.578 1349 HB3 LYS 78 1HB LYS 78 0.170 -10.017 -0.517 1350 HG2 LYS 78 2HG LYS 78 -1.276 -9.106 1.202 1351 HG3 LYS 78 1HG LYS 78 -1.875 -7.910 0.086 1352 HD2 LYS 78 2HD LYS 78 -2.199 -10.935 -0.119 1353 HD3 LYS 78 1HD LYS 78 -3.461 -9.774 0.256 1354 HE2 LYS 78 2HE LYS 78 -3.824 -10.383 -1.983 1355 HE3 LYS 78 1HE LYS 78 -3.036 -8.810 -2.071 1356 HZ1 LYS 78 1HZ LYS 78 -1.864 -11.478 -2.592 1357 HZ2 LYS 78 2HZ LYS 78 -0.902 -10.102 -2.515 1358 HZ3 LYS 78 3HZ LYS 78 -2.103 -10.243 -3.695 1359 H TYR 79 H TYR 79 1.707 -7.343 -2.205 1360 HA TYR 79 HA TYR 79 3.741 -9.262 -2.643 1361 HB2 TYR 79 2HB TYR 79 2.597 -7.896 -4.400 1362 HB3 TYR 79 1HB TYR 79 3.527 -6.514 -3.848 1363 HD1 TYR 79 1HD TYR 79 3.455 -9.346 -5.982 1364 HD2 TYR 79 2HD TYR 79 6.076 -6.671 -4.014 1365 HE1 TYR 79 1HE TYR 79 5.240 -9.970 -7.555 1366 HE2 TYR 79 2HE TYR 79 7.887 -7.273 -5.588 1367 HH TYR 79 HH TYR 79 8.437 -9.249 -7.023 1368 H TYR 80 H TYR 80 3.849 -5.920 -1.498 1369 HA TYR 80 HA TYR 80 6.589 -5.534 -1.347 1370 HB2 TYR 80 2HB TYR 80 4.848 -3.785 -1.064 1371 HB3 TYR 80 1HB TYR 80 4.452 -4.465 0.503 1372 HD1 TYR 80 1HD TYR 80 6.995 -2.696 -1.429 1373 HD2 TYR 80 2HD TYR 80 5.793 -3.955 2.440 1374 HE1 TYR 80 1HE TYR 80 8.686 -1.233 -0.440 1375 HE2 TYR 80 2HE TYR 80 7.477 -2.489 3.450 1376 HH TYR 80 HH TYR 80 9.083 -0.095 1.665 1377 H LEU 81 H LEU 81 4.348 -6.799 1.058 1378 HA LEU 81 HA LEU 81 6.397 -7.303 2.937 1379 HB2 LEU 81 2HB LEU 81 3.528 -8.134 2.868 1380 HB3 LEU 81 1HB LEU 81 4.601 -8.465 4.226 1381 HG LEU 81 HG LEU 81 3.834 -5.723 3.208 1382 HD11 LEU 81 1HD1 LEU 81 3.031 -7.184 5.704 1383 HD12 LEU 81 2HD1 LEU 81 1.989 -6.845 4.319 1384 HD13 LEU 81 3HD1 LEU 81 2.613 -5.518 5.302 1385 HD21 LEU 81 1HD2 LEU 81 4.968 -4.912 5.226 1386 HD22 LEU 81 2HD2 LEU 81 6.079 -5.716 4.134 1387 HD23 LEU 81 3HD2 LEU 81 5.507 -6.550 5.580 1388 H ALA 82 H ALA 82 4.773 -9.298 0.537 1389 HA ALA 82 HA ALA 82 5.582 -11.810 1.517 1390 HB1 ALA 82 1HB ALA 82 5.007 -11.016 -1.339 1391 HB2 ALA 82 2HB ALA 82 3.803 -11.524 -0.156 1392 HB3 ALA 82 3HB ALA 82 5.038 -12.661 -0.706 1393 H ASN 83 H ASN 83 7.147 -9.484 -0.633 1394 HA ASN 83 HA ASN 83 9.202 -10.924 -1.632 1395 HB2 ASN 83 2HB ASN 83 8.221 -8.516 -1.908 1396 HB3 ASN 83 1HB ASN 83 9.501 -8.115 -0.767 1397 HD21 ASN 83 1HD2 ASN 83 8.693 -9.307 -3.822 1398 HD22 ASN 83 2HD2 ASN 83 10.228 -9.153 -4.547 1399 H HIS 84 H HIS 84 8.677 -10.038 1.666 1400 HA HIS 84 HA HIS 84 11.543 -10.002 2.323 1401 HB2 HIS 84 2HB HIS 84 9.184 -9.668 4.183 1402 HB3 HIS 84 1HB HIS 84 10.868 -9.445 4.618 1403 HD1 HIS 84 1HD HIS 84 11.963 -7.507 2.692 1404 HD2 HIS 84 2HD HIS 84 8.024 -7.312 3.965 1405 HE1 HIS 84 1HE HIS 84 11.213 -5.186 2.173 1406 HE2 HIS 84 2HE HIS 84 8.733 -5.321 2.519 1407 H GLY 85 H GLY 85 9.391 -12.339 1.754 1408 HA2 GLY 85 2HA GLY 85 9.897 -14.635 2.141 1409 HA3 GLY 85 1HA GLY 85 10.735 -14.175 3.616 1410 H ILE 86 H ILE 86 7.889 -12.518 3.288 1411 HA ILE 86 HA ILE 86 6.632 -14.127 5.357 1412 HB ILE 86 HB ILE 86 5.835 -11.446 4.181 1413 HG12 ILE 86 2HG1 ILE 86 7.101 -12.150 6.838 1414 HG13 ILE 86 1HG1 ILE 86 7.910 -11.365 5.489 1415 HG21 ILE 86 1HG2 ILE 86 4.248 -11.290 6.052 1416 HG22 ILE 86 2HG2 ILE 86 4.680 -12.927 6.546 1417 HG23 ILE 86 3HG2 ILE 86 3.877 -12.657 5.000 1418 HD11 ILE 86 1HD1 ILE 86 7.277 -9.802 7.258 1419 HD12 ILE 86 2HD1 ILE 86 5.589 -10.254 7.027 1420 HD13 ILE 86 3HD1 ILE 86 6.454 -9.435 5.725 1421 H ASP 87 H ASP 87 4.920 -15.370 4.997 1422 HA ASP 87 HA ASP 87 3.953 -15.563 2.244 1423 HB2 ASP 87 2HB ASP 87 4.724 -17.642 3.345 1424 HB3 ASP 87 1HB ASP 87 3.508 -17.419 4.597 1425 H ILE 88 H ILE 88 2.117 -14.594 1.718 1426 HA ILE 88 HA ILE 88 0.157 -14.014 3.829 1427 HB ILE 88 HB ILE 88 0.684 -12.426 1.274 1428 HG12 ILE 88 2HG1 ILE 88 1.375 -11.715 4.122 1429 HG13 ILE 88 1HG1 ILE 88 2.536 -12.233 2.903 1430 HG21 ILE 88 1HG2 ILE 88 -1.051 -11.792 3.642 1431 HG22 ILE 88 2HG2 ILE 88 -1.632 -12.309 2.054 1432 HG23 ILE 88 3HG2 ILE 88 -0.790 -10.766 2.237 1433 HD11 ILE 88 1HD1 ILE 88 2.463 -9.799 3.251 1434 HD12 ILE 88 2HD1 ILE 88 0.796 -9.795 2.684 1435 HD13 ILE 88 3HD1 ILE 88 2.081 -10.271 1.588 1436 H LYS 89 H LYS 89 -2.064 -14.314 3.189 1437 HA LYS 89 HA LYS 89 -2.345 -16.185 0.972 1438 HB2 LYS 89 2HB LYS 89 -4.345 -15.450 3.121 1439 HB3 LYS 89 1HB LYS 89 -4.517 -16.744 1.946 1440 HG2 LYS 89 2HG LYS 89 -2.478 -16.597 4.159 1441 HG3 LYS 89 1HG LYS 89 -3.895 -17.643 4.103 1442 HD2 LYS 89 2HD LYS 89 -2.957 -18.788 2.138 1443 HD3 LYS 89 1HD LYS 89 -1.546 -17.730 2.200 1444 HE2 LYS 89 2HE LYS 89 -1.025 -18.576 4.438 1445 HE3 LYS 89 1HE LYS 89 -2.410 -19.657 4.354 1446 HZ1 LYS 89 1HZ LYS 89 -1.360 -20.763 2.444 1447 HZ2 LYS 89 2HZ LYS 89 -0.363 -20.820 3.789 1448 HZ3 LYS 89 3HZ LYS 89 -0.040 -19.715 2.567 Start of MODEL 11 1 H1 MET 1 1HT MET 1 -20.489 16.782 11.567 2 H2 MET 1 2HT MET 1 -20.933 18.220 10.801 3 H3 MET 1 3HT MET 1 -19.290 17.860 11.082 4 HA MET 1 HA MET 1 -21.101 16.318 9.369 5 HB2 MET 1 2HB MET 1 -19.761 17.190 7.462 6 HB3 MET 1 1HB MET 1 -20.620 18.467 8.300 7 HG2 MET 1 2HG MET 1 -18.555 19.131 9.407 8 HG3 MET 1 1HG MET 1 -17.694 17.813 8.612 9 HE1 MET 1 1HE MET 1 -16.254 20.980 6.836 10 HE2 MET 1 2HE MET 1 -15.874 19.502 7.718 11 HE3 MET 1 3HE MET 1 -16.707 20.823 8.533 12 H GLY 2 H GLY 2 -20.519 14.309 9.160 13 HA2 GLY 2 2HA GLY 2 -18.029 13.409 10.279 14 HA3 GLY 2 1HA GLY 2 -19.319 12.410 9.626 15 H PHE 3 H PHE 3 -16.856 14.680 8.638 16 HA PHE 3 HA PHE 3 -16.266 12.919 6.397 17 HB2 PHE 3 2HB PHE 3 -17.529 14.821 5.494 18 HB3 PHE 3 1HB PHE 3 -16.428 15.944 6.283 19 HD1 PHE 3 1HD PHE 3 -14.286 16.451 5.332 20 HD2 PHE 3 2HD PHE 3 -16.775 13.481 3.572 21 HE1 PHE 3 1HE PHE 3 -12.844 16.428 3.349 22 HE2 PHE 3 2HE PHE 3 -15.332 13.458 1.580 23 HZ PHE 3 HZ PHE 3 -13.363 14.928 1.466 24 H THR 4 H THR 4 -14.252 12.313 6.507 25 HA THR 4 HA THR 4 -12.208 14.181 7.191 26 HB THR 4 HB THR 4 -12.500 11.590 8.768 27 HG1 THR 4 1HG THR 4 -13.412 14.065 9.192 28 HG21 THR 4 1HG2 THR 4 -10.381 13.750 8.905 29 HG22 THR 4 2HG2 THR 4 -10.151 12.132 8.246 30 HG23 THR 4 3HG2 THR 4 -10.487 12.343 9.965 31 H ASP 5 H ASP 5 -11.528 13.985 5.123 32 HA ASP 5 HA ASP 5 -10.129 11.500 4.543 33 HB2 ASP 5 2HB ASP 5 -12.163 11.587 3.070 34 HB3 ASP 5 1HB ASP 5 -11.626 13.149 2.467 35 H GLU 6 H GLU 6 -8.156 12.135 4.945 36 HA GLU 6 HA GLU 6 -7.380 14.830 4.124 37 HB2 GLU 6 2HB GLU 6 -5.717 14.721 5.973 38 HB3 GLU 6 1HB GLU 6 -7.398 14.726 6.473 39 HG2 GLU 6 2HG GLU 6 -7.302 12.334 6.870 40 HG3 GLU 6 1HG GLU 6 -5.618 12.308 6.336 41 H THR 7 H THR 7 -7.106 12.108 2.715 42 HA THR 7 HA THR 7 -4.295 11.938 2.468 43 HB THR 7 HB THR 7 -4.950 10.548 0.385 44 HG1 THR 7 1HG THR 7 -7.326 9.828 1.229 45 HG21 THR 7 1HG2 THR 7 -5.784 9.693 3.166 46 HG22 THR 7 2HG2 THR 7 -4.181 9.541 2.465 47 HG23 THR 7 3HG2 THR 7 -5.513 8.602 1.799 48 H VAL 8 H VAL 8 -3.693 13.998 2.040 49 HA VAL 8 HA VAL 8 -4.484 15.380 -0.323 50 HB VAL 8 HB VAL 8 -3.581 16.596 1.644 51 HG11 VAL 8 1HG1 VAL 8 -1.960 15.009 2.450 52 HG12 VAL 8 2HG1 VAL 8 -1.188 16.568 2.177 53 HG13 VAL 8 3HG1 VAL 8 -0.958 15.260 1.016 54 HG21 VAL 8 1HG2 VAL 8 -1.993 18.083 0.473 55 HG22 VAL 8 2HG2 VAL 8 -3.411 17.709 -0.504 56 HG23 VAL 8 3HG2 VAL 8 -1.875 16.900 -0.825 57 H ARG 9 H ARG 9 -3.350 15.501 -2.285 58 HA ARG 9 HA ARG 9 -1.694 13.153 -2.675 59 HB2 ARG 9 2HB ARG 9 -2.847 14.997 -4.796 60 HB3 ARG 9 1HB ARG 9 -1.911 13.549 -5.113 61 HG2 ARG 9 2HG ARG 9 -4.174 12.958 -5.462 62 HG3 ARG 9 1HG ARG 9 -3.724 12.253 -3.912 63 HD2 ARG 9 2HD ARG 9 -4.732 14.230 -2.794 64 HD3 ARG 9 1HD ARG 9 -5.294 14.783 -4.372 65 HE ARG 9 HE ARG 9 -6.098 12.261 -3.117 66 HH11 ARG 9 1HH1 ARG 9 -6.914 15.142 -5.020 67 HH12 ARG 9 2HH1 ARG 9 -8.563 14.767 -5.109 68 HH21 ARG 9 1HH2 ARG 9 -8.406 11.797 -3.185 69 HH22 ARG 9 2HH2 ARG 9 -9.428 12.851 -4.042 70 H PHE 10 H PHE 10 0.163 13.713 -1.747 71 HA PHE 10 HA PHE 10 1.543 16.077 -2.749 72 HB2 PHE 10 2HB PHE 10 1.415 15.449 -0.256 73 HB3 PHE 10 1HB PHE 10 2.495 14.120 -0.642 74 HD1 PHE 10 1HD PHE 10 2.233 17.578 0.187 75 HD2 PHE 10 2HD PHE 10 4.782 14.704 -1.626 76 HE1 PHE 10 1HE PHE 10 4.150 19.090 0.496 77 HE2 PHE 10 2HE PHE 10 6.702 16.207 -1.321 78 HZ PHE 10 HZ PHE 10 6.390 18.403 -0.259 79 H ASP 11 H ASP 11 2.884 15.828 -4.416 80 HA ASP 11 HA ASP 11 3.704 13.138 -5.227 81 HB2 ASP 11 2HB ASP 11 4.327 14.183 -7.365 82 HB3 ASP 11 1HB ASP 11 2.672 14.597 -6.935 83 H PHE 12 H PHE 12 5.922 12.620 -5.650 84 HA PHE 12 HA PHE 12 7.778 14.470 -4.332 85 HB2 PHE 12 2HB PHE 12 7.951 11.444 -4.267 86 HB3 PHE 12 1HB PHE 12 9.050 12.563 -3.470 87 HD1 PHE 12 1HD PHE 12 5.888 10.826 -3.332 88 HD2 PHE 12 2HD PHE 12 8.239 13.871 -1.525 89 HE1 PHE 12 1HE PHE 12 4.459 10.728 -1.335 90 HE2 PHE 12 2HE PHE 12 6.816 13.777 0.477 91 HZ PHE 12 HZ PHE 12 4.923 12.206 0.574 92 H ASP 13 H ASP 13 8.679 11.429 -5.868 93 HA ASP 13 HA ASP 13 9.174 11.994 -8.479 94 HB2 ASP 13 2HB ASP 13 10.660 13.903 -7.612 95 HB3 ASP 13 1HB ASP 13 11.678 12.674 -6.871 96 H ASP 14 H ASP 14 11.032 11.000 -5.631 97 HA ASP 14 HA ASP 14 10.676 8.212 -6.146 98 HB2 ASP 14 2HB ASP 14 12.947 7.583 -6.415 99 HB3 ASP 14 1HB ASP 14 12.777 8.951 -7.499 100 H ASN 15 H ASN 15 11.919 7.050 -4.231 101 HA ASN 15 HA ASN 15 12.748 8.423 -1.913 102 HB2 ASN 15 2HB ASN 15 10.411 9.258 -1.871 103 HB3 ASN 15 1HB ASN 15 9.844 7.600 -1.864 104 HD21 ASN 15 1HD2 ASN 15 8.864 7.570 0.014 105 HD22 ASN 15 2HD2 ASN 15 9.604 7.800 1.561 106 H ARG 16 H ARG 16 14.149 6.536 -1.848 107 HA ARG 16 HA ARG 16 12.592 4.183 -1.132 108 HB2 ARG 16 2HB ARG 16 14.344 2.643 -1.904 109 HB3 ARG 16 1HB ARG 16 13.715 3.640 -3.187 110 HG2 ARG 16 2HG ARG 16 16.353 4.127 -1.807 111 HG3 ARG 16 1HG ARG 16 16.168 3.171 -3.270 112 HD2 ARG 16 2HD ARG 16 15.209 5.209 -4.371 113 HD3 ARG 16 1HD ARG 16 15.624 6.121 -2.915 114 HE ARG 16 HE ARG 16 17.873 4.724 -3.739 115 HH11 ARG 16 1HH1 ARG 16 15.945 7.544 -4.900 116 HH12 ARG 16 2HH1 ARG 16 17.245 8.141 -5.784 117 HH21 ARG 16 1HH2 ARG 16 19.594 5.672 -4.997 118 HH22 ARG 16 2HH2 ARG 16 19.309 7.133 -5.828 119 H LYS 17 H LYS 17 12.513 3.653 0.811 120 HA LYS 17 HA LYS 17 14.865 4.154 2.521 121 HB2 LYS 17 2HB LYS 17 11.978 4.599 3.299 122 HB3 LYS 17 1HB LYS 17 13.376 4.862 4.319 123 HG2 LYS 17 2HG LYS 17 12.706 6.406 1.820 124 HG3 LYS 17 1HG LYS 17 12.450 6.954 3.474 125 HD2 LYS 17 2HD LYS 17 14.861 6.913 3.867 126 HD3 LYS 17 1HD LYS 17 15.120 6.297 2.232 127 HE2 LYS 17 2HE LYS 17 14.122 8.316 1.305 128 HE3 LYS 17 1HE LYS 17 13.845 8.935 2.927 129 HZ1 LYS 17 1HZ LYS 17 16.227 9.021 3.271 130 HZ2 LYS 17 2HZ LYS 17 15.841 9.853 1.845 131 HZ3 LYS 17 3HZ LYS 17 16.495 8.313 1.773 132 H LYS 18 H LYS 18 15.499 2.317 3.490 133 HA LYS 18 HA LYS 18 14.058 -0.130 3.358 134 HB2 LYS 18 2HB LYS 18 15.778 -1.055 4.814 135 HB3 LYS 18 1HB LYS 18 16.538 -0.020 3.615 136 HG2 LYS 18 2HG LYS 18 16.766 1.759 5.258 137 HG3 LYS 18 1HG LYS 18 15.910 0.791 6.449 138 HD2 LYS 18 2HD LYS 18 17.710 -0.889 6.338 139 HD3 LYS 18 1HD LYS 18 18.577 0.144 5.196 140 HE2 LYS 18 2HE LYS 18 19.435 0.434 7.472 141 HE3 LYS 18 1HE LYS 18 18.695 1.914 6.871 142 HZ1 LYS 18 1HZ LYS 18 17.400 -0.023 8.739 143 HZ2 LYS 18 2HZ LYS 18 16.694 1.389 8.162 144 HZ3 LYS 18 3HZ LYS 18 18.022 1.482 9.147 145 H ALA 19 H ALA 19 14.044 2.487 5.509 146 HA ALA 19 HA ALA 19 13.268 1.443 7.951 147 HB1 ALA 19 1HB ALA 19 13.931 3.755 7.546 148 HB2 ALA 19 2HB ALA 19 12.391 3.639 8.427 149 HB3 ALA 19 3HB ALA 19 12.392 3.981 6.694 150 H ILE 20 H ILE 20 11.271 2.450 5.198 151 HA ILE 20 HA ILE 20 8.786 2.025 6.470 152 HB ILE 20 HB ILE 20 9.463 2.043 3.507 153 HG12 ILE 20 2HG1 ILE 20 8.448 4.242 5.330 154 HG13 ILE 20 1HG1 ILE 20 10.067 4.115 4.660 155 HG21 ILE 20 1HG2 ILE 20 6.778 2.346 4.873 156 HG22 ILE 20 2HG2 ILE 20 7.301 0.953 3.924 157 HG23 ILE 20 3HG2 ILE 20 7.078 2.519 3.143 158 HD11 ILE 20 1HD1 ILE 20 8.735 5.759 3.468 159 HD12 ILE 20 2HD1 ILE 20 7.528 4.531 3.098 160 HD13 ILE 20 3HD1 ILE 20 9.147 4.407 2.409 161 H SER 21 H SER 21 10.967 0.036 4.681 162 HA SER 21 HA SER 21 9.223 -2.162 4.259 163 HB2 SER 21 2HB SER 21 12.249 -2.113 4.384 164 HB3 SER 21 1HB SER 21 11.260 -3.383 3.657 165 HG SER 21 HG SER 21 10.376 -1.370 2.443 166 H GLU 22 H GLU 22 11.715 -1.467 6.691 167 HA GLU 22 HA GLU 22 11.447 -3.817 8.221 168 HB2 GLU 22 2HB GLU 22 12.278 -1.063 9.169 169 HB3 GLU 22 1HB GLU 22 12.616 -2.581 9.987 170 HG2 GLU 22 2HG GLU 22 13.995 -3.282 8.090 171 HG3 GLU 22 1HG GLU 22 13.678 -1.741 7.296 172 H THR 23 H THR 23 9.795 -0.759 8.281 173 HA THR 23 HA THR 23 8.396 -1.074 10.715 174 HB THR 23 HB THR 23 7.692 0.599 8.289 175 HG1 THR 23 1HG THR 23 9.736 0.990 9.385 176 HG21 THR 23 1HG2 THR 23 5.739 0.304 9.743 177 HG22 THR 23 2HG2 THR 23 6.354 1.954 9.862 178 HG23 THR 23 3HG2 THR 23 6.692 0.788 11.143 179 H LEU 24 H LEU 24 7.346 -1.585 7.323 180 HA LEU 24 HA LEU 24 4.735 -2.360 8.050 181 HB2 LEU 24 2HB LEU 24 6.220 -2.863 5.485 182 HB3 LEU 24 1HB LEU 24 4.507 -3.132 5.728 183 HG LEU 24 HG LEU 24 5.903 -0.465 5.848 184 HD11 LEU 24 1HD1 LEU 24 4.018 -1.654 3.838 185 HD12 LEU 24 2HD1 LEU 24 5.735 -1.349 3.604 186 HD13 LEU 24 3HD1 LEU 24 4.627 0.002 3.818 187 HD21 LEU 24 1HD2 LEU 24 4.026 -0.523 7.401 188 HD22 LEU 24 2HD2 LEU 24 2.978 -1.166 6.129 189 HD23 LEU 24 3HD2 LEU 24 3.632 0.467 6.003 190 H GLU 25 H GLU 25 7.653 -4.235 7.574 191 HA GLU 25 HA GLU 25 6.545 -6.774 7.441 192 HB2 GLU 25 2HB GLU 25 8.949 -6.262 7.126 193 HB3 GLU 25 1HB GLU 25 9.095 -5.934 8.845 194 HG2 GLU 25 2HG GLU 25 8.467 -8.264 9.319 195 HG3 GLU 25 1HG GLU 25 8.403 -8.578 7.588 196 H THR 26 H THR 26 7.339 -4.673 10.165 197 HA THR 26 HA THR 26 6.758 -6.493 12.257 198 HB THR 26 HB THR 26 6.918 -3.461 12.354 199 HG1 THR 26 1HG THR 26 8.913 -3.931 11.727 200 HG21 THR 26 1HG2 THR 26 7.514 -3.825 14.699 201 HG22 THR 26 2HG2 THR 26 7.416 -5.570 14.460 202 HG23 THR 26 3HG2 THR 26 5.958 -4.591 14.350 203 H VAL 27 H VAL 27 4.997 -3.833 10.696 204 HA VAL 27 HA VAL 27 2.760 -3.720 12.375 205 HB VAL 27 HB VAL 27 2.867 -3.139 9.390 206 HG11 VAL 27 1HG1 VAL 27 0.571 -3.417 10.169 207 HG12 VAL 27 2HG1 VAL 27 0.898 -1.728 9.776 208 HG13 VAL 27 3HG1 VAL 27 0.867 -2.250 11.462 209 HG21 VAL 27 1HG2 VAL 27 3.182 -1.285 11.751 210 HG22 VAL 27 2HG2 VAL 27 3.159 -0.798 10.055 211 HG23 VAL 27 3HG2 VAL 27 4.466 -1.805 10.665 212 H TYR 28 H TYR 28 3.423 -5.707 9.583 213 HA TYR 28 HA TYR 28 0.912 -6.923 9.282 214 HB2 TYR 28 2HB TYR 28 2.657 -7.118 7.574 215 HB3 TYR 28 1HB TYR 28 3.665 -8.043 8.678 216 HD1 TYR 28 1HD TYR 28 3.086 -10.386 9.223 217 HD2 TYR 28 2HD TYR 28 0.808 -8.159 6.404 218 HE1 TYR 28 1HE TYR 28 2.064 -12.463 8.411 219 HE2 TYR 28 2HE TYR 28 -0.215 -10.233 5.590 220 HH TYR 28 HH TYR 28 0.351 -12.646 5.539 221 H ARG 29 H ARG 29 3.735 -7.869 11.135 222 HA ARG 29 HA ARG 29 2.705 -10.335 12.013 223 HB2 ARG 29 2HB ARG 29 4.938 -8.653 13.076 224 HB3 ARG 29 1HB ARG 29 4.649 -10.316 13.565 225 HG2 ARG 29 2HG ARG 29 4.949 -10.999 11.195 226 HG3 ARG 29 1HG ARG 29 5.344 -9.328 10.800 227 HD2 ARG 29 2HD ARG 29 7.375 -10.594 11.067 228 HD3 ARG 29 1HD ARG 29 7.225 -9.445 12.396 229 HE ARG 29 HE ARG 29 6.069 -11.816 13.213 230 HH11 ARG 29 1HH1 ARG 29 9.270 -10.628 12.364 231 HH12 ARG 29 2HH1 ARG 29 10.135 -11.751 13.286 232 HH21 ARG 29 1HH2 ARG 29 7.203 -13.375 14.530 233 HH22 ARG 29 2HH2 ARG 29 8.899 -13.384 14.584 234 H ALA 30 H ALA 30 2.744 -7.141 13.474 235 HA ALA 30 HA ALA 30 1.782 -7.888 16.011 236 HB1 ALA 30 1HB ALA 30 2.669 -5.643 15.530 237 HB2 ALA 30 2HB ALA 30 1.063 -5.553 16.253 238 HB3 ALA 30 3HB ALA 30 1.264 -5.309 14.519 239 H LEU 31 H LEU 31 0.153 -7.229 13.013 240 HA LEU 31 HA LEU 31 -2.469 -7.362 14.099 241 HB2 LEU 31 2HB LEU 31 -1.487 -7.388 11.270 242 HB3 LEU 31 1HB LEU 31 -3.182 -7.381 11.709 243 HG LEU 31 HG LEU 31 -1.284 -5.290 12.664 244 HD11 LEU 31 1HD1 LEU 31 -3.199 -5.065 10.336 245 HD12 LEU 31 2HD1 LEU 31 -1.437 -5.221 10.155 246 HD13 LEU 31 3HD1 LEU 31 -2.133 -3.816 10.952 247 HD21 LEU 31 1HD2 LEU 31 -3.379 -4.022 12.972 248 HD22 LEU 31 2HD2 LEU 31 -3.243 -5.456 13.988 249 HD23 LEU 31 3HD2 LEU 31 -4.263 -5.481 12.547 250 H GLU 32 H GLU 32 -0.442 -9.738 12.376 251 HA GLU 32 HA GLU 32 -2.661 -11.488 12.402 252 HB2 GLU 32 2HB GLU 32 -1.119 -13.266 11.547 253 HB3 GLU 32 1HB GLU 32 -1.325 -11.863 10.506 254 HG2 GLU 32 2HG GLU 32 0.931 -12.384 10.332 255 HG3 GLU 32 1HG GLU 32 0.911 -11.110 11.543 256 H GLU 33 H GLU 33 0.057 -11.191 14.469 257 HA GLU 33 HA GLU 33 -0.478 -13.396 16.120 258 HB2 GLU 33 2HB GLU 33 0.719 -10.715 16.761 259 HB3 GLU 33 1HB GLU 33 0.505 -11.952 17.992 260 HG2 GLU 33 2HG GLU 33 2.072 -12.297 15.458 261 HG3 GLU 33 1HG GLU 33 2.773 -11.903 17.035 262 H LYS 34 H LYS 34 -1.961 -10.210 16.094 263 HA LYS 34 HA LYS 34 -3.550 -10.855 18.422 264 HB2 LYS 34 2HB LYS 34 -3.538 -8.452 16.623 265 HB3 LYS 34 1HB LYS 34 -4.641 -8.629 17.975 266 HG2 LYS 34 2HG LYS 34 -1.633 -8.594 18.168 267 HG3 LYS 34 1HG LYS 34 -2.693 -7.224 18.496 268 HD2 LYS 34 2HD LYS 34 -2.779 -9.856 19.987 269 HD3 LYS 34 1HD LYS 34 -1.942 -8.405 20.540 270 HE2 LYS 34 2HE LYS 34 -4.034 -7.199 20.627 271 HE3 LYS 34 1HE LYS 34 -4.912 -8.591 19.992 272 HZ1 LYS 34 1HZ LYS 34 -4.288 -9.822 21.972 273 HZ2 LYS 34 2HZ LYS 34 -5.126 -8.444 22.402 274 HZ3 LYS 34 3HZ LYS 34 -3.455 -8.515 22.593 275 H GLY 35 H GLY 35 -3.801 -11.507 15.187 276 HA2 GLY 35 2HA GLY 35 -5.447 -12.813 14.208 277 HA3 GLY 35 1HA GLY 35 -6.446 -12.561 15.630 278 H TYR 36 H TYR 36 -5.025 -9.986 13.681 279 HA TYR 36 HA TYR 36 -7.753 -9.242 12.834 280 HB2 TYR 36 2HB TYR 36 -5.223 -7.556 12.902 281 HB3 TYR 36 1HB TYR 36 -6.800 -6.992 12.376 282 HD1 TYR 36 1HD TYR 36 -4.545 -7.081 15.040 283 HD2 TYR 36 2HD TYR 36 -8.709 -7.293 14.210 284 HE1 TYR 36 1HE TYR 36 -5.039 -6.415 17.363 285 HE2 TYR 36 2HE TYR 36 -9.210 -6.615 16.518 286 HH TYR 36 HH TYR 36 -8.106 -6.745 18.689 287 H ASN 37 H ASN 37 -7.447 -7.939 10.577 288 HA ASN 37 HA ASN 37 -5.935 -9.777 8.860 289 HB2 ASN 37 2HB ASN 37 -8.024 -7.719 8.075 290 HB3 ASN 37 1HB ASN 37 -7.212 -8.807 6.963 291 HD21 ASN 37 1HD2 ASN 37 -7.773 -11.023 6.999 292 HD22 ASN 37 2HD2 ASN 37 -9.255 -11.528 7.719 293 HA PRO 38 HA PRO 38 -2.757 -6.542 9.306 294 HB2 PRO 38 2HB PRO 38 -1.751 -8.275 7.115 295 HB3 PRO 38 1HB PRO 38 -0.877 -7.551 8.467 296 HG2 PRO 38 2HG PRO 38 -1.615 -10.114 8.497 297 HG3 PRO 38 1HG PRO 38 -1.627 -9.131 9.968 298 HD2 PRO 38 2HD PRO 38 -3.902 -10.177 8.414 299 HD3 PRO 38 1HD PRO 38 -3.785 -9.601 10.100 300 H ILE 39 H ILE 39 -3.989 -7.737 6.241 301 HA ILE 39 HA ILE 39 -2.893 -5.594 4.739 302 HB ILE 39 HB ILE 39 -5.047 -7.546 3.930 303 HG12 ILE 39 2HG1 ILE 39 -3.110 -8.759 4.708 304 HG13 ILE 39 1HG1 ILE 39 -3.176 -8.853 2.957 305 HG21 ILE 39 1HG2 ILE 39 -4.291 -7.064 1.640 306 HG22 ILE 39 2HG2 ILE 39 -3.143 -5.883 2.274 307 HG23 ILE 39 3HG2 ILE 39 -4.876 -5.608 2.450 308 HD11 ILE 39 1HD1 ILE 39 -1.430 -7.121 2.815 309 HD12 ILE 39 2HD1 ILE 39 -0.896 -8.522 3.748 310 HD13 ILE 39 3HD1 ILE 39 -1.372 -7.049 4.579 311 H ASN 40 H ASN 40 -6.167 -6.408 5.818 312 HA ASN 40 HA ASN 40 -7.507 -4.239 4.661 313 HB2 ASN 40 2HB ASN 40 -8.207 -5.762 7.188 314 HB3 ASN 40 1HB ASN 40 -9.279 -4.632 6.382 315 HD21 ASN 40 1HD2 ASN 40 -10.852 -6.224 6.048 316 HD22 ASN 40 2HD2 ASN 40 -10.629 -7.471 4.880 317 H GLN 41 H GLN 41 -5.750 -4.529 7.651 318 HA GLN 41 HA GLN 41 -6.674 -2.052 8.718 319 HB2 GLN 41 2HB GLN 41 -4.167 -3.536 9.461 320 HB3 GLN 41 1HB GLN 41 -4.996 -2.335 10.431 321 HG2 GLN 41 2HG GLN 41 -6.020 -5.083 9.721 322 HG3 GLN 41 1HG GLN 41 -5.422 -4.553 11.284 323 HE21 GLN 41 1HE2 GLN 41 -6.797 -1.977 11.173 324 HE22 GLN 41 2HE2 GLN 41 -8.470 -2.332 11.397 325 H ILE 42 H ILE 42 -3.776 -3.070 6.920 326 HA ILE 42 HA ILE 42 -2.533 -0.530 7.103 327 HB ILE 42 HB ILE 42 -1.967 -2.811 5.177 328 HG12 ILE 42 2HG1 ILE 42 -0.535 -1.924 7.699 329 HG13 ILE 42 1HG1 ILE 42 -1.578 -3.334 7.563 330 HG21 ILE 42 1HG2 ILE 42 -0.335 -0.306 5.710 331 HG22 ILE 42 2HG2 ILE 42 -1.183 -0.691 4.224 332 HG23 ILE 42 3HG2 ILE 42 0.190 -1.678 4.731 333 HD11 ILE 42 1HD1 ILE 42 -0.010 -4.336 5.981 334 HD12 ILE 42 2HD1 ILE 42 0.770 -3.957 7.516 335 HD13 ILE 42 3HD1 ILE 42 1.031 -2.920 6.113 336 H VAL 43 H VAL 43 -4.364 -2.091 4.440 337 HA VAL 43 HA VAL 43 -4.139 0.107 2.715 338 HB VAL 43 HB VAL 43 -4.906 -2.037 1.799 339 HG11 VAL 43 1HG1 VAL 43 -6.216 -2.844 3.694 340 HG12 VAL 43 2HG1 VAL 43 -7.186 -2.895 2.217 341 HG13 VAL 43 3HG1 VAL 43 -7.438 -1.609 3.399 342 HG21 VAL 43 1HG2 VAL 43 -7.046 0.076 1.511 343 HG22 VAL 43 2HG2 VAL 43 -6.829 -1.305 0.436 344 HG23 VAL 43 3HG2 VAL 43 -5.574 -0.071 0.554 345 H GLY 44 H GLY 44 -6.454 -0.564 5.251 346 HA2 GLY 44 2HA GLY 44 -8.117 1.682 4.813 347 HA3 GLY 44 1HA GLY 44 -7.959 0.791 6.323 348 H TYR 45 H TYR 45 -5.236 1.178 6.829 349 HA TYR 45 HA TYR 45 -5.272 3.637 8.141 350 HB2 TYR 45 2HB TYR 45 -3.777 1.884 8.922 351 HB3 TYR 45 1HB TYR 45 -2.853 1.965 7.425 352 HD1 TYR 45 1HD TYR 45 -1.183 3.705 7.080 353 HD2 TYR 45 2HD TYR 45 -3.657 3.771 10.538 354 HE1 TYR 45 1HE TYR 45 0.228 5.445 8.043 355 HE2 TYR 45 2HE TYR 45 -2.230 5.519 11.505 356 HH TYR 45 HH TYR 45 0.095 6.292 11.288 357 H LEU 46 H LEU 46 -3.568 2.780 5.150 358 HA LEU 46 HA LEU 46 -2.572 5.417 4.958 359 HB2 LEU 46 2HB LEU 46 -2.594 3.239 2.910 360 HB3 LEU 46 1HB LEU 46 -1.959 4.830 2.553 361 HG LEU 46 HG LEU 46 -0.308 4.428 4.482 362 HD11 LEU 46 1HD1 LEU 46 0.154 2.219 5.178 363 HD12 LEU 46 2HD1 LEU 46 -1.144 1.602 4.166 364 HD13 LEU 46 3HD1 LEU 46 -1.533 2.608 5.551 365 HD21 LEU 46 1HD2 LEU 46 0.361 4.323 2.176 366 HD22 LEU 46 2HD2 LEU 46 -0.192 2.649 2.068 367 HD23 LEU 46 3HD2 LEU 46 1.166 3.068 3.113 368 H LEU 47 H LEU 47 -5.464 3.957 3.656 369 HA LEU 47 HA LEU 47 -5.956 6.250 2.012 370 HB2 LEU 47 2HB LEU 47 -7.763 3.966 2.770 371 HB3 LEU 47 1HB LEU 47 -8.189 5.232 1.637 372 HG LEU 47 HG LEU 47 -5.975 3.204 1.279 373 HD11 LEU 47 1HD1 LEU 47 -7.383 2.324 -0.508 374 HD12 LEU 47 2HD1 LEU 47 -8.637 3.493 -0.092 375 HD13 LEU 47 3HD1 LEU 47 -8.190 2.231 1.056 376 HD21 LEU 47 1HD2 LEU 47 -5.799 4.120 -0.997 377 HD22 LEU 47 2HD2 LEU 47 -5.395 5.332 0.220 378 HD23 LEU 47 3HD2 LEU 47 -6.968 5.370 -0.582 379 H SER 48 H SER 48 -6.769 5.377 5.288 380 HA SER 48 HA SER 48 -8.658 7.611 5.391 381 HB2 SER 48 2HB SER 48 -9.488 5.464 6.200 382 HB3 SER 48 1HB SER 48 -8.172 5.372 7.362 383 HG SER 48 HG SER 48 -9.470 7.702 7.686 384 H GLY 49 H GLY 49 -5.448 6.711 6.560 385 HA2 GLY 49 2HA GLY 49 -3.918 7.912 7.732 386 HA3 GLY 49 1HA GLY 49 -4.966 9.318 7.535 387 H ASP 50 H ASP 50 -5.497 6.200 9.141 388 HA ASP 50 HA ASP 50 -6.127 7.715 11.569 389 HB2 ASP 50 2HB ASP 50 -8.173 7.093 10.382 390 HB3 ASP 50 1HB ASP 50 -7.691 5.408 10.433 391 HA PRO 51 HA PRO 51 -3.064 4.802 13.136 392 HB2 PRO 51 2HB PRO 51 -3.057 5.782 15.689 393 HB3 PRO 51 1HB PRO 51 -2.167 6.522 14.354 394 HG2 PRO 51 2HG PRO 51 -4.811 7.269 15.522 395 HG3 PRO 51 1HG PRO 51 -3.487 8.323 14.996 396 HD2 PRO 51 2HD PRO 51 -5.691 7.909 13.508 397 HD3 PRO 51 1HD PRO 51 -4.101 8.182 12.768 398 H ALA 52 H ALA 52 -6.295 5.181 14.331 399 HA ALA 52 HA ALA 52 -6.291 3.354 16.451 400 HB1 ALA 52 1HB ALA 52 -8.594 4.048 14.639 401 HB2 ALA 52 2HB ALA 52 -8.082 4.983 16.041 402 HB3 ALA 52 3HB ALA 52 -8.708 3.348 16.252 403 H TYR 53 H TYR 53 -6.083 2.729 13.115 404 HA TYR 53 HA TYR 53 -7.254 0.182 13.033 405 HB2 TYR 53 2HB TYR 53 -5.181 1.464 11.286 406 HB3 TYR 53 1HB TYR 53 -5.756 -0.175 11.003 407 HD1 TYR 53 1HD TYR 53 -8.355 -0.388 11.001 408 HD2 TYR 53 2HD TYR 53 -6.256 3.188 10.171 409 HE1 TYR 53 1HE TYR 53 -10.275 0.421 9.815 410 HE2 TYR 53 2HE TYR 53 -8.202 4.050 8.939 411 HH TYR 53 HH TYR 53 -11.252 2.540 9.089 412 H ILE 54 H ILE 54 -4.116 1.237 14.217 413 HA ILE 54 HA ILE 54 -3.136 -1.518 14.082 414 HB ILE 54 HB ILE 54 -1.481 0.986 14.637 415 HG12 ILE 54 2HG1 ILE 54 -2.386 1.067 12.360 416 HG13 ILE 54 1HG1 ILE 54 -0.669 0.692 12.324 417 HG21 ILE 54 1HG2 ILE 54 0.448 -0.418 14.208 418 HG22 ILE 54 2HG2 ILE 54 -0.599 -1.808 13.959 419 HG23 ILE 54 3HG2 ILE 54 -0.497 -1.065 15.555 420 HD11 ILE 54 1HD1 ILE 54 -2.913 -1.283 11.963 421 HD12 ILE 54 2HD1 ILE 54 -1.191 -1.667 11.939 422 HD13 ILE 54 3HD1 ILE 54 -1.884 -0.625 10.694 423 HA PRO 55 HA PRO 55 -3.816 -2.011 18.462 424 HB2 PRO 55 2HB PRO 55 -2.563 -4.400 18.712 425 HB3 PRO 55 1HB PRO 55 -4.147 -4.240 17.936 426 HG2 PRO 55 2HG PRO 55 -1.433 -4.420 16.704 427 HG3 PRO 55 1HG PRO 55 -2.919 -5.274 16.253 428 HD2 PRO 55 2HD PRO 55 -2.073 -3.106 14.926 429 HD3 PRO 55 1HD PRO 55 -3.801 -3.442 15.168 430 H ARG 56 H ARG 56 -2.545 -2.385 20.410 431 HA ARG 56 HA ARG 56 -0.002 -0.952 20.212 432 HB2 ARG 56 2HB ARG 56 -1.782 -1.501 22.579 433 HB3 ARG 56 1HB ARG 56 -0.251 -0.670 22.676 434 HG2 ARG 56 2HG ARG 56 -2.017 0.942 22.771 435 HG3 ARG 56 1HG ARG 56 -1.183 1.124 21.233 436 HD2 ARG 56 2HD ARG 56 -3.001 -0.073 20.110 437 HD3 ARG 56 1HD ARG 56 -3.814 -0.315 21.654 438 HE ARG 56 HE ARG 56 -3.371 2.379 21.411 439 HH11 ARG 56 1HH1 ARG 56 -5.309 -0.047 19.627 440 HH12 ARG 56 2HH1 ARG 56 -6.468 1.072 19.128 441 HH21 ARG 56 1HH2 ARG 56 -4.981 3.885 20.706 442 HH22 ARG 56 2HH2 ARG 56 -6.276 3.380 19.749 443 H TYR 57 H TYR 57 -0.789 -3.946 19.987 444 HA TYR 57 HA TYR 57 0.429 -5.409 21.993 445 HB2 TYR 57 2HB TYR 57 -1.002 -6.367 20.270 446 HB3 TYR 57 1HB TYR 57 0.227 -6.059 19.055 447 HD1 TYR 57 1HD TYR 57 0.007 -7.753 22.388 448 HD2 TYR 57 2HD TYR 57 1.405 -7.927 18.375 449 HE1 TYR 57 1HE TYR 57 0.897 -10.005 22.798 450 HE2 TYR 57 2HE TYR 57 2.304 -10.177 18.785 451 HH TYR 57 HH TYR 57 2.983 -11.574 20.594 452 H GLN 58 H GLN 58 1.928 -3.844 19.192 453 HA GLN 58 HA GLN 58 4.500 -4.340 20.440 454 HB2 GLN 58 2HB GLN 58 3.950 -4.813 17.501 455 HB3 GLN 58 1HB GLN 58 5.543 -4.809 18.238 456 HG2 GLN 58 2HG GLN 58 4.865 -6.719 19.640 457 HG3 GLN 58 1HG GLN 58 3.308 -6.738 18.823 458 HE21 GLN 58 1HE2 GLN 58 5.309 -8.781 18.986 459 HE22 GLN 58 2HE2 GLN 58 5.767 -9.173 17.361 460 H ASP 59 H ASP 59 6.194 -3.052 19.226 461 HA ASP 59 HA ASP 59 5.587 -0.329 19.518 462 HB2 ASP 59 2HB ASP 59 7.901 0.084 18.723 463 HB3 ASP 59 1HB ASP 59 7.807 -1.100 20.013 464 H ALA 60 H ALA 60 5.057 -2.300 16.935 465 HA ALA 60 HA ALA 60 5.504 -0.884 14.621 466 HB1 ALA 60 1HB ALA 60 4.600 -3.163 14.721 467 HB2 ALA 60 2HB ALA 60 3.677 -2.125 13.632 468 HB3 ALA 60 3HB ALA 60 3.049 -2.511 15.234 469 H ARG 61 H ARG 61 2.813 -0.423 16.903 470 HA ARG 61 HA ARG 61 1.419 1.366 15.299 471 HB2 ARG 61 2HB ARG 61 0.223 2.090 17.402 472 HB3 ARG 61 1HB ARG 61 0.161 0.384 17.035 473 HG2 ARG 61 2HG ARG 61 0.398 0.680 19.371 474 HG3 ARG 61 1HG ARG 61 1.924 0.016 18.779 475 HD2 ARG 61 2HD ARG 61 2.864 2.283 18.869 476 HD3 ARG 61 1HD ARG 61 1.341 2.905 19.480 477 HE ARG 61 HE ARG 61 2.859 0.837 20.926 478 HH11 ARG 61 1HH1 ARG 61 1.158 3.942 20.931 479 HH12 ARG 61 2HH1 ARG 61 1.499 4.280 22.561 480 HH21 ARG 61 1HH2 ARG 61 3.254 1.259 23.156 481 HH22 ARG 61 2HH2 ARG 61 2.685 2.701 23.870 482 H ASN 62 H ASN 62 4.107 1.980 17.399 483 HA ASN 62 HA ASN 62 3.843 4.848 17.210 484 HB2 ASN 62 2HB ASN 62 5.020 3.772 19.150 485 HB3 ASN 62 1HB ASN 62 6.232 3.144 18.051 486 HD21 ASN 62 1HD2 ASN 62 6.542 4.899 20.387 487 HD22 ASN 62 2HD2 ASN 62 7.292 6.341 19.809 488 H LEU 63 H LEU 63 5.770 2.309 15.750 489 HA LEU 63 HA LEU 63 7.456 3.784 14.116 490 HB2 LEU 63 2HB LEU 63 6.210 1.108 13.521 491 HB3 LEU 63 1HB LEU 63 7.580 1.803 12.684 492 HG LEU 63 HG LEU 63 7.536 0.961 15.581 493 HD11 LEU 63 1HD1 LEU 63 8.864 -0.256 13.163 494 HD12 LEU 63 2HD1 LEU 63 7.472 -0.923 14.014 495 HD13 LEU 63 3HD1 LEU 63 9.034 -0.811 14.826 496 HD21 LEU 63 1HD2 LEU 63 9.777 1.972 13.841 497 HD22 LEU 63 2HD2 LEU 63 9.945 1.366 15.485 498 HD23 LEU 63 3HD2 LEU 63 9.042 2.852 15.188 499 H ILE 64 H ILE 64 4.211 2.550 13.403 500 HA ILE 64 HA ILE 64 4.286 3.429 10.723 501 HB ILE 64 HB ILE 64 2.820 1.568 11.558 502 HG12 ILE 64 2HG1 ILE 64 1.303 3.775 10.142 503 HG13 ILE 64 1HG1 ILE 64 2.432 2.678 9.357 504 HG21 ILE 64 1HG2 ILE 64 1.143 3.820 12.663 505 HG22 ILE 64 2HG2 ILE 64 2.015 2.611 13.603 506 HG23 ILE 64 3HG2 ILE 64 0.656 2.129 12.585 507 HD11 ILE 64 1HD1 ILE 64 0.981 0.791 9.957 508 HD12 ILE 64 2HD1 ILE 64 0.146 1.996 8.973 509 HD13 ILE 64 3HD1 ILE 64 -0.151 1.919 10.707 510 H ARG 65 H ARG 65 3.592 5.115 13.663 511 HA ARG 65 HA ARG 65 2.171 7.238 12.299 512 HB2 ARG 65 2HB ARG 65 3.211 7.146 15.139 513 HB3 ARG 65 1HB ARG 65 2.226 8.436 14.470 514 HG2 ARG 65 2HG ARG 65 0.445 6.730 14.047 515 HG3 ARG 65 1HG ARG 65 1.436 5.579 14.932 516 HD2 ARG 65 2HD ARG 65 0.363 8.177 16.001 517 HD3 ARG 65 1HD ARG 65 -0.286 6.592 16.372 518 HE ARG 65 HE ARG 65 2.483 7.294 17.056 519 HH11 ARG 65 1HH1 ARG 65 -0.687 6.117 18.050 520 HH12 ARG 65 2HH1 ARG 65 -0.314 5.993 19.703 521 HH21 ARG 65 1HH2 ARG 65 3.048 7.112 19.303 522 HH22 ARG 65 2HH2 ARG 65 1.898 6.582 20.446 523 H ARG 66 H ARG 66 5.334 6.323 12.748 524 HA ARG 66 HA ARG 66 6.509 8.982 12.688 525 HB2 ARG 66 2HB ARG 66 7.790 6.266 12.364 526 HB3 ARG 66 1HB ARG 66 8.654 7.787 12.476 527 HG2 ARG 66 2HG ARG 66 7.809 8.090 14.738 528 HG3 ARG 66 1HG ARG 66 6.947 6.553 14.622 529 HD2 ARG 66 2HD ARG 66 9.072 5.390 14.270 530 HD3 ARG 66 1HD ARG 66 9.919 6.932 14.364 531 HE ARG 66 HE ARG 66 8.330 6.500 16.643 532 HH11 ARG 66 1HH1 ARG 66 11.373 5.422 15.172 533 HH12 ARG 66 2HH1 ARG 66 12.175 5.160 16.638 534 HH21 ARG 66 1HH2 ARG 66 9.414 6.154 18.661 535 HH22 ARG 66 2HH2 ARG 66 11.013 5.580 18.708 536 H HIS 67 H HIS 67 5.205 6.806 10.508 537 HA HIS 67 HA HIS 67 6.742 7.983 8.308 538 HB2 HIS 67 2HB HIS 67 5.393 5.277 8.408 539 HB3 HIS 67 1HB HIS 67 6.173 5.955 6.985 540 HD1 HIS 67 1HD HIS 67 8.798 5.953 6.992 541 HD2 HIS 67 2HD HIS 67 7.060 4.197 10.319 542 HE1 HIS 67 1HE HIS 67 10.618 4.650 8.092 543 HE2 HIS 67 2HE HIS 67 9.456 3.377 9.914 544 H GLU 68 H GLU 68 5.556 9.411 7.266 545 HA GLU 68 HA GLU 68 2.765 9.545 7.605 546 HB2 GLU 68 2HB GLU 68 4.566 10.938 5.619 547 HB3 GLU 68 1HB GLU 68 2.870 11.330 5.799 548 HG2 GLU 68 2HG GLU 68 3.338 11.840 8.207 549 HG3 GLU 68 1HG GLU 68 5.049 11.643 7.842 550 H ARG 69 H ARG 69 1.102 9.237 6.065 551 HA ARG 69 HA ARG 69 1.653 6.789 4.775 552 HB2 ARG 69 2HB ARG 69 -0.821 6.641 4.337 553 HB3 ARG 69 1HB ARG 69 -0.184 6.519 5.970 554 HG2 ARG 69 2HG ARG 69 -2.131 7.747 6.249 555 HG3 ARG 69 1HG ARG 69 -0.908 8.995 6.182 556 HD2 ARG 69 2HD ARG 69 -2.529 8.172 3.779 557 HD3 ARG 69 1HD ARG 69 -3.131 9.338 4.930 558 HE ARG 69 HE ARG 69 -0.784 9.723 3.176 559 HH11 ARG 69 1HH1 ARG 69 -3.334 11.070 5.242 560 HH12 ARG 69 2HH1 ARG 69 -3.350 12.599 4.522 561 HH21 ARG 69 1HH2 ARG 69 -0.782 11.927 2.151 562 HH22 ARG 69 2HH2 ARG 69 -1.812 13.091 2.760 563 H ASP 70 H ASP 70 1.997 9.569 3.683 564 HA ASP 70 HA ASP 70 1.340 9.058 0.869 565 HB2 ASP 70 2HB ASP 70 3.377 11.067 1.913 566 HB3 ASP 70 1HB ASP 70 2.611 11.013 0.324 567 H GLU 71 H GLU 71 4.187 9.225 2.899 568 HA GLU 71 HA GLU 71 6.274 8.463 1.252 569 HB2 GLU 71 2HB GLU 71 5.830 7.710 4.143 570 HB3 GLU 71 1HB GLU 71 7.369 7.718 3.305 571 HG2 GLU 71 2HG GLU 71 5.689 10.172 3.749 572 HG3 GLU 71 1HG GLU 71 6.964 9.642 4.841 573 H ILE 72 H ILE 72 4.348 6.461 3.414 574 HA ILE 72 HA ILE 72 5.533 3.991 2.846 575 HB ILE 72 HB ILE 72 2.682 4.462 3.739 576 HG12 ILE 72 2HG1 ILE 72 5.190 4.094 5.402 577 HG13 ILE 72 1HG1 ILE 72 4.306 5.602 5.202 578 HG21 ILE 72 1HG2 ILE 72 3.113 2.158 2.992 579 HG22 ILE 72 2HG2 ILE 72 2.869 2.216 4.736 580 HG23 ILE 72 3HG2 ILE 72 4.500 2.071 4.079 581 HD11 ILE 72 1HD1 ILE 72 3.259 3.099 6.516 582 HD12 ILE 72 2HD1 ILE 72 2.358 4.599 6.302 583 HD13 ILE 72 3HD1 ILE 72 3.781 4.571 7.335 584 H MET 73 H MET 73 2.813 5.631 1.324 585 HA MET 73 HA MET 73 1.870 3.370 -0.097 586 HB2 MET 73 2HB MET 73 0.558 5.486 0.500 587 HB3 MET 73 1HB MET 73 1.400 6.257 -0.828 588 HG2 MET 73 2HG MET 73 -0.423 3.867 -1.073 589 HG3 MET 73 1HG MET 73 -0.856 5.526 -1.439 590 HE1 MET 73 1HE MET 73 -0.783 3.815 -4.935 591 HE2 MET 73 2HE MET 73 -1.723 4.750 -3.758 592 HE3 MET 73 3HE MET 73 -1.278 3.086 -3.404 593 H GLU 74 H GLU 74 3.846 6.201 -1.100 594 HA GLU 74 HA GLU 74 4.049 5.134 -3.686 595 HB2 GLU 74 2HB GLU 74 5.646 6.931 -4.216 596 HB3 GLU 74 1HB GLU 74 4.225 7.550 -3.412 597 HG2 GLU 74 2HG GLU 74 6.067 8.755 -2.571 598 HG3 GLU 74 1HG GLU 74 5.630 7.616 -1.302 599 H GLU 75 H GLU 75 5.937 4.688 -0.841 600 HA GLU 75 HA GLU 75 8.103 3.355 -2.038 601 HB2 GLU 75 2HB GLU 75 8.058 4.100 0.335 602 HB3 GLU 75 1HB GLU 75 6.890 2.831 0.684 603 HG2 GLU 75 2HG GLU 75 9.096 2.120 1.356 604 HG3 GLU 75 1HG GLU 75 8.540 1.145 -0.002 605 H LEU 76 H LEU 76 4.952 2.199 -0.884 606 HA LEU 76 HA LEU 76 5.212 -0.531 -1.364 607 HB2 LEU 76 2HB LEU 76 2.760 1.173 -1.865 608 HB3 LEU 76 1HB LEU 76 2.771 -0.572 -1.788 609 HG LEU 76 HG LEU 76 3.362 1.294 0.510 610 HD11 LEU 76 1HD1 LEU 76 1.225 0.509 1.385 611 HD12 LEU 76 2HD1 LEU 76 0.969 -0.441 -0.078 612 HD13 LEU 76 3HD1 LEU 76 1.020 1.319 -0.168 613 HD21 LEU 76 1HD2 LEU 76 3.105 -1.710 0.415 614 HD22 LEU 76 2HD2 LEU 76 3.275 -0.732 1.873 615 HD23 LEU 76 3HD2 LEU 76 4.589 -0.796 0.707 616 H THR 77 H THR 77 4.167 2.038 -3.558 617 HA THR 77 HA THR 77 3.625 0.507 -5.783 618 HB THR 77 HB THR 77 4.661 3.348 -5.653 619 HG1 THR 77 1HG THR 77 2.752 3.256 -4.448 620 HG21 THR 77 1HG2 THR 77 4.726 2.410 -7.933 621 HG22 THR 77 2HG2 THR 77 3.468 3.636 -7.787 622 HG23 THR 77 3HG2 THR 77 3.038 1.925 -7.783 623 H LYS 78 H LYS 78 6.738 1.974 -4.803 624 HA LYS 78 HA LYS 78 8.031 1.319 -7.257 625 HB2 LYS 78 2HB LYS 78 9.266 2.068 -4.624 626 HB3 LYS 78 1HB LYS 78 10.137 1.935 -6.144 627 HG2 LYS 78 2HG LYS 78 8.676 3.666 -7.074 628 HG3 LYS 78 1HG LYS 78 7.939 3.871 -5.494 629 HD2 LYS 78 2HD LYS 78 10.838 4.333 -6.226 630 HD3 LYS 78 1HD LYS 78 9.643 5.570 -5.850 631 HE2 LYS 78 2HE LYS 78 10.644 3.453 -3.950 632 HE3 LYS 78 1HE LYS 78 11.156 5.132 -3.975 633 HZ1 LYS 78 1HZ LYS 78 9.538 4.645 -2.295 634 HZ2 LYS 78 2HZ LYS 78 8.377 4.221 -3.431 635 HZ3 LYS 78 3HZ LYS 78 8.934 5.815 -3.327 636 H TYR 79 H TYR 79 8.254 -0.090 -4.037 637 HA TYR 79 HA TYR 79 10.187 -2.007 -4.770 638 HB2 TYR 79 2HB TYR 79 9.697 -1.206 -2.450 639 HB3 TYR 79 1HB TYR 79 8.213 -2.140 -2.490 640 HD1 TYR 79 1HD TYR 79 11.857 -2.684 -3.139 641 HD2 TYR 79 2HD TYR 79 8.280 -4.150 -1.373 642 HE1 TYR 79 1HE TYR 79 13.101 -4.589 -2.209 643 HE2 TYR 79 2HE TYR 79 9.507 -6.052 -0.452 644 HH TYR 79 HH TYR 79 12.909 -6.175 -0.402 645 H TYR 80 H TYR 80 6.705 -2.019 -4.841 646 HA TYR 80 HA TYR 80 6.111 -4.701 -5.407 647 HB2 TYR 80 2HB TYR 80 4.483 -2.915 -4.863 648 HB3 TYR 80 1HB TYR 80 4.833 -2.140 -6.390 649 HD1 TYR 80 1HD TYR 80 3.000 -4.715 -4.680 650 HD2 TYR 80 2HD TYR 80 3.983 -3.179 -8.501 651 HE1 TYR 80 1HE TYR 80 1.090 -5.928 -5.646 652 HE2 TYR 80 2HE TYR 80 2.084 -4.370 -9.487 653 HH TYR 80 HH TYR 80 -0.358 -5.791 -7.564 654 H LEU 81 H LEU 81 6.818 -1.956 -7.522 655 HA LEU 81 HA LEU 81 6.651 -3.449 -9.929 656 HB2 LEU 81 2HB LEU 81 7.715 -0.710 -9.360 657 HB3 LEU 81 1HB LEU 81 7.562 -1.381 -10.978 658 HG LEU 81 HG LEU 81 5.276 -0.897 -9.062 659 HD11 LEU 81 1HD1 LEU 81 4.645 0.881 -10.606 660 HD12 LEU 81 2HD1 LEU 81 6.115 0.578 -11.538 661 HD13 LEU 81 3HD1 LEU 81 6.228 1.179 -9.885 662 HD21 LEU 81 1HD2 LEU 81 3.878 -1.382 -11.006 663 HD22 LEU 81 2HD2 LEU 81 4.840 -2.781 -10.545 664 HD23 LEU 81 3HD2 LEU 81 5.310 -1.800 -11.937 665 H ALA 82 H ALA 82 9.220 -2.699 -7.750 666 HA ALA 82 HA ALA 82 11.443 -3.100 -9.373 667 HB1 ALA 82 1HB ALA 82 11.572 -2.254 -7.068 668 HB2 ALA 82 2HB ALA 82 12.669 -3.610 -7.326 669 HB3 ALA 82 3HB ALA 82 11.151 -3.856 -6.465 670 H ASN 83 H ASN 83 9.246 -5.419 -7.972 671 HA ASN 83 HA ASN 83 10.824 -7.754 -8.327 672 HB2 ASN 83 2HB ASN 83 7.833 -7.435 -8.243 673 HB3 ASN 83 1HB ASN 83 8.619 -8.988 -8.431 674 HD21 ASN 83 1HD2 ASN 83 9.741 -6.350 -6.260 675 HD22 ASN 83 2HD2 ASN 83 9.391 -7.239 -4.835 676 H HIS 84 H HIS 84 9.245 -5.777 -10.584 677 HA HIS 84 HA HIS 84 8.960 -7.867 -12.572 678 HB2 HIS 84 2HB HIS 84 8.462 -4.890 -12.712 679 HB3 HIS 84 1HB HIS 84 8.315 -5.948 -14.108 680 HD1 HIS 84 1HD HIS 84 6.199 -7.236 -14.345 681 HD2 HIS 84 2HD HIS 84 6.431 -5.240 -10.728 682 HE1 HIS 84 1HE HIS 84 3.939 -7.481 -13.301 683 HE2 HIS 84 2HE HIS 84 4.167 -6.546 -11.044 684 H GLY 85 H GLY 85 11.602 -6.400 -11.394 685 HA2 GLY 85 2HA GLY 85 13.761 -6.472 -12.258 686 HA3 GLY 85 1HA GLY 85 13.082 -6.935 -13.817 687 H ILE 86 H ILE 86 11.808 -4.263 -12.161 688 HA ILE 86 HA ILE 86 12.757 -2.539 -14.293 689 HB ILE 86 HB ILE 86 10.500 -2.184 -12.309 690 HG12 ILE 86 2HG1 ILE 86 10.482 -2.689 -15.293 691 HG13 ILE 86 1HG1 ILE 86 10.048 -3.854 -14.050 692 HG21 ILE 86 1HG2 ILE 86 9.908 -0.185 -13.591 693 HG22 ILE 86 2HG2 ILE 86 11.357 -0.396 -14.572 694 HG23 ILE 86 3HG2 ILE 86 11.507 -0.040 -12.854 695 HD11 ILE 86 1HD1 ILE 86 8.616 -1.281 -14.639 696 HD12 ILE 86 2HD1 ILE 86 8.150 -2.456 -13.410 697 HD13 ILE 86 3HD1 ILE 86 8.083 -2.892 -15.126 698 H ASP 87 H ASP 87 14.099 -0.936 -13.908 699 HA ASP 87 HA ASP 87 15.157 -0.584 -11.221 700 HB2 ASP 87 2HB ASP 87 16.024 0.646 -13.858 701 HB3 ASP 87 1HB ASP 87 16.835 0.887 -12.319 702 H ILE 88 H ILE 88 14.276 0.937 -9.971 703 HA ILE 88 HA ILE 88 12.980 3.171 -11.342 704 HB ILE 88 HB ILE 88 12.405 2.176 -8.520 705 HG12 ILE 88 2HG1 ILE 88 10.762 1.906 -11.047 706 HG13 ILE 88 1HG1 ILE 88 11.644 0.604 -10.264 707 HG21 ILE 88 1HG2 ILE 88 10.500 3.708 -8.583 708 HG22 ILE 88 2HG2 ILE 88 11.013 4.278 -10.172 709 HG23 ILE 88 3HG2 ILE 88 12.030 4.572 -8.760 710 HD11 ILE 88 1HD1 ILE 88 9.370 2.141 -9.026 711 HD12 ILE 88 2HD1 ILE 88 10.209 0.768 -8.319 712 HD13 ILE 88 3HD1 ILE 88 9.251 0.558 -9.788 713 H LYS 89 H LYS 89 13.535 5.174 -10.877 714 HA LYS 89 HA LYS 89 16.092 5.675 -9.780 715 HB2 LYS 89 2HB LYS 89 15.234 6.834 -11.743 716 HB3 LYS 89 1HB LYS 89 13.874 7.438 -10.837 717 HG2 LYS 89 2HG LYS 89 16.702 8.212 -10.203 718 HG3 LYS 89 1HG LYS 89 15.741 9.040 -11.430 719 HD2 LYS 89 2HD LYS 89 14.042 9.558 -9.685 720 HD3 LYS 89 1HD LYS 89 15.081 8.791 -8.491 721 HE2 LYS 89 2HE LYS 89 16.804 10.433 -8.846 722 HE3 LYS 89 1HE LYS 89 15.905 11.136 -10.187 723 HZ1 LYS 89 1HZ LYS 89 14.154 11.746 -8.649 724 HZ2 LYS 89 2HZ LYS 89 15.622 12.446 -8.171 725 HZ3 LYS 89 3HZ LYS 89 14.977 11.109 -7.351 726 H1 MET 1 H MET 1 -22.781 23.245 3.228 727 HA MET 1 HA MET 1 -21.454 23.447 0.754 728 HB2 MET 1 2HB MET 1 -19.180 23.276 1.656 729 HB3 MET 1 1HB MET 1 -19.924 24.795 2.129 730 HG2 MET 1 2HG MET 1 -20.383 23.901 4.339 731 HG3 MET 1 1HG MET 1 -19.669 22.359 3.875 732 HE1 MET 1 1HE MET 1 -18.104 22.431 5.989 733 HE2 MET 1 2HE MET 1 -18.840 23.961 6.461 734 HE3 MET 1 3HE MET 1 -17.083 23.807 6.411 735 H GLY 2 H GLY 2 -20.229 21.378 0.414 736 HA2 GLY 2 2HA GLY 2 -20.938 19.282 2.269 737 HA3 GLY 2 1HA GLY 2 -21.673 19.201 0.675 738 H PHE 3 H PHE 3 -19.712 17.497 2.053 739 HA PHE 3 HA PHE 3 -17.665 17.530 -0.042 740 HB2 PHE 3 2HB PHE 3 -17.327 16.706 2.859 741 HB3 PHE 3 1HB PHE 3 -16.094 16.574 1.617 742 HD1 PHE 3 1HD PHE 3 -17.772 18.768 3.967 743 HD2 PHE 3 2HD PHE 3 -15.049 18.616 0.700 744 HE1 PHE 3 1HE PHE 3 -16.983 21.029 4.524 745 HE2 PHE 3 2HE PHE 3 -14.253 20.877 1.258 746 HZ PHE 3 HZ PHE 3 -15.222 22.087 3.172 747 H THR 4 H THR 4 -17.757 15.717 -1.221 748 HA THR 4 HA THR 4 -19.438 13.586 -0.129 749 HB THR 4 HB THR 4 -18.982 14.274 -3.033 750 HG1 THR 4 1HG THR 4 -20.158 15.871 -2.164 751 HG21 THR 4 1HG2 THR 4 -20.895 12.772 -3.411 752 HG22 THR 4 2HG2 THR 4 -20.980 12.444 -1.678 753 HG23 THR 4 3HG2 THR 4 -19.581 11.910 -2.611 754 H ASP 5 H ASP 5 -18.096 12.131 0.683 755 HA ASP 5 HA ASP 5 -16.477 10.668 -1.246 756 HB2 ASP 5 2HB ASP 5 -14.831 12.044 0.016 757 HB3 ASP 5 1HB ASP 5 -15.457 11.374 1.524 758 H GLU 6 H GLU 6 -17.410 8.786 -1.291 759 HA GLU 6 HA GLU 6 -19.026 7.928 0.869 760 HB2 GLU 6 2HB GLU 6 -19.409 5.890 -0.465 761 HB3 GLU 6 1HB GLU 6 -19.688 7.354 -1.390 762 HG2 GLU 6 2HG GLU 6 -17.523 7.075 -2.473 763 HG3 GLU 6 1HG GLU 6 -17.235 5.618 -1.524 764 H THR 7 H THR 7 -18.555 6.705 2.497 765 HA THR 7 HA THR 7 -15.849 6.083 3.069 766 HB THR 7 HB THR 7 -16.826 5.086 5.159 767 HG1 THR 7 1HG THR 7 -19.066 5.153 3.656 768 HG21 THR 7 1HG2 THR 7 -16.197 7.440 5.081 769 HG22 THR 7 2HG2 THR 7 -17.670 7.230 6.038 770 HG23 THR 7 3HG2 THR 7 -17.768 7.846 4.393 771 H VAL 8 H VAL 8 -14.860 4.391 2.119 772 HA VAL 8 HA VAL 8 -16.459 1.989 1.887 773 HB VAL 8 HB VAL 8 -16.196 2.890 -0.342 774 HG11 VAL 8 1HG1 VAL 8 -14.028 3.117 -1.438 775 HG12 VAL 8 2HG1 VAL 8 -13.223 2.786 0.094 776 HG13 VAL 8 3HG1 VAL 8 -14.216 4.235 -0.086 777 HG21 VAL 8 1HG2 VAL 8 -14.444 0.463 0.059 778 HG22 VAL 8 2HG2 VAL 8 -15.138 0.979 -1.480 779 HG23 VAL 8 3HG2 VAL 8 -16.194 0.469 -0.163 780 H ARG 9 H ARG 9 -15.836 0.507 3.175 781 HA ARG 9 HA ARG 9 -12.981 -0.048 3.379 782 HB2 ARG 9 2HB ARG 9 -15.051 -0.560 5.561 783 HB3 ARG 9 1HB ARG 9 -13.388 -1.091 5.618 784 HG2 ARG 9 2HG ARG 9 -13.505 0.773 7.042 785 HG3 ARG 9 1HG ARG 9 -12.758 1.377 5.571 786 HD2 ARG 9 2HD ARG 9 -14.955 2.274 4.861 787 HD3 ARG 9 1HD ARG 9 -15.654 1.694 6.372 788 HE ARG 9 HE ARG 9 -13.378 3.482 6.513 789 HH11 ARG 9 1HH1 ARG 9 -16.876 3.077 6.993 790 HH12 ARG 9 2HH1 ARG 9 -17.070 4.547 7.811 791 HH21 ARG 9 1HH2 ARG 9 -13.680 5.521 7.658 792 HH22 ARG 9 2HH2 ARG 9 -15.230 5.971 8.190 793 H PHE 10 H PHE 10 -13.083 -1.359 1.658 794 HA PHE 10 HA PHE 10 -15.231 -3.157 1.220 795 HB2 PHE 10 2HB PHE 10 -13.925 -2.076 -0.601 796 HB3 PHE 10 1HB PHE 10 -12.530 -3.037 -0.140 797 HD1 PHE 10 1HD PHE 10 -15.908 -3.135 -1.584 798 HD2 PHE 10 2HD PHE 10 -12.324 -5.315 -0.863 799 HE1 PHE 10 1HE PHE 10 -16.664 -4.888 -3.136 800 HE2 PHE 10 2HE PHE 10 -13.076 -7.068 -2.413 801 HZ PHE 10 HZ PHE 10 -15.242 -6.859 -3.551 802 H ASP 11 H ASP 11 -15.482 -4.701 2.695 803 HA ASP 11 HA ASP 11 -13.173 -6.325 3.430 804 HB2 ASP 11 2HB ASP 11 -14.532 -5.465 5.298 805 HB3 ASP 11 1HB ASP 11 -15.948 -6.277 4.641 806 H PHE 12 H PHE 12 -12.816 -7.957 2.204 807 HA PHE 12 HA PHE 12 -14.857 -9.875 1.578 808 HB2 PHE 12 2HB PHE 12 -15.055 -8.372 -0.341 809 HB3 PHE 12 1HB PHE 12 -13.312 -8.365 -0.552 810 HD1 PHE 12 1HD PHE 12 -16.219 -10.704 -0.550 811 HD2 PHE 12 2HD PHE 12 -12.372 -9.773 -2.115 812 HE1 PHE 12 1HE PHE 12 -16.411 -12.573 -2.138 813 HE2 PHE 12 2HE PHE 12 -12.560 -11.638 -3.704 814 HZ PHE 12 HZ PHE 12 -14.574 -13.037 -3.717 815 H ASP 13 H ASP 13 -13.940 -11.891 1.469 816 HA ASP 13 HA ASP 13 -11.410 -12.276 2.572 817 HB2 ASP 13 2HB ASP 13 -13.001 -14.038 2.780 818 HB3 ASP 13 1HB ASP 13 -13.162 -14.185 1.033 819 H ASP 14 H ASP 14 -9.437 -12.532 1.841 820 HA ASP 14 HA ASP 14 -8.709 -11.328 -0.510 821 HB2 ASP 14 2HB ASP 14 -7.097 -11.406 1.198 822 HB3 ASP 14 1HB ASP 14 -7.117 -13.167 1.243 823 H ASN 15 H ASN 15 -8.582 -11.806 -2.475 824 HA ASN 15 HA ASN 15 -7.644 -14.378 -3.344 825 HB2 ASN 15 2HB ASN 15 -10.168 -14.501 -3.566 826 HB3 ASN 15 1HB ASN 15 -10.102 -13.088 -4.609 827 HD21 ASN 15 1HD2 ASN 15 -11.089 -15.727 -5.205 828 HD22 ASN 15 2HD2 ASN 15 -10.183 -16.329 -6.546 829 H ARG 16 H ARG 16 -5.797 -13.250 -3.663 830 HA ARG 16 HA ARG 16 -5.800 -10.820 -5.141 831 HB2 ARG 16 2HB ARG 16 -3.340 -10.815 -5.083 832 HB3 ARG 16 1HB ARG 16 -4.059 -10.987 -3.505 833 HG2 ARG 16 2HG ARG 16 -2.913 -13.290 -5.082 834 HG3 ARG 16 1HG ARG 16 -1.984 -12.329 -3.934 835 HD2 ARG 16 2HD ARG 16 -3.663 -12.961 -2.189 836 HD3 ARG 16 1HD ARG 16 -4.392 -14.046 -3.367 837 HE ARG 16 HE ARG 16 -1.947 -14.909 -3.451 838 HH11 ARG 16 1HH1 ARG 16 -3.966 -14.067 -0.636 839 HH12 ARG 16 2HH1 ARG 16 -3.076 -15.068 0.423 840 HH21 ARG 16 1HH2 ARG 16 -0.808 -16.356 -1.928 841 HH22 ARG 16 2HH2 ARG 16 -1.309 -16.396 -0.304 842 H LYS 17 H LYS 17 -4.424 -10.388 -7.009 843 HA LYS 17 HA LYS 17 -4.422 -12.560 -8.879 844 HB2 LYS 17 2HB LYS 17 -5.632 -11.073 -10.602 845 HB3 LYS 17 1HB LYS 17 -6.608 -11.886 -9.401 846 HG2 LYS 17 2HG LYS 17 -5.777 -8.977 -9.216 847 HG3 LYS 17 1HG LYS 17 -7.276 -9.517 -9.968 848 HD2 LYS 17 2HD LYS 17 -7.934 -10.561 -7.796 849 HD3 LYS 17 1HD LYS 17 -6.461 -9.915 -7.077 850 HE2 LYS 17 2HE LYS 17 -7.241 -7.643 -7.565 851 HE3 LYS 17 1HE LYS 17 -8.701 -8.316 -8.294 852 HZ1 LYS 17 1HZ LYS 17 -9.175 -7.608 -6.078 853 HZ2 LYS 17 2HZ LYS 17 -7.908 -8.536 -5.436 854 HZ3 LYS 17 3HZ LYS 17 -9.228 -9.296 -6.118 855 H LYS 18 H LYS 18 -3.143 -12.259 -10.700 856 HA LYS 18 HA LYS 18 -0.945 -10.449 -10.134 857 HB2 LYS 18 2HB LYS 18 0.303 -11.657 -11.827 858 HB3 LYS 18 1HB LYS 18 -0.483 -12.801 -10.755 859 HG2 LYS 18 2HG LYS 18 -2.245 -13.127 -12.473 860 HG3 LYS 18 1HG LYS 18 -1.348 -12.053 -13.547 861 HD2 LYS 18 2HD LYS 18 0.608 -13.606 -13.332 862 HD3 LYS 18 1HD LYS 18 -0.426 -14.693 -12.414 863 HE2 LYS 18 2HE LYS 18 -0.366 -15.448 -14.699 864 HE3 LYS 18 1HE LYS 18 -1.970 -14.804 -14.359 865 HZ1 LYS 18 1HZ LYS 18 -1.193 -14.024 -16.507 866 HZ2 LYS 18 2HZ LYS 18 0.212 -13.428 -15.818 867 HZ3 LYS 18 3HZ LYS 18 -1.232 -12.689 -15.465 868 H ALA 19 H ALA 19 -3.712 -10.390 -11.921 869 HA ALA 19 HA ALA 19 -3.219 -9.064 -14.301 870 HB1 ALA 19 1HB ALA 19 -5.455 -8.125 -14.060 871 HB2 ALA 19 2HB ALA 19 -5.415 -8.570 -12.355 872 HB3 ALA 19 3HB ALA 19 -5.418 -9.841 -13.595 873 H ILE 20 H ILE 20 -3.668 -7.727 -11.095 874 HA ILE 20 HA ILE 20 -3.495 -5.002 -11.759 875 HB ILE 20 HB ILE 20 -2.846 -6.431 -9.174 876 HG12 ILE 20 2HG1 ILE 20 -5.345 -4.989 -10.084 877 HG13 ILE 20 1HG1 ILE 20 -5.151 -6.730 -9.942 878 HG21 ILE 20 1HG2 ILE 20 -1.768 -4.253 -9.205 879 HG22 ILE 20 2HG2 ILE 20 -3.122 -4.250 -8.076 880 HG23 ILE 20 3HG2 ILE 20 -3.288 -3.488 -9.664 881 HD11 ILE 20 1HD1 ILE 20 -6.410 -5.774 -8.074 882 HD12 ILE 20 2HD1 ILE 20 -5.034 -4.758 -7.677 883 HD13 ILE 20 3HD1 ILE 20 -4.895 -6.506 -7.526 884 H SER 21 H SER 21 -1.133 -7.409 -10.978 885 HA SER 21 HA SER 21 1.045 -5.600 -10.669 886 HB2 SER 21 2HB SER 21 0.989 -7.866 -9.616 887 HB3 SER 21 1HB SER 21 1.102 -8.588 -11.219 888 HG SER 21 HG SER 21 3.066 -8.536 -10.291 889 H GLU 22 H GLU 22 -0.128 -7.678 -13.258 890 HA GLU 22 HA GLU 22 1.797 -7.090 -15.202 891 HB2 GLU 22 2HB GLU 22 -1.125 -7.789 -15.533 892 HB3 GLU 22 1HB GLU 22 0.069 -7.825 -16.820 893 HG2 GLU 22 2HG GLU 22 1.293 -9.582 -15.627 894 HG3 GLU 22 1HG GLU 22 0.091 -9.522 -14.340 895 H THR 23 H THR 23 -1.250 -5.568 -14.371 896 HA THR 23 HA THR 23 -1.397 -3.659 -16.399 897 HB THR 23 HB THR 23 -2.392 -3.497 -13.542 898 HG1 THR 23 1HG THR 23 -3.193 -5.252 -14.857 899 HG21 THR 23 1HG2 THR 23 -4.017 -1.839 -14.408 900 HG22 THR 23 2HG2 THR 23 -3.192 -1.876 -15.972 901 HG23 THR 23 3HG2 THR 23 -2.353 -1.274 -14.548 902 H LEU 24 H LEU 24 -0.036 -3.357 -13.101 903 HA LEU 24 HA LEU 24 0.730 -0.680 -13.469 904 HB2 LEU 24 2HB LEU 24 1.743 -2.657 -11.435 905 HB3 LEU 24 1HB LEU 24 2.025 -0.926 -11.414 906 HG LEU 24 HG LEU 24 -0.658 -2.268 -11.131 907 HD11 LEU 24 1HD1 LEU 24 0.740 -2.554 -9.181 908 HD12 LEU 24 2HD1 LEU 24 -0.564 -1.411 -8.847 909 HD13 LEU 24 3HD1 LEU 24 1.071 -0.822 -9.144 910 HD21 LEU 24 1HD2 LEU 24 -0.879 -0.114 -12.261 911 HD22 LEU 24 2HD2 LEU 24 0.096 0.659 -11.007 912 HD23 LEU 24 3HD2 LEU 24 -1.487 -0.011 -10.614 913 H GLU 25 H GLU 25 2.413 -3.665 -14.166 914 HA GLU 25 HA GLU 25 4.987 -2.667 -14.470 915 HB2 GLU 25 2HB GLU 25 4.486 -5.068 -14.589 916 HB3 GLU 25 1HB GLU 25 3.581 -4.823 -16.074 917 HG2 GLU 25 2HG GLU 25 5.613 -4.139 -17.217 918 HG3 GLU 25 1HG GLU 25 6.528 -4.346 -15.725 919 H THR 26 H THR 26 2.283 -2.893 -16.752 920 HA THR 26 HA THR 26 3.534 -1.698 -18.967 921 HB THR 26 HB THR 26 0.601 -1.921 -18.272 922 HG1 THR 26 1HG THR 26 2.429 -3.644 -19.607 923 HG21 THR 26 1HG2 THR 26 1.071 -0.355 -20.089 924 HG22 THR 26 2HG2 THR 26 0.253 -1.796 -20.706 925 HG23 THR 26 3HG2 THR 26 1.994 -1.600 -20.934 926 H VAL 27 H VAL 27 1.343 -0.449 -16.446 927 HA VAL 27 HA VAL 27 1.014 2.160 -17.386 928 HB VAL 27 HB VAL 27 1.045 1.208 -14.496 929 HG11 VAL 27 1HG1 VAL 27 1.358 3.622 -14.618 930 HG12 VAL 27 2HG1 VAL 27 -0.246 3.224 -13.994 931 HG13 VAL 27 3HG1 VAL 27 -0.055 3.757 -15.668 932 HG21 VAL 27 1HG2 VAL 27 -1.255 1.672 -16.396 933 HG22 VAL 27 2HG2 VAL 27 -1.394 1.188 -14.706 934 HG23 VAL 27 3HG2 VAL 27 -0.642 0.103 -15.877 935 H TYR 28 H TYR 28 3.506 0.826 -15.307 936 HA TYR 28 HA TYR 28 4.834 3.223 -14.740 937 HB2 TYR 28 2HB TYR 28 5.278 1.167 -13.470 938 HB3 TYR 28 1HB TYR 28 5.960 0.409 -14.900 939 HD1 TYR 28 1HD TYR 28 8.105 1.284 -15.830 940 HD2 TYR 28 2HD TYR 28 6.635 2.581 -12.063 941 HE1 TYR 28 1HE TYR 28 10.300 2.125 -15.275 942 HE2 TYR 28 2HE TYR 28 8.897 3.435 -11.486 943 HH TYR 28 HH TYR 28 11.362 3.655 -13.879 944 H ARG 29 H ARG 29 5.335 0.833 -17.318 945 HA ARG 29 HA ARG 29 7.573 2.132 -18.399 946 HB2 ARG 29 2HB ARG 29 5.729 0.157 -19.727 947 HB3 ARG 29 1HB ARG 29 7.243 0.726 -20.417 948 HG2 ARG 29 2HG ARG 29 8.398 -0.162 -18.399 949 HG3 ARG 29 1HG ARG 29 6.868 -0.885 -17.907 950 HD2 ARG 29 2HD ARG 29 8.236 -2.520 -19.066 951 HD3 ARG 29 1HD ARG 29 6.800 -2.133 -20.020 952 HE ARG 29 HE ARG 29 8.759 -0.418 -20.885 953 HH11 ARG 29 1HH1 ARG 29 8.376 -3.958 -20.810 954 HH12 ARG 29 2HH1 ARG 29 9.345 -4.216 -22.188 955 HH21 ARG 29 1HH2 ARG 29 10.083 -0.818 -22.809 956 HH22 ARG 29 2HH2 ARG 29 10.295 -2.418 -23.340 957 H ALA 30 H ALA 30 4.182 2.538 -19.002 958 HA ALA 30 HA ALA 30 4.421 4.034 -21.388 959 HB1 ALA 30 1HB ALA 30 2.251 4.180 -19.291 960 HB2 ALA 30 2HB ALA 30 2.296 3.053 -20.646 961 HB3 ALA 30 3HB ALA 30 2.134 4.784 -20.944 962 H LEU 31 H LEU 31 4.468 4.944 -18.006 963 HA LEU 31 HA LEU 31 4.460 7.734 -18.527 964 HB2 LEU 31 2HB LEU 31 4.979 6.164 -16.041 965 HB3 LEU 31 1HB LEU 31 5.024 7.919 -16.086 966 HG LEU 31 HG LEU 31 2.668 6.407 -17.060 967 HD11 LEU 31 1HD1 LEU 31 3.105 5.818 -14.638 968 HD12 LEU 31 2HD1 LEU 31 1.620 6.750 -14.865 969 HD13 LEU 31 3HD1 LEU 31 3.055 7.565 -14.297 970 HD21 LEU 31 1HD2 LEU 31 2.772 8.680 -17.742 971 HD22 LEU 31 2HD2 LEU 31 3.071 9.203 -16.082 972 HD23 LEU 31 3HD2 LEU 31 1.516 8.509 -16.522 973 H GLU 32 H GLU 32 7.046 5.404 -18.124 974 HA GLU 32 HA GLU 32 8.953 7.502 -17.861 975 HB2 GLU 32 2HB GLU 32 10.694 5.815 -18.350 976 HB3 GLU 32 1HB GLU 32 9.648 5.371 -17.003 977 HG2 GLU 32 2HG GLU 32 8.516 3.795 -18.369 978 HG3 GLU 32 1HG GLU 32 9.384 4.327 -19.807 979 H GLU 33 H GLU 33 7.609 5.772 -20.543 980 HA GLU 33 HA GLU 33 9.312 6.832 -22.560 981 HB2 GLU 33 2HB GLU 33 6.400 6.063 -22.841 982 HB3 GLU 33 1HB GLU 33 7.538 6.267 -24.157 983 HG2 GLU 33 2HG GLU 33 7.626 4.151 -22.026 984 HG3 GLU 33 1HG GLU 33 7.139 3.937 -23.702 985 H LYS 34 H LYS 34 6.517 8.031 -20.922 986 HA LYS 34 HA LYS 34 6.241 10.369 -22.619 987 HB2 LYS 34 2HB LYS 34 4.760 9.466 -20.160 988 HB3 LYS 34 1HB LYS 34 4.403 10.963 -21.006 989 HG2 LYS 34 2HG LYS 34 4.306 8.237 -22.287 990 HG3 LYS 34 1HG LYS 34 2.907 9.044 -21.576 991 HD2 LYS 34 2HD LYS 34 4.579 10.278 -23.770 992 HD3 LYS 34 1HD LYS 34 3.159 9.290 -24.080 993 HE2 LYS 34 2HE LYS 34 1.767 10.794 -22.877 994 HE3 LYS 34 1HE LYS 34 3.143 11.782 -22.372 995 HZ1 LYS 34 1HZ LYS 34 3.514 12.321 -24.722 996 HZ2 LYS 34 2HZ LYS 34 1.966 12.776 -24.241 997 HZ3 LYS 34 3HZ LYS 34 2.196 11.390 -25.171 998 H GLY 35 H GLY 35 8.130 9.559 -19.992 999 HA2 GLY 35 2HA GLY 35 9.748 10.846 -18.983 1000 HA3 GLY 35 1HA GLY 35 9.132 12.237 -19.858 1001 H TYR 36 H TYR 36 6.970 10.361 -17.891 1002 HA TYR 36 HA TYR 36 6.807 12.625 -16.024 1003 HB2 TYR 36 2HB TYR 36 4.942 10.271 -16.432 1004 HB3 TYR 36 1HB TYR 36 4.723 11.485 -15.183 1005 HD1 TYR 36 1HD TYR 36 3.866 10.500 -18.434 1006 HD2 TYR 36 2HD TYR 36 4.580 13.949 -16.060 1007 HE1 TYR 36 1HE TYR 36 2.576 11.884 -20.041 1008 HE2 TYR 36 2HE TYR 36 3.297 15.326 -17.633 1009 HH TYR 36 HH TYR 36 2.638 15.285 -19.906 1010 H ASN 37 H ASN 37 6.091 11.678 -13.720 1011 HA ASN 37 HA ASN 37 8.122 9.707 -12.992 1012 HB2 ASN 37 2HB ASN 37 6.384 11.488 -11.259 1013 HB3 ASN 37 1HB ASN 37 7.520 10.321 -10.623 1014 HD21 ASN 37 1HD2 ASN 37 9.738 10.773 -10.811 1015 HD22 ASN 37 2HD2 ASN 37 10.297 12.381 -11.078 1016 HA PRO 38 HA PRO 38 4.610 6.831 -13.592 1017 HB2 PRO 38 2HB PRO 38 6.717 5.132 -12.377 1018 HB3 PRO 38 1HB PRO 38 5.639 4.796 -13.732 1019 HG2 PRO 38 2HG PRO 38 8.205 5.477 -14.090 1020 HG3 PRO 38 1HG PRO 38 6.938 5.957 -15.227 1021 HD2 PRO 38 2HD PRO 38 8.454 7.616 -13.324 1022 HD3 PRO 38 1HD PRO 38 7.523 8.044 -14.786 1023 H ILE 39 H ILE 39 6.704 7.036 -10.767 1024 HA ILE 39 HA ILE 39 4.961 5.582 -9.094 1025 HB ILE 39 HB ILE 39 7.189 7.472 -8.326 1026 HG12 ILE 39 2HG1 ILE 39 8.011 5.743 -9.797 1027 HG13 ILE 39 1HG1 ILE 39 8.539 5.388 -8.159 1028 HG21 ILE 39 1HG2 ILE 39 5.688 7.008 -6.452 1029 HG22 ILE 39 2HG2 ILE 39 7.248 6.220 -6.212 1030 HG23 ILE 39 3HG2 ILE 39 5.853 5.275 -6.737 1031 HD11 ILE 39 1HD1 ILE 39 7.832 3.365 -9.309 1032 HD12 ILE 39 2HD1 ILE 39 6.259 4.069 -9.636 1033 HD13 ILE 39 3HD1 ILE 39 6.730 3.710 -7.976 1034 H ASN 40 H ASN 40 5.539 9.063 -9.475 1035 HA ASN 40 HA ASN 40 3.725 9.861 -7.466 1036 HB2 ASN 40 2HB ASN 40 4.625 11.408 -9.909 1037 HB3 ASN 40 1HB ASN 40 3.615 12.088 -8.646 1038 HD21 ASN 40 1HD2 ASN 40 6.167 13.012 -9.489 1039 HD22 ASN 40 2HD2 ASN 40 7.243 12.882 -8.148 1040 H GLN 41 H GLN 41 3.262 9.212 -10.888 1041 HA GLN 41 HA GLN 41 0.606 10.173 -10.947 1042 HB2 GLN 41 2HB GLN 41 1.923 8.159 -12.751 1043 HB3 GLN 41 1HB GLN 41 0.424 9.005 -13.093 1044 HG2 GLN 41 2HG GLN 41 3.148 10.277 -12.803 1045 HG3 GLN 41 1HG GLN 41 2.305 9.980 -14.315 1046 HE21 GLN 41 1HE2 GLN 41 -0.289 10.796 -13.289 1047 HE22 GLN 41 2HE2 GLN 41 -0.228 12.511 -13.113 1048 H ILE 42 H ILE 42 1.986 6.966 -10.311 1049 HA ILE 42 HA ILE 42 -0.556 5.698 -10.226 1050 HB ILE 42 HB ILE 42 2.088 4.725 -9.093 1051 HG12 ILE 42 2HG1 ILE 42 0.615 3.970 -11.636 1052 HG13 ILE 42 1HG1 ILE 42 2.038 4.999 -11.552 1053 HG21 ILE 42 1HG2 ILE 42 0.205 3.646 -7.931 1054 HG22 ILE 42 2HG2 ILE 42 1.026 2.493 -8.980 1055 HG23 ILE 42 3HG2 ILE 42 -0.515 3.200 -9.464 1056 HD11 ILE 42 1HD1 ILE 42 3.346 3.110 -10.715 1057 HD12 ILE 42 2HD1 ILE 42 2.605 2.745 -12.275 1058 HD13 ILE 42 3HD1 ILE 42 1.913 2.086 -10.791 1059 H VAL 43 H VAL 43 1.630 6.815 -7.604 1060 HA VAL 43 HA VAL 43 -0.133 6.072 -5.548 1061 HB VAL 43 HB VAL 43 2.172 6.638 -4.925 1062 HG11 VAL 43 1HG1 VAL 43 2.616 8.384 -6.563 1063 HG12 VAL 43 2HG1 VAL 43 3.010 8.951 -4.939 1064 HG13 VAL 43 3HG1 VAL 43 1.516 9.478 -5.721 1065 HG21 VAL 43 1HG2 VAL 43 0.249 8.609 -3.687 1066 HG22 VAL 43 2HG2 VAL 43 1.812 8.145 -3.012 1067 HG23 VAL 43 3HG2 VAL 43 0.527 6.944 -3.171 1068 H GLY 44 H GLY 44 0.051 9.032 -7.428 1069 HA2 GLY 44 2HA GLY 44 -1.949 10.477 -6.084 1070 HA3 GLY 44 1HA GLY 44 -1.468 10.691 -7.765 1071 H TYR 45 H TYR 45 -2.100 8.122 -8.732 1072 HA TYR 45 HA TYR 45 -4.827 8.452 -9.272 1073 HB2 TYR 45 2HB TYR 45 -3.453 7.249 -10.882 1074 HB3 TYR 45 1HB TYR 45 -3.128 5.985 -9.699 1075 HD1 TYR 45 1HD TYR 45 -4.824 4.286 -9.166 1076 HD2 TYR 45 2HD TYR 45 -5.696 7.395 -11.958 1077 HE1 TYR 45 1HE TYR 45 -6.813 3.081 -9.879 1078 HE2 TYR 45 2HE TYR 45 -7.688 6.167 -12.671 1079 HH TYR 45 HH TYR 45 -8.323 3.564 -12.620 1080 H LEU 46 H LEU 46 -3.231 6.009 -7.240 1081 HA LEU 46 HA LEU 46 -5.700 4.882 -6.547 1082 HB2 LEU 46 2HB LEU 46 -3.051 4.589 -5.217 1083 HB3 LEU 46 1HB LEU 46 -4.483 3.829 -4.559 1084 HG LEU 46 HG LEU 46 -4.696 2.636 -6.818 1085 HD11 LEU 46 1HD1 LEU 46 -2.792 2.413 -8.187 1086 HD12 LEU 46 2HD1 LEU 46 -1.897 3.538 -7.166 1087 HD13 LEU 46 3HD1 LEU 46 -3.280 4.113 -8.091 1088 HD21 LEU 46 1HD2 LEU 46 -3.036 0.979 -6.226 1089 HD22 LEU 46 2HD2 LEU 46 -3.955 1.538 -4.829 1090 HD23 LEU 46 3HD2 LEU 46 -2.306 2.117 -5.091 1091 H LEU 47 H LEU 47 -3.998 7.486 -5.042 1092 HA LEU 47 HA LEU 47 -5.596 7.525 -2.725 1093 HB2 LEU 47 2HB LEU 47 -4.161 9.799 -4.112 1094 HB3 LEU 47 1HB LEU 47 -4.887 9.919 -2.531 1095 HG LEU 47 HG LEU 47 -2.542 8.170 -3.270 1096 HD11 LEU 47 1HD1 LEU 47 -1.956 10.529 -3.190 1097 HD12 LEU 47 2HD1 LEU 47 -1.260 9.684 -1.812 1098 HD13 LEU 47 3HD1 LEU 47 -2.701 10.676 -1.598 1099 HD21 LEU 47 1HD2 LEU 47 -3.880 7.105 -1.525 1100 HD22 LEU 47 2HD2 LEU 47 -3.882 8.607 -0.595 1101 HD23 LEU 47 3HD2 LEU 47 -2.377 7.734 -0.852 1102 H SER 48 H SER 48 -6.151 8.821 -5.961 1103 HA SER 48 HA SER 48 -8.604 10.115 -4.967 1104 HB2 SER 48 2HB SER 48 -6.963 11.598 -6.016 1105 HB3 SER 48 1HB SER 48 -7.056 10.654 -7.500 1106 HG SER 48 HG SER 48 -9.450 11.577 -6.488 1107 H GLY 49 H GLY 49 -7.558 7.563 -7.108 1108 HA2 GLY 49 2HA GLY 49 -8.682 6.130 -8.473 1109 HA3 GLY 49 1HA GLY 49 -10.167 6.667 -7.696 1110 H ASP 50 H ASP 50 -7.903 8.713 -9.469 1111 HA ASP 50 HA ASP 50 -10.141 9.360 -11.269 1112 HB2 ASP 50 2HB ASP 50 -9.352 11.107 -9.668 1113 HB3 ASP 50 1HB ASP 50 -7.828 11.121 -10.525 1114 HA PRO 51 HA PRO 51 -7.645 7.595 -14.473 1115 HB2 PRO 51 2HB PRO 51 -8.947 8.729 -16.604 1116 HB3 PRO 51 1HB PRO 51 -9.465 7.269 -15.766 1117 HG2 PRO 51 2HG PRO 51 -10.443 10.079 -15.461 1118 HG3 PRO 51 1HG PRO 51 -11.359 8.568 -15.419 1119 HD2 PRO 51 2HD PRO 51 -10.718 9.934 -13.189 1120 HD3 PRO 51 1HD PRO 51 -10.827 8.163 -13.206 1121 H ALA 52 H ALA 52 -7.998 11.080 -14.175 1122 HA ALA 52 HA ALA 52 -6.418 11.850 -16.384 1123 HB1 ALA 52 1HB ALA 52 -6.227 14.028 -15.318 1124 HB2 ALA 52 2HB ALA 52 -6.829 13.346 -13.807 1125 HB3 ALA 52 3HB ALA 52 -7.878 13.417 -15.220 1126 H TYR 53 H TYR 53 -5.458 10.354 -13.537 1127 HA TYR 53 HA TYR 53 -2.894 11.512 -13.335 1128 HB2 TYR 53 2HB TYR 53 -4.091 9.050 -12.145 1129 HB3 TYR 53 1HB TYR 53 -2.380 9.433 -11.939 1130 HD1 TYR 53 1HD TYR 53 -1.723 11.541 -10.914 1131 HD2 TYR 53 2HD TYR 53 -5.752 10.240 -10.910 1132 HE1 TYR 53 1HE TYR 53 -2.192 13.113 -9.163 1133 HE2 TYR 53 2HE TYR 53 -6.267 11.826 -9.115 1134 HH TYR 53 HH TYR 53 -5.132 13.032 -7.368 1135 H ILE 54 H ILE 54 -4.168 9.274 -15.580 1136 HA ILE 54 HA ILE 54 -1.440 8.555 -16.337 1137 HB ILE 54 HB ILE 54 -3.890 6.775 -16.668 1138 HG12 ILE 54 2HG1 ILE 54 -3.121 6.780 -14.334 1139 HG13 ILE 54 1HG1 ILE 54 -2.739 5.248 -15.105 1140 HG21 ILE 54 1HG2 ILE 54 -2.340 5.084 -17.529 1141 HG22 ILE 54 2HG2 ILE 54 -1.011 6.240 -17.403 1142 HG23 ILE 54 3HG2 ILE 54 -2.327 6.538 -18.531 1143 HD11 ILE 54 1HD1 ILE 54 -0.925 5.992 -13.684 1144 HD12 ILE 54 2HD1 ILE 54 -0.807 7.494 -14.595 1145 HD13 ILE 54 3HD1 ILE 54 -0.424 5.960 -15.377 1146 HA PRO 55 HA PRO 55 -2.763 10.801 -19.938 1147 HB2 PRO 55 2HB PRO 55 -0.417 10.706 -21.276 1148 HB3 PRO 55 1HB PRO 55 -0.672 11.773 -19.889 1149 HG2 PRO 55 2HG PRO 55 0.671 9.102 -19.993 1150 HG3 PRO 55 1HG PRO 55 1.182 10.575 -19.151 1151 HD2 PRO 55 2HD PRO 55 -0.069 8.529 -17.906 1152 HD3 PRO 55 1HD PRO 55 -0.257 10.222 -17.389 1153 H ARG 56 H ARG 56 -3.010 10.407 -22.224 1154 HA ARG 56 HA ARG 56 -3.452 7.591 -22.714 1155 HB2 ARG 56 2HB ARG 56 -4.255 9.977 -24.411 1156 HB3 ARG 56 1HB ARG 56 -4.630 8.318 -24.816 1157 HG2 ARG 56 2HG ARG 56 -6.583 9.343 -23.890 1158 HG3 ARG 56 1HG ARG 56 -5.987 8.191 -22.704 1159 HD2 ARG 56 2HD ARG 56 -4.851 10.074 -21.545 1160 HD3 ARG 56 1HD ARG 56 -5.602 11.179 -22.693 1161 HE ARG 56 HE ARG 56 -7.625 9.688 -21.588 1162 HH11 ARG 56 1HH1 ARG 56 -5.153 11.946 -20.444 1163 HH12 ARG 56 2HH1 ARG 56 -6.078 12.496 -19.117 1164 HH21 ARG 56 1HH2 ARG 56 -8.888 10.445 -19.789 1165 HH22 ARG 56 2HH2 ARG 56 -8.269 11.617 -18.729 1166 H TYR 57 H TYR 57 -1.218 7.192 -22.728 1167 HA TYR 57 HA TYR 57 0.033 7.686 -25.336 1168 HB2 TYR 57 2HB TYR 57 1.470 8.161 -23.446 1169 HB3 TYR 57 1HB TYR 57 1.173 6.565 -22.772 1170 HD1 TYR 57 1HD TYR 57 2.625 8.267 -25.734 1171 HD2 TYR 57 2HD TYR 57 2.575 4.771 -23.325 1172 HE1 TYR 57 1HE TYR 57 4.522 7.395 -26.984 1173 HE2 TYR 57 2HE TYR 57 4.465 3.863 -24.574 1174 HH TYR 57 HH TYR 57 5.475 4.166 -26.781 1175 H GLN 58 H GLN 58 -1.123 5.169 -23.207 1176 HA GLN 58 HA GLN 58 -0.976 3.268 -25.397 1177 HB2 GLN 58 2HB GLN 58 1.141 3.235 -23.843 1178 HB3 GLN 58 1HB GLN 58 0.040 2.562 -22.652 1179 HG2 GLN 58 2HG GLN 58 -0.447 0.691 -24.200 1180 HG3 GLN 58 1HG GLN 58 0.726 1.420 -25.311 1181 HE21 GLN 58 1HE2 GLN 58 0.726 -1.200 -23.983 1182 HE22 GLN 58 2HE2 GLN 58 2.223 -1.274 -23.139 1183 H ASP 59 H ASP 59 -2.163 1.249 -24.634 1184 HA ASP 59 HA ASP 59 -4.705 1.793 -23.684 1185 HB2 ASP 59 2HB ASP 59 -4.956 -0.704 -23.509 1186 HB3 ASP 59 1HB ASP 59 -4.388 -0.127 -25.067 1187 H ALA 60 H ALA 60 -1.920 1.521 -21.886 1188 HA ALA 60 HA ALA 60 -2.558 0.396 -19.464 1189 HB1 ALA 60 1HB ALA 60 -0.902 1.871 -18.470 1190 HB2 ALA 60 2HB ALA 60 -0.987 2.935 -19.873 1191 HB3 ALA 60 3HB ALA 60 -0.349 1.302 -20.047 1192 H ARG 61 H ARG 61 -3.462 3.690 -20.591 1193 HA ARG 61 HA ARG 61 -4.618 4.451 -18.180 1194 HB2 ARG 61 2HB ARG 61 -5.895 6.194 -19.539 1195 HB3 ARG 61 1HB ARG 61 -4.150 6.245 -19.648 1196 HG2 ARG 61 2HG ARG 61 -5.039 6.666 -21.806 1197 HG3 ARG 61 1HG ARG 61 -4.335 5.058 -21.839 1198 HD2 ARG 61 2HD ARG 61 -6.589 4.107 -21.553 1199 HD3 ARG 61 1HD ARG 61 -7.263 5.735 -21.589 1200 HE ARG 61 HE ARG 61 -5.690 5.394 -23.848 1201 HH11 ARG 61 1HH1 ARG 61 -8.745 4.178 -22.527 1202 HH12 ARG 61 2HH1 ARG 61 -9.408 3.810 -24.045 1203 HH21 ARG 61 1HH2 ARG 61 -6.634 4.936 -25.929 1204 HH22 ARG 61 2HH2 ARG 61 -8.188 4.274 -26.041 1205 H ASN 62 H ASN 62 -5.920 2.481 -20.687 1206 HA ASN 62 HA ASN 62 -8.583 2.444 -19.632 1207 HB2 ASN 62 2HB ASN 62 -8.415 1.925 -21.957 1208 HB3 ASN 62 1HB ASN 62 -7.131 0.757 -21.676 1209 HD21 ASN 62 1HD2 ASN 62 -10.593 1.340 -21.371 1210 HD22 ASN 62 2HD2 ASN 62 -11.011 -0.319 -21.236 1211 H LEU 63 H LEU 63 -5.801 0.318 -19.559 1212 HA LEU 63 HA LEU 63 -6.832 -1.802 -18.114 1213 HB2 LEU 63 2HB LEU 63 -4.040 -0.678 -18.029 1214 HB3 LEU 63 1HB LEU 63 -4.521 -2.256 -17.441 1215 HG LEU 63 HG LEU 63 -4.670 -1.374 -20.326 1216 HD11 LEU 63 1HD1 LEU 63 -2.362 -1.590 -19.578 1217 HD12 LEU 63 2HD1 LEU 63 -2.813 -2.904 -20.652 1218 HD13 LEU 63 3HD1 LEU 63 -2.714 -3.187 -18.914 1219 HD21 LEU 63 1HD2 LEU 63 -5.077 -3.761 -20.742 1220 HD22 LEU 63 2HD2 LEU 63 -6.361 -3.043 -19.771 1221 HD23 LEU 63 3HD2 LEU 63 -5.128 -4.051 -19.009 1222 H ILE 64 H ILE 64 -5.286 1.146 -16.886 1223 HA ILE 64 HA ILE 64 -5.478 0.301 -14.180 1224 HB ILE 64 HB ILE 64 -3.777 1.971 -15.025 1225 HG12 ILE 64 2HG1 ILE 64 -5.478 2.984 -12.726 1226 HG13 ILE 64 1HG1 ILE 64 -4.297 1.687 -12.595 1227 HG21 ILE 64 1HG2 ILE 64 -4.468 4.339 -15.222 1228 HG22 ILE 64 2HG2 ILE 64 -6.145 3.849 -15.015 1229 HG23 ILE 64 3HG2 ILE 64 -5.241 3.310 -16.427 1230 HD11 ILE 64 1HD1 ILE 64 -2.521 3.274 -13.200 1231 HD12 ILE 64 2HD1 ILE 64 -3.400 3.769 -11.754 1232 HD13 ILE 64 3HD1 ILE 64 -3.729 4.559 -13.292 1233 H ARG 65 H ARG 65 -7.739 1.666 -16.331 1234 HA ARG 65 HA ARG 65 -9.411 2.606 -14.178 1235 HB2 ARG 65 2HB ARG 65 -9.649 2.835 -17.153 1236 HB3 ARG 65 1HB ARG 65 -11.025 3.150 -16.102 1237 HG2 ARG 65 2HG ARG 65 -8.367 4.566 -15.969 1238 HG3 ARG 65 1HG ARG 65 -9.856 5.206 -16.677 1239 HD2 ARG 65 2HD ARG 65 -9.478 4.432 -13.768 1240 HD3 ARG 65 1HD ARG 65 -9.544 6.060 -14.363 1241 HE ARG 65 HE ARG 65 -11.864 4.871 -15.242 1242 HH11 ARG 65 1HH1 ARG 65 -10.418 5.557 -12.066 1243 HH12 ARG 65 2HH1 ARG 65 -11.930 5.636 -11.285 1244 HH21 ARG 65 1HH2 ARG 65 -13.877 4.989 -14.142 1245 HH22 ARG 65 2HH2 ARG 65 -13.925 5.292 -12.473 1246 H ARG 66 H ARG 66 -8.792 -0.288 -15.539 1247 HA ARG 66 HA ARG 66 -11.538 -1.249 -15.278 1248 HB2 ARG 66 2HB ARG 66 -9.049 -2.750 -16.114 1249 HB3 ARG 66 1HB ARG 66 -10.679 -3.398 -16.121 1250 HG2 ARG 66 2HG ARG 66 -11.294 -1.644 -17.790 1251 HG3 ARG 66 1HG ARG 66 -9.588 -1.198 -17.855 1252 HD2 ARG 66 2HD ARG 66 -10.116 -2.709 -19.679 1253 HD3 ARG 66 1HD ARG 66 -9.040 -3.511 -18.532 1254 HE ARG 66 HE ARG 66 -11.731 -4.006 -17.882 1255 HH11 ARG 66 1HH1 ARG 66 -9.287 -4.996 -20.261 1256 HH12 ARG 66 2HH1 ARG 66 -9.980 -6.506 -20.560 1257 HH21 ARG 66 1HH2 ARG 66 -12.698 -6.114 -18.289 1258 HH22 ARG 66 2HH2 ARG 66 -11.960 -7.169 -19.390 1259 H HIS 67 H HIS 67 -9.326 -0.461 -13.180 1260 HA HIS 67 HA HIS 67 -10.042 -2.599 -11.310 1261 HB2 HIS 67 2HB HIS 67 -7.263 -1.377 -11.506 1262 HB3 HIS 67 1HB HIS 67 -7.782 -2.590 -10.351 1263 HD1 HIS 67 1HD HIS 67 -8.137 -5.057 -11.376 1264 HD2 HIS 67 2HD HIS 67 -6.349 -2.294 -13.899 1265 HE1 HIS 67 1HE HIS 67 -7.089 -6.395 -13.214 1266 HE2 HIS 67 2HE HIS 67 -6.307 -4.658 -14.858 1267 H GLU 68 H GLU 68 -10.176 -1.766 -9.123 1268 HA GLU 68 HA GLU 68 -10.268 1.134 -9.084 1269 HB2 GLU 68 2HB GLU 68 -11.480 -0.858 -7.195 1270 HB3 GLU 68 1HB GLU 68 -11.420 0.862 -6.850 1271 HG2 GLU 68 2HG GLU 68 -12.689 1.297 -8.913 1272 HG3 GLU 68 1HG GLU 68 -12.801 -0.440 -9.182 1273 H ARG 69 H ARG 69 -9.686 2.237 -7.120 1274 HA ARG 69 HA ARG 69 -6.915 2.289 -6.690 1275 HB2 ARG 69 2HB ARG 69 -8.769 3.034 -4.446 1276 HB3 ARG 69 1HB ARG 69 -7.293 3.785 -4.972 1277 HG2 ARG 69 2HG ARG 69 -8.362 4.818 -6.741 1278 HG3 ARG 69 1HG ARG 69 -9.873 3.911 -6.483 1279 HD2 ARG 69 2HD ARG 69 -8.605 5.975 -4.663 1280 HD3 ARG 69 1HD ARG 69 -10.197 6.046 -5.422 1281 HE ARG 69 HE ARG 69 -10.376 3.808 -3.896 1282 HH11 ARG 69 1HH1 ARG 69 -9.447 7.173 -3.065 1283 HH12 ARG 69 2HH1 ARG 69 -9.877 6.983 -1.433 1284 HH21 ARG 69 1HH2 ARG 69 -10.884 3.590 -1.606 1285 HH22 ARG 69 2HH2 ARG 69 -10.689 4.952 -0.599 1286 H ASP 70 H ASP 70 -9.500 1.217 -4.627 1287 HA ASP 70 HA ASP 70 -8.166 0.359 -2.410 1288 HB2 ASP 70 2HB ASP 70 -10.820 -0.570 -3.516 1289 HB3 ASP 70 1HB ASP 70 -10.313 -0.652 -1.826 1290 H GLU 71 H GLU 71 -9.176 -1.496 -5.255 1291 HA GLU 71 HA GLU 71 -8.356 -4.059 -4.408 1292 HB2 GLU 71 2HB GLU 71 -8.592 -2.852 -7.166 1293 HB3 GLU 71 1HB GLU 71 -8.166 -4.530 -6.892 1294 HG2 GLU 71 2HG GLU 71 -10.707 -3.240 -5.948 1295 HG3 GLU 71 1HG GLU 71 -10.544 -4.174 -7.437 1296 H ILE 72 H ILE 72 -6.703 -1.652 -6.397 1297 HA ILE 72 HA ILE 72 -4.337 -3.149 -6.774 1298 HB ILE 72 HB ILE 72 -4.687 -0.140 -6.899 1299 HG12 ILE 72 2HG1 ILE 72 -4.918 -2.205 -9.107 1300 HG13 ILE 72 1HG1 ILE 72 -6.264 -1.341 -8.379 1301 HG21 ILE 72 1HG2 ILE 72 -2.602 -1.936 -8.155 1302 HG22 ILE 72 2HG2 ILE 72 -2.329 -0.843 -6.799 1303 HG23 ILE 72 3HG2 ILE 72 -2.728 -0.190 -8.388 1304 HD11 ILE 72 1HD1 ILE 72 -5.359 0.769 -9.220 1305 HD12 ILE 72 2HD1 ILE 72 -5.660 -0.376 -10.529 1306 HD13 ILE 72 3HD1 ILE 72 -4.014 -0.103 -9.953 1307 H MET 73 H MET 73 -5.307 -0.826 -4.353 1308 HA MET 73 HA MET 73 -2.749 -0.381 -3.253 1309 HB2 MET 73 2HB MET 73 -4.849 1.046 -2.950 1310 HB3 MET 73 1HB MET 73 -5.360 -0.129 -1.760 1311 HG2 MET 73 2HG MET 73 -2.849 1.540 -1.600 1312 HG3 MET 73 1HG MET 73 -4.346 1.872 -0.751 1313 HE1 MET 73 1HE MET 73 -1.467 1.684 0.609 1314 HE2 MET 73 2HE MET 73 -1.897 0.824 2.095 1315 HE3 MET 73 3HE MET 73 -2.975 2.062 1.435 1316 H GLU 74 H GLU 74 -5.378 -2.619 -2.202 1317 HA GLU 74 HA GLU 74 -3.734 -3.528 -0.093 1318 HB2 GLU 74 2HB GLU 74 -5.432 -5.252 0.388 1319 HB3 GLU 74 1HB GLU 74 -6.168 -3.686 0.162 1320 HG2 GLU 74 2HG GLU 74 -7.629 -5.200 -0.853 1321 HG3 GLU 74 1HG GLU 74 -6.735 -4.508 -2.201 1322 H GLU 75 H GLU 75 -4.121 -4.479 -3.357 1323 HA GLU 75 HA GLU 75 -2.731 -6.912 -3.343 1324 HB2 GLU 75 2HB GLU 75 -4.058 -5.883 -5.241 1325 HB3 GLU 75 1HB GLU 75 -2.702 -4.800 -5.506 1326 HG2 GLU 75 2HG GLU 75 -2.620 -6.621 -7.075 1327 HG3 GLU 75 1HG GLU 75 -1.272 -6.754 -5.943 1328 H LEU 76 H LEU 76 -1.653 -3.550 -3.772 1329 HA LEU 76 HA LEU 76 1.094 -3.908 -4.076 1330 HB2 LEU 76 2HB LEU 76 -0.273 -1.684 -2.546 1331 HB3 LEU 76 1HB LEU 76 1.384 -1.667 -3.079 1332 HG LEU 76 HG LEU 76 -1.040 -1.627 -4.878 1333 HD11 LEU 76 1HD1 LEU 76 -0.354 0.667 -5.342 1334 HD12 LEU 76 2HD1 LEU 76 0.947 0.523 -4.165 1335 HD13 LEU 76 3HD1 LEU 76 -0.732 0.449 -3.633 1336 HD21 LEU 76 1HD2 LEU 76 0.858 -2.745 -5.929 1337 HD22 LEU 76 2HD2 LEU 76 1.894 -1.374 -5.528 1338 HD23 LEU 76 3HD2 LEU 76 0.561 -1.171 -6.661 1339 H THR 77 H THR 77 -0.807 -3.481 -1.093 1340 HA THR 77 HA THR 77 1.273 -3.494 0.716 1341 HB THR 77 HB THR 77 -1.561 -4.499 1.084 1342 HG1 THR 77 1HG THR 77 -1.681 -2.354 0.400 1343 HG21 THR 77 1HG2 THR 77 -1.223 -3.892 3.441 1344 HG22 THR 77 2HG2 THR 77 0.441 -3.430 3.088 1345 HG23 THR 77 3HG2 THR 77 -0.054 -5.115 2.944 1346 H LYS 78 H LYS 78 -0.695 -6.247 -0.406 1347 HA LYS 78 HA LYS 78 0.530 -8.197 1.241 1348 HB2 LYS 78 2HB LYS 78 -0.918 -8.503 -1.363 1349 HB3 LYS 78 1HB LYS 78 -0.513 -9.834 -0.280 1350 HG2 LYS 78 2HG LYS 78 -1.866 -8.933 1.417 1351 HG3 LYS 78 1HG LYS 78 -2.188 -7.483 0.494 1352 HD2 LYS 78 2HD LYS 78 -3.088 -10.299 -0.149 1353 HD3 LYS 78 1HD LYS 78 -4.112 -8.956 0.360 1354 HE2 LYS 78 2HE LYS 78 -3.313 -7.734 -1.666 1355 HE3 LYS 78 1HE LYS 78 -2.588 -9.262 -2.196 1356 HZ1 LYS 78 1HZ LYS 78 -5.407 -8.609 -1.750 1357 HZ2 LYS 78 2HZ LYS 78 -4.927 -10.188 -1.882 1358 HZ3 LYS 78 3HZ LYS 78 -4.732 -9.103 -3.214 1359 H TYR 79 H TYR 79 1.066 -7.264 -2.073 1360 HA TYR 79 HA TYR 79 2.928 -9.298 -2.673 1361 HB2 TYR 79 2HB TYR 79 1.548 -7.808 -4.208 1362 HB3 TYR 79 1HB TYR 79 2.777 -6.588 -3.932 1363 HD1 TYR 79 1HD TYR 79 1.853 -9.550 -5.705 1364 HD2 TYR 79 2HD TYR 79 5.096 -7.017 -4.727 1365 HE1 TYR 79 1HE TYR 79 3.114 -10.479 -7.595 1366 HE2 TYR 79 2HE TYR 79 6.388 -7.932 -6.628 1367 HH TYR 79 HH TYR 79 6.408 -10.017 -7.958 1368 H TYR 80 H TYR 80 3.270 -5.963 -1.534 1369 HA TYR 80 HA TYR 80 6.071 -5.688 -1.562 1370 HB2 TYR 80 2HB TYR 80 4.425 -3.849 -1.220 1371 HB3 TYR 80 1HB TYR 80 4.018 -4.518 0.344 1372 HD1 TYR 80 1HD TYR 80 6.234 -2.389 -1.517 1373 HD2 TYR 80 2HD TYR 80 5.768 -4.414 2.190 1374 HE1 TYR 80 1HE TYR 80 7.912 -0.910 -0.505 1375 HE2 TYR 80 2HE TYR 80 7.451 -2.949 3.211 1376 HH TYR 80 HH TYR 80 8.528 -0.104 1.688 1377 H LEU 81 H LEU 81 3.830 -6.849 0.896 1378 HA LEU 81 HA LEU 81 5.837 -7.408 2.813 1379 HB2 LEU 81 2HB LEU 81 2.964 -8.202 2.641 1380 HB3 LEU 81 1HB LEU 81 3.983 -8.571 4.029 1381 HG LEU 81 HG LEU 81 3.268 -5.811 3.026 1382 HD11 LEU 81 1HD1 LEU 81 2.372 -7.321 5.456 1383 HD12 LEU 81 2HD1 LEU 81 1.379 -6.956 4.044 1384 HD13 LEU 81 3HD1 LEU 81 1.962 -5.646 5.077 1385 HD21 LEU 81 1HD2 LEU 81 4.309 -5.043 5.109 1386 HD22 LEU 81 2HD2 LEU 81 5.471 -5.827 4.047 1387 HD23 LEU 81 3HD2 LEU 81 4.835 -6.689 5.451 1388 H ALA 82 H ALA 82 4.414 -9.229 0.222 1389 HA ALA 82 HA ALA 82 5.045 -11.827 1.050 1390 HB1 ALA 82 1HB ALA 82 4.910 -10.707 -1.751 1391 HB2 ALA 82 2HB ALA 82 3.550 -11.354 -0.835 1392 HB3 ALA 82 3HB ALA 82 4.871 -12.415 -1.329 1393 H ASN 83 H ASN 83 6.915 -9.324 -0.473 1394 HA ASN 83 HA ASN 83 9.172 -10.847 -1.200 1395 HB2 ASN 83 2HB ASN 83 8.898 -7.936 -0.548 1396 HB3 ASN 83 1HB ASN 83 10.409 -8.640 -1.111 1397 HD21 ASN 83 1HD2 ASN 83 9.026 -10.484 -2.969 1398 HD22 ASN 83 2HD2 ASN 83 8.475 -9.467 -4.251 1399 H HIS 84 H HIS 84 8.087 -9.931 1.875 1400 HA HIS 84 HA HIS 84 10.719 -10.050 3.076 1401 HB2 HIS 84 2HB HIS 84 7.978 -9.842 4.354 1402 HB3 HIS 84 1HB HIS 84 9.465 -9.952 5.283 1403 HD1 HIS 84 1HD HIS 84 10.707 -7.825 5.680 1404 HD2 HIS 84 2HD HIS 84 7.722 -7.402 2.852 1405 HE1 HIS 84 1HE HIS 84 10.660 -5.384 5.125 1406 HE2 HIS 84 2HE HIS 84 9.232 -5.346 3.078 1407 H GLY 85 H GLY 85 8.766 -12.327 1.831 1408 HA2 GLY 85 2HA GLY 85 9.207 -14.626 1.864 1409 HA3 GLY 85 1HA GLY 85 10.044 -14.426 3.401 1410 H ILE 86 H ILE 86 7.038 -12.923 2.989 1411 HA ILE 86 HA ILE 86 5.912 -14.682 5.029 1412 HB ILE 86 HB ILE 86 5.069 -11.919 4.127 1413 HG12 ILE 86 2HG1 ILE 86 6.456 -12.829 6.661 1414 HG13 ILE 86 1HG1 ILE 86 7.210 -11.947 5.340 1415 HG21 ILE 86 1HG2 ILE 86 3.581 -11.931 6.066 1416 HG22 ILE 86 2HG2 ILE 86 4.027 -13.609 6.398 1417 HG23 ILE 86 3HG2 ILE 86 3.167 -13.199 4.910 1418 HD11 ILE 86 1HD1 ILE 86 6.692 -10.476 7.205 1419 HD12 ILE 86 2HD1 ILE 86 4.993 -10.950 7.103 1420 HD13 ILE 86 3HD1 ILE 86 5.734 -10.051 5.782 1421 H ASP 87 H ASP 87 4.134 -15.861 4.659 1422 HA ASP 87 HA ASP 87 2.876 -15.751 2.006 1423 HB2 ASP 87 2HB ASP 87 2.583 -17.788 4.245 1424 HB3 ASP 87 1HB ASP 87 1.695 -17.858 2.731 1425 H ILE 88 H ILE 88 1.040 -14.671 1.768 1426 HA ILE 88 HA ILE 88 -0.334 -13.775 4.214 1427 HB ILE 88 HB ILE 88 -0.128 -12.487 1.489 1428 HG12 ILE 88 2HG1 ILE 88 1.041 -11.703 4.160 1429 HG13 ILE 88 1HG1 ILE 88 1.925 -12.356 2.786 1430 HG21 ILE 88 1HG2 ILE 88 -1.559 -11.430 3.934 1431 HG22 ILE 88 2HG2 ILE 88 -2.306 -11.965 2.427 1432 HG23 ILE 88 3HG2 ILE 88 -1.270 -10.544 2.436 1433 HD11 ILE 88 1HD1 ILE 88 2.207 -9.969 3.040 1434 HD12 ILE 88 2HD1 ILE 88 0.463 -9.727 2.821 1435 HD13 ILE 88 3HD1 ILE 88 1.439 -10.370 1.510 1436 H LYS 89 H LYS 89 -2.635 -13.809 4.301 1437 HA LYS 89 HA LYS 89 -4.032 -14.784 1.998 1438 HB2 LYS 89 2HB LYS 89 -3.444 -16.480 3.996 1439 HB3 LYS 89 1HB LYS 89 -4.817 -15.669 4.732 1440 HG2 LYS 89 2HG LYS 89 -4.719 -17.070 2.138 1441 HG3 LYS 89 1HG LYS 89 -5.474 -17.692 3.624 1442 HD2 LYS 89 2HD LYS 89 -7.107 -15.820 3.493 1443 HD3 LYS 89 1HD LYS 89 -6.338 -15.277 2.000 1444 HE2 LYS 89 2HE LYS 89 -6.887 -17.459 0.976 1445 HE3 LYS 89 1HE LYS 89 -7.737 -17.900 2.452 1446 HZ1 LYS 89 1HZ LYS 89 -8.446 -15.634 0.652 1447 HZ2 LYS 89 2HZ LYS 89 -9.267 -16.010 2.069 1448 HZ3 LYS 89 3HZ LYS 89 -9.255 -17.077 0.784 Start of MODEL 12 1 H1 MET 1 1HT MET 1 21.602 35.555 -2.569 2 H2 MET 1 2HT MET 1 23.077 36.367 -2.533 3 H3 MET 1 3HT MET 1 21.784 36.979 -3.452 4 HA MET 1 HA MET 1 21.835 36.706 -0.521 5 HB2 MET 1 2HB MET 1 23.300 38.530 -1.321 6 HB3 MET 1 1HB MET 1 21.985 39.176 -2.283 7 HG2 MET 1 2HG MET 1 20.720 39.638 -0.250 8 HG3 MET 1 1HG MET 1 22.041 38.989 0.719 9 HE1 MET 1 1HE MET 1 22.215 42.821 1.446 10 HE2 MET 1 2HE MET 1 22.076 41.206 2.137 11 HE3 MET 1 3HE MET 1 20.760 41.862 1.168 12 H GLY 2 H GLY 2 19.900 36.612 0.344 13 HA2 GLY 2 2HA GLY 2 17.642 37.957 -0.145 14 HA3 GLY 2 1HA GLY 2 17.599 36.692 -1.376 15 H PHE 3 H PHE 3 17.901 37.271 2.057 16 HA PHE 3 HA PHE 3 17.526 34.492 2.687 17 HB2 PHE 3 2HB PHE 3 19.087 35.930 3.971 18 HB3 PHE 3 1HB PHE 3 17.726 36.914 4.487 19 HD1 PHE 3 1HD PHE 3 16.281 36.175 6.259 20 HD2 PHE 3 2HD PHE 3 19.372 33.659 4.786 21 HE1 PHE 3 1HE PHE 3 15.999 34.686 8.204 22 HE2 PHE 3 2HE PHE 3 19.090 32.176 6.717 23 HZ PHE 3 HZ PHE 3 17.395 32.692 8.428 24 H THR 4 H THR 4 15.574 33.630 2.720 25 HA THR 4 HA THR 4 13.243 35.273 3.211 26 HB THR 4 HB THR 4 12.050 33.138 2.612 27 HG1 THR 4 1HG THR 4 13.746 31.734 3.129 28 HG21 THR 4 1HG2 THR 4 14.030 34.192 0.586 29 HG22 THR 4 2HG2 THR 4 12.454 34.894 0.951 30 HG23 THR 4 3HG2 THR 4 12.555 33.296 0.213 31 H ASP 5 H ASP 5 13.009 35.570 5.363 32 HA ASP 5 HA ASP 5 13.733 33.436 7.156 33 HB2 ASP 5 2HB ASP 5 14.287 35.745 7.791 34 HB3 ASP 5 1HB ASP 5 12.577 36.148 7.787 35 H GLU 6 H GLU 6 12.362 31.807 6.933 36 HA GLU 6 HA GLU 6 9.554 32.388 7.427 37 HB2 GLU 6 2HB GLU 6 9.105 30.124 6.480 38 HB3 GLU 6 1HB GLU 6 9.835 31.237 5.340 39 HG2 GLU 6 2HG GLU 6 12.010 30.151 5.725 40 HG3 GLU 6 1HG GLU 6 11.214 29.000 6.800 41 H THR 7 H THR 7 8.479 31.360 9.074 42 HA THR 7 HA THR 7 10.296 30.228 11.025 43 HB THR 7 HB THR 7 8.472 31.034 12.664 44 HG1 THR 7 1HG THR 7 7.974 33.030 10.806 45 HG21 THR 7 1HG2 THR 7 10.700 32.021 12.521 46 HG22 THR 7 2HG2 THR 7 9.487 33.278 12.742 47 HG23 THR 7 3HG2 THR 7 10.187 33.008 11.146 48 H VAL 8 H VAL 8 10.141 28.083 10.709 49 HA VAL 8 HA VAL 8 7.798 26.988 11.810 50 HB VAL 8 HB VAL 8 7.045 27.030 9.481 51 HG11 VAL 8 1HG1 VAL 8 8.048 25.675 7.750 52 HG12 VAL 8 2HG1 VAL 8 9.362 25.259 8.839 53 HG13 VAL 8 3HG1 VAL 8 9.163 26.940 8.299 54 HG21 VAL 8 1HG2 VAL 8 6.438 24.658 9.221 55 HG22 VAL 8 2HG2 VAL 8 6.237 25.225 10.879 56 HG23 VAL 8 3HG2 VAL 8 7.635 24.239 10.450 57 H ARG 9 H ARG 9 9.124 26.490 13.415 58 HA ARG 9 HA ARG 9 10.783 24.186 12.852 59 HB2 ARG 9 2HB ARG 9 10.698 25.958 15.298 60 HB3 ARG 9 1HB ARG 9 11.477 24.385 15.325 61 HG2 ARG 9 2HG ARG 9 13.171 26.043 15.009 62 HG3 ARG 9 1HG ARG 9 12.979 25.176 13.497 63 HD2 ARG 9 2HD ARG 9 13.229 27.504 13.007 64 HD3 ARG 9 1HD ARG 9 11.554 27.054 12.691 65 HE ARG 9 HE ARG 9 11.465 27.964 15.223 66 HH11 ARG 9 1HH1 ARG 9 12.725 29.347 12.235 67 HH12 ARG 9 2HH1 ARG 9 12.536 30.970 12.697 68 HH21 ARG 9 1HH2 ARG 9 11.178 30.201 15.901 69 HH22 ARG 9 2HH2 ARG 9 11.615 31.457 14.855 70 H PHE 10 H PHE 10 9.215 22.850 12.416 71 HA PHE 10 HA PHE 10 7.378 22.138 14.571 72 HB2 PHE 10 2HB PHE 10 6.269 23.161 12.603 73 HB3 PHE 10 1HB PHE 10 7.042 21.984 11.559 74 HD1 PHE 10 1HD PHE 10 4.463 22.527 14.076 75 HD2 PHE 10 2HD PHE 10 6.199 19.787 11.376 76 HE1 PHE 10 1HE PHE 10 2.505 21.049 14.353 77 HE2 PHE 10 2HE PHE 10 4.254 18.274 11.628 78 HZ PHE 10 HZ PHE 10 2.404 18.911 13.122 79 H ASP 11 H ASP 11 7.111 19.852 14.814 80 HA ASP 11 HA ASP 11 9.516 18.531 14.047 81 HB2 ASP 11 2HB ASP 11 8.891 16.731 15.593 82 HB3 ASP 11 1HB ASP 11 8.869 18.303 16.369 83 H PHE 12 H PHE 12 9.165 18.433 11.865 84 HA PHE 12 HA PHE 12 7.306 16.385 10.922 85 HB2 PHE 12 2HB PHE 12 9.493 17.864 9.395 86 HB3 PHE 12 1HB PHE 12 8.325 16.770 8.696 87 HD1 PHE 12 1HD PHE 12 5.907 17.446 8.646 88 HD2 PHE 12 2HD PHE 12 9.017 20.151 9.704 89 HE1 PHE 12 1HE PHE 12 4.419 19.346 8.150 90 HE2 PHE 12 2HE PHE 12 7.535 22.054 9.218 91 HZ PHE 12 HZ PHE 12 5.232 21.652 8.438 92 H ASP 13 H ASP 13 10.701 17.069 11.241 93 HA ASP 13 HA ASP 13 12.553 15.887 11.564 94 HB2 ASP 13 2HB ASP 13 11.389 14.793 13.417 95 HB3 ASP 13 1HB ASP 13 10.723 13.598 12.308 96 H ASP 14 H ASP 14 13.546 15.791 9.721 97 HA ASP 14 HA ASP 14 12.614 14.014 7.672 98 HB2 ASP 14 2HB ASP 14 13.471 16.137 6.905 99 HB3 ASP 14 1HB ASP 14 15.009 15.863 7.710 100 H ASN 15 H ASN 15 12.758 12.076 8.542 101 HA ASN 15 HA ASN 15 15.204 10.727 8.017 102 HB2 ASN 15 2HB ASN 15 15.613 11.368 10.369 103 HB3 ASN 15 1HB ASN 15 14.091 10.620 10.841 104 HD21 ASN 15 1HD2 ASN 15 17.332 10.045 9.703 105 HD22 ASN 15 2HD2 ASN 15 17.400 8.396 10.166 106 H ARG 16 H ARG 16 14.061 9.725 6.521 107 HA ARG 16 HA ARG 16 11.695 8.251 7.326 108 HB2 ARG 16 2HB ARG 16 12.736 9.173 4.668 109 HB3 ARG 16 1HB ARG 16 11.459 7.964 4.789 110 HG2 ARG 16 2HG ARG 16 9.957 9.452 5.762 111 HG3 ARG 16 1HG ARG 16 11.227 10.583 6.226 112 HD2 ARG 16 2HD ARG 16 10.562 9.976 3.361 113 HD3 ARG 16 1HD ARG 16 9.731 11.243 4.269 114 HE ARG 16 HE ARG 16 12.359 11.746 4.659 115 HH11 ARG 16 1HH1 ARG 16 10.457 11.315 1.661 116 HH12 ARG 16 2HH1 ARG 16 11.319 12.504 0.818 117 HH21 ARG 16 1HH2 ARG 16 13.468 13.430 3.494 118 HH22 ARG 16 2HH2 ARG 16 13.061 13.749 1.869 119 H LYS 17 H LYS 17 14.304 7.531 5.011 120 HA LYS 17 HA LYS 17 15.468 5.644 4.529 121 HB2 LYS 17 2HB LYS 17 14.936 4.962 7.423 122 HB3 LYS 17 1HB LYS 17 16.090 4.127 6.404 123 HG2 LYS 17 2HG LYS 17 17.367 6.243 6.196 124 HG3 LYS 17 1HG LYS 17 16.226 7.003 7.305 125 HD2 LYS 17 2HD LYS 17 17.963 4.605 7.945 126 HD3 LYS 17 1HD LYS 17 18.278 6.259 8.464 127 HE2 LYS 17 2HE LYS 17 16.196 6.256 9.753 128 HE3 LYS 17 1HE LYS 17 15.844 4.620 9.202 129 HZ1 LYS 17 1HZ LYS 17 18.192 5.394 10.853 130 HZ2 LYS 17 2HZ LYS 17 17.810 3.840 10.352 131 HZ3 LYS 17 3HZ LYS 17 16.818 4.645 11.435 132 H LYS 18 H LYS 18 15.336 3.068 4.889 133 HA LYS 18 HA LYS 18 12.665 2.351 4.078 134 HB2 LYS 18 2HB LYS 18 15.225 0.760 4.166 135 HB3 LYS 18 1HB LYS 18 13.678 0.084 3.665 136 HG2 LYS 18 2HG LYS 18 13.545 1.788 1.885 137 HG3 LYS 18 1HG LYS 18 15.145 2.358 2.354 138 HD2 LYS 18 2HD LYS 18 16.100 0.199 1.815 139 HD3 LYS 18 1HD LYS 18 14.496 -0.436 1.434 140 HE2 LYS 18 2HE LYS 18 14.282 1.207 -0.371 141 HE3 LYS 18 1HE LYS 18 15.884 1.829 0.004 142 HZ1 LYS 18 1HZ LYS 18 15.250 -0.917 -0.879 143 HZ2 LYS 18 2HZ LYS 18 16.803 -0.335 -0.536 144 HZ3 LYS 18 3HZ LYS 18 15.922 0.294 -1.846 145 H ALA 19 H ALA 19 13.273 3.144 6.768 146 HA ALA 19 HA ALA 19 12.946 1.011 8.589 147 HB1 ALA 19 1HB ALA 19 13.584 3.259 9.267 148 HB2 ALA 19 2HB ALA 19 12.090 2.731 10.090 149 HB3 ALA 19 3HB ALA 19 11.992 3.824 8.708 150 H ILE 20 H ILE 20 10.882 2.766 6.478 151 HA ILE 20 HA ILE 20 8.318 2.192 7.401 152 HB ILE 20 HB ILE 20 9.316 2.326 4.538 153 HG12 ILE 20 2HG1 ILE 20 8.128 4.494 6.291 154 HG13 ILE 20 1HG1 ILE 20 9.828 4.346 5.874 155 HG21 ILE 20 1HG2 ILE 20 6.512 2.605 5.621 156 HG22 ILE 20 2HG2 ILE 20 7.134 1.278 4.644 157 HG23 ILE 20 3HG2 ILE 20 6.999 2.893 3.946 158 HD11 ILE 20 1HD1 ILE 20 8.735 6.050 4.541 159 HD12 ILE 20 2HD1 ILE 20 7.566 4.865 3.954 160 HD13 ILE 20 3HD1 ILE 20 9.269 4.715 3.519 161 H SER 21 H SER 21 10.657 0.260 5.681 162 HA SER 21 HA SER 21 8.892 -1.862 4.930 163 HB2 SER 21 2HB SER 21 11.895 -1.930 5.274 164 HB3 SER 21 1HB SER 21 10.926 -3.050 4.312 165 HG SER 21 HG SER 21 10.336 -1.254 2.994 166 H GLU 22 H GLU 22 10.993 -1.164 7.637 167 HA GLU 22 HA GLU 22 10.765 -3.647 9.013 168 HB2 GLU 22 2HB GLU 22 11.337 -0.878 10.082 169 HB3 GLU 22 1HB GLU 22 11.625 -2.384 10.932 170 HG2 GLU 22 2HG GLU 22 12.971 -1.493 8.406 171 HG3 GLU 22 1HG GLU 22 13.668 -1.439 10.024 172 H THR 23 H THR 23 9.092 -0.615 8.978 173 HA THR 23 HA THR 23 7.457 -0.943 11.222 174 HB THR 23 HB THR 23 6.926 0.647 8.705 175 HG1 THR 23 1HG THR 23 8.933 0.982 10.108 176 HG21 THR 23 1HG2 THR 23 4.926 0.369 10.113 177 HG22 THR 23 2HG2 THR 23 5.512 2.031 10.147 178 HG23 THR 23 3HG2 THR 23 5.827 0.959 11.509 179 H LEU 24 H LEU 24 6.757 -1.487 7.744 180 HA LEU 24 HA LEU 24 4.157 -2.470 8.198 181 HB2 LEU 24 2HB LEU 24 5.975 -2.981 5.836 182 HB3 LEU 24 1HB LEU 24 4.248 -3.279 5.877 183 HG LEU 24 HG LEU 24 5.591 -0.585 6.046 184 HD11 LEU 24 1HD1 LEU 24 3.938 -1.852 3.884 185 HD12 LEU 24 2HD1 LEU 24 5.674 -1.532 3.833 186 HD13 LEU 24 3HD1 LEU 24 4.533 -0.192 3.891 187 HD21 LEU 24 1HD2 LEU 24 3.563 -0.589 7.397 188 HD22 LEU 24 2HD2 LEU 24 2.649 -1.287 6.056 189 HD23 LEU 24 3HD2 LEU 24 3.316 0.338 5.922 190 H GLU 25 H GLU 25 7.262 -4.044 8.019 191 HA GLU 25 HA GLU 25 6.559 -6.743 8.092 192 HB2 GLU 25 2HB GLU 25 8.855 -5.913 7.860 193 HB3 GLU 25 1HB GLU 25 8.796 -5.266 9.488 194 HG2 GLU 25 2HG GLU 25 8.549 -7.561 10.342 195 HG3 GLU 25 1HG GLU 25 8.743 -8.159 8.693 196 H THR 26 H THR 26 7.035 -4.420 10.668 197 HA THR 26 HA THR 26 6.493 -6.109 12.860 198 HB THR 26 HB THR 26 6.393 -3.100 12.625 199 HG1 THR 26 1HG THR 26 8.387 -3.920 12.048 200 HG21 THR 26 1HG2 THR 26 6.810 -3.105 15.049 201 HG22 THR 26 2HG2 THR 26 6.735 -4.866 15.057 202 HG23 THR 26 3HG2 THR 26 5.298 -3.929 14.657 203 H VAL 27 H VAL 27 4.522 -3.799 11.040 204 HA VAL 27 HA VAL 27 2.218 -3.974 12.633 205 HB VAL 27 HB VAL 27 2.438 -3.299 9.670 206 HG11 VAL 27 1HG1 VAL 27 0.146 -3.905 10.304 207 HG12 VAL 27 2HG1 VAL 27 0.296 -2.176 9.946 208 HG13 VAL 27 3HG1 VAL 27 0.232 -2.721 11.620 209 HG21 VAL 27 1HG2 VAL 27 2.306 -1.484 12.077 210 HG22 VAL 27 2HG2 VAL 27 2.349 -0.973 10.391 211 HG23 VAL 27 3HG2 VAL 27 3.741 -1.797 11.102 212 H TYR 28 H TYR 28 3.348 -5.883 9.898 213 HA TYR 28 HA TYR 28 1.008 -7.391 9.485 214 HB2 TYR 28 2HB TYR 28 3.030 -7.308 7.931 215 HB3 TYR 28 1HB TYR 28 3.853 -8.381 9.053 216 HD1 TYR 28 1HD TYR 28 2.735 -10.708 9.480 217 HD2 TYR 28 2HD TYR 28 1.692 -8.177 6.226 218 HE1 TYR 28 1HE TYR 28 1.729 -12.626 8.311 219 HE2 TYR 28 2HE TYR 28 0.684 -10.089 5.052 220 HH TYR 28 HH TYR 28 0.051 -13.024 6.619 221 H ARG 29 H ARG 29 3.856 -7.946 11.482 222 HA ARG 29 HA ARG 29 3.063 -10.469 12.483 223 HB2 ARG 29 2HB ARG 29 5.004 -8.496 13.690 224 HB3 ARG 29 1HB ARG 29 4.836 -10.180 14.169 225 HG2 ARG 29 2HG ARG 29 5.759 -9.152 11.491 226 HG3 ARG 29 1HG ARG 29 6.753 -9.927 12.726 227 HD2 ARG 29 2HD ARG 29 5.420 -11.987 12.468 228 HD3 ARG 29 1HD ARG 29 4.463 -11.197 11.225 229 HE ARG 29 HE ARG 29 7.290 -11.237 10.734 230 HH11 ARG 29 1HH1 ARG 29 4.172 -12.859 10.181 231 HH12 ARG 29 2HH1 ARG 29 4.762 -13.804 8.893 232 HH21 ARG 29 1HH2 ARG 29 8.069 -12.563 8.944 233 HH22 ARG 29 2HH2 ARG 29 6.996 -13.645 8.189 234 H ALA 30 H ALA 30 2.388 -7.244 13.554 235 HA ALA 30 HA ALA 30 1.299 -8.014 16.069 236 HB1 ALA 30 1HB ALA 30 2.049 -5.714 15.627 237 HB2 ALA 30 2HB ALA 30 0.363 -5.756 16.147 238 HB3 ALA 30 3HB ALA 30 0.754 -5.527 14.443 239 H LEU 31 H LEU 31 -0.071 -7.421 12.879 240 HA LEU 31 HA LEU 31 -2.769 -7.706 13.693 241 HB2 LEU 31 2HB LEU 31 -1.506 -7.733 10.976 242 HB3 LEU 31 1HB LEU 31 -3.242 -7.784 11.234 243 HG LEU 31 HG LEU 31 -1.481 -5.605 12.274 244 HD11 LEU 31 1HD1 LEU 31 -3.244 -5.581 9.833 245 HD12 LEU 31 2HD1 LEU 31 -1.467 -5.592 9.804 246 HD13 LEU 31 3HD1 LEU 31 -2.338 -4.210 10.458 247 HD21 LEU 31 1HD2 LEU 31 -3.600 -4.385 12.455 248 HD22 LEU 31 2HD2 LEU 31 -3.524 -5.809 13.493 249 HD23 LEU 31 3HD2 LEU 31 -4.447 -5.851 11.986 250 H GLU 32 H GLU 32 -0.447 -10.024 12.446 251 HA GLU 32 HA GLU 32 -2.403 -12.025 12.016 252 HB2 GLU 32 2HB GLU 32 -0.501 -13.642 12.027 253 HB3 GLU 32 1HB GLU 32 -0.308 -12.306 10.898 254 HG2 GLU 32 2HG GLU 32 1.216 -11.229 12.412 255 HG3 GLU 32 1HG GLU 32 0.969 -12.496 13.610 256 H GLU 33 H GLU 33 -0.522 -11.155 14.821 257 HA GLU 33 HA GLU 33 -1.497 -13.318 16.435 258 HB2 GLU 33 2HB GLU 33 -0.177 -10.711 17.170 259 HB3 GLU 33 1HB GLU 33 -0.647 -11.917 18.355 260 HG2 GLU 33 2HG GLU 33 1.316 -12.349 16.111 261 HG3 GLU 33 1HG GLU 33 1.725 -12.035 17.799 262 H LYS 34 H LYS 34 -2.556 -10.123 15.668 263 HA LYS 34 HA LYS 34 -4.574 -10.119 17.708 264 HB2 LYS 34 2HB LYS 34 -3.843 -8.144 15.602 265 HB3 LYS 34 1HB LYS 34 -5.323 -7.959 16.521 266 HG2 LYS 34 2HG LYS 34 -2.522 -8.068 17.643 267 HG3 LYS 34 1HG LYS 34 -3.512 -6.618 17.459 268 HD2 LYS 34 2HD LYS 34 -4.162 -8.995 19.233 269 HD3 LYS 34 1HD LYS 34 -3.566 -7.430 19.762 270 HE2 LYS 34 2HE LYS 34 -5.570 -6.341 19.019 271 HE3 LYS 34 1HE LYS 34 -6.177 -7.829 18.291 272 HZ1 LYS 34 1HZ LYS 34 -6.261 -8.811 20.506 273 HZ2 LYS 34 2HZ LYS 34 -7.217 -7.437 20.421 274 HZ3 LYS 34 3HZ LYS 34 -5.719 -7.406 21.202 275 H GLY 35 H GLY 35 -4.465 -11.676 14.888 276 HA2 GLY 35 2HA GLY 35 -6.111 -12.925 13.882 277 HA3 GLY 35 1HA GLY 35 -7.242 -12.284 15.064 278 H TYR 36 H TYR 36 -5.301 -10.412 12.806 279 HA TYR 36 HA TYR 36 -7.795 -9.682 11.425 280 HB2 TYR 36 2HB TYR 36 -5.331 -7.976 11.864 281 HB3 TYR 36 1HB TYR 36 -6.695 -7.519 10.865 282 HD1 TYR 36 1HD TYR 36 -5.213 -7.216 14.002 283 HD2 TYR 36 2HD TYR 36 -9.017 -7.524 12.143 284 HE1 TYR 36 1HE TYR 36 -6.256 -6.172 15.973 285 HE2 TYR 36 2HE TYR 36 -10.068 -6.479 14.105 286 HH TYR 36 HH TYR 36 -9.608 -6.165 16.459 287 H ASN 37 H ASN 37 -7.135 -8.705 9.234 288 HA ASN 37 HA ASN 37 -5.183 -10.488 8.020 289 HB2 ASN 37 2HB ASN 37 -7.436 -8.891 6.756 290 HB3 ASN 37 1HB ASN 37 -6.263 -9.853 5.865 291 HD21 ASN 37 1HD2 ASN 37 -9.026 -9.941 7.951 292 HD22 ASN 37 2HD2 ASN 37 -9.373 -11.616 7.739 293 HA PRO 38 HA PRO 38 -2.525 -6.981 8.826 294 HB2 PRO 38 2HB PRO 38 -1.049 -8.570 6.807 295 HB3 PRO 38 1HB PRO 38 -0.453 -7.744 8.248 296 HG2 PRO 38 2HG PRO 38 -0.916 -10.360 8.260 297 HG3 PRO 38 1HG PRO 38 -1.282 -9.367 9.679 298 HD2 PRO 38 2HD PRO 38 -3.125 -10.673 7.789 299 HD3 PRO 38 1HD PRO 38 -3.369 -10.077 9.459 300 H ILE 39 H ILE 39 -3.131 -8.057 5.487 301 HA ILE 39 HA ILE 39 -1.907 -5.694 4.432 302 HB ILE 39 HB ILE 39 -3.748 -7.527 2.864 303 HG12 ILE 39 2HG1 ILE 39 -1.942 -8.786 4.129 304 HG13 ILE 39 1HG1 ILE 39 -1.897 -8.976 2.391 305 HG21 ILE 39 1HG2 ILE 39 -2.386 -6.796 0.994 306 HG22 ILE 39 2HG2 ILE 39 -1.417 -5.829 2.102 307 HG23 ILE 39 3HG2 ILE 39 -3.114 -5.417 1.835 308 HD11 ILE 39 1HD1 ILE 39 -0.089 -7.387 2.267 309 HD12 ILE 39 2HD1 ILE 39 0.311 -8.714 3.360 310 HD13 ILE 39 3HD1 ILE 39 -0.145 -7.129 4.017 311 H ASN 40 H ASN 40 -5.220 -6.832 4.899 312 HA ASN 40 HA ASN 40 -6.620 -4.751 3.661 313 HB2 ASN 40 2HB ASN 40 -7.461 -6.351 6.094 314 HB3 ASN 40 1HB ASN 40 -8.523 -5.287 5.200 315 HD21 ASN 40 1HD2 ASN 40 -7.301 -6.237 2.565 316 HD22 ASN 40 2HD2 ASN 40 -8.003 -7.772 2.366 317 H GLN 41 H GLN 41 -5.345 -4.993 6.913 318 HA GLN 41 HA GLN 41 -6.533 -2.547 7.775 319 HB2 GLN 41 2HB GLN 41 -4.220 -4.048 9.000 320 HB3 GLN 41 1HB GLN 41 -5.153 -2.785 9.784 321 HG2 GLN 41 2HG GLN 41 -6.217 -5.470 8.906 322 HG3 GLN 41 1HG GLN 41 -5.810 -5.016 10.556 323 HE21 GLN 41 1HE2 GLN 41 -6.957 -2.323 10.319 324 HE22 GLN 41 2HE2 GLN 41 -8.665 -2.535 10.302 325 H ILE 42 H ILE 42 -3.387 -3.431 6.428 326 HA ILE 42 HA ILE 42 -2.183 -0.905 6.883 327 HB ILE 42 HB ILE 42 -1.434 -3.072 4.887 328 HG12 ILE 42 2HG1 ILE 42 -0.216 -2.309 7.556 329 HG13 ILE 42 1HG1 ILE 42 -1.248 -3.703 7.272 330 HG21 ILE 42 1HG2 ILE 42 0.140 -0.616 5.691 331 HG22 ILE 42 2HG2 ILE 42 -0.592 -0.908 4.112 332 HG23 ILE 42 3HG2 ILE 42 0.737 -1.925 4.673 333 HD11 ILE 42 1HD1 ILE 42 0.448 -4.642 5.777 334 HD12 ILE 42 2HD1 ILE 42 1.096 -4.337 7.388 335 HD13 ILE 42 3HD1 ILE 42 1.469 -3.232 6.061 336 H VAL 43 H VAL 43 -3.696 -2.296 3.948 337 HA VAL 43 HA VAL 43 -3.454 0.053 2.422 338 HB VAL 43 HB VAL 43 -4.022 -1.979 1.196 339 HG11 VAL 43 1HG1 VAL 43 -5.247 -3.160 2.931 340 HG12 VAL 43 2HG1 VAL 43 -6.178 -3.118 1.434 341 HG13 VAL 43 3HG1 VAL 43 -6.597 -2.038 2.764 342 HG21 VAL 43 1HG2 VAL 43 -6.411 -0.148 1.141 343 HG22 VAL 43 2HG2 VAL 43 -5.949 -1.283 -0.124 344 HG23 VAL 43 3HG2 VAL 43 -4.911 0.107 0.259 345 H GLY 44 H GLY 44 -5.822 -0.935 4.742 346 HA2 GLY 44 2HA GLY 44 -7.725 1.104 4.370 347 HA3 GLY 44 1HA GLY 44 -7.433 0.253 5.887 348 H TYR 45 H TYR 45 -4.950 0.945 6.567 349 HA TYR 45 HA TYR 45 -5.225 3.526 7.596 350 HB2 TYR 45 2HB TYR 45 -3.758 2.025 8.755 351 HB3 TYR 45 1HB TYR 45 -2.770 1.786 7.319 352 HD1 TYR 45 1HD TYR 45 -0.973 3.231 6.821 353 HD2 TYR 45 2HD TYR 45 -3.728 4.321 9.868 354 HE1 TYR 45 1HE TYR 45 0.477 5.097 7.452 355 HE2 TYR 45 2HE TYR 45 -2.285 6.183 10.513 356 HH TYR 45 HH TYR 45 0.181 6.783 10.314 357 H LEU 46 H LEU 46 -3.488 2.366 4.781 358 HA LEU 46 HA LEU 46 -2.218 4.827 4.327 359 HB2 LEU 46 2HB LEU 46 -2.669 2.507 2.481 360 HB3 LEU 46 1HB LEU 46 -1.616 3.871 2.134 361 HG LEU 46 HG LEU 46 -1.249 1.973 4.461 362 HD11 LEU 46 1HD1 LEU 46 0.670 1.119 3.242 363 HD12 LEU 46 2HD1 LEU 46 0.244 2.132 1.857 364 HD13 LEU 46 3HD1 LEU 46 -0.842 0.842 2.377 365 HD21 LEU 46 1HD2 LEU 46 -0.370 4.183 4.925 366 HD22 LEU 46 2HD2 LEU 46 0.516 4.173 3.398 367 HD23 LEU 46 3HD2 LEU 46 0.942 3.038 4.677 368 H LEU 47 H LEU 47 -4.959 3.360 2.479 369 HA LEU 47 HA LEU 47 -5.486 5.655 0.984 370 HB2 LEU 47 2HB LEU 47 -7.340 3.458 1.853 371 HB3 LEU 47 1HB LEU 47 -7.811 4.729 0.752 372 HG LEU 47 HG LEU 47 -5.635 2.697 0.252 373 HD11 LEU 47 1HD1 LEU 47 -7.187 1.824 -1.420 374 HD12 LEU 47 2HD1 LEU 47 -8.417 2.973 -0.887 375 HD13 LEU 47 3HD1 LEU 47 -7.854 1.706 0.207 376 HD21 LEU 47 1HD2 LEU 47 -5.658 3.607 -2.029 377 HD22 LEU 47 2HD2 LEU 47 -5.144 4.800 -0.851 378 HD23 LEU 47 3HD2 LEU 47 -6.784 4.866 -1.515 379 H SER 48 H SER 48 -6.641 4.865 4.241 380 HA SER 48 HA SER 48 -8.420 7.147 4.096 381 HB2 SER 48 2HB SER 48 -8.020 5.128 6.273 382 HB3 SER 48 1HB SER 48 -9.258 6.393 6.270 383 HG SER 48 HG SER 48 -10.013 5.448 4.276 384 H GLY 49 H GLY 49 -5.255 6.432 5.485 385 HA2 GLY 49 2HA GLY 49 -3.826 7.781 6.515 386 HA3 GLY 49 1HA GLY 49 -4.886 9.132 6.142 387 H ASP 50 H ASP 50 -5.760 6.293 8.068 388 HA ASP 50 HA ASP 50 -5.916 8.077 10.391 389 HB2 ASP 50 2HB ASP 50 -8.146 7.738 9.409 390 HB3 ASP 50 1HB ASP 50 -7.982 6.006 9.659 391 HA PRO 51 HA PRO 51 -3.287 4.967 12.204 392 HB2 PRO 51 2HB PRO 51 -4.253 6.103 14.761 393 HB3 PRO 51 1HB PRO 51 -2.600 5.906 14.164 394 HG2 PRO 51 2HG PRO 51 -3.734 8.311 14.214 395 HG3 PRO 51 1HG PRO 51 -2.709 7.823 12.854 396 HD2 PRO 51 2HD PRO 51 -5.690 7.946 13.030 397 HD3 PRO 51 1HD PRO 51 -4.596 8.431 11.709 398 H ALA 52 H ALA 52 -6.692 5.190 13.099 399 HA ALA 52 HA ALA 52 -6.692 3.160 15.065 400 HB1 ALA 52 1HB ALA 52 -9.018 4.078 13.416 401 HB2 ALA 52 2HB ALA 52 -8.455 4.817 14.921 402 HB3 ALA 52 3HB ALA 52 -9.080 3.168 14.922 403 H TYR 53 H TYR 53 -6.426 2.836 11.739 404 HA TYR 53 HA TYR 53 -7.723 0.362 11.388 405 HB2 TYR 53 2HB TYR 53 -5.500 1.692 9.909 406 HB3 TYR 53 1HB TYR 53 -6.073 0.084 9.458 407 HD1 TYR 53 1HD TYR 53 -8.389 -0.236 8.816 408 HD2 TYR 53 2HD TYR 53 -6.753 3.623 9.377 409 HE1 TYR 53 1HE TYR 53 -10.227 0.682 7.591 410 HE2 TYR 53 2HE TYR 53 -8.611 4.601 8.133 411 HH TYR 53 HH TYR 53 -10.198 3.879 6.417 412 H ILE 54 H ILE 54 -4.754 1.249 12.892 413 HA ILE 54 HA ILE 54 -3.855 -1.539 12.931 414 HB ILE 54 HB ILE 54 -2.250 0.980 13.496 415 HG12 ILE 54 2HG1 ILE 54 -2.841 0.957 11.138 416 HG13 ILE 54 1HG1 ILE 54 -1.144 0.535 11.317 417 HG21 ILE 54 1HG2 ILE 54 -0.280 -0.478 13.354 418 HG22 ILE 54 2HG2 ILE 54 -1.333 -1.873 13.138 419 HG23 ILE 54 3HG2 ILE 54 -1.366 -0.972 14.656 420 HD11 ILE 54 1HD1 ILE 54 -3.400 -1.392 10.800 421 HD12 ILE 54 2HD1 ILE 54 -1.705 -1.824 10.991 422 HD13 ILE 54 3HD1 ILE 54 -2.211 -0.831 9.623 423 HA PRO 55 HA PRO 55 -5.228 -1.463 17.189 424 HB2 PRO 55 2HB PRO 55 -3.924 -3.720 18.015 425 HB3 PRO 55 1HB PRO 55 -5.421 -3.755 17.074 426 HG2 PRO 55 2HG PRO 55 -2.592 -4.059 16.163 427 HG3 PRO 55 1HG PRO 55 -4.026 -4.985 15.685 428 HD2 PRO 55 2HD PRO 55 -3.021 -3.050 14.140 429 HD3 PRO 55 1HD PRO 55 -4.769 -3.337 14.249 430 H ARG 56 H ARG 56 -4.493 -0.692 19.076 431 HA ARG 56 HA ARG 56 -1.802 0.339 19.210 432 HB2 ARG 56 2HB ARG 56 -2.533 1.426 21.281 433 HB3 ARG 56 1HB ARG 56 -3.701 1.684 19.995 434 HG2 ARG 56 2HG ARG 56 -5.081 -0.149 20.962 435 HG3 ARG 56 1HG ARG 56 -3.928 -0.252 22.286 436 HD2 ARG 56 2HD ARG 56 -4.388 2.084 22.871 437 HD3 ARG 56 1HD ARG 56 -5.563 2.180 21.558 438 HE ARG 56 HE ARG 56 -6.097 0.020 23.316 439 HH11 ARG 56 1HH1 ARG 56 -6.551 3.526 23.028 440 HH12 ARG 56 2HH1 ARG 56 -7.904 3.545 24.062 441 HH21 ARG 56 1HH2 ARG 56 -7.905 0.079 24.692 442 HH22 ARG 56 2HH2 ARG 56 -8.707 1.547 25.048 443 H TYR 57 H TYR 57 -2.946 -2.588 19.738 444 HA TYR 57 HA TYR 57 -2.095 -3.608 22.131 445 HB2 TYR 57 2HB TYR 57 -3.339 -4.952 20.611 446 HB3 TYR 57 1HB TYR 57 -2.094 -4.822 19.378 447 HD1 TYR 57 1HD TYR 57 -2.682 -6.168 22.805 448 HD2 TYR 57 2HD TYR 57 -0.515 -6.509 19.166 449 HE1 TYR 57 1HE TYR 57 -1.692 -8.278 23.594 450 HE2 TYR 57 2HE TYR 57 0.481 -8.612 19.942 451 HH TYR 57 HH TYR 57 0.937 -9.738 21.988 452 H GLN 58 H GLN 58 -0.059 -2.771 19.366 453 HA GLN 58 HA GLN 58 2.249 -3.474 21.038 454 HB2 GLN 58 2HB GLN 58 1.649 -5.003 18.897 455 HB3 GLN 58 1HB GLN 58 2.468 -3.680 18.071 456 HG2 GLN 58 2HG GLN 58 4.441 -4.050 19.565 457 HG3 GLN 58 1HG GLN 58 3.609 -5.465 20.196 458 HE21 GLN 58 1HE2 GLN 58 5.322 -4.083 17.600 459 HE22 GLN 58 2HE2 GLN 58 5.488 -5.541 16.671 460 H ASP 59 H ASP 59 4.252 -2.409 19.726 461 HA ASP 59 HA ASP 59 3.849 0.402 19.802 462 HB2 ASP 59 2HB ASP 59 6.226 0.552 19.349 463 HB3 ASP 59 1HB ASP 59 5.942 -0.708 20.540 464 H ALA 60 H ALA 60 3.452 -1.904 17.457 465 HA ALA 60 HA ALA 60 4.286 -0.819 15.050 466 HB1 ALA 60 1HB ALA 60 3.392 -3.093 15.331 467 HB2 ALA 60 2HB ALA 60 2.654 -2.241 13.973 468 HB3 ALA 60 3HB ALA 60 1.773 -2.415 15.488 469 H ARG 61 H ARG 61 1.325 -0.073 16.834 470 HA ARG 61 HA ARG 61 0.037 1.416 14.809 471 HB2 ARG 61 2HB ARG 61 -1.015 0.456 16.903 472 HB3 ARG 61 1HB ARG 61 -0.234 1.722 17.816 473 HG2 ARG 61 2HG ARG 61 -2.322 2.183 15.667 474 HG3 ARG 61 1HG ARG 61 -2.662 2.097 17.386 475 HD2 ARG 61 2HD ARG 61 -0.935 4.148 15.997 476 HD3 ARG 61 1HD ARG 61 -2.573 4.406 16.589 477 HE ARG 61 HE ARG 61 -0.849 3.504 18.649 478 HH11 ARG 61 1HH1 ARG 61 -1.713 6.404 16.804 479 HH12 ARG 61 2HH1 ARG 61 -1.204 7.484 18.014 480 HH21 ARG 61 1HH2 ARG 61 -0.203 4.999 20.313 481 HH22 ARG 61 2HH2 ARG 61 -0.328 6.673 20.066 482 H ASN 62 H ASN 62 2.298 2.245 17.346 483 HA ASN 62 HA ASN 62 2.238 5.070 16.904 484 HB2 ASN 62 2HB ASN 62 2.868 4.042 19.087 485 HB3 ASN 62 1HB ASN 62 4.274 3.319 18.334 486 HD21 ASN 62 1HD2 ASN 62 4.027 5.112 20.608 487 HD22 ASN 62 2HD2 ASN 62 5.014 6.482 20.276 488 H LEU 63 H LEU 63 4.344 2.412 15.941 489 HA LEU 63 HA LEU 63 6.374 3.827 14.637 490 HB2 LEU 63 2HB LEU 63 5.256 1.108 13.981 491 HB3 LEU 63 1HB LEU 63 6.755 1.753 13.351 492 HG LEU 63 HG LEU 63 6.201 1.170 16.258 493 HD11 LEU 63 1HD1 LEU 63 7.853 -0.330 14.223 494 HD12 LEU 63 2HD1 LEU 63 6.332 -0.865 14.947 495 HD13 LEU 63 3HD1 LEU 63 7.761 -0.677 15.951 496 HD21 LEU 63 1HD2 LEU 63 8.726 2.010 14.834 497 HD22 LEU 63 2HD2 LEU 63 8.609 1.534 16.523 498 HD23 LEU 63 3HD2 LEU 63 7.796 2.996 15.967 499 H ILE 64 H ILE 64 3.371 2.472 13.275 500 HA ILE 64 HA ILE 64 3.932 3.268 10.609 501 HB ILE 64 HB ILE 64 2.272 1.459 11.399 502 HG12 ILE 64 2HG1 ILE 64 1.249 3.473 9.374 503 HG13 ILE 64 1HG1 ILE 64 2.501 2.281 9.041 504 HG21 ILE 64 1HG2 ILE 64 0.497 3.918 11.776 505 HG22 ILE 64 2HG2 ILE 64 1.007 2.837 13.029 506 HG23 ILE 64 3HG2 ILE 64 -0.092 2.258 11.773 507 HD11 ILE 64 1HD1 ILE 64 0.878 0.485 9.480 508 HD12 ILE 64 2HD1 ILE 64 0.371 1.555 8.176 509 HD13 ILE 64 3HD1 ILE 64 -0.363 1.708 9.772 510 H ARG 65 H ARG 65 2.646 4.843 13.330 511 HA ARG 65 HA ARG 65 1.028 6.752 11.975 512 HB2 ARG 65 2HB ARG 65 0.888 5.726 14.377 513 HB3 ARG 65 1HB ARG 65 2.027 6.991 14.785 514 HG2 ARG 65 2HG ARG 65 -0.684 7.420 13.588 515 HG3 ARG 65 1HG ARG 65 -0.310 7.519 15.296 516 HD2 ARG 65 2HD ARG 65 0.887 9.229 13.133 517 HD3 ARG 65 1HD ARG 65 -0.460 9.654 14.200 518 HE ARG 65 HE ARG 65 1.596 8.902 15.846 519 HH11 ARG 65 1HH1 ARG 65 1.156 11.520 13.467 520 HH12 ARG 65 2HH1 ARG 65 2.298 12.546 14.179 521 HH21 ARG 65 1HH2 ARG 65 3.183 10.351 16.809 522 HH22 ARG 65 2HH2 ARG 65 3.470 11.879 16.100 523 H ARG 66 H ARG 66 4.294 6.517 13.120 524 HA ARG 66 HA ARG 66 4.862 9.324 12.929 525 HB2 ARG 66 2HB ARG 66 6.684 6.945 13.239 526 HB3 ARG 66 1HB ARG 66 7.218 8.618 13.280 527 HG2 ARG 66 2HG ARG 66 5.851 9.024 15.244 528 HG3 ARG 66 1HG ARG 66 5.256 7.362 15.182 529 HD2 ARG 66 2HD ARG 66 7.027 7.605 16.836 530 HD3 ARG 66 1HD ARG 66 7.512 6.533 15.521 531 HE ARG 66 HE ARG 66 8.340 9.189 15.006 532 HH11 ARG 66 1HH1 ARG 66 9.162 6.401 17.002 533 HH12 ARG 66 2HH1 ARG 66 10.809 6.789 17.152 534 HH21 ARG 66 1HH2 ARG 66 10.573 9.742 15.170 535 HH22 ARG 66 2HH2 ARG 66 11.653 8.759 16.062 536 H HIS 67 H HIS 67 4.276 7.145 10.580 537 HA HIS 67 HA HIS 67 6.198 8.398 8.752 538 HB2 HIS 67 2HB HIS 67 4.803 5.740 8.468 539 HB3 HIS 67 1HB HIS 67 5.780 6.493 7.216 540 HD1 HIS 67 1HD HIS 67 8.386 6.903 8.044 541 HD2 HIS 67 2HD HIS 67 6.124 4.076 10.058 542 HE1 HIS 67 1HE HIS 67 10.043 5.379 9.158 543 HE2 HIS 67 2HE HIS 67 8.588 3.981 10.670 544 H GLU 68 H GLU 68 5.481 9.090 6.810 545 HA GLU 68 HA GLU 68 2.705 9.854 6.733 546 HB2 GLU 68 2HB GLU 68 3.437 11.270 4.799 547 HB3 GLU 68 1HB GLU 68 4.270 11.637 6.296 548 HG2 GLU 68 2HG GLU 68 5.422 9.933 4.092 549 HG3 GLU 68 1HG GLU 68 5.702 11.665 4.237 550 H ARG 69 H ARG 69 1.261 9.146 5.209 551 HA ARG 69 HA ARG 69 1.724 6.516 4.303 552 HB2 ARG 69 2HB ARG 69 -0.623 8.328 3.555 553 HB3 ARG 69 1HB ARG 69 -0.481 6.639 3.172 554 HG2 ARG 69 2HG ARG 69 -1.953 6.703 4.950 555 HG3 ARG 69 1HG ARG 69 -0.434 6.273 5.721 556 HD2 ARG 69 2HD ARG 69 -1.476 9.097 5.593 557 HD3 ARG 69 1HD ARG 69 -1.949 7.988 6.865 558 HE ARG 69 HE ARG 69 0.734 7.999 7.032 559 HH11 ARG 69 1HH1 ARG 69 -1.629 10.662 6.782 560 HH12 ARG 69 2HH1 ARG 69 -0.810 11.668 7.879 561 HH21 ARG 69 1HH2 ARG 69 1.842 9.405 8.546 562 HH22 ARG 69 2HH2 ARG 69 1.202 10.953 8.893 563 H ASP 70 H ASP 70 1.836 9.594 2.708 564 HA ASP 70 HA ASP 70 1.841 8.735 0.027 565 HB2 ASP 70 2HB ASP 70 1.528 11.086 0.693 566 HB3 ASP 70 1HB ASP 70 3.206 11.150 1.214 567 H GLU 71 H GLU 71 4.489 9.088 2.318 568 HA GLU 71 HA GLU 71 6.556 8.558 0.421 569 HB2 GLU 71 2HB GLU 71 6.853 9.760 2.596 570 HB3 GLU 71 1HB GLU 71 6.594 8.234 3.424 571 HG2 GLU 71 2HG GLU 71 8.930 8.729 3.350 572 HG3 GLU 71 1HG GLU 71 8.601 7.344 2.317 573 H ILE 72 H ILE 72 4.719 6.674 2.759 574 HA ILE 72 HA ILE 72 6.057 4.231 2.571 575 HB ILE 72 HB ILE 72 3.101 4.704 3.068 576 HG12 ILE 72 2HG1 ILE 72 5.401 4.346 5.012 577 HG13 ILE 72 1HG1 ILE 72 4.552 5.847 4.686 578 HG21 ILE 72 1HG2 ILE 72 3.495 2.391 2.416 579 HG22 ILE 72 2HG2 ILE 72 3.096 2.484 4.134 580 HG23 ILE 72 3HG2 ILE 72 4.769 2.247 3.626 581 HD11 ILE 72 1HD1 ILE 72 3.358 3.378 5.935 582 HD12 ILE 72 2HD1 ILE 72 2.498 4.880 5.608 583 HD13 ILE 72 3HD1 ILE 72 3.817 4.858 6.779 584 H MET 73 H MET 73 3.377 5.496 0.636 585 HA MET 73 HA MET 73 3.062 3.102 -0.818 586 HB2 MET 73 2HB MET 73 2.128 5.838 -1.420 587 HB3 MET 73 1HB MET 73 1.841 4.500 -2.529 588 HG2 MET 73 2HG MET 73 0.715 3.400 -0.468 589 HG3 MET 73 1HG MET 73 0.733 5.047 0.183 590 HE1 MET 73 1HE MET 73 0.321 4.057 -3.663 591 HE2 MET 73 2HE MET 73 -1.429 3.814 -3.682 592 HE3 MET 73 3HE MET 73 -0.409 2.755 -2.736 593 H GLU 74 H GLU 74 5.251 5.769 -1.391 594 HA GLU 74 HA GLU 74 5.480 4.951 -4.088 595 HB2 GLU 74 2HB GLU 74 7.288 6.566 -4.391 596 HB3 GLU 74 1HB GLU 74 5.986 7.302 -3.493 597 HG2 GLU 74 2HG GLU 74 7.996 8.100 -2.557 598 HG3 GLU 74 1HG GLU 74 7.393 6.902 -1.411 599 H GLU 75 H GLU 75 7.166 4.098 -1.180 600 HA GLU 75 HA GLU 75 9.097 2.541 -2.565 601 HB2 GLU 75 2HB GLU 75 9.374 3.393 -0.207 602 HB3 GLU 75 1HB GLU 75 8.210 2.173 0.293 603 HG2 GLU 75 2HG GLU 75 10.550 1.476 0.679 604 HG3 GLU 75 1HG GLU 75 9.688 0.398 -0.414 605 H LEU 76 H LEU 76 5.938 1.884 -1.173 606 HA LEU 76 HA LEU 76 5.787 -0.881 -1.560 607 HB2 LEU 76 2HB LEU 76 3.605 1.159 -2.036 608 HB3 LEU 76 1HB LEU 76 3.347 -0.563 -1.938 609 HG LEU 76 HG LEU 76 4.279 1.203 0.334 610 HD11 LEU 76 1HD1 LEU 76 2.055 0.796 1.235 611 HD12 LEU 76 2HD1 LEU 76 1.641 -0.157 -0.183 612 HD13 LEU 76 3HD1 LEU 76 1.923 1.572 -0.346 613 HD21 LEU 76 1HD2 LEU 76 3.466 -1.688 0.275 614 HD22 LEU 76 2HD2 LEU 76 3.863 -0.756 1.711 615 HD23 LEU 76 3HD2 LEU 76 5.120 -1.100 0.516 616 H THR 77 H THR 77 5.039 1.761 -3.776 617 HA THR 77 HA THR 77 4.331 0.107 -5.930 618 HB THR 77 HB THR 77 5.269 2.989 -6.042 619 HG1 THR 77 1HG THR 77 3.581 2.919 -4.595 620 HG21 THR 77 1HG2 THR 77 5.037 1.861 -8.235 621 HG22 THR 77 2HG2 THR 77 3.805 3.106 -8.010 622 HG23 THR 77 3HG2 THR 77 3.387 1.406 -7.807 623 H LYS 78 H LYS 78 7.432 1.658 -5.007 624 HA LYS 78 HA LYS 78 8.704 0.953 -7.443 625 HB2 LYS 78 2HB LYS 78 10.036 1.584 -4.817 626 HB3 LYS 78 1HB LYS 78 10.874 1.391 -6.342 627 HG2 LYS 78 2HG LYS 78 9.438 3.301 -7.174 628 HG3 LYS 78 1HG LYS 78 9.014 3.586 -5.490 629 HD2 LYS 78 2HD LYS 78 11.760 3.692 -6.752 630 HD3 LYS 78 1HD LYS 78 10.864 5.022 -6.031 631 HE2 LYS 78 2HE LYS 78 11.939 2.615 -4.556 632 HE3 LYS 78 1HE LYS 78 12.699 4.197 -4.580 633 HZ1 LYS 78 1HZ LYS 78 11.382 3.756 -2.564 634 HZ2 LYS 78 2HZ LYS 78 9.983 3.656 -3.494 635 HZ3 LYS 78 3HZ LYS 78 10.786 5.099 -3.379 636 H TYR 79 H TYR 79 8.910 -0.520 -4.236 637 HA TYR 79 HA TYR 79 10.759 -2.485 -5.023 638 HB2 TYR 79 2HB TYR 79 10.248 -1.754 -2.670 639 HB3 TYR 79 1HB TYR 79 8.764 -2.687 -2.770 640 HD1 TYR 79 1HD TYR 79 12.365 -3.187 -3.474 641 HD2 TYR 79 2HD TYR 79 8.843 -4.757 -1.713 642 HE1 TYR 79 1HE TYR 79 13.656 -5.137 -2.666 643 HE2 TYR 79 2HE TYR 79 10.108 -6.720 -0.900 644 HH TYR 79 HH TYR 79 12.183 -7.953 -1.414 645 H TYR 80 H TYR 80 7.300 -2.366 -5.131 646 HA TYR 80 HA TYR 80 6.678 -5.024 -5.728 647 HB2 TYR 80 2HB TYR 80 5.049 -3.265 -5.150 648 HB3 TYR 80 1HB TYR 80 5.402 -2.449 -6.658 649 HD1 TYR 80 1HD TYR 80 3.695 -5.227 -5.072 650 HD2 TYR 80 2HD TYR 80 4.507 -3.311 -8.760 651 HE1 TYR 80 1HE TYR 80 1.860 -6.475 -6.111 652 HE2 TYR 80 2HE TYR 80 2.665 -4.541 -9.821 653 HH TYR 80 HH TYR 80 0.375 -6.203 -8.001 654 H LEU 81 H LEU 81 7.259 -2.248 -7.886 655 HA LEU 81 HA LEU 81 7.156 -3.853 -10.231 656 HB2 LEU 81 2HB LEU 81 7.990 -0.991 -9.846 657 HB3 LEU 81 1HB LEU 81 7.835 -1.764 -11.413 658 HG LEU 81 HG LEU 81 5.593 -1.315 -9.434 659 HD11 LEU 81 1HD1 LEU 81 4.771 0.303 -11.066 660 HD12 LEU 81 2HD1 LEU 81 6.218 0.045 -12.042 661 HD13 LEU 81 3HD1 LEU 81 6.356 0.758 -10.436 662 HD21 LEU 81 1HD2 LEU 81 4.119 -2.036 -11.252 663 HD22 LEU 81 2HD2 LEU 81 5.219 -3.327 -10.789 664 HD23 LEU 81 3HD2 LEU 81 5.518 -2.395 -12.257 665 H ALA 82 H ALA 82 9.786 -2.757 -8.174 666 HA ALA 82 HA ALA 82 11.850 -3.191 -10.042 667 HB1 ALA 82 1HB ALA 82 12.145 -1.870 -8.012 668 HB2 ALA 82 2HB ALA 82 13.340 -3.165 -8.138 669 HB3 ALA 82 3HB ALA 82 11.972 -3.335 -7.034 670 H ASN 83 H ASN 83 10.165 -5.289 -7.823 671 HA ASN 83 HA ASN 83 11.913 -7.497 -8.503 672 HB2 ASN 83 2HB ASN 83 9.554 -7.327 -6.647 673 HB3 ASN 83 1HB ASN 83 10.350 -8.852 -7.026 674 HD21 ASN 83 1HD2 ASN 83 10.630 -5.796 -5.407 675 HD22 ASN 83 2HD2 ASN 83 12.062 -6.192 -4.525 676 H HIS 84 H HIS 84 9.577 -6.033 -10.054 677 HA HIS 84 HA HIS 84 8.451 -8.449 -11.252 678 HB2 HIS 84 2HB HIS 84 6.919 -6.535 -10.670 679 HB3 HIS 84 1HB HIS 84 7.820 -5.509 -11.770 680 HD1 HIS 84 1HD HIS 84 5.159 -8.132 -11.672 681 HD2 HIS 84 2HD HIS 84 7.250 -5.945 -14.524 682 HE1 HIS 84 1HE HIS 84 3.895 -8.411 -13.824 683 HE2 HIS 84 2HE HIS 84 5.259 -7.177 -15.555 684 H GLY 85 H GLY 85 11.180 -6.724 -11.430 685 HA2 GLY 85 2HA GLY 85 12.907 -7.092 -12.973 686 HA3 GLY 85 1HA GLY 85 11.707 -7.600 -14.152 687 H ILE 86 H ILE 86 11.006 -4.669 -12.502 688 HA ILE 86 HA ILE 86 11.623 -3.238 -14.975 689 HB ILE 86 HB ILE 86 9.742 -2.503 -12.712 690 HG12 ILE 86 2HG1 ILE 86 9.187 -3.381 -15.555 691 HG13 ILE 86 1HG1 ILE 86 8.925 -4.347 -14.108 692 HG21 ILE 86 1HG2 ILE 86 9.016 -0.641 -14.147 693 HG22 ILE 86 2HG2 ILE 86 10.265 -1.065 -15.318 694 HG23 ILE 86 3HG2 ILE 86 10.718 -0.498 -13.711 695 HD11 ILE 86 1HD1 ILE 86 7.523 -1.791 -14.814 696 HD12 ILE 86 2HD1 ILE 86 7.243 -2.758 -13.363 697 HD13 ILE 86 3HD1 ILE 86 6.846 -3.417 -14.954 698 H ASP 87 H ASP 87 13.064 -1.633 -15.025 699 HA ASP 87 HA ASP 87 14.444 -1.002 -12.529 700 HB2 ASP 87 2HB ASP 87 15.887 -1.524 -14.454 701 HB3 ASP 87 1HB ASP 87 15.125 -0.234 -15.382 702 H ILE 88 H ILE 88 13.910 0.717 -11.442 703 HA ILE 88 HA ILE 88 12.017 2.520 -12.676 704 HB ILE 88 HB ILE 88 12.750 2.085 -9.798 705 HG12 ILE 88 2HG1 ILE 88 10.325 1.284 -11.404 706 HG13 ILE 88 1HG1 ILE 88 11.611 0.208 -10.873 707 HG21 ILE 88 1HG2 ILE 88 10.812 3.475 -9.247 708 HG22 ILE 88 2HG2 ILE 88 10.550 3.804 -10.963 709 HG23 ILE 88 3HG2 ILE 88 12.004 4.393 -10.162 710 HD11 ILE 88 1HD1 ILE 88 9.731 1.731 -9.115 711 HD12 ILE 88 2HD1 ILE 88 11.007 0.649 -8.567 712 HD13 ILE 88 3HD1 ILE 88 9.656 0.006 -9.494 713 H LYS 89 H LYS 89 12.356 4.476 -13.007 714 HA LYS 89 HA LYS 89 14.628 5.922 -11.900 715 HB2 LYS 89 2HB LYS 89 15.456 6.615 -14.088 716 HB3 LYS 89 1HB LYS 89 15.557 4.872 -13.915 717 HG2 LYS 89 2HG LYS 89 13.460 4.677 -15.234 718 HG3 LYS 89 1HG LYS 89 13.495 6.415 -15.476 719 HD2 LYS 89 2HD LYS 89 15.661 4.500 -16.382 720 HD3 LYS 89 1HD LYS 89 14.375 5.092 -17.412 721 HE2 LYS 89 2HE LYS 89 16.352 6.366 -17.904 722 HE3 LYS 89 1HE LYS 89 15.252 7.420 -17.035 723 HZ1 LYS 89 1HZ LYS 89 16.630 7.192 -15.052 724 HZ2 LYS 89 2HZ LYS 89 17.615 7.581 -16.346 725 HZ3 LYS 89 3HZ LYS 89 17.561 6.008 -15.797 726 H1 MET 1 H MET 1 -2.970 14.210 7.794 727 HA MET 1 HA MET 1 -3.480 11.498 8.354 728 HB2 MET 1 2HB MET 1 -2.838 12.227 10.626 729 HB3 MET 1 1HB MET 1 -4.006 13.539 10.535 730 HG2 MET 1 2HG MET 1 -5.825 11.928 10.449 731 HG3 MET 1 1HG MET 1 -4.678 10.598 10.475 732 HE1 MET 1 1HE MET 1 -5.376 13.482 14.023 733 HE2 MET 1 2HE MET 1 -6.228 13.597 12.486 734 HE3 MET 1 3HE MET 1 -4.504 13.970 12.572 735 H GLY 2 H GLY 2 -5.637 11.031 7.907 736 HA2 GLY 2 2HA GLY 2 -7.494 13.211 7.490 737 HA3 GLY 2 1HA GLY 2 -7.030 12.292 6.058 738 H PHE 3 H PHE 3 -9.380 11.796 6.062 739 HA PHE 3 HA PHE 3 -9.726 9.175 7.119 740 HB2 PHE 3 2HB PHE 3 -10.349 10.550 9.116 741 HB3 PHE 3 1HB PHE 3 -11.588 11.342 8.155 742 HD1 PHE 3 1HD PHE 3 -13.735 10.371 7.947 743 HD2 PHE 3 2HD PHE 3 -10.531 8.095 9.577 744 HE1 PHE 3 1HE PHE 3 -15.328 8.632 8.641 745 HE2 PHE 3 2HE PHE 3 -12.120 6.348 10.272 746 HZ PHE 3 HZ PHE 3 -14.524 6.618 9.803 747 H THR 4 H THR 4 -10.007 8.623 4.987 748 HA THR 4 HA THR 4 -12.078 9.954 3.496 749 HB THR 4 HB THR 4 -11.340 8.430 1.612 750 HG1 THR 4 1HG THR 4 -8.937 7.775 2.519 751 HG21 THR 4 1HG2 THR 4 -9.221 9.605 1.228 752 HG22 THR 4 2HG2 THR 4 -9.200 10.117 2.916 753 HG23 THR 4 3HG2 THR 4 -10.464 10.702 1.834 754 H ASP 5 H ASP 5 -14.046 9.400 4.011 755 HA ASP 5 HA ASP 5 -14.734 6.552 4.017 756 HB2 ASP 5 2HB ASP 5 -14.718 7.294 6.352 757 HB3 ASP 5 1HB ASP 5 -15.779 8.639 5.948 758 H GLU 6 H GLU 6 -15.873 6.293 2.269 759 HA GLU 6 HA GLU 6 -18.231 7.868 1.893 760 HB2 GLU 6 2HB GLU 6 -17.658 8.226 -0.559 761 HB3 GLU 6 1HB GLU 6 -16.754 9.205 0.584 762 HG2 GLU 6 2HG GLU 6 -14.871 7.597 0.393 763 HG3 GLU 6 1HG GLU 6 -15.793 6.732 -0.835 764 H THR 7 H THR 7 -19.673 6.310 1.985 765 HA THR 7 HA THR 7 -19.051 3.681 1.064 766 HB THR 7 HB THR 7 -21.729 4.702 2.070 767 HG1 THR 7 1HG THR 7 -19.398 4.357 3.322 768 HG21 THR 7 1HG2 THR 7 -21.850 2.552 0.864 769 HG22 THR 7 2HG2 THR 7 -22.149 2.334 2.586 770 HG23 THR 7 3HG2 THR 7 -20.582 1.900 1.901 771 H VAL 8 H VAL 8 -18.657 4.161 -1.075 772 HA VAL 8 HA VAL 8 -21.074 4.254 -2.698 773 HB VAL 8 HB VAL 8 -19.983 6.427 -2.930 774 HG11 VAL 8 1HG1 VAL 8 -17.502 4.939 -3.757 775 HG12 VAL 8 2HG1 VAL 8 -17.738 5.841 -2.258 776 HG13 VAL 8 3HG1 VAL 8 -17.731 6.691 -3.798 777 HG21 VAL 8 1HG2 VAL 8 -19.530 4.714 -5.371 778 HG22 VAL 8 2HG2 VAL 8 -19.589 6.475 -5.364 779 HG23 VAL 8 3HG2 VAL 8 -21.023 5.547 -4.938 780 H ARG 9 H ARG 9 -21.246 2.645 -4.132 781 HA ARG 9 HA ARG 9 -18.901 0.913 -4.412 782 HB2 ARG 9 2HB ARG 9 -21.768 -0.058 -4.228 783 HB3 ARG 9 1HB ARG 9 -20.333 -1.046 -4.377 784 HG2 ARG 9 2HG ARG 9 -21.042 -1.249 -2.130 785 HG3 ARG 9 1HG ARG 9 -19.657 -0.159 -2.085 786 HD2 ARG 9 2HD ARG 9 -21.456 0.661 -0.635 787 HD3 ARG 9 1HD ARG 9 -21.189 1.767 -1.984 788 HE ARG 9 HE ARG 9 -23.234 -0.212 -2.430 789 HH11 ARG 9 1HH1 ARG 9 -22.662 3.140 -1.254 790 HH12 ARG 9 2HH1 ARG 9 -24.273 3.579 -1.472 791 HH21 ARG 9 1HH2 ARG 9 -25.426 0.468 -2.691 792 HH22 ARG 9 2HH2 ARG 9 -25.888 2.056 -2.297 793 H PHE 10 H PHE 10 -18.314 1.434 -6.467 794 HA PHE 10 HA PHE 10 -20.344 1.492 -8.541 795 HB2 PHE 10 2HB PHE 10 -17.312 1.566 -8.790 796 HB3 PHE 10 1HB PHE 10 -18.451 1.831 -10.095 797 HD1 PHE 10 1HD PHE 10 -19.941 3.869 -9.990 798 HD2 PHE 10 2HD PHE 10 -16.599 3.311 -7.421 799 HE1 PHE 10 1HE PHE 10 -19.887 6.286 -9.535 800 HE2 PHE 10 2HE PHE 10 -16.543 5.720 -6.958 801 HZ PHE 10 HZ PHE 10 -18.188 7.212 -8.020 802 H ASP 11 H ASP 11 -17.305 -0.241 -8.097 803 HA ASP 11 HA ASP 11 -18.176 -2.816 -7.857 804 HB2 ASP 11 2HB ASP 11 -17.664 -3.786 -10.068 805 HB3 ASP 11 1HB ASP 11 -18.977 -2.630 -10.222 806 H PHE 12 H PHE 12 -16.218 -4.264 -7.936 807 HA PHE 12 HA PHE 12 -13.781 -2.622 -7.766 808 HB2 PHE 12 2HB PHE 12 -14.590 -4.789 -5.803 809 HB3 PHE 12 1HB PHE 12 -13.091 -3.875 -5.771 810 HD1 PHE 12 1HD PHE 12 -13.067 -1.562 -5.009 811 HD2 PHE 12 2HD PHE 12 -16.690 -3.798 -5.091 812 HE1 PHE 12 1HE PHE 12 -14.142 0.123 -3.579 813 HE2 PHE 12 2HE PHE 12 -17.768 -2.112 -3.665 814 HZ PHE 12 HZ PHE 12 -16.498 -0.151 -2.907 815 H ASP 13 H ASP 13 -14.945 -5.962 -7.719 816 HA ASP 13 HA ASP 13 -14.335 -7.843 -8.760 817 HB2 ASP 13 2HB ASP 13 -12.287 -6.188 -10.252 818 HB3 ASP 13 1HB ASP 13 -12.350 -7.933 -10.380 819 H ASP 14 H ASP 14 -13.821 -8.955 -7.065 820 HA ASP 14 HA ASP 14 -11.262 -8.674 -5.795 821 HB2 ASP 14 2HB ASP 14 -13.145 -9.459 -4.424 822 HB3 ASP 14 1HB ASP 14 -13.392 -10.818 -5.505 823 H ASN 15 H ASN 15 -9.893 -8.875 -7.473 824 HA ASN 15 HA ASN 15 -9.194 -11.586 -8.140 825 HB2 ASN 15 2HB ASN 15 -10.841 -10.940 -9.903 826 HB3 ASN 15 1HB ASN 15 -9.808 -9.582 -10.326 827 HD21 ASN 15 1HD2 ASN 15 -10.192 -13.020 -10.389 828 HD22 ASN 15 2HD2 ASN 15 -8.962 -13.346 -11.543 829 H ARG 16 H ARG 16 -7.190 -11.533 -7.548 830 HA ARG 16 HA ARG 16 -5.602 -9.157 -8.113 831 HB2 ARG 16 2HB ARG 16 -5.272 -11.364 -6.085 832 HB3 ARG 16 1HB ARG 16 -4.050 -10.136 -6.391 833 HG2 ARG 16 2HG ARG 16 -5.419 -8.412 -5.585 834 HG3 ARG 16 1HG ARG 16 -6.864 -9.415 -5.667 835 HD2 ARG 16 2HD ARG 16 -4.542 -9.869 -3.796 836 HD3 ARG 16 1HD ARG 16 -6.061 -9.080 -3.359 837 HE ARG 16 HE ARG 16 -5.584 -11.881 -3.799 838 HH11 ARG 16 1HH1 ARG 16 -8.012 -9.318 -3.370 839 HH12 ARG 16 2HH1 ARG 16 -9.339 -10.369 -3.160 840 HH21 ARG 16 1HH2 ARG 16 -7.436 -13.358 -3.431 841 HH22 ARG 16 2HH2 ARG 16 -8.979 -12.724 -3.160 842 H LYS 17 H LYS 17 -5.072 -12.650 -7.798 843 HA LYS 17 HA LYS 17 -3.576 -14.056 -8.770 844 HB2 LYS 17 2HB LYS 17 -4.448 -12.605 -11.287 845 HB3 LYS 17 1HB LYS 17 -3.685 -14.190 -11.239 846 HG2 LYS 17 2HG LYS 17 -5.681 -15.047 -10.065 847 HG3 LYS 17 1HG LYS 17 -6.424 -13.452 -10.213 848 HD2 LYS 17 2HD LYS 17 -5.567 -15.239 -12.503 849 HD3 LYS 17 1HD LYS 17 -7.223 -14.972 -11.971 850 HE2 LYS 17 2HE LYS 17 -7.024 -12.590 -12.555 851 HE3 LYS 17 1HE LYS 17 -5.364 -12.856 -13.074 852 HZ1 LYS 17 1HZ LYS 17 -7.782 -14.073 -14.320 853 HZ2 LYS 17 2HZ LYS 17 -6.196 -14.347 -14.808 854 HZ3 LYS 17 3HZ LYS 17 -6.871 -12.824 -14.936 855 H LYS 18 H LYS 18 -2.745 -12.281 -11.499 856 HA LYS 18 HA LYS 18 -0.783 -10.596 -10.257 857 HB2 LYS 18 2HB LYS 18 -0.119 -12.601 -12.456 858 HB3 LYS 18 1HB LYS 18 0.917 -11.262 -11.981 859 HG2 LYS 18 2HG LYS 18 1.035 -12.240 -9.695 860 HG3 LYS 18 1HG LYS 18 0.141 -13.631 -10.297 861 HD2 LYS 18 2HD LYS 18 1.926 -14.114 -11.881 862 HD3 LYS 18 1HD LYS 18 2.810 -12.682 -11.345 863 HE2 LYS 18 2HE LYS 18 2.877 -13.656 -9.048 864 HE3 LYS 18 1HE LYS 18 2.122 -15.109 -9.696 865 HZ1 LYS 18 1HZ LYS 18 4.052 -15.385 -11.160 866 HZ2 LYS 18 2HZ LYS 18 4.514 -15.349 -9.529 867 HZ3 LYS 18 3HZ LYS 18 4.746 -14.009 -10.516 868 H ALA 19 H ALA 19 -3.413 -10.562 -11.548 869 HA ALA 19 HA ALA 19 -3.270 -9.467 -14.170 870 HB1 ALA 19 1HB ALA 19 -5.596 -8.809 -13.757 871 HB2 ALA 19 2HB ALA 19 -5.392 -9.188 -12.048 872 HB3 ALA 19 3HB ALA 19 -5.319 -10.483 -13.250 873 H ILE 20 H ILE 20 -3.635 -8.188 -10.942 874 HA ILE 20 HA ILE 20 -3.684 -5.481 -11.597 875 HB ILE 20 HB ILE 20 -2.697 -6.820 -9.061 876 HG12 ILE 20 2HG1 ILE 20 -5.391 -5.629 -9.767 877 HG13 ILE 20 1HG1 ILE 20 -5.034 -7.343 -9.637 878 HG21 ILE 20 1HG2 ILE 20 -1.855 -4.522 -9.221 879 HG22 ILE 20 2HG2 ILE 20 -3.069 -4.664 -7.950 880 HG23 ILE 20 3HG2 ILE 20 -3.492 -3.930 -9.502 881 HD11 ILE 20 1HD1 ILE 20 -6.206 -6.546 -7.676 882 HD12 ILE 20 2HD1 ILE 20 -4.965 -5.325 -7.404 883 HD13 ILE 20 3HD1 ILE 20 -4.566 -7.037 -7.243 884 H SER 21 H SER 21 -1.095 -7.783 -11.163 885 HA SER 21 HA SER 21 1.083 -6.004 -10.973 886 HB2 SER 21 2HB SER 21 1.042 -8.829 -12.042 887 HB3 SER 21 1HB SER 21 2.446 -7.965 -11.405 888 HG SER 21 HG SER 21 1.060 -7.710 -9.481 889 H GLU 22 H GLU 22 -0.345 -7.759 -13.722 890 HA GLU 22 HA GLU 22 1.404 -6.674 -15.671 891 HB2 GLU 22 2HB GLU 22 -1.371 -7.828 -16.004 892 HB3 GLU 22 1HB GLU 22 -0.233 -7.519 -17.310 893 HG2 GLU 22 2HG GLU 22 0.158 -9.451 -15.039 894 HG3 GLU 22 1HG GLU 22 -0.252 -9.866 -16.702 895 H THR 23 H THR 23 -1.601 -5.673 -14.308 896 HA THR 23 HA THR 23 -2.240 -3.599 -16.083 897 HB THR 23 HB THR 23 -2.854 -3.897 -13.132 898 HG1 THR 23 1HG THR 23 -3.715 -5.584 -14.303 899 HG21 THR 23 1HG2 THR 23 -4.750 -2.352 -13.582 900 HG22 THR 23 2HG2 THR 23 -4.122 -2.105 -15.217 901 HG23 THR 23 3HG2 THR 23 -3.185 -1.580 -13.829 902 H LEU 24 H LEU 24 -0.506 -3.544 -12.947 903 HA LEU 24 HA LEU 24 0.156 -0.804 -13.090 904 HB2 LEU 24 2HB LEU 24 1.419 -3.016 -11.487 905 HB3 LEU 24 1HB LEU 24 1.730 -1.308 -11.255 906 HG LEU 24 HG LEU 24 -0.925 -2.682 -10.845 907 HD11 LEU 24 1HD1 LEU 24 0.682 -3.263 -9.139 908 HD12 LEU 24 2HD1 LEU 24 -0.546 -2.182 -8.482 909 HD13 LEU 24 3HD1 LEU 24 1.051 -1.556 -8.888 910 HD21 LEU 24 1HD2 LEU 24 -1.244 -0.395 -11.600 911 HD22 LEU 24 2HD2 LEU 24 -0.109 0.193 -10.380 912 HD23 LEU 24 3HD2 LEU 24 -1.643 -0.534 -9.894 913 H GLU 25 H GLU 25 1.783 -3.704 -14.197 914 HA GLU 25 HA GLU 25 4.271 -2.674 -14.895 915 HB2 GLU 25 2HB GLU 25 3.718 -5.041 -15.120 916 HB3 GLU 25 1HB GLU 25 2.526 -4.670 -16.354 917 HG2 GLU 25 2HG GLU 25 4.363 -3.782 -17.770 918 HG3 GLU 25 1HG GLU 25 5.505 -4.354 -16.557 919 H THR 26 H THR 26 1.238 -2.786 -16.696 920 HA THR 26 HA THR 26 2.159 -1.477 -18.998 921 HB THR 26 HB THR 26 -0.666 -1.585 -17.936 922 HG1 THR 26 1HG THR 26 0.044 -3.720 -18.143 923 HG21 THR 26 1HG2 THR 26 -0.277 -0.006 -19.759 924 HG22 THR 26 2HG2 THR 26 -1.282 -1.356 -20.308 925 HG23 THR 26 3HG2 THR 26 0.437 -1.286 -20.733 926 H VAL 27 H VAL 27 0.686 -0.330 -16.014 927 HA VAL 27 HA VAL 27 0.305 2.335 -16.786 928 HB VAL 27 HB VAL 27 0.875 1.256 -14.001 929 HG11 VAL 27 1HG1 VAL 27 1.261 3.659 -14.163 930 HG12 VAL 27 2HG1 VAL 27 -0.187 3.311 -13.206 931 HG13 VAL 27 3HG1 VAL 27 -0.341 3.864 -14.875 932 HG21 VAL 27 1HG2 VAL 27 -1.746 1.865 -15.370 933 HG22 VAL 27 2HG2 VAL 27 -1.552 1.348 -13.695 934 HG23 VAL 27 3HG2 VAL 27 -1.115 0.258 -15.014 935 H TYR 28 H TYR 28 3.085 0.689 -15.416 936 HA TYR 28 HA TYR 28 4.669 3.042 -15.192 937 HB2 TYR 28 2HB TYR 28 5.197 0.851 -14.005 938 HB3 TYR 28 1HB TYR 28 5.716 0.207 -15.555 939 HD1 TYR 28 1HD TYR 28 7.696 1.318 -16.721 940 HD2 TYR 28 2HD TYR 28 6.670 2.167 -12.684 941 HE1 TYR 28 1HE TYR 28 9.938 2.270 -16.356 942 HE2 TYR 28 2HE TYR 28 8.913 3.119 -12.307 943 HH TYR 28 HH TYR 28 11.033 3.785 -14.915 944 H ARG 29 H ARG 29 4.242 0.588 -17.670 945 HA ARG 29 HA ARG 29 6.197 1.379 -19.500 946 HB2 ARG 29 2HB ARG 29 3.500 0.176 -20.130 947 HB3 ARG 29 1HB ARG 29 4.848 0.271 -21.245 948 HG2 ARG 29 2HG ARG 29 4.727 -1.325 -18.693 949 HG3 ARG 29 1HG ARG 29 4.672 -1.955 -20.336 950 HD2 ARG 29 2HD ARG 29 6.944 -1.130 -20.722 951 HD3 ARG 29 1HD ARG 29 6.990 -0.485 -19.084 952 HE ARG 29 HE ARG 29 6.484 -3.327 -19.428 953 HH11 ARG 29 1HH1 ARG 29 8.733 -0.751 -18.454 954 HH12 ARG 29 2HH1 ARG 29 9.836 -1.803 -17.714 955 HH21 ARG 29 1HH2 ARG 29 8.027 -4.795 -18.364 956 HH22 ARG 29 2HH2 ARG 29 9.428 -4.146 -17.664 957 H ALA 30 H ALA 30 2.984 2.610 -18.992 958 HA ALA 30 HA ALA 30 2.830 4.183 -21.330 959 HB1 ALA 30 1HB ALA 30 1.426 4.621 -18.699 960 HB2 ALA 30 2HB ALA 30 0.856 3.586 -20.008 961 HB3 ALA 30 3HB ALA 30 0.979 5.331 -20.248 962 H LEU 31 H LEU 31 3.773 5.045 -18.002 963 HA LEU 31 HA LEU 31 4.342 7.670 -18.909 964 HB2 LEU 31 2HB LEU 31 4.861 6.489 -16.211 965 HB3 LEU 31 1HB LEU 31 5.299 8.134 -16.619 966 HG LEU 31 HG LEU 31 2.737 8.161 -17.301 967 HD11 LEU 31 1HD1 LEU 31 2.267 5.876 -16.693 968 HD12 LEU 31 2HD1 LEU 31 1.384 7.003 -15.649 969 HD13 LEU 31 3HD1 LEU 31 2.829 6.205 -15.047 970 HD21 LEU 31 1HD2 LEU 31 3.738 9.756 -15.850 971 HD22 LEU 31 2HD2 LEU 31 3.802 8.591 -14.526 972 HD23 LEU 31 3HD2 LEU 31 2.251 9.147 -15.135 973 H GLU 32 H GLU 32 6.357 4.856 -18.532 974 HA GLU 32 HA GLU 32 8.769 6.327 -18.626 975 HB2 GLU 32 2HB GLU 32 9.866 4.240 -19.414 976 HB3 GLU 32 1HB GLU 32 8.913 4.004 -17.954 977 HG2 GLU 32 2HG GLU 32 7.200 2.965 -19.185 978 HG3 GLU 32 1HG GLU 32 7.951 3.370 -20.719 979 H GLU 33 H GLU 33 6.664 5.112 -21.144 980 HA GLU 33 HA GLU 33 8.259 5.839 -23.354 981 HB2 GLU 33 2HB GLU 33 5.269 5.596 -23.061 982 HB3 GLU 33 1HB GLU 33 6.074 5.893 -24.593 983 HG2 GLU 33 2HG GLU 33 6.534 3.497 -22.845 984 HG3 GLU 33 1HG GLU 33 5.464 3.539 -24.247 985 H LYS 34 H LYS 34 5.977 7.600 -21.404 986 HA LYS 34 HA LYS 34 6.054 9.935 -23.108 987 HB2 LYS 34 2HB LYS 34 4.740 9.419 -20.460 988 HB3 LYS 34 1HB LYS 34 4.631 10.961 -21.298 989 HG2 LYS 34 2HG LYS 34 3.728 8.321 -22.432 990 HG3 LYS 34 1HG LYS 34 2.666 9.470 -21.620 991 HD2 LYS 34 2HD LYS 34 4.303 10.134 -24.085 992 HD3 LYS 34 1HD LYS 34 2.633 9.589 -24.129 993 HE2 LYS 34 2HE LYS 34 1.922 11.498 -22.861 994 HE3 LYS 34 1HE LYS 34 3.583 12.067 -22.674 995 HZ1 LYS 34 1HZ LYS 34 3.698 12.320 -25.080 996 HZ2 LYS 34 2HZ LYS 34 2.438 13.252 -24.446 997 HZ3 LYS 34 3HZ LYS 34 2.101 11.819 -25.252 998 H GLY 35 H GLY 35 8.064 8.784 -20.691 999 HA2 GLY 35 2HA GLY 35 10.085 9.772 -20.081 1000 HA3 GLY 35 1HA GLY 35 9.532 11.285 -20.777 1001 H TYR 36 H TYR 36 7.296 9.904 -18.647 1002 HA TYR 36 HA TYR 36 8.006 11.892 -16.600 1003 HB2 TYR 36 2HB TYR 36 5.599 10.060 -16.755 1004 HB3 TYR 36 1HB TYR 36 5.850 11.284 -15.530 1005 HD1 TYR 36 1HD TYR 36 4.429 10.494 -18.668 1006 HD2 TYR 36 2HD TYR 36 5.892 13.742 -16.370 1007 HE1 TYR 36 1HE TYR 36 3.118 12.039 -20.049 1008 HE2 TYR 36 2HE TYR 36 4.583 15.313 -17.754 1009 HH TYR 36 HH TYR 36 3.595 15.367 -20.021 1010 H ASN 37 H ASN 37 7.721 11.034 -14.279 1011 HA ASN 37 HA ASN 37 9.007 8.419 -14.125 1012 HB2 ASN 37 2HB ASN 37 8.796 10.615 -12.030 1013 HB3 ASN 37 1HB ASN 37 9.594 9.082 -11.769 1014 HD21 ASN 37 1HD2 ASN 37 10.643 11.795 -11.675 1015 HD22 ASN 37 2HD2 ASN 37 11.965 11.846 -12.774 1016 HA PRO 38 HA PRO 38 4.722 7.133 -13.721 1017 HB2 PRO 38 2HB PRO 38 5.961 4.565 -13.034 1018 HB3 PRO 38 1HB PRO 38 4.786 4.961 -14.284 1019 HG2 PRO 38 2HG PRO 38 7.420 4.478 -14.753 1020 HG3 PRO 38 1HG PRO 38 6.433 5.447 -15.831 1021 HD2 PRO 38 2HD PRO 38 8.575 6.259 -14.011 1022 HD3 PRO 38 1HD PRO 38 7.821 7.135 -15.366 1023 H ILE 39 H ILE 39 7.068 6.204 -11.224 1024 HA ILE 39 HA ILE 39 5.253 5.076 -9.413 1025 HB ILE 39 HB ILE 39 7.818 6.546 -8.767 1026 HG12 ILE 39 2HG1 ILE 39 8.138 4.708 -10.372 1027 HG13 ILE 39 1HG1 ILE 39 8.894 4.354 -8.824 1028 HG21 ILE 39 1HG2 ILE 39 6.446 6.257 -6.775 1029 HG22 ILE 39 2HG2 ILE 39 7.857 5.206 -6.706 1030 HG23 ILE 39 3HG2 ILE 39 6.280 4.536 -7.127 1031 HD11 ILE 39 1HD1 ILE 39 7.816 2.405 -9.775 1032 HD12 ILE 39 2HD1 ILE 39 6.274 3.258 -9.837 1033 HD13 ILE 39 3HD1 ILE 39 7.023 2.888 -8.279 1034 H ASN 40 H ASN 40 6.361 8.379 -9.683 1035 HA ASN 40 HA ASN 40 5.154 9.492 -7.398 1036 HB2 ASN 40 2HB ASN 40 5.710 10.873 -10.039 1037 HB3 ASN 40 1HB ASN 40 5.396 11.674 -8.508 1038 HD21 ASN 40 1HD2 ASN 40 7.677 9.919 -10.417 1039 HD22 ASN 40 2HD2 ASN 40 9.038 10.176 -9.393 1040 H GLN 41 H GLN 41 3.913 8.979 -10.653 1041 HA GLN 41 HA GLN 41 1.590 10.527 -10.201 1042 HB2 GLN 41 2HB GLN 41 2.309 8.582 -12.378 1043 HB3 GLN 41 1HB GLN 41 0.904 9.642 -12.403 1044 HG2 GLN 41 2HG GLN 41 3.765 10.579 -12.237 1045 HG3 GLN 41 1HG GLN 41 2.812 10.530 -13.710 1046 HE21 GLN 41 1HE2 GLN 41 0.372 11.399 -12.455 1047 HE22 GLN 41 2HE2 GLN 41 0.576 13.075 -12.094 1048 H ILE 42 H ILE 42 2.408 7.123 -9.923 1049 HA ILE 42 HA ILE 42 -0.329 6.339 -9.683 1050 HB ILE 42 HB ILE 42 2.051 4.718 -8.711 1051 HG12 ILE 42 2HG1 ILE 42 0.718 4.691 -11.438 1052 HG13 ILE 42 1HG1 ILE 42 2.299 5.386 -11.105 1053 HG21 ILE 42 1HG2 ILE 42 -0.155 3.961 -7.925 1054 HG22 ILE 42 2HG2 ILE 42 0.458 2.823 -9.140 1055 HG23 ILE 42 3HG2 ILE 42 -0.766 4.022 -9.568 1056 HD11 ILE 42 1HD1 ILE 42 3.133 3.173 -10.474 1057 HD12 ILE 42 2HD1 ILE 42 2.504 3.189 -12.121 1058 HD13 ILE 42 3HD1 ILE 42 1.546 2.483 -10.821 1059 H VAL 43 H VAL 43 2.270 6.977 -7.332 1060 HA VAL 43 HA VAL 43 0.677 6.343 -5.095 1061 HB VAL 43 HB VAL 43 3.091 6.442 -4.734 1062 HG11 VAL 43 1HG1 VAL 43 3.665 8.157 -6.370 1063 HG12 VAL 43 2HG1 VAL 43 4.349 8.545 -4.791 1064 HG13 VAL 43 3HG1 VAL 43 2.907 9.389 -5.357 1065 HG21 VAL 43 1HG2 VAL 43 1.808 8.715 -3.231 1066 HG22 VAL 43 2HG2 VAL 43 3.225 7.791 -2.729 1067 HG23 VAL 43 3HG2 VAL 43 1.651 7.003 -2.838 1068 H GLY 44 H GLY 44 1.079 9.305 -6.898 1069 HA2 GLY 44 2HA GLY 44 -0.460 10.980 -5.224 1070 HA3 GLY 44 1HA GLY 44 -0.164 11.218 -6.936 1071 H TYR 45 H TYR 45 -1.275 8.698 -7.740 1072 HA TYR 45 HA TYR 45 -3.943 9.486 -8.257 1073 HB2 TYR 45 2HB TYR 45 -2.566 8.036 -9.727 1074 HB3 TYR 45 1HB TYR 45 -2.652 6.765 -8.530 1075 HD1 TYR 45 1HD TYR 45 -5.499 6.593 -7.853 1076 HD2 TYR 45 2HD TYR 45 -3.664 7.415 -11.529 1077 HE1 TYR 45 1HE TYR 45 -7.487 5.676 -8.988 1078 HE2 TYR 45 2HE TYR 45 -5.668 6.529 -12.746 1079 HH TYR 45 HH TYR 45 -7.496 4.886 -12.216 1080 H LEU 46 H LEU 46 -2.648 6.769 -6.327 1081 HA LEU 46 HA LEU 46 -5.212 5.933 -5.658 1082 HB2 LEU 46 2HB LEU 46 -2.550 5.062 -4.683 1083 HB3 LEU 46 1HB LEU 46 -4.002 4.412 -3.943 1084 HG LEU 46 HG LEU 46 -4.700 3.601 -6.221 1085 HD11 LEU 46 1HD1 LEU 46 -3.047 3.379 -7.978 1086 HD12 LEU 46 2HD1 LEU 46 -1.968 4.426 -7.050 1087 HD13 LEU 46 3HD1 LEU 46 -3.503 5.051 -7.637 1088 HD21 LEU 46 1HD2 LEU 46 -3.188 1.696 -6.295 1089 HD22 LEU 46 2HD2 LEU 46 -3.672 2.084 -4.642 1090 HD23 LEU 46 3HD2 LEU 46 -2.071 2.537 -5.224 1091 H LEU 47 H LEU 47 -2.925 7.659 -3.547 1092 HA LEU 47 HA LEU 47 -4.712 7.649 -1.372 1093 HB2 LEU 47 2HB LEU 47 -2.510 9.596 -2.012 1094 HB3 LEU 47 1HB LEU 47 -3.358 9.526 -0.482 1095 HG LEU 47 HG LEU 47 -1.598 7.370 -1.640 1096 HD11 LEU 47 1HD1 LEU 47 -0.338 9.251 -0.780 1097 HD12 LEU 47 2HD1 LEU 47 -0.178 7.853 0.279 1098 HD13 LEU 47 3HD1 LEU 47 -1.239 9.180 0.737 1099 HD21 LEU 47 1HD2 LEU 47 -3.432 6.366 -0.416 1100 HD22 LEU 47 2HD2 LEU 47 -3.132 7.436 0.959 1101 HD23 LEU 47 3HD2 LEU 47 -1.934 6.230 0.495 1102 H SER 48 H SER 48 -4.811 9.472 -4.249 1103 HA SER 48 HA SER 48 -6.613 11.448 -3.053 1104 HB2 SER 48 2HB SER 48 -5.504 11.317 -5.861 1105 HB3 SER 48 1HB SER 48 -6.355 12.674 -5.123 1106 HG SER 48 HG SER 48 -3.768 11.826 -4.887 1107 H GLY 49 H GLY 49 -6.671 8.483 -4.801 1108 HA2 GLY 49 2HA GLY 49 -8.267 7.335 -5.932 1109 HA3 GLY 49 1HA GLY 49 -9.457 8.349 -5.118 1110 H ASP 50 H ASP 50 -6.880 9.365 -7.297 1111 HA ASP 50 HA ASP 50 -8.956 10.717 -8.886 1112 HB2 ASP 50 2HB ASP 50 -7.467 12.112 -7.514 1113 HB3 ASP 50 1HB ASP 50 -6.119 11.542 -8.440 1114 HA PRO 51 HA PRO 51 -7.404 8.103 -12.144 1115 HB2 PRO 51 2HB PRO 51 -9.102 8.925 -14.071 1116 HB3 PRO 51 1HB PRO 51 -9.572 7.847 -12.749 1117 HG2 PRO 51 2HG PRO 51 -10.012 10.801 -13.006 1118 HG3 PRO 51 1HG PRO 51 -11.135 9.549 -12.448 1119 HD2 PRO 51 2HD PRO 51 -9.747 11.157 -10.767 1120 HD3 PRO 51 1HD PRO 51 -10.224 9.500 -10.341 1121 H ALA 52 H ALA 52 -7.400 11.576 -12.245 1122 HA ALA 52 HA ALA 52 -6.414 11.874 -14.894 1123 HB1 ALA 52 1HB ALA 52 -6.111 14.210 -14.350 1124 HB2 ALA 52 2HB ALA 52 -6.337 13.852 -12.638 1125 HB3 ALA 52 3HB ALA 52 -7.672 13.628 -13.763 1126 H TYR 53 H TYR 53 -4.840 10.883 -12.107 1127 HA TYR 53 HA TYR 53 -2.324 12.062 -12.579 1128 HB2 TYR 53 2HB TYR 53 -3.185 9.811 -10.852 1129 HB3 TYR 53 1HB TYR 53 -1.469 10.137 -11.088 1130 HD1 TYR 53 1HD TYR 53 -0.568 12.341 -10.534 1131 HD2 TYR 53 2HD TYR 53 -4.492 11.205 -9.470 1132 HE1 TYR 53 1HE TYR 53 -0.614 14.152 -8.955 1133 HE2 TYR 53 2HE TYR 53 -4.588 13.053 -7.828 1134 HH TYR 53 HH TYR 53 -2.216 15.522 -7.795 1135 H ILE 54 H ILE 54 -3.808 9.461 -14.226 1136 HA ILE 54 HA ILE 54 -1.165 8.637 -15.199 1137 HB ILE 54 HB ILE 54 -3.757 7.046 -15.368 1138 HG12 ILE 54 2HG1 ILE 54 -2.858 7.132 -13.128 1139 HG13 ILE 54 1HG1 ILE 54 -2.668 5.505 -13.782 1140 HG21 ILE 54 1HG2 ILE 54 -2.390 5.210 -16.232 1141 HG22 ILE 54 2HG2 ILE 54 -0.981 6.271 -16.250 1142 HG23 ILE 54 3HG2 ILE 54 -2.350 6.612 -17.303 1143 HD11 ILE 54 1HD1 ILE 54 -0.710 6.149 -12.518 1144 HD12 ILE 54 2HD1 ILE 54 -0.533 7.620 -13.467 1145 HD13 ILE 54 3HD1 ILE 54 -0.283 6.047 -14.226 1146 HA PRO 55 HA PRO 55 -2.134 10.784 -19.014 1147 HB2 PRO 55 2HB PRO 55 0.068 8.999 -19.946 1148 HB3 PRO 55 1HB PRO 55 -0.106 10.748 -20.131 1149 HG2 PRO 55 2HG PRO 55 1.610 9.766 -18.376 1150 HG3 PRO 55 1HG PRO 55 0.624 11.184 -17.973 1151 HD2 PRO 55 2HD PRO 55 0.284 8.339 -17.111 1152 HD3 PRO 55 1HD PRO 55 0.060 9.847 -16.193 1153 H ARG 56 H ARG 56 -3.316 10.247 -20.743 1154 HA ARG 56 HA ARG 56 -4.305 7.526 -20.876 1155 HB2 ARG 56 2HB ARG 56 -6.026 8.499 -22.413 1156 HB3 ARG 56 1HB ARG 56 -6.033 9.140 -20.778 1157 HG2 ARG 56 2HG ARG 56 -4.863 11.134 -21.599 1158 HG3 ARG 56 1HG ARG 56 -4.912 10.473 -23.236 1159 HD2 ARG 56 2HD ARG 56 -7.339 10.426 -23.164 1160 HD3 ARG 56 1HD ARG 56 -7.313 11.019 -21.506 1161 HE ARG 56 HE ARG 56 -5.920 12.819 -23.082 1162 HH11 ARG 56 1HH1 ARG 56 -9.237 11.633 -22.694 1163 HH12 ARG 56 2HH1 ARG 56 -9.984 13.068 -23.208 1164 HH21 ARG 56 1HH2 ARG 56 -6.935 14.803 -23.792 1165 HH22 ARG 56 2HH2 ARG 56 -8.626 14.934 -23.875 1166 H TYR 57 H TYR 57 -1.737 8.709 -22.050 1167 HA TYR 57 HA TYR 57 -1.505 8.467 -24.751 1168 HB2 TYR 57 2HB TYR 57 0.320 9.148 -23.380 1169 HB3 TYR 57 1HB TYR 57 0.357 7.600 -22.554 1170 HD1 TYR 57 1HD TYR 57 0.805 9.108 -25.924 1171 HD2 TYR 57 2HD TYR 57 1.854 5.972 -23.264 1172 HE1 TYR 57 1HE TYR 57 2.516 8.333 -27.520 1173 HE2 TYR 57 2HE TYR 57 3.559 5.189 -24.844 1174 HH TYR 57 HH TYR 57 4.078 5.312 -27.157 1175 H GLN 58 H GLN 58 -1.752 5.796 -22.429 1176 HA GLN 58 HA GLN 58 -1.910 4.017 -24.749 1177 HB2 GLN 58 2HB GLN 58 0.331 4.045 -23.222 1178 HB3 GLN 58 1HB GLN 58 -0.674 2.956 -22.272 1179 HG2 GLN 58 2HG GLN 58 -0.961 1.503 -24.233 1180 HG3 GLN 58 1HG GLN 58 0.074 2.586 -25.158 1181 HE21 GLN 58 1HE2 GLN 58 -0.086 0.144 -22.774 1182 HE22 GLN 58 2HE2 GLN 58 1.634 -0.101 -22.637 1183 H ASP 59 H ASP 59 -2.521 1.695 -23.569 1184 HA ASP 59 HA ASP 59 -5.175 1.953 -22.747 1185 HB2 ASP 59 2HB ASP 59 -5.043 -0.524 -22.434 1186 HB3 ASP 59 1HB ASP 59 -4.466 0.026 -23.999 1187 H ALA 60 H ALA 60 -2.378 2.248 -20.963 1188 HA ALA 60 HA ALA 60 -2.830 1.036 -18.508 1189 HB1 ALA 60 1HB ALA 60 -1.382 2.718 -17.556 1190 HB2 ALA 60 2HB ALA 60 -1.490 3.671 -19.026 1191 HB3 ALA 60 3HB ALA 60 -0.720 2.073 -19.066 1192 H ARG 61 H ARG 61 -3.948 4.258 -19.551 1193 HA ARG 61 HA ARG 61 -4.953 5.082 -17.063 1194 HB2 ARG 61 2HB ARG 61 -4.483 6.540 -19.066 1195 HB3 ARG 61 1HB ARG 61 -5.933 5.915 -19.820 1196 HG2 ARG 61 2HG ARG 61 -5.860 7.535 -17.257 1197 HG3 ARG 61 1HG ARG 61 -6.177 8.198 -18.850 1198 HD2 ARG 61 2HD ARG 61 -7.871 6.193 -17.352 1199 HD3 ARG 61 1HD ARG 61 -8.241 7.896 -17.612 1200 HE ARG 61 HE ARG 61 -7.870 6.767 -20.102 1201 HH11 ARG 61 1HH1 ARG 61 -10.222 6.551 -17.459 1202 HH12 ARG 61 2HH1 ARG 61 -11.435 5.855 -18.432 1203 HH21 ARG 61 1HH2 ARG 61 -9.548 5.904 -21.416 1204 HH22 ARG 61 2HH2 ARG 61 -11.071 5.505 -20.739 1205 H ASN 62 H ASN 62 -6.464 3.362 -19.756 1206 HA ASN 62 HA ASN 62 -9.054 3.209 -18.620 1207 HB2 ASN 62 2HB ASN 62 -8.781 2.846 -20.991 1208 HB3 ASN 62 1HB ASN 62 -7.679 1.505 -20.706 1209 HD21 ASN 62 1HD2 ASN 62 -11.007 2.540 -20.648 1210 HD22 ASN 62 2HD2 ASN 62 -11.681 0.964 -20.542 1211 H LEU 63 H LEU 63 -6.305 1.040 -18.634 1212 HA LEU 63 HA LEU 63 -7.437 -1.173 -17.372 1213 HB2 LEU 63 2HB LEU 63 -4.624 -0.163 -17.258 1214 HB3 LEU 63 1HB LEU 63 -5.153 -1.772 -16.767 1215 HG LEU 63 HG LEU 63 -5.272 -0.646 -19.554 1216 HD11 LEU 63 1HD1 LEU 63 -3.010 -1.055 -18.808 1217 HD12 LEU 63 2HD1 LEU 63 -3.508 -2.216 -20.022 1218 HD13 LEU 63 3HD1 LEU 63 -3.448 -2.695 -18.320 1219 HD21 LEU 63 1HD2 LEU 63 -5.841 -2.927 -20.205 1220 HD22 LEU 63 2HD2 LEU 63 -7.064 -2.247 -19.137 1221 HD23 LEU 63 3HD2 LEU 63 -5.889 -3.410 -18.509 1222 H ILE 64 H ILE 64 -5.848 1.656 -15.936 1223 HA ILE 64 HA ILE 64 -6.040 0.533 -13.314 1224 HB ILE 64 HB ILE 64 -4.219 2.142 -13.992 1225 HG12 ILE 64 2HG1 ILE 64 -5.823 3.098 -11.604 1226 HG13 ILE 64 1HG1 ILE 64 -4.783 1.680 -11.592 1227 HG21 ILE 64 1HG2 ILE 64 -4.690 4.560 -13.967 1228 HG22 ILE 64 2HG2 ILE 64 -6.409 4.217 -13.809 1229 HG23 ILE 64 3HG2 ILE 64 -5.545 3.729 -15.265 1230 HD11 ILE 64 1HD1 ILE 64 -2.849 3.112 -12.050 1231 HD12 ILE 64 2HD1 ILE 64 -3.688 3.594 -10.576 1232 HD13 ILE 64 3HD1 ILE 64 -3.906 4.524 -12.058 1233 H ARG 65 H ARG 65 -8.249 2.041 -15.319 1234 HA ARG 65 HA ARG 65 -9.971 2.996 -13.173 1235 HB2 ARG 65 2HB ARG 65 -10.381 2.868 -16.169 1236 HB3 ARG 65 1HB ARG 65 -11.558 3.504 -15.033 1237 HG2 ARG 65 2HG ARG 65 -8.784 4.591 -15.432 1238 HG3 ARG 65 1HG ARG 65 -10.251 5.254 -16.155 1239 HD2 ARG 65 2HD ARG 65 -9.700 5.016 -13.191 1240 HD3 ARG 65 1HD ARG 65 -9.572 6.478 -14.166 1241 HE ARG 65 HE ARG 65 -12.067 5.746 -14.665 1242 HH11 ARG 65 1HH1 ARG 65 -10.368 6.028 -11.542 1243 HH12 ARG 65 2HH1 ARG 65 -11.762 6.486 -10.673 1244 HH21 ARG 65 1HH2 ARG 65 -13.965 6.385 -13.450 1245 HH22 ARG 65 2HH2 ARG 65 -13.862 6.678 -11.782 1246 H ARG 66 H ARG 66 -9.337 0.184 -14.968 1247 HA ARG 66 HA ARG 66 -11.917 -1.019 -14.634 1248 HB2 ARG 66 2HB ARG 66 -9.278 -2.253 -15.450 1249 HB3 ARG 66 1HB ARG 66 -10.815 -3.109 -15.443 1250 HG2 ARG 66 2HG ARG 66 -11.689 -1.522 -17.091 1251 HG3 ARG 66 1HG ARG 66 -10.124 -0.711 -17.124 1252 HD2 ARG 66 2HD ARG 66 -10.340 -2.245 -19.003 1253 HD3 ARG 66 1HD ARG 66 -9.069 -2.778 -17.906 1254 HE ARG 66 HE ARG 66 -11.410 -4.065 -17.150 1255 HH11 ARG 66 1HH1 ARG 66 -9.308 -3.989 -20.002 1256 HH12 ARG 66 2HH1 ARG 66 -9.583 -5.601 -20.443 1257 HH21 ARG 66 1HH2 ARG 66 -11.797 -6.314 -17.760 1258 HH22 ARG 66 2HH2 ARG 66 -11.048 -6.953 -19.154 1259 H HIS 67 H HIS 67 -9.674 -0.243 -12.514 1260 HA HIS 67 HA HIS 67 -10.664 -2.206 -10.637 1261 HB2 HIS 67 2HB HIS 67 -7.790 -1.556 -11.103 1262 HB3 HIS 67 1HB HIS 67 -8.336 -1.870 -9.465 1263 HD1 HIS 67 1HD HIS 67 -8.815 -4.238 -8.833 1264 HD2 HIS 67 2HD HIS 67 -7.881 -3.770 -12.844 1265 HE1 HIS 67 1HE HIS 67 -8.224 -6.596 -9.727 1266 HE2 HIS 67 2HE HIS 67 -8.002 -6.256 -12.169 1267 H GLU 68 H GLU 68 -10.213 -1.544 -8.491 1268 HA GLU 68 HA GLU 68 -11.093 1.154 -7.970 1269 HB2 GLU 68 2HB GLU 68 -11.504 0.248 -5.771 1270 HB3 GLU 68 1HB GLU 68 -12.039 -0.940 -6.943 1271 HG2 GLU 68 2HG GLU 68 -9.669 -1.046 -5.090 1272 HG3 GLU 68 1HG GLU 68 -10.973 -2.206 -5.275 1273 H ARG 69 H ARG 69 -9.771 1.628 -5.513 1274 HA ARG 69 HA ARG 69 -6.945 1.589 -6.328 1275 HB2 ARG 69 2HB ARG 69 -8.285 3.407 -4.276 1276 HB3 ARG 69 1HB ARG 69 -6.559 3.243 -4.421 1277 HG2 ARG 69 2HG ARG 69 -7.153 5.260 -5.461 1278 HG3 ARG 69 1HG ARG 69 -6.789 4.150 -6.766 1279 HD2 ARG 69 2HD ARG 69 -9.594 4.678 -5.826 1280 HD3 ARG 69 1HD ARG 69 -8.807 5.729 -6.985 1281 HE ARG 69 HE ARG 69 -8.684 3.093 -7.913 1282 HH11 ARG 69 1HH1 ARG 69 -11.105 5.593 -7.216 1283 HH12 ARG 69 2HH1 ARG 69 -12.150 5.148 -8.476 1284 HH21 ARG 69 1HH2 ARG 69 -10.209 2.462 -9.717 1285 HH22 ARG 69 2HH2 ARG 69 -11.634 3.360 -9.870 1286 H ASP 70 H ASP 70 -9.141 0.382 -4.033 1287 HA ASP 70 HA ASP 70 -7.481 -0.176 -1.828 1288 HB2 ASP 70 2HB ASP 70 -9.898 -0.076 -1.659 1289 HB3 ASP 70 1HB ASP 70 -10.053 -1.499 -2.680 1290 H GLU 71 H GLU 71 -8.650 -2.481 -4.318 1291 HA GLU 71 HA GLU 71 -7.286 -4.672 -3.150 1292 HB2 GLU 71 2HB GLU 71 -9.364 -4.662 -4.688 1293 HB3 GLU 71 1HB GLU 71 -8.224 -4.527 -6.010 1294 HG2 GLU 71 2HG GLU 71 -8.890 -6.814 -5.739 1295 HG3 GLU 71 1HG GLU 71 -7.190 -6.642 -5.285 1296 H ILE 72 H ILE 72 -6.578 -2.430 -5.754 1297 HA ILE 72 HA ILE 72 -4.191 -3.519 -6.686 1298 HB ILE 72 HB ILE 72 -4.858 -0.578 -6.343 1299 HG12 ILE 72 2HG1 ILE 72 -5.044 -2.400 -8.756 1300 HG13 ILE 72 1HG1 ILE 72 -6.397 -1.747 -7.842 1301 HG21 ILE 72 1HG2 ILE 72 -2.643 -1.834 -7.966 1302 HG22 ILE 72 2HG2 ILE 72 -2.440 -0.854 -6.514 1303 HG23 ILE 72 3HG2 ILE 72 -3.077 -0.126 -7.989 1304 HD11 ILE 72 1HD1 ILE 72 -5.777 0.512 -8.555 1305 HD12 ILE 72 2HD1 ILE 72 -6.074 -0.549 -9.933 1306 HD13 ILE 72 3HD1 ILE 72 -4.419 -0.155 -9.463 1307 H MET 73 H MET 73 -4.697 -1.378 -3.892 1308 HA MET 73 HA MET 73 -1.943 -1.400 -3.175 1309 HB2 MET 73 2HB MET 73 -4.301 -0.797 -1.443 1310 HB3 MET 73 1HB MET 73 -2.628 -0.600 -0.950 1311 HG2 MET 73 2HG MET 73 -2.454 1.032 -2.916 1312 HG3 MET 73 1HG MET 73 -4.236 0.957 -2.920 1313 HE1 MET 73 1HE MET 73 -1.022 1.773 -0.929 1314 HE2 MET 73 2HE MET 73 -1.843 0.724 0.215 1315 HE3 MET 73 3HE MET 73 -1.690 2.432 0.561 1316 H GLU 74 H GLU 74 -4.620 -3.460 -2.405 1317 HA GLU 74 HA GLU 74 -3.574 -4.947 -0.278 1318 HB2 GLU 74 2HB GLU 74 -5.876 -5.159 -1.339 1319 HB3 GLU 74 1HB GLU 74 -5.053 -5.982 -2.669 1320 HG2 GLU 74 2HG GLU 74 -6.094 -7.627 -1.342 1321 HG3 GLU 74 1HG GLU 74 -4.353 -7.688 -1.092 1322 H GLU 75 H GLU 75 -3.372 -5.454 -3.777 1323 HA GLU 75 HA GLU 75 -1.553 -7.594 -3.767 1324 HB2 GLU 75 2HB GLU 75 -2.961 -7.063 -5.678 1325 HB3 GLU 75 1HB GLU 75 -2.149 -5.524 -5.883 1326 HG2 GLU 75 2HG GLU 75 -1.402 -7.105 -7.562 1327 HG3 GLU 75 1HG GLU 75 -0.104 -6.680 -6.454 1328 H LEU 76 H LEU 76 -1.015 -4.084 -4.173 1329 HA LEU 76 HA LEU 76 1.755 -4.022 -4.505 1330 HB2 LEU 76 2HB LEU 76 -0.010 -2.095 -2.994 1331 HB3 LEU 76 1HB LEU 76 1.678 -1.799 -3.298 1332 HG LEU 76 HG LEU 76 -0.406 -2.102 -5.471 1333 HD11 LEU 76 1HD1 LEU 76 -0.182 0.328 -5.708 1334 HD12 LEU 76 2HD1 LEU 76 0.911 0.374 -4.328 1335 HD13 LEU 76 3HD1 LEU 76 -0.776 -0.072 -4.099 1336 HD21 LEU 76 1HD2 LEU 76 1.850 -2.686 -6.192 1337 HD22 LEU 76 2HD2 LEU 76 2.454 -1.175 -5.498 1338 HD23 LEU 76 3HD2 LEU 76 1.347 -1.127 -6.862 1339 H THR 77 H THR 77 -0.089 -3.968 -1.480 1340 HA THR 77 HA THR 77 2.213 -3.838 0.134 1341 HB THR 77 HB THR 77 -0.619 -4.601 0.867 1342 HG1 THR 77 1HG THR 77 -0.736 -2.632 0.023 1343 HG21 THR 77 1HG2 THR 77 0.000 -3.804 3.111 1344 HG22 THR 77 2HG2 THR 77 1.643 -3.486 2.552 1345 HG23 THR 77 3HG2 THR 77 1.038 -5.143 2.623 1346 H LYS 78 H LYS 78 0.171 -6.520 -1.048 1347 HA LYS 78 HA LYS 78 1.291 -8.430 0.697 1348 HB2 LYS 78 2HB LYS 78 0.157 -8.989 -2.041 1349 HB3 LYS 78 1HB LYS 78 0.549 -10.188 -0.834 1350 HG2 LYS 78 2HG LYS 78 -1.326 -8.926 0.584 1351 HG3 LYS 78 1HG LYS 78 -1.683 -8.251 -0.949 1352 HD2 LYS 78 2HD LYS 78 -1.803 -10.427 -2.002 1353 HD3 LYS 78 1HD LYS 78 -1.511 -11.169 -0.433 1354 HE2 LYS 78 2HE LYS 78 -3.933 -9.520 -1.197 1355 HE3 LYS 78 1HE LYS 78 -3.878 -11.255 -1.049 1356 HZ1 LYS 78 1HZ LYS 78 -3.766 -9.260 1.137 1357 HZ2 LYS 78 2HZ LYS 78 -3.294 -10.900 1.374 1358 HZ3 LYS 78 3HZ LYS 78 -4.800 -10.528 0.826 1359 H TYR 79 H TYR 79 2.038 -7.672 -2.679 1360 HA TYR 79 HA TYR 79 4.044 -9.648 -2.871 1361 HB2 TYR 79 2HB TYR 79 2.830 -8.503 -4.777 1362 HB3 TYR 79 1HB TYR 79 3.893 -7.131 -4.505 1363 HD1 TYR 79 1HD TYR 79 4.010 -10.751 -5.093 1364 HD2 TYR 79 2HD TYR 79 5.879 -7.018 -5.723 1365 HE1 TYR 79 1HE TYR 79 5.632 -11.848 -6.601 1366 HE2 TYR 79 2HE TYR 79 7.530 -8.084 -7.241 1367 HH TYR 79 HH TYR 79 7.057 -11.203 -8.457 1368 H TYR 80 H TYR 80 4.095 -6.312 -1.907 1369 HA TYR 80 HA TYR 80 6.832 -5.801 -1.781 1370 HB2 TYR 80 2HB TYR 80 5.056 -4.108 -1.503 1371 HB3 TYR 80 1HB TYR 80 4.587 -4.853 0.010 1372 HD1 TYR 80 1HD TYR 80 7.055 -2.776 -1.678 1373 HD2 TYR 80 2HD TYR 80 5.885 -4.472 2.029 1374 HE1 TYR 80 1HE TYR 80 8.570 -1.244 -0.511 1375 HE2 TYR 80 2HE TYR 80 7.396 -2.939 3.220 1376 HH TYR 80 HH TYR 80 8.790 -0.262 1.694 1377 H LEU 81 H LEU 81 4.608 -6.986 0.736 1378 HA LEU 81 HA LEU 81 6.719 -7.483 2.570 1379 HB2 LEU 81 2HB LEU 81 3.823 -8.266 2.643 1380 HB3 LEU 81 1HB LEU 81 4.940 -8.567 3.962 1381 HG LEU 81 HG LEU 81 4.127 -5.852 2.906 1382 HD11 LEU 81 1HD1 LEU 81 3.460 -7.249 5.481 1383 HD12 LEU 81 2HD1 LEU 81 2.347 -6.967 4.140 1384 HD13 LEU 81 3HD1 LEU 81 3.000 -5.604 5.051 1385 HD21 LEU 81 1HD2 LEU 81 5.353 -4.969 4.838 1386 HD22 LEU 81 2HD2 LEU 81 6.426 -5.824 3.739 1387 HD23 LEU 81 3HD2 LEU 81 5.897 -6.596 5.237 1388 H ALA 82 H ALA 82 5.092 -9.442 0.167 1389 HA ALA 82 HA ALA 82 5.925 -11.927 1.183 1390 HB1 ALA 82 1HB ALA 82 5.332 -11.113 -1.650 1391 HB2 ALA 82 2HB ALA 82 4.153 -11.696 -0.468 1392 HB3 ALA 82 3HB ALA 82 5.432 -12.769 -1.040 1393 H ASN 83 H ASN 83 7.310 -9.651 -1.113 1394 HA ASN 83 HA ASN 83 9.646 -11.275 -1.529 1395 HB2 ASN 83 2HB ASN 83 8.927 -8.489 -2.425 1396 HB3 ASN 83 1HB ASN 83 10.500 -9.194 -2.747 1397 HD21 ASN 83 1HD2 ASN 83 7.519 -11.055 -2.791 1398 HD22 ASN 83 2HD2 ASN 83 7.493 -11.333 -4.483 1399 H HIS 84 H HIS 84 8.679 -9.658 0.989 1400 HA HIS 84 HA HIS 84 11.285 -8.608 1.800 1401 HB2 HIS 84 2HB HIS 84 9.279 -7.181 2.161 1402 HB3 HIS 84 1HB HIS 84 8.548 -8.455 3.111 1403 HD1 HIS 84 1HD HIS 84 11.069 -5.694 3.287 1404 HD2 HIS 84 2HD HIS 84 9.471 -8.621 5.761 1405 HE1 HIS 84 1HE HIS 84 11.730 -5.052 5.610 1406 HE2 HIS 84 2HE HIS 84 10.976 -7.003 7.036 1407 H GLY 85 H GLY 85 9.594 -11.466 1.766 1408 HA2 GLY 85 2HA GLY 85 10.598 -13.442 2.631 1409 HA3 GLY 85 1HA GLY 85 11.194 -12.503 3.990 1410 H ILE 86 H ILE 86 7.990 -11.691 3.306 1411 HA ILE 86 HA ILE 86 7.099 -13.362 5.528 1412 HB ILE 86 HB ILE 86 5.872 -10.861 4.322 1413 HG12 ILE 86 2HG1 ILE 86 7.254 -11.303 6.982 1414 HG13 ILE 86 1HG1 ILE 86 7.914 -10.423 5.610 1415 HG21 ILE 86 1HG2 ILE 86 4.281 -10.929 6.199 1416 HG22 ILE 86 2HG2 ILE 86 4.967 -12.473 6.712 1417 HG23 ILE 86 3HG2 ILE 86 4.129 -12.346 5.164 1418 HD11 ILE 86 1HD1 ILE 86 7.070 -8.930 7.346 1419 HD12 ILE 86 2HD1 ILE 86 5.472 -9.665 7.183 1420 HD13 ILE 86 3HD1 ILE 86 6.156 -8.754 5.839 1421 H ASP 87 H ASP 87 5.526 -14.845 5.216 1422 HA ASP 87 HA ASP 87 4.538 -15.109 2.469 1423 HB2 ASP 87 2HB ASP 87 5.637 -17.125 3.289 1424 HB3 ASP 87 1HB ASP 87 4.575 -17.158 4.693 1425 H ILE 88 H ILE 88 2.573 -14.568 2.014 1426 HA ILE 88 HA ILE 88 0.849 -13.722 4.222 1427 HB ILE 88 HB ILE 88 0.878 -12.919 1.304 1428 HG12 ILE 88 2HG1 ILE 88 1.749 -11.456 3.792 1429 HG13 ILE 88 1HG1 ILE 88 2.810 -12.172 2.585 1430 HG21 ILE 88 1HG2 ILE 88 -0.749 -11.769 3.583 1431 HG22 ILE 88 2HG2 ILE 88 -1.394 -12.732 2.250 1432 HG23 ILE 88 3HG2 ILE 88 -0.692 -11.139 1.937 1433 HD11 ILE 88 1HD1 ILE 88 2.528 -9.738 2.390 1434 HD12 ILE 88 2HD1 ILE 88 0.832 -9.997 2.012 1435 HD13 ILE 88 3HD1 ILE 88 2.067 -10.625 0.937 1436 H LYS 89 H LYS 89 -1.311 -14.214 4.319 1437 HA LYS 89 HA LYS 89 -2.601 -15.651 2.250 1438 HB2 LYS 89 2HB LYS 89 -3.536 -17.446 3.749 1439 HB3 LYS 89 1HB LYS 89 -1.827 -17.617 3.437 1440 HG2 LYS 89 2HG LYS 89 -3.025 -16.502 5.982 1441 HG3 LYS 89 1HG LYS 89 -2.519 -18.171 5.760 1442 HD2 LYS 89 2HD LYS 89 -0.666 -15.795 5.492 1443 HD3 LYS 89 1HD LYS 89 -0.899 -16.678 6.994 1444 HE2 LYS 89 2HE LYS 89 1.140 -17.373 5.820 1445 HE3 LYS 89 1HE LYS 89 0.001 -18.699 5.972 1446 HZ1 LYS 89 1HZ LYS 89 0.232 -17.080 3.477 1447 HZ2 LYS 89 2HZ LYS 89 -0.486 -18.583 3.662 1448 HZ3 LYS 89 3HZ LYS 89 1.193 -18.405 3.754 Start of MODEL 13 1 H1 MET 1 1HT MET 1 -12.878 25.184 12.395 2 H2 MET 1 2HT MET 1 -13.451 26.761 12.353 3 H3 MET 1 3HT MET 1 -14.334 25.574 13.170 4 HA MET 1 HA MET 1 -13.150 27.023 14.672 5 HB2 MET 1 2HB MET 1 -13.526 24.660 15.317 6 HB3 MET 1 1HB MET 1 -12.018 24.216 14.544 7 HG2 MET 1 2HG MET 1 -10.781 25.545 16.152 8 HG3 MET 1 1HG MET 1 -12.291 26.042 16.911 9 HE1 MET 1 1HE MET 1 -10.705 23.614 19.561 10 HE2 MET 1 2HE MET 1 -11.352 25.228 19.270 11 HE3 MET 1 3HE MET 1 -9.848 24.729 18.495 12 H GLY 2 H GLY 2 -11.765 28.597 14.242 13 HA2 GLY 2 2HA GLY 2 -9.054 27.808 13.512 14 HA3 GLY 2 1HA GLY 2 -9.874 29.097 12.640 15 H PHE 3 H PHE 3 -8.693 28.111 15.783 16 HA PHE 3 HA PHE 3 -8.596 30.907 16.620 17 HB2 PHE 3 2HB PHE 3 -8.111 28.328 18.139 18 HB3 PHE 3 1HB PHE 3 -7.893 29.934 18.819 19 HD1 PHE 3 1HD PHE 3 -9.801 31.318 19.350 20 HD2 PHE 3 2HD PHE 3 -10.319 27.412 17.760 21 HE1 PHE 3 1HE PHE 3 -12.158 31.357 20.043 22 HE2 PHE 3 2HE PHE 3 -12.685 27.446 18.451 23 HZ PHE 3 HZ PHE 3 -13.601 29.420 19.593 24 H THR 4 H THR 4 -6.444 31.494 17.724 25 HA THR 4 HA THR 4 -4.414 30.755 15.848 26 HB THR 4 HB THR 4 -4.202 32.594 18.243 27 HG1 THR 4 1HG THR 4 -5.228 32.856 15.667 28 HG21 THR 4 1HG2 THR 4 -2.493 32.330 15.749 29 HG22 THR 4 2HG2 THR 4 -2.023 31.823 17.370 30 HG23 THR 4 3HG2 THR 4 -2.267 33.534 17.015 31 H ASP 5 H ASP 5 -3.978 28.674 16.202 32 HA ASP 5 HA ASP 5 -2.502 28.064 18.644 33 HB2 ASP 5 2HB ASP 5 -4.721 27.018 18.824 34 HB3 ASP 5 1HB ASP 5 -4.496 26.249 17.260 35 H GLU 6 H GLU 6 -0.554 28.291 17.649 36 HA GLU 6 HA GLU 6 -0.252 26.882 15.175 37 HB2 GLU 6 2HB GLU 6 1.986 27.898 15.000 38 HB3 GLU 6 1HB GLU 6 0.680 29.065 15.096 39 HG2 GLU 6 2HG GLU 6 1.258 29.574 17.374 40 HG3 GLU 6 1HG GLU 6 2.476 28.293 17.385 41 H THR 7 H THR 7 -0.265 24.878 15.574 42 HA THR 7 HA THR 7 2.201 23.882 16.670 43 HB THR 7 HB THR 7 -0.508 22.653 17.263 44 HG1 THR 7 1HG THR 7 1.397 24.115 18.740 45 HG21 THR 7 1HG2 THR 7 0.785 21.070 18.671 46 HG22 THR 7 2HG2 THR 7 2.280 21.783 18.082 47 HG23 THR 7 3HG2 THR 7 1.217 20.934 16.962 48 H VAL 8 H VAL 8 2.956 23.685 14.667 49 HA VAL 8 HA VAL 8 1.617 21.697 13.045 50 HB VAL 8 HB VAL 8 1.247 23.861 11.993 51 HG11 VAL 8 1HG1 VAL 8 3.059 25.255 11.114 52 HG12 VAL 8 2HG1 VAL 8 4.229 24.215 11.924 53 HG13 VAL 8 3HG1 VAL 8 3.075 25.150 12.875 54 HG21 VAL 8 1HG2 VAL 8 3.272 22.233 10.469 55 HG22 VAL 8 2HG2 VAL 8 2.187 23.430 9.764 56 HG23 VAL 8 3HG2 VAL 8 1.528 21.974 10.508 57 H ARG 9 H ARG 9 2.726 19.981 13.383 58 HA ARG 9 HA ARG 9 5.619 20.141 13.135 59 HB2 ARG 9 2HB ARG 9 3.931 18.278 14.814 60 HB3 ARG 9 1HB ARG 9 5.674 18.119 14.598 61 HG2 ARG 9 2HG ARG 9 6.043 20.273 15.630 62 HG3 ARG 9 1HG ARG 9 4.306 20.539 15.754 63 HD2 ARG 9 2HD ARG 9 4.118 18.671 17.293 64 HD3 ARG 9 1HD ARG 9 5.842 18.341 17.125 65 HE ARG 9 HE ARG 9 5.969 20.823 17.953 66 HH11 ARG 9 1HH1 ARG 9 3.724 18.362 19.165 67 HH12 ARG 9 2HH1 ARG 9 3.773 18.943 20.765 68 HH21 ARG 9 1HH2 ARG 9 6.006 21.597 20.125 69 HH22 ARG 9 2HH2 ARG 9 5.098 20.784 21.326 70 H PHE 10 H PHE 10 6.271 19.375 11.368 71 HA PHE 10 HA PHE 10 4.567 17.772 9.666 72 HB2 PHE 10 2HB PHE 10 7.336 18.895 9.206 73 HB3 PHE 10 1HB PHE 10 6.300 18.180 7.985 74 HD1 PHE 10 1HD PHE 10 7.013 21.130 9.988 75 HD2 PHE 10 2HD PHE 10 4.338 19.406 7.167 76 HE1 PHE 10 1HE PHE 10 6.098 23.357 9.500 77 HE2 PHE 10 2HE PHE 10 3.420 21.633 6.671 78 HZ PHE 10 HZ PHE 10 4.302 23.611 7.841 79 H ASP 11 H ASP 11 6.220 16.286 8.255 80 HA ASP 11 HA ASP 11 6.860 14.025 9.736 81 HB2 ASP 11 2HB ASP 11 8.097 13.341 7.629 82 HB3 ASP 11 1HB ASP 11 6.428 13.828 7.371 83 H PHE 12 H PHE 12 8.949 16.498 8.359 84 HA PHE 12 HA PHE 12 11.078 17.067 8.640 85 HB2 PHE 12 2HB PHE 12 10.025 18.245 10.508 86 HB3 PHE 12 1HB PHE 12 10.285 16.859 11.555 87 HD1 PHE 12 1HD PHE 12 12.215 16.753 12.863 88 HD2 PHE 12 2HD PHE 12 12.125 19.350 9.489 89 HE1 PHE 12 1HE PHE 12 14.385 17.694 13.533 90 HE2 PHE 12 2HE PHE 12 14.299 20.296 10.159 91 HZ PHE 12 HZ PHE 12 15.430 19.467 12.181 92 H ASP 13 H ASP 13 11.959 15.260 7.663 93 HA ASP 13 HA ASP 13 14.101 14.207 9.137 94 HB2 ASP 13 2HB ASP 13 13.662 11.861 9.168 95 HB3 ASP 13 1HB ASP 13 12.217 12.594 9.845 96 H ASP 14 H ASP 14 15.243 12.556 7.690 97 HA ASP 14 HA ASP 14 14.709 12.854 4.835 98 HB2 ASP 14 2HB ASP 14 16.308 14.715 5.611 99 HB3 ASP 14 1HB ASP 14 17.441 13.440 6.038 100 H ASN 15 H ASN 15 14.379 10.883 6.801 101 HA ASN 15 HA ASN 15 16.713 9.152 6.689 102 HB2 ASN 15 2HB ASN 15 14.246 9.066 8.424 103 HB3 ASN 15 1HB ASN 15 15.564 7.898 8.493 104 HD21 ASN 15 1HD2 ASN 15 17.565 8.553 9.328 105 HD22 ASN 15 2HD2 ASN 15 17.733 9.984 10.255 106 H ARG 16 H ARG 16 14.712 9.555 4.462 107 HA ARG 16 HA ARG 16 13.191 7.259 4.061 108 HB2 ARG 16 2HB ARG 16 13.523 7.637 1.581 109 HB3 ARG 16 1HB ARG 16 12.981 9.051 2.459 110 HG2 ARG 16 2HG ARG 16 15.215 9.993 2.389 111 HG3 ARG 16 1HG ARG 16 15.831 8.527 1.621 112 HD2 ARG 16 2HD ARG 16 15.449 10.349 -0.003 113 HD3 ARG 16 1HD ARG 16 14.455 8.933 -0.338 114 HE ARG 16 HE ARG 16 12.909 10.584 1.223 115 HH11 ARG 16 1HH1 ARG 16 14.484 10.909 -1.939 116 HH12 ARG 16 2HH1 ARG 16 13.289 11.948 -2.568 117 HH21 ARG 16 1HH2 ARG 16 11.300 11.999 0.344 118 HH22 ARG 16 2HH2 ARG 16 11.440 12.582 -1.245 119 H LYS 17 H LYS 17 13.672 5.190 3.994 120 HA LYS 17 HA LYS 17 16.214 4.152 3.109 121 HB2 LYS 17 2HB LYS 17 16.611 5.242 5.368 122 HB3 LYS 17 1HB LYS 17 15.447 4.129 6.047 123 HG2 LYS 17 2HG LYS 17 16.945 2.260 5.414 124 HG3 LYS 17 1HG LYS 17 18.117 3.452 4.836 125 HD2 LYS 17 2HD LYS 17 17.068 3.174 7.656 126 HD3 LYS 17 1HD LYS 17 18.664 2.694 7.097 127 HE2 LYS 17 2HE LYS 17 17.586 5.532 7.170 128 HE3 LYS 17 1HE LYS 17 18.727 4.819 8.298 129 HZ1 LYS 17 1HZ LYS 17 19.866 6.158 6.660 130 HZ2 LYS 17 2HZ LYS 17 19.252 5.254 5.392 131 HZ3 LYS 17 3HZ LYS 17 20.304 4.557 6.489 132 H LYS 18 H LYS 18 16.095 1.634 4.012 133 HA LYS 18 HA LYS 18 13.497 0.674 3.242 134 HB2 LYS 18 2HB LYS 18 14.382 -1.549 3.453 135 HB3 LYS 18 1HB LYS 18 15.580 -0.561 2.643 136 HG2 LYS 18 2HG LYS 18 16.886 -0.428 4.668 137 HG3 LYS 18 1HG LYS 18 15.622 -1.286 5.556 138 HD2 LYS 18 2HD LYS 18 15.915 -3.200 4.023 139 HD3 LYS 18 1HD LYS 18 17.277 -2.354 3.284 140 HE2 LYS 18 2HE LYS 18 18.423 -2.329 5.419 141 HE3 LYS 18 1HE LYS 18 17.057 -3.141 6.180 142 HZ1 LYS 18 1HZ LYS 18 17.423 -5.011 4.671 143 HZ2 LYS 18 2HZ LYS 18 18.735 -4.713 5.682 144 HZ3 LYS 18 3HZ LYS 18 18.809 -4.244 4.059 145 H ALA 19 H ALA 19 14.076 2.172 5.827 146 HA ALA 19 HA ALA 19 13.497 0.599 8.067 147 HB1 ALA 19 1HB ALA 19 14.207 2.945 8.159 148 HB2 ALA 19 2HB ALA 19 12.691 2.675 9.055 149 HB3 ALA 19 3HB ALA 19 12.646 3.376 7.435 150 H ILE 20 H ILE 20 11.526 2.089 5.621 151 HA ILE 20 HA ILE 20 8.954 1.666 6.636 152 HB ILE 20 HB ILE 20 9.891 1.638 3.752 153 HG12 ILE 20 2HG1 ILE 20 8.875 3.927 5.451 154 HG13 ILE 20 1HG1 ILE 20 10.548 3.673 4.981 155 HG21 ILE 20 1HG2 ILE 20 7.143 2.142 4.897 156 HG22 ILE 20 2HG2 ILE 20 7.643 0.713 3.992 157 HG23 ILE 20 3HG2 ILE 20 7.590 2.288 3.195 158 HD11 ILE 20 1HD1 ILE 20 9.545 5.365 3.623 159 HD12 ILE 20 2HD1 ILE 20 8.241 4.274 3.145 160 HD13 ILE 20 3HD1 ILE 20 9.903 3.959 2.627 161 H SER 21 H SER 21 11.209 -0.394 4.964 162 HA SER 21 HA SER 21 9.411 -2.508 4.301 163 HB2 SER 21 2HB SER 21 12.421 -2.543 4.609 164 HB3 SER 21 1HB SER 21 11.464 -3.789 3.811 165 HG SER 21 HG SER 21 10.707 -1.696 2.616 166 H GLU 22 H GLU 22 11.556 -1.764 6.946 167 HA GLU 22 HA GLU 22 11.223 -4.257 8.269 168 HB2 GLU 22 2HB GLU 22 12.252 -1.629 9.341 169 HB3 GLU 22 1HB GLU 22 12.446 -3.199 10.100 170 HG2 GLU 22 2HG GLU 22 13.732 -3.939 8.108 171 HG3 GLU 22 1HG GLU 22 13.631 -2.293 7.494 172 H THR 23 H THR 23 9.886 -1.020 8.600 173 HA THR 23 HA THR 23 8.406 -1.403 10.922 174 HB THR 23 HB THR 23 7.884 0.463 8.601 175 HG1 THR 23 1HG THR 23 9.774 0.354 10.386 176 HG21 THR 23 1HG2 THR 23 5.856 0.223 9.958 177 HG22 THR 23 2HG2 THR 23 6.583 1.806 10.231 178 HG23 THR 23 3HG2 THR 23 6.784 0.515 11.423 179 H LEU 24 H LEU 24 7.323 -1.785 7.529 180 HA LEU 24 HA LEU 24 4.697 -2.483 8.285 181 HB2 LEU 24 2HB LEU 24 6.159 -3.079 5.724 182 HB3 LEU 24 1HB LEU 24 4.435 -3.294 5.981 183 HG LEU 24 HG LEU 24 5.920 -0.674 6.013 184 HD11 LEU 24 1HD1 LEU 24 3.968 -1.856 4.062 185 HD12 LEU 24 2HD1 LEU 24 5.697 -1.609 3.798 186 HD13 LEU 24 3HD1 LEU 24 4.626 -0.221 3.990 187 HD21 LEU 24 1HD2 LEU 24 4.057 -0.624 7.588 188 HD22 LEU 24 2HD2 LEU 24 2.976 -1.260 6.352 189 HD23 LEU 24 3HD2 LEU 24 3.682 0.343 6.163 190 H GLU 25 H GLU 25 7.600 -4.365 7.943 191 HA GLU 25 HA GLU 25 6.462 -6.914 7.936 192 HB2 GLU 25 2HB GLU 25 8.823 -6.399 7.379 193 HB3 GLU 25 1HB GLU 25 9.113 -5.905 9.025 194 HG2 GLU 25 2HG GLU 25 8.363 -8.713 8.250 195 HG3 GLU 25 1HG GLU 25 10.024 -8.139 8.305 196 H THR 26 H THR 26 7.615 -4.780 10.557 197 HA THR 26 HA THR 26 6.916 -6.372 12.749 198 HB THR 26 HB THR 26 7.011 -3.339 12.609 199 HG1 THR 26 1HG THR 26 9.049 -5.303 12.818 200 HG21 THR 26 1HG2 THR 26 7.719 -3.519 14.950 201 HG22 THR 26 2HG2 THR 26 7.594 -5.280 14.846 202 HG23 THR 26 3HG2 THR 26 6.146 -4.290 14.697 203 H VAL 27 H VAL 27 5.138 -3.733 11.129 204 HA VAL 27 HA VAL 27 2.864 -3.671 12.782 205 HB VAL 27 HB VAL 27 2.976 -3.011 9.813 206 HG11 VAL 27 1HG1 VAL 27 0.680 -3.289 10.591 207 HG12 VAL 27 2HG1 VAL 27 1.020 -1.596 10.228 208 HG13 VAL 27 3HG1 VAL 27 0.977 -2.152 11.901 209 HG21 VAL 27 1HG2 VAL 27 3.332 -1.202 12.209 210 HG22 VAL 27 2HG2 VAL 27 3.266 -0.683 10.525 211 HG23 VAL 27 3HG2 VAL 27 4.591 -1.702 11.083 212 H TYR 28 H TYR 28 3.608 -5.687 10.023 213 HA TYR 28 HA TYR 28 1.072 -6.783 9.566 214 HB2 TYR 28 2HB TYR 28 2.991 -7.029 8.014 215 HB3 TYR 28 1HB TYR 28 3.774 -8.096 9.163 216 HD1 TYR 28 1HD TYR 28 2.843 -10.387 9.542 217 HD2 TYR 28 2HD TYR 28 1.255 -7.818 6.557 218 HE1 TYR 28 1HE TYR 28 1.740 -12.323 8.465 219 HE2 TYR 28 2HE TYR 28 0.157 -9.743 5.475 220 HH TYR 28 HH TYR 28 -0.180 -12.777 6.927 221 H ARG 29 H ARG 29 3.630 -7.658 11.798 222 HA ARG 29 HA ARG 29 2.505 -10.167 12.561 223 HB2 ARG 29 2HB ARG 29 4.420 -8.528 14.217 224 HB3 ARG 29 1HB ARG 29 4.157 -10.258 14.287 225 HG2 ARG 29 2HG ARG 29 5.563 -8.678 12.152 226 HG3 ARG 29 1HG ARG 29 6.233 -9.902 13.221 227 HD2 ARG 29 2HD ARG 29 4.248 -10.336 10.998 228 HD3 ARG 29 1HD ARG 29 5.951 -10.762 10.961 229 HE ARG 29 HE ARG 29 4.312 -12.003 13.023 230 HH11 ARG 29 1HH1 ARG 29 5.993 -12.323 9.926 231 HH12 ARG 29 2HH1 ARG 29 5.770 -13.996 9.806 232 HH21 ARG 29 1HH2 ARG 29 3.983 -14.315 12.840 233 HH22 ARG 29 2HH2 ARG 29 4.594 -15.164 11.489 234 H ALA 30 H ALA 30 2.217 -6.910 13.650 235 HA ALA 30 HA ALA 30 1.065 -7.341 16.177 236 HB1 ALA 30 1HB ALA 30 1.867 -5.143 15.445 237 HB2 ALA 30 2HB ALA 30 0.199 -5.059 16.021 238 HB3 ALA 30 3HB ALA 30 0.538 -5.045 14.290 239 H LEU 31 H LEU 31 -0.473 -6.968 13.007 240 HA LEU 31 HA LEU 31 -3.034 -7.365 14.167 241 HB2 LEU 31 2HB LEU 31 -2.267 -7.214 11.287 242 HB3 LEU 31 1HB LEU 31 -3.906 -7.542 11.797 243 HG LEU 31 HG LEU 31 -3.655 -5.370 13.137 244 HD11 LEU 31 1HD1 LEU 31 -1.560 -4.936 11.058 245 HD12 LEU 31 2HD1 LEU 31 -1.299 -4.963 12.814 246 HD13 LEU 31 3HD1 LEU 31 -2.269 -3.680 12.060 247 HD21 LEU 31 1HD2 LEU 31 -4.534 -4.098 11.430 248 HD22 LEU 31 2HD2 LEU 31 -5.174 -5.708 11.266 249 HD23 LEU 31 3HD2 LEU 31 -3.915 -5.120 10.146 250 H GLU 32 H GLU 32 -0.813 -9.568 12.572 251 HA GLU 32 HA GLU 32 -2.909 -11.440 12.492 252 HB2 GLU 32 2HB GLU 32 -1.217 -13.136 11.790 253 HB3 GLU 32 1HB GLU 32 -1.505 -11.794 10.678 254 HG2 GLU 32 2HG GLU 32 0.789 -12.156 10.589 255 HG3 GLU 32 1HG GLU 32 0.648 -10.846 11.752 256 H GLU 33 H GLU 33 -0.527 -10.853 14.781 257 HA GLU 33 HA GLU 33 -1.137 -13.049 16.497 258 HB2 GLU 33 2HB GLU 33 -0.278 -10.243 17.200 259 HB3 GLU 33 1HB GLU 33 -0.489 -11.506 18.398 260 HG2 GLU 33 2HG GLU 33 1.438 -11.574 16.100 261 HG3 GLU 33 1HG GLU 33 1.848 -11.192 17.774 262 H LYS 34 H LYS 34 -2.750 -10.013 15.943 263 HA LYS 34 HA LYS 34 -4.695 -10.469 18.031 264 HB2 LYS 34 2HB LYS 34 -4.323 -8.290 16.015 265 HB3 LYS 34 1HB LYS 34 -5.808 -8.408 16.943 266 HG2 LYS 34 2HG LYS 34 -3.045 -8.135 18.114 267 HG3 LYS 34 1HG LYS 34 -4.207 -6.817 17.907 268 HD2 LYS 34 2HD LYS 34 -5.815 -8.070 19.321 269 HD3 LYS 34 1HD LYS 34 -4.585 -9.298 19.575 270 HE2 LYS 34 2HE LYS 34 -3.156 -7.648 20.633 271 HE3 LYS 34 1HE LYS 34 -4.386 -6.414 20.380 272 HZ1 LYS 34 1HZ LYS 34 -4.761 -8.890 21.966 273 HZ2 LYS 34 2HZ LYS 34 -5.902 -7.678 21.742 274 HZ3 LYS 34 3HZ LYS 34 -4.507 -7.351 22.622 275 H GLY 35 H GLY 35 -4.386 -11.581 14.938 276 HA2 GLY 35 2HA GLY 35 -5.803 -13.037 13.833 277 HA3 GLY 35 1HA GLY 35 -7.016 -12.726 15.067 278 H TYR 36 H TYR 36 -5.597 -10.042 13.453 279 HA TYR 36 HA TYR 36 -8.123 -9.598 12.018 280 HB2 TYR 36 2HB TYR 36 -5.816 -7.717 12.574 281 HB3 TYR 36 1HB TYR 36 -7.186 -7.307 11.565 282 HD1 TYR 36 1HD TYR 36 -5.815 -7.266 14.815 283 HD2 TYR 36 2HD TYR 36 -9.502 -7.388 12.719 284 HE1 TYR 36 1HE TYR 36 -6.964 -6.394 16.798 285 HE2 TYR 36 2HE TYR 36 -10.665 -6.518 14.693 286 HH TYR 36 HH TYR 36 -10.302 -6.452 17.117 287 H ASN 37 H ASN 37 -7.576 -8.273 9.898 288 HA ASN 37 HA ASN 37 -5.677 -9.874 8.377 289 HB2 ASN 37 2HB ASN 37 -7.784 -7.896 7.457 290 HB3 ASN 37 1HB ASN 37 -6.723 -8.790 6.385 291 HD21 ASN 37 1HD2 ASN 37 -7.065 -10.986 6.105 292 HD22 ASN 37 2HD2 ASN 37 -8.553 -11.745 6.552 293 HA PRO 38 HA PRO 38 -2.863 -6.462 9.467 294 HB2 PRO 38 2HB PRO 38 -1.317 -7.994 7.444 295 HB3 PRO 38 1HB PRO 38 -0.806 -7.336 9.001 296 HG2 PRO 38 2HG PRO 38 -1.311 -9.934 8.707 297 HG3 PRO 38 1HG PRO 38 -1.731 -9.077 10.197 298 HD2 PRO 38 2HD PRO 38 -3.501 -10.079 8.041 299 HD3 PRO 38 1HD PRO 38 -3.818 -9.802 9.770 300 H ILE 39 H ILE 39 -3.483 -7.681 6.247 301 HA ILE 39 HA ILE 39 -2.341 -5.485 4.898 302 HB ILE 39 HB ILE 39 -4.335 -7.511 3.888 303 HG12 ILE 39 2HG1 ILE 39 -2.346 -8.565 4.813 304 HG13 ILE 39 1HG1 ILE 39 -2.361 -8.712 3.063 305 HG21 ILE 39 1HG2 ILE 39 -3.454 -6.949 1.664 306 HG22 ILE 39 2HG2 ILE 39 -2.427 -5.711 2.388 307 HG23 ILE 39 3HG2 ILE 39 -4.182 -5.540 2.439 308 HD11 ILE 39 1HD1 ILE 39 -0.729 -6.880 2.920 309 HD12 ILE 39 2HD1 ILE 39 -0.127 -8.217 3.898 310 HD13 ILE 39 3HD1 ILE 39 -0.716 -6.757 4.678 311 H ASN 40 H ASN 40 -5.722 -6.316 5.637 312 HA ASN 40 HA ASN 40 -6.851 -4.165 4.251 313 HB2 ASN 40 2HB ASN 40 -7.962 -5.754 6.546 314 HB3 ASN 40 1HB ASN 40 -8.864 -4.462 5.768 315 HD21 ASN 40 1HD2 ASN 40 -9.510 -4.718 3.628 316 HD22 ASN 40 2HD2 ASN 40 -9.589 -6.257 2.879 317 H GLN 41 H GLN 41 -5.813 -4.329 7.638 318 HA GLN 41 HA GLN 41 -6.823 -1.727 7.886 319 HB2 GLN 41 2HB GLN 41 -5.363 -3.432 9.854 320 HB3 GLN 41 1HB GLN 41 -5.922 -1.797 10.246 321 HG2 GLN 41 2HG GLN 41 -8.230 -2.495 9.610 322 HG3 GLN 41 1HG GLN 41 -7.634 -4.124 9.361 323 HE21 GLN 41 1HE2 GLN 41 -9.685 -3.072 11.101 324 HE22 GLN 41 2HE2 GLN 41 -9.281 -3.558 12.706 325 H ILE 42 H ILE 42 -3.659 -2.982 7.169 326 HA ILE 42 HA ILE 42 -2.349 -0.489 7.464 327 HB ILE 42 HB ILE 42 -1.661 -2.786 5.585 328 HG12 ILE 42 2HG1 ILE 42 -0.439 -1.957 8.236 329 HG13 ILE 42 1HG1 ILE 42 -1.511 -3.329 7.993 330 HG21 ILE 42 1HG2 ILE 42 0.001 -0.342 6.269 331 HG22 ILE 42 2HG2 ILE 42 -0.722 -0.695 4.717 332 HG23 ILE 42 3HG2 ILE 42 0.564 -1.730 5.340 333 HD11 ILE 42 1HD1 ILE 42 0.163 -4.378 6.550 334 HD12 ILE 42 2HD1 ILE 42 0.807 -4.038 8.156 335 HD13 ILE 42 3HD1 ILE 42 1.233 -2.999 6.796 336 H VAL 43 H VAL 43 -3.846 -2.013 4.557 337 HA VAL 43 HA VAL 43 -3.394 0.191 2.896 338 HB VAL 43 HB VAL 43 -4.062 -1.915 1.806 339 HG11 VAL 43 1HG1 VAL 43 -5.540 -2.781 3.538 340 HG12 VAL 43 2HG1 VAL 43 -6.360 -2.786 1.972 341 HG13 VAL 43 3HG1 VAL 43 -6.738 -1.542 3.162 342 HG21 VAL 43 1HG2 VAL 43 -6.208 0.169 1.404 343 HG22 VAL 43 2HG2 VAL 43 -5.837 -1.156 0.297 344 HG23 VAL 43 3HG2 VAL 43 -4.644 0.106 0.593 345 H GLY 44 H GLY 44 -6.079 -0.485 5.071 346 HA2 GLY 44 2HA GLY 44 -7.693 1.712 4.466 347 HA3 GLY 44 1HA GLY 44 -7.612 0.920 6.037 348 H TYR 45 H TYR 45 -4.960 1.441 6.737 349 HA TYR 45 HA TYR 45 -5.136 4.027 7.779 350 HB2 TYR 45 2HB TYR 45 -3.733 2.424 8.925 351 HB3 TYR 45 1HB TYR 45 -2.696 2.250 7.510 352 HD1 TYR 45 1HD TYR 45 -0.841 3.724 7.183 353 HD2 TYR 45 2HD TYR 45 -3.778 4.675 10.097 354 HE1 TYR 45 1HE TYR 45 0.549 5.575 7.971 355 HE2 TYR 45 2HE TYR 45 -2.385 6.526 10.902 356 HH TYR 45 HH TYR 45 -0.104 7.240 10.872 357 H LEU 46 H LEU 46 -3.117 2.858 5.087 358 HA LEU 46 HA LEU 46 -2.066 5.442 4.682 359 HB2 LEU 46 2HB LEU 46 -2.036 3.093 2.809 360 HB3 LEU 46 1HB LEU 46 -1.328 4.631 2.383 361 HG LEU 46 HG LEU 46 0.177 4.326 4.457 362 HD11 LEU 46 1HD1 LEU 46 0.565 2.141 5.261 363 HD12 LEU 46 2HD1 LEU 46 -0.757 1.516 4.276 364 HD13 LEU 46 3HD1 LEU 46 -1.094 2.649 5.582 365 HD21 LEU 46 1HD2 LEU 46 1.000 4.080 2.198 366 HD22 LEU 46 2HD2 LEU 46 0.434 2.409 2.161 367 HD23 LEU 46 3HD2 LEU 46 1.722 2.878 3.267 368 H LEU 47 H LEU 47 -4.895 3.926 3.347 369 HA LEU 47 HA LEU 47 -5.250 5.883 1.328 370 HB2 LEU 47 2HB LEU 47 -7.289 4.039 2.560 371 HB3 LEU 47 1HB LEU 47 -7.562 5.031 1.144 372 HG LEU 47 HG LEU 47 -5.646 2.714 1.377 373 HD11 LEU 47 1HD1 LEU 47 -7.101 1.657 -0.261 374 HD12 LEU 47 2HD1 LEU 47 -8.184 3.046 -0.198 375 HD13 LEU 47 3HD1 LEU 47 -7.956 2.038 1.235 376 HD21 LEU 47 1HD2 LEU 47 -5.239 3.030 -1.018 377 HD22 LEU 47 2HD2 LEU 47 -4.694 4.411 -0.075 378 HD23 LEU 47 3HD2 LEU 47 -6.203 4.508 -0.989 379 H SER 48 H SER 48 -6.415 5.709 4.683 380 HA SER 48 HA SER 48 -7.916 8.184 4.167 381 HB2 SER 48 2HB SER 48 -9.045 7.660 6.306 382 HB3 SER 48 1HB SER 48 -9.215 6.390 5.092 383 HG SER 48 HG SER 48 -7.867 5.093 6.210 384 H GLY 49 H GLY 49 -5.114 6.998 5.915 385 HA2 GLY 49 2HA GLY 49 -3.574 8.185 7.076 386 HA3 GLY 49 1HA GLY 49 -4.606 9.613 7.001 387 H ASP 50 H ASP 50 -6.316 6.869 7.982 388 HA ASP 50 HA ASP 50 -6.566 7.965 10.653 389 HB2 ASP 50 2HB ASP 50 -8.589 7.402 9.447 390 HB3 ASP 50 1HB ASP 50 -8.077 5.724 9.321 391 HA PRO 51 HA PRO 51 -3.581 5.062 12.173 392 HB2 PRO 51 2HB PRO 51 -3.548 5.952 14.715 393 HB3 PRO 51 1HB PRO 51 -2.765 6.816 13.384 394 HG2 PRO 51 2HG PRO 51 -5.424 7.335 14.662 395 HG3 PRO 51 1HG PRO 51 -4.167 8.493 14.192 396 HD2 PRO 51 2HD PRO 51 -6.363 8.015 12.696 397 HD3 PRO 51 1HD PRO 51 -4.804 8.477 11.980 398 H ALA 52 H ALA 52 -6.822 5.441 13.348 399 HA ALA 52 HA ALA 52 -6.781 3.532 15.415 400 HB1 ALA 52 1HB ALA 52 -9.139 4.451 13.784 401 HB2 ALA 52 2HB ALA 52 -8.515 5.242 15.225 402 HB3 ALA 52 3HB ALA 52 -9.208 3.627 15.349 403 H TYR 53 H TYR 53 -6.664 3.099 12.075 404 HA TYR 53 HA TYR 53 -7.907 0.604 11.835 405 HB2 TYR 53 2HB TYR 53 -5.830 2.019 10.239 406 HB3 TYR 53 1HB TYR 53 -6.195 0.325 9.906 407 HD1 TYR 53 1HD TYR 53 -8.326 -0.353 9.177 408 HD2 TYR 53 2HD TYR 53 -7.456 3.745 9.745 409 HE1 TYR 53 1HE TYR 53 -10.294 0.194 7.939 410 HE2 TYR 53 2HE TYR 53 -9.475 4.354 8.475 411 HH TYR 53 HH TYR 53 -10.975 3.373 6.821 412 H ILE 54 H ILE 54 -4.737 1.524 13.034 413 HA ILE 54 HA ILE 54 -3.980 -1.287 13.073 414 HB ILE 54 HB ILE 54 -2.306 1.173 13.683 415 HG12 ILE 54 2HG1 ILE 54 -2.861 1.076 11.311 416 HG13 ILE 54 1HG1 ILE 54 -1.171 0.645 11.541 417 HG21 ILE 54 1HG2 ILE 54 -0.369 -0.340 13.639 418 HG22 ILE 54 2HG2 ILE 54 -1.450 -1.714 13.430 419 HG23 ILE 54 3HG2 ILE 54 -1.500 -0.776 14.923 420 HD11 ILE 54 1HD1 ILE 54 -3.425 -1.298 11.057 421 HD12 ILE 54 2HD1 ILE 54 -1.725 -1.713 11.271 422 HD13 ILE 54 3HD1 ILE 54 -2.230 -0.768 9.873 423 HA PRO 55 HA PRO 55 -5.447 -1.356 17.251 424 HB2 PRO 55 2HB PRO 55 -4.604 -3.879 17.868 425 HB3 PRO 55 1HB PRO 55 -6.053 -3.547 16.917 426 HG2 PRO 55 2HG PRO 55 -3.321 -4.335 16.000 427 HG3 PRO 55 1HG PRO 55 -4.901 -4.871 15.402 428 HD2 PRO 55 2HD PRO 55 -3.392 -3.012 14.134 429 HD3 PRO 55 1HD PRO 55 -5.166 -3.003 14.074 430 H ARG 56 H ARG 56 -4.585 -0.830 19.181 431 HA ARG 56 HA ARG 56 -1.741 -0.525 19.255 432 HB2 ARG 56 2HB ARG 56 -2.043 0.695 21.387 433 HB3 ARG 56 1HB ARG 56 -2.994 1.360 20.071 434 HG2 ARG 56 2HG ARG 56 -4.989 0.286 20.965 435 HG3 ARG 56 1HG ARG 56 -4.031 -0.420 22.266 436 HD2 ARG 56 2HD ARG 56 -3.418 1.873 22.982 437 HD3 ARG 56 1HD ARG 56 -4.506 2.508 21.747 438 HE ARG 56 HE ARG 56 -6.087 0.847 23.106 439 HH11 ARG 56 1HH1 ARG 56 -4.001 3.548 24.112 440 HH12 ARG 56 2HH1 ARG 56 -4.843 3.844 25.549 441 HH21 ARG 56 1HH2 ARG 56 -7.271 1.316 25.119 442 HH22 ARG 56 2HH2 ARG 56 -6.697 2.562 26.133 443 H TYR 57 H TYR 57 -1.441 -2.734 19.115 444 HA TYR 57 HA TYR 57 -1.287 -4.138 21.708 445 HB2 TYR 57 2HB TYR 57 -2.421 -5.502 20.125 446 HB3 TYR 57 1HB TYR 57 -1.308 -5.079 18.837 447 HD1 TYR 57 1HD TYR 57 -1.636 -7.080 21.972 448 HD2 TYR 57 2HD TYR 57 0.632 -6.359 18.441 449 HE1 TYR 57 1HE TYR 57 -0.305 -9.111 22.403 450 HE2 TYR 57 2HE TYR 57 1.959 -8.360 18.862 451 HH TYR 57 HH TYR 57 1.079 -10.726 21.128 452 H GLN 58 H GLN 58 0.498 -2.488 19.351 453 HA GLN 58 HA GLN 58 3.036 -3.400 20.422 454 HB2 GLN 58 2HB GLN 58 2.323 -4.964 18.590 455 HB3 GLN 58 1HB GLN 58 2.253 -3.583 17.515 456 HG2 GLN 58 2HG GLN 58 4.698 -3.265 17.904 457 HG3 GLN 58 1HG GLN 58 4.655 -4.791 18.805 458 HE21 GLN 58 1HE2 GLN 58 4.369 -6.717 17.708 459 HE22 GLN 58 2HE2 GLN 58 4.476 -6.787 15.985 460 H ASP 59 H ASP 59 4.779 -2.013 19.383 461 HA ASP 59 HA ASP 59 4.211 0.745 19.346 462 HB2 ASP 59 2HB ASP 59 6.593 -0.545 18.008 463 HB3 ASP 59 1HB ASP 59 6.421 1.121 18.459 464 H ALA 60 H ALA 60 3.633 -1.575 17.050 465 HA ALA 60 HA ALA 60 4.165 -0.568 14.569 466 HB1 ALA 60 1HB ALA 60 3.178 -2.753 14.969 467 HB2 ALA 60 2HB ALA 60 2.237 -1.849 13.784 468 HB3 ALA 60 3HB ALA 60 1.661 -1.990 15.443 469 H ARG 61 H ARG 61 1.421 0.265 16.667 470 HA ARG 61 HA ARG 61 0.196 1.901 14.747 471 HB2 ARG 61 2HB ARG 61 -1.198 2.843 16.605 472 HB3 ARG 61 1HB ARG 61 -1.193 1.099 16.549 473 HG2 ARG 61 2HG ARG 61 -1.133 1.711 18.837 474 HG3 ARG 61 1HG ARG 61 0.494 1.169 18.447 475 HD2 ARG 61 2HD ARG 61 0.525 3.169 19.849 476 HD3 ARG 61 1HD ARG 61 1.218 3.512 18.264 477 HE ARG 61 HE ARG 61 -1.542 4.100 18.316 478 HH11 ARG 61 1HH1 ARG 61 1.539 5.410 19.500 479 HH12 ARG 61 2HH1 ARG 61 1.012 7.028 19.462 480 HH21 ARG 61 1HH2 ARG 61 -2.257 6.305 18.342 481 HH22 ARG 61 2HH2 ARG 61 -1.205 7.546 18.819 482 H ASN 62 H ASN 62 2.704 2.556 17.013 483 HA ASN 62 HA ASN 62 2.737 5.413 16.606 484 HB2 ASN 62 2HB ASN 62 3.721 4.214 18.689 485 HB3 ASN 62 1HB ASN 62 4.920 3.603 17.609 486 HD21 ASN 62 1HD2 ASN 62 6.613 4.819 16.927 487 HD22 ASN 62 2HD2 ASN 62 6.924 6.417 17.478 488 H LEU 63 H LEU 63 4.609 2.643 15.564 489 HA LEU 63 HA LEU 63 6.604 3.897 14.079 490 HB2 LEU 63 2HB LEU 63 5.396 1.183 13.598 491 HB3 LEU 63 1HB LEU 63 6.957 1.746 13.040 492 HG LEU 63 HG LEU 63 6.168 1.285 15.910 493 HD11 LEU 63 1HD1 LEU 63 7.973 -0.282 14.084 494 HD12 LEU 63 2HD1 LEU 63 6.411 -0.786 14.725 495 HD13 LEU 63 3HD1 LEU 63 7.771 -0.556 15.818 496 HD21 LEU 63 1HD2 LEU 63 8.812 2.118 14.723 497 HD22 LEU 63 2HD2 LEU 63 8.550 1.670 16.407 498 HD23 LEU 63 3HD2 LEU 63 7.772 3.108 15.743 499 H ILE 64 H ILE 64 3.419 2.715 13.073 500 HA ILE 64 HA ILE 64 3.942 3.285 10.334 501 HB ILE 64 HB ILE 64 2.333 1.500 11.200 502 HG12 ILE 64 2HG1 ILE 64 1.146 3.452 9.211 503 HG13 ILE 64 1HG1 ILE 64 2.386 2.266 8.824 504 HG21 ILE 64 1HG2 ILE 64 0.532 3.888 11.612 505 HG22 ILE 64 2HG2 ILE 64 1.173 2.837 12.875 506 HG23 ILE 64 3HG2 ILE 64 0.024 2.203 11.695 507 HD11 ILE 64 1HD1 ILE 64 0.832 0.466 9.418 508 HD12 ILE 64 2HD1 ILE 64 0.194 1.487 8.130 509 HD13 ILE 64 3HD1 ILE 64 -0.408 1.669 9.776 510 H ARG 65 H ARG 65 2.982 5.204 13.014 511 HA ARG 65 HA ARG 65 1.654 7.174 11.359 512 HB2 ARG 65 2HB ARG 65 2.249 7.217 14.294 513 HB3 ARG 65 1HB ARG 65 1.449 8.525 13.446 514 HG2 ARG 65 2HG ARG 65 -0.278 6.738 12.796 515 HG3 ARG 65 1HG ARG 65 0.475 5.776 14.060 516 HD2 ARG 65 2HD ARG 65 -1.406 7.002 14.997 517 HD3 ARG 65 1HD ARG 65 0.113 7.602 15.668 518 HE ARG 65 HE ARG 65 -0.308 9.198 13.511 519 HH11 ARG 65 1HH1 ARG 65 -2.323 8.500 16.375 520 HH12 ARG 65 2HH1 ARG 65 -3.075 10.021 16.328 521 HH21 ARG 65 1HH2 ARG 65 -1.373 11.225 13.479 522 HH22 ARG 65 2HH2 ARG 65 -2.545 11.589 14.676 523 H ARG 66 H ARG 66 4.794 6.615 12.658 524 HA ARG 66 HA ARG 66 5.572 9.378 12.452 525 HB2 ARG 66 2HB ARG 66 7.884 8.648 12.872 526 HB3 ARG 66 1HB ARG 66 6.774 8.003 14.064 527 HG2 ARG 66 2HG ARG 66 6.855 5.835 13.043 528 HG3 ARG 66 1HG ARG 66 7.802 6.462 11.695 529 HD2 ARG 66 2HD ARG 66 8.684 6.417 14.586 530 HD3 ARG 66 1HD ARG 66 9.205 5.279 13.343 531 HE ARG 66 HE ARG 66 9.735 7.777 12.344 532 HH11 ARG 66 1HH1 ARG 66 10.833 5.894 15.147 533 HH12 ARG 66 2HH1 ARG 66 12.352 6.648 15.235 534 HH21 ARG 66 1HH2 ARG 66 11.796 8.819 12.489 535 HH22 ARG 66 2HH2 ARG 66 12.916 8.363 13.690 536 H HIS 67 H HIS 67 5.492 6.693 10.392 537 HA HIS 67 HA HIS 67 7.016 8.101 8.353 538 HB2 HIS 67 2HB HIS 67 5.765 5.351 8.396 539 HB3 HIS 67 1HB HIS 67 6.515 6.041 6.961 540 HD1 HIS 67 1HD HIS 67 9.047 6.149 6.923 541 HD2 HIS 67 2HD HIS 67 7.512 4.435 10.373 542 HE1 HIS 67 1HE HIS 67 10.999 4.958 8.031 543 HE2 HIS 67 2HE HIS 67 10.083 4.219 10.244 544 H GLU 68 H GLU 68 6.053 9.112 6.715 545 HA GLU 68 HA GLU 68 3.296 9.683 6.994 546 HB2 GLU 68 2HB GLU 68 5.208 10.393 4.770 547 HB3 GLU 68 1HB GLU 68 3.587 11.047 4.939 548 HG2 GLU 68 2HG GLU 68 5.849 11.403 6.901 549 HG3 GLU 68 1HG GLU 68 5.262 12.610 5.761 550 H ARG 69 H ARG 69 1.577 9.234 5.601 551 HA ARG 69 HA ARG 69 1.451 6.544 4.821 552 HB2 ARG 69 2HB ARG 69 -0.456 8.800 4.021 553 HB3 ARG 69 1HB ARG 69 -0.715 7.113 3.696 554 HG2 ARG 69 2HG ARG 69 -2.123 7.656 5.496 555 HG3 ARG 69 1HG ARG 69 -0.792 6.773 6.212 556 HD2 ARG 69 2HD ARG 69 -0.956 9.795 6.191 557 HD3 ARG 69 1HD ARG 69 -1.672 8.826 7.453 558 HE ARG 69 HE ARG 69 0.800 7.953 7.601 559 HH11 ARG 69 1HH1 ARG 69 -0.292 11.333 7.218 560 HH12 ARG 69 2HH1 ARG 69 1.000 11.962 8.122 561 HH21 ARG 69 1HH2 ARG 69 2.548 8.881 8.842 562 HH22 ARG 69 2HH2 ARG 69 2.676 10.567 9.003 563 H ASP 70 H ASP 70 1.835 9.497 2.984 564 HA ASP 70 HA ASP 70 1.838 8.349 0.392 565 HB2 ASP 70 2HB ASP 70 3.223 10.885 1.320 566 HB3 ASP 70 1HB ASP 70 2.970 10.430 -0.355 567 H GLU 71 H GLU 71 4.367 8.966 2.728 568 HA GLU 71 HA GLU 71 6.642 8.462 1.201 569 HB2 GLU 71 2HB GLU 71 6.726 9.418 3.456 570 HB3 GLU 71 1HB GLU 71 6.173 7.893 4.136 571 HG2 GLU 71 2HG GLU 71 8.240 6.841 3.208 572 HG3 GLU 71 1HG GLU 71 8.796 8.456 2.781 573 H ILE 72 H ILE 72 4.858 6.299 3.348 574 HA ILE 72 HA ILE 72 6.279 3.928 2.866 575 HB ILE 72 HB ILE 72 3.387 4.282 3.659 576 HG12 ILE 72 2HG1 ILE 72 5.842 3.912 5.395 577 HG13 ILE 72 1HG1 ILE 72 4.934 5.405 5.200 578 HG21 ILE 72 1HG2 ILE 72 3.794 2.011 2.881 579 HG22 ILE 72 2HG2 ILE 72 3.548 2.025 4.630 580 HG23 ILE 72 3HG2 ILE 72 5.175 1.874 3.970 581 HD11 ILE 72 1HD1 ILE 72 3.890 2.852 6.413 582 HD12 ILE 72 2HD1 ILE 72 2.979 4.349 6.229 583 HD13 ILE 72 3HD1 ILE 72 4.379 4.295 7.298 584 H MET 73 H MET 73 3.522 5.371 1.283 585 HA MET 73 HA MET 73 2.720 3.092 -0.166 586 HB2 MET 73 2HB MET 73 1.501 5.346 0.435 587 HB3 MET 73 1HB MET 73 2.151 5.865 -1.109 588 HG2 MET 73 2HG MET 73 0.333 3.507 -0.654 589 HG3 MET 73 1HG MET 73 -0.121 5.073 -1.312 590 HE1 MET 73 1HE MET 73 -0.468 2.538 -4.239 591 HE2 MET 73 2HE MET 73 -1.306 3.685 -3.186 592 HE3 MET 73 3HE MET 73 -0.670 2.177 -2.526 593 H GLU 74 H GLU 74 4.761 5.900 -1.029 594 HA GLU 74 HA GLU 74 5.217 5.222 -3.720 595 HB2 GLU 74 2HB GLU 74 7.099 6.591 -1.798 596 HB3 GLU 74 1HB GLU 74 7.309 6.539 -3.537 597 HG2 GLU 74 2HG GLU 74 5.223 7.792 -3.802 598 HG3 GLU 74 1HG GLU 74 5.068 7.875 -2.045 599 H GLU 75 H GLU 75 6.770 4.210 -0.768 600 HA GLU 75 HA GLU 75 8.955 2.848 -1.900 601 HB2 GLU 75 2HB GLU 75 8.680 3.572 0.497 602 HB3 GLU 75 1HB GLU 75 7.558 2.236 0.703 603 HG2 GLU 75 2HG GLU 75 9.748 1.651 1.545 604 HG3 GLU 75 1HG GLU 75 9.345 0.665 0.136 605 H LEU 76 H LEU 76 5.706 1.819 -0.935 606 HA LEU 76 HA LEU 76 5.881 -0.936 -1.482 607 HB2 LEU 76 2HB LEU 76 3.496 0.886 -1.833 608 HB3 LEU 76 1HB LEU 76 3.436 -0.859 -1.757 609 HG LEU 76 HG LEU 76 4.245 0.968 0.505 610 HD11 LEU 76 1HD1 LEU 76 2.128 0.281 1.501 611 HD12 LEU 76 2HD1 LEU 76 1.743 -0.649 0.056 612 HD13 LEU 76 3HD1 LEU 76 1.868 1.107 -0.034 613 HD21 LEU 76 1HD2 LEU 76 3.829 -2.014 0.415 614 HD22 LEU 76 2HD2 LEU 76 4.137 -1.058 1.863 615 HD23 LEU 76 3HD2 LEU 76 5.373 -1.183 0.615 616 H THR 77 H THR 77 4.811 1.760 -3.494 617 HA THR 77 HA THR 77 4.171 0.337 -5.793 618 HB THR 77 HB THR 77 5.130 3.201 -5.542 619 HG1 THR 77 1HG THR 77 3.282 2.975 -4.267 620 HG21 THR 77 1HG2 THR 77 5.124 2.397 -7.873 621 HG22 THR 77 2HG2 THR 77 3.836 3.572 -7.608 622 HG23 THR 77 3HG2 THR 77 3.457 1.851 -7.682 623 H LYS 78 H LYS 78 7.209 1.979 -4.902 624 HA LYS 78 HA LYS 78 8.496 1.402 -7.344 625 HB2 LYS 78 2HB LYS 78 9.684 2.151 -4.682 626 HB3 LYS 78 1HB LYS 78 10.611 2.020 -6.173 627 HG2 LYS 78 2HG LYS 78 9.142 3.720 -7.161 628 HG3 LYS 78 1HG LYS 78 8.364 3.934 -5.597 629 HD2 LYS 78 2HD LYS 78 11.306 4.387 -6.178 630 HD3 LYS 78 1HD LYS 78 10.100 5.656 -5.976 631 HE2 LYS 78 2HE LYS 78 9.705 4.875 -3.677 632 HE3 LYS 78 1HE LYS 78 10.931 3.632 -3.920 633 HZ1 LYS 78 1HZ LYS 78 12.597 5.353 -4.200 634 HZ2 LYS 78 2HZ LYS 78 11.798 5.530 -2.730 635 HZ3 LYS 78 3HZ LYS 78 11.428 6.567 -3.996 636 H TYR 79 H TYR 79 8.611 -0.189 -4.247 637 HA TYR 79 HA TYR 79 10.632 -2.025 -4.996 638 HB2 TYR 79 2HB TYR 79 9.838 -1.435 -2.641 639 HB3 TYR 79 1HB TYR 79 8.504 -2.540 -2.933 640 HD1 TYR 79 1HD TYR 79 11.898 -2.199 -1.925 641 HD2 TYR 79 2HD TYR 79 9.067 -4.951 -3.432 642 HE1 TYR 79 1HE TYR 79 13.321 -4.054 -1.135 643 HE2 TYR 79 2HE TYR 79 10.475 -6.837 -2.637 644 HH TYR 79 HH TYR 79 12.766 -7.254 -2.114 645 H TYR 80 H TYR 80 7.123 -2.097 -5.222 646 HA TYR 80 HA TYR 80 6.788 -4.775 -6.025 647 HB2 TYR 80 2HB TYR 80 4.948 -3.315 -5.252 648 HB3 TYR 80 1HB TYR 80 5.134 -2.326 -6.689 649 HD1 TYR 80 1HD TYR 80 3.924 -5.519 -5.367 650 HD2 TYR 80 2HD TYR 80 4.236 -3.074 -8.828 651 HE1 TYR 80 1HE TYR 80 2.244 -6.907 -6.492 652 HE2 TYR 80 2HE TYR 80 2.559 -4.464 -9.972 653 HH TYR 80 HH TYR 80 0.675 -6.761 -8.280 654 H LEU 81 H LEU 81 7.158 -1.772 -7.868 655 HA LEU 81 HA LEU 81 7.020 -3.086 -10.384 656 HB2 LEU 81 2HB LEU 81 7.882 -0.304 -9.671 657 HB3 LEU 81 1HB LEU 81 7.726 -0.888 -11.316 658 HG LEU 81 HG LEU 81 5.492 -0.653 -9.300 659 HD11 LEU 81 1HD1 LEU 81 4.671 1.111 -10.761 660 HD12 LEU 81 2HD1 LEU 81 6.095 0.919 -11.788 661 HD13 LEU 81 3HD1 LEU 81 6.274 1.504 -10.133 662 HD21 LEU 81 1HD2 LEU 81 4.042 -1.186 -11.207 663 HD22 LEU 81 2HD2 LEU 81 5.100 -2.531 -10.800 664 HD23 LEU 81 3HD2 LEU 81 5.462 -1.507 -12.194 665 H ALA 82 H ALA 82 9.651 -2.438 -8.220 666 HA ALA 82 HA ALA 82 11.700 -2.496 -10.156 667 HB1 ALA 82 1HB ALA 82 12.059 -1.650 -7.896 668 HB2 ALA 82 2HB ALA 82 13.209 -2.925 -8.312 669 HB3 ALA 82 3HB ALA 82 11.844 -3.284 -7.250 670 H ASN 83 H ASN 83 9.923 -4.959 -8.500 671 HA ASN 83 HA ASN 83 11.698 -7.044 -9.361 672 HB2 ASN 83 2HB ASN 83 9.068 -7.157 -7.897 673 HB3 ASN 83 1HB ASN 83 9.895 -8.609 -8.444 674 HD21 ASN 83 1HD2 ASN 83 10.009 -5.906 -6.188 675 HD22 ASN 83 2HD2 ASN 83 11.254 -6.597 -5.217 676 H HIS 84 H HIS 84 9.544 -5.288 -10.994 677 HA HIS 84 HA HIS 84 8.795 -7.435 -12.825 678 HB2 HIS 84 2HB HIS 84 8.141 -4.482 -12.798 679 HB3 HIS 84 1HB HIS 84 7.829 -5.478 -14.210 680 HD1 HIS 84 1HD HIS 84 5.841 -6.980 -14.148 681 HD2 HIS 84 2HD HIS 84 6.452 -4.953 -10.608 682 HE1 HIS 84 1HE HIS 84 3.806 -7.446 -12.760 683 HE2 HIS 84 2HE HIS 84 4.523 -6.677 -10.514 684 H GLY 85 H GLY 85 11.521 -5.968 -12.191 685 HA2 GLY 85 2HA GLY 85 13.483 -5.946 -13.422 686 HA3 GLY 85 1HA GLY 85 12.549 -6.375 -14.850 687 H ILE 86 H ILE 86 11.417 -3.766 -12.981 688 HA ILE 86 HA ILE 86 12.035 -2.017 -15.216 689 HB ILE 86 HB ILE 86 10.049 -1.735 -12.954 690 HG12 ILE 86 2HG1 ILE 86 9.669 -2.197 -15.917 691 HG13 ILE 86 1HG1 ILE 86 9.411 -3.384 -14.643 692 HG21 ILE 86 1HG2 ILE 86 9.248 0.274 -14.107 693 HG22 ILE 86 2HG2 ILE 86 10.565 0.123 -15.273 694 HG23 ILE 86 3HG2 ILE 86 10.921 0.452 -13.578 695 HD11 ILE 86 1HD1 ILE 86 7.895 -0.829 -15.010 696 HD12 ILE 86 2HD1 ILE 86 7.590 -2.041 -13.759 697 HD13 ILE 86 3HD1 ILE 86 7.321 -2.432 -15.469 698 H ASP 87 H ASP 87 13.462 -0.501 -15.039 699 HA ASP 87 HA ASP 87 14.850 -0.126 -12.515 700 HB2 ASP 87 2HB ASP 87 16.083 -0.334 -14.701 701 HB3 ASP 87 1HB ASP 87 15.321 1.164 -15.220 702 H ILE 88 H ILE 88 14.179 1.413 -11.156 703 HA ILE 88 HA ILE 88 12.223 3.259 -12.207 704 HB ILE 88 HB ILE 88 12.876 2.527 -9.386 705 HG12 ILE 88 2HG1 ILE 88 10.535 1.914 -11.179 706 HG13 ILE 88 1HG1 ILE 88 11.783 0.790 -10.669 707 HG21 ILE 88 1HG2 ILE 88 10.911 3.861 -8.707 708 HG22 ILE 88 2HG2 ILE 88 10.696 4.388 -10.381 709 HG23 ILE 88 3HG2 ILE 88 12.126 4.872 -9.474 710 HD11 ILE 88 1HD1 ILE 88 9.765 2.132 -8.920 711 HD12 ILE 88 2HD1 ILE 88 11.020 1.018 -8.377 712 HD13 ILE 88 3HD1 ILE 88 9.752 0.449 -9.461 713 H LYS 89 H LYS 89 12.532 5.084 -12.518 714 HA LYS 89 HA LYS 89 15.092 6.398 -11.791 715 HB2 LYS 89 2HB LYS 89 13.356 6.886 -14.208 716 HB3 LYS 89 1HB LYS 89 14.978 7.508 -13.928 717 HG2 LYS 89 2HG LYS 89 15.898 5.275 -14.110 718 HG3 LYS 89 1HG LYS 89 14.279 4.593 -14.258 719 HD2 LYS 89 2HD LYS 89 13.987 5.923 -16.345 720 HD3 LYS 89 1HD LYS 89 15.670 6.431 -16.198 721 HE2 LYS 89 2HE LYS 89 14.702 3.581 -16.473 722 HE3 LYS 89 1HE LYS 89 15.418 4.548 -17.755 723 HZ1 LYS 89 1HZ LYS 89 16.754 3.630 -15.260 724 HZ2 LYS 89 2HZ LYS 89 17.461 4.667 -16.408 725 HZ3 LYS 89 3HZ LYS 89 17.037 3.076 -16.813 726 H1 MET 1 H MET 1 -7.912 13.752 15.124 727 HA MET 1 HA MET 1 -7.096 16.064 13.715 728 HB2 MET 1 2HB MET 1 -5.169 15.922 15.214 729 HB3 MET 1 1HB MET 1 -4.965 14.221 14.821 730 HG2 MET 1 2HG MET 1 -4.478 14.829 12.489 731 HG3 MET 1 1HG MET 1 -4.637 16.528 12.908 732 HE1 MET 1 1HE MET 1 -0.785 16.080 12.293 733 HE2 MET 1 2HE MET 1 -2.234 16.977 11.837 734 HE3 MET 1 3HE MET 1 -2.098 15.263 11.443 735 H GLY 2 H GLY 2 -7.197 15.600 11.612 736 HA2 GLY 2 2HA GLY 2 -6.691 14.270 9.742 737 HA3 GLY 2 1HA GLY 2 -6.762 12.848 10.776 738 H PHE 3 H PHE 3 -8.068 12.252 8.807 739 HA PHE 3 HA PHE 3 -10.879 12.664 9.423 740 HB2 PHE 3 2HB PHE 3 -9.700 12.828 6.634 741 HB3 PHE 3 1HB PHE 3 -11.408 12.897 7.039 742 HD1 PHE 3 1HD PHE 3 -12.276 14.899 8.274 743 HD2 PHE 3 2HD PHE 3 -8.328 14.734 6.702 744 HE1 PHE 3 1HE PHE 3 -12.105 17.342 8.443 745 HE2 PHE 3 2HE PHE 3 -8.157 17.185 6.871 746 HZ PHE 3 HZ PHE 3 -10.045 18.486 7.743 747 H THR 4 H THR 4 -11.544 10.647 9.862 748 HA THR 4 HA THR 4 -10.283 8.291 8.849 749 HB THR 4 HB THR 4 -13.029 8.590 10.138 750 HG1 THR 4 1HG THR 4 -10.501 8.038 11.375 751 HG21 THR 4 1HG2 THR 4 -12.628 6.379 9.085 752 HG22 THR 4 2HG2 THR 4 -12.705 6.252 10.844 753 HG23 THR 4 3HG2 THR 4 -11.145 6.216 10.024 754 H ASP 5 H ASP 5 -12.583 10.493 7.735 755 HA ASP 5 HA ASP 5 -13.706 10.811 5.803 756 HB2 ASP 5 2HB ASP 5 -11.600 9.686 4.812 757 HB3 ASP 5 1HB ASP 5 -12.516 8.192 4.800 758 H GLU 6 H GLU 6 -15.229 9.180 4.242 759 HA GLU 6 HA GLU 6 -16.862 7.732 6.214 760 HB2 GLU 6 2HB GLU 6 -18.795 8.234 4.809 761 HB3 GLU 6 1HB GLU 6 -17.960 9.711 5.255 762 HG2 GLU 6 2HG GLU 6 -16.872 9.711 3.031 763 HG3 GLU 6 1HG GLU 6 -17.845 8.308 2.601 764 H THR 7 H THR 7 -14.741 7.392 3.780 765 HA THR 7 HA THR 7 -15.867 5.368 2.201 766 HB THR 7 HB THR 7 -12.965 6.081 2.640 767 HG1 THR 7 1HG THR 7 -14.028 7.808 1.819 768 HG21 THR 7 1HG2 THR 7 -14.304 4.526 0.412 769 HG22 THR 7 2HG2 THR 7 -13.239 3.857 1.644 770 HG23 THR 7 3HG2 THR 7 -12.602 4.995 0.459 771 H VAL 8 H VAL 8 -16.435 3.472 2.922 772 HA VAL 8 HA VAL 8 -14.447 1.873 4.263 773 HB VAL 8 HB VAL 8 -16.006 2.487 6.058 774 HG11 VAL 8 1HG1 VAL 8 -18.386 1.900 6.009 775 HG12 VAL 8 2HG1 VAL 8 -18.217 1.417 4.320 776 HG13 VAL 8 3HG1 VAL 8 -17.961 3.097 4.784 777 HG21 VAL 8 1HG2 VAL 8 -15.119 0.232 6.142 778 HG22 VAL 8 2HG2 VAL 8 -16.460 -0.354 5.156 779 HG23 VAL 8 3HG2 VAL 8 -16.764 0.257 6.779 780 H ARG 9 H ARG 9 -13.891 0.579 2.658 781 HA ARG 9 HA ARG 9 -16.026 -0.292 0.880 782 HB2 ARG 9 2HB ARG 9 -13.087 -0.039 0.348 783 HB3 ARG 9 1HB ARG 9 -14.225 -0.768 -0.769 784 HG2 ARG 9 2HG ARG 9 -15.438 1.349 -0.917 785 HG3 ARG 9 1HG ARG 9 -14.299 2.075 0.221 786 HD2 ARG 9 2HD ARG 9 -12.471 1.657 -1.338 787 HD3 ARG 9 1HD ARG 9 -13.594 0.904 -2.464 788 HE ARG 9 HE ARG 9 -14.702 3.287 -2.195 789 HH11 ARG 9 1HH1 ARG 9 -11.324 2.399 -2.782 790 HH12 ARG 9 2HH1 ARG 9 -10.938 3.857 -3.582 791 HH21 ARG 9 1HH2 ARG 9 -14.200 5.220 -3.318 792 HH22 ARG 9 2HH2 ARG 9 -12.637 5.511 -3.948 793 H PHE 10 H PHE 10 -16.322 -2.239 0.242 794 HA PHE 10 HA PHE 10 -14.579 -4.403 1.034 795 HB2 PHE 10 2HB PHE 10 -17.623 -4.467 1.263 796 HB3 PHE 10 1HB PHE 10 -16.572 -5.857 1.458 797 HD1 PHE 10 1HD PHE 10 -18.003 -2.932 3.031 798 HD2 PHE 10 2HD PHE 10 -15.079 -5.996 3.438 799 HE1 PHE 10 1HE PHE 10 -17.852 -2.459 5.438 800 HE2 PHE 10 2HE PHE 10 -14.924 -5.533 5.849 801 HZ PHE 10 HZ PHE 10 -16.309 -3.762 6.852 802 H ASP 11 H ASP 11 -13.830 -4.075 -1.040 803 HA ASP 11 HA ASP 11 -15.534 -3.846 -3.301 804 HB2 ASP 11 2HB ASP 11 -13.443 -3.803 -4.567 805 HB3 ASP 11 1HB ASP 11 -13.376 -2.721 -3.181 806 H PHE 12 H PHE 12 -14.172 -6.449 -1.605 807 HA PHE 12 HA PHE 12 -14.247 -8.667 -1.815 808 HB2 PHE 12 2HB PHE 12 -16.600 -8.553 -2.385 809 HB3 PHE 12 1HB PHE 12 -16.231 -8.094 -4.039 810 HD1 PHE 12 1HD PHE 12 -15.840 -10.876 -1.614 811 HD2 PHE 12 2HD PHE 12 -16.109 -9.739 -5.698 812 HE1 PHE 12 1HE PHE 12 -15.945 -13.253 -2.272 813 HE2 PHE 12 2HE PHE 12 -16.206 -12.102 -6.363 814 HZ PHE 12 HZ PHE 12 -16.122 -13.862 -4.645 815 H ASP 13 H ASP 13 -12.151 -8.941 -2.240 816 HA ASP 13 HA ASP 13 -11.523 -9.348 -5.057 817 HB2 ASP 13 2HB ASP 13 -10.088 -7.615 -4.300 818 HB3 ASP 13 1HB ASP 13 -9.717 -8.512 -2.826 819 H ASP 14 H ASP 14 -11.654 -11.228 -5.555 820 HA ASP 14 HA ASP 14 -10.187 -13.313 -4.110 821 HB2 ASP 14 2HB ASP 14 -12.680 -13.457 -3.606 822 HB3 ASP 14 1HB ASP 14 -12.967 -13.608 -5.333 823 H ASN 15 H ASN 15 -9.817 -11.413 -6.286 824 HA ASN 15 HA ASN 15 -9.912 -13.080 -8.692 825 HB2 ASN 15 2HB ASN 15 -10.048 -10.085 -8.332 826 HB3 ASN 15 1HB ASN 15 -9.971 -10.910 -9.886 827 HD21 ASN 15 1HD2 ASN 15 -11.757 -12.009 -10.610 828 HD22 ASN 15 2HD2 ASN 15 -13.327 -11.798 -9.911 829 H ARG 16 H ARG 16 -7.797 -12.951 -6.602 830 HA ARG 16 HA ARG 16 -5.754 -11.395 -7.639 831 HB2 ARG 16 2HB ARG 16 -4.100 -12.786 -6.317 832 HB3 ARG 16 1HB ARG 16 -5.377 -12.030 -5.407 833 HG2 ARG 16 2HG ARG 16 -4.990 -14.184 -4.478 834 HG3 ARG 16 1HG ARG 16 -6.524 -14.264 -5.328 835 HD2 ARG 16 2HD ARG 16 -5.464 -15.418 -7.179 836 HD3 ARG 16 1HD ARG 16 -3.882 -15.243 -6.421 837 HE ARG 16 HE ARG 16 -5.314 -16.497 -4.542 838 HH11 ARG 16 1HH1 ARG 16 -4.772 -17.241 -7.989 839 HH12 ARG 16 2HH1 ARG 16 -4.887 -18.915 -7.785 840 HH21 ARG 16 1HH2 ARG 16 -5.427 -18.856 -4.282 841 HH22 ARG 16 2HH2 ARG 16 -5.252 -19.846 -5.639 842 H LYS 17 H LYS 17 -4.529 -11.433 -9.204 843 HA LYS 17 HA LYS 17 -3.990 -13.802 -10.768 844 HB2 LYS 17 2HB LYS 17 -6.339 -13.096 -11.324 845 HB3 LYS 17 1HB LYS 17 -5.725 -11.523 -11.791 846 HG2 LYS 17 2HG LYS 17 -4.459 -12.592 -13.615 847 HG3 LYS 17 1HG LYS 17 -5.120 -14.156 -13.125 848 HD2 LYS 17 2HD LYS 17 -6.734 -11.774 -14.071 849 HD3 LYS 17 1HD LYS 17 -6.359 -13.204 -15.029 850 HE2 LYS 17 2HE LYS 17 -7.997 -13.180 -12.475 851 HE3 LYS 17 1HE LYS 17 -8.644 -13.269 -14.102 852 HZ1 LYS 17 1HZ LYS 17 -8.533 -15.424 -13.032 853 HZ2 LYS 17 2HZ LYS 17 -6.863 -15.327 -12.875 854 HZ3 LYS 17 3HZ LYS 17 -7.588 -15.405 -14.403 855 H LYS 18 H LYS 18 -2.641 -12.936 -12.712 856 HA LYS 18 HA LYS 18 -0.878 -10.900 -11.694 857 HB2 LYS 18 2HB LYS 18 0.481 -11.303 -13.700 858 HB3 LYS 18 1HB LYS 18 0.062 -12.791 -12.867 859 HG2 LYS 18 2HG LYS 18 -1.649 -13.257 -14.521 860 HG3 LYS 18 1HG LYS 18 -1.256 -11.746 -15.347 861 HD2 LYS 18 2HD LYS 18 0.999 -12.531 -15.769 862 HD3 LYS 18 1HD LYS 18 0.665 -14.016 -14.880 863 HE2 LYS 18 2HE LYS 18 -1.048 -14.604 -16.491 864 HE3 LYS 18 1HE LYS 18 -0.741 -13.113 -17.383 865 HZ1 LYS 18 1HZ LYS 18 0.360 -15.010 -18.385 866 HZ2 LYS 18 2HZ LYS 18 1.219 -15.311 -16.971 867 HZ3 LYS 18 3HZ LYS 18 1.483 -13.893 -17.837 868 H ALA 19 H ALA 19 -3.722 -10.541 -12.875 869 HA ALA 19 HA ALA 19 -3.685 -8.790 -15.020 870 HB1 ALA 19 1HB ALA 19 -5.858 -8.027 -14.208 871 HB2 ALA 19 2HB ALA 19 -5.509 -8.790 -12.659 872 HB3 ALA 19 3HB ALA 19 -5.708 -9.793 -14.108 873 H ILE 20 H ILE 20 -3.567 -8.046 -11.526 874 HA ILE 20 HA ILE 20 -3.366 -5.233 -11.880 875 HB ILE 20 HB ILE 20 -2.478 -6.920 -9.512 876 HG12 ILE 20 2HG1 ILE 20 -5.059 -5.422 -10.020 877 HG13 ILE 20 1HG1 ILE 20 -4.861 -7.169 -10.006 878 HG21 ILE 20 1HG2 ILE 20 -1.408 -4.723 -9.480 879 HG22 ILE 20 2HG2 ILE 20 -2.614 -4.838 -8.201 880 HG23 ILE 20 3HG2 ILE 20 -2.975 -3.939 -9.676 881 HD11 ILE 20 1HD1 ILE 20 -5.868 -6.383 -7.963 882 HD12 ILE 20 2HD1 ILE 20 -4.493 -5.322 -7.665 883 HD13 ILE 20 3HD1 ILE 20 -4.275 -7.071 -7.634 884 H SER 21 H SER 21 -1.113 -7.842 -11.706 885 HA SER 21 HA SER 21 1.249 -6.368 -11.401 886 HB2 SER 21 2HB SER 21 0.806 -9.072 -12.689 887 HB3 SER 21 1HB SER 21 2.341 -8.469 -12.065 888 HG SER 21 HG SER 21 1.162 -8.215 -10.023 889 H GLU 22 H GLU 22 -0.364 -7.702 -14.309 890 HA GLU 22 HA GLU 22 1.352 -6.663 -16.265 891 HB2 GLU 22 2HB GLU 22 -1.646 -7.053 -16.437 892 HB3 GLU 22 1HB GLU 22 -0.564 -6.855 -17.801 893 HG2 GLU 22 2HG GLU 22 0.509 -8.983 -17.242 894 HG3 GLU 22 1HG GLU 22 -0.580 -9.157 -15.864 895 H THR 23 H THR 23 -1.458 -5.342 -14.666 896 HA THR 23 HA THR 23 -1.867 -3.029 -16.148 897 HB THR 23 HB THR 23 -2.378 -3.615 -13.242 898 HG1 THR 23 1HG THR 23 -3.518 -4.946 -14.567 899 HG21 THR 23 1HG2 THR 23 -4.003 -1.756 -13.296 900 HG22 THR 23 2HG2 THR 23 -3.466 -1.344 -14.925 901 HG23 THR 23 3HG2 THR 23 -2.355 -1.192 -13.565 902 H LEU 24 H LEU 24 -0.031 -3.390 -13.095 903 HA LEU 24 HA LEU 24 0.674 -0.630 -13.120 904 HB2 LEU 24 2HB LEU 24 1.732 -2.860 -11.403 905 HB3 LEU 24 1HB LEU 24 2.045 -1.153 -11.159 906 HG LEU 24 HG LEU 24 -0.657 -2.476 -10.976 907 HD11 LEU 24 1HD1 LEU 24 0.795 -3.056 -9.133 908 HD12 LEU 24 2HD1 LEU 24 -0.471 -1.945 -8.600 909 HD13 LEU 24 3HD1 LEU 24 1.167 -1.353 -8.877 910 HD21 LEU 24 1HD2 LEU 24 -0.849 -0.175 -11.787 911 HD22 LEU 24 2HD2 LEU 24 0.174 0.384 -10.466 912 HD23 LEU 24 3HD2 LEU 24 -1.414 -0.295 -10.120 913 H GLU 25 H GLU 25 2.280 -3.550 -14.121 914 HA GLU 25 HA GLU 25 4.834 -2.544 -14.434 915 HB2 GLU 25 2HB GLU 25 4.234 -4.924 -14.602 916 HB3 GLU 25 1HB GLU 25 3.380 -4.608 -16.104 917 HG2 GLU 25 2HG GLU 25 5.478 -3.999 -17.175 918 HG3 GLU 25 1HG GLU 25 6.330 -4.272 -15.654 919 H THR 26 H THR 26 1.968 -2.542 -16.511 920 HA THR 26 HA THR 26 3.147 -1.325 -18.802 921 HB THR 26 HB THR 26 0.224 -1.487 -18.056 922 HG1 THR 26 1HG THR 26 1.034 -3.573 -18.130 923 HG21 THR 26 1HG2 THR 26 0.779 0.061 -19.900 924 HG22 THR 26 2HG2 THR 26 -0.170 -1.316 -20.477 925 HG23 THR 26 3HG2 THR 26 1.575 -1.244 -20.758 926 H VAL 27 H VAL 27 1.374 -0.125 -15.981 927 HA VAL 27 HA VAL 27 0.904 2.466 -16.947 928 HB VAL 27 HB VAL 27 1.303 1.640 -14.038 929 HG11 VAL 27 1HG1 VAL 27 1.544 4.045 -14.341 930 HG12 VAL 27 2HG1 VAL 27 0.011 3.665 -13.529 931 HG13 VAL 27 3HG1 VAL 27 0.020 4.071 -15.243 932 HG21 VAL 27 1HG2 VAL 27 -1.249 2.012 -15.598 933 HG22 VAL 27 2HG2 VAL 27 -1.118 1.573 -13.901 934 HG23 VAL 27 3HG2 VAL 27 -0.559 0.454 -15.149 935 H TYR 28 H TYR 28 3.718 1.067 -15.374 936 HA TYR 28 HA TYR 28 5.086 3.542 -15.094 937 HB2 TYR 28 2HB TYR 28 5.745 1.334 -13.939 938 HB3 TYR 28 1HB TYR 28 6.456 0.857 -15.476 939 HD1 TYR 28 1HD TYR 28 8.311 2.399 -16.448 940 HD2 TYR 28 2HD TYR 28 6.995 2.632 -12.408 941 HE1 TYR 28 1HE TYR 28 10.374 3.609 -15.842 942 HE2 TYR 28 2HE TYR 28 9.047 3.839 -11.802 943 HH TYR 28 HH TYR 28 11.061 5.187 -14.115 944 H ARG 29 H ARG 29 5.025 1.064 -17.581 945 HA ARG 29 HA ARG 29 6.901 2.111 -19.384 946 HB2 ARG 29 2HB ARG 29 4.392 0.530 -19.966 947 HB3 ARG 29 1HB ARG 29 5.690 0.803 -21.111 948 HG2 ARG 29 2HG ARG 29 5.914 -0.712 -18.514 949 HG3 ARG 29 1HG ARG 29 5.792 -1.424 -20.122 950 HD2 ARG 29 2HD ARG 29 7.886 -0.327 -20.756 951 HD3 ARG 29 1HD ARG 29 8.018 0.360 -19.135 952 HE ARG 29 HE ARG 29 7.747 -2.415 -18.951 953 HH11 ARG 29 1HH1 ARG 29 10.096 -0.013 -20.057 954 HH12 ARG 29 2HH1 ARG 29 11.451 -0.971 -19.757 955 HH21 ARG 29 1HH2 ARG 29 9.621 -3.756 -18.517 956 HH22 ARG 29 2HH2 ARG 29 11.175 -3.139 -18.838 957 H ALA 30 H ALA 30 3.543 2.897 -18.880 958 HA ALA 30 HA ALA 30 3.163 4.379 -21.244 959 HB1 ALA 30 1HB ALA 30 1.713 4.680 -18.616 960 HB2 ALA 30 2HB ALA 30 1.293 3.542 -19.895 961 HB3 ALA 30 3HB ALA 30 1.160 5.276 -20.181 962 H LEU 31 H LEU 31 3.945 5.478 -17.946 963 HA LEU 31 HA LEU 31 4.186 8.116 -18.953 964 HB2 LEU 31 2HB LEU 31 4.745 7.143 -16.181 965 HB3 LEU 31 1HB LEU 31 5.009 8.799 -16.676 966 HG LEU 31 HG LEU 31 2.526 8.618 -17.411 967 HD11 LEU 31 1HD1 LEU 31 2.175 6.285 -16.974 968 HD12 LEU 31 2HD1 LEU 31 1.178 7.265 -15.893 969 HD13 LEU 31 3HD1 LEU 31 2.651 6.523 -15.285 970 HD21 LEU 31 1HD2 LEU 31 3.335 10.192 -15.816 971 HD22 LEU 31 2HD2 LEU 31 3.378 8.967 -14.549 972 HD23 LEU 31 3HD2 LEU 31 1.839 9.445 -15.256 973 H GLU 32 H GLU 32 6.571 5.631 -18.472 974 HA GLU 32 HA GLU 32 8.547 7.629 -18.554 975 HB2 GLU 32 2HB GLU 32 10.233 5.801 -18.832 976 HB3 GLU 32 1HB GLU 32 9.293 5.759 -17.343 977 HG2 GLU 32 2HG GLU 32 9.452 3.539 -17.942 978 HG3 GLU 32 1HG GLU 32 7.907 3.982 -18.652 979 H GLU 33 H GLU 33 7.102 5.756 -20.983 980 HA GLU 33 HA GLU 33 8.640 6.729 -23.170 981 HB2 GLU 33 2HB GLU 33 5.737 5.901 -23.064 982 HB3 GLU 33 1HB GLU 33 6.594 6.273 -24.551 983 HG2 GLU 33 2HG GLU 33 7.381 4.122 -22.619 984 HG3 GLU 33 1HG GLU 33 6.407 3.854 -24.063 985 H LYS 34 H LYS 34 6.205 8.167 -21.236 986 HA LYS 34 HA LYS 34 5.865 10.457 -22.984 987 HB2 LYS 34 2HB LYS 34 4.646 9.665 -20.370 988 HB3 LYS 34 1HB LYS 34 4.491 11.305 -20.970 989 HG2 LYS 34 2HG LYS 34 3.594 8.854 -22.465 990 HG3 LYS 34 1HG LYS 34 2.543 9.860 -21.461 991 HD2 LYS 34 2HD LYS 34 3.135 11.815 -22.878 992 HD3 LYS 34 1HD LYS 34 4.067 10.744 -23.921 993 HE2 LYS 34 2HE LYS 34 2.067 9.480 -24.430 994 HE3 LYS 34 1HE LYS 34 1.122 10.512 -23.356 995 HZ1 LYS 34 1HZ LYS 34 2.516 11.388 -25.835 996 HZ2 LYS 34 2HZ LYS 34 1.649 12.388 -24.781 997 HZ3 LYS 34 3HZ LYS 34 0.851 11.180 -25.641 998 H GLY 35 H GLY 35 8.162 9.538 -20.852 999 HA2 GLY 35 2HA GLY 35 9.975 10.691 -20.036 1000 HA3 GLY 35 1HA GLY 35 9.344 12.128 -20.822 1001 H TYR 36 H TYR 36 7.660 10.217 -18.382 1002 HA TYR 36 HA TYR 36 8.029 12.445 -16.477 1003 HB2 TYR 36 2HB TYR 36 5.583 10.685 -16.779 1004 HB3 TYR 36 1HB TYR 36 5.795 11.912 -15.549 1005 HD1 TYR 36 1HD TYR 36 4.289 11.161 -18.562 1006 HD2 TYR 36 2HD TYR 36 6.324 14.342 -16.617 1007 HE1 TYR 36 1HE TYR 36 3.204 12.758 -20.061 1008 HE2 TYR 36 2HE TYR 36 5.245 15.954 -18.120 1009 HH TYR 36 HH TYR 36 4.215 15.970 -20.321 1010 H ASN 37 H ASN 37 7.276 11.487 -14.193 1011 HA ASN 37 HA ASN 37 8.620 8.901 -13.906 1012 HB2 ASN 37 2HB ASN 37 8.171 11.036 -11.798 1013 HB3 ASN 37 1HB ASN 37 8.895 9.466 -11.493 1014 HD21 ASN 37 1HD2 ASN 37 10.364 9.550 -14.094 1015 HD22 ASN 37 2HD2 ASN 37 11.648 10.647 -13.842 1016 HA PRO 38 HA PRO 38 4.359 7.508 -13.800 1017 HB2 PRO 38 2HB PRO 38 5.737 5.017 -13.029 1018 HB3 PRO 38 1HB PRO 38 4.552 5.323 -14.303 1019 HG2 PRO 38 2HG PRO 38 7.199 4.987 -14.784 1020 HG3 PRO 38 1HG PRO 38 6.171 5.960 -15.821 1021 HD2 PRO 38 2HD PRO 38 8.243 6.775 -13.913 1022 HD3 PRO 38 1HD PRO 38 7.550 7.650 -15.302 1023 H ILE 39 H ILE 39 6.720 6.919 -11.278 1024 HA ILE 39 HA ILE 39 5.134 5.599 -9.415 1025 HB ILE 39 HB ILE 39 7.420 7.502 -8.858 1026 HG12 ILE 39 2HG1 ILE 39 8.094 5.689 -10.348 1027 HG13 ILE 39 1HG1 ILE 39 8.812 5.466 -8.760 1028 HG21 ILE 39 1HG2 ILE 39 6.129 7.118 -6.833 1029 HG22 ILE 39 2HG2 ILE 39 7.690 6.306 -6.729 1030 HG23 ILE 39 3HG2 ILE 39 6.233 5.373 -7.075 1031 HD11 ILE 39 1HD1 ILE 39 8.048 3.357 -9.683 1032 HD12 ILE 39 2HD1 ILE 39 6.418 3.995 -9.853 1033 HD13 ILE 39 3HD1 ILE 39 7.111 3.771 -8.247 1034 H ASN 40 H ASN 40 5.647 9.096 -9.759 1035 HA ASN 40 HA ASN 40 4.166 9.817 -7.469 1036 HB2 ASN 40 2HB ASN 40 4.729 11.482 -9.932 1037 HB3 ASN 40 1HB ASN 40 4.001 12.106 -8.458 1038 HD21 ASN 40 1HD2 ASN 40 6.908 11.128 -10.025 1039 HD22 ASN 40 2HD2 ASN 40 7.987 11.565 -8.756 1040 H GLN 41 H GLN 41 3.141 9.346 -10.813 1041 HA GLN 41 HA GLN 41 0.546 10.355 -10.279 1042 HB2 GLN 41 2HB GLN 41 1.572 8.698 -12.573 1043 HB3 GLN 41 1HB GLN 41 -0.001 9.474 -12.518 1044 HG2 GLN 41 2HG GLN 41 2.673 10.867 -12.521 1045 HG3 GLN 41 1HG GLN 41 1.552 10.765 -13.866 1046 HE21 GLN 41 1HE2 GLN 41 2.583 13.055 -12.721 1047 HE22 GLN 41 2HE2 GLN 41 1.314 14.023 -12.082 1048 H ILE 42 H ILE 42 2.035 7.161 -10.342 1049 HA ILE 42 HA ILE 42 -0.352 5.667 -10.149 1050 HB ILE 42 HB ILE 42 2.425 4.893 -9.178 1051 HG12 ILE 42 2HG1 ILE 42 1.008 4.262 -11.777 1052 HG13 ILE 42 1HG1 ILE 42 2.315 5.422 -11.590 1053 HG21 ILE 42 1HG2 ILE 42 0.699 3.514 -8.148 1054 HG22 ILE 42 2HG2 ILE 42 1.602 2.565 -9.335 1055 HG23 ILE 42 3HG2 ILE 42 -0.005 3.182 -9.729 1056 HD11 ILE 42 1HD1 ILE 42 3.830 3.610 -10.955 1057 HD12 ILE 42 2HD1 ILE 42 3.106 3.328 -12.538 1058 HD13 ILE 42 3HD1 ILE 42 2.509 2.452 -11.130 1059 H VAL 43 H VAL 43 1.965 6.642 -7.597 1060 HA VAL 43 HA VAL 43 0.456 5.617 -5.461 1061 HB VAL 43 HB VAL 43 2.837 6.210 -5.136 1062 HG11 VAL 43 1HG1 VAL 43 2.975 8.198 -6.518 1063 HG12 VAL 43 2HG1 VAL 43 3.555 8.558 -4.889 1064 HG13 VAL 43 3HG1 VAL 43 1.947 9.078 -5.389 1065 HG21 VAL 43 1HG2 VAL 43 1.038 7.834 -3.344 1066 HG22 VAL 43 2HG2 VAL 43 2.694 7.351 -2.972 1067 HG23 VAL 43 3HG2 VAL 43 1.435 6.129 -3.156 1068 H GLY 44 H GLY 44 0.334 8.635 -7.128 1069 HA2 GLY 44 2HA GLY 44 -1.343 10.047 -5.344 1070 HA3 GLY 44 1HA GLY 44 -1.148 10.406 -7.060 1071 H TYR 45 H TYR 45 -2.055 8.234 -8.305 1072 HA TYR 45 HA TYR 45 -4.829 8.496 -8.230 1073 HB2 TYR 45 2HB TYR 45 -3.828 7.693 -10.257 1074 HB3 TYR 45 1HB TYR 45 -3.102 6.321 -9.427 1075 HD1 TYR 45 1HD TYR 45 -4.288 4.301 -9.152 1076 HD2 TYR 45 2HD TYR 45 -6.342 7.757 -10.474 1077 HE1 TYR 45 1HE TYR 45 -6.279 2.934 -9.584 1078 HE2 TYR 45 2HE TYR 45 -8.334 6.417 -10.926 1079 HH TYR 45 HH TYR 45 -8.959 4.130 -11.322 1080 H LEU 46 H LEU 46 -2.790 5.937 -6.944 1081 HA LEU 46 HA LEU 46 -4.921 4.337 -6.115 1082 HB2 LEU 46 2HB LEU 46 -2.077 4.410 -5.172 1083 HB3 LEU 46 1HB LEU 46 -3.223 3.134 -4.791 1084 HG LEU 46 HG LEU 46 -2.319 3.852 -7.581 1085 HD11 LEU 46 1HD1 LEU 46 -1.097 1.748 -7.511 1086 HD12 LEU 46 2HD1 LEU 46 -1.534 1.557 -5.809 1087 HD13 LEU 46 3HD1 LEU 46 -0.520 2.917 -6.327 1088 HD21 LEU 46 1HD2 LEU 46 -3.419 1.767 -8.213 1089 HD22 LEU 46 2HD2 LEU 46 -4.567 2.916 -7.529 1090 HD23 LEU 46 3HD2 LEU 46 -3.987 1.563 -6.556 1091 H LEU 47 H LEU 47 -3.243 6.910 -4.421 1092 HA LEU 47 HA LEU 47 -4.632 6.286 -1.992 1093 HB2 LEU 47 2HB LEU 47 -2.923 8.653 -2.714 1094 HB3 LEU 47 1HB LEU 47 -3.683 8.448 -1.150 1095 HG LEU 47 HG LEU 47 -1.595 6.619 -2.351 1096 HD11 LEU 47 1HD1 LEU 47 -0.686 8.764 -1.654 1097 HD12 LEU 47 2HD1 LEU 47 -0.157 7.470 -0.579 1098 HD13 LEU 47 3HD1 LEU 47 -1.432 8.576 -0.066 1099 HD21 LEU 47 1HD2 LEU 47 -3.094 5.332 -0.958 1100 HD22 LEU 47 2HD2 LEU 47 -2.999 6.548 0.323 1101 HD23 LEU 47 3HD2 LEU 47 -1.588 5.596 -0.084 1102 H SER 48 H SER 48 -5.033 8.795 -4.478 1103 HA SER 48 HA SER 48 -7.225 9.893 -2.901 1104 HB2 SER 48 2HB SER 48 -7.249 11.718 -4.600 1105 HB3 SER 48 1HB SER 48 -5.695 11.511 -3.792 1106 HG SER 48 HG SER 48 -4.937 10.413 -5.627 1107 H GLY 49 H GLY 49 -6.832 7.895 -5.702 1108 HA2 GLY 49 2HA GLY 49 -8.393 6.695 -6.813 1109 HA3 GLY 49 1HA GLY 49 -9.639 7.416 -5.801 1110 H ASP 50 H ASP 50 -7.407 9.381 -7.617 1111 HA ASP 50 HA ASP 50 -9.668 10.175 -9.305 1112 HB2 ASP 50 2HB ASP 50 -8.653 11.938 -7.818 1113 HB3 ASP 50 1HB ASP 50 -7.155 11.760 -8.721 1114 HA PRO 51 HA PRO 51 -7.372 7.877 -12.390 1115 HB2 PRO 51 2HB PRO 51 -8.961 8.573 -14.515 1116 HB3 PRO 51 1HB PRO 51 -9.297 7.264 -13.379 1117 HG2 PRO 51 2HG PRO 51 -10.369 10.052 -13.433 1118 HG3 PRO 51 1HG PRO 51 -11.214 8.539 -13.072 1119 HD2 PRO 51 2HD PRO 51 -10.450 10.229 -11.147 1120 HD3 PRO 51 1HD PRO 51 -10.420 8.473 -10.898 1121 H ALA 52 H ALA 52 -7.816 11.323 -12.585 1122 HA ALA 52 HA ALA 52 -6.736 11.804 -15.134 1123 HB1 ALA 52 1HB ALA 52 -6.594 14.123 -14.520 1124 HB2 ALA 52 2HB ALA 52 -6.718 13.705 -12.812 1125 HB3 ALA 52 3HB ALA 52 -8.086 13.425 -13.885 1126 H TYR 53 H TYR 53 -5.029 10.798 -12.420 1127 HA TYR 53 HA TYR 53 -2.503 12.102 -12.789 1128 HB2 TYR 53 2HB TYR 53 -3.265 9.486 -11.506 1129 HB3 TYR 53 1HB TYR 53 -1.641 10.168 -11.478 1130 HD1 TYR 53 1HD TYR 53 -1.496 12.616 -10.644 1131 HD2 TYR 53 2HD TYR 53 -4.688 10.007 -9.772 1132 HE1 TYR 53 1HE TYR 53 -2.023 13.972 -8.759 1133 HE2 TYR 53 2HE TYR 53 -5.275 11.357 -7.823 1134 HH TYR 53 HH TYR 53 -4.212 12.916 -6.305 1135 H ILE 54 H ILE 54 -3.969 9.280 -14.380 1136 HA ILE 54 HA ILE 54 -1.345 8.664 -15.524 1137 HB ILE 54 HB ILE 54 -3.872 6.959 -15.725 1138 HG12 ILE 54 2HG1 ILE 54 -3.150 7.116 -13.381 1139 HG13 ILE 54 1HG1 ILE 54 -2.791 5.522 -14.027 1140 HG21 ILE 54 1HG2 ILE 54 -2.373 5.184 -16.430 1141 HG22 ILE 54 2HG2 ILE 54 -1.010 6.304 -16.376 1142 HG23 ILE 54 3HG2 ILE 54 -2.313 6.557 -17.535 1143 HD11 ILE 54 1HD1 ILE 54 -0.976 6.329 -12.630 1144 HD12 ILE 54 2HD1 ILE 54 -0.813 7.762 -13.638 1145 HD13 ILE 54 3HD1 ILE 54 -0.441 6.172 -14.304 1146 HA PRO 55 HA PRO 55 -2.801 10.743 -19.202 1147 HB2 PRO 55 2HB PRO 55 -0.490 10.581 -20.607 1148 HB3 PRO 55 1HB PRO 55 -0.734 11.746 -19.305 1149 HG2 PRO 55 2HG PRO 55 0.733 9.149 -19.260 1150 HG3 PRO 55 1HG PRO 55 1.148 10.688 -18.488 1151 HD2 PRO 55 2HD PRO 55 -0.005 8.576 -17.172 1152 HD3 PRO 55 1HD PRO 55 -0.178 10.269 -16.670 1153 H ARG 56 H ARG 56 -3.583 10.071 -21.140 1154 HA ARG 56 HA ARG 56 -3.585 7.249 -21.540 1155 HB2 ARG 56 2HB ARG 56 -5.226 7.660 -23.375 1156 HB3 ARG 56 1HB ARG 56 -5.724 8.276 -21.814 1157 HG2 ARG 56 2HG ARG 56 -5.124 10.536 -22.517 1158 HG3 ARG 56 1HG ARG 56 -4.607 9.911 -24.087 1159 HD2 ARG 56 2HD ARG 56 -6.886 9.088 -24.497 1160 HD3 ARG 56 1HD ARG 56 -7.395 9.731 -22.938 1161 HE ARG 56 HE ARG 56 -6.272 11.824 -24.312 1162 HH11 ARG 56 1HH1 ARG 56 -9.068 9.669 -24.788 1163 HH12 ARG 56 2HH1 ARG 56 -9.947 10.845 -25.662 1164 HH21 ARG 56 1HH2 ARG 56 -7.528 13.386 -25.495 1165 HH22 ARG 56 2HH2 ARG 56 -9.081 12.957 -26.066 1166 H TYR 57 H TYR 57 -1.580 6.777 -22.036 1167 HA TYR 57 HA TYR 57 -0.818 7.351 -24.830 1168 HB2 TYR 57 2HB TYR 57 0.924 8.036 -23.203 1169 HB3 TYR 57 1HB TYR 57 0.981 6.393 -22.582 1170 HD1 TYR 57 1HD TYR 57 1.273 8.150 -25.878 1171 HD2 TYR 57 2HD TYR 57 2.727 5.045 -23.359 1172 HE1 TYR 57 1HE TYR 57 2.972 7.614 -27.546 1173 HE2 TYR 57 2HE TYR 57 4.443 4.497 -25.042 1174 HH TYR 57 HH TYR 57 5.071 6.591 -27.684 1175 H GLN 58 H GLN 58 -1.476 4.933 -22.462 1176 HA GLN 58 HA GLN 58 -1.760 2.964 -24.558 1177 HB2 GLN 58 2HB GLN 58 -0.154 2.510 -22.033 1178 HB3 GLN 58 1HB GLN 58 -0.727 1.224 -23.072 1179 HG2 GLN 58 2HG GLN 58 0.612 2.240 -24.919 1180 HG3 GLN 58 1HG GLN 58 1.285 3.354 -23.728 1181 HE21 GLN 58 1HE2 GLN 58 2.749 2.559 -22.177 1182 HE22 GLN 58 2HE2 GLN 58 3.442 0.985 -22.354 1183 H ASP 59 H ASP 59 -2.723 0.931 -23.456 1184 HA ASP 59 HA ASP 59 -5.272 1.564 -22.463 1185 HB2 ASP 59 2HB ASP 59 -3.892 -1.112 -22.191 1186 HB3 ASP 59 1HB ASP 59 -5.598 -0.785 -22.098 1187 H ALA 60 H ALA 60 -2.358 1.472 -20.881 1188 HA ALA 60 HA ALA 60 -2.713 0.366 -18.395 1189 HB1 ALA 60 1HB ALA 60 -1.032 1.914 -17.588 1190 HB2 ALA 60 2HB ALA 60 -1.286 2.950 -18.993 1191 HB3 ALA 60 3HB ALA 60 -0.615 1.334 -19.196 1192 H ARG 61 H ARG 61 -3.797 3.576 -19.482 1193 HA ARG 61 HA ARG 61 -4.762 4.388 -17.004 1194 HB2 ARG 61 2HB ARG 61 -6.164 6.071 -18.293 1195 HB3 ARG 61 1HB ARG 61 -4.444 6.127 -18.594 1196 HG2 ARG 61 2HG ARG 61 -5.533 6.469 -20.680 1197 HG3 ARG 61 1HG ARG 61 -4.882 4.841 -20.726 1198 HD2 ARG 61 2HD ARG 61 -7.106 4.872 -21.689 1199 HD3 ARG 61 1HD ARG 61 -7.126 3.969 -20.178 1200 HE ARG 61 HE ARG 61 -7.807 6.715 -19.830 1201 HH11 ARG 61 1HH1 ARG 61 -9.154 3.569 -20.789 1202 HH12 ARG 61 2HH1 ARG 61 -10.750 3.994 -20.406 1203 HH21 ARG 61 1HH2 ARG 61 -10.025 7.261 -19.334 1204 HH22 ARG 61 2HH2 ARG 61 -11.257 6.086 -19.565 1205 H ASN 62 H ASN 62 -6.225 2.344 -19.381 1206 HA ASN 62 HA ASN 62 -8.850 2.321 -18.170 1207 HB2 ASN 62 2HB ASN 62 -8.419 1.724 -20.632 1208 HB3 ASN 62 1HB ASN 62 -7.542 0.350 -20.050 1209 HD21 ASN 62 1HD2 ASN 62 -8.860 -1.100 -21.093 1210 HD22 ASN 62 2HD2 ASN 62 -10.442 -1.479 -20.556 1211 H LEU 63 H LEU 63 -6.021 0.265 -18.274 1212 HA LEU 63 HA LEU 63 -6.936 -1.920 -16.825 1213 HB2 LEU 63 2HB LEU 63 -4.141 -0.830 -17.020 1214 HB3 LEU 63 1HB LEU 63 -4.563 -2.417 -16.410 1215 HG LEU 63 HG LEU 63 -4.974 -1.442 -19.233 1216 HD11 LEU 63 1HD1 LEU 63 -2.632 -1.834 -18.698 1217 HD12 LEU 63 2HD1 LEU 63 -3.246 -3.076 -19.788 1218 HD13 LEU 63 3HD1 LEU 63 -3.030 -3.437 -18.078 1219 HD21 LEU 63 1HD2 LEU 63 -5.588 -3.769 -19.698 1220 HD22 LEU 63 2HD2 LEU 63 -6.712 -3.010 -18.574 1221 HD23 LEU 63 3HD2 LEU 63 -5.492 -4.134 -17.976 1222 H ILE 64 H ILE 64 -5.440 1.056 -15.684 1223 HA ILE 64 HA ILE 64 -5.261 0.082 -13.011 1224 HB ILE 64 HB ILE 64 -3.710 1.808 -14.044 1225 HG12 ILE 64 2HG1 ILE 64 -5.048 2.692 -11.476 1226 HG13 ILE 64 1HG1 ILE 64 -3.840 1.419 -11.589 1227 HG21 ILE 64 1HG2 ILE 64 -4.415 4.164 -14.028 1228 HG22 ILE 64 2HG2 ILE 64 -6.045 3.663 -13.594 1229 HG23 ILE 64 3HG2 ILE 64 -5.371 3.196 -15.151 1230 HD11 ILE 64 1HD1 ILE 64 -2.199 3.052 -12.389 1231 HD12 ILE 64 2HD1 ILE 64 -2.853 3.497 -10.814 1232 HD13 ILE 64 3HD1 ILE 64 -3.417 4.324 -12.268 1233 H ARG 65 H ARG 65 -7.753 1.499 -14.875 1234 HA ARG 65 HA ARG 65 -9.231 2.503 -12.571 1235 HB2 ARG 65 2HB ARG 65 -9.960 2.481 -15.503 1236 HB3 ARG 65 1HB ARG 65 -10.937 3.208 -14.237 1237 HG2 ARG 65 2HG ARG 65 -9.085 4.735 -13.726 1238 HG3 ARG 65 1HG ARG 65 -8.157 4.012 -15.028 1239 HD2 ARG 65 2HD ARG 65 -9.158 6.082 -15.755 1240 HD3 ARG 65 1HD ARG 65 -9.855 4.732 -16.643 1241 HE ARG 65 HE ARG 65 -11.631 4.999 -14.716 1242 HH11 ARG 65 1HH1 ARG 65 -10.057 7.586 -16.582 1243 HH12 ARG 65 2HH1 ARG 65 -11.408 8.627 -16.545 1244 HH21 ARG 65 1HH2 ARG 65 -13.444 6.414 -14.643 1245 HH22 ARG 65 2HH2 ARG 65 -13.397 7.943 -15.382 1246 H ARG 66 H ARG 66 -9.148 -0.290 -14.595 1247 HA ARG 66 HA ARG 66 -11.798 -1.184 -13.910 1248 HB2 ARG 66 2HB ARG 66 -11.144 -3.350 -15.000 1249 HB3 ARG 66 1HB ARG 66 -11.003 -1.932 -16.030 1250 HG2 ARG 66 2HG ARG 66 -8.637 -1.907 -15.751 1251 HG3 ARG 66 1HG ARG 66 -8.727 -3.187 -14.548 1252 HD2 ARG 66 2HD ARG 66 -9.612 -3.510 -17.404 1253 HD3 ARG 66 1HD ARG 66 -8.004 -3.935 -16.824 1254 HE ARG 66 HE ARG 66 -10.036 -5.163 -15.260 1255 HH11 ARG 66 1HH1 ARG 66 -8.475 -5.463 -18.422 1256 HH12 ARG 66 2HH1 ARG 66 -8.557 -7.161 -18.453 1257 HH21 ARG 66 1HH2 ARG 66 -10.147 -7.471 -15.298 1258 HH22 ARG 66 2HH2 ARG 66 -9.503 -8.327 -16.640 1259 H HIS 67 H HIS 67 -9.183 -0.988 -12.042 1260 HA HIS 67 HA HIS 67 -10.131 -3.206 -10.387 1261 HB2 HIS 67 2HB HIS 67 -7.268 -2.222 -10.635 1262 HB3 HIS 67 1HB HIS 67 -7.822 -3.360 -9.417 1263 HD1 HIS 67 1HD HIS 67 -7.987 -5.814 -10.124 1264 HD2 HIS 67 2HD HIS 67 -7.090 -3.236 -13.260 1265 HE1 HIS 67 1HE HIS 67 -7.329 -7.276 -12.045 1266 HE2 HIS 67 2HE HIS 67 -6.998 -5.708 -13.973 1267 H GLU 68 H GLU 68 -10.524 -2.629 -8.270 1268 HA GLU 68 HA GLU 68 -10.712 0.136 -7.723 1269 HB2 GLU 68 2HB GLU 68 -10.930 -2.221 -5.840 1270 HB3 GLU 68 1HB GLU 68 -11.261 -0.557 -5.382 1271 HG2 GLU 68 2HG GLU 68 -12.753 -2.178 -7.438 1272 HG3 GLU 68 1HG GLU 68 -13.323 -1.731 -5.832 1273 H ARG 69 H ARG 69 -9.536 1.444 -6.384 1274 HA ARG 69 HA ARG 69 -6.774 1.130 -6.510 1275 HB2 ARG 69 2HB ARG 69 -8.349 2.917 -4.622 1276 HB3 ARG 69 1HB ARG 69 -6.619 2.978 -4.817 1277 HG2 ARG 69 2HG ARG 69 -7.429 4.819 -6.023 1278 HG3 ARG 69 1HG ARG 69 -7.084 3.625 -7.256 1279 HD2 ARG 69 2HD ARG 69 -9.852 4.002 -6.120 1280 HD3 ARG 69 1HD ARG 69 -9.270 4.994 -7.442 1281 HE ARG 69 HE ARG 69 -8.918 2.633 -8.496 1282 HH11 ARG 69 1HH1 ARG 69 -11.679 3.757 -6.550 1283 HH12 ARG 69 2HH1 ARG 69 -12.789 2.738 -7.328 1284 HH21 ARG 69 1HH2 ARG 69 -10.499 1.288 -9.580 1285 HH22 ARG 69 2HH2 ARG 69 -12.125 1.302 -9.055 1286 H ASP 70 H ASP 70 -9.067 0.391 -3.971 1287 HA ASP 70 HA ASP 70 -7.436 -0.284 -1.847 1288 HB2 ASP 70 2HB ASP 70 -10.015 -1.619 -2.710 1289 HB3 ASP 70 1HB ASP 70 -9.339 -1.608 -1.087 1290 H GLU 71 H GLU 71 -8.818 -2.389 -4.359 1291 HA GLU 71 HA GLU 71 -7.715 -4.845 -3.706 1292 HB2 GLU 71 2HB GLU 71 -9.448 -4.406 -5.454 1293 HB3 GLU 71 1HB GLU 71 -8.189 -3.758 -6.491 1294 HG2 GLU 71 2HG GLU 71 -7.060 -5.998 -6.341 1295 HG3 GLU 71 1HG GLU 71 -8.504 -6.593 -5.537 1296 H ILE 72 H ILE 72 -6.459 -2.335 -5.832 1297 HA ILE 72 HA ILE 72 -4.085 -3.662 -6.644 1298 HB ILE 72 HB ILE 72 -4.613 -0.678 -6.533 1299 HG12 ILE 72 2HG1 ILE 72 -4.974 -2.628 -8.825 1300 HG13 ILE 72 1HG1 ILE 72 -6.276 -1.899 -7.893 1301 HG21 ILE 72 1HG2 ILE 72 -2.560 -2.242 -8.098 1302 HG22 ILE 72 2HG2 ILE 72 -2.236 -1.176 -6.732 1303 HG23 ILE 72 3HG2 ILE 72 -2.855 -0.509 -8.244 1304 HD11 ILE 72 1HD1 ILE 72 -5.621 0.311 -8.710 1305 HD12 ILE 72 2HD1 ILE 72 -5.982 -0.781 -10.047 1306 HD13 ILE 72 3HD1 ILE 72 -4.310 -0.417 -9.634 1307 H MET 73 H MET 73 -4.741 -1.320 -4.088 1308 HA MET 73 HA MET 73 -2.054 -0.992 -3.306 1309 HB2 MET 73 2HB MET 73 -4.004 0.564 -2.846 1310 HB3 MET 73 1HB MET 73 -4.509 -0.556 -1.600 1311 HG2 MET 73 2HG MET 73 -1.887 0.929 -1.643 1312 HG3 MET 73 1HG MET 73 -3.305 1.424 -0.734 1313 HE1 MET 73 1HE MET 73 -0.469 1.169 0.559 1314 HE2 MET 73 2HE MET 73 -0.859 0.334 2.065 1315 HE3 MET 73 3HE MET 73 -1.935 1.593 1.440 1316 H GLU 74 H GLU 74 -4.658 -3.127 -2.138 1317 HA GLU 74 HA GLU 74 -3.185 -4.310 -0.068 1318 HB2 GLU 74 2HB GLU 74 -5.371 -5.510 -1.755 1319 HB3 GLU 74 1HB GLU 74 -4.688 -6.284 -0.338 1320 HG2 GLU 74 2HG GLU 74 -5.402 -4.336 0.996 1321 HG3 GLU 74 1HG GLU 74 -6.213 -3.704 -0.441 1322 H GLU 75 H GLU 75 -3.417 -5.127 -3.472 1323 HA GLU 75 HA GLU 75 -1.845 -7.440 -3.444 1324 HB2 GLU 75 2HB GLU 75 -3.216 -6.717 -5.362 1325 HB3 GLU 75 1HB GLU 75 -2.152 -5.339 -5.584 1326 HG2 GLU 75 2HG GLU 75 -1.741 -7.103 -7.235 1327 HG3 GLU 75 1HG GLU 75 -0.333 -6.791 -6.226 1328 H LEU 76 H LEU 76 -0.986 -4.022 -3.750 1329 HA LEU 76 HA LEU 76 1.788 -4.304 -4.116 1330 HB2 LEU 76 2HB LEU 76 0.304 -2.099 -2.689 1331 HB3 LEU 76 1HB LEU 76 1.971 -2.021 -3.205 1332 HG LEU 76 HG LEU 76 -0.426 -2.212 -5.025 1333 HD11 LEU 76 1HD1 LEU 76 0.148 0.078 -5.620 1334 HD12 LEU 76 2HD1 LEU 76 1.451 0.072 -4.435 1335 HD13 LEU 76 3HD1 LEU 76 -0.227 -0.048 -3.903 1336 HD21 LEU 76 1HD2 LEU 76 1.530 -3.301 -5.974 1337 HD22 LEU 76 2HD2 LEU 76 2.502 -1.869 -5.642 1338 HD23 LEU 76 3HD2 LEU 76 1.181 -1.785 -6.803 1339 H THR 77 H THR 77 -0.122 -3.813 -1.110 1340 HA THR 77 HA THR 77 2.076 -3.845 0.597 1341 HB THR 77 HB THR 77 -0.795 -4.608 1.203 1342 HG1 THR 77 1HG THR 77 -0.955 -2.522 0.513 1343 HG21 THR 77 1HG2 THR 77 -0.266 -3.859 3.483 1344 HG22 THR 77 2HG2 THR 77 1.397 -3.527 2.997 1345 HG23 THR 77 3HG2 THR 77 0.793 -5.185 3.012 1346 H LYS 78 H LYS 78 -0.040 -6.465 -0.507 1347 HA LYS 78 HA LYS 78 1.077 -8.403 1.200 1348 HB2 LYS 78 2HB LYS 78 -0.539 -8.760 -1.312 1349 HB3 LYS 78 1HB LYS 78 -0.048 -10.094 -0.269 1350 HG2 LYS 78 2HG LYS 78 -1.103 -9.008 1.581 1351 HG3 LYS 78 1HG LYS 78 -1.694 -7.734 0.550 1352 HD2 LYS 78 2HD LYS 78 -2.412 -10.679 0.348 1353 HD3 LYS 78 1HD LYS 78 -3.443 -9.422 1.016 1354 HE2 LYS 78 2HE LYS 78 -3.447 -8.334 -1.222 1355 HE3 LYS 78 1HE LYS 78 -2.531 -9.708 -1.843 1356 HZ1 LYS 78 1HZ LYS 78 -5.244 -9.782 -0.660 1357 HZ2 LYS 78 2HZ LYS 78 -4.371 -11.161 -1.087 1358 HZ3 LYS 78 3HZ LYS 78 -4.848 -10.053 -2.272 1359 H TYR 79 H TYR 79 1.754 -7.592 -2.117 1360 HA TYR 79 HA TYR 79 3.625 -9.693 -2.506 1361 HB2 TYR 79 2HB TYR 79 2.563 -8.421 -4.356 1362 HB3 TYR 79 1HB TYR 79 3.488 -7.007 -3.880 1363 HD1 TYR 79 1HD TYR 79 3.498 -10.118 -5.690 1364 HD2 TYR 79 2HD TYR 79 5.951 -7.027 -4.168 1365 HE1 TYR 79 1HE TYR 79 5.296 -10.823 -7.218 1366 HE2 TYR 79 2HE TYR 79 7.775 -7.702 -5.707 1367 HH TYR 79 HH TYR 79 8.443 -9.742 -6.863 1368 H TYR 80 H TYR 80 3.944 -6.355 -1.475 1369 HA TYR 80 HA TYR 80 6.713 -6.112 -1.326 1370 HB2 TYR 80 2HB TYR 80 5.025 -4.300 -1.125 1371 HB3 TYR 80 1HB TYR 80 4.585 -4.917 0.452 1372 HD1 TYR 80 1HD TYR 80 7.107 -3.138 -1.490 1373 HD2 TYR 80 2HD TYR 80 5.981 -4.453 2.386 1374 HE1 TYR 80 1HE TYR 80 8.739 -1.594 -0.501 1375 HE2 TYR 80 2HE TYR 80 7.610 -2.921 3.389 1376 HH TYR 80 HH TYR 80 9.078 -0.446 1.594 1377 H LEU 81 H LEU 81 4.363 -7.085 1.143 1378 HA LEU 81 HA LEU 81 6.383 -7.641 3.051 1379 HB2 LEU 81 2HB LEU 81 3.445 -8.227 3.090 1380 HB3 LEU 81 1HB LEU 81 4.523 -8.540 4.440 1381 HG LEU 81 HG LEU 81 3.951 -5.830 3.238 1382 HD11 LEU 81 1HD1 LEU 81 3.129 -7.043 5.858 1383 HD12 LEU 81 2HD1 LEU 81 2.065 -6.710 4.491 1384 HD13 LEU 81 3HD1 LEU 81 2.836 -5.377 5.354 1385 HD21 LEU 81 1HD2 LEU 81 5.214 -4.980 5.162 1386 HD22 LEU 81 2HD2 LEU 81 6.228 -5.936 4.089 1387 HD23 LEU 81 3HD2 LEU 81 5.644 -6.626 5.606 1388 H ALA 82 H ALA 82 4.865 -9.549 0.598 1389 HA ALA 82 HA ALA 82 5.250 -12.101 1.715 1390 HB1 ALA 82 1HB ALA 82 5.229 -11.273 -1.188 1391 HB2 ALA 82 2HB ALA 82 3.813 -11.694 -0.227 1392 HB3 ALA 82 3HB ALA 82 5.032 -12.916 -0.583 1393 H ASN 83 H ASN 83 7.316 -9.867 0.193 1394 HA ASN 83 HA ASN 83 9.423 -11.639 -0.497 1395 HB2 ASN 83 2HB ASN 83 9.377 -8.643 -0.196 1396 HB3 ASN 83 1HB ASN 83 10.769 -9.544 -0.793 1397 HD21 ASN 83 1HD2 ASN 83 9.017 -7.563 -2.086 1398 HD22 ASN 83 2HD2 ASN 83 8.455 -8.347 -3.526 1399 H HIS 84 H HIS 84 8.404 -10.677 2.496 1400 HA HIS 84 HA HIS 84 11.085 -10.863 3.650 1401 HB2 HIS 84 2HB HIS 84 8.416 -10.271 4.962 1402 HB3 HIS 84 1HB HIS 84 9.890 -10.528 5.882 1403 HD1 HIS 84 1HD HIS 84 11.634 -8.632 5.868 1404 HD2 HIS 84 2HD HIS 84 8.235 -7.814 3.633 1405 HE1 HIS 84 1HE HIS 84 11.752 -6.185 5.336 1406 HE2 HIS 84 2HE HIS 84 9.933 -5.881 3.639 1407 H GLY 85 H GLY 85 9.207 -13.007 2.390 1408 HA2 GLY 85 2HA GLY 85 9.449 -15.329 2.627 1409 HA3 GLY 85 1HA GLY 85 10.036 -15.067 4.264 1410 H ILE 86 H ILE 86 7.274 -13.349 3.356 1411 HA ILE 86 HA ILE 86 5.703 -14.989 5.189 1412 HB ILE 86 HB ILE 86 5.140 -12.177 4.182 1413 HG12 ILE 86 2HG1 ILE 86 6.194 -13.105 6.860 1414 HG13 ILE 86 1HG1 ILE 86 7.149 -12.293 5.624 1415 HG21 ILE 86 1HG2 ILE 86 3.458 -12.111 5.974 1416 HG22 ILE 86 2HG2 ILE 86 3.831 -13.787 6.380 1417 HG23 ILE 86 3HG2 ILE 86 3.112 -13.398 4.817 1418 HD11 ILE 86 1HD1 ILE 86 6.504 -10.762 7.399 1419 HD12 ILE 86 2HD1 ILE 86 4.803 -11.139 7.113 1420 HD13 ILE 86 3HD1 ILE 86 5.737 -10.303 5.873 1421 H ASP 87 H ASP 87 3.882 -15.961 4.523 1422 HA ASP 87 HA ASP 87 3.121 -15.741 1.691 1423 HB2 ASP 87 2HB ASP 87 3.517 -18.031 2.576 1424 HB3 ASP 87 1HB ASP 87 2.274 -17.763 3.790 1425 H ILE 88 H ILE 88 1.386 -14.492 1.233 1426 HA ILE 88 HA ILE 88 -0.466 -13.993 3.458 1427 HB ILE 88 HB ILE 88 0.169 -11.931 1.306 1428 HG12 ILE 88 2HG1 ILE 88 1.243 -12.046 4.132 1429 HG13 ILE 88 1HG1 ILE 88 2.186 -12.438 2.698 1430 HG21 ILE 88 1HG2 ILE 88 -1.201 -11.773 3.996 1431 HG22 ILE 88 2HG2 ILE 88 -1.991 -11.690 2.422 1432 HG23 ILE 88 3HG2 ILE 88 -0.891 -10.407 2.928 1433 HD11 ILE 88 1HD1 ILE 88 2.607 -10.159 3.535 1434 HD12 ILE 88 2HD1 ILE 88 0.903 -9.780 3.252 1435 HD13 ILE 88 3HD1 ILE 88 1.939 -10.178 1.894 1436 H LYS 89 H LYS 89 -2.635 -13.804 2.909 1437 HA LYS 89 HA LYS 89 -3.401 -14.993 0.349 1438 HB2 LYS 89 2HB LYS 89 -4.878 -14.678 2.963 1439 HB3 LYS 89 1HB LYS 89 -5.520 -15.464 1.528 1440 HG2 LYS 89 2HG LYS 89 -3.941 -17.223 1.670 1441 HG3 LYS 89 1HG LYS 89 -3.012 -16.385 2.908 1442 HD2 LYS 89 2HD LYS 89 -4.874 -16.591 4.465 1443 HD3 LYS 89 1HD LYS 89 -5.846 -17.386 3.232 1444 HE2 LYS 89 2HE LYS 89 -3.223 -18.406 4.296 1445 HE3 LYS 89 1HE LYS 89 -4.798 -18.959 4.847 1446 HZ1 LYS 89 1HZ LYS 89 -3.687 -19.248 2.102 1447 HZ2 LYS 89 2HZ LYS 89 -5.249 -19.708 2.572 1448 HZ3 LYS 89 3HZ LYS 89 -3.891 -20.456 3.241 Start of MODEL 14 1 H1 MET 1 1HT MET 1 -27.780 19.750 6.665 2 H2 MET 1 2HT MET 1 -27.331 21.381 6.862 3 H3 MET 1 3HT MET 1 -26.358 20.154 7.472 4 HA MET 1 HA MET 1 -25.774 19.366 5.378 5 HB2 MET 1 2HB MET 1 -26.448 20.501 3.323 6 HB3 MET 1 1HB MET 1 -27.858 19.897 4.162 7 HG2 MET 1 2HG MET 1 -26.911 22.765 4.184 8 HG3 MET 1 1HG MET 1 -28.182 22.124 3.156 9 HE1 MET 1 1HE MET 1 -30.106 24.406 5.721 10 HE2 MET 1 2HE MET 1 -29.782 24.088 4.016 11 HE3 MET 1 3HE MET 1 -28.495 24.687 5.061 12 H GLY 2 H GLY 2 -23.866 20.089 4.514 13 HA2 GLY 2 2HA GLY 2 -22.332 21.734 3.883 14 HA3 GLY 2 1HA GLY 2 -23.181 22.894 4.892 15 H PHE 3 H PHE 3 -22.785 20.094 6.698 16 HA PHE 3 HA PHE 3 -20.149 20.951 7.585 17 HB2 PHE 3 2HB PHE 3 -21.796 22.073 9.039 18 HB3 PHE 3 1HB PHE 3 -22.473 20.506 9.466 19 HD1 PHE 3 1HD PHE 3 -19.450 22.617 9.709 20 HD2 PHE 3 2HD PHE 3 -21.487 19.185 11.167 21 HE1 PHE 3 1HE PHE 3 -17.827 22.442 11.538 22 HE2 PHE 3 2HE PHE 3 -19.862 19.002 13.012 23 HZ PHE 3 HZ PHE 3 -18.026 20.633 13.196 24 H THR 4 H THR 4 -18.859 19.338 7.496 25 HA THR 4 HA THR 4 -19.625 16.759 8.613 26 HB THR 4 HB THR 4 -18.020 17.208 6.062 27 HG1 THR 4 1HG THR 4 -20.597 17.143 6.508 28 HG21 THR 4 1HG2 THR 4 -17.329 15.201 7.347 29 HG22 THR 4 2HG2 THR 4 -18.122 14.762 5.831 30 HG23 THR 4 3HG2 THR 4 -19.004 14.646 7.355 31 H ASP 5 H ASP 5 -18.111 16.236 10.154 32 HA ASP 5 HA ASP 5 -16.036 18.160 10.460 33 HB2 ASP 5 2HB ASP 5 -15.561 17.165 12.674 34 HB3 ASP 5 1HB ASP 5 -17.230 17.660 12.484 35 H GLU 6 H GLU 6 -14.892 17.706 8.678 36 HA GLU 6 HA GLU 6 -12.639 16.040 9.379 37 HB2 GLU 6 2HB GLU 6 -13.827 14.600 7.774 38 HB3 GLU 6 1HB GLU 6 -13.928 15.930 6.623 39 HG2 GLU 6 2HG GLU 6 -11.510 15.968 6.397 40 HG3 GLU 6 1HG GLU 6 -11.351 14.715 7.612 41 H THR 7 H THR 7 -11.358 17.731 9.809 42 HA THR 7 HA THR 7 -11.089 19.728 7.754 43 HB THR 7 HB THR 7 -9.523 20.804 9.443 44 HG1 THR 7 1HG THR 7 -9.485 19.965 11.489 45 HG21 THR 7 1HG2 THR 7 -11.326 21.563 10.928 46 HG22 THR 7 2HG2 THR 7 -12.334 20.222 10.383 47 HG23 THR 7 3HG2 THR 7 -11.871 21.491 9.250 48 H VAL 8 H VAL 8 -9.007 20.158 6.835 49 HA VAL 8 HA VAL 8 -7.725 17.621 6.296 50 HB VAL 8 HB VAL 8 -6.595 18.792 4.418 51 HG11 VAL 8 1HG1 VAL 8 -9.594 19.093 4.534 52 HG12 VAL 8 2HG1 VAL 8 -8.707 17.645 4.063 53 HG13 VAL 8 3HG1 VAL 8 -8.621 19.095 3.062 54 HG21 VAL 8 1HG2 VAL 8 -6.520 21.045 5.359 55 HG22 VAL 8 2HG2 VAL 8 -8.281 21.136 5.297 56 HG23 VAL 8 3HG2 VAL 8 -7.352 21.048 3.804 57 H ARG 9 H ARG 9 -5.684 17.044 6.666 58 HA ARG 9 HA ARG 9 -3.938 18.972 8.012 59 HB2 ARG 9 2HB ARG 9 -3.998 15.949 8.177 60 HB3 ARG 9 1HB ARG 9 -2.642 16.899 8.713 61 HG2 ARG 9 2HG ARG 9 -3.904 16.218 10.611 62 HG3 ARG 9 1HG ARG 9 -4.122 17.947 10.409 63 HD2 ARG 9 2HD ARG 9 -6.340 17.592 9.515 64 HD3 ARG 9 1HD ARG 9 -6.098 15.839 9.520 65 HE ARG 9 HE ARG 9 -5.586 16.580 12.063 66 HH11 ARG 9 1HH1 ARG 9 -8.446 16.934 9.987 67 HH12 ARG 9 2HH1 ARG 9 -9.529 16.958 11.286 68 HH21 ARG 9 1HH2 ARG 9 -7.102 16.584 13.822 69 HH22 ARG 9 2HH2 ARG 9 -8.762 16.742 13.508 70 H PHE 10 H PHE 10 -2.362 19.678 6.692 71 HA PHE 10 HA PHE 10 -1.298 17.741 4.780 72 HB2 PHE 10 2HB PHE 10 -1.680 20.700 4.280 73 HB3 PHE 10 1HB PHE 10 -0.716 19.646 3.257 74 HD1 PHE 10 1HD PHE 10 -3.866 21.092 3.682 75 HD2 PHE 10 2HD PHE 10 -1.987 17.489 2.436 76 HE1 PHE 10 1HE PHE 10 -5.867 20.494 2.384 77 HE2 PHE 10 2HE PHE 10 -3.982 16.888 1.142 78 HZ PHE 10 HZ PHE 10 -5.927 18.392 1.112 79 H ASP 11 H ASP 11 0.587 17.110 5.357 80 HA ASP 11 HA ASP 11 2.666 19.013 5.972 81 HB2 ASP 11 2HB ASP 11 1.648 18.421 8.191 82 HB3 ASP 11 1HB ASP 11 1.981 16.727 7.848 83 H PHE 12 H PHE 12 4.751 18.008 5.698 84 HA PHE 12 HA PHE 12 4.615 15.403 4.407 85 HB2 PHE 12 2HB PHE 12 4.702 17.122 2.663 86 HB3 PHE 12 1HB PHE 12 6.132 17.812 3.414 87 HD1 PHE 12 1HD PHE 12 4.855 14.719 1.814 88 HD2 PHE 12 2HD PHE 12 8.252 17.094 2.778 89 HE1 PHE 12 1HE PHE 12 6.266 13.264 0.429 90 HE2 PHE 12 2HE PHE 12 9.664 15.646 1.390 91 HZ PHE 12 HZ PHE 12 8.672 13.732 0.213 92 H ASP 13 H ASP 13 5.658 14.152 5.752 93 HA ASP 13 HA ASP 13 8.132 15.103 6.970 94 HB2 ASP 13 2HB ASP 13 6.504 14.169 8.561 95 HB3 ASP 13 1HB ASP 13 6.432 12.675 7.636 96 H ASP 14 H ASP 14 9.664 14.835 5.482 97 HA ASP 14 HA ASP 14 9.732 12.640 3.652 98 HB2 ASP 14 2HB ASP 14 10.715 14.724 2.944 99 HB3 ASP 14 1HB ASP 14 11.816 14.725 4.315 100 H ASN 15 H ASN 15 10.061 10.726 4.347 101 HA ASN 15 HA ASN 15 12.562 10.169 5.748 102 HB2 ASN 15 2HB ASN 15 10.628 10.468 7.464 103 HB3 ASN 15 1HB ASN 15 10.016 8.955 6.817 104 HD21 ASN 15 1HD2 ASN 15 11.221 7.042 7.201 105 HD22 ASN 15 2HD2 ASN 15 12.383 6.976 8.497 106 H ARG 16 H ARG 16 10.727 9.691 3.188 107 HA ARG 16 HA ARG 16 10.529 6.945 2.833 108 HB2 ARG 16 2HB ARG 16 9.533 8.539 1.277 109 HB3 ARG 16 1HB ARG 16 11.129 9.110 0.815 110 HG2 ARG 16 2HG ARG 16 11.643 6.992 -0.204 111 HG3 ARG 16 1HG ARG 16 10.107 6.319 0.351 112 HD2 ARG 16 2HD ARG 16 10.402 8.667 -1.508 113 HD3 ARG 16 1HD ARG 16 10.063 7.016 -2.017 114 HE ARG 16 HE ARG 16 8.055 7.231 -0.520 115 HH11 ARG 16 1HH1 ARG 16 9.412 10.002 -2.249 116 HH12 ARG 16 2HH1 ARG 16 7.920 10.810 -2.403 117 HH21 ARG 16 1HH2 ARG 16 5.975 8.363 -0.819 118 HH22 ARG 16 2HH2 ARG 16 5.922 9.854 -1.570 119 H LYS 17 H LYS 17 12.009 5.537 3.124 120 HA LYS 17 HA LYS 17 14.577 5.577 1.962 121 HB2 LYS 17 2HB LYS 17 14.662 7.284 3.842 122 HB3 LYS 17 1HB LYS 17 14.328 5.984 4.963 123 HG2 LYS 17 2HG LYS 17 16.449 4.937 4.411 124 HG3 LYS 17 1HG LYS 17 16.754 6.169 3.186 125 HD2 LYS 17 2HD LYS 17 16.456 6.698 6.155 126 HD3 LYS 17 1HD LYS 17 17.980 6.663 5.269 127 HE2 LYS 17 2HE LYS 17 17.218 8.553 3.882 128 HE3 LYS 17 1HE LYS 17 15.696 8.591 4.758 129 HZ1 LYS 17 1HZ LYS 17 16.935 9.138 6.778 130 HZ2 LYS 17 2HZ LYS 17 17.181 10.268 5.572 131 HZ3 LYS 17 3HZ LYS 17 18.378 9.168 5.915 132 H LYS 18 H LYS 18 15.713 3.483 3.036 133 HA LYS 18 HA LYS 18 13.732 1.494 2.827 134 HB2 LYS 18 2HB LYS 18 16.645 1.187 3.503 135 HB3 LYS 18 1HB LYS 18 15.555 -0.171 3.270 136 HG2 LYS 18 2HG LYS 18 15.084 0.677 0.970 137 HG3 LYS 18 1HG LYS 18 16.325 1.903 1.207 138 HD2 LYS 18 2HD LYS 18 16.728 -1.090 1.294 139 HD3 LYS 18 1HD LYS 18 17.193 -0.028 -0.032 140 HE2 LYS 18 2HE LYS 18 18.777 1.116 1.458 141 HE3 LYS 18 1HE LYS 18 18.280 0.066 2.783 142 HZ1 LYS 18 1HZ LYS 18 19.101 -1.839 1.517 143 HZ2 LYS 18 2HZ LYS 18 20.310 -0.723 1.812 144 HZ3 LYS 18 3HZ LYS 18 19.616 -0.814 0.279 145 H ALA 19 H ALA 19 14.593 3.193 5.547 146 HA ALA 19 HA ALA 19 14.280 1.270 7.583 147 HB1 ALA 19 1HB ALA 19 15.073 3.512 8.061 148 HB2 ALA 19 2HB ALA 19 13.650 3.043 9.029 149 HB3 ALA 19 3HB ALA 19 13.440 4.125 7.652 150 H ILE 20 H ILE 20 11.971 2.816 5.549 151 HA ILE 20 HA ILE 20 9.646 2.480 7.027 152 HB ILE 20 HB ILE 20 10.055 2.372 4.025 153 HG12 ILE 20 2HG1 ILE 20 9.093 4.582 5.856 154 HG13 ILE 20 1HG1 ILE 20 10.665 4.492 5.073 155 HG21 ILE 20 1HG2 ILE 20 7.452 2.578 5.538 156 HG22 ILE 20 2HG2 ILE 20 7.982 1.228 4.536 157 HG23 ILE 20 3HG2 ILE 20 7.646 2.793 3.795 158 HD11 ILE 20 1HD1 ILE 20 9.130 6.049 3.978 159 HD12 ILE 20 2HD1 ILE 20 8.023 4.722 3.655 160 HD13 ILE 20 3HD1 ILE 20 9.618 4.738 2.896 161 H SER 21 H SER 21 11.559 0.169 5.348 162 HA SER 21 HA SER 21 9.548 -1.865 5.141 163 HB2 SER 21 2HB SER 21 11.374 -3.418 4.571 164 HB3 SER 21 1HB SER 21 11.572 -1.902 3.702 165 HG SER 21 HG SER 21 13.236 -1.336 5.018 166 H GLU 22 H GLU 22 11.860 -0.949 7.502 167 HA GLU 22 HA GLU 22 11.733 -3.123 9.289 168 HB2 GLU 22 2HB GLU 22 13.516 -1.451 9.253 169 HB3 GLU 22 1HB GLU 22 12.372 -0.198 9.668 170 HG2 GLU 22 2HG GLU 22 12.023 -1.209 11.816 171 HG3 GLU 22 1HG GLU 22 13.190 -2.495 11.436 172 H THR 23 H THR 23 9.941 -0.118 8.919 173 HA THR 23 HA THR 23 8.402 -0.242 11.269 174 HB THR 23 HB THR 23 7.766 1.084 8.618 175 HG1 THR 23 1HG THR 23 9.615 1.619 10.513 176 HG21 THR 23 1HG2 THR 23 5.786 0.925 10.053 177 HG22 THR 23 2HG2 THR 23 6.345 2.593 9.968 178 HG23 THR 23 3HG2 THR 23 6.696 1.618 11.396 179 H LEU 24 H LEU 24 7.608 -1.154 7.901 180 HA LEU 24 HA LEU 24 5.075 -2.129 8.679 181 HB2 LEU 24 2HB LEU 24 6.501 -2.312 6.055 182 HB3 LEU 24 1HB LEU 24 5.004 -3.178 6.336 183 HG LEU 24 HG LEU 24 3.884 -1.024 6.829 184 HD11 LEU 24 1HD1 LEU 24 4.925 1.071 6.184 185 HD12 LEU 24 2HD1 LEU 24 6.451 0.230 5.904 186 HD13 LEU 24 3HD1 LEU 24 5.769 0.302 7.528 187 HD21 LEU 24 1HD2 LEU 24 3.775 -0.267 4.515 188 HD22 LEU 24 2HD2 LEU 24 3.720 -2.025 4.641 189 HD23 LEU 24 3HD2 LEU 24 5.210 -1.225 4.143 190 H GLU 25 H GLU 25 8.128 -3.724 8.423 191 HA GLU 25 HA GLU 25 7.210 -6.354 8.466 192 HB2 GLU 25 2HB GLU 25 9.571 -5.641 8.098 193 HB3 GLU 25 1HB GLU 25 9.665 -5.115 9.760 194 HG2 GLU 25 2HG GLU 25 9.172 -7.982 9.016 195 HG3 GLU 25 1HG GLU 25 10.791 -7.305 9.093 196 H THR 26 H THR 26 7.560 -3.935 11.024 197 HA THR 26 HA THR 26 6.775 -5.648 13.152 198 HB THR 26 HB THR 26 6.651 -2.611 13.049 199 HG1 THR 26 1HG THR 26 8.746 -4.463 13.482 200 HG21 THR 26 1HG2 THR 26 6.882 -2.782 15.466 201 HG22 THR 26 2HG2 THR 26 7.062 -4.541 15.336 202 HG23 THR 26 3HG2 THR 26 5.531 -3.799 14.927 203 H VAL 27 H VAL 27 5.091 -3.322 11.068 204 HA VAL 27 HA VAL 27 2.587 -3.365 12.347 205 HB VAL 27 HB VAL 27 3.104 -2.952 9.377 206 HG11 VAL 27 1HG1 VAL 27 0.761 -3.383 9.858 207 HG12 VAL 27 2HG1 VAL 27 0.999 -1.698 9.388 208 HG13 VAL 27 3HG1 VAL 27 0.769 -2.115 11.087 209 HG21 VAL 27 1HG2 VAL 27 2.888 -0.881 11.564 210 HG22 VAL 27 2HG2 VAL 27 3.131 -0.566 9.854 211 HG23 VAL 27 3HG2 VAL 27 4.397 -1.372 10.787 212 H TYR 28 H TYR 28 3.968 -5.443 9.903 213 HA TYR 28 HA TYR 28 1.645 -6.888 9.277 214 HB2 TYR 28 2HB TYR 28 3.642 -7.010 7.859 215 HB3 TYR 28 1HB TYR 28 4.532 -7.817 9.146 216 HD1 TYR 28 1HD TYR 28 4.261 -10.144 9.549 217 HD2 TYR 28 2HD TYR 28 1.797 -8.197 6.695 218 HE1 TYR 28 1HE TYR 28 3.470 -12.332 8.740 219 HE2 TYR 28 2HE TYR 28 1.001 -10.382 5.871 220 HH TYR 28 HH TYR 28 1.486 -13.204 7.631 221 H ARG 29 H ARG 29 4.240 -7.638 11.592 222 HA ARG 29 HA ARG 29 3.044 -9.965 12.583 223 HB2 ARG 29 2HB ARG 29 5.196 -8.190 13.607 224 HB3 ARG 29 1HB ARG 29 4.483 -9.351 14.713 225 HG2 ARG 29 2HG ARG 29 5.654 -10.064 12.042 226 HG3 ARG 29 1HG ARG 29 6.541 -10.176 13.566 227 HD2 ARG 29 2HD ARG 29 4.805 -11.720 14.420 228 HD3 ARG 29 1HD ARG 29 3.985 -11.648 12.869 229 HE ARG 29 HE ARG 29 6.507 -12.414 12.265 230 HH11 ARG 29 1HH1 ARG 29 3.982 -13.719 14.492 231 HH12 ARG 29 2HH1 ARG 29 4.507 -15.307 14.287 232 HH21 ARG 29 1HH2 ARG 29 7.148 -14.666 12.054 233 HH22 ARG 29 2HH2 ARG 29 6.295 -15.873 12.907 234 H ALA 30 H ALA 30 2.565 -6.670 13.430 235 HA ALA 30 HA ALA 30 1.297 -6.937 15.886 236 HB1 ALA 30 1HB ALA 30 1.886 -4.766 14.905 237 HB2 ALA 30 2HB ALA 30 0.198 -4.809 15.422 238 HB3 ALA 30 3HB ALA 30 0.608 -4.964 13.708 239 H LEU 31 H LEU 31 -0.216 -6.943 12.673 240 HA LEU 31 HA LEU 31 -2.678 -7.710 13.857 241 HB2 LEU 31 2HB LEU 31 -1.959 -7.479 10.969 242 HB3 LEU 31 1HB LEU 31 -3.542 -7.996 11.500 243 HG LEU 31 HG LEU 31 -3.467 -5.776 12.849 244 HD11 LEU 31 1HD1 LEU 31 -1.519 -5.125 10.680 245 HD12 LEU 31 2HD1 LEU 31 -1.230 -5.110 12.421 246 HD13 LEU 31 3HD1 LEU 31 -2.342 -3.947 11.697 247 HD21 LEU 31 1HD2 LEU 31 -4.515 -4.600 11.007 248 HD22 LEU 31 2HD2 LEU 31 -5.115 -6.234 11.213 249 HD23 LEU 31 3HD2 LEU 31 -4.016 -5.858 9.890 250 H GLU 32 H GLU 32 -0.126 -9.502 12.353 251 HA GLU 32 HA GLU 32 -1.481 -11.925 11.956 252 HB2 GLU 32 2HB GLU 32 1.386 -11.326 12.574 253 HB3 GLU 32 1HB GLU 32 0.807 -12.965 12.333 254 HG2 GLU 32 2HG GLU 32 0.428 -10.782 10.324 255 HG3 GLU 32 1HG GLU 32 1.826 -11.854 10.338 256 H GLU 33 H GLU 33 0.236 -10.758 14.812 257 HA GLU 33 HA GLU 33 -0.225 -13.100 16.315 258 HB2 GLU 33 2HB GLU 33 0.374 -10.310 17.275 259 HB3 GLU 33 1HB GLU 33 0.539 -11.779 18.222 260 HG2 GLU 33 2HG GLU 33 2.145 -11.014 15.787 261 HG3 GLU 33 1HG GLU 33 2.709 -11.033 17.457 262 H LYS 34 H LYS 34 -2.116 -10.326 15.615 263 HA LYS 34 HA LYS 34 -4.021 -10.835 17.760 264 HB2 LYS 34 2HB LYS 34 -3.831 -8.721 15.653 265 HB3 LYS 34 1HB LYS 34 -5.219 -8.857 16.717 266 HG2 LYS 34 2HG LYS 34 -2.378 -8.474 17.630 267 HG3 LYS 34 1HG LYS 34 -3.558 -7.177 17.440 268 HD2 LYS 34 2HD LYS 34 -3.918 -9.557 19.275 269 HD3 LYS 34 1HD LYS 34 -3.332 -7.978 19.782 270 HE2 LYS 34 2HE LYS 34 -5.374 -6.947 19.072 271 HE3 LYS 34 1HE LYS 34 -6.015 -8.483 18.484 272 HZ1 LYS 34 1HZ LYS 34 -5.960 -9.306 20.787 273 HZ2 LYS 34 2HZ LYS 34 -6.895 -7.915 20.630 274 HZ3 LYS 34 3HZ LYS 34 -5.369 -7.807 21.306 275 H GLY 35 H GLY 35 -3.543 -11.905 14.641 276 HA2 GLY 35 2HA GLY 35 -4.809 -13.471 13.505 277 HA3 GLY 35 1HA GLY 35 -6.083 -13.253 14.693 278 H TYR 36 H TYR 36 -4.861 -10.419 13.186 279 HA TYR 36 HA TYR 36 -7.379 -10.187 11.665 280 HB2 TYR 36 2HB TYR 36 -5.323 -8.065 12.322 281 HB3 TYR 36 1HB TYR 36 -6.790 -7.786 11.409 282 HD1 TYR 36 1HD TYR 36 -5.254 -7.366 14.435 283 HD2 TYR 36 2HD TYR 36 -8.993 -8.587 12.832 284 HE1 TYR 36 1HE TYR 36 -6.343 -6.719 16.522 285 HE2 TYR 36 2HE TYR 36 -10.109 -7.927 14.931 286 HH TYR 36 HH TYR 36 -9.519 -7.599 17.290 287 H ASN 37 H ASN 37 -7.003 -8.835 9.569 288 HA ASN 37 HA ASN 37 -4.842 -10.127 8.084 289 HB2 ASN 37 2HB ASN 37 -7.260 -8.571 7.103 290 HB3 ASN 37 1HB ASN 37 -6.022 -9.230 6.050 291 HD21 ASN 37 1HD2 ASN 37 -5.950 -11.448 5.701 292 HD22 ASN 37 2HD2 ASN 37 -7.233 -12.496 6.144 293 HA PRO 38 HA PRO 38 -2.480 -6.348 9.006 294 HB2 PRO 38 2HB PRO 38 -0.746 -7.687 7.001 295 HB3 PRO 38 1HB PRO 38 -0.327 -6.992 8.571 296 HG2 PRO 38 2HG PRO 38 -0.488 -9.624 8.248 297 HG3 PRO 38 1HG PRO 38 -1.058 -8.866 9.737 298 HD2 PRO 38 2HD PRO 38 -2.622 -9.992 7.471 299 HD3 PRO 38 1HD PRO 38 -3.007 -9.913 9.207 300 H ILE 39 H ILE 39 -2.908 -7.688 5.802 301 HA ILE 39 HA ILE 39 -2.045 -5.440 4.364 302 HB ILE 39 HB ILE 39 -3.918 -7.638 3.484 303 HG12 ILE 39 2HG1 ILE 39 -1.793 -8.524 4.250 304 HG13 ILE 39 1HG1 ILE 39 -1.889 -8.641 2.499 305 HG21 ILE 39 1HG2 ILE 39 -3.235 -7.048 1.194 306 HG22 ILE 39 2HG2 ILE 39 -2.308 -5.690 1.834 307 HG23 ILE 39 3HG2 ILE 39 -4.062 -5.715 1.996 308 HD11 ILE 39 1HD1 ILE 39 -0.491 -6.624 2.317 309 HD12 ILE 39 2HD1 ILE 39 0.318 -7.940 3.148 310 HD13 ILE 39 3HD1 ILE 39 -0.334 -6.589 4.073 311 H ASN 40 H ASN 40 -5.313 -6.464 5.269 312 HA ASN 40 HA ASN 40 -6.591 -4.439 3.801 313 HB2 ASN 40 2HB ASN 40 -7.627 -6.106 6.078 314 HB3 ASN 40 1HB ASN 40 -8.621 -5.016 5.115 315 HD21 ASN 40 1HD2 ASN 40 -9.036 -5.521 2.942 316 HD22 ASN 40 2HD2 ASN 40 -8.751 -7.099 2.332 317 H GLN 41 H GLN 41 -5.541 -4.553 7.138 318 HA GLN 41 HA GLN 41 -6.783 -2.052 7.640 319 HB2 GLN 41 2HB GLN 41 -4.714 -3.524 9.245 320 HB3 GLN 41 1HB GLN 41 -5.559 -2.080 9.790 321 HG2 GLN 41 2HG GLN 41 -6.856 -4.728 9.119 322 HG3 GLN 41 1HG GLN 41 -6.555 -4.114 10.735 323 HE21 GLN 41 1HE2 GLN 41 -7.341 -1.397 10.080 324 HE22 GLN 41 2HE2 GLN 41 -9.062 -1.410 9.904 325 H ILE 42 H ILE 42 -3.576 -3.037 6.567 326 HA ILE 42 HA ILE 42 -2.389 -0.488 6.831 327 HB ILE 42 HB ILE 42 -1.690 -2.756 4.927 328 HG12 ILE 42 2HG1 ILE 42 -0.376 -1.819 7.491 329 HG13 ILE 42 1HG1 ILE 42 -1.378 -3.253 7.324 330 HG21 ILE 42 1HG2 ILE 42 -0.123 -0.224 5.481 331 HG22 ILE 42 2HG2 ILE 42 -0.899 -0.659 3.964 332 HG23 ILE 42 3HG2 ILE 42 0.466 -1.605 4.554 333 HD11 ILE 42 1HD1 ILE 42 0.285 -4.224 5.805 334 HD12 ILE 42 2HD1 ILE 42 0.982 -3.828 7.374 335 HD13 ILE 42 3HD1 ILE 42 1.284 -2.782 5.986 336 H VAL 43 H VAL 43 -3.904 -2.041 3.975 337 HA VAL 43 HA VAL 43 -3.733 0.214 2.338 338 HB VAL 43 HB VAL 43 -4.325 -1.859 1.218 339 HG11 VAL 43 1HG1 VAL 43 -5.461 -2.942 3.074 340 HG12 VAL 43 2HG1 VAL 43 -6.451 -3.013 1.609 341 HG13 VAL 43 3HG1 VAL 43 -6.836 -1.859 2.887 342 HG21 VAL 43 1HG2 VAL 43 -6.756 -0.079 1.173 343 HG22 VAL 43 2HG2 VAL 43 -6.327 -1.278 -0.051 344 HG23 VAL 43 3HG2 VAL 43 -5.299 0.138 0.209 345 H GLY 44 H GLY 44 -6.206 -0.682 4.663 346 HA2 GLY 44 2HA GLY 44 -7.978 1.434 4.190 347 HA3 GLY 44 1HA GLY 44 -7.809 0.568 5.711 348 H TYR 45 H TYR 45 -5.104 1.205 6.252 349 HA TYR 45 HA TYR 45 -5.432 3.721 7.467 350 HB2 TYR 45 2HB TYR 45 -3.941 2.118 8.526 351 HB3 TYR 45 1HB TYR 45 -2.887 2.110 7.110 352 HD1 TYR 45 1HD TYR 45 -1.220 3.836 6.795 353 HD2 TYR 45 2HD TYR 45 -4.093 4.209 9.904 354 HE1 TYR 45 1HE TYR 45 0.002 5.748 7.694 355 HE2 TYR 45 2HE TYR 45 -2.863 6.123 10.790 356 HH TYR 45 HH TYR 45 -0.553 6.944 10.712 357 H LEU 46 H LEU 46 -3.321 2.748 4.763 358 HA LEU 46 HA LEU 46 -2.358 5.352 4.509 359 HB2 LEU 46 2HB LEU 46 -2.176 3.084 2.572 360 HB3 LEU 46 1HB LEU 46 -1.552 4.670 2.161 361 HG LEU 46 HG LEU 46 -0.079 4.460 4.251 362 HD11 LEU 46 1HD1 LEU 46 0.390 2.301 5.140 363 HD12 LEU 46 2HD1 LEU 46 -0.809 1.581 4.060 364 HD13 LEU 46 3HD1 LEU 46 -1.338 2.673 5.312 365 HD21 LEU 46 1HD2 LEU 46 0.823 4.226 2.026 366 HD22 LEU 46 2HD2 LEU 46 0.347 2.527 1.987 367 HD23 LEU 46 3HD2 LEU 46 1.580 3.072 3.124 368 H LEU 47 H LEU 47 -5.133 3.900 3.038 369 HA LEU 47 HA LEU 47 -5.509 6.158 1.291 370 HB2 LEU 47 2HB LEU 47 -7.402 3.913 1.978 371 HB3 LEU 47 1HB LEU 47 -7.642 5.091 0.707 372 HG LEU 47 HG LEU 47 -5.529 2.942 0.811 373 HD11 LEU 47 1HD1 LEU 47 -6.679 2.062 -1.154 374 HD12 LEU 47 2HD1 LEU 47 -7.898 3.328 -1.000 375 HD13 LEU 47 3HD1 LEU 47 -7.725 2.112 0.266 376 HD21 LEU 47 1HD2 LEU 47 -4.895 3.692 -1.443 377 HD22 LEU 47 2HD2 LEU 47 -4.596 4.919 -0.217 378 HD23 LEU 47 3HD2 LEU 47 -5.996 5.064 -1.284 379 H SER 48 H SER 48 -5.843 5.925 4.566 380 HA SER 48 HA SER 48 -8.107 7.810 4.522 381 HB2 SER 48 2HB SER 48 -7.613 5.745 6.661 382 HB3 SER 48 1HB SER 48 -8.970 6.867 6.569 383 HG SER 48 HG SER 48 -8.381 4.592 5.132 384 H GLY 49 H GLY 49 -4.849 7.155 5.849 385 HA2 GLY 49 2HA GLY 49 -3.538 8.396 7.171 386 HA3 GLY 49 1HA GLY 49 -4.641 9.736 6.898 387 H ASP 50 H ASP 50 -5.832 6.760 8.305 388 HA ASP 50 HA ASP 50 -6.178 8.247 10.796 389 HB2 ASP 50 2HB ASP 50 -8.277 7.931 9.701 390 HB3 ASP 50 1HB ASP 50 -8.009 6.203 9.555 391 HA PRO 51 HA PRO 51 -3.387 5.147 12.500 392 HB2 PRO 51 2HB PRO 51 -3.759 5.975 15.111 393 HB3 PRO 51 1HB PRO 51 -2.585 6.647 13.977 394 HG2 PRO 51 2HG PRO 51 -5.303 7.650 14.697 395 HG3 PRO 51 1HG PRO 51 -3.807 8.567 14.439 396 HD2 PRO 51 2HD PRO 51 -5.706 8.475 12.612 397 HD3 PRO 51 1HD PRO 51 -3.996 8.437 12.127 398 H ALA 52 H ALA 52 -6.755 5.468 13.390 399 HA ALA 52 HA ALA 52 -6.747 3.315 15.248 400 HB1 ALA 52 1HB ALA 52 -9.101 4.485 13.774 401 HB2 ALA 52 2HB ALA 52 -8.467 5.073 15.311 402 HB3 ALA 52 3HB ALA 52 -9.173 3.459 15.206 403 H TYR 53 H TYR 53 -6.588 3.365 11.876 404 HA TYR 53 HA TYR 53 -7.866 0.929 11.358 405 HB2 TYR 53 2HB TYR 53 -5.870 2.524 9.835 406 HB3 TYR 53 1HB TYR 53 -6.269 0.887 9.304 407 HD1 TYR 53 1HD TYR 53 -8.394 0.340 8.467 408 HD2 TYR 53 2HD TYR 53 -7.597 4.252 9.857 409 HE1 TYR 53 1HE TYR 53 -10.454 1.074 7.475 410 HE2 TYR 53 2HE TYR 53 -9.687 5.046 8.845 411 HH TYR 53 HH TYR 53 -11.268 4.436 7.150 412 H ILE 54 H ILE 54 -4.684 1.643 12.605 413 HA ILE 54 HA ILE 54 -4.031 -1.202 12.440 414 HB ILE 54 HB ILE 54 -2.206 1.154 13.111 415 HG12 ILE 54 2HG1 ILE 54 -2.840 1.156 10.738 416 HG13 ILE 54 1HG1 ILE 54 -1.156 0.693 10.932 417 HG21 ILE 54 1HG2 ILE 54 -0.354 -0.421 12.966 418 HG22 ILE 54 2HG2 ILE 54 -1.486 -1.747 12.721 419 HG23 ILE 54 3HG2 ILE 54 -1.475 -0.866 14.253 420 HD11 ILE 54 1HD1 ILE 54 -3.449 -1.188 10.402 421 HD12 ILE 54 2HD1 ILE 54 -1.758 -1.650 10.600 422 HD13 ILE 54 3HD1 ILE 54 -2.250 -0.650 9.232 423 HA PRO 55 HA PRO 55 -5.114 -1.476 16.765 424 HB2 PRO 55 2HB PRO 55 -3.949 -3.914 17.257 425 HB3 PRO 55 1HB PRO 55 -5.525 -3.726 16.484 426 HG2 PRO 55 2HG PRO 55 -2.860 -4.245 15.254 427 HG3 PRO 55 1HG PRO 55 -4.441 -4.910 14.825 428 HD2 PRO 55 2HD PRO 55 -3.272 -2.920 13.416 429 HD3 PRO 55 1HD PRO 55 -5.034 -3.062 13.585 430 H ARG 56 H ARG 56 -4.048 -1.533 18.799 431 HA ARG 56 HA ARG 56 -1.280 -0.612 18.556 432 HB2 ARG 56 2HB ARG 56 -1.524 0.554 20.740 433 HB3 ARG 56 1HB ARG 56 -2.613 1.150 19.515 434 HG2 ARG 56 2HG ARG 56 -3.462 -0.796 21.648 435 HG3 ARG 56 1HG ARG 56 -3.496 0.949 21.869 436 HD2 ARG 56 2HD ARG 56 -5.013 1.155 19.962 437 HD3 ARG 56 1HD ARG 56 -4.987 -0.589 19.730 438 HE ARG 56 HE ARG 56 -5.731 -0.173 22.330 439 HH11 ARG 56 1HH1 ARG 56 -7.008 0.628 19.144 440 HH12 ARG 56 2HH1 ARG 56 -8.633 0.662 19.637 441 HH21 ARG 56 1HH2 ARG 56 -7.920 -0.090 23.027 442 HH22 ARG 56 2HH2 ARG 56 -9.179 0.256 21.927 443 H TYR 57 H TYR 57 -2.317 -3.391 18.857 444 HA TYR 57 HA TYR 57 -1.505 -4.548 21.217 445 HB2 TYR 57 2HB TYR 57 -2.586 -5.773 19.397 446 HB3 TYR 57 1HB TYR 57 -1.157 -5.574 18.399 447 HD1 TYR 57 1HD TYR 57 -2.131 -6.970 21.719 448 HD2 TYR 57 2HD TYR 57 0.324 -7.353 18.274 449 HE1 TYR 57 1HE TYR 57 -1.282 -9.112 22.569 450 HE2 TYR 57 2HE TYR 57 1.184 -9.489 19.113 451 HH TYR 57 HH TYR 57 1.419 -10.687 21.172 452 H GLN 58 H GLN 58 0.426 -3.577 18.423 453 HA GLN 58 HA GLN 58 2.884 -3.931 19.966 454 HB2 GLN 58 2HB GLN 58 2.454 -3.902 16.966 455 HB3 GLN 58 1HB GLN 58 4.021 -4.017 17.739 456 HG2 GLN 58 2HG GLN 58 1.803 -6.040 17.959 457 HG3 GLN 58 1HG GLN 58 3.203 -6.179 16.900 458 HE21 GLN 58 1HE2 GLN 58 5.209 -6.690 17.811 459 HE22 GLN 58 2HE2 GLN 58 5.344 -7.296 19.415 460 H ASP 59 H ASP 59 4.546 -2.291 19.101 461 HA ASP 59 HA ASP 59 3.403 0.326 19.407 462 HB2 ASP 59 2HB ASP 59 5.704 1.225 19.331 463 HB3 ASP 59 1HB ASP 59 5.527 -0.046 20.521 464 H ALA 60 H ALA 60 3.864 -1.580 16.863 465 HA ALA 60 HA ALA 60 4.687 -0.136 14.694 466 HB1 ALA 60 1HB ALA 60 4.066 -2.503 14.681 467 HB2 ALA 60 2HB ALA 60 3.342 -1.604 13.349 468 HB3 ALA 60 3HB ALA 60 2.368 -2.035 14.749 469 H ARG 61 H ARG 61 1.537 0.153 16.325 470 HA ARG 61 HA ARG 61 0.178 1.594 14.342 471 HB2 ARG 61 2HB ARG 61 -0.918 0.630 16.339 472 HB3 ARG 61 1HB ARG 61 -0.130 1.845 17.337 473 HG2 ARG 61 2HG ARG 61 -1.306 3.604 16.056 474 HG3 ARG 61 1HG ARG 61 -2.159 2.344 15.166 475 HD2 ARG 61 2HD ARG 61 -3.041 1.497 17.303 476 HD3 ARG 61 1HD ARG 61 -2.253 2.835 18.134 477 HE ARG 61 HE ARG 61 -4.161 3.353 16.001 478 HH11 ARG 61 1HH1 ARG 61 -3.239 3.712 19.418 479 HH12 ARG 61 2HH1 ARG 61 -4.603 4.615 19.861 480 HH21 ARG 61 1HH2 ARG 61 -6.072 4.664 16.636 481 HH22 ARG 61 2HH2 ARG 61 -6.253 5.145 18.255 482 H ASN 62 H ASN 62 2.210 2.697 17.033 483 HA ASN 62 HA ASN 62 1.913 5.467 16.498 484 HB2 ASN 62 2HB ASN 62 2.722 4.679 18.676 485 HB3 ASN 62 1HB ASN 62 4.156 3.998 17.916 486 HD21 ASN 62 1HD2 ASN 62 5.571 5.255 19.101 487 HD22 ASN 62 2HD2 ASN 62 5.744 6.956 18.861 488 H LEU 63 H LEU 63 4.295 3.044 15.664 489 HA LEU 63 HA LEU 63 6.142 4.623 14.326 490 HB2 LEU 63 2HB LEU 63 5.366 1.781 13.716 491 HB3 LEU 63 1HB LEU 63 6.808 2.591 13.137 492 HG LEU 63 HG LEU 63 6.205 1.894 16.025 493 HD11 LEU 63 1HD1 LEU 63 8.200 0.790 14.067 494 HD12 LEU 63 2HD1 LEU 63 6.752 -0.037 14.637 495 HD13 LEU 63 3HD1 LEU 63 8.055 0.339 15.763 496 HD21 LEU 63 1HD2 LEU 63 8.643 3.148 14.767 497 HD22 LEU 63 2HD2 LEU 63 8.481 2.661 16.453 498 HD23 LEU 63 3HD2 LEU 63 7.496 3.984 15.817 499 H ILE 64 H ILE 64 3.315 2.932 12.954 500 HA ILE 64 HA ILE 64 3.902 3.752 10.316 501 HB ILE 64 HB ILE 64 2.465 1.767 10.849 502 HG12 ILE 64 2HG1 ILE 64 1.108 3.823 9.083 503 HG13 ILE 64 1HG1 ILE 64 2.439 2.784 8.589 504 HG21 ILE 64 1HG2 ILE 64 0.389 3.848 11.541 505 HG22 ILE 64 2HG2 ILE 64 1.138 2.719 12.655 506 HG23 ILE 64 3HG2 ILE 64 0.076 2.120 11.374 507 HD11 ILE 64 1HD1 ILE 64 0.999 0.816 8.939 508 HD12 ILE 64 2HD1 ILE 64 0.325 1.944 7.760 509 HD13 ILE 64 3HD1 ILE 64 -0.321 1.892 9.397 510 H ARG 65 H ARG 65 2.002 5.236 12.888 511 HA ARG 65 HA ARG 65 1.133 7.237 11.001 512 HB2 ARG 65 2HB ARG 65 -0.287 8.205 12.779 513 HB3 ARG 65 1HB ARG 65 -0.604 6.510 12.531 514 HG2 ARG 65 2HG ARG 65 -0.740 6.883 14.863 515 HG3 ARG 65 1HG ARG 65 0.805 6.085 14.597 516 HD2 ARG 65 2HD ARG 65 1.963 8.186 14.796 517 HD3 ARG 65 1HD ARG 65 0.412 9.033 14.862 518 HE ARG 65 HE ARG 65 0.643 7.092 16.915 519 HH11 ARG 65 1HH1 ARG 65 1.630 10.409 16.096 520 HH12 ARG 65 2HH1 ARG 65 1.798 10.886 17.718 521 HH21 ARG 65 1HH2 ARG 65 0.872 7.758 19.091 522 HH22 ARG 65 2HH2 ARG 65 1.377 9.351 19.466 523 H ARG 66 H ARG 66 3.834 6.753 12.492 524 HA ARG 66 HA ARG 66 4.471 9.495 13.124 525 HB2 ARG 66 2HB ARG 66 5.431 7.671 14.481 526 HB3 ARG 66 1HB ARG 66 6.141 6.966 13.045 527 HG2 ARG 66 2HG ARG 66 7.634 8.878 12.826 528 HG3 ARG 66 1HG ARG 66 6.904 9.622 14.254 529 HD2 ARG 66 2HD ARG 66 7.666 7.819 15.640 530 HD3 ARG 66 1HD ARG 66 8.240 6.924 14.235 531 HE ARG 66 HE ARG 66 9.433 9.515 14.522 532 HH11 ARG 66 1HH1 ARG 66 9.612 6.198 15.689 533 HH12 ARG 66 2HH1 ARG 66 11.305 6.193 15.879 534 HH21 ARG 66 1HH2 ARG 66 11.762 9.518 14.782 535 HH22 ARG 66 2HH2 ARG 66 12.555 8.125 15.365 536 H HIS 67 H HIS 67 4.071 7.694 10.402 537 HA HIS 67 HA HIS 67 6.001 9.281 8.865 538 HB2 HIS 67 2HB HIS 67 5.029 6.471 8.285 539 HB3 HIS 67 1HB HIS 67 6.008 7.429 7.191 540 HD1 HIS 67 1HD HIS 67 8.470 7.964 8.096 541 HD2 HIS 67 2HD HIS 67 6.399 5.004 10.130 542 HE1 HIS 67 1HE HIS 67 10.223 6.630 9.332 543 HE2 HIS 67 2HE HIS 67 8.968 4.827 10.517 544 H GLU 68 H GLU 68 5.246 9.726 6.653 545 HA GLU 68 HA GLU 68 2.399 10.195 6.610 546 HB2 GLU 68 2HB GLU 68 4.528 10.873 4.572 547 HB3 GLU 68 1HB GLU 68 2.831 11.294 4.408 548 HG2 GLU 68 2HG GLU 68 4.737 12.276 6.517 549 HG3 GLU 68 1HG GLU 68 4.075 13.203 5.169 550 H ARG 69 H ARG 69 1.153 9.583 4.632 551 HA ARG 69 HA ARG 69 1.539 6.744 4.414 552 HB2 ARG 69 2HB ARG 69 -0.744 8.406 3.279 553 HB3 ARG 69 1HB ARG 69 -0.669 6.653 3.271 554 HG2 ARG 69 2HG ARG 69 -2.087 7.177 5.074 555 HG3 ARG 69 1HG ARG 69 -0.529 6.835 5.842 556 HD2 ARG 69 2HD ARG 69 -0.228 9.421 5.571 557 HD3 ARG 69 1HD ARG 69 -1.962 9.403 5.409 558 HE ARG 69 HE ARG 69 -1.034 7.985 7.711 559 HH11 ARG 69 1HH1 ARG 69 -2.064 11.160 6.476 560 HH12 ARG 69 2HH1 ARG 69 -2.266 11.836 8.008 561 HH21 ARG 69 1HH2 ARG 69 -1.306 8.911 9.778 562 HH22 ARG 69 2HH2 ARG 69 -1.818 10.534 9.973 563 H ASP 70 H ASP 70 1.752 9.525 2.376 564 HA ASP 70 HA ASP 70 1.955 8.242 -0.130 565 HB2 ASP 70 2HB ASP 70 1.635 10.699 0.196 566 HB3 ASP 70 1HB ASP 70 3.298 10.811 0.751 567 H GLU 71 H GLU 71 4.389 9.097 2.262 568 HA GLU 71 HA GLU 71 6.781 8.446 1.004 569 HB2 GLU 71 2HB GLU 71 5.958 8.073 3.884 570 HB3 GLU 71 1HB GLU 71 7.611 7.987 3.306 571 HG2 GLU 71 2HG GLU 71 5.862 10.412 3.022 572 HG3 GLU 71 1HG GLU 71 6.970 10.151 4.375 573 H ILE 72 H ILE 72 4.747 6.385 2.983 574 HA ILE 72 HA ILE 72 6.302 4.017 2.646 575 HB ILE 72 HB ILE 72 3.444 4.383 3.574 576 HG12 ILE 72 2HG1 ILE 72 6.001 4.158 5.183 577 HG13 ILE 72 1HG1 ILE 72 5.074 5.631 4.936 578 HG21 ILE 72 1HG2 ILE 72 3.862 2.084 2.900 579 HG22 ILE 72 2HG2 ILE 72 3.701 2.193 4.653 580 HG23 ILE 72 3HG2 ILE 72 5.297 2.025 3.924 581 HD11 ILE 72 1HD1 ILE 72 4.114 3.167 6.380 582 HD12 ILE 72 2HD1 ILE 72 3.197 4.657 6.147 583 HD13 ILE 72 3HD1 ILE 72 4.662 4.666 7.132 584 H MET 73 H MET 73 3.501 5.386 1.092 585 HA MET 73 HA MET 73 2.579 3.054 -0.143 586 HB2 MET 73 2HB MET 73 1.505 5.423 0.313 587 HB3 MET 73 1HB MET 73 2.070 5.735 -1.314 588 HG2 MET 73 2HG MET 73 0.229 3.504 -0.510 589 HG3 MET 73 1HG MET 73 -0.270 5.029 -1.221 590 HE1 MET 73 1HE MET 73 -0.917 2.356 -3.949 591 HE2 MET 73 2HE MET 73 -1.628 3.605 -2.911 592 HE3 MET 73 3HE MET 73 -0.967 2.121 -2.205 593 H GLU 74 H GLU 74 4.825 5.601 -1.313 594 HA GLU 74 HA GLU 74 5.072 4.694 -3.976 595 HB2 GLU 74 2HB GLU 74 6.195 6.812 -3.094 596 HB3 GLU 74 1HB GLU 74 7.371 5.743 -2.314 597 HG2 GLU 74 2HG GLU 74 7.943 4.839 -4.542 598 HG3 GLU 74 1HG GLU 74 6.898 6.056 -5.257 599 H GLU 75 H GLU 75 6.806 3.822 -1.043 600 HA GLU 75 HA GLU 75 8.658 2.002 -2.024 601 HB2 GLU 75 2HB GLU 75 7.197 1.849 0.615 602 HB3 GLU 75 1HB GLU 75 8.717 1.065 0.226 603 HG2 GLU 75 2HG GLU 75 8.234 4.028 0.417 604 HG3 GLU 75 1HG GLU 75 9.091 3.017 1.576 605 H LEU 76 H LEU 76 5.378 1.420 -0.875 606 HA LEU 76 HA LEU 76 5.261 -1.362 -1.170 607 HB2 LEU 76 2HB LEU 76 3.015 0.600 -1.627 608 HB3 LEU 76 1HB LEU 76 2.833 -1.106 -1.294 609 HG LEU 76 HG LEU 76 3.892 0.974 0.618 610 HD11 LEU 76 1HD1 LEU 76 1.839 0.549 1.843 611 HD12 LEU 76 2HD1 LEU 76 1.313 -0.567 0.581 612 HD13 LEU 76 3HD1 LEU 76 1.503 1.148 0.220 613 HD21 LEU 76 1HD2 LEU 76 3.372 -1.963 1.026 614 HD22 LEU 76 2HD2 LEU 76 3.810 -0.804 2.279 615 HD23 LEU 76 3HD2 LEU 76 4.949 -1.179 0.989 616 H THR 77 H THR 77 4.344 1.193 -3.411 617 HA THR 77 HA THR 77 3.429 -0.449 -5.482 618 HB THR 77 HB THR 77 4.507 2.377 -5.675 619 HG1 THR 77 1HG THR 77 2.827 2.408 -4.165 620 HG21 THR 77 1HG2 THR 77 4.164 1.275 -7.858 621 HG22 THR 77 2HG2 THR 77 2.986 2.563 -7.600 622 HG23 THR 77 3HG2 THR 77 2.510 0.880 -7.391 623 H LYS 78 H LYS 78 6.593 0.951 -4.798 624 HA LYS 78 HA LYS 78 7.771 0.302 -7.264 625 HB2 LYS 78 2HB LYS 78 9.114 0.751 -4.608 626 HB3 LYS 78 1HB LYS 78 9.956 0.643 -6.152 627 HG2 LYS 78 2HG LYS 78 8.532 2.585 -6.930 628 HG3 LYS 78 1HG LYS 78 7.938 2.653 -5.311 629 HD2 LYS 78 2HD LYS 78 10.838 2.937 -6.007 630 HD3 LYS 78 1HD LYS 78 9.730 4.286 -5.752 631 HE2 LYS 78 2HE LYS 78 9.249 3.348 -3.491 632 HE3 LYS 78 1HE LYS 78 10.545 2.181 -3.768 633 HZ1 LYS 78 1HZ LYS 78 12.134 3.997 -3.861 634 HZ2 LYS 78 2HZ LYS 78 11.116 4.147 -2.482 635 HZ3 LYS 78 3HZ LYS 78 10.823 5.108 -3.812 636 H TYR 79 H TYR 79 7.793 -1.436 -4.233 637 HA TYR 79 HA TYR 79 9.424 -3.568 -5.131 638 HB2 TYR 79 2HB TYR 79 7.381 -3.446 -2.943 639 HB3 TYR 79 1HB TYR 79 8.194 -4.953 -3.338 640 HD1 TYR 79 1HD TYR 79 9.647 -1.547 -3.316 641 HD2 TYR 79 2HD TYR 79 9.453 -5.335 -1.441 642 HE1 TYR 79 1HE TYR 79 11.529 -0.906 -1.836 643 HE2 TYR 79 2HE TYR 79 11.310 -4.739 0.028 644 HH TYR 79 HH TYR 79 12.410 -1.544 0.350 645 H TYR 80 H TYR 80 5.978 -3.123 -5.308 646 HA TYR 80 HA TYR 80 5.173 -5.641 -6.249 647 HB2 TYR 80 2HB TYR 80 3.708 -3.732 -5.528 648 HB3 TYR 80 1HB TYR 80 4.097 -2.932 -7.039 649 HD1 TYR 80 1HD TYR 80 2.464 -5.854 -5.552 650 HD2 TYR 80 2HD TYR 80 2.917 -3.493 -9.048 651 HE1 TYR 80 1HE TYR 80 0.587 -7.015 -6.555 652 HE2 TYR 80 2HE TYR 80 1.006 -4.659 -10.073 653 HH TYR 80 HH TYR 80 -1.083 -6.669 -8.268 654 H LEU 81 H LEU 81 6.145 -2.760 -8.036 655 HA LEU 81 HA LEU 81 6.116 -4.126 -10.511 656 HB2 LEU 81 2HB LEU 81 7.109 -1.418 -9.751 657 HB3 LEU 81 1HB LEU 81 7.152 -2.025 -11.401 658 HG LEU 81 HG LEU 81 4.675 -1.623 -9.726 659 HD11 LEU 81 1HD1 LEU 81 4.154 0.096 -11.399 660 HD12 LEU 81 2HD1 LEU 81 5.754 -0.149 -12.098 661 HD13 LEU 81 3HD1 LEU 81 5.593 0.464 -10.447 662 HD21 LEU 81 1HD2 LEU 81 3.492 -2.141 -11.827 663 HD22 LEU 81 2HD2 LEU 81 4.369 -3.524 -11.189 664 HD23 LEU 81 3HD2 LEU 81 5.019 -2.607 -12.552 665 H ALA 82 H ALA 82 8.687 -3.293 -8.243 666 HA ALA 82 HA ALA 82 10.854 -3.843 -9.914 667 HB1 ALA 82 1HB ALA 82 11.038 -2.669 -7.760 668 HB2 ALA 82 2HB ALA 82 12.174 -4.015 -7.882 669 HB3 ALA 82 3HB ALA 82 10.707 -4.187 -6.922 670 H ASN 83 H ASN 83 8.765 -5.969 -8.125 671 HA ASN 83 HA ASN 83 10.458 -8.246 -8.322 672 HB2 ASN 83 2HB ASN 83 7.478 -8.142 -7.788 673 HB3 ASN 83 1HB ASN 83 8.458 -9.597 -7.683 674 HD21 ASN 83 1HD2 ASN 83 6.924 -8.418 -5.608 675 HD22 ASN 83 2HD2 ASN 83 7.988 -7.982 -4.330 676 H HIS 84 H HIS 84 8.998 -6.646 -10.740 677 HA HIS 84 HA HIS 84 8.580 -9.054 -12.371 678 HB2 HIS 84 2HB HIS 84 8.029 -6.143 -12.998 679 HB3 HIS 84 1HB HIS 84 7.884 -7.421 -14.188 680 HD1 HIS 84 1HD HIS 84 5.856 -9.039 -13.909 681 HD2 HIS 84 2HD HIS 84 5.921 -5.892 -11.216 682 HE1 HIS 84 1HE HIS 84 3.542 -8.913 -12.988 683 HE2 HIS 84 2HE HIS 84 3.542 -6.765 -11.737 684 H GLY 85 H GLY 85 11.143 -7.479 -11.379 685 HA2 GLY 85 2HA GLY 85 13.312 -7.679 -12.217 686 HA3 GLY 85 1HA GLY 85 12.647 -8.045 -13.808 687 H ILE 86 H ILE 86 11.145 -5.465 -12.379 688 HA ILE 86 HA ILE 86 12.324 -3.618 -14.272 689 HB ILE 86 HB ILE 86 10.083 -3.227 -12.271 690 HG12 ILE 86 2HG1 ILE 86 9.980 -3.712 -15.254 691 HG13 ILE 86 1HG1 ILE 86 9.516 -4.865 -14.008 692 HG21 ILE 86 1HG2 ILE 86 9.547 -1.192 -13.552 693 HG22 ILE 86 2HG2 ILE 86 10.978 -1.458 -14.546 694 HG23 ILE 86 3HG2 ILE 86 11.153 -1.113 -12.826 695 HD11 ILE 86 1HD1 ILE 86 8.213 -2.219 -14.534 696 HD12 ILE 86 2HD1 ILE 86 7.707 -3.390 -13.317 697 HD13 ILE 86 3HD1 ILE 86 7.583 -3.793 -15.038 698 H ASP 87 H ASP 87 13.725 -2.082 -13.739 699 HA ASP 87 HA ASP 87 14.449 -1.846 -10.910 700 HB2 ASP 87 2HB ASP 87 16.332 -2.360 -12.387 701 HB3 ASP 87 1HB ASP 87 15.964 -0.950 -13.374 702 H ILE 88 H ILE 88 13.668 -0.227 -9.870 703 HA ILE 88 HA ILE 88 12.745 2.138 -11.337 704 HB ILE 88 HB ILE 88 11.991 1.147 -8.577 705 HG12 ILE 88 2HG1 ILE 88 10.395 1.043 -11.139 706 HG13 ILE 88 1HG1 ILE 88 11.203 -0.331 -10.401 707 HG21 ILE 88 1HG2 ILE 88 10.217 2.808 -8.631 708 HG22 ILE 88 2HG2 ILE 88 10.776 3.368 -10.213 709 HG23 ILE 88 3HG2 ILE 88 11.799 3.564 -8.789 710 HD11 ILE 88 1HD1 ILE 88 9.027 1.276 -9.113 711 HD12 ILE 88 2HD1 ILE 88 9.775 -0.177 -8.474 712 HD13 ILE 88 3HD1 ILE 88 8.792 -0.265 -9.944 713 H LYS 89 H LYS 89 13.616 4.111 -10.734 714 HA LYS 89 HA LYS 89 15.653 4.004 -8.655 715 HB2 LYS 89 2HB LYS 89 16.390 4.033 -11.097 716 HB3 LYS 89 1HB LYS 89 15.757 5.666 -11.165 717 HG2 LYS 89 2HG LYS 89 17.762 4.774 -9.195 718 HG3 LYS 89 1HG LYS 89 18.230 5.358 -10.801 719 HD2 LYS 89 2HD LYS 89 16.691 6.945 -8.717 720 HD3 LYS 89 1HD LYS 89 18.426 7.087 -8.975 721 HE2 LYS 89 2HE LYS 89 17.972 7.764 -11.321 722 HE3 LYS 89 1HE LYS 89 16.252 7.718 -10.964 723 HZ1 LYS 89 1HZ LYS 89 16.554 9.473 -9.346 724 HZ2 LYS 89 2HZ LYS 89 17.180 9.955 -10.826 725 HZ3 LYS 89 3HZ LYS 89 18.220 9.479 -9.603 726 H1 MET 1 H MET 1 -17.598 25.723 8.659 727 HA MET 1 HA MET 1 -15.077 25.241 7.589 728 HB2 MET 1 2HB MET 1 -13.945 24.338 9.532 729 HB3 MET 1 1HB MET 1 -14.326 26.019 9.842 730 HG2 MET 1 2HG MET 1 -15.858 23.647 10.920 731 HG3 MET 1 1HG MET 1 -14.644 24.558 11.802 732 HE1 MET 1 1HE MET 1 -17.593 23.964 12.923 733 HE2 MET 1 2HE MET 1 -17.962 25.535 13.626 734 HE3 MET 1 3HE MET 1 -16.348 24.854 13.798 735 H GLY 2 H GLY 2 -14.677 22.884 7.620 736 HA2 GLY 2 2HA GLY 2 -15.347 20.700 7.624 737 HA3 GLY 2 1HA GLY 2 -16.730 21.157 8.606 738 H PHE 3 H PHE 3 -16.246 22.882 5.679 739 HA PHE 3 HA PHE 3 -18.617 21.590 4.637 740 HB2 PHE 3 2HB PHE 3 -18.521 24.074 4.650 741 HB3 PHE 3 1HB PHE 3 -17.133 24.004 3.574 742 HD1 PHE 3 1HD PHE 3 -20.726 23.179 3.829 743 HD2 PHE 3 2HD PHE 3 -17.435 23.914 1.254 744 HE1 PHE 3 1HE PHE 3 -22.251 23.237 1.906 745 HE2 PHE 3 2HE PHE 3 -18.947 23.976 -0.681 746 HZ PHE 3 HZ PHE 3 -21.361 23.637 -0.357 747 H THR 4 H THR 4 -17.695 19.633 4.175 748 HA THR 4 HA THR 4 -16.471 19.434 1.571 749 HB THR 4 HB THR 4 -15.164 18.211 4.039 750 HG1 THR 4 1HG THR 4 -14.846 20.623 2.867 751 HG21 THR 4 1HG2 THR 4 -14.296 18.227 1.134 752 HG22 THR 4 2HG2 THR 4 -14.939 16.840 2.010 753 HG23 THR 4 3HG2 THR 4 -13.385 17.530 2.476 754 H ASP 5 H ASP 5 -17.454 17.652 0.620 755 HA ASP 5 HA ASP 5 -19.005 15.967 2.400 756 HB2 ASP 5 2HB ASP 5 -20.133 15.083 0.418 757 HB3 ASP 5 1HB ASP 5 -20.180 16.837 0.396 758 H GLU 6 H GLU 6 -18.492 13.973 2.895 759 HA GLU 6 HA GLU 6 -15.991 12.980 1.877 760 HB2 GLU 6 2HB GLU 6 -16.433 12.802 4.289 761 HB3 GLU 6 1HB GLU 6 -17.880 11.858 3.961 762 HG2 GLU 6 2HG GLU 6 -16.539 10.078 3.011 763 HG3 GLU 6 1HG GLU 6 -15.077 11.026 3.255 764 H THR 7 H THR 7 -15.977 11.857 0.099 765 HA THR 7 HA THR 7 -18.425 10.762 -0.881 766 HB THR 7 HB THR 7 -15.635 10.633 -2.049 767 HG1 THR 7 1HG THR 7 -17.272 12.686 -1.786 768 HG21 THR 7 1HG2 THR 7 -18.339 10.125 -3.307 769 HG22 THR 7 2HG2 THR 7 -17.176 8.877 -2.866 770 HG23 THR 7 3HG2 THR 7 -16.772 10.044 -4.123 771 H VAL 8 H VAL 8 -19.034 9.054 0.222 772 HA VAL 8 HA VAL 8 -17.160 7.030 0.957 773 HB VAL 8 HB VAL 8 -19.203 5.799 1.821 774 HG11 VAL 8 1HG1 VAL 8 -17.885 7.279 3.260 775 HG12 VAL 8 2HG1 VAL 8 -19.596 7.350 3.683 776 HG13 VAL 8 3HG1 VAL 8 -18.862 8.652 2.749 777 HG21 VAL 8 1HG2 VAL 8 -20.868 6.751 0.289 778 HG22 VAL 8 2HG2 VAL 8 -20.622 8.342 1.006 779 HG23 VAL 8 3HG2 VAL 8 -21.318 7.040 1.968 780 H ARG 9 H ARG 9 -16.527 5.461 -0.285 781 HA ARG 9 HA ARG 9 -17.892 5.113 -2.789 782 HB2 ARG 9 2HB ARG 9 -15.224 4.081 -1.851 783 HB3 ARG 9 1HB ARG 9 -15.990 3.451 -3.292 784 HG2 ARG 9 2HG ARG 9 -14.358 5.085 -3.933 785 HG3 ARG 9 1HG ARG 9 -15.954 5.740 -4.258 786 HD2 ARG 9 2HD ARG 9 -15.801 7.077 -2.202 787 HD3 ARG 9 1HD ARG 9 -14.197 6.409 -1.892 788 HE ARG 9 HE ARG 9 -14.360 7.543 -4.477 789 HH11 ARG 9 1HH1 ARG 9 -14.004 8.471 -1.082 790 HH12 ARG 9 2HH1 ARG 9 -13.149 9.900 -1.395 791 HH21 ARG 9 1HH2 ARG 9 -13.223 9.546 -4.934 792 HH22 ARG 9 2HH2 ARG 9 -12.692 10.547 -3.668 793 H PHE 10 H PHE 10 -19.771 4.155 -2.184 794 HA PHE 10 HA PHE 10 -19.515 1.366 -1.370 795 HB2 PHE 10 2HB PHE 10 -21.978 3.069 -1.864 796 HB3 PHE 10 1HB PHE 10 -22.043 1.350 -1.505 797 HD1 PHE 10 1HD PHE 10 -22.045 4.608 -0.123 798 HD2 PHE 10 2HD PHE 10 -20.901 0.593 0.678 799 HE1 PHE 10 1HE PHE 10 -22.031 5.087 2.289 800 HE2 PHE 10 2HE PHE 10 -20.888 1.064 3.081 801 HZ PHE 10 HZ PHE 10 -21.456 3.319 3.895 802 H ASP 11 H ASP 11 -19.216 3.154 -3.947 803 HA ASP 11 HA ASP 11 -20.261 1.313 -5.927 804 HB2 ASP 11 2HB ASP 11 -20.345 3.748 -6.354 805 HB3 ASP 11 1HB ASP 11 -18.599 3.833 -6.181 806 H PHE 12 H PHE 12 -19.117 -0.489 -5.960 807 HA PHE 12 HA PHE 12 -16.239 -0.347 -6.293 808 HB2 PHE 12 2HB PHE 12 -16.666 -0.564 -3.855 809 HB3 PHE 12 1HB PHE 12 -17.648 -1.979 -4.185 810 HD1 PHE 12 1HD PHE 12 -14.253 -0.646 -4.051 811 HD2 PHE 12 2HD PHE 12 -16.641 -4.116 -4.636 812 HE1 PHE 12 1HE PHE 12 -12.269 -2.055 -3.777 813 HE2 PHE 12 2HE PHE 12 -14.655 -5.533 -4.357 814 HZ PHE 12 HZ PHE 12 -12.463 -4.500 -3.926 815 H ASP 13 H ASP 13 -16.121 -1.354 -8.210 816 HA ASP 13 HA ASP 13 -17.789 -3.722 -8.590 817 HB2 ASP 13 2HB ASP 13 -18.013 -2.004 -10.347 818 HB3 ASP 13 1HB ASP 13 -16.288 -2.106 -10.662 819 H ASP 14 H ASP 14 -16.872 -5.500 -8.036 820 HA ASP 14 HA ASP 14 -14.130 -5.761 -7.482 821 HB2 ASP 14 2HB ASP 14 -15.869 -7.148 -6.400 822 HB3 ASP 14 1HB ASP 14 -16.146 -7.969 -7.927 823 H ASN 15 H ASN 15 -12.539 -6.011 -8.751 824 HA ASN 15 HA ASN 15 -12.772 -7.489 -11.267 825 HB2 ASN 15 2HB ASN 15 -13.109 -4.913 -11.570 826 HB3 ASN 15 1HB ASN 15 -11.420 -4.775 -11.115 827 HD21 ASN 15 1HD2 ASN 15 -12.708 -4.012 -13.542 828 HD22 ASN 15 2HD2 ASN 15 -11.958 -4.883 -14.833 829 H ARG 16 H ARG 16 -11.781 -7.812 -8.572 830 HA ARG 16 HA ARG 16 -8.950 -7.618 -8.620 831 HB2 ARG 16 2HB ARG 16 -10.227 -7.583 -6.526 832 HB3 ARG 16 1HB ARG 16 -10.791 -9.217 -6.840 833 HG2 ARG 16 2HG ARG 16 -8.564 -10.086 -6.628 834 HG3 ARG 16 1HG ARG 16 -7.903 -8.458 -6.473 835 HD2 ARG 16 2HD ARG 16 -9.833 -9.780 -4.579 836 HD3 ARG 16 1HD ARG 16 -8.108 -9.551 -4.297 837 HE ARG 16 HE ARG 16 -9.818 -7.207 -4.775 838 HH11 ARG 16 1HH1 ARG 16 -7.759 -9.029 -2.540 839 HH12 ARG 16 2HH1 ARG 16 -7.688 -7.741 -1.412 840 HH21 ARG 16 1HH2 ARG 16 -9.712 -5.547 -3.295 841 HH22 ARG 16 2HH2 ARG 16 -8.825 -5.717 -1.827 842 H LYS 17 H LYS 17 -7.721 -8.839 -9.776 843 HA LYS 17 HA LYS 17 -8.083 -11.628 -10.061 844 HB2 LYS 17 2HB LYS 17 -9.716 -10.674 -11.688 845 HB3 LYS 17 1HB LYS 17 -8.420 -9.785 -12.457 846 HG2 LYS 17 2HG LYS 17 -7.395 -11.832 -13.202 847 HG3 LYS 17 1HG LYS 17 -8.576 -12.794 -12.303 848 HD2 LYS 17 2HD LYS 17 -9.207 -10.927 -14.602 849 HD3 LYS 17 1HD LYS 17 -9.104 -12.686 -14.713 850 HE2 LYS 17 2HE LYS 17 -10.950 -12.890 -13.093 851 HE3 LYS 17 1HE LYS 17 -11.061 -11.136 -13.003 852 HZ1 LYS 17 1HZ LYS 17 -11.649 -11.113 -15.363 853 HZ2 LYS 17 2HZ LYS 17 -12.724 -12.055 -14.453 854 HZ3 LYS 17 3HZ LYS 17 -11.552 -12.794 -15.406 855 H LYS 18 H LYS 18 -6.124 -12.416 -11.344 856 HA LYS 18 HA LYS 18 -3.916 -10.991 -10.311 857 HB2 LYS 18 2HB LYS 18 -3.957 -13.461 -12.041 858 HB3 LYS 18 1HB LYS 18 -2.541 -12.827 -11.227 859 HG2 LYS 18 2HG LYS 18 -3.617 -13.115 -9.051 860 HG3 LYS 18 1HG LYS 18 -5.054 -13.753 -9.841 861 HD2 LYS 18 2HD LYS 18 -2.299 -14.983 -9.956 862 HD3 LYS 18 1HD LYS 18 -3.611 -15.513 -8.909 863 HE2 LYS 18 2HE LYS 18 -4.962 -16.067 -10.869 864 HE3 LYS 18 1HE LYS 18 -3.670 -15.509 -11.932 865 HZ1 LYS 18 1HZ LYS 18 -3.471 -17.779 -10.022 866 HZ2 LYS 18 2HZ LYS 18 -2.244 -17.234 -11.024 867 HZ3 LYS 18 3HZ LYS 18 -3.631 -17.918 -11.682 868 H ALA 19 H ALA 19 -5.529 -10.077 -12.752 869 HA ALA 19 HA ALA 19 -3.606 -9.569 -14.799 870 HB1 ALA 19 1HB ALA 19 -5.181 -8.064 -15.685 871 HB2 ALA 19 2HB ALA 19 -6.080 -8.099 -14.161 872 HB3 ALA 19 3HB ALA 19 -6.038 -9.556 -15.196 873 H ILE 20 H ILE 20 -4.479 -8.066 -11.789 874 HA ILE 20 HA ILE 20 -3.886 -5.379 -12.242 875 HB ILE 20 HB ILE 20 -3.436 -6.959 -9.681 876 HG12 ILE 20 2HG1 ILE 20 -5.806 -5.295 -10.582 877 HG13 ILE 20 1HG1 ILE 20 -5.757 -7.051 -10.464 878 HG21 ILE 20 1HG2 ILE 20 -2.197 -4.869 -9.604 879 HG22 ILE 20 2HG2 ILE 20 -3.578 -4.806 -8.510 880 HG23 ILE 20 3HG2 ILE 20 -3.644 -3.972 -10.063 881 HD11 ILE 20 1HD1 ILE 20 -6.940 -6.044 -8.569 882 HD12 ILE 20 2HD1 ILE 20 -5.478 -5.143 -8.143 883 HD13 ILE 20 3HD1 ILE 20 -5.487 -6.897 -8.048 884 H SER 21 H SER 21 -1.803 -8.038 -11.722 885 HA SER 21 HA SER 21 0.530 -6.487 -11.129 886 HB2 SER 21 2HB SER 21 1.720 -8.724 -11.516 887 HB3 SER 21 1HB SER 21 0.531 -8.657 -10.214 888 HG SER 21 HG SER 21 0.556 -10.199 -12.418 889 H GLU 22 H GLU 22 -0.858 -7.848 -13.939 890 HA GLU 22 HA GLU 22 1.249 -7.265 -15.781 891 HB2 GLU 22 2HB GLU 22 -0.413 -9.052 -16.079 892 HB3 GLU 22 1HB GLU 22 -1.689 -7.857 -16.133 893 HG2 GLU 22 2HG GLU 22 -0.773 -6.975 -18.196 894 HG3 GLU 22 1HG GLU 22 0.517 -8.190 -18.154 895 H THR 23 H THR 23 -1.754 -5.792 -14.701 896 HA THR 23 HA THR 23 -2.020 -3.719 -16.523 897 HB THR 23 HB THR 23 -2.853 -3.885 -13.627 898 HG1 THR 23 1HG THR 23 -3.710 -5.117 -15.824 899 HG21 THR 23 1HG2 THR 23 -4.547 -2.153 -14.237 900 HG22 THR 23 2HG2 THR 23 -3.707 -1.961 -15.792 901 HG23 THR 23 3HG2 THR 23 -2.886 -1.570 -14.293 902 H LEU 24 H LEU 24 -0.517 -3.595 -13.263 903 HA LEU 24 HA LEU 24 0.291 -0.919 -13.708 904 HB2 LEU 24 2HB LEU 24 0.981 -2.817 -11.487 905 HB3 LEU 24 1HB LEU 24 1.746 -1.248 -11.625 906 HG LEU 24 HG LEU 24 -0.472 -0.169 -11.437 907 HD11 LEU 24 1HD1 LEU 24 -1.497 -2.931 -10.861 908 HD12 LEU 24 2HD1 LEU 24 -1.901 -1.929 -12.254 909 HD13 LEU 24 3HD1 LEU 24 -2.392 -1.426 -10.637 910 HD21 LEU 24 1HD2 LEU 24 -0.755 -0.588 -9.053 911 HD22 LEU 24 2HD2 LEU 24 0.942 -0.420 -9.501 912 HD23 LEU 24 3HD2 LEU 24 0.269 -2.019 -9.195 913 H GLU 25 H GLU 25 1.828 -3.925 -14.317 914 HA GLU 25 HA GLU 25 4.469 -3.032 -14.649 915 HB2 GLU 25 2HB GLU 25 3.633 -5.416 -14.555 916 HB3 GLU 25 1HB GLU 25 2.953 -5.204 -16.146 917 HG2 GLU 25 2HG GLU 25 5.899 -5.028 -15.539 918 HG3 GLU 25 1HG GLU 25 5.088 -6.515 -15.994 919 H THR 26 H THR 26 1.654 -3.101 -16.747 920 HA THR 26 HA THR 26 2.846 -1.947 -19.037 921 HB THR 26 HB THR 26 -0.048 -2.083 -18.162 922 HG1 THR 26 1HG THR 26 0.555 -4.153 -18.392 923 HG21 THR 26 1HG2 THR 26 0.355 -0.455 -19.973 924 HG22 THR 26 2HG2 THR 26 -0.561 -1.850 -20.558 925 HG23 THR 26 3HG2 THR 26 1.158 -1.710 -20.915 926 H VAL 27 H VAL 27 1.045 -0.636 -16.275 927 HA VAL 27 HA VAL 27 0.812 2.031 -17.180 928 HB VAL 27 HB VAL 27 0.999 1.110 -14.284 929 HG11 VAL 27 1HG1 VAL 27 1.336 3.505 -14.552 930 HG12 VAL 27 2HG1 VAL 27 -0.221 3.173 -13.775 931 HG13 VAL 27 3HG1 VAL 27 -0.161 3.601 -15.486 932 HG21 VAL 27 1HG2 VAL 27 -1.473 1.563 -15.964 933 HG22 VAL 27 2HG2 VAL 27 -1.428 1.103 -14.269 934 HG23 VAL 27 3HG2 VAL 27 -0.836 -0.015 -15.500 935 H TYR 28 H TYR 28 3.369 0.381 -15.446 936 HA TYR 28 HA TYR 28 4.923 2.611 -14.806 937 HB2 TYR 28 2HB TYR 28 5.386 0.367 -13.889 938 HB3 TYR 28 1HB TYR 28 5.901 -0.183 -15.474 939 HD1 TYR 28 1HD TYR 28 8.051 0.518 -16.409 940 HD2 TYR 28 2HD TYR 28 6.866 1.843 -12.543 941 HE1 TYR 28 1HE TYR 28 10.341 1.294 -15.979 942 HE2 TYR 28 2HE TYR 28 9.177 2.624 -12.101 943 HH TYR 28 HH TYR 28 11.415 2.945 -14.609 944 H ARG 29 H ARG 29 4.888 0.577 -17.663 945 HA ARG 29 HA ARG 29 7.089 1.726 -19.014 946 HB2 ARG 29 2HB ARG 29 4.663 0.472 -20.300 947 HB3 ARG 29 1HB ARG 29 6.274 0.611 -20.986 948 HG2 ARG 29 2HG ARG 29 5.473 -1.087 -18.634 949 HG3 ARG 29 1HG ARG 29 5.830 -1.650 -20.262 950 HD2 ARG 29 2HD ARG 29 8.138 -0.920 -20.027 951 HD3 ARG 29 1HD ARG 29 7.782 -0.258 -18.427 952 HE ARG 29 HE ARG 29 7.013 -2.919 -18.406 953 HH11 ARG 29 1HH1 ARG 29 10.062 -1.123 -18.613 954 HH12 ARG 29 2HH1 ARG 29 10.987 -2.415 -17.965 955 HH21 ARG 29 1HH2 ARG 29 8.210 -4.565 -17.586 956 HH22 ARG 29 2HH2 ARG 29 9.912 -4.457 -17.348 957 H ALA 30 H ALA 30 3.693 2.500 -18.914 958 HA ALA 30 HA ALA 30 3.481 4.239 -21.076 959 HB1 ALA 30 1HB ALA 30 1.972 4.391 -18.470 960 HB2 ALA 30 2HB ALA 30 1.552 3.368 -19.842 961 HB3 ALA 30 3HB ALA 30 1.490 5.124 -20.000 962 H LEU 31 H LEU 31 4.224 5.048 -17.683 963 HA LEU 31 HA LEU 31 4.573 7.755 -18.451 964 HB2 LEU 31 2HB LEU 31 5.142 6.498 -15.792 965 HB3 LEU 31 1HB LEU 31 5.434 8.192 -16.131 966 HG LEU 31 HG LEU 31 2.956 8.187 -16.832 967 HD11 LEU 31 1HD1 LEU 31 2.496 5.845 -16.713 968 HD12 LEU 31 2HD1 LEU 31 1.529 6.725 -15.523 969 HD13 LEU 31 3HD1 LEU 31 2.944 5.821 -15.003 970 HD21 LEU 31 1HD2 LEU 31 3.748 9.527 -15.061 971 HD22 LEU 31 2HD2 LEU 31 3.837 8.154 -13.958 972 HD23 LEU 31 3HD2 LEU 31 2.280 8.711 -14.536 973 H GLU 32 H GLU 32 6.739 5.117 -18.194 974 HA GLU 32 HA GLU 32 9.130 6.595 -18.170 975 HB2 GLU 32 2HB GLU 32 8.501 3.912 -19.389 976 HB3 GLU 32 1HB GLU 32 10.126 4.567 -19.239 977 HG2 GLU 32 2HG GLU 32 8.270 4.057 -16.931 978 HG3 GLU 32 1HG GLU 32 9.521 2.944 -17.472 979 H GLU 33 H GLU 33 6.942 5.704 -20.736 980 HA GLU 33 HA GLU 33 8.541 6.638 -22.914 981 HB2 GLU 33 2HB GLU 33 5.538 6.303 -22.744 982 HB3 GLU 33 1HB GLU 33 6.478 6.457 -24.218 983 HG2 GLU 33 2HG GLU 33 6.671 4.183 -22.252 984 HG3 GLU 33 1HG GLU 33 5.775 4.153 -23.766 985 H LYS 34 H LYS 34 6.370 8.077 -20.654 986 HA LYS 34 HA LYS 34 6.056 10.533 -22.207 987 HB2 LYS 34 2HB LYS 34 4.770 9.619 -19.645 988 HB3 LYS 34 1HB LYS 34 4.428 11.153 -20.427 989 HG2 LYS 34 2HG LYS 34 3.997 8.450 -21.693 990 HG3 LYS 34 1HG LYS 34 2.741 9.396 -20.894 991 HD2 LYS 34 2HD LYS 34 4.359 10.405 -23.240 992 HD3 LYS 34 1HD LYS 34 2.807 9.598 -23.406 993 HE2 LYS 34 2HE LYS 34 1.729 11.280 -22.112 994 HE3 LYS 34 1HE LYS 34 3.256 12.109 -21.785 995 HZ1 LYS 34 1HZ LYS 34 3.422 12.464 -24.242 996 HZ2 LYS 34 2HZ LYS 34 2.085 13.220 -23.554 997 HZ3 LYS 34 3HZ LYS 34 1.883 11.800 -24.404 998 H GLY 35 H GLY 35 8.152 9.364 -19.915 999 HA2 GLY 35 2HA GLY 35 9.922 10.397 -18.869 1000 HA3 GLY 35 1HA GLY 35 9.425 11.903 -19.624 1001 H TYR 36 H TYR 36 7.450 9.913 -17.518 1002 HA TYR 36 HA TYR 36 7.622 12.060 -15.515 1003 HB2 TYR 36 2HB TYR 36 5.199 10.393 -16.203 1004 HB3 TYR 36 1HB TYR 36 5.269 11.538 -14.864 1005 HD1 TYR 36 1HD TYR 36 4.000 11.112 -17.982 1006 HD2 TYR 36 2HD TYR 36 6.285 13.946 -15.798 1007 HE1 TYR 36 1HE TYR 36 3.276 12.868 -19.522 1008 HE2 TYR 36 2HE TYR 36 5.561 15.726 -17.338 1009 HH TYR 36 HH TYR 36 3.010 15.316 -19.456 1010 H ASN 37 H ASN 37 6.478 10.990 -13.353 1011 HA ASN 37 HA ASN 37 8.201 8.696 -12.826 1012 HB2 ASN 37 2HB ASN 37 6.826 10.642 -10.959 1013 HB3 ASN 37 1HB ASN 37 7.699 9.233 -10.390 1014 HD21 ASN 37 1HD2 ASN 37 9.954 9.199 -10.594 1015 HD22 ASN 37 2HD2 ASN 37 10.867 10.633 -10.856 1016 HA PRO 38 HA PRO 38 4.368 6.418 -13.558 1017 HB2 PRO 38 2HB PRO 38 6.029 4.114 -12.837 1018 HB3 PRO 38 1HB PRO 38 5.107 4.461 -14.305 1019 HG2 PRO 38 2HG PRO 38 7.821 4.552 -14.188 1020 HG3 PRO 38 1HG PRO 38 6.862 5.503 -15.324 1021 HD2 PRO 38 2HD PRO 38 8.284 6.364 -12.874 1022 HD3 PRO 38 1HD PRO 38 7.840 7.267 -14.342 1023 H ILE 39 H ILE 39 6.507 5.784 -10.828 1024 HA ILE 39 HA ILE 39 4.559 4.271 -9.392 1025 HB ILE 39 HB ILE 39 6.996 5.699 -8.296 1026 HG12 ILE 39 2HG1 ILE 39 7.554 4.146 -10.139 1027 HG13 ILE 39 1HG1 ILE 39 8.189 3.599 -8.598 1028 HG21 ILE 39 1HG2 ILE 39 5.388 5.035 -6.589 1029 HG22 ILE 39 2HG2 ILE 39 6.851 4.054 -6.495 1030 HG23 ILE 39 3HG2 ILE 39 5.390 3.391 -7.229 1031 HD11 ILE 39 1HD1 ILE 39 7.274 1.785 -9.926 1032 HD12 ILE 39 2HD1 ILE 39 5.700 2.580 -9.946 1033 HD13 ILE 39 3HD1 ILE 39 6.386 2.000 -8.416 1034 H ASN 40 H ASN 40 5.742 7.549 -9.239 1035 HA ASN 40 HA ASN 40 4.262 8.266 -6.967 1036 HB2 ASN 40 2HB ASN 40 5.512 10.055 -9.047 1037 HB3 ASN 40 1HB ASN 40 4.917 10.584 -7.471 1038 HD21 ASN 40 1HD2 ASN 40 5.969 9.855 -5.596 1039 HD22 ASN 40 2HD2 ASN 40 7.553 9.185 -5.645 1040 H GLN 41 H GLN 41 3.503 8.423 -10.378 1041 HA GLN 41 HA GLN 41 1.153 9.912 -9.847 1042 HB2 GLN 41 2HB GLN 41 1.970 8.362 -12.292 1043 HB3 GLN 41 1HB GLN 41 0.564 9.420 -12.198 1044 HG2 GLN 41 2HG GLN 41 3.433 10.279 -11.815 1045 HG3 GLN 41 1HG GLN 41 2.473 10.532 -13.265 1046 HE21 GLN 41 1HE2 GLN 41 0.063 11.210 -11.823 1047 HE22 GLN 41 2HE2 GLN 41 0.303 12.784 -11.151 1048 H ILE 42 H ILE 42 1.908 6.478 -10.037 1049 HA ILE 42 HA ILE 42 -0.759 5.533 -10.027 1050 HB ILE 42 HB ILE 42 1.765 4.189 -8.981 1051 HG12 ILE 42 2HG1 ILE 42 0.208 3.777 -11.544 1052 HG13 ILE 42 1HG1 ILE 42 1.738 4.636 -11.407 1053 HG21 ILE 42 1HG2 ILE 42 -0.182 3.222 -7.871 1054 HG22 ILE 42 2HG2 ILE 42 0.502 2.073 -9.022 1055 HG23 ILE 42 3HG2 ILE 42 -0.962 2.965 -9.433 1056 HD11 ILE 42 1HD1 ILE 42 2.831 2.555 -10.709 1057 HD12 ILE 42 2HD1 ILE 42 2.057 2.391 -12.285 1058 HD13 ILE 42 3HD1 ILE 42 1.290 1.705 -10.851 1059 H VAL 43 H VAL 43 1.529 6.054 -7.336 1060 HA VAL 43 HA VAL 43 -0.307 5.456 -5.303 1061 HB VAL 43 HB VAL 43 2.003 5.568 -4.608 1062 HG11 VAL 43 1HG1 VAL 43 2.818 7.093 -6.272 1063 HG12 VAL 43 2HG1 VAL 43 3.331 7.618 -4.663 1064 HG13 VAL 43 3HG1 VAL 43 1.995 8.436 -5.490 1065 HG21 VAL 43 1HG2 VAL 43 0.576 7.948 -3.459 1066 HG22 VAL 43 2HG2 VAL 43 1.999 7.176 -2.758 1067 HG23 VAL 43 3HG2 VAL 43 0.474 6.288 -2.875 1068 H GLY 44 H GLY 44 0.250 8.404 -7.036 1069 HA2 GLY 44 2HA GLY 44 -1.371 10.137 -5.494 1070 HA3 GLY 44 1HA GLY 44 -0.996 10.350 -7.206 1071 H TYR 45 H TYR 45 -2.080 8.108 -8.300 1072 HA TYR 45 HA TYR 45 -4.797 8.699 -8.559 1073 HB2 TYR 45 2HB TYR 45 -3.797 7.486 -10.364 1074 HB3 TYR 45 1HB TYR 45 -3.219 6.221 -9.284 1075 HD1 TYR 45 1HD TYR 45 -4.506 4.294 -8.929 1076 HD2 TYR 45 2HD TYR 45 -6.343 7.709 -10.629 1077 HE1 TYR 45 1HE TYR 45 -6.555 2.998 -9.294 1078 HE2 TYR 45 2HE TYR 45 -8.390 6.451 -10.995 1079 HH TYR 45 HH TYR 45 -9.099 4.115 -11.219 1080 H LEU 46 H LEU 46 -3.194 6.198 -6.716 1081 HA LEU 46 HA LEU 46 -5.584 4.970 -5.867 1082 HB2 LEU 46 2HB LEU 46 -2.775 4.742 -4.841 1083 HB3 LEU 46 1HB LEU 46 -4.097 3.698 -4.351 1084 HG LEU 46 HG LEU 46 -3.144 3.956 -7.211 1085 HD11 LEU 46 1HD1 LEU 46 -2.127 1.779 -6.904 1086 HD12 LEU 46 2HD1 LEU 46 -2.544 1.825 -5.187 1087 HD13 LEU 46 3HD1 LEU 46 -1.409 3.007 -5.867 1088 HD21 LEU 46 1HD2 LEU 46 -4.438 1.914 -7.550 1089 HD22 LEU 46 2HD2 LEU 46 -5.458 3.245 -7.004 1090 HD23 LEU 46 3HD2 LEU 46 -4.978 1.981 -5.871 1091 H LEU 47 H LEU 47 -3.551 7.422 -4.328 1092 HA LEU 47 HA LEU 47 -4.959 7.253 -1.841 1093 HB2 LEU 47 2HB LEU 47 -3.190 9.457 -2.896 1094 HB3 LEU 47 1HB LEU 47 -3.811 9.372 -1.266 1095 HG LEU 47 HG LEU 47 -1.845 7.460 -2.532 1096 HD11 LEU 47 1HD1 LEU 47 -0.881 9.621 -1.989 1097 HD12 LEU 47 2HD1 LEU 47 -0.278 8.372 -0.902 1098 HD13 LEU 47 3HD1 LEU 47 -1.509 9.504 -0.346 1099 HD21 LEU 47 1HD2 LEU 47 -3.271 6.258 -0.982 1100 HD22 LEU 47 2HD2 LEU 47 -3.002 7.485 0.260 1101 HD23 LEU 47 3HD2 LEU 47 -1.668 6.474 -0.287 1102 H SER 48 H SER 48 -5.356 9.223 -4.720 1103 HA SER 48 HA SER 48 -7.384 10.817 -3.374 1104 HB2 SER 48 2HB SER 48 -6.243 11.074 -6.155 1105 HB3 SER 48 1HB SER 48 -7.333 12.218 -5.373 1106 HG SER 48 HG SER 48 -5.771 12.812 -3.994 1107 H GLY 49 H GLY 49 -7.231 8.102 -5.633 1108 HA2 GLY 49 2HA GLY 49 -8.813 6.964 -6.637 1109 HA3 GLY 49 1HA GLY 49 -10.023 7.826 -5.680 1110 H ASP 50 H ASP 50 -7.648 9.089 -8.027 1111 HA ASP 50 HA ASP 50 -9.899 9.844 -9.737 1112 HB2 ASP 50 2HB ASP 50 -9.280 11.794 -8.302 1113 HB3 ASP 50 1HB ASP 50 -7.667 11.746 -9.010 1114 HA PRO 51 HA PRO 51 -7.320 7.863 -12.721 1115 HB2 PRO 51 2HB PRO 51 -8.674 8.636 -14.960 1116 HB3 PRO 51 1HB PRO 51 -9.214 7.360 -13.857 1117 HG2 PRO 51 2HG PRO 51 -10.052 10.232 -13.967 1118 HG3 PRO 51 1HG PRO 51 -11.061 8.784 -13.794 1119 HD2 PRO 51 2HD PRO 51 -10.419 10.306 -11.697 1120 HD3 PRO 51 1HD PRO 51 -10.540 8.539 -11.547 1121 H ALA 52 H ALA 52 -7.745 11.328 -12.767 1122 HA ALA 52 HA ALA 52 -6.237 11.915 -15.096 1123 HB1 ALA 52 1HB ALA 52 -6.158 14.200 -14.329 1124 HB2 ALA 52 2HB ALA 52 -6.631 13.700 -12.704 1125 HB3 ALA 52 3HB ALA 52 -7.758 13.526 -14.047 1126 H TYR 53 H TYR 53 -5.184 10.759 -12.142 1127 HA TYR 53 HA TYR 53 -2.666 11.980 -12.040 1128 HB2 TYR 53 2HB TYR 53 -3.808 9.575 -10.737 1129 HB3 TYR 53 1HB TYR 53 -2.083 9.939 -10.587 1130 HD1 TYR 53 1HD TYR 53 -1.337 11.949 -9.558 1131 HD2 TYR 53 2HD TYR 53 -5.457 10.973 -9.651 1132 HE1 TYR 53 1HE TYR 53 -1.732 13.610 -7.888 1133 HE2 TYR 53 2HE TYR 53 -5.900 12.663 -7.932 1134 HH TYR 53 HH TYR 53 -4.675 13.829 -6.165 1135 H ILE 54 H ILE 54 -3.819 9.413 -14.043 1136 HA ILE 54 HA ILE 54 -1.034 8.861 -14.766 1137 HB ILE 54 HB ILE 54 -3.490 7.133 -15.358 1138 HG12 ILE 54 2HG1 ILE 54 -2.800 6.990 -12.997 1139 HG13 ILE 54 1HG1 ILE 54 -2.429 5.500 -13.856 1140 HG21 ILE 54 1HG2 ILE 54 -1.948 5.485 -16.260 1141 HG22 ILE 54 2HG2 ILE 54 -0.608 6.612 -16.044 1142 HG23 ILE 54 3HG2 ILE 54 -1.900 6.991 -17.178 1143 HD11 ILE 54 1HD1 ILE 54 -0.644 6.105 -12.338 1144 HD12 ILE 54 2HD1 ILE 54 -0.454 7.656 -13.150 1145 HD13 ILE 54 3HD1 ILE 54 -0.091 6.158 -14.011 1146 HA PRO 55 HA PRO 55 -1.939 11.419 -18.284 1147 HB2 PRO 55 2HB PRO 55 0.332 10.766 -19.719 1148 HB3 PRO 55 1HB PRO 55 0.270 11.997 -18.454 1149 HG2 PRO 55 2HG PRO 55 1.219 9.175 -18.307 1150 HG3 PRO 55 1HG PRO 55 1.886 10.627 -17.543 1151 HD2 PRO 55 2HD PRO 55 0.410 8.839 -16.187 1152 HD3 PRO 55 1HD PRO 55 0.357 10.574 -15.811 1153 H ARG 56 H ARG 56 -2.965 11.086 -20.148 1154 HA ARG 56 HA ARG 56 -3.334 8.348 -20.904 1155 HB2 ARG 56 2HB ARG 56 -5.174 9.251 -22.425 1156 HB3 ARG 56 1HB ARG 56 -5.421 9.319 -20.689 1157 HG2 ARG 56 2HG ARG 56 -4.807 11.694 -20.722 1158 HG3 ARG 56 1HG ARG 56 -4.627 11.611 -22.481 1159 HD2 ARG 56 2HD ARG 56 -6.946 11.043 -22.739 1160 HD3 ARG 56 1HD ARG 56 -7.140 10.889 -20.997 1161 HE ARG 56 HE ARG 56 -6.249 13.452 -21.501 1162 HH11 ARG 56 1HH1 ARG 56 -9.106 11.516 -22.341 1163 HH12 ARG 56 2HH1 ARG 56 -10.186 12.823 -22.257 1164 HH21 ARG 56 1HH2 ARG 56 -7.767 15.246 -21.332 1165 HH22 ARG 56 2HH2 ARG 56 -9.412 14.978 -21.663 1166 H TYR 57 H TYR 57 -1.501 7.899 -21.727 1167 HA TYR 57 HA TYR 57 -1.186 8.665 -24.547 1168 HB2 TYR 57 2HB TYR 57 0.735 9.367 -23.270 1169 HB3 TYR 57 1HB TYR 57 0.894 7.778 -22.550 1170 HD1 TYR 57 1HD TYR 57 0.743 9.225 -26.017 1171 HD2 TYR 57 2HD TYR 57 2.637 6.517 -23.340 1172 HE1 TYR 57 1HE TYR 57 2.313 8.559 -27.797 1173 HE2 TYR 57 2HE TYR 57 4.195 5.847 -25.096 1174 HH TYR 57 HH TYR 57 4.271 5.811 -27.487 1175 H GLN 58 H GLN 58 -1.228 6.054 -22.192 1176 HA GLN 58 HA GLN 58 -1.362 4.081 -24.356 1177 HB2 GLN 58 2HB GLN 58 -0.270 3.774 -21.547 1178 HB3 GLN 58 1HB GLN 58 -0.398 2.488 -22.729 1179 HG2 GLN 58 2HG GLN 58 1.301 4.952 -23.024 1180 HG3 GLN 58 1HG GLN 58 1.883 3.375 -22.498 1181 HE21 GLN 58 1HE2 GLN 58 2.066 1.739 -23.990 1182 HE22 GLN 58 2HE2 GLN 58 2.026 2.031 -25.690 1183 H ASP 59 H ASP 59 -2.593 2.176 -23.671 1184 HA ASP 59 HA ASP 59 -5.160 2.813 -22.654 1185 HB2 ASP 59 2HB ASP 59 -5.698 0.417 -22.838 1186 HB3 ASP 59 1HB ASP 59 -4.875 0.986 -24.276 1187 H ALA 60 H ALA 60 -2.342 2.138 -21.134 1188 HA ALA 60 HA ALA 60 -2.869 0.765 -18.825 1189 HB1 ALA 60 1HB ALA 60 -1.019 1.942 -17.842 1190 HB2 ALA 60 2HB ALA 60 -1.101 3.179 -19.093 1191 HB3 ALA 60 3HB ALA 60 -0.661 1.524 -19.517 1192 H ARG 61 H ARG 61 -3.639 4.217 -19.478 1193 HA ARG 61 HA ARG 61 -4.368 4.868 -16.830 1194 HB2 ARG 61 2HB ARG 61 -3.965 6.573 -18.600 1195 HB3 ARG 61 1HB ARG 61 -5.452 6.060 -19.390 1196 HG2 ARG 61 2HG ARG 61 -6.711 6.714 -17.363 1197 HG3 ARG 61 1HG ARG 61 -5.215 7.317 -16.660 1198 HD2 ARG 61 2HD ARG 61 -4.982 8.869 -18.557 1199 HD3 ARG 61 1HD ARG 61 -6.524 8.300 -19.190 1200 HE ARG 61 HE ARG 61 -6.224 9.578 -16.576 1201 HH11 ARG 61 1HH1 ARG 61 -8.016 9.206 -19.630 1202 HH12 ARG 61 2HH1 ARG 61 -9.146 10.429 -19.278 1203 HH21 ARG 61 1HH2 ARG 61 -7.850 11.294 -16.121 1204 HH22 ARG 61 2HH2 ARG 61 -9.065 11.601 -17.263 1205 H ASN 62 H ASN 62 -6.131 3.492 -19.520 1206 HA ASN 62 HA ASN 62 -8.721 3.561 -18.348 1207 HB2 ASN 62 2HB ASN 62 -7.594 1.738 -20.497 1208 HB3 ASN 62 1HB ASN 62 -9.297 1.868 -20.079 1209 HD21 ASN 62 1HD2 ASN 62 -10.448 3.648 -20.755 1210 HD22 ASN 62 2HD2 ASN 62 -9.849 4.780 -21.895 1211 H LEU 63 H LEU 63 -6.170 1.183 -18.576 1212 HA LEU 63 HA LEU 63 -7.446 -0.955 -17.294 1213 HB2 LEU 63 2HB LEU 63 -4.508 -0.323 -17.398 1214 HB3 LEU 63 1HB LEU 63 -5.238 -1.836 -16.901 1215 HG LEU 63 HG LEU 63 -5.418 -0.693 -19.687 1216 HD11 LEU 63 1HD1 LEU 63 -3.138 -1.356 -19.088 1217 HD12 LEU 63 2HD1 LEU 63 -3.858 -2.474 -20.240 1218 HD13 LEU 63 3HD1 LEU 63 -3.740 -2.921 -18.539 1219 HD21 LEU 63 1HD2 LEU 63 -6.259 -2.918 -20.231 1220 HD22 LEU 63 2HD2 LEU 63 -7.319 -2.119 -19.067 1221 HD23 LEU 63 3HD2 LEU 63 -6.180 -3.363 -18.529 1222 H ILE 64 H ILE 64 -5.369 1.607 -15.954 1223 HA ILE 64 HA ILE 64 -5.289 0.397 -13.405 1224 HB ILE 64 HB ILE 64 -3.554 2.037 -14.150 1225 HG12 ILE 64 2HG1 ILE 64 -4.958 2.869 -11.595 1226 HG13 ILE 64 1HG1 ILE 64 -3.854 1.507 -11.742 1227 HG21 ILE 64 1HG2 ILE 64 -4.023 4.450 -13.995 1228 HG22 ILE 64 2HG2 ILE 64 -5.721 4.081 -13.695 1229 HG23 ILE 64 3HG2 ILE 64 -4.988 3.659 -15.241 1230 HD11 ILE 64 1HD1 ILE 64 -2.047 3.067 -12.337 1231 HD12 ILE 64 2HD1 ILE 64 -2.741 3.422 -10.752 1232 HD13 ILE 64 3HD1 ILE 64 -3.172 4.411 -12.143 1233 H ARG 65 H ARG 65 -7.519 2.711 -14.835 1234 HA ARG 65 HA ARG 65 -8.843 2.787 -12.282 1235 HB2 ARG 65 2HB ARG 65 -10.423 4.471 -13.237 1236 HB3 ARG 65 1HB ARG 65 -8.753 4.967 -13.199 1237 HG2 ARG 65 2HG ARG 65 -9.759 5.772 -15.212 1238 HG3 ARG 65 1HG ARG 65 -8.621 4.506 -15.637 1239 HD2 ARG 65 2HD ARG 65 -10.409 2.955 -16.034 1240 HD3 ARG 65 1HD ARG 65 -11.597 4.080 -15.366 1241 HE ARG 65 HE ARG 65 -10.344 5.419 -17.385 1242 HH11 ARG 65 1HH1 ARG 65 -12.227 2.422 -17.224 1243 HH12 ARG 65 2HH1 ARG 65 -12.990 2.653 -18.714 1244 HH21 ARG 65 1HH2 ARG 65 -11.421 5.737 -19.458 1245 HH22 ARG 65 2HH2 ARG 65 -12.508 4.558 -20.020 1246 H ARG 66 H ARG 66 -8.781 0.700 -14.597 1247 HA ARG 66 HA ARG 66 -11.564 0.008 -14.818 1248 HB2 ARG 66 2HB ARG 66 -9.912 -0.514 -16.602 1249 HB3 ARG 66 1HB ARG 66 -9.056 -1.559 -15.493 1250 HG2 ARG 66 2HG ARG 66 -10.371 -2.858 -17.052 1251 HG3 ARG 66 1HG ARG 66 -10.998 -3.056 -15.418 1252 HD2 ARG 66 2HD ARG 66 -12.774 -1.487 -15.865 1253 HD3 ARG 66 1HD ARG 66 -12.122 -1.153 -17.471 1254 HE ARG 66 HE ARG 66 -12.530 -3.746 -17.656 1255 HH11 ARG 66 1HH1 ARG 66 -14.665 -1.296 -16.225 1256 HH12 ARG 66 2HH1 ARG 66 -16.094 -2.048 -16.725 1257 HH21 ARG 66 1HH2 ARG 66 -14.493 -4.801 -18.303 1258 HH22 ARG 66 2HH2 ARG 66 -16.010 -4.114 -17.929 1259 H HIS 67 H HIS 67 -9.131 -0.341 -12.529 1260 HA HIS 67 HA HIS 67 -10.649 -2.450 -11.154 1261 HB2 HIS 67 2HB HIS 67 -7.691 -1.817 -10.823 1262 HB3 HIS 67 1HB HIS 67 -8.578 -3.080 -9.991 1263 HD1 HIS 67 1HD HIS 67 -9.074 -5.306 -11.386 1264 HD2 HIS 67 2HD HIS 67 -6.876 -2.404 -13.426 1265 HE1 HIS 67 1HE HIS 67 -8.122 -6.448 -13.372 1266 HE2 HIS 67 2HE HIS 67 -6.983 -4.652 -14.693 1267 H GLU 68 H GLU 68 -10.796 -2.098 -8.833 1268 HA GLU 68 HA GLU 68 -11.036 0.685 -8.292 1269 HB2 GLU 68 2HB GLU 68 -11.566 -1.689 -6.490 1270 HB3 GLU 68 1HB GLU 68 -11.986 -0.027 -6.119 1271 HG2 GLU 68 2HG GLU 68 -13.114 -1.696 -8.365 1272 HG3 GLU 68 1HG GLU 68 -13.942 -1.213 -6.886 1273 H ARG 69 H ARG 69 -10.113 1.737 -6.375 1274 HA ARG 69 HA ARG 69 -7.303 1.521 -6.524 1275 HB2 ARG 69 2HB ARG 69 -8.932 3.133 -4.481 1276 HB3 ARG 69 1HB ARG 69 -7.207 3.197 -4.675 1277 HG2 ARG 69 2HG ARG 69 -8.066 5.150 -5.643 1278 HG3 ARG 69 1HG ARG 69 -7.636 4.125 -6.997 1279 HD2 ARG 69 2HD ARG 69 -10.458 4.266 -5.936 1280 HD3 ARG 69 1HD ARG 69 -9.873 5.442 -7.076 1281 HE ARG 69 HE ARG 69 -9.340 3.287 -8.437 1282 HH11 ARG 69 1HH1 ARG 69 -12.267 3.877 -6.472 1283 HH12 ARG 69 2HH1 ARG 69 -13.273 2.979 -7.511 1284 HH21 ARG 69 1HH2 ARG 69 -10.774 2.112 -9.847 1285 HH22 ARG 69 2HH2 ARG 69 -12.415 1.941 -9.448 1286 H ASP 70 H ASP 70 -9.651 0.456 -4.218 1287 HA ASP 70 HA ASP 70 -8.030 -0.300 -2.041 1288 HB2 ASP 70 2HB ASP 70 -10.546 -0.112 -2.094 1289 HB3 ASP 70 1HB ASP 70 -10.561 -1.606 -3.002 1290 H GLU 71 H GLU 71 -9.130 -2.073 -4.835 1291 HA GLU 71 HA GLU 71 -8.278 -4.698 -4.422 1292 HB2 GLU 71 2HB GLU 71 -8.258 -3.122 -6.986 1293 HB3 GLU 71 1HB GLU 71 -8.371 -4.866 -6.828 1294 HG2 GLU 71 2HG GLU 71 -10.411 -3.120 -5.569 1295 HG3 GLU 71 1HG GLU 71 -10.460 -3.427 -7.301 1296 H ILE 72 H ILE 72 -6.707 -2.081 -6.179 1297 HA ILE 72 HA ILE 72 -4.362 -3.485 -6.888 1298 HB ILE 72 HB ILE 72 -4.874 -0.503 -6.790 1299 HG12 ILE 72 2HG1 ILE 72 -5.087 -2.455 -9.095 1300 HG13 ILE 72 1HG1 ILE 72 -6.443 -1.728 -8.244 1301 HG21 ILE 72 1HG2 ILE 72 -2.708 -2.043 -8.225 1302 HG22 ILE 72 2HG2 ILE 72 -2.484 -0.978 -6.843 1303 HG23 ILE 72 3HG2 ILE 72 -3.017 -0.315 -8.389 1304 HD11 ILE 72 1HD1 ILE 72 -5.749 0.479 -9.031 1305 HD12 ILE 72 2HD1 ILE 72 -6.028 -0.620 -10.379 1306 HD13 ILE 72 3HD1 ILE 72 -4.382 -0.246 -9.872 1307 H MET 73 H MET 73 -5.139 -1.279 -4.272 1308 HA MET 73 HA MET 73 -2.501 -0.779 -3.459 1309 HB2 MET 73 2HB MET 73 -4.651 0.517 -2.950 1310 HB3 MET 73 1HB MET 73 -4.922 -0.661 -1.681 1311 HG2 MET 73 2HG MET 73 -2.555 1.166 -1.905 1312 HG3 MET 73 1HG MET 73 -3.937 1.446 -0.862 1313 HE1 MET 73 1HE MET 73 -0.920 1.534 0.139 1314 HE2 MET 73 2HE MET 73 -1.088 0.680 1.675 1315 HE3 MET 73 3HE MET 73 -2.342 1.804 1.138 1316 H GLU 74 H GLU 74 -4.894 -3.195 -2.342 1317 HA GLU 74 HA GLU 74 -3.382 -4.315 -0.272 1318 HB2 GLU 74 2HB GLU 74 -5.360 -5.628 -2.123 1319 HB3 GLU 74 1HB GLU 74 -4.611 -6.435 -0.756 1320 HG2 GLU 74 2HG GLU 74 -5.621 -4.799 0.752 1321 HG3 GLU 74 1HG GLU 74 -6.408 -4.030 -0.631 1322 H GLU 75 H GLU 75 -3.429 -5.078 -3.697 1323 HA GLU 75 HA GLU 75 -1.677 -7.252 -3.669 1324 HB2 GLU 75 2HB GLU 75 -2.173 -5.193 -5.822 1325 HB3 GLU 75 1HB GLU 75 -1.279 -6.685 -6.061 1326 HG2 GLU 75 2HG GLU 75 -4.160 -6.505 -5.226 1327 HG3 GLU 75 1HG GLU 75 -3.579 -6.836 -6.859 1328 H LEU 76 H LEU 76 -1.072 -3.818 -4.044 1329 HA LEU 76 HA LEU 76 1.707 -3.863 -4.456 1330 HB2 LEU 76 2HB LEU 76 0.167 -1.791 -2.901 1331 HB3 LEU 76 1HB LEU 76 1.739 -1.579 -3.634 1332 HG LEU 76 HG LEU 76 -0.870 -1.964 -5.094 1333 HD11 LEU 76 1HD1 LEU 76 -0.523 0.329 -5.804 1334 HD12 LEU 76 2HD1 LEU 76 0.929 0.416 -4.807 1335 HD13 LEU 76 3HD1 LEU 76 -0.649 0.201 -4.052 1336 HD21 LEU 76 1HD2 LEU 76 0.959 -2.967 -6.333 1337 HD22 LEU 76 2HD2 LEU 76 1.906 -1.488 -6.170 1338 HD23 LEU 76 3HD2 LEU 76 0.413 -1.481 -7.105 1339 H THR 77 H THR 77 -0.140 -3.560 -1.405 1340 HA THR 77 HA THR 77 2.019 -3.328 0.293 1341 HB THR 77 HB THR 77 -0.685 -4.559 0.896 1342 HG1 THR 77 1HG THR 77 -1.088 -2.496 0.085 1343 HG21 THR 77 1HG2 THR 77 -0.278 -3.713 3.166 1344 HG22 THR 77 2HG2 THR 77 1.310 -3.124 2.671 1345 HG23 THR 77 3HG2 THR 77 0.978 -4.857 2.692 1346 H LYS 78 H LYS 78 0.430 -6.262 -0.931 1347 HA LYS 78 HA LYS 78 1.767 -8.023 0.829 1348 HB2 LYS 78 2HB LYS 78 0.427 -8.600 -1.791 1349 HB3 LYS 78 1HB LYS 78 1.070 -9.846 -0.722 1350 HG2 LYS 78 2HG LYS 78 -0.338 -9.037 1.038 1351 HG3 LYS 78 1HG LYS 78 -1.068 -7.857 -0.023 1352 HD2 LYS 78 2HD LYS 78 -1.181 -10.874 -0.317 1353 HD3 LYS 78 1HD LYS 78 -2.515 -9.828 0.162 1354 HE2 LYS 78 2HE LYS 78 -2.380 -8.722 -2.040 1355 HE3 LYS 78 1HE LYS 78 -1.112 -9.861 -2.496 1356 HZ1 LYS 78 1HZ LYS 78 -3.892 -10.550 -1.770 1357 HZ2 LYS 78 2HZ LYS 78 -2.695 -11.676 -2.185 1358 HZ3 LYS 78 3HZ LYS 78 -3.253 -10.521 -3.319 1359 H TYR 79 H TYR 79 2.530 -6.972 -2.375 1360 HA TYR 79 HA TYR 79 4.750 -8.742 -2.704 1361 HB2 TYR 79 2HB TYR 79 4.005 -6.221 -4.134 1362 HB3 TYR 79 1HB TYR 79 5.523 -7.044 -4.463 1363 HD1 TYR 79 1HD TYR 79 2.187 -8.533 -3.771 1364 HD2 TYR 79 2HD TYR 79 5.269 -7.854 -6.600 1365 HE1 TYR 79 1HE TYR 79 1.038 -10.032 -5.374 1366 HE2 TYR 79 2HE TYR 79 4.174 -9.318 -8.193 1367 HH TYR 79 HH TYR 79 0.958 -10.391 -7.795 1368 H TYR 80 H TYR 80 4.467 -5.596 -1.322 1369 HA TYR 80 HA TYR 80 7.226 -5.027 -1.077 1370 HB2 TYR 80 2HB TYR 80 5.420 -3.362 -0.790 1371 HB3 TYR 80 1HB TYR 80 4.917 -4.179 0.682 1372 HD1 TYR 80 1HD TYR 80 7.643 -2.275 -0.877 1373 HD2 TYR 80 2HD TYR 80 6.006 -3.731 2.755 1374 HE1 TYR 80 1HE TYR 80 9.218 -0.895 0.368 1375 HE2 TYR 80 2HE TYR 80 7.587 -2.342 4.025 1376 HH TYR 80 HH TYR 80 9.515 0.089 2.537 1377 H LEU 81 H LEU 81 4.892 -6.508 1.103 1378 HA LEU 81 HA LEU 81 6.846 -7.099 3.072 1379 HB2 LEU 81 2HB LEU 81 4.037 -8.097 2.727 1380 HB3 LEU 81 1HB LEU 81 5.036 -8.414 4.137 1381 HG LEU 81 HG LEU 81 4.131 -5.677 3.222 1382 HD11 LEU 81 1HD1 LEU 81 3.248 -7.361 5.543 1383 HD12 LEU 81 2HD1 LEU 81 2.297 -7.004 4.098 1384 HD13 LEU 81 3HD1 LEU 81 2.732 -5.706 5.214 1385 HD21 LEU 81 1HD2 LEU 81 5.023 -4.927 5.382 1386 HD22 LEU 81 2HD2 LEU 81 6.292 -5.582 4.348 1387 HD23 LEU 81 3HD2 LEU 81 5.654 -6.547 5.678 1388 H ALA 82 H ALA 82 5.607 -8.831 0.296 1389 HA ALA 82 HA ALA 82 6.306 -11.422 0.938 1390 HB1 ALA 82 1HB ALA 82 6.490 -10.126 -1.778 1391 HB2 ALA 82 2HB ALA 82 5.025 -10.790 -1.059 1392 HB3 ALA 82 3HB ALA 82 6.377 -11.856 -1.454 1393 H ASN 83 H ASN 83 8.334 -8.816 -0.287 1394 HA ASN 83 HA ASN 83 10.588 -10.495 -0.733 1395 HB2 ASN 83 2HB ASN 83 10.426 -7.489 -0.581 1396 HB3 ASN 83 1HB ASN 83 11.928 -8.353 -0.888 1397 HD21 ASN 83 1HD2 ASN 83 10.552 -6.503 -2.613 1398 HD22 ASN 83 2HD2 ASN 83 10.186 -7.391 -4.061 1399 H HIS 84 H HIS 84 9.278 -9.827 2.077 1400 HA HIS 84 HA HIS 84 11.784 -9.687 3.575 1401 HB2 HIS 84 2HB HIS 84 8.889 -9.728 4.436 1402 HB3 HIS 84 1HB HIS 84 10.208 -9.868 5.584 1403 HD1 HIS 84 1HD HIS 84 8.818 -7.372 3.032 1404 HD2 HIS 84 2HD HIS 84 11.208 -7.496 6.429 1405 HE1 HIS 84 1HE HIS 84 9.170 -4.994 3.698 1406 HE2 HIS 84 2HE HIS 84 10.892 -5.145 5.566 1407 H GLY 85 H GLY 85 10.220 -12.003 1.924 1408 HA2 GLY 85 2HA GLY 85 10.615 -14.293 1.946 1409 HA3 GLY 85 1HA GLY 85 11.276 -14.152 3.575 1410 H ILE 86 H ILE 86 8.397 -12.540 3.012 1411 HA ILE 86 HA ILE 86 6.968 -14.410 4.742 1412 HB ILE 86 HB ILE 86 6.390 -11.513 4.054 1413 HG12 ILE 86 2HG1 ILE 86 7.430 -12.750 6.630 1414 HG13 ILE 86 1HG1 ILE 86 8.358 -11.772 5.503 1415 HG21 ILE 86 1HG2 ILE 86 4.670 -11.612 5.800 1416 HG22 ILE 86 2HG2 ILE 86 4.990 -13.336 5.994 1417 HG23 ILE 86 3HG2 ILE 86 4.329 -12.729 4.476 1418 HD11 ILE 86 1HD1 ILE 86 7.676 -10.507 7.460 1419 HD12 ILE 86 2HD1 ILE 86 5.984 -10.871 7.099 1420 HD13 ILE 86 3HD1 ILE 86 6.922 -9.862 5.994 1421 H ASP 87 H ASP 87 5.231 -15.443 4.017 1422 HA ASP 87 HA ASP 87 4.320 -14.904 1.276 1423 HB2 ASP 87 2HB ASP 87 4.981 -17.199 1.621 1424 HB3 ASP 87 1HB ASP 87 3.926 -17.334 3.026 1425 H ILE 88 H ILE 88 2.524 -13.769 1.037 1426 HA ILE 88 HA ILE 88 0.473 -13.953 3.132 1427 HB ILE 88 HB ILE 88 0.910 -11.571 1.271 1428 HG12 ILE 88 2HG1 ILE 88 1.827 -11.850 4.146 1429 HG13 ILE 88 1HG1 ILE 88 2.875 -11.847 2.738 1430 HG21 ILE 88 1HG2 ILE 88 -0.715 -11.884 3.785 1431 HG22 ILE 88 2HG2 ILE 88 -1.332 -11.788 2.134 1432 HG23 ILE 88 3HG2 ILE 88 -0.520 -10.400 2.852 1433 HD11 ILE 88 1HD1 ILE 88 2.880 -9.667 3.786 1434 HD12 ILE 88 2HD1 ILE 88 1.120 -9.608 3.651 1435 HD13 ILE 88 3HD1 ILE 88 2.096 -9.581 2.194 1436 H LYS 89 H LYS 89 -1.702 -14.088 2.289 1437 HA LYS 89 HA LYS 89 -1.862 -15.316 -0.267 1438 HB2 LYS 89 2HB LYS 89 -3.102 -16.085 1.775 1439 HB3 LYS 89 1HB LYS 89 -4.029 -14.606 1.741 1440 HG2 LYS 89 2HG LYS 89 -4.019 -16.604 -0.500 1441 HG3 LYS 89 1HG LYS 89 -5.132 -16.695 0.861 1442 HD2 LYS 89 2HD LYS 89 -4.922 -14.365 -1.071 1443 HD3 LYS 89 1HD LYS 89 -6.125 -15.649 -1.183 1444 HE2 LYS 89 2HE LYS 89 -6.969 -15.011 1.056 1445 HE3 LYS 89 1HE LYS 89 -5.782 -13.720 1.118 1446 HZ1 LYS 89 1HZ LYS 89 -6.816 -12.647 -0.712 1447 HZ2 LYS 89 2HZ LYS 89 -7.979 -12.958 0.457 1448 HZ3 LYS 89 3HZ LYS 89 -7.920 -13.914 -0.937 Start of MODEL 15 1 H1 MET 1 1HT MET 1 -15.215 25.607 6.630 2 H2 MET 1 2HT MET 1 -15.924 26.797 5.675 3 H3 MET 1 3HT MET 1 -15.204 27.198 7.160 4 HA MET 1 HA MET 1 -13.763 26.062 4.864 5 HB2 MET 1 2HB MET 1 -13.874 28.917 5.873 6 HB3 MET 1 1HB MET 1 -12.687 28.331 4.724 7 HG2 MET 1 2HG MET 1 -14.436 29.519 3.565 8 HG3 MET 1 1HG MET 1 -14.504 27.811 3.141 9 HE1 MET 1 1HE MET 1 -18.262 28.907 2.974 10 HE2 MET 1 2HE MET 1 -16.929 28.136 2.113 11 HE3 MET 1 3HE MET 1 -16.851 29.855 2.504 12 H GLY 2 H GLY 2 -12.255 24.801 5.713 13 HA2 GLY 2 2HA GLY 2 -10.084 24.769 6.737 14 HA3 GLY 2 1HA GLY 2 -10.692 25.902 7.942 15 H PHE 3 H PHE 3 -9.407 23.575 8.684 16 HA PHE 3 HA PHE 3 -11.617 22.067 9.892 17 HB2 PHE 3 2HB PHE 3 -9.002 20.917 8.878 18 HB3 PHE 3 1HB PHE 3 -10.215 20.035 9.787 19 HD1 PHE 3 1HD PHE 3 -12.334 19.428 8.742 20 HD2 PHE 3 2HD PHE 3 -9.263 21.386 6.544 21 HE1 PHE 3 1HE PHE 3 -13.431 18.781 6.644 22 HE2 PHE 3 2HE PHE 3 -10.349 20.743 4.441 23 HZ PHE 3 HZ PHE 3 -12.438 19.438 4.484 24 H THR 4 H THR 4 -11.369 21.645 12.035 25 HA THR 4 HA THR 4 -9.118 22.841 13.342 26 HB THR 4 HB THR 4 -10.336 21.977 15.441 27 HG1 THR 4 1HG THR 4 -11.987 20.764 15.113 28 HG21 THR 4 1HG2 THR 4 -10.464 24.306 14.719 29 HG22 THR 4 2HG2 THR 4 -12.023 23.773 15.351 30 HG23 THR 4 3HG2 THR 4 -11.768 23.901 13.605 31 H ASP 5 H ASP 5 -7.408 21.696 12.885 32 HA ASP 5 HA ASP 5 -7.524 18.792 13.063 33 HB2 ASP 5 2HB ASP 5 -6.627 19.850 11.005 34 HB3 ASP 5 1HB ASP 5 -5.355 20.585 11.968 35 H GLU 6 H GLU 6 -6.304 17.637 14.455 36 HA GLU 6 HA GLU 6 -5.472 18.959 16.826 37 HB2 GLU 6 2HB GLU 6 -6.542 16.780 16.927 38 HB3 GLU 6 1HB GLU 6 -5.264 16.079 15.951 39 HG2 GLU 6 2HG GLU 6 -3.662 16.462 17.724 40 HG3 GLU 6 1HG GLU 6 -4.900 17.248 18.699 41 H THR 7 H THR 7 -3.558 19.720 17.268 42 HA THR 7 HA THR 7 -1.482 19.854 15.460 43 HB THR 7 HB THR 7 -1.661 21.491 17.204 44 HG1 THR 7 1HG THR 7 0.405 21.325 16.577 45 HG21 THR 7 1HG2 THR 7 -1.195 20.993 19.573 46 HG22 THR 7 2HG2 THR 7 -1.053 19.279 19.177 47 HG23 THR 7 3HG2 THR 7 -2.602 20.102 18.992 48 H VAL 8 H VAL 8 0.042 18.519 14.863 49 HA VAL 8 HA VAL 8 0.885 16.421 16.670 50 HB VAL 8 HB VAL 8 -0.753 15.370 15.174 51 HG11 VAL 8 1HG1 VAL 8 -0.391 15.202 12.756 52 HG12 VAL 8 2HG1 VAL 8 0.979 16.305 12.895 53 HG13 VAL 8 3HG1 VAL 8 -0.647 16.866 13.281 54 HG21 VAL 8 1HG2 VAL 8 0.636 13.564 14.247 55 HG22 VAL 8 2HG2 VAL 8 1.139 14.013 15.878 56 HG23 VAL 8 3HG2 VAL 8 2.072 14.554 14.485 57 H ARG 9 H ARG 9 3.005 16.216 16.764 58 HA ARG 9 HA ARG 9 4.579 17.746 14.876 59 HB2 ARG 9 2HB ARG 9 5.292 16.567 17.561 60 HB3 ARG 9 1HB ARG 9 6.441 17.380 16.506 61 HG2 ARG 9 2HG ARG 9 5.139 19.417 16.625 62 HG3 ARG 9 1HG ARG 9 3.959 18.617 17.662 63 HD2 ARG 9 2HD ARG 9 5.605 18.300 19.365 64 HD3 ARG 9 1HD ARG 9 6.878 18.950 18.325 65 HE ARG 9 HE ARG 9 4.968 20.899 18.484 66 HH11 ARG 9 1HH1 ARG 9 6.885 19.151 20.851 67 HH12 ARG 9 2HH1 ARG 9 7.100 20.482 21.892 68 HH21 ARG 9 1HH2 ARG 9 5.240 22.753 19.916 69 HH22 ARG 9 2HH2 ARG 9 6.133 22.578 21.341 70 H PHE 10 H PHE 10 5.154 16.689 13.205 71 HA PHE 10 HA PHE 10 5.228 13.836 13.292 72 HB2 PHE 10 2HB PHE 10 4.088 14.815 11.419 73 HB3 PHE 10 1HB PHE 10 5.505 15.758 10.985 74 HD1 PHE 10 1HD PHE 10 4.641 12.178 11.589 75 HD2 PHE 10 2HD PHE 10 6.696 15.015 9.192 76 HE1 PHE 10 1HE PHE 10 5.400 10.374 10.108 77 HE2 PHE 10 2HE PHE 10 7.457 13.218 7.707 78 HZ PHE 10 HZ PHE 10 6.809 10.892 8.164 79 H ASP 11 H ASP 11 6.949 13.308 14.456 80 HA ASP 11 HA ASP 11 9.614 14.047 13.627 81 HB2 ASP 11 2HB ASP 11 9.236 13.520 15.978 82 HB3 ASP 11 1HB ASP 11 8.613 11.932 15.565 83 H PHE 12 H PHE 12 10.354 13.302 11.792 84 HA PHE 12 HA PHE 12 9.191 10.864 10.702 85 HB2 PHE 12 2HB PHE 12 10.062 11.588 8.531 86 HB3 PHE 12 1HB PHE 12 9.028 12.800 9.265 87 HD1 PHE 12 1HD PHE 12 9.965 14.926 10.017 88 HD2 PHE 12 2HD PHE 12 12.416 11.967 8.186 89 HE1 PHE 12 1HE PHE 12 11.730 16.606 9.666 90 HE2 PHE 12 2HE PHE 12 14.184 13.640 7.830 91 HZ PHE 12 HZ PHE 12 13.839 15.964 8.572 92 H ASP 13 H ASP 13 10.405 9.283 9.756 93 HA ASP 13 HA ASP 13 13.142 9.115 10.770 94 HB2 ASP 13 2HB ASP 13 11.603 7.273 11.418 95 HB3 ASP 13 1HB ASP 13 11.365 6.906 9.711 96 H ASP 14 H ASP 14 14.724 9.322 9.369 97 HA ASP 14 HA ASP 14 14.117 9.983 6.648 98 HB2 ASP 14 2HB ASP 14 15.840 11.195 7.893 99 HB3 ASP 14 1HB ASP 14 16.793 9.729 8.050 100 H ASN 15 H ASN 15 16.846 7.955 7.470 101 HA ASN 15 HA ASN 15 17.764 6.205 6.380 102 HB2 ASN 15 2HB ASN 15 15.226 5.032 7.483 103 HB3 ASN 15 1HB ASN 15 16.550 4.067 6.849 104 HD21 ASN 15 1HD2 ASN 15 15.407 5.974 9.447 105 HD22 ASN 15 2HD2 ASN 15 16.731 5.701 10.523 106 H ARG 16 H ARG 16 17.904 6.711 4.177 107 HA ARG 16 HA ARG 16 15.787 5.565 2.604 108 HB2 ARG 16 2HB ARG 16 17.069 6.201 0.563 109 HB3 ARG 16 1HB ARG 16 16.761 7.561 1.622 110 HG2 ARG 16 2HG ARG 16 19.044 7.515 2.395 111 HG3 ARG 16 1HG ARG 16 19.361 6.059 1.443 112 HD2 ARG 16 2HD ARG 16 18.865 7.317 -0.601 113 HD3 ARG 16 1HD ARG 16 18.583 8.765 0.371 114 HE ARG 16 HE ARG 16 21.007 8.144 1.138 115 HH11 ARG 16 1HH1 ARG 16 19.667 8.219 -2.141 116 HH12 ARG 16 2HH1 ARG 16 21.132 8.635 -2.902 117 HH21 ARG 16 1HH2 ARG 16 23.038 8.735 0.091 118 HH22 ARG 16 2HH2 ARG 16 23.089 8.942 -1.588 119 H LYS 17 H LYS 17 15.716 3.611 3.171 120 HA LYS 17 HA LYS 17 17.558 1.679 2.097 121 HB2 LYS 17 2HB LYS 17 18.568 2.350 4.302 122 HB3 LYS 17 1HB LYS 17 17.049 1.978 5.091 123 HG2 LYS 17 2HG LYS 17 17.340 -0.395 4.440 124 HG3 LYS 17 1HG LYS 17 18.901 0.025 3.731 125 HD2 LYS 17 2HD LYS 17 18.138 0.370 6.632 126 HD3 LYS 17 1HD LYS 17 19.113 -0.946 5.986 127 HE2 LYS 17 2HE LYS 17 20.813 0.679 5.261 128 HE3 LYS 17 1HE LYS 17 19.832 1.992 5.916 129 HZ1 LYS 17 1HZ LYS 17 20.092 1.045 8.110 130 HZ2 LYS 17 2HZ LYS 17 21.585 1.353 7.436 131 HZ3 LYS 17 3HZ LYS 17 21.010 -0.232 7.507 132 H LYS 18 H LYS 18 16.425 -0.549 2.706 133 HA LYS 18 HA LYS 18 13.591 -0.239 2.339 134 HB2 LYS 18 2HB LYS 18 15.300 -2.705 2.723 135 HB3 LYS 18 1HB LYS 18 13.588 -2.736 2.324 136 HG2 LYS 18 2HG LYS 18 14.043 -1.553 0.245 137 HG3 LYS 18 1HG LYS 18 15.759 -1.515 0.642 138 HD2 LYS 18 2HD LYS 18 15.822 -3.960 0.596 139 HD3 LYS 18 1HD LYS 18 14.096 -3.999 0.225 140 HE2 LYS 18 2HE LYS 18 14.506 -2.773 -1.847 141 HE3 LYS 18 1HE LYS 18 16.227 -2.717 -1.479 142 HZ1 LYS 18 1HZ LYS 18 14.662 -5.198 -1.900 143 HZ2 LYS 18 2HZ LYS 18 16.338 -5.105 -1.685 144 HZ3 LYS 18 3HZ LYS 18 15.632 -4.463 -3.047 145 H ALA 19 H ALA 19 14.233 0.955 4.604 146 HA ALA 19 HA ALA 19 14.002 -0.608 6.982 147 HB1 ALA 19 1HB ALA 19 15.150 1.537 6.919 148 HB2 ALA 19 2HB ALA 19 13.812 1.523 8.085 149 HB3 ALA 19 3HB ALA 19 13.609 2.303 6.504 150 H ILE 20 H ILE 20 11.815 1.239 4.918 151 HA ILE 20 HA ILE 20 9.568 1.144 6.592 152 HB ILE 20 HB ILE 20 9.697 1.300 3.550 153 HG12 ILE 20 2HG1 ILE 20 9.398 3.483 5.629 154 HG13 ILE 20 1HG1 ILE 20 10.844 3.160 4.686 155 HG21 ILE 20 1HG2 ILE 20 7.375 1.909 5.378 156 HG22 ILE 20 2HG2 ILE 20 7.496 0.558 4.246 157 HG23 ILE 20 3HG2 ILE 20 7.431 2.212 3.641 158 HD11 ILE 20 1HD1 ILE 20 9.629 5.076 3.816 159 HD12 ILE 20 2HD1 ILE 20 8.186 4.082 3.608 160 HD13 ILE 20 3HD1 ILE 20 9.630 3.759 2.644 161 H SER 21 H SER 21 11.036 -1.090 4.454 162 HA SER 21 HA SER 21 8.920 -2.956 4.202 163 HB2 SER 21 2HB SER 21 11.897 -3.462 4.067 164 HB3 SER 21 1HB SER 21 10.634 -4.515 3.417 165 HG SER 21 HG SER 21 10.121 -2.208 2.383 166 H GLU 22 H GLU 22 11.367 -2.407 6.631 167 HA GLU 22 HA GLU 22 10.871 -4.794 8.133 168 HB2 GLU 22 2HB GLU 22 12.122 -2.173 8.993 169 HB3 GLU 22 1HB GLU 22 12.176 -3.678 9.893 170 HG2 GLU 22 2HG GLU 22 13.430 -3.187 7.203 171 HG3 GLU 22 1HG GLU 22 14.271 -3.200 8.747 172 H THR 23 H THR 23 9.776 -1.466 8.111 173 HA THR 23 HA THR 23 8.402 -1.327 10.522 174 HB THR 23 HB THR 23 7.744 0.086 7.925 175 HG1 THR 23 1HG THR 23 9.828 0.223 9.670 176 HG21 THR 23 1HG2 THR 23 6.002 0.345 9.652 177 HG22 THR 23 2HG2 THR 23 6.869 1.863 9.397 178 HG23 THR 23 3HG2 THR 23 7.229 0.865 10.806 179 H LEU 24 H LEU 24 7.093 -2.060 7.252 180 HA LEU 24 HA LEU 24 4.534 -2.595 8.313 181 HB2 LEU 24 2HB LEU 24 5.652 -3.145 5.586 182 HB3 LEU 24 1HB LEU 24 4.071 -3.738 6.048 183 HG LEU 24 HG LEU 24 3.369 -1.396 6.492 184 HD11 LEU 24 1HD1 LEU 24 4.667 0.445 5.587 185 HD12 LEU 24 2HD1 LEU 24 5.995 -0.664 5.244 186 HD13 LEU 24 3HD1 LEU 24 5.502 -0.371 6.912 187 HD21 LEU 24 1HD2 LEU 24 3.146 -0.772 4.138 188 HD22 LEU 24 2HD2 LEU 24 2.809 -2.479 4.418 189 HD23 LEU 24 3HD2 LEU 24 4.356 -1.989 3.718 190 H GLU 25 H GLU 25 7.274 -4.620 7.828 191 HA GLU 25 HA GLU 25 6.009 -7.083 8.114 192 HB2 GLU 25 2HB GLU 25 8.351 -6.928 7.505 193 HB3 GLU 25 1HB GLU 25 8.736 -6.191 9.054 194 HG2 GLU 25 2HG GLU 25 8.066 -8.253 10.190 195 HG3 GLU 25 1HG GLU 25 7.712 -8.974 8.623 196 H THR 26 H THR 26 7.246 -4.768 10.511 197 HA THR 26 HA THR 26 6.604 -6.193 12.834 198 HB THR 26 HB THR 26 6.665 -3.180 12.451 199 HG1 THR 26 1HG THR 26 8.646 -5.136 12.570 200 HG21 THR 26 1HG2 THR 26 7.243 -3.150 14.829 201 HG22 THR 26 2HG2 THR 26 7.113 -4.915 14.880 202 HG23 THR 26 3HG2 THR 26 5.684 -3.940 14.548 203 H VAL 27 H VAL 27 4.799 -3.808 10.916 204 HA VAL 27 HA VAL 27 2.528 -3.632 12.560 205 HB VAL 27 HB VAL 27 2.668 -3.247 9.545 206 HG11 VAL 27 1HG1 VAL 27 0.377 -3.511 10.323 207 HG12 VAL 27 2HG1 VAL 27 0.679 -1.844 9.837 208 HG13 VAL 27 3HG1 VAL 27 0.639 -2.268 11.548 209 HG21 VAL 27 1HG2 VAL 27 2.934 -1.221 11.772 210 HG22 VAL 27 2HG2 VAL 27 2.916 -0.864 10.047 211 HG23 VAL 27 3HG2 VAL 27 4.242 -1.800 10.740 212 H TYR 28 H TYR 28 3.322 -5.802 9.914 213 HA TYR 28 HA TYR 28 0.853 -7.121 9.689 214 HB2 TYR 28 2HB TYR 28 2.658 -7.402 8.024 215 HB3 TYR 28 1HB TYR 28 3.634 -8.252 9.212 216 HD1 TYR 28 1HD TYR 28 2.939 -10.549 9.959 217 HD2 TYR 28 2HD TYR 28 0.926 -8.532 6.794 218 HE1 TYR 28 1HE TYR 28 1.929 -12.670 9.258 219 HE2 TYR 28 2HE TYR 28 -0.086 -10.664 6.078 220 HH TYR 28 HH TYR 28 -0.005 -13.427 8.055 221 H ARG 29 H ARG 29 3.681 -7.800 11.643 222 HA ARG 29 HA ARG 29 2.746 -10.147 12.875 223 HB2 ARG 29 2HB ARG 29 4.781 -8.140 13.832 224 HB3 ARG 29 1HB ARG 29 4.551 -9.724 14.541 225 HG2 ARG 29 2HG ARG 29 5.472 -9.124 11.740 226 HG3 ARG 29 1HG ARG 29 6.469 -9.704 13.069 227 HD2 ARG 29 2HD ARG 29 5.136 -11.787 13.125 228 HD3 ARG 29 1HD ARG 29 4.188 -11.199 11.754 229 HE ARG 29 HE ARG 29 6.950 -11.135 11.180 230 HH11 ARG 29 1HH1 ARG 29 4.246 -13.475 11.377 231 HH12 ARG 29 2HH1 ARG 29 5.024 -14.582 10.361 232 HH21 ARG 29 1HH2 ARG 29 7.935 -12.682 9.780 233 HH22 ARG 29 2HH2 ARG 29 7.136 -14.148 9.435 234 H ALA 30 H ALA 30 2.317 -6.769 13.631 235 HA ALA 30 HA ALA 30 1.356 -7.093 16.257 236 HB1 ALA 30 1HB ALA 30 2.111 -4.932 15.373 237 HB2 ALA 30 2HB ALA 30 0.482 -4.825 16.038 238 HB3 ALA 30 3HB ALA 30 0.719 -4.892 14.293 239 H LEU 31 H LEU 31 -0.363 -6.863 13.153 240 HA LEU 31 HA LEU 31 -2.854 -7.183 14.475 241 HB2 LEU 31 2HB LEU 31 -2.239 -7.146 11.558 242 HB3 LEU 31 1HB LEU 31 -3.843 -7.506 12.156 243 HG LEU 31 HG LEU 31 -3.637 -5.296 13.396 244 HD11 LEU 31 1HD1 LEU 31 -1.574 -4.837 11.288 245 HD12 LEU 31 2HD1 LEU 31 -1.309 -4.805 13.042 246 HD13 LEU 31 3HD1 LEU 31 -2.326 -3.581 12.258 247 HD21 LEU 31 1HD2 LEU 31 -4.502 -4.076 11.534 248 HD22 LEU 31 2HD2 LEU 31 -5.195 -5.686 11.653 249 HD23 LEU 31 3HD2 LEU 31 -3.988 -5.331 10.418 250 H GLU 32 H GLU 32 -0.685 -9.498 13.081 251 HA GLU 32 HA GLU 32 -2.797 -11.369 12.963 252 HB2 GLU 32 2HB GLU 32 -1.120 -13.103 12.500 253 HB3 GLU 32 1HB GLU 32 -1.074 -11.751 11.371 254 HG2 GLU 32 2HG GLU 32 1.158 -12.318 11.712 255 HG3 GLU 32 1HG GLU 32 0.903 -10.973 12.821 256 H GLU 33 H GLU 33 -0.532 -10.605 15.368 257 HA GLU 33 HA GLU 33 -1.236 -12.624 17.251 258 HB2 GLU 33 2HB GLU 33 -0.286 -9.789 17.649 259 HB3 GLU 33 1HB GLU 33 -0.578 -10.885 18.988 260 HG2 GLU 33 2HG GLU 33 1.333 -11.428 16.746 261 HG3 GLU 33 1HG GLU 33 1.789 -10.709 18.295 262 H LYS 34 H LYS 34 -2.739 -9.651 16.326 263 HA LYS 34 HA LYS 34 -4.659 -9.696 18.495 264 HB2 LYS 34 2HB LYS 34 -4.201 -7.808 16.210 265 HB3 LYS 34 1HB LYS 34 -5.511 -7.610 17.363 266 HG2 LYS 34 2HG LYS 34 -2.617 -7.774 18.169 267 HG3 LYS 34 1HG LYS 34 -3.432 -6.256 17.803 268 HD2 LYS 34 2HD LYS 34 -4.423 -8.199 19.897 269 HD3 LYS 34 1HD LYS 34 -3.318 -6.876 20.256 270 HE2 LYS 34 2HE LYS 34 -4.906 -5.273 19.458 271 HE3 LYS 34 1HE LYS 34 -6.049 -6.545 18.999 272 HZ1 LYS 34 1HZ LYS 34 -6.166 -7.138 21.388 273 HZ2 LYS 34 2HZ LYS 34 -6.665 -5.552 21.109 274 HZ3 LYS 34 3HZ LYS 34 -5.148 -5.870 21.757 275 H GLY 35 H GLY 35 -4.511 -11.168 15.516 276 HA2 GLY 35 2HA GLY 35 -6.079 -12.558 14.536 277 HA3 GLY 35 1HA GLY 35 -7.222 -12.071 15.775 278 H TYR 36 H TYR 36 -5.670 -9.633 13.901 279 HA TYR 36 HA TYR 36 -8.236 -9.113 12.565 280 HB2 TYR 36 2HB TYR 36 -5.868 -7.292 13.002 281 HB3 TYR 36 1HB TYR 36 -7.288 -6.846 12.078 282 HD1 TYR 36 1HD TYR 36 -5.725 -6.545 15.132 283 HD2 TYR 36 2HD TYR 36 -9.572 -7.233 13.472 284 HE1 TYR 36 1HE TYR 36 -6.754 -5.687 17.182 285 HE2 TYR 36 2HE TYR 36 -10.613 -6.367 15.522 286 HH TYR 36 HH TYR 36 -10.036 -6.083 17.858 287 H ASN 37 H ASN 37 -7.632 -7.743 10.415 288 HA ASN 37 HA ASN 37 -6.017 -9.592 8.832 289 HB2 ASN 37 2HB ASN 37 -7.997 -7.473 7.918 290 HB3 ASN 37 1HB ASN 37 -7.148 -8.593 6.864 291 HD21 ASN 37 1HD2 ASN 37 -9.710 -8.156 9.124 292 HD22 ASN 37 2HD2 ASN 37 -10.492 -9.664 8.878 293 HA PRO 38 HA PRO 38 -2.797 -6.459 9.583 294 HB2 PRO 38 2HB PRO 38 -1.634 -8.202 7.470 295 HB3 PRO 38 1HB PRO 38 -0.891 -7.547 8.934 296 HG2 PRO 38 2HG PRO 38 -1.671 -10.067 8.874 297 HG3 PRO 38 1HG PRO 38 -1.951 -9.078 10.319 298 HD2 PRO 38 2HD PRO 38 -3.897 -9.987 8.251 299 HD3 PRO 38 1HD PRO 38 -4.109 -9.679 9.995 300 H ILE 39 H ILE 39 -3.762 -7.548 6.348 301 HA ILE 39 HA ILE 39 -2.472 -5.313 5.119 302 HB ILE 39 HB ILE 39 -4.430 -7.280 3.912 303 HG12 ILE 39 2HG1 ILE 39 -2.501 -8.420 4.868 304 HG13 ILE 39 1HG1 ILE 39 -2.450 -8.474 3.114 305 HG21 ILE 39 1HG2 ILE 39 -3.416 -6.622 1.773 306 HG22 ILE 39 2HG2 ILE 39 -2.441 -5.420 2.627 307 HG23 ILE 39 3HG2 ILE 39 -4.195 -5.258 2.581 308 HD11 ILE 39 1HD1 ILE 39 -0.775 -6.692 3.122 309 HD12 ILE 39 2HD1 ILE 39 -0.236 -8.069 4.084 310 HD13 ILE 39 3HD1 ILE 39 -0.847 -6.626 4.882 311 H ASN 40 H ASN 40 -5.906 -6.207 5.780 312 HA ASN 40 HA ASN 40 -7.292 -4.306 4.580 313 HB2 ASN 40 2HB ASN 40 -8.057 -6.266 5.857 314 HB3 ASN 40 1HB ASN 40 -7.653 -5.407 7.339 315 HD21 ASN 40 1HD2 ASN 40 -9.740 -5.641 4.664 316 HD22 ASN 40 2HD2 ASN 40 -10.936 -4.581 5.291 317 H GLN 41 H GLN 41 -5.731 -4.101 7.796 318 HA GLN 41 HA GLN 41 -6.753 -1.490 8.217 319 HB2 GLN 41 2HB GLN 41 -4.687 -3.057 9.728 320 HB3 GLN 41 1HB GLN 41 -5.397 -1.540 10.274 321 HG2 GLN 41 2HG GLN 41 -6.954 -4.069 9.727 322 HG3 GLN 41 1HG GLN 41 -6.445 -3.540 11.318 323 HE21 GLN 41 1HE2 GLN 41 -6.999 -0.761 10.852 324 HE22 GLN 41 2HE2 GLN 41 -8.717 -0.593 10.842 325 H ILE 42 H ILE 42 -3.700 -2.783 7.016 326 HA ILE 42 HA ILE 42 -2.289 -0.330 7.141 327 HB ILE 42 HB ILE 42 -1.808 -2.717 5.319 328 HG12 ILE 42 2HG1 ILE 42 -0.406 -1.838 7.858 329 HG13 ILE 42 1HG1 ILE 42 -1.537 -3.176 7.729 330 HG21 ILE 42 1HG2 ILE 42 -0.036 -0.303 5.812 331 HG22 ILE 42 2HG2 ILE 42 -0.844 -0.713 4.311 332 HG23 ILE 42 3HG2 ILE 42 0.443 -1.751 4.919 333 HD11 ILE 42 1HD1 ILE 42 0.017 -4.341 6.238 334 HD12 ILE 42 2HD1 ILE 42 0.765 -3.957 7.790 335 HD13 ILE 42 3HD1 ILE 42 1.145 -2.990 6.365 336 H VAL 43 H VAL 43 -4.014 -1.917 4.446 337 HA VAL 43 HA VAL 43 -3.645 0.201 2.656 338 HB VAL 43 HB VAL 43 -4.411 -1.939 1.745 339 HG11 VAL 43 1HG1 VAL 43 -5.741 -2.722 3.623 340 HG12 VAL 43 2HG1 VAL 43 -6.716 -2.773 2.155 341 HG13 VAL 43 3HG1 VAL 43 -6.951 -1.473 3.329 342 HG21 VAL 43 1HG2 VAL 43 -6.578 0.139 1.398 343 HG22 VAL 43 2HG2 VAL 43 -6.305 -1.252 0.342 344 HG23 VAL 43 3HG2 VAL 43 -5.083 0.014 0.470 345 H GLY 44 H GLY 44 -6.050 -0.298 5.143 346 HA2 GLY 44 2HA GLY 44 -7.702 1.906 4.548 347 HA3 GLY 44 1HA GLY 44 -7.529 1.158 6.133 348 H TYR 45 H TYR 45 -4.774 1.617 6.522 349 HA TYR 45 HA TYR 45 -4.810 4.236 7.547 350 HB2 TYR 45 2HB TYR 45 -3.398 2.550 8.598 351 HB3 TYR 45 1HB TYR 45 -2.438 2.395 7.132 352 HD1 TYR 45 1HD TYR 45 -0.603 3.939 6.690 353 HD2 TYR 45 2HD TYR 45 -3.267 4.691 9.929 354 HE1 TYR 45 1HE TYR 45 0.901 5.684 7.516 355 HE2 TYR 45 2HE TYR 45 -1.747 6.438 10.753 356 HH TYR 45 HH TYR 45 0.866 7.656 8.941 357 H LEU 46 H LEU 46 -3.098 2.888 4.756 358 HA LEU 46 HA LEU 46 -1.962 5.404 4.223 359 HB2 LEU 46 2HB LEU 46 -2.028 2.961 2.502 360 HB3 LEU 46 1HB LEU 46 -1.297 4.456 1.948 361 HG LEU 46 HG LEU 46 0.238 4.296 4.000 362 HD11 LEU 46 1HD1 LEU 46 0.588 2.194 5.035 363 HD12 LEU 46 2HD1 LEU 46 -0.713 1.488 4.086 364 HD13 LEU 46 3HD1 LEU 46 -1.085 2.716 5.283 365 HD21 LEU 46 1HD2 LEU 46 1.025 3.803 1.781 366 HD22 LEU 46 2HD2 LEU 46 0.416 2.152 1.913 367 HD23 LEU 46 3HD2 LEU 46 1.730 2.696 2.954 368 H LEU 47 H LEU 47 -4.940 4.018 2.978 369 HA LEU 47 HA LEU 47 -5.214 6.177 1.156 370 HB2 LEU 47 2HB LEU 47 -7.105 4.055 2.094 371 HB3 LEU 47 1HB LEU 47 -7.688 5.404 1.143 372 HG LEU 47 HG LEU 47 -6.162 4.773 -0.665 373 HD11 LEU 47 1HD1 LEU 47 -5.089 2.611 -0.729 374 HD12 LEU 47 2HD1 LEU 47 -5.508 2.351 0.966 375 HD13 LEU 47 3HD1 LEU 47 -4.409 3.660 0.516 376 HD21 LEU 47 1HD2 LEU 47 -8.026 2.589 0.220 377 HD22 LEU 47 2HD2 LEU 47 -7.370 2.769 -1.407 378 HD23 LEU 47 3HD2 LEU 47 -8.439 4.007 -0.745 379 H SER 48 H SER 48 -5.379 6.262 4.455 380 HA SER 48 HA SER 48 -7.166 8.603 4.304 381 HB2 SER 48 2HB SER 48 -8.364 6.741 5.345 382 HB3 SER 48 1HB SER 48 -7.076 6.551 6.526 383 HG SER 48 HG SER 48 -8.470 8.989 6.243 384 H GLY 49 H GLY 49 -4.124 7.342 5.533 385 HA2 GLY 49 2HA GLY 49 -2.483 8.200 6.827 386 HA3 GLY 49 1HA GLY 49 -3.104 9.793 6.402 387 H ASP 50 H ASP 50 -4.714 7.179 8.178 388 HA ASP 50 HA ASP 50 -4.970 9.036 10.435 389 HB2 ASP 50 2HB ASP 50 -7.069 8.742 9.140 390 HB3 ASP 50 1HB ASP 50 -7.019 7.024 9.495 391 HA PRO 51 HA PRO 51 -2.626 5.787 12.392 392 HB2 PRO 51 2HB PRO 51 -2.926 6.723 14.961 393 HB3 PRO 51 1HB PRO 51 -1.703 7.244 13.797 394 HG2 PRO 51 2HG PRO 51 -4.270 8.557 14.548 395 HG3 PRO 51 1HG PRO 51 -2.704 9.285 14.171 396 HD2 PRO 51 2HD PRO 51 -4.741 9.263 12.416 397 HD3 PRO 51 1HD PRO 51 -3.048 9.163 11.893 398 H ALA 52 H ALA 52 -5.959 6.408 13.274 399 HA ALA 52 HA ALA 52 -6.201 4.413 15.256 400 HB1 ALA 52 1HB ALA 52 -8.363 5.491 13.458 401 HB2 ALA 52 2HB ALA 52 -7.843 6.208 14.980 402 HB3 ALA 52 3HB ALA 52 -8.607 4.617 14.972 403 H TYR 53 H TYR 53 -5.788 4.083 11.947 404 HA TYR 53 HA TYR 53 -7.211 1.685 11.592 405 HB2 TYR 53 2HB TYR 53 -5.123 3.041 9.971 406 HB3 TYR 53 1HB TYR 53 -5.627 1.398 9.569 407 HD1 TYR 53 1HD TYR 53 -7.948 0.921 9.088 408 HD2 TYR 53 2HD TYR 53 -6.557 4.898 9.509 409 HE1 TYR 53 1HE TYR 53 -9.955 1.702 8.017 410 HE2 TYR 53 2HE TYR 53 -8.590 5.728 8.413 411 HH TYR 53 HH TYR 53 -10.387 4.903 6.900 412 H ILE 54 H ILE 54 -4.110 2.263 13.037 413 HA ILE 54 HA ILE 54 -3.649 -0.612 12.870 414 HB ILE 54 HB ILE 54 -1.640 1.551 13.624 415 HG12 ILE 54 2HG1 ILE 54 -2.140 1.630 11.231 416 HG13 ILE 54 1HG1 ILE 54 -0.549 0.921 11.491 417 HG21 ILE 54 1HG2 ILE 54 0.047 -0.221 13.553 418 HG22 ILE 54 2HG2 ILE 54 -1.219 -1.416 13.279 419 HG23 ILE 54 3HG2 ILE 54 -1.165 -0.525 14.798 420 HD11 ILE 54 1HD1 ILE 54 -3.067 -0.606 10.865 421 HD12 ILE 54 2HD1 ILE 54 -1.471 -1.304 11.121 422 HD13 ILE 54 3HD1 ILE 54 -1.756 -0.244 9.741 423 HA PRO 55 HA PRO 55 -5.295 -0.769 16.997 424 HB2 PRO 55 2HB PRO 55 -4.461 -3.357 17.507 425 HB3 PRO 55 1HB PRO 55 -5.962 -2.925 16.688 426 HG2 PRO 55 2HG PRO 55 -3.351 -3.791 15.529 427 HG3 PRO 55 1HG PRO 55 -5.000 -4.182 15.011 428 HD2 PRO 55 2HD PRO 55 -3.488 -2.389 13.727 429 HD3 PRO 55 1HD PRO 55 -5.250 -2.193 13.865 430 H ARG 56 H ARG 56 -4.521 -0.360 18.899 431 HA ARG 56 HA ARG 56 -1.669 -0.117 19.168 432 HB2 ARG 56 2HB ARG 56 -2.042 1.168 21.258 433 HB3 ARG 56 1HB ARG 56 -2.969 1.817 19.931 434 HG2 ARG 56 2HG ARG 56 -4.152 0.035 22.054 435 HG3 ARG 56 1HG ARG 56 -4.115 1.789 22.181 436 HD2 ARG 56 2HD ARG 56 -5.525 1.950 20.173 437 HD3 ARG 56 1HD ARG 56 -5.498 0.198 20.004 438 HE ARG 56 HE ARG 56 -6.414 0.770 22.539 439 HH11 ARG 56 1HH1 ARG 56 -7.507 1.323 19.199 440 HH12 ARG 56 2HH1 ARG 56 -9.154 1.174 19.558 441 HH21 ARG 56 1HH2 ARG 56 -8.744 0.588 23.014 442 HH22 ARG 56 2HH2 ARG 56 -9.860 0.763 21.732 443 H TYR 57 H TYR 57 -1.286 -2.298 19.106 444 HA TYR 57 HA TYR 57 -1.355 -3.498 21.799 445 HB2 TYR 57 2HB TYR 57 -2.604 -4.869 20.242 446 HB3 TYR 57 1HB TYR 57 -1.257 -4.880 19.112 447 HD1 TYR 57 1HD TYR 57 -1.990 -5.836 22.672 448 HD2 TYR 57 2HD TYR 57 0.088 -6.762 19.078 449 HE1 TYR 57 1HE TYR 57 -1.166 -7.920 23.688 450 HE2 TYR 57 2HE TYR 57 0.924 -8.835 20.081 451 HH TYR 57 HH TYR 57 1.345 -9.740 22.295 452 H GLN 58 H GLN 58 0.552 -2.738 18.985 453 HA GLN 58 HA GLN 58 2.971 -3.344 20.506 454 HB2 GLN 58 2HB GLN 58 2.475 -3.711 17.546 455 HB3 GLN 58 1HB GLN 58 4.051 -3.804 18.303 456 HG2 GLN 58 2HG GLN 58 1.732 -5.595 18.950 457 HG3 GLN 58 1HG GLN 58 3.034 -6.010 17.837 458 HE21 GLN 58 1HE2 GLN 58 5.083 -6.404 18.671 459 HE22 GLN 58 2HE2 GLN 58 5.338 -6.755 20.338 460 H ASP 59 H ASP 59 4.812 -2.156 19.591 461 HA ASP 59 HA ASP 59 4.370 0.632 19.561 462 HB2 ASP 59 2HB ASP 59 6.791 0.815 19.198 463 HB3 ASP 59 1HB ASP 59 6.429 -0.322 20.479 464 H ALA 60 H ALA 60 4.181 -1.668 17.199 465 HA ALA 60 HA ALA 60 4.962 -0.551 14.812 466 HB1 ALA 60 1HB ALA 60 4.032 -2.810 15.059 467 HB2 ALA 60 2HB ALA 60 3.259 -1.920 13.746 468 HB3 ALA 60 3HB ALA 60 2.433 -2.115 15.293 469 H ARG 61 H ARG 61 2.070 0.233 16.749 470 HA ARG 61 HA ARG 61 0.601 1.800 15.024 471 HB2 ARG 61 2HB ARG 61 -0.036 1.207 17.331 472 HB3 ARG 61 1HB ARG 61 1.206 2.286 17.945 473 HG2 ARG 61 2HG ARG 61 0.000 4.163 16.787 474 HG3 ARG 61 1HG ARG 61 -1.312 3.023 16.471 475 HD2 ARG 61 2HD ARG 61 -1.795 4.274 18.493 476 HD3 ARG 61 1HD ARG 61 -1.468 2.584 18.886 477 HE ARG 61 HE ARG 61 0.916 4.051 19.024 478 HH11 ARG 61 1HH1 ARG 61 -2.118 3.806 20.881 479 HH12 ARG 61 2HH1 ARG 61 -1.385 4.135 22.367 480 HH21 ARG 61 1HH2 ARG 61 1.901 4.535 21.049 481 HH22 ARG 61 2HH2 ARG 61 0.958 4.577 22.467 482 H ASN 62 H ASN 62 3.341 2.736 17.090 483 HA ASN 62 HA ASN 62 3.363 5.443 16.165 484 HB2 ASN 62 2HB ASN 62 5.246 3.874 17.923 485 HB3 ASN 62 1HB ASN 62 5.530 5.556 17.500 486 HD21 ASN 62 1HD2 ASN 62 4.246 7.141 18.401 487 HD22 ASN 62 2HD2 ASN 62 3.193 6.849 19.721 488 H LEU 63 H LEU 63 5.135 2.527 15.440 489 HA LEU 63 HA LEU 63 7.225 3.637 13.938 490 HB2 LEU 63 2HB LEU 63 5.888 0.968 13.602 491 HB3 LEU 63 1HB LEU 63 7.370 1.440 12.810 492 HG LEU 63 HG LEU 63 6.997 1.094 15.791 493 HD11 LEU 63 1HD1 LEU 63 8.506 -0.531 13.750 494 HD12 LEU 63 2HD1 LEU 63 6.988 -0.990 14.513 495 HD13 LEU 63 3HD1 LEU 63 8.446 -0.828 15.489 496 HD21 LEU 63 1HD2 LEU 63 9.439 1.798 14.154 497 HD22 LEU 63 2HD2 LEU 63 9.444 1.380 15.860 498 HD23 LEU 63 3HD2 LEU 63 8.634 2.848 15.326 499 H ILE 64 H ILE 64 3.955 2.785 12.955 500 HA ILE 64 HA ILE 64 4.581 3.249 10.199 501 HB ILE 64 HB ILE 64 2.841 1.596 10.965 502 HG12 ILE 64 2HG1 ILE 64 1.758 3.728 9.106 503 HG13 ILE 64 1HG1 ILE 64 2.895 2.474 8.628 504 HG21 ILE 64 1HG2 ILE 64 1.266 4.090 11.588 505 HG22 ILE 64 2HG2 ILE 64 1.800 2.868 12.735 506 HG23 ILE 64 3HG2 ILE 64 0.576 2.477 11.520 507 HD11 ILE 64 1HD1 ILE 64 1.212 0.770 9.171 508 HD12 ILE 64 2HD1 ILE 64 0.633 1.909 7.954 509 HD13 ILE 64 3HD1 ILE 64 0.084 2.046 9.623 510 H ARG 65 H ARG 65 3.605 5.220 12.849 511 HA ARG 65 HA ARG 65 2.368 7.277 11.224 512 HB2 ARG 65 2HB ARG 65 3.158 7.366 14.126 513 HB3 ARG 65 1HB ARG 65 2.228 8.587 13.280 514 HG2 ARG 65 2HG ARG 65 0.471 6.919 12.876 515 HG3 ARG 65 1HG ARG 65 1.401 5.758 13.830 516 HD2 ARG 65 2HD ARG 65 -0.243 6.760 15.264 517 HD3 ARG 65 1HD ARG 65 1.353 7.346 15.721 518 HE ARG 65 HE ARG 65 0.227 9.115 13.857 519 HH11 ARG 65 1HH1 ARG 65 -0.057 8.197 17.234 520 HH12 ARG 65 2HH1 ARG 65 -0.814 9.632 17.746 521 HH21 ARG 65 1HH2 ARG 65 -0.832 11.091 14.499 522 HH22 ARG 65 2HH2 ARG 65 -1.286 11.346 16.121 523 H ARG 66 H ARG 66 5.502 6.489 12.190 524 HA ARG 66 HA ARG 66 6.460 9.211 12.030 525 HB2 ARG 66 2HB ARG 66 8.732 8.265 12.517 526 HB3 ARG 66 1HB ARG 66 7.522 7.932 13.736 527 HG2 ARG 66 2HG ARG 66 7.267 5.663 12.769 528 HG3 ARG 66 1HG ARG 66 8.600 6.032 11.676 529 HD2 ARG 66 2HD ARG 66 9.365 4.790 13.650 530 HD3 ARG 66 1HD ARG 66 10.083 6.396 13.570 531 HE ARG 66 HE ARG 66 7.758 6.545 15.122 532 HH11 ARG 66 1HH1 ARG 66 10.966 5.002 15.401 533 HH12 ARG 66 2HH1 ARG 66 11.021 5.226 17.096 534 HH21 ARG 66 1HH2 ARG 66 7.901 6.799 17.413 535 HH22 ARG 66 2HH2 ARG 66 9.267 6.226 18.254 536 H HIS 67 H HIS 67 5.442 7.408 9.746 537 HA HIS 67 HA HIS 67 7.213 8.631 7.795 538 HB2 HIS 67 2HB HIS 67 6.138 5.795 7.671 539 HB3 HIS 67 1HB HIS 67 6.829 6.635 6.289 540 HD1 HIS 67 1HD HIS 67 9.369 6.854 6.210 541 HD2 HIS 67 2HD HIS 67 7.969 4.837 9.564 542 HE1 HIS 67 1HE HIS 67 11.400 5.744 7.257 543 HE2 HIS 67 2HE HIS 67 10.540 4.737 9.387 544 H GLU 68 H GLU 68 6.055 9.558 6.108 545 HA GLU 68 HA GLU 68 3.310 9.935 6.699 546 HB2 GLU 68 2HB GLU 68 5.047 11.035 4.522 547 HB3 GLU 68 1HB GLU 68 3.321 11.349 4.580 548 HG2 GLU 68 2HG GLU 68 5.262 12.004 6.783 549 HG3 GLU 68 1HG GLU 68 4.670 13.150 5.580 550 H ARG 69 H ARG 69 1.609 9.766 5.396 551 HA ARG 69 HA ARG 69 0.713 7.380 4.581 552 HB2 ARG 69 2HB ARG 69 -0.664 9.289 4.939 553 HB3 ARG 69 1HB ARG 69 0.011 10.140 3.581 554 HG2 ARG 69 2HG ARG 69 -0.944 8.274 2.158 555 HG3 ARG 69 1HG ARG 69 -1.831 7.794 3.606 556 HD2 ARG 69 2HD ARG 69 -1.951 10.495 2.258 557 HD3 ARG 69 1HD ARG 69 -3.198 9.260 2.195 558 HE ARG 69 HE ARG 69 -3.513 9.603 4.567 559 HH11 ARG 69 1HH1 ARG 69 -1.793 12.158 2.805 560 HH12 ARG 69 2HH1 ARG 69 -2.210 13.390 3.902 561 HH21 ARG 69 1HH2 ARG 69 -4.131 11.357 6.077 562 HH22 ARG 69 2HH2 ARG 69 -3.555 12.922 5.790 563 H ASP 70 H ASP 70 1.974 9.868 2.329 564 HA ASP 70 HA ASP 70 1.686 8.089 0.104 565 HB2 ASP 70 2HB ASP 70 2.491 9.950 -1.273 566 HB3 ASP 70 1HB ASP 70 1.211 10.467 -0.184 567 H GLU 71 H GLU 71 4.273 8.981 2.217 568 HA GLU 71 HA GLU 71 6.468 8.343 0.540 569 HB2 GLU 71 2HB GLU 71 6.746 9.602 2.637 570 HB3 GLU 71 1HB GLU 71 6.247 8.193 3.557 571 HG2 GLU 71 2HG GLU 71 8.223 6.977 2.767 572 HG3 GLU 71 1HG GLU 71 8.722 8.394 1.851 573 H ILE 72 H ILE 72 4.777 6.458 3.000 574 HA ILE 72 HA ILE 72 6.208 4.058 2.668 575 HB ILE 72 HB ILE 72 3.330 4.417 3.553 576 HG12 ILE 72 2HG1 ILE 72 5.858 4.231 5.209 577 HG13 ILE 72 1HG1 ILE 72 4.923 5.700 4.941 578 HG21 ILE 72 1HG2 ILE 72 3.807 2.097 2.929 579 HG22 ILE 72 2HG2 ILE 72 3.586 2.246 4.676 580 HG23 ILE 72 3HG2 ILE 72 5.205 2.093 3.998 581 HD11 ILE 72 1HD1 ILE 72 3.976 3.228 6.379 582 HD12 ILE 72 2HD1 ILE 72 3.027 4.689 6.120 583 HD13 ILE 72 3HD1 ILE 72 4.468 4.742 7.137 584 H MET 73 H MET 73 3.342 5.339 1.115 585 HA MET 73 HA MET 73 2.597 2.959 -0.178 586 HB2 MET 73 2HB MET 73 1.292 5.205 0.339 587 HB3 MET 73 1HB MET 73 1.860 5.634 -1.258 588 HG2 MET 73 2HG MET 73 0.234 3.198 -0.605 589 HG3 MET 73 1HG MET 73 -0.402 4.690 -1.267 590 HE1 MET 73 1HE MET 73 -0.688 2.068 -4.114 591 HE2 MET 73 2HE MET 73 -1.562 3.186 -3.053 592 HE3 MET 73 3HE MET 73 -0.762 1.754 -2.385 593 H GLU 74 H GLU 74 4.478 5.815 -1.323 594 HA GLU 74 HA GLU 74 4.872 4.842 -3.931 595 HB2 GLU 74 2HB GLU 74 6.668 6.646 -2.300 596 HB3 GLU 74 1HB GLU 74 6.929 6.290 -4.001 597 HG2 GLU 74 2HG GLU 74 4.746 7.270 -4.507 598 HG3 GLU 74 1HG GLU 74 4.557 7.700 -2.803 599 H GLU 75 H GLU 75 6.550 4.166 -0.953 600 HA GLU 75 HA GLU 75 8.724 2.762 -2.072 601 HB2 GLU 75 2HB GLU 75 8.603 3.528 0.303 602 HB3 GLU 75 1HB GLU 75 7.406 2.278 0.609 603 HG2 GLU 75 2HG GLU 75 9.566 1.542 1.377 604 HG3 GLU 75 1HG GLU 75 9.064 0.568 -0.004 605 H LEU 76 H LEU 76 5.529 1.725 -0.961 606 HA LEU 76 HA LEU 76 5.740 -1.044 -1.335 607 HB2 LEU 76 2HB LEU 76 3.291 0.640 -1.863 608 HB3 LEU 76 1HB LEU 76 3.319 -1.072 -1.530 609 HG LEU 76 HG LEU 76 3.968 1.144 0.402 610 HD11 LEU 76 1HD1 LEU 76 1.967 0.379 1.555 611 HD12 LEU 76 2HD1 LEU 76 1.676 -0.795 0.273 612 HD13 LEU 76 3HD1 LEU 76 1.610 0.930 -0.081 613 HD21 LEU 76 1HD2 LEU 76 3.924 -1.833 0.835 614 HD22 LEU 76 2HD2 LEU 76 4.128 -0.601 2.082 615 HD23 LEU 76 3HD2 LEU 76 5.357 -0.802 0.837 616 H THR 77 H THR 77 4.584 1.470 -3.536 617 HA THR 77 HA THR 77 3.972 -0.163 -5.692 618 HB THR 77 HB THR 77 4.840 2.740 -5.737 619 HG1 THR 77 1HG THR 77 3.062 2.645 -4.362 620 HG21 THR 77 1HG2 THR 77 4.715 1.678 -7.970 621 HG22 THR 77 2HG2 THR 77 3.434 2.874 -7.751 622 HG23 THR 77 3HG2 THR 77 3.072 1.153 -7.616 623 H LYS 78 H LYS 78 6.995 1.555 -4.903 624 HA LYS 78 HA LYS 78 8.311 0.849 -7.310 625 HB2 LYS 78 2HB LYS 78 9.487 1.668 -4.671 626 HB3 LYS 78 1HB LYS 78 10.420 1.507 -6.158 627 HG2 LYS 78 2HG LYS 78 8.896 3.188 -7.160 628 HG3 LYS 78 1HG LYS 78 8.197 3.420 -5.570 629 HD2 LYS 78 2HD LYS 78 11.105 3.899 -6.278 630 HD3 LYS 78 1HD LYS 78 9.873 5.143 -6.156 631 HE2 LYS 78 2HE LYS 78 11.128 5.224 -4.142 632 HE3 LYS 78 1HE LYS 78 9.587 4.480 -3.737 633 HZ1 LYS 78 1HZ LYS 78 12.197 3.085 -4.097 634 HZ2 LYS 78 2HZ LYS 78 10.772 2.270 -3.736 635 HZ3 LYS 78 3HZ LYS 78 11.409 3.330 -2.651 636 H TYR 79 H TYR 79 8.298 -0.578 -4.130 637 HA TYR 79 HA TYR 79 10.276 -2.553 -4.588 638 HB2 TYR 79 2HB TYR 79 9.434 -1.831 -2.363 639 HB3 TYR 79 1HB TYR 79 7.908 -2.609 -2.719 640 HD1 TYR 79 1HD TYR 79 11.145 -2.977 -1.296 641 HD2 TYR 79 2HD TYR 79 7.968 -5.161 -3.063 642 HE1 TYR 79 1HE TYR 79 11.975 -5.028 -0.214 643 HE2 TYR 79 2HE TYR 79 8.773 -7.226 -1.993 644 HH TYR 79 HH TYR 79 11.068 -7.204 0.500 645 H TYR 80 H TYR 80 6.779 -2.559 -4.967 646 HA TYR 80 HA TYR 80 6.345 -5.229 -5.626 647 HB2 TYR 80 2HB TYR 80 4.619 -3.521 -5.066 648 HB3 TYR 80 1HB TYR 80 4.909 -2.760 -6.618 649 HD1 TYR 80 1HD TYR 80 3.332 -5.514 -4.861 650 HD2 TYR 80 2HD TYR 80 4.096 -3.844 -8.684 651 HE1 TYR 80 1HE TYR 80 1.554 -6.914 -5.813 652 HE2 TYR 80 2HE TYR 80 2.336 -5.228 -9.652 653 HH TYR 80 HH TYR 80 1.151 -7.420 -9.102 654 H LEU 81 H LEU 81 6.945 -2.413 -7.686 655 HA LEU 81 HA LEU 81 6.970 -3.946 -10.089 656 HB2 LEU 81 2HB LEU 81 7.787 -1.129 -9.532 657 HB3 LEU 81 1HB LEU 81 7.802 -1.823 -11.146 658 HG LEU 81 HG LEU 81 5.384 -1.360 -9.388 659 HD11 LEU 81 1HD1 LEU 81 4.727 0.218 -11.120 660 HD12 LEU 81 2HD1 LEU 81 6.241 -0.085 -11.972 661 HD13 LEU 81 3HD1 LEU 81 6.264 0.667 -10.377 662 HD21 LEU 81 1HD2 LEU 81 4.072 -2.120 -11.314 663 HD22 LEU 81 2HD2 LEU 81 5.088 -3.411 -10.685 664 HD23 LEU 81 3HD2 LEU 81 5.552 -2.557 -12.157 665 H ALA 82 H ALA 82 9.411 -3.063 -7.798 666 HA ALA 82 HA ALA 82 11.652 -3.276 -9.465 667 HB1 ALA 82 1HB ALA 82 11.757 -2.327 -7.211 668 HB2 ALA 82 2HB ALA 82 12.935 -3.623 -7.424 669 HB3 ALA 82 3HB ALA 82 11.444 -3.924 -6.526 670 H ASN 83 H ASN 83 9.869 -5.630 -7.591 671 HA ASN 83 HA ASN 83 11.634 -7.775 -8.287 672 HB2 ASN 83 2HB ASN 83 8.959 -7.803 -6.901 673 HB3 ASN 83 1HB ASN 83 9.932 -9.243 -7.173 674 HD21 ASN 83 1HD2 ASN 83 9.087 -8.001 -4.691 675 HD22 ASN 83 2HD2 ASN 83 10.542 -7.657 -3.814 676 H HIS 84 H HIS 84 9.314 -6.213 -9.998 677 HA HIS 84 HA HIS 84 8.416 -8.465 -11.617 678 HB2 HIS 84 2HB HIS 84 7.060 -6.317 -11.309 679 HB3 HIS 84 1HB HIS 84 8.293 -5.465 -12.211 680 HD1 HIS 84 1HD HIS 84 8.560 -7.349 -14.686 681 HD2 HIS 84 2HD HIS 84 4.923 -6.217 -13.017 682 HE1 HIS 84 1HE HIS 84 6.855 -7.693 -16.471 683 HE2 HIS 84 2HE HIS 84 4.706 -7.478 -15.296 684 H GLY 85 H GLY 85 11.182 -6.601 -11.214 685 HA2 GLY 85 2HA GLY 85 13.203 -6.951 -12.361 686 HA3 GLY 85 1HA GLY 85 12.286 -7.479 -13.771 687 H ILE 86 H ILE 86 11.193 -4.683 -12.103 688 HA ILE 86 HA ILE 86 11.983 -3.074 -14.396 689 HB ILE 86 HB ILE 86 9.893 -2.557 -12.269 690 HG12 ILE 86 2HG1 ILE 86 9.591 -3.277 -15.189 691 HG13 ILE 86 1HG1 ILE 86 9.297 -4.362 -13.835 692 HG21 ILE 86 1HG2 ILE 86 9.192 -0.648 -13.662 693 HG22 ILE 86 2HG2 ILE 86 10.558 -0.945 -14.742 694 HG23 ILE 86 3HG2 ILE 86 10.838 -0.452 -13.070 695 HD11 ILE 86 1HD1 ILE 86 7.810 -1.842 -14.470 696 HD12 ILE 86 2HD1 ILE 86 7.500 -2.890 -13.081 697 HD13 ILE 86 3HD1 ILE 86 7.232 -3.498 -14.720 698 H ASP 87 H ASP 87 13.369 -1.433 -14.136 699 HA ASP 87 HA ASP 87 14.324 -0.977 -11.417 700 HB2 ASP 87 2HB ASP 87 15.641 -0.289 -14.046 701 HB3 ASP 87 1HB ASP 87 16.252 0.260 -12.490 702 H ILE 88 H ILE 88 13.708 0.639 -10.361 703 HA ILE 88 HA ILE 88 12.514 2.919 -11.754 704 HB ILE 88 HB ILE 88 12.023 1.890 -8.951 705 HG12 ILE 88 2HG1 ILE 88 10.275 1.705 -11.419 706 HG13 ILE 88 1HG1 ILE 88 11.175 0.386 -10.697 707 HG21 ILE 88 1HG2 ILE 88 10.161 3.478 -8.903 708 HG22 ILE 88 2HG2 ILE 88 10.622 4.071 -10.498 709 HG23 ILE 88 3HG2 ILE 88 11.702 4.307 -9.121 710 HD11 ILE 88 1HD1 ILE 88 9.014 1.924 -9.317 711 HD12 ILE 88 2HD1 ILE 88 9.822 0.457 -8.736 712 HD13 ILE 88 3HD1 ILE 88 8.789 0.404 -10.172 713 H LYS 89 H LYS 89 13.280 4.878 -11.270 714 HA LYS 89 HA LYS 89 15.534 5.030 -9.402 715 HB2 LYS 89 2HB LYS 89 15.271 6.344 -12.102 716 HB3 LYS 89 1HB LYS 89 16.604 6.604 -10.993 717 HG2 LYS 89 2HG LYS 89 17.213 4.240 -11.183 718 HG3 LYS 89 1HG LYS 89 15.874 3.986 -12.295 719 HD2 LYS 89 2HD LYS 89 16.856 5.594 -13.850 720 HD3 LYS 89 1HD LYS 89 18.208 5.847 -12.746 721 HE2 LYS 89 2HE LYS 89 18.827 3.479 -12.981 722 HE3 LYS 89 1HE LYS 89 17.470 3.241 -14.076 723 HZ1 LYS 89 1HZ LYS 89 19.557 3.549 -15.259 724 HZ2 LYS 89 2HZ LYS 89 19.764 5.060 -14.557 725 HZ3 LYS 89 3HZ LYS 89 18.482 4.799 -15.616 726 H1 MET 1 H MET 1 -19.258 -9.036 23.650 727 HA MET 1 HA MET 1 -19.356 -11.532 22.380 728 HB2 MET 1 2HB MET 1 -21.621 -10.802 24.253 729 HB3 MET 1 1HB MET 1 -21.635 -12.116 23.091 730 HG2 MET 1 2HG MET 1 -19.841 -13.219 24.311 731 HG3 MET 1 1HG MET 1 -19.814 -11.896 25.472 732 HE1 MET 1 1HE MET 1 -21.389 -14.786 27.573 733 HE2 MET 1 2HE MET 1 -20.129 -13.556 27.500 734 HE3 MET 1 3HE MET 1 -20.104 -14.911 26.371 735 H GLY 2 H GLY 2 -21.001 -11.433 20.691 736 HA2 GLY 2 2HA GLY 2 -22.248 -10.369 19.099 737 HA3 GLY 2 1HA GLY 2 -22.621 -9.143 20.301 738 H PHE 3 H PHE 3 -19.686 -10.214 18.628 739 HA PHE 3 HA PHE 3 -18.848 -7.470 18.387 740 HB2 PHE 3 2HB PHE 3 -17.532 -10.030 17.456 741 HB3 PHE 3 1HB PHE 3 -16.805 -8.432 17.367 742 HD1 PHE 3 1HD PHE 3 -17.675 -11.220 19.554 743 HD2 PHE 3 2HD PHE 3 -16.083 -7.279 19.388 744 HE1 PHE 3 1HE PHE 3 -16.787 -11.498 21.811 745 HE2 PHE 3 2HE PHE 3 -15.188 -7.552 21.658 746 HZ PHE 3 HZ PHE 3 -15.540 -9.671 22.872 747 H THR 4 H THR 4 -19.160 -6.239 16.675 748 HA THR 4 HA THR 4 -20.769 -7.202 14.550 749 HB THR 4 HB THR 4 -20.558 -4.831 13.759 750 HG1 THR 4 1HG THR 4 -18.485 -4.461 14.618 751 HG21 THR 4 1HG2 THR 4 -21.806 -3.858 15.639 752 HG22 THR 4 2HG2 THR 4 -21.264 -5.169 16.683 753 HG23 THR 4 3HG2 THR 4 -22.348 -5.511 15.333 754 H ASP 5 H ASP 5 -19.751 -8.513 13.088 755 HA ASP 5 HA ASP 5 -17.102 -7.845 12.195 756 HB2 ASP 5 2HB ASP 5 -17.652 -10.209 12.328 757 HB3 ASP 5 1HB ASP 5 -19.012 -9.983 11.232 758 H GLU 6 H GLU 6 -16.776 -6.287 10.860 759 HA GLU 6 HA GLU 6 -18.839 -5.161 9.269 760 HB2 GLU 6 2HB GLU 6 -17.039 -3.810 10.261 761 HB3 GLU 6 1HB GLU 6 -15.860 -4.649 9.269 762 HG2 GLU 6 2HG GLU 6 -16.886 -3.742 7.258 763 HG3 GLU 6 1HG GLU 6 -18.100 -2.922 8.236 764 H THR 7 H THR 7 -19.547 -6.203 7.553 765 HA THR 7 HA THR 7 -17.702 -7.834 6.079 766 HB THR 7 HB THR 7 -19.774 -8.954 6.554 767 HG1 THR 7 1HG THR 7 -19.051 -9.562 4.648 768 HG21 THR 7 1HG2 THR 7 -21.270 -7.035 6.868 769 HG22 THR 7 2HG2 THR 7 -21.973 -8.173 5.718 770 HG23 THR 7 3HG2 THR 7 -21.218 -6.693 5.137 771 H VAL 8 H VAL 8 -16.425 -6.439 5.107 772 HA VAL 8 HA VAL 8 -17.340 -4.247 3.562 773 HB VAL 8 HB VAL 8 -15.100 -4.217 4.562 774 HG11 VAL 8 1HG1 VAL 8 -14.407 -6.461 2.682 775 HG12 VAL 8 2HG1 VAL 8 -14.521 -6.561 4.439 776 HG13 VAL 8 3HG1 VAL 8 -13.258 -5.582 3.690 777 HG21 VAL 8 1HG2 VAL 8 -14.980 -4.179 1.546 778 HG22 VAL 8 2HG2 VAL 8 -13.779 -3.459 2.618 779 HG23 VAL 8 3HG2 VAL 8 -15.429 -2.834 2.592 780 H ARG 9 H ARG 9 -17.868 -4.124 1.449 781 HA ARG 9 HA ARG 9 -18.173 -6.587 0.034 782 HB2 ARG 9 2HB ARG 9 -18.847 -3.758 -0.773 783 HB3 ARG 9 1HB ARG 9 -19.161 -5.163 -1.784 784 HG2 ARG 9 2HG ARG 9 -20.626 -6.076 -0.046 785 HG3 ARG 9 1HG ARG 9 -20.325 -4.650 0.948 786 HD2 ARG 9 2HD ARG 9 -21.317 -3.236 -0.763 787 HD3 ARG 9 1HD ARG 9 -21.580 -4.640 -1.796 788 HE ARG 9 HE ARG 9 -22.828 -5.216 0.586 789 HH11 ARG 9 1HH1 ARG 9 -23.166 -2.712 -1.901 790 HH12 ARG 9 2HH1 ARG 9 -24.824 -2.481 -1.667 791 HH21 ARG 9 1HH2 ARG 9 -25.110 -4.890 0.940 792 HH22 ARG 9 2HH2 ARG 9 -25.966 -3.750 -0.002 793 H PHE 10 H PHE 10 -16.457 -7.472 -0.695 794 HA PHE 10 HA PHE 10 -14.744 -5.994 -2.539 795 HB2 PHE 10 2HB PHE 10 -13.627 -6.241 -0.288 796 HB3 PHE 10 1HB PHE 10 -13.824 -7.976 -0.416 797 HD1 PHE 10 1HD PHE 10 -12.263 -9.282 -1.629 798 HD2 PHE 10 2HD PHE 10 -12.126 -5.049 -1.865 799 HE1 PHE 10 1HE PHE 10 -10.081 -9.418 -2.752 800 HE2 PHE 10 2HE PHE 10 -9.943 -5.178 -2.990 801 HZ PHE 10 HZ PHE 10 -8.918 -7.373 -3.433 802 H ASP 11 H ASP 11 -14.186 -7.290 -4.327 803 HA ASP 11 HA ASP 11 -15.990 -9.533 -4.693 804 HB2 ASP 11 2HB ASP 11 -15.450 -7.636 -6.410 805 HB3 ASP 11 1HB ASP 11 -13.986 -8.556 -6.735 806 H PHE 12 H PHE 12 -14.369 -11.152 -6.490 807 HA PHE 12 HA PHE 12 -12.368 -12.091 -4.563 808 HB2 PHE 12 2HB PHE 12 -13.034 -14.429 -4.913 809 HB3 PHE 12 1HB PHE 12 -14.360 -13.485 -4.274 810 HD1 PHE 12 1HD PHE 12 -16.133 -12.673 -5.972 811 HD2 PHE 12 2HD PHE 12 -13.292 -15.725 -6.800 812 HE1 PHE 12 1HE PHE 12 -17.562 -13.504 -7.788 813 HE2 PHE 12 2HE PHE 12 -14.716 -16.563 -8.618 814 HZ PHE 12 HZ PHE 12 -16.852 -15.458 -9.114 815 H ASP 13 H ASP 13 -10.708 -13.508 -5.448 816 HA ASP 13 HA ASP 13 -9.873 -12.444 -7.980 817 HB2 ASP 13 2HB ASP 13 -8.455 -14.308 -6.070 818 HB3 ASP 13 1HB ASP 13 -7.789 -13.842 -7.627 819 H ASP 14 H ASP 14 -11.039 -13.215 -9.548 820 HA ASP 14 HA ASP 14 -10.802 -16.082 -10.117 821 HB2 ASP 14 2HB ASP 14 -13.161 -15.410 -9.675 822 HB3 ASP 14 1HB ASP 14 -13.040 -14.195 -10.939 823 H ASN 15 H ASN 15 -10.612 -16.508 -12.509 824 HA ASN 15 HA ASN 15 -9.477 -16.220 -14.461 825 HB2 ASN 15 2HB ASN 15 -10.046 -13.259 -13.992 826 HB3 ASN 15 1HB ASN 15 -9.336 -13.909 -15.463 827 HD21 ASN 15 1HD2 ASN 15 -11.787 -12.391 -15.030 828 HD22 ASN 15 2HD2 ASN 15 -13.064 -13.352 -15.676 829 H ARG 16 H ARG 16 -8.237 -16.497 -12.078 830 HA ARG 16 HA ARG 16 -6.362 -14.850 -11.093 831 HB2 ARG 16 2HB ARG 16 -5.087 -16.849 -10.383 832 HB3 ARG 16 1HB ARG 16 -6.807 -16.932 -10.046 833 HG2 ARG 16 2HG ARG 16 -7.088 -18.352 -12.064 834 HG3 ARG 16 1HG ARG 16 -5.342 -18.311 -12.274 835 HD2 ARG 16 2HD ARG 16 -5.018 -19.375 -10.125 836 HD3 ARG 16 1HD ARG 16 -6.757 -19.331 -9.828 837 HE ARG 16 HE ARG 16 -6.069 -20.677 -12.233 838 HH11 ARG 16 1HH1 ARG 16 -6.316 -21.086 -8.729 839 HH12 ARG 16 2HH1 ARG 16 -6.629 -22.759 -8.781 840 HH21 ARG 16 1HH2 ARG 16 -6.514 -23.013 -12.328 841 HH22 ARG 16 2HH2 ARG 16 -6.749 -23.879 -10.899 842 H LYS 17 H LYS 17 -4.995 -13.660 -11.981 843 HA LYS 17 HA LYS 17 -2.803 -14.712 -13.544 844 HB2 LYS 17 2HB LYS 17 -4.520 -14.096 -15.241 845 HB3 LYS 17 1HB LYS 17 -4.618 -12.487 -14.548 846 HG2 LYS 17 2HG LYS 17 -2.254 -12.112 -15.169 847 HG3 LYS 17 1HG LYS 17 -2.226 -13.697 -15.934 848 HD2 LYS 17 2HD LYS 17 -4.016 -11.389 -16.703 849 HD3 LYS 17 1HD LYS 17 -2.566 -11.884 -17.563 850 HE2 LYS 17 2HE LYS 17 -3.608 -14.069 -18.044 851 HE3 LYS 17 1HE LYS 17 -5.052 -13.555 -17.176 852 HZ1 LYS 17 1HZ LYS 17 -5.363 -11.798 -18.787 853 HZ2 LYS 17 2HZ LYS 17 -5.296 -13.284 -19.578 854 HZ3 LYS 17 3HZ LYS 17 -3.978 -12.252 -19.617 855 H LYS 18 H LYS 18 -1.044 -13.113 -13.477 856 HA LYS 18 HA LYS 18 -1.264 -11.295 -11.222 857 HB2 LYS 18 2HB LYS 18 1.078 -11.887 -13.062 858 HB3 LYS 18 1HB LYS 18 1.165 -10.939 -11.583 859 HG2 LYS 18 2HG LYS 18 0.500 -12.918 -10.292 860 HG3 LYS 18 1HG LYS 18 0.464 -13.862 -11.775 861 HD2 LYS 18 2HD LYS 18 2.871 -13.394 -12.092 862 HD3 LYS 18 1HD LYS 18 2.878 -12.509 -10.567 863 HE2 LYS 18 2HE LYS 18 2.124 -14.547 -9.404 864 HE3 LYS 18 1HE LYS 18 2.186 -15.418 -10.931 865 HZ1 LYS 18 1HZ LYS 18 4.584 -14.984 -11.018 866 HZ2 LYS 18 2HZ LYS 18 4.135 -15.827 -9.633 867 HZ3 LYS 18 3HZ LYS 18 4.477 -14.183 -9.529 868 H ALA 19 H ALA 19 -3.004 -10.512 -12.863 869 HA ALA 19 HA ALA 19 -2.361 -8.989 -15.124 870 HB1 ALA 19 1HB ALA 19 -4.597 -8.143 -14.979 871 HB2 ALA 19 2HB ALA 19 -4.706 -8.743 -13.315 872 HB3 ALA 19 3HB ALA 19 -4.580 -9.890 -14.659 873 H ILE 20 H ILE 20 -2.983 -8.051 -11.778 874 HA ILE 20 HA ILE 20 -2.798 -5.275 -12.110 875 HB ILE 20 HB ILE 20 -2.057 -6.969 -9.699 876 HG12 ILE 20 2HG1 ILE 20 -4.562 -5.398 -10.342 877 HG13 ILE 20 1HG1 ILE 20 -4.408 -7.144 -10.419 878 HG21 ILE 20 1HG2 ILE 20 -0.958 -4.798 -9.533 879 HG22 ILE 20 2HG2 ILE 20 -2.273 -4.919 -8.363 880 HG23 ILE 20 3HG2 ILE 20 -2.490 -3.979 -9.841 881 HD11 ILE 20 1HD1 ILE 20 -5.562 -6.408 -8.402 882 HD12 ILE 20 2HD1 ILE 20 -4.150 -5.455 -7.949 883 HD13 ILE 20 3HD1 ILE 20 -4.046 -7.218 -8.010 884 H SER 21 H SER 21 -0.381 -7.713 -11.768 885 HA SER 21 HA SER 21 1.816 -5.990 -11.267 886 HB2 SER 21 2HB SER 21 1.806 -8.784 -12.395 887 HB3 SER 21 1HB SER 21 3.164 -7.974 -11.601 888 HG SER 21 HG SER 21 2.128 -9.279 -10.087 889 H GLU 22 H GLU 22 0.559 -7.533 -14.176 890 HA GLU 22 HA GLU 22 2.507 -6.398 -15.903 891 HB2 GLU 22 2HB GLU 22 -0.228 -7.520 -16.520 892 HB3 GLU 22 1HB GLU 22 0.992 -7.131 -17.724 893 HG2 GLU 22 2HG GLU 22 1.236 -9.211 -15.559 894 HG3 GLU 22 1HG GLU 22 0.927 -9.516 -17.267 895 H THR 23 H THR 23 -0.698 -5.463 -14.851 896 HA THR 23 HA THR 23 -1.156 -3.330 -16.610 897 HB THR 23 HB THR 23 -2.142 -3.627 -13.753 898 HG1 THR 23 1HG THR 23 -2.622 -5.364 -15.236 899 HG21 THR 23 1HG2 THR 23 -4.002 -2.191 -14.478 900 HG22 THR 23 2HG2 THR 23 -3.255 -2.012 -16.063 901 HG23 THR 23 3HG2 THR 23 -2.461 -1.347 -14.634 902 H LEU 24 H LEU 24 0.258 -3.329 -13.319 903 HA LEU 24 HA LEU 24 0.718 -0.558 -13.323 904 HB2 LEU 24 2HB LEU 24 2.031 -2.713 -11.686 905 HB3 LEU 24 1HB LEU 24 2.228 -0.991 -11.405 906 HG LEU 24 HG LEU 24 -0.344 -2.549 -11.154 907 HD11 LEU 24 1HD1 LEU 24 1.219 -2.999 -9.363 908 HD12 LEU 24 2HD1 LEU 24 -0.144 -2.034 -8.792 909 HD13 LEU 24 3HD1 LEU 24 1.415 -1.269 -9.084 910 HD21 LEU 24 1HD2 LEU 24 -0.798 -0.287 -11.937 911 HD22 LEU 24 2HD2 LEU 24 0.223 0.377 -10.657 912 HD23 LEU 24 3HD2 LEU 24 -1.278 -0.457 -10.256 913 H GLU 25 H GLU 25 2.637 -3.252 -14.502 914 HA GLU 25 HA GLU 25 4.968 -1.817 -14.896 915 HB2 GLU 25 2HB GLU 25 5.031 -4.203 -15.205 916 HB3 GLU 25 1HB GLU 25 3.857 -4.112 -16.519 917 HG2 GLU 25 2HG GLU 25 5.425 -2.859 -17.872 918 HG3 GLU 25 1HG GLU 25 6.604 -2.886 -16.578 919 H THR 26 H THR 26 2.145 -2.378 -16.983 920 HA THR 26 HA THR 26 2.909 -0.975 -19.247 921 HB THR 26 HB THR 26 0.097 -1.254 -18.107 922 HG1 THR 26 1HG THR 26 1.818 -3.075 -19.072 923 HG21 THR 26 1HG2 THR 26 0.301 0.411 -19.878 924 HG22 THR 26 2HG2 THR 26 -0.610 -1.002 -20.441 925 HG23 THR 26 3HG2 THR 26 1.082 -0.785 -20.910 926 H VAL 27 H VAL 27 1.228 0.166 -16.338 927 HA VAL 27 HA VAL 27 0.859 2.822 -17.203 928 HB VAL 27 HB VAL 27 1.066 1.795 -14.348 929 HG11 VAL 27 1HG1 VAL 27 1.338 4.211 -14.459 930 HG12 VAL 27 2HG1 VAL 27 -0.224 3.798 -13.753 931 HG13 VAL 27 3HG1 VAL 27 -0.130 4.343 -15.428 932 HG21 VAL 27 1HG2 VAL 27 -1.359 2.216 -16.100 933 HG22 VAL 27 2HG2 VAL 27 -1.385 1.748 -14.401 934 HG23 VAL 27 3HG2 VAL 27 -0.695 0.660 -15.604 935 H TYR 28 H TYR 28 3.491 1.243 -15.476 936 HA TYR 28 HA TYR 28 4.971 3.560 -14.898 937 HB2 TYR 28 2HB TYR 28 5.510 1.389 -13.839 938 HB3 TYR 28 1HB TYR 28 6.010 0.744 -15.400 939 HD1 TYR 28 1HD TYR 28 8.165 1.382 -16.375 940 HD2 TYR 28 2HD TYR 28 6.925 2.969 -12.627 941 HE1 TYR 28 1HE TYR 28 10.449 2.201 -15.975 942 HE2 TYR 28 2HE TYR 28 9.216 3.794 -12.219 943 HH TYR 28 HH TYR 28 11.565 3.868 -14.706 944 H ARG 29 H ARG 29 4.959 1.408 -17.661 945 HA ARG 29 HA ARG 29 7.096 2.522 -19.135 946 HB2 ARG 29 2HB ARG 29 4.625 1.196 -20.270 947 HB3 ARG 29 1HB ARG 29 6.162 1.390 -21.082 948 HG2 ARG 29 2HG ARG 29 5.612 -0.346 -18.679 949 HG3 ARG 29 1HG ARG 29 5.828 -0.888 -20.338 950 HD2 ARG 29 2HD ARG 29 8.145 -0.057 -20.283 951 HD3 ARG 29 1HD ARG 29 7.889 0.473 -18.616 952 HE ARG 29 HE ARG 29 7.208 -2.188 -18.716 953 HH11 ARG 29 1HH1 ARG 29 10.159 -0.283 -19.131 954 HH12 ARG 29 2HH1 ARG 29 11.228 -1.508 -18.687 955 HH21 ARG 29 1HH2 ARG 29 8.663 -3.930 -18.022 956 HH22 ARG 29 2HH2 ARG 29 10.338 -3.643 -18.026 957 H ALA 30 H ALA 30 3.769 3.434 -18.799 958 HA ALA 30 HA ALA 30 3.648 5.118 -21.071 959 HB1 ALA 30 1HB ALA 30 1.872 5.134 -18.639 960 HB2 ALA 30 2HB ALA 30 1.644 4.127 -20.064 961 HB3 ALA 30 3HB ALA 30 1.520 5.880 -20.197 962 H LEU 31 H LEU 31 4.127 5.830 -17.607 963 HA LEU 31 HA LEU 31 4.167 8.608 -18.213 964 HB2 LEU 31 2HB LEU 31 4.718 7.266 -15.617 965 HB3 LEU 31 1HB LEU 31 4.932 8.986 -15.826 966 HG LEU 31 HG LEU 31 2.520 8.936 -16.647 967 HD11 LEU 31 1HD1 LEU 31 2.204 6.555 -16.764 968 HD12 LEU 31 2HD1 LEU 31 1.095 7.279 -15.587 969 HD13 LEU 31 3HD1 LEU 31 2.527 6.439 -15.016 970 HD21 LEU 31 1HD2 LEU 31 3.198 10.090 -14.692 971 HD22 LEU 31 2HD2 LEU 31 3.175 8.616 -13.733 972 HD23 LEU 31 3HD2 LEU 31 1.679 9.254 -14.400 973 H GLU 32 H GLU 32 6.813 6.376 -17.637 974 HA GLU 32 HA GLU 32 8.492 8.633 -17.486 975 HB2 GLU 32 2HB GLU 32 10.427 6.961 -17.585 976 HB3 GLU 32 1HB GLU 32 9.402 6.988 -16.151 977 HG2 GLU 32 2HG GLU 32 9.811 4.734 -16.594 978 HG3 GLU 32 1HG GLU 32 8.206 5.018 -17.248 979 H GLU 33 H GLU 33 7.656 6.643 -20.069 980 HA GLU 33 HA GLU 33 9.353 7.801 -22.023 981 HB2 GLU 33 2HB GLU 33 6.578 6.647 -22.256 982 HB3 GLU 33 1HB GLU 33 7.512 7.175 -23.647 983 HG2 GLU 33 2HG GLU 33 8.479 5.121 -21.696 984 HG3 GLU 33 1HG GLU 33 7.569 4.712 -23.143 985 H LYS 34 H LYS 34 6.460 8.942 -20.490 986 HA LYS 34 HA LYS 34 6.104 11.182 -22.311 987 HB2 LYS 34 2HB LYS 34 4.660 10.252 -19.860 988 HB3 LYS 34 1HB LYS 34 4.275 11.775 -20.646 989 HG2 LYS 34 2HG LYS 34 4.214 9.108 -22.035 990 HG3 LYS 34 1HG LYS 34 2.816 9.823 -21.233 991 HD2 LYS 34 2HD LYS 34 4.365 11.157 -23.465 992 HD3 LYS 34 1HD LYS 34 2.886 10.228 -23.695 993 HE2 LYS 34 2HE LYS 34 1.701 11.749 -22.196 994 HE3 LYS 34 1HE LYS 34 3.165 12.706 -21.986 995 HZ1 LYS 34 1HZ LYS 34 3.117 13.155 -24.388 996 HZ2 LYS 34 2HZ LYS 34 1.740 13.715 -23.586 997 HZ3 LYS 34 3HZ LYS 34 1.642 12.327 -24.507 998 H GLY 35 H GLY 35 7.960 10.562 -19.581 999 HA2 GLY 35 2HA GLY 35 9.478 12.029 -18.597 1000 HA3 GLY 35 1HA GLY 35 8.676 13.362 -19.410 1001 H TYR 36 H TYR 36 6.711 11.175 -17.626 1002 HA TYR 36 HA TYR 36 6.365 13.230 -15.546 1003 HB2 TYR 36 2HB TYR 36 4.521 10.986 -16.392 1004 HB3 TYR 36 1HB TYR 36 4.245 11.988 -14.977 1005 HD1 TYR 36 1HD TYR 36 3.756 11.608 -18.474 1006 HD2 TYR 36 2HD TYR 36 3.930 14.487 -15.366 1007 HE1 TYR 36 1HE TYR 36 2.492 13.189 -19.876 1008 HE2 TYR 36 2HE TYR 36 2.659 16.076 -16.747 1009 HH TYR 36 HH TYR 36 2.217 16.476 -19.091 1010 H ASN 37 H ASN 37 5.475 12.024 -13.431 1011 HA ASN 37 HA ASN 37 7.613 10.170 -12.678 1012 HB2 ASN 37 2HB ASN 37 5.636 11.729 -10.989 1013 HB3 ASN 37 1HB ASN 37 6.885 10.681 -10.338 1014 HD21 ASN 37 1HD2 ASN 37 6.408 13.525 -9.918 1015 HD22 ASN 37 2HD2 ASN 37 7.854 14.313 -10.386 1016 HA PRO 38 HA PRO 38 4.319 7.140 -13.580 1017 HB2 PRO 38 2HB PRO 38 6.409 5.248 -12.757 1018 HB3 PRO 38 1HB PRO 38 5.456 5.325 -14.239 1019 HG2 PRO 38 2HG PRO 38 8.054 6.007 -14.171 1020 HG3 PRO 38 1HG PRO 38 6.895 6.780 -15.262 1021 HD2 PRO 38 2HD PRO 38 8.135 7.842 -12.772 1022 HD3 PRO 38 1HD PRO 38 7.559 8.666 -14.246 1023 H ILE 39 H ILE 39 6.425 6.882 -10.748 1024 HA ILE 39 HA ILE 39 4.599 5.077 -9.445 1025 HB ILE 39 HB ILE 39 6.975 6.570 -8.310 1026 HG12 ILE 39 2HG1 ILE 39 7.616 5.104 -10.159 1027 HG13 ILE 39 1HG1 ILE 39 8.217 4.481 -8.629 1028 HG21 ILE 39 1HG2 ILE 39 5.456 5.838 -6.557 1029 HG22 ILE 39 2HG2 ILE 39 6.950 4.899 -6.518 1030 HG23 ILE 39 3HG2 ILE 39 5.481 4.201 -7.201 1031 HD11 ILE 39 1HD1 ILE 39 7.370 2.728 -10.087 1032 HD12 ILE 39 2HD1 ILE 39 5.779 3.485 -10.094 1033 HD13 ILE 39 3HD1 ILE 39 6.448 2.831 -8.588 1034 H ASN 40 H ASN 40 5.551 8.477 -9.068 1035 HA ASN 40 HA ASN 40 4.095 9.172 -6.920 1036 HB2 ASN 40 2HB ASN 40 5.878 10.386 -8.211 1037 HB3 ASN 40 1HB ASN 40 4.618 10.809 -9.364 1038 HD21 ASN 40 1HD2 ASN 40 5.761 11.116 -6.160 1039 HD22 ASN 40 2HD2 ASN 40 4.901 12.548 -5.779 1040 H GLN 41 H GLN 41 3.070 9.042 -10.385 1041 HA GLN 41 HA GLN 41 0.521 10.050 -9.668 1042 HB2 GLN 41 2HB GLN 41 1.458 8.862 -12.261 1043 HB3 GLN 41 1HB GLN 41 -0.109 9.632 -12.015 1044 HG2 GLN 41 2HG GLN 41 2.581 10.954 -11.701 1045 HG3 GLN 41 1HG GLN 41 1.467 11.181 -13.043 1046 HE21 GLN 41 1HE2 GLN 41 -0.903 11.267 -11.401 1047 HE22 GLN 41 2HE2 GLN 41 -0.856 12.784 -10.556 1048 H ILE 42 H ILE 42 1.830 6.815 -10.105 1049 HA ILE 42 HA ILE 42 -0.641 5.470 -10.133 1050 HB ILE 42 HB ILE 42 2.062 4.487 -9.128 1051 HG12 ILE 42 2HG1 ILE 42 0.573 3.932 -11.706 1052 HG13 ILE 42 1HG1 ILE 42 1.950 5.012 -11.537 1053 HG21 ILE 42 1HG2 ILE 42 0.289 3.196 -8.065 1054 HG22 ILE 42 2HG2 ILE 42 1.128 2.209 -9.264 1055 HG23 ILE 42 3HG2 ILE 42 -0.454 2.897 -9.633 1056 HD11 ILE 42 1HD1 ILE 42 3.364 3.109 -10.921 1057 HD12 ILE 42 2HD1 ILE 42 2.606 2.874 -12.496 1058 HD13 ILE 42 3HD1 ILE 42 1.976 2.031 -11.083 1059 H VAL 43 H VAL 43 1.491 6.277 -7.396 1060 HA VAL 43 HA VAL 43 -0.246 5.287 -5.429 1061 HB VAL 43 HB VAL 43 2.048 5.796 -4.751 1062 HG11 VAL 43 1HG1 VAL 43 2.510 7.657 -6.235 1063 HG12 VAL 43 2HG1 VAL 43 2.868 8.110 -4.561 1064 HG13 VAL 43 3HG1 VAL 43 1.386 8.670 -5.336 1065 HG21 VAL 43 1HG2 VAL 43 0.149 7.680 -3.371 1066 HG22 VAL 43 2HG2 VAL 43 1.706 7.142 -2.742 1067 HG23 VAL 43 3HG2 VAL 43 0.402 5.976 -2.986 1068 H GLY 44 H GLY 44 -0.122 8.404 -7.009 1069 HA2 GLY 44 2HA GLY 44 -2.022 9.769 -5.438 1070 HA3 GLY 44 1HA GLY 44 -1.645 10.135 -7.119 1071 H TYR 45 H TYR 45 -2.335 7.749 -8.292 1072 HA TYR 45 HA TYR 45 -5.119 7.956 -8.640 1073 HB2 TYR 45 2HB TYR 45 -3.727 7.019 -10.406 1074 HB3 TYR 45 1HB TYR 45 -3.199 5.721 -9.347 1075 HD1 TYR 45 1HD TYR 45 -4.766 3.890 -8.768 1076 HD2 TYR 45 2HD TYR 45 -5.843 6.886 -11.562 1077 HE1 TYR 45 1HE TYR 45 -6.613 2.468 -9.564 1078 HE2 TYR 45 2HE TYR 45 -7.680 5.465 -12.375 1079 HH TYR 45 HH TYR 45 -8.221 3.053 -12.425 1080 H LEU 46 H LEU 46 -3.164 5.506 -7.030 1081 HA LEU 46 HA LEU 46 -5.238 3.807 -6.383 1082 HB2 LEU 46 2HB LEU 46 -2.542 4.083 -5.120 1083 HB3 LEU 46 1HB LEU 46 -3.646 2.753 -4.810 1084 HG LEU 46 HG LEU 46 -2.563 3.440 -7.545 1085 HD11 LEU 46 1HD1 LEU 46 -1.175 1.474 -7.304 1086 HD12 LEU 46 2HD1 LEU 46 -1.746 1.270 -5.644 1087 HD13 LEU 46 3HD1 LEU 46 -0.796 2.701 -6.097 1088 HD21 LEU 46 1HD2 LEU 46 -3.438 1.253 -8.161 1089 HD22 LEU 46 2HD2 LEU 46 -4.734 2.296 -7.580 1090 HD23 LEU 46 3HD2 LEU 46 -4.071 1.043 -6.536 1091 H LEU 47 H LEU 47 -4.091 6.505 -4.441 1092 HA LEU 47 HA LEU 47 -5.623 5.752 -2.223 1093 HB2 LEU 47 2HB LEU 47 -4.322 8.314 -3.006 1094 HB3 LEU 47 1HB LEU 47 -5.427 8.290 -1.652 1095 HG LEU 47 HG LEU 47 -4.003 6.644 -0.522 1096 HD11 LEU 47 1HD1 LEU 47 -2.988 5.499 -2.359 1097 HD12 LEU 47 2HD1 LEU 47 -1.752 6.181 -1.293 1098 HD13 LEU 47 3HD1 LEU 47 -2.120 6.965 -2.826 1099 HD21 LEU 47 1HD2 LEU 47 -2.138 8.135 -0.001 1100 HD22 LEU 47 2HD2 LEU 47 -3.678 8.991 -0.056 1101 HD23 LEU 47 3HD2 LEU 47 -2.548 9.122 -1.404 1102 H SER 48 H SER 48 -6.675 7.138 -5.176 1103 HA SER 48 HA SER 48 -9.249 7.747 -3.870 1104 HB2 SER 48 2HB SER 48 -8.071 9.843 -4.385 1105 HB3 SER 48 1HB SER 48 -7.948 9.372 -6.075 1106 HG SER 48 HG SER 48 -10.479 9.404 -4.914 1107 H GLY 49 H GLY 49 -7.686 6.007 -6.320 1108 HA2 GLY 49 2HA GLY 49 -8.379 4.726 -8.068 1109 HA3 GLY 49 1HA GLY 49 -9.993 4.793 -7.364 1110 H ASP 50 H ASP 50 -8.061 7.517 -8.546 1111 HA ASP 50 HA ASP 50 -10.313 8.187 -10.326 1112 HB2 ASP 50 2HB ASP 50 -9.707 9.749 -8.464 1113 HB3 ASP 50 1HB ASP 50 -8.182 10.030 -9.270 1114 HA PRO 51 HA PRO 51 -7.522 7.029 -13.608 1115 HB2 PRO 51 2HB PRO 51 -9.016 7.958 -15.684 1116 HB3 PRO 51 1HB PRO 51 -9.332 6.444 -14.819 1117 HG2 PRO 51 2HG PRO 51 -10.601 9.125 -14.448 1118 HG3 PRO 51 1HG PRO 51 -11.377 7.532 -14.539 1119 HD2 PRO 51 2HD PRO 51 -10.953 8.743 -12.198 1120 HD3 PRO 51 1HD PRO 51 -10.771 6.982 -12.361 1121 H ALA 52 H ALA 52 -8.481 10.373 -13.126 1122 HA ALA 52 HA ALA 52 -7.006 11.420 -15.313 1123 HB1 ALA 52 1HB ALA 52 -7.360 13.604 -14.312 1124 HB2 ALA 52 2HB ALA 52 -7.881 12.836 -12.814 1125 HB3 ALA 52 3HB ALA 52 -8.848 12.657 -14.282 1126 H TYR 53 H TYR 53 -5.983 10.216 -12.332 1127 HA TYR 53 HA TYR 53 -3.648 11.752 -11.988 1128 HB2 TYR 53 2HB TYR 53 -4.429 9.041 -11.023 1129 HB3 TYR 53 1HB TYR 53 -2.810 9.679 -10.738 1130 HD1 TYR 53 1HD TYR 53 -2.553 11.824 -9.590 1131 HD2 TYR 53 2HD TYR 53 -6.236 9.754 -9.709 1132 HE1 TYR 53 1HE TYR 53 -3.287 13.115 -7.722 1133 HE2 TYR 53 2HE TYR 53 -7.040 11.064 -7.780 1134 HH TYR 53 HH TYR 53 -5.498 13.837 -6.742 1135 H ILE 54 H ILE 54 -4.405 9.043 -14.042 1136 HA ILE 54 HA ILE 54 -1.607 8.781 -14.750 1137 HB ILE 54 HB ILE 54 -4.004 7.153 -15.661 1138 HG12 ILE 54 2HG1 ILE 54 -3.647 6.816 -13.276 1139 HG13 ILE 54 1HG1 ILE 54 -3.119 5.387 -14.152 1140 HG21 ILE 54 1HG2 ILE 54 -2.355 5.522 -16.479 1141 HG22 ILE 54 2HG2 ILE 54 -1.055 6.620 -16.028 1142 HG23 ILE 54 3HG2 ILE 54 -2.195 7.081 -17.290 1143 HD11 ILE 54 1HD1 ILE 54 -1.588 5.926 -12.350 1144 HD12 ILE 54 2HD1 ILE 54 -1.332 7.535 -13.029 1145 HD13 ILE 54 3HD1 ILE 54 -0.791 6.110 -13.913 1146 HA PRO 55 HA PRO 55 -2.400 11.599 -18.161 1147 HB2 PRO 55 2HB PRO 55 -0.023 11.134 -19.467 1148 HB3 PRO 55 1HB PRO 55 -0.193 12.245 -18.105 1149 HG2 PRO 55 2HG PRO 55 0.790 9.431 -18.144 1150 HG3 PRO 55 1HG PRO 55 1.410 10.824 -17.242 1151 HD2 PRO 55 2HD PRO 55 -0.108 8.939 -16.086 1152 HD3 PRO 55 1HD PRO 55 -0.215 10.646 -15.603 1153 H ARG 56 H ARG 56 -3.167 11.353 -20.176 1154 HA ARG 56 HA ARG 56 -3.455 8.605 -21.012 1155 HB2 ARG 56 2HB ARG 56 -5.158 9.280 -22.694 1156 HB3 ARG 56 1HB ARG 56 -5.591 9.692 -21.052 1157 HG2 ARG 56 2HG ARG 56 -4.466 11.679 -23.027 1158 HG3 ARG 56 1HG ARG 56 -6.186 11.377 -22.838 1159 HD2 ARG 56 2HD ARG 56 -6.048 12.068 -20.503 1160 HD3 ARG 56 1HD ARG 56 -4.321 12.336 -20.665 1161 HE ARG 56 HE ARG 56 -5.771 13.802 -22.584 1162 HH11 ARG 56 1HH1 ARG 56 -4.944 13.761 -19.166 1163 HH12 ARG 56 2HH1 ARG 56 -5.012 15.450 -18.962 1164 HH21 ARG 56 1HH2 ARG 56 -5.871 16.163 -22.325 1165 HH22 ARG 56 2HH2 ARG 56 -5.516 16.838 -20.814 1166 H TYR 57 H TYR 57 -1.393 8.323 -21.538 1167 HA TYR 57 HA TYR 57 -0.563 9.347 -24.123 1168 HB2 TYR 57 2HB TYR 57 1.176 9.102 -22.448 1169 HB3 TYR 57 1HB TYR 57 0.760 7.412 -22.203 1170 HD1 TYR 57 1HD TYR 57 1.432 9.449 -25.285 1171 HD2 TYR 57 2HD TYR 57 2.513 6.084 -22.920 1172 HE1 TYR 57 1HE TYR 57 3.115 8.821 -26.960 1173 HE2 TYR 57 2HE TYR 57 4.194 5.443 -24.594 1174 HH TYR 57 HH TYR 57 4.591 5.792 -26.988 1175 H GLN 58 H GLN 58 -1.109 6.191 -22.633 1176 HA GLN 58 HA GLN 58 -2.081 5.194 -25.207 1177 HB2 GLN 58 2HB GLN 58 -0.295 3.756 -23.230 1178 HB3 GLN 58 1HB GLN 58 -1.046 3.008 -24.629 1179 HG2 GLN 58 2HG GLN 58 0.975 5.232 -24.712 1180 HG3 GLN 58 1HG GLN 58 1.346 3.531 -24.936 1181 HE21 GLN 58 1HE2 GLN 58 0.656 2.530 -26.828 1182 HE22 GLN 58 2HE2 GLN 58 0.215 3.432 -28.235 1183 H ASP 59 H ASP 59 -2.882 2.782 -24.463 1184 HA ASP 59 HA ASP 59 -5.320 3.102 -23.155 1185 HB2 ASP 59 2HB ASP 59 -5.440 0.591 -23.241 1186 HB3 ASP 59 1HB ASP 59 -5.122 1.388 -24.776 1187 H ALA 60 H ALA 60 -2.307 2.738 -21.730 1188 HA ALA 60 HA ALA 60 -2.606 1.173 -19.502 1189 HB1 ALA 60 1HB ALA 60 -0.886 2.505 -18.450 1190 HB2 ALA 60 2HB ALA 60 -1.197 3.830 -19.567 1191 HB3 ALA 60 3HB ALA 60 -0.522 2.320 -20.169 1192 H ARG 61 H ARG 61 -3.789 4.496 -19.891 1193 HA ARG 61 HA ARG 61 -4.533 4.904 -17.187 1194 HB2 ARG 61 2HB ARG 61 -4.315 6.784 -18.768 1195 HB3 ARG 61 1HB ARG 61 -5.694 6.185 -19.676 1196 HG2 ARG 61 2HG ARG 61 -7.134 6.545 -17.722 1197 HG3 ARG 61 1HG ARG 61 -5.760 7.162 -16.820 1198 HD2 ARG 61 2HD ARG 61 -7.103 8.988 -17.663 1199 HD3 ARG 61 1HD ARG 61 -5.531 8.987 -18.459 1200 HE ARG 61 HE ARG 61 -7.022 7.593 -20.186 1201 HH11 ARG 61 1HH1 ARG 61 -7.619 10.716 -18.607 1202 HH12 ARG 61 2HH1 ARG 61 -8.577 11.310 -19.887 1203 HH21 ARG 61 1HH2 ARG 61 -8.315 8.434 -21.911 1204 HH22 ARG 61 2HH2 ARG 61 -8.964 10.013 -21.787 1205 H ASN 62 H ASN 62 -6.171 3.465 -19.905 1206 HA ASN 62 HA ASN 62 -8.687 3.258 -18.569 1207 HB2 ASN 62 2HB ASN 62 -7.686 1.923 -21.090 1208 HB3 ASN 62 1HB ASN 62 -9.344 1.863 -20.503 1209 HD21 ASN 62 1HD2 ASN 62 -10.631 3.703 -20.667 1210 HD22 ASN 62 2HD2 ASN 62 -10.177 5.050 -21.649 1211 H LEU 63 H LEU 63 -5.968 1.131 -19.214 1212 HA LEU 63 HA LEU 63 -7.028 -1.306 -18.344 1213 HB2 LEU 63 2HB LEU 63 -4.197 -0.325 -18.137 1214 HB3 LEU 63 1HB LEU 63 -4.696 -1.979 -17.890 1215 HG LEU 63 HG LEU 63 -4.881 -0.443 -20.479 1216 HD11 LEU 63 1HD1 LEU 63 -2.604 -1.007 -19.800 1217 HD12 LEU 63 2HD1 LEU 63 -3.111 -1.955 -21.199 1218 HD13 LEU 63 3HD1 LEU 63 -3.082 -2.691 -19.596 1219 HD21 LEU 63 1HD2 LEU 63 -5.498 -2.603 -21.451 1220 HD22 LEU 63 2HD2 LEU 63 -6.681 -2.097 -20.246 1221 HD23 LEU 63 3HD2 LEU 63 -5.482 -3.333 -19.847 1222 H ILE 64 H ILE 64 -5.421 1.213 -16.489 1223 HA ILE 64 HA ILE 64 -5.288 -0.311 -14.106 1224 HB ILE 64 HB ILE 64 -3.805 1.642 -14.616 1225 HG12 ILE 64 2HG1 ILE 64 -5.337 1.985 -12.024 1226 HG13 ILE 64 1HG1 ILE 64 -4.022 0.840 -12.276 1227 HG21 ILE 64 1HG2 ILE 64 -4.617 3.925 -14.214 1228 HG22 ILE 64 2HG2 ILE 64 -6.251 3.291 -14.032 1229 HG23 ILE 64 3HG2 ILE 64 -5.419 3.148 -15.578 1230 HD11 ILE 64 1HD1 ILE 64 -2.479 2.703 -12.657 1231 HD12 ILE 64 2HD1 ILE 64 -3.269 2.838 -11.085 1232 HD13 ILE 64 3HD1 ILE 64 -3.799 3.846 -12.426 1233 H ARG 65 H ARG 65 -7.894 1.202 -15.624 1234 HA ARG 65 HA ARG 65 -9.412 1.886 -13.259 1235 HB2 ARG 65 2HB ARG 65 -10.235 1.777 -16.148 1236 HB3 ARG 65 1HB ARG 65 -11.228 2.381 -14.834 1237 HG2 ARG 65 2HG ARG 65 -9.612 4.149 -14.414 1238 HG3 ARG 65 1HG ARG 65 -8.593 3.532 -15.718 1239 HD2 ARG 65 2HD ARG 65 -9.948 5.412 -16.495 1240 HD3 ARG 65 1HD ARG 65 -10.395 3.924 -17.317 1241 HE ARG 65 HE ARG 65 -12.073 4.056 -15.175 1242 HH11 ARG 65 1HH1 ARG 65 -11.382 6.233 -17.875 1243 HH12 ARG 65 2HH1 ARG 65 -12.963 6.848 -17.953 1244 HH21 ARG 65 1HH2 ARG 65 -14.229 4.887 -15.300 1245 HH22 ARG 65 2HH2 ARG 65 -14.615 6.065 -16.454 1246 H ARG 66 H ARG 66 -8.930 -0.979 -15.088 1247 HA ARG 66 HA ARG 66 -11.566 -2.014 -14.532 1248 HB2 ARG 66 2HB ARG 66 -10.862 -4.111 -15.606 1249 HB3 ARG 66 1HB ARG 66 -10.529 -2.724 -16.620 1250 HG2 ARG 66 2HG ARG 66 -8.161 -2.852 -15.938 1251 HG3 ARG 66 1HG ARG 66 -8.543 -4.296 -14.995 1252 HD2 ARG 66 2HD ARG 66 -7.629 -4.891 -17.202 1253 HD3 ARG 66 1HD ARG 66 -9.300 -5.427 -17.028 1254 HE ARG 66 HE ARG 66 -9.316 -2.900 -18.171 1255 HH11 ARG 66 1HH1 ARG 66 -8.300 -6.159 -19.064 1256 HH12 ARG 66 2HH1 ARG 66 -8.588 -5.959 -20.723 1257 HH21 ARG 66 1HH2 ARG 66 -9.713 -2.600 -20.431 1258 HH22 ARG 66 2HH2 ARG 66 -9.420 -3.861 -21.530 1259 H HIS 67 H HIS 67 -9.371 -1.387 -12.468 1260 HA HIS 67 HA HIS 67 -10.068 -3.681 -10.810 1261 HB2 HIS 67 2HB HIS 67 -7.398 -2.248 -10.851 1262 HB3 HIS 67 1HB HIS 67 -7.877 -3.413 -9.620 1263 HD1 HIS 67 1HD HIS 67 -7.826 -5.891 -10.258 1264 HD2 HIS 67 2HD HIS 67 -6.732 -3.360 -13.365 1265 HE1 HIS 67 1HE HIS 67 -6.832 -7.370 -12.015 1266 HE2 HIS 67 2HE HIS 67 -6.491 -5.852 -13.981 1267 H GLU 68 H GLU 68 -10.629 -3.165 -8.695 1268 HA GLU 68 HA GLU 68 -11.503 -0.429 -8.482 1269 HB2 GLU 68 2HB GLU 68 -12.228 -2.889 -6.935 1270 HB3 GLU 68 1HB GLU 68 -12.793 -1.281 -6.503 1271 HG2 GLU 68 2HG GLU 68 -13.266 -2.604 -9.162 1272 HG3 GLU 68 1HG GLU 68 -14.418 -2.581 -7.825 1273 H ARG 69 H ARG 69 -9.684 0.668 -8.021 1274 HA ARG 69 HA ARG 69 -8.092 1.723 -6.794 1275 HB2 ARG 69 2HB ARG 69 -10.249 2.702 -6.205 1276 HB3 ARG 69 1HB ARG 69 -10.374 1.642 -4.816 1277 HG2 ARG 69 2HG ARG 69 -8.212 2.711 -4.012 1278 HG3 ARG 69 1HG ARG 69 -8.469 3.910 -5.281 1279 HD2 ARG 69 2HD ARG 69 -10.281 3.277 -2.965 1280 HD3 ARG 69 1HD ARG 69 -9.368 4.753 -3.214 1281 HE ARG 69 HE ARG 69 -10.909 4.778 -5.368 1282 HH11 ARG 69 1HH1 ARG 69 -11.753 4.131 -1.981 1283 HH12 ARG 69 2HH1 ARG 69 -13.362 4.610 -2.132 1284 HH21 ARG 69 1HH2 ARG 69 -13.142 5.481 -5.575 1285 HH22 ARG 69 2HH2 ARG 69 -14.177 5.397 -4.228 1286 H ASP 70 H ASP 70 -9.597 0.082 -4.118 1287 HA ASP 70 HA ASP 70 -7.207 -0.158 -2.599 1288 HB2 ASP 70 2HB ASP 70 -8.669 -1.367 -0.986 1289 HB3 ASP 70 1HB ASP 70 -9.285 0.210 -1.468 1290 H GLU 71 H GLU 71 -8.901 -2.277 -4.741 1291 HA GLU 71 HA GLU 71 -8.073 -4.813 -3.944 1292 HB2 GLU 71 2HB GLU 71 -9.653 -4.300 -5.787 1293 HB3 GLU 71 1HB GLU 71 -8.296 -3.762 -6.759 1294 HG2 GLU 71 2HG GLU 71 -7.337 -6.038 -6.579 1295 HG3 GLU 71 1HG GLU 71 -8.815 -6.544 -5.760 1296 H ILE 72 H ILE 72 -6.472 -2.455 -5.987 1297 HA ILE 72 HA ILE 72 -4.183 -4.032 -6.588 1298 HB ILE 72 HB ILE 72 -4.578 -1.034 -6.739 1299 HG12 ILE 72 2HG1 ILE 72 -4.780 -3.151 -8.902 1300 HG13 ILE 72 1HG1 ILE 72 -6.131 -2.302 -8.165 1301 HG21 ILE 72 1HG2 ILE 72 -2.400 -2.742 -7.957 1302 HG22 ILE 72 2HG2 ILE 72 -2.206 -1.568 -6.657 1303 HG23 ILE 72 3HG2 ILE 72 -2.649 -1.025 -8.274 1304 HD11 ILE 72 1HD1 ILE 72 -5.322 -0.201 -9.094 1305 HD12 ILE 72 2HD1 ILE 72 -5.576 -1.395 -10.366 1306 HD13 ILE 72 3HD1 ILE 72 -3.941 -1.034 -9.805 1307 H MET 73 H MET 73 -4.970 -1.621 -4.184 1308 HA MET 73 HA MET 73 -2.329 -1.239 -3.266 1309 HB2 MET 73 2HB MET 73 -4.329 0.310 -2.929 1310 HB3 MET 73 1HB MET 73 -4.828 -0.768 -1.638 1311 HG2 MET 73 2HG MET 73 -2.215 0.717 -1.746 1312 HG3 MET 73 1HG MET 73 -3.620 1.256 -0.850 1313 HE1 MET 73 1HE MET 73 -0.682 0.964 0.370 1314 HE2 MET 73 2HE MET 73 -1.085 0.264 1.938 1315 HE3 MET 73 3HE MET 73 -2.107 1.521 1.234 1316 H GLU 74 H GLU 74 -4.986 -3.349 -2.073 1317 HA GLU 74 HA GLU 74 -3.450 -4.394 0.050 1318 HB2 GLU 74 2HB GLU 74 -5.723 -5.732 -1.429 1319 HB3 GLU 74 1HB GLU 74 -4.992 -6.354 0.037 1320 HG2 GLU 74 2HG GLU 74 -5.641 -4.196 1.133 1321 HG3 GLU 74 1HG GLU 74 -6.598 -3.850 -0.311 1322 H GLU 75 H GLU 75 -3.713 -5.275 -3.309 1323 HA GLU 75 HA GLU 75 -2.286 -7.691 -3.211 1324 HB2 GLU 75 2HB GLU 75 -3.618 -6.700 -5.162 1325 HB3 GLU 75 1HB GLU 75 -2.218 -5.686 -5.467 1326 HG2 GLU 75 2HG GLU 75 -2.139 -7.561 -6.940 1327 HG3 GLU 75 1HG GLU 75 -0.856 -7.737 -5.744 1328 H LEU 76 H LEU 76 -1.292 -4.322 -3.680 1329 HA LEU 76 HA LEU 76 1.463 -4.663 -4.021 1330 HB2 LEU 76 2HB LEU 76 0.069 -2.383 -2.625 1331 HB3 LEU 76 1HB LEU 76 1.711 -2.359 -3.225 1332 HG LEU 76 HG LEU 76 -0.803 -2.495 -4.882 1333 HD11 LEU 76 1HD1 LEU 76 -0.143 -0.264 -5.603 1334 HD12 LEU 76 2HD1 LEU 76 1.222 -0.308 -4.488 1335 HD13 LEU 76 3HD1 LEU 76 -0.430 -0.329 -3.864 1336 HD21 LEU 76 1HD2 LEU 76 1.010 -3.717 -5.955 1337 HD22 LEU 76 2HD2 LEU 76 2.080 -2.334 -5.734 1338 HD23 LEU 76 3HD2 LEU 76 0.681 -2.202 -6.795 1339 H THR 77 H THR 77 -0.410 -4.016 -0.993 1340 HA THR 77 HA THR 77 1.817 -3.975 0.654 1341 HB THR 77 HB THR 77 -1.042 -4.679 1.363 1342 HG1 THR 77 1HG THR 77 -1.229 -2.648 0.539 1343 HG21 THR 77 1HG2 THR 77 -0.474 -3.764 3.558 1344 HG22 THR 77 2HG2 THR 77 1.174 -3.445 3.017 1345 HG23 THR 77 3HG2 THR 77 0.604 -5.110 3.173 1346 H LYS 78 H LYS 78 -0.207 -6.680 -0.409 1347 HA LYS 78 HA LYS 78 0.886 -8.535 1.447 1348 HB2 LYS 78 2HB LYS 78 -0.530 -9.055 -1.152 1349 HB3 LYS 78 1HB LYS 78 -0.118 -10.306 0.022 1350 HG2 LYS 78 2HG LYS 78 -1.450 -9.191 1.654 1351 HG3 LYS 78 1HG LYS 78 -1.911 -7.952 0.509 1352 HD2 LYS 78 2HD LYS 78 -2.626 -10.906 0.460 1353 HD3 LYS 78 1HD LYS 78 -3.724 -9.553 0.706 1354 HE2 LYS 78 2HE LYS 78 -4.140 -10.167 -1.502 1355 HE3 LYS 78 1HE LYS 78 -2.994 -8.831 -1.635 1356 HZ1 LYS 78 1HZ LYS 78 -2.381 -11.730 -1.905 1357 HZ2 LYS 78 2HZ LYS 78 -1.189 -10.519 -1.959 1358 HZ3 LYS 78 3HZ LYS 78 -2.335 -10.550 -3.140 1359 H TYR 79 H TYR 79 1.518 -7.877 -1.944 1360 HA TYR 79 HA TYR 79 3.458 -9.899 -2.256 1361 HB2 TYR 79 2HB TYR 79 2.254 -8.893 -4.131 1362 HB3 TYR 79 1HB TYR 79 3.047 -7.357 -3.821 1363 HD1 TYR 79 1HD TYR 79 3.590 -10.826 -4.895 1364 HD2 TYR 79 2HD TYR 79 5.204 -6.923 -4.674 1365 HE1 TYR 79 1HE TYR 79 5.386 -11.499 -6.429 1366 HE2 TYR 79 2HE TYR 79 7.010 -7.561 -6.204 1367 HH TYR 79 HH TYR 79 6.936 -10.428 -7.994 1368 H TYR 80 H TYR 80 3.600 -6.590 -1.227 1369 HA TYR 80 HA TYR 80 6.325 -6.052 -1.283 1370 HB2 TYR 80 2HB TYR 80 4.481 -4.453 -0.798 1371 HB3 TYR 80 1HB TYR 80 4.248 -5.228 0.755 1372 HD1 TYR 80 1HD TYR 80 6.609 -3.273 -1.266 1373 HD2 TYR 80 2HD TYR 80 5.525 -4.544 2.628 1374 HE1 TYR 80 1HE TYR 80 8.184 -1.645 -0.313 1375 HE2 TYR 80 2HE TYR 80 7.087 -2.932 3.604 1376 HH TYR 80 HH TYR 80 8.519 -0.436 1.776 1377 H LEU 81 H LEU 81 4.339 -7.327 1.362 1378 HA LEU 81 HA LEU 81 6.584 -7.949 2.998 1379 HB2 LEU 81 2HB LEU 81 3.696 -8.725 3.252 1380 HB3 LEU 81 1HB LEU 81 4.916 -9.013 4.480 1381 HG LEU 81 HG LEU 81 4.014 -6.304 3.494 1382 HD11 LEU 81 1HD1 LEU 81 3.501 -7.728 6.091 1383 HD12 LEU 81 2HD1 LEU 81 2.315 -7.394 4.827 1384 HD13 LEU 81 3HD1 LEU 81 3.050 -6.064 5.725 1385 HD21 LEU 81 1HD2 LEU 81 5.369 -5.430 5.351 1386 HD22 LEU 81 2HD2 LEU 81 6.354 -6.261 4.154 1387 HD23 LEU 81 3HD2 LEU 81 5.962 -7.057 5.677 1388 H ALA 82 H ALA 82 4.854 -9.695 0.555 1389 HA ALA 82 HA ALA 82 5.376 -12.302 1.405 1390 HB1 ALA 82 1HB ALA 82 5.093 -11.335 -1.434 1391 HB2 ALA 82 2HB ALA 82 3.761 -11.752 -0.349 1392 HB3 ALA 82 3HB ALA 82 4.910 -12.994 -0.856 1393 H ASN 83 H ASN 83 7.277 -10.082 -0.468 1394 HA ASN 83 HA ASN 83 9.293 -12.073 -0.997 1395 HB2 ASN 83 2HB ASN 83 9.195 -9.127 -1.611 1396 HB3 ASN 83 1HB ASN 83 10.589 -10.131 -1.988 1397 HD21 ASN 83 1HD2 ASN 83 7.222 -9.460 -2.773 1398 HD22 ASN 83 2HD2 ASN 83 7.251 -10.357 -4.249 1399 H HIS 84 H HIS 84 8.533 -10.396 1.682 1400 HA HIS 84 HA HIS 84 11.303 -10.102 2.595 1401 HB2 HIS 84 2HB HIS 84 9.408 -8.411 3.162 1402 HB3 HIS 84 1HB HIS 84 8.781 -9.645 4.241 1403 HD1 HIS 84 1HD HIS 84 11.936 -10.337 5.143 1404 HD2 HIS 84 2HD HIS 84 9.876 -6.739 5.403 1405 HE1 HIS 84 1HE HIS 84 13.156 -8.992 6.848 1406 HE2 HIS 84 2HE HIS 84 12.166 -6.739 6.661 1407 H GLY 85 H GLY 85 9.150 -12.501 2.142 1408 HA2 GLY 85 2HA GLY 85 9.722 -14.738 2.734 1409 HA3 GLY 85 1HA GLY 85 10.358 -14.134 4.256 1410 H ILE 86 H ILE 86 7.424 -12.620 3.588 1411 HA ILE 86 HA ILE 86 6.104 -14.441 5.459 1412 HB ILE 86 HB ILE 86 5.366 -11.605 4.665 1413 HG12 ILE 86 2HG1 ILE 86 6.526 -12.719 7.226 1414 HG13 ILE 86 1HG1 ILE 86 7.360 -11.695 6.062 1415 HG21 ILE 86 1HG2 ILE 86 3.685 -11.736 6.458 1416 HG22 ILE 86 2HG2 ILE 86 4.104 -13.430 6.720 1417 HG23 ILE 86 3HG2 ILE 86 3.380 -12.930 5.195 1418 HD11 ILE 86 1HD1 ILE 86 6.612 -10.486 8.059 1419 HD12 ILE 86 2HD1 ILE 86 4.950 -10.921 7.656 1420 HD13 ILE 86 3HD1 ILE 86 5.857 -9.863 6.574 1421 H ASP 87 H ASP 87 4.479 -15.655 4.782 1422 HA ASP 87 HA ASP 87 3.659 -15.337 1.998 1423 HB2 ASP 87 2HB ASP 87 4.269 -17.600 2.690 1424 HB3 ASP 87 1HB ASP 87 3.044 -17.559 3.954 1425 H ILE 88 H ILE 88 1.928 -14.225 1.533 1426 HA ILE 88 HA ILE 88 -0.241 -14.123 3.506 1427 HB ILE 88 HB ILE 88 0.399 -11.877 1.550 1428 HG12 ILE 88 2HG1 ILE 88 1.067 -11.954 4.499 1429 HG13 ILE 88 1HG1 ILE 88 2.252 -12.151 3.211 1430 HG21 ILE 88 1HG2 ILE 88 -1.341 -12.027 4.013 1431 HG22 ILE 88 2HG2 ILE 88 -1.904 -11.985 2.342 1432 HG23 ILE 88 3HG2 ILE 88 -1.081 -10.588 3.037 1433 HD11 ILE 88 1HD1 ILE 88 2.112 -9.823 4.158 1434 HD12 ILE 88 2HD1 ILE 88 0.474 -9.769 3.479 1435 HD13 ILE 88 3HD1 ILE 88 1.834 -9.960 2.404 1436 H LYS 89 H LYS 89 -2.303 -14.129 2.595 1437 HA LYS 89 HA LYS 89 -2.515 -15.492 0.066 1438 HB2 LYS 89 2HB LYS 89 -4.627 -14.561 2.028 1439 HB3 LYS 89 1HB LYS 89 -4.878 -15.655 0.671 1440 HG2 LYS 89 2HG LYS 89 -3.497 -17.331 1.682 1441 HG3 LYS 89 1HG LYS 89 -3.044 -16.234 2.986 1442 HD2 LYS 89 2HD LYS 89 -5.405 -16.173 3.711 1443 HD3 LYS 89 1HD LYS 89 -5.813 -17.325 2.435 1444 HE2 LYS 89 2HE LYS 89 -4.337 -18.982 3.430 1445 HE3 LYS 89 1HE LYS 89 -3.830 -17.815 4.647 1446 HZ1 LYS 89 1HZ LYS 89 -6.590 -18.880 4.346 1447 HZ2 LYS 89 2HZ LYS 89 -6.062 -17.792 5.523 1448 HZ3 LYS 89 3HZ LYS 89 -5.460 -19.355 5.502 Start of MODEL 16 1 H1 MET 1 1HT MET 1 44.794 14.842 2.524 2 H2 MET 1 2HT MET 1 45.308 14.592 0.955 3 H3 MET 1 3HT MET 1 44.253 13.491 1.701 4 HA MET 1 HA MET 1 43.608 16.306 1.104 5 HB2 MET 1 2HB MET 1 42.507 13.756 -0.105 6 HB3 MET 1 1HB MET 1 41.961 15.380 -0.473 7 HG2 MET 1 2HG MET 1 44.162 15.880 -1.440 8 HG3 MET 1 1HG MET 1 44.672 14.233 -1.085 9 HE1 MET 1 1HE MET 1 41.958 12.594 -1.730 10 HE2 MET 1 2HE MET 1 43.569 12.063 -2.196 11 HE3 MET 1 3HE MET 1 42.284 12.131 -3.398 12 H GLY 2 H GLY 2 41.314 16.743 1.569 13 HA2 GLY 2 2HA GLY 2 39.261 16.008 2.590 14 HA3 GLY 2 1HA GLY 2 40.220 14.902 3.572 15 H PHE 3 H PHE 3 38.640 16.249 5.033 16 HA PHE 3 HA PHE 3 38.434 17.569 6.778 17 HB2 PHE 3 2HB PHE 3 41.430 17.864 6.564 18 HB3 PHE 3 1HB PHE 3 40.477 18.580 7.855 19 HD1 PHE 3 1HD PHE 3 39.369 17.165 9.502 20 HD2 PHE 3 2HD PHE 3 41.905 15.520 6.512 21 HE1 PHE 3 1HE PHE 3 39.526 15.085 10.791 22 HE2 PHE 3 2HE PHE 3 42.064 13.429 7.799 23 HZ PHE 3 HZ PHE 3 40.873 13.209 9.941 24 H THR 4 H THR 4 37.109 18.921 5.774 25 HA THR 4 HA THR 4 38.150 21.600 5.675 26 HB THR 4 HB THR 4 38.155 20.881 3.299 27 HG1 THR 4 1HG THR 4 37.373 23.044 4.057 28 HG21 THR 4 1HG2 THR 4 35.194 20.395 3.680 29 HG22 THR 4 2HG2 THR 4 36.419 19.166 3.366 30 HG23 THR 4 3HG2 THR 4 36.037 20.365 2.129 31 H ASP 5 H ASP 5 36.602 23.091 6.401 32 HA ASP 5 HA ASP 5 34.431 21.791 7.761 33 HB2 ASP 5 2HB ASP 5 35.776 23.356 9.075 34 HB3 ASP 5 1HB ASP 5 35.371 24.656 7.959 35 H GLU 6 H GLU 6 33.140 21.271 6.101 36 HA GLU 6 HA GLU 6 31.733 23.528 4.903 37 HB2 GLU 6 2HB GLU 6 30.646 21.856 3.397 38 HB3 GLU 6 1HB GLU 6 32.386 21.918 3.218 39 HG2 GLU 6 2HG GLU 6 32.625 19.865 4.465 40 HG3 GLU 6 1HG GLU 6 30.892 19.836 4.797 41 H THR 7 H THR 7 29.742 24.034 5.493 42 HA THR 7 HA THR 7 28.826 22.746 7.851 43 HB THR 7 HB THR 7 27.044 24.528 7.801 44 HG1 THR 7 1HG THR 7 27.603 24.737 5.347 45 HG21 THR 7 1HG2 THR 7 28.596 26.350 8.378 46 HG22 THR 7 2HG2 THR 7 29.919 25.457 7.630 47 HG23 THR 7 3HG2 THR 7 29.128 24.817 9.067 48 H VAL 8 H VAL 8 28.202 20.711 7.149 49 HA VAL 8 HA VAL 8 26.001 20.584 5.330 50 HB VAL 8 HB VAL 8 25.893 18.153 5.767 51 HG11 VAL 8 1HG1 VAL 8 27.461 18.899 4.102 52 HG12 VAL 8 2HG1 VAL 8 28.111 17.499 4.959 53 HG13 VAL 8 3HG1 VAL 8 28.705 19.115 5.334 54 HG21 VAL 8 1HG2 VAL 8 27.462 17.036 7.264 55 HG22 VAL 8 2HG2 VAL 8 26.399 18.176 8.110 56 HG23 VAL 8 3HG2 VAL 8 28.081 18.620 7.795 57 H ARG 9 H ARG 9 24.182 21.265 5.882 58 HA ARG 9 HA ARG 9 23.461 21.426 8.708 59 HB2 ARG 9 2HB ARG 9 22.497 22.888 6.264 60 HB3 ARG 9 1HB ARG 9 21.913 23.165 7.901 61 HG2 ARG 9 2HG ARG 9 23.999 23.979 8.633 62 HG3 ARG 9 1HG ARG 9 24.811 23.369 7.197 63 HD2 ARG 9 2HD ARG 9 22.718 25.523 7.152 64 HD3 ARG 9 1HD ARG 9 24.452 25.830 7.235 65 HE ARG 9 HE ARG 9 23.558 24.145 5.055 66 HH11 ARG 9 1HH1 ARG 9 24.407 27.402 6.117 67 HH12 ARG 9 2HH1 ARG 9 24.842 27.969 4.576 68 HH21 ARG 9 1HH2 ARG 9 24.122 24.938 2.872 69 HH22 ARG 9 2HH2 ARG 9 24.654 26.552 2.717 70 H PHE 10 H PHE 10 22.991 19.289 6.354 71 HA PHE 10 HA PHE 10 20.208 18.864 7.124 72 HB2 PHE 10 2HB PHE 10 21.346 18.525 4.356 73 HB3 PHE 10 1HB PHE 10 19.725 18.054 4.854 74 HD1 PHE 10 1HD PHE 10 18.007 19.661 5.076 75 HD2 PHE 10 2HD PHE 10 21.994 20.823 4.305 76 HE1 PHE 10 1HE PHE 10 17.222 21.931 4.555 77 HE2 PHE 10 2HE PHE 10 21.232 23.121 3.767 78 HZ PHE 10 HZ PHE 10 18.846 23.661 3.896 79 H ASP 11 H ASP 11 19.477 16.787 6.572 80 HA ASP 11 HA ASP 11 21.109 14.544 6.083 81 HB2 ASP 11 2HB ASP 11 21.677 14.822 8.499 82 HB3 ASP 11 1HB ASP 11 19.958 14.829 8.891 83 H PHE 12 H PHE 12 18.204 16.018 7.300 84 HA PHE 12 HA PHE 12 16.422 13.994 6.504 85 HB2 PHE 12 2HB PHE 12 15.785 15.619 8.191 86 HB3 PHE 12 1HB PHE 12 16.000 16.939 7.053 87 HD1 PHE 12 1HD PHE 12 13.907 13.997 7.857 88 HD2 PHE 12 2HD PHE 12 14.239 17.610 5.637 89 HE1 PHE 12 1HE PHE 12 11.522 13.861 7.276 90 HE2 PHE 12 2HE PHE 12 11.866 17.477 5.049 91 HZ PHE 12 HZ PHE 12 10.499 15.609 5.865 92 H ASP 13 H ASP 13 16.842 13.407 4.497 93 HA ASP 13 HA ASP 13 15.430 14.582 2.413 94 HB2 ASP 13 2HB ASP 13 17.296 16.222 2.276 95 HB3 ASP 13 1HB ASP 13 18.428 14.882 2.084 96 H ASP 14 H ASP 14 18.343 12.734 3.108 97 HA ASP 14 HA ASP 14 17.833 10.805 1.088 98 HB2 ASP 14 2HB ASP 14 20.115 11.204 1.963 99 HB3 ASP 14 1HB ASP 14 19.591 10.634 3.542 100 H ASN 15 H ASN 15 15.889 9.945 1.289 101 HA ASN 15 HA ASN 15 14.985 8.865 3.813 102 HB2 ASN 15 2HB ASN 15 13.405 9.922 2.147 103 HB3 ASN 15 1HB ASN 15 13.782 8.627 1.025 104 HD21 ASN 15 1HD2 ASN 15 11.219 9.443 2.197 105 HD22 ASN 15 2HD2 ASN 15 10.624 8.044 3.002 106 H ARG 16 H ARG 16 15.179 6.761 4.311 107 HA ARG 16 HA ARG 16 16.915 5.276 2.552 108 HB2 ARG 16 2HB ARG 16 17.073 3.523 4.373 109 HB3 ARG 16 1HB ARG 16 17.736 5.096 4.750 110 HG2 ARG 16 2HG ARG 16 14.995 4.257 5.660 111 HG3 ARG 16 1HG ARG 16 16.442 3.847 6.571 112 HD2 ARG 16 2HD ARG 16 15.464 6.640 5.906 113 HD3 ARG 16 1HD ARG 16 15.456 5.858 7.481 114 HE ARG 16 HE ARG 16 18.062 5.815 6.564 115 HH11 ARG 16 1HH1 ARG 16 15.700 8.264 7.589 116 HH12 ARG 16 2HH1 ARG 16 16.905 9.391 8.022 117 HH21 ARG 16 1HH2 ARG 16 19.665 7.361 7.204 118 HH22 ARG 16 2HH2 ARG 16 19.169 8.871 7.822 119 H LYS 17 H LYS 17 13.646 5.410 3.212 120 HA LYS 17 HA LYS 17 11.847 4.336 2.566 121 HB2 LYS 17 2HB LYS 17 13.636 3.128 0.445 122 HB3 LYS 17 1HB LYS 17 11.914 2.863 0.502 123 HG2 LYS 17 2HG LYS 17 12.223 4.532 -1.125 124 HG3 LYS 17 1HG LYS 17 11.657 5.386 0.299 125 HD2 LYS 17 2HD LYS 17 13.436 6.642 -0.759 126 HD3 LYS 17 1HD LYS 17 14.006 6.027 0.793 127 HE2 LYS 17 2HE LYS 17 15.188 4.214 -0.331 128 HE3 LYS 17 1HE LYS 17 14.556 4.743 -1.887 129 HZ1 LYS 17 1HZ LYS 17 16.347 6.335 -0.136 130 HZ2 LYS 17 2HZ LYS 17 15.848 6.788 -1.673 131 HZ3 LYS 17 3HZ LYS 17 16.869 5.472 -1.468 132 H LYS 18 H LYS 18 14.432 1.975 2.636 133 HA LYS 18 HA LYS 18 12.748 -0.232 3.111 134 HB2 LYS 18 2HB LYS 18 14.820 -1.487 3.473 135 HB3 LYS 18 1HB LYS 18 14.860 -0.527 2.010 136 HG2 LYS 18 2HG LYS 18 16.098 1.211 3.470 137 HG3 LYS 18 1HG LYS 18 16.369 -0.149 4.562 138 HD2 LYS 18 2HD LYS 18 17.189 0.059 1.666 139 HD3 LYS 18 1HD LYS 18 18.257 0.060 3.064 140 HE2 LYS 18 2HE LYS 18 17.619 -2.260 3.546 141 HE3 LYS 18 1HE LYS 18 16.506 -2.240 2.182 142 HZ1 LYS 18 1HZ LYS 18 18.566 -3.293 1.545 143 HZ2 LYS 18 2HZ LYS 18 19.461 -1.950 2.016 144 HZ3 LYS 18 3HZ LYS 18 18.409 -1.857 0.707 145 H ALA 19 H ALA 19 13.516 2.166 5.195 146 HA ALA 19 HA ALA 19 13.524 0.709 7.676 147 HB1 ALA 19 1HB ALA 19 14.314 3.034 7.553 148 HB2 ALA 19 2HB ALA 19 12.935 2.891 8.665 149 HB3 ALA 19 3HB ALA 19 12.698 3.517 7.028 150 H ILE 20 H ILE 20 11.202 2.103 5.496 151 HA ILE 20 HA ILE 20 8.890 1.775 7.042 152 HB ILE 20 HB ILE 20 9.195 1.888 4.013 153 HG12 ILE 20 2HG1 ILE 20 8.565 4.090 5.998 154 HG13 ILE 20 1HG1 ILE 20 10.118 3.850 5.207 155 HG21 ILE 20 1HG2 ILE 20 6.746 2.344 5.725 156 HG22 ILE 20 2HG2 ILE 20 7.024 0.967 4.663 157 HG23 ILE 20 3HG2 ILE 20 6.840 2.583 3.980 158 HD11 ILE 20 1HD1 ILE 20 8.853 5.634 4.157 159 HD12 ILE 20 2HD1 ILE 20 7.519 4.523 3.837 160 HD13 ILE 20 3HD1 ILE 20 9.075 4.289 3.042 161 H SER 21 H SER 21 10.781 -0.196 4.927 162 HA SER 21 HA SER 21 9.031 -2.333 4.407 163 HB2 SER 21 2HB SER 21 12.036 -2.470 4.741 164 HB3 SER 21 1HB SER 21 11.025 -3.593 3.833 165 HG SER 21 HG SER 21 10.395 -1.569 2.629 166 H GLU 22 H GLU 22 11.305 -1.694 7.036 167 HA GLU 22 HA GLU 22 10.893 -4.112 8.463 168 HB2 GLU 22 2HB GLU 22 11.792 -1.410 9.491 169 HB3 GLU 22 1HB GLU 22 12.036 -2.954 10.289 170 HG2 GLU 22 2HG GLU 22 13.525 -3.654 8.480 171 HG3 GLU 22 1HG GLU 22 13.247 -2.116 7.665 172 H THR 23 H THR 23 9.534 -0.887 8.528 173 HA THR 23 HA THR 23 7.951 -0.979 10.803 174 HB THR 23 HB THR 23 7.538 0.476 8.195 175 HG1 THR 23 1HG THR 23 9.358 0.732 10.054 176 HG21 THR 23 1HG2 THR 23 5.451 0.446 9.459 177 HG22 THR 23 2HG2 THR 23 6.160 2.059 9.487 178 HG23 THR 23 3HG2 THR 23 6.292 1.013 10.900 179 H LEU 24 H LEU 24 6.981 -1.677 7.417 180 HA LEU 24 HA LEU 24 4.324 -2.372 8.142 181 HB2 LEU 24 2HB LEU 24 5.824 -3.010 5.604 182 HB3 LEU 24 1HB LEU 24 4.105 -3.250 5.847 183 HG LEU 24 HG LEU 24 5.542 -0.597 5.809 184 HD11 LEU 24 1HD1 LEU 24 3.610 -1.864 3.882 185 HD12 LEU 24 2HD1 LEU 24 5.335 -1.605 3.616 186 HD13 LEU 24 3HD1 LEU 24 4.245 -0.225 3.772 187 HD21 LEU 24 1HD2 LEU 24 3.674 -0.532 7.379 188 HD22 LEU 24 2HD2 LEU 24 2.601 -1.213 6.155 189 HD23 LEU 24 3HD2 LEU 24 3.298 0.391 5.929 190 H GLU 25 H GLU 25 7.241 -4.188 7.855 191 HA GLU 25 HA GLU 25 6.210 -6.772 7.790 192 HB2 GLU 25 2HB GLU 25 8.566 -6.226 7.431 193 HB3 GLU 25 1HB GLU 25 8.714 -5.707 9.101 194 HG2 GLU 25 2HG GLU 25 8.247 -8.001 9.831 195 HG3 GLU 25 1HG GLU 25 8.163 -8.499 8.141 196 H THR 26 H THR 26 7.086 -4.622 10.504 197 HA THR 26 HA THR 26 6.332 -6.356 12.588 198 HB THR 26 HB THR 26 6.473 -3.339 12.584 199 HG1 THR 26 1HG THR 26 8.627 -4.176 13.636 200 HG21 THR 26 1HG2 THR 26 6.916 -3.593 14.980 201 HG22 THR 26 2HG2 THR 26 6.780 -5.349 14.820 202 HG23 THR 26 3HG2 THR 26 5.372 -4.328 14.538 203 H VAL 27 H VAL 27 4.648 -3.816 10.791 204 HA VAL 27 HA VAL 27 2.307 -3.676 12.336 205 HB VAL 27 HB VAL 27 2.617 -3.195 9.343 206 HG11 VAL 27 1HG1 VAL 27 0.289 -3.574 9.947 207 HG12 VAL 27 2HG1 VAL 27 0.565 -1.871 9.551 208 HG13 VAL 27 3HG1 VAL 27 0.435 -2.381 11.238 209 HG21 VAL 27 1HG2 VAL 27 2.603 -1.247 11.652 210 HG22 VAL 27 2HG2 VAL 27 2.726 -0.837 9.946 211 HG23 VAL 27 3HG2 VAL 27 4.024 -1.738 10.722 212 H TYR 28 H TYR 28 3.186 -5.789 9.699 213 HA TYR 28 HA TYR 28 0.767 -7.156 9.355 214 HB2 TYR 28 2HB TYR 28 2.709 -7.420 7.833 215 HB3 TYR 28 1HB TYR 28 3.603 -8.227 9.108 216 HD1 TYR 28 1HD TYR 28 2.880 -10.506 9.865 217 HD2 TYR 28 2HD TYR 28 1.142 -8.628 6.464 218 HE1 TYR 28 1HE TYR 28 1.988 -12.666 9.129 219 HE2 TYR 28 2HE TYR 28 0.243 -10.804 5.723 220 HH TYR 28 HH TYR 28 0.911 -13.267 6.130 221 H ARG 29 H ARG 29 3.461 -7.753 11.507 222 HA ARG 29 HA ARG 29 2.497 -10.131 12.719 223 HB2 ARG 29 2HB ARG 29 4.572 -8.146 13.630 224 HB3 ARG 29 1HB ARG 29 4.318 -9.741 14.339 225 HG2 ARG 29 2HG ARG 29 4.996 -9.279 11.448 226 HG3 ARG 29 1HG ARG 29 6.183 -9.639 12.702 227 HD2 ARG 29 2HD ARG 29 3.818 -11.410 12.077 228 HD3 ARG 29 1HD ARG 29 5.425 -11.614 11.390 229 HE ARG 29 HE ARG 29 6.183 -11.705 13.763 230 HH11 ARG 29 1HH1 ARG 29 2.839 -12.791 13.008 231 HH12 ARG 29 2HH1 ARG 29 2.888 -14.048 14.103 232 HH21 ARG 29 1HH2 ARG 29 6.170 -13.408 15.303 233 HH22 ARG 29 2HH2 ARG 29 4.815 -14.413 15.466 234 H ALA 30 H ALA 30 2.098 -6.777 13.475 235 HA ALA 30 HA ALA 30 1.027 -7.229 16.074 236 HB1 ALA 30 1HB ALA 30 1.955 -5.052 15.418 237 HB2 ALA 30 2HB ALA 30 0.293 -4.907 15.990 238 HB3 ALA 30 3HB ALA 30 0.641 -4.847 14.260 239 H LEU 31 H LEU 31 -0.299 -7.026 12.873 240 HA LEU 31 HA LEU 31 -3.002 -6.966 13.741 241 HB2 LEU 31 2HB LEU 31 -1.810 -7.424 11.041 242 HB3 LEU 31 1HB LEU 31 -3.528 -7.303 11.344 243 HG LEU 31 HG LEU 31 -1.642 -5.158 12.157 244 HD11 LEU 31 1HD1 LEU 31 -3.287 -5.318 9.625 245 HD12 LEU 31 2HD1 LEU 31 -1.517 -5.376 9.706 246 HD13 LEU 31 3HD1 LEU 31 -2.380 -3.906 10.154 247 HD21 LEU 31 1HD2 LEU 31 -3.692 -3.788 12.119 248 HD22 LEU 31 2HD2 LEU 31 -3.731 -5.102 13.295 249 HD23 LEU 31 3HD2 LEU 31 -4.602 -5.253 11.770 250 H GLU 32 H GLU 32 -1.022 -9.598 12.309 251 HA GLU 32 HA GLU 32 -3.346 -11.173 12.556 252 HB2 GLU 32 2HB GLU 32 -1.895 -13.117 11.727 253 HB3 GLU 32 1HB GLU 32 -2.376 -11.844 10.611 254 HG2 GLU 32 2HG GLU 32 -0.130 -12.385 10.148 255 HG3 GLU 32 1HG GLU 32 -0.099 -10.854 11.002 256 H GLU 33 H GLU 33 -0.509 -11.085 14.477 257 HA GLU 33 HA GLU 33 -1.267 -13.228 16.142 258 HB2 GLU 33 2HB GLU 33 0.294 -10.732 16.814 259 HB3 GLU 33 1HB GLU 33 0.043 -12.039 17.959 260 HG2 GLU 33 2HG GLU 33 1.417 -12.299 15.295 261 HG3 GLU 33 1HG GLU 33 2.223 -12.171 16.857 262 H LYS 34 H LYS 34 -2.584 -10.069 15.872 263 HA LYS 34 HA LYS 34 -4.150 -10.371 18.314 264 HB2 LYS 34 2HB LYS 34 -3.837 -8.117 16.367 265 HB3 LYS 34 1HB LYS 34 -5.092 -8.091 17.591 266 HG2 LYS 34 2HG LYS 34 -2.141 -8.354 18.173 267 HG3 LYS 34 1HG LYS 34 -3.019 -6.827 18.182 268 HD2 LYS 34 2HD LYS 34 -3.679 -9.202 19.936 269 HD3 LYS 34 1HD LYS 34 -2.728 -7.804 20.442 270 HE2 LYS 34 2HE LYS 34 -4.605 -6.341 20.044 271 HE3 LYS 34 1HE LYS 34 -5.589 -7.676 19.457 272 HZ1 LYS 34 1HZ LYS 34 -5.484 -8.656 21.672 273 HZ2 LYS 34 2HZ LYS 34 -6.118 -7.114 21.746 274 HZ3 LYS 34 3HZ LYS 34 -4.529 -7.387 22.224 275 H GLY 35 H GLY 35 -4.455 -11.255 15.117 276 HA2 GLY 35 2HA GLY 35 -6.238 -12.537 14.305 277 HA3 GLY 35 1HA GLY 35 -7.239 -11.923 15.606 278 H TYR 36 H TYR 36 -5.470 -9.612 13.701 279 HA TYR 36 HA TYR 36 -7.998 -8.779 12.473 280 HB2 TYR 36 2HB TYR 36 -5.336 -7.335 12.657 281 HB3 TYR 36 1HB TYR 36 -6.787 -6.678 11.921 282 HD1 TYR 36 1HD TYR 36 -4.825 -6.757 14.800 283 HD2 TYR 36 2HD TYR 36 -8.881 -6.600 13.552 284 HE1 TYR 36 1HE TYR 36 -5.455 -5.801 16.987 285 HE2 TYR 36 2HE TYR 36 -9.525 -5.628 15.721 286 HH TYR 36 HH TYR 36 -8.694 -5.569 17.991 287 H ASN 37 H ASN 37 -7.450 -7.733 10.197 288 HA ASN 37 HA ASN 37 -6.056 -9.809 8.667 289 HB2 ASN 37 2HB ASN 37 -7.925 -7.618 7.746 290 HB3 ASN 37 1HB ASN 37 -7.193 -8.807 6.683 291 HD21 ASN 37 1HD2 ASN 37 -7.640 -10.991 8.645 292 HD22 ASN 37 2HD2 ASN 37 -9.332 -11.307 8.597 293 HA PRO 38 HA PRO 38 -2.533 -6.905 8.896 294 HB2 PRO 38 2HB PRO 38 -1.810 -8.893 6.807 295 HB3 PRO 38 1HB PRO 38 -0.805 -8.169 8.067 296 HG2 PRO 38 2HG PRO 38 -1.802 -10.608 8.361 297 HG3 PRO 38 1HG PRO 38 -1.711 -9.487 9.728 298 HD2 PRO 38 2HD PRO 38 -4.089 -10.424 8.244 299 HD3 PRO 38 1HD PRO 38 -3.909 -9.759 9.892 300 H ILE 39 H ILE 39 -3.894 -8.121 5.852 301 HA ILE 39 HA ILE 39 -2.665 -5.977 4.399 302 HB ILE 39 HB ILE 39 -4.724 -7.983 3.462 303 HG12 ILE 39 2HG1 ILE 39 -2.724 -9.095 4.245 304 HG13 ILE 39 1HG1 ILE 39 -2.781 -9.166 2.492 305 HG21 ILE 39 1HG2 ILE 39 -3.951 -7.409 1.197 306 HG22 ILE 39 2HG2 ILE 39 -2.896 -6.170 1.876 307 HG23 ILE 39 3HG2 ILE 39 -4.648 -6.012 2.021 308 HD11 ILE 39 1HD1 ILE 39 -1.131 -7.338 2.386 309 HD12 ILE 39 2HD1 ILE 39 -0.523 -8.732 3.284 310 HD13 ILE 39 3HD1 ILE 39 -1.073 -7.303 4.150 311 H ASN 40 H ASN 40 -5.945 -6.778 5.357 312 HA ASN 40 HA ASN 40 -7.165 -4.607 4.025 313 HB2 ASN 40 2HB ASN 40 -8.207 -6.215 6.365 314 HB3 ASN 40 1HB ASN 40 -9.155 -5.044 5.467 315 HD21 ASN 40 1HD2 ASN 40 -9.573 -7.918 5.812 316 HD22 ASN 40 2HD2 ASN 40 -9.599 -8.582 4.227 317 H GLN 41 H GLN 41 -5.819 -4.881 7.249 318 HA GLN 41 HA GLN 41 -6.858 -2.348 8.038 319 HB2 GLN 41 2HB GLN 41 -4.690 -4.017 9.287 320 HB3 GLN 41 1HB GLN 41 -5.338 -2.548 9.998 321 HG2 GLN 41 2HG GLN 41 -6.930 -5.034 9.399 322 HG3 GLN 41 1HG GLN 41 -6.326 -4.572 10.985 323 HE21 GLN 41 1HE2 GLN 41 -6.906 -1.756 10.647 324 HE22 GLN 41 2HE2 GLN 41 -8.620 -1.588 10.725 325 H ILE 42 H ILE 42 -3.798 -3.384 6.597 326 HA ILE 42 HA ILE 42 -2.582 -0.845 6.950 327 HB ILE 42 HB ILE 42 -1.853 -3.058 4.994 328 HG12 ILE 42 2HG1 ILE 42 -0.586 -2.204 7.613 329 HG13 ILE 42 1HG1 ILE 42 -1.585 -3.635 7.386 330 HG21 ILE 42 1HG2 ILE 42 -0.302 -0.546 5.693 331 HG22 ILE 42 2HG2 ILE 42 -1.068 -0.883 4.157 332 HG23 ILE 42 3HG2 ILE 42 0.296 -1.869 4.689 333 HD11 ILE 42 1HD1 ILE 42 0.109 -4.555 5.868 334 HD12 ILE 42 2HD1 ILE 42 0.778 -4.201 7.460 335 HD13 ILE 42 3HD1 ILE 42 1.099 -3.116 6.109 336 H VAL 43 H VAL 43 -4.197 -2.353 4.136 337 HA VAL 43 HA VAL 43 -3.962 -0.066 2.537 338 HB VAL 43 HB VAL 43 -4.584 -2.191 1.470 339 HG11 VAL 43 1HG1 VAL 43 -5.960 -3.132 3.246 340 HG12 VAL 43 2HG1 VAL 43 -6.827 -3.173 1.707 341 HG13 VAL 43 3HG1 VAL 43 -7.228 -1.951 2.920 342 HG21 VAL 43 1HG2 VAL 43 -6.799 -0.161 1.156 343 HG22 VAL 43 2HG2 VAL 43 -6.442 -1.466 0.022 344 HG23 VAL 43 3HG2 VAL 43 -5.262 -0.183 0.290 345 H GLY 44 H GLY 44 -6.360 -0.927 4.946 346 HA2 GLY 44 2HA GLY 44 -8.114 1.234 4.557 347 HA3 GLY 44 1HA GLY 44 -7.885 0.362 6.070 348 H TYR 45 H TYR 45 -5.141 0.936 6.473 349 HA TYR 45 HA TYR 45 -5.327 3.425 7.737 350 HB2 TYR 45 2HB TYR 45 -3.746 1.893 8.672 351 HB3 TYR 45 1HB TYR 45 -2.879 1.758 7.140 352 HD1 TYR 45 1HD TYR 45 -1.065 3.208 6.665 353 HD2 TYR 45 2HD TYR 45 -3.716 4.195 9.836 354 HE1 TYR 45 1HE TYR 45 0.390 5.060 7.283 355 HE2 TYR 45 2HE TYR 45 -2.256 6.060 10.463 356 HH TYR 45 HH TYR 45 0.368 7.051 8.424 357 H LEU 46 H LEU 46 -3.529 2.582 4.783 358 HA LEU 46 HA LEU 46 -2.658 5.268 4.579 359 HB2 LEU 46 2HB LEU 46 -2.509 3.106 2.493 360 HB3 LEU 46 1HB LEU 46 -1.847 4.709 2.269 361 HG LEU 46 HG LEU 46 -0.411 4.208 4.366 362 HD11 LEU 46 1HD1 LEU 46 0.069 1.968 4.893 363 HD12 LEU 46 2HD1 LEU 46 -1.105 1.395 3.711 364 HD13 LEU 46 3HD1 LEU 46 -1.649 2.281 5.133 365 HD21 LEU 46 1HD2 LEU 46 0.544 4.354 2.185 366 HD22 LEU 46 2HD2 LEU 46 0.043 2.702 1.814 367 HD23 LEU 46 3HD2 LEU 46 1.249 3.000 3.064 368 H LEU 47 H LEU 47 -5.394 3.637 3.161 369 HA LEU 47 HA LEU 47 -5.950 5.865 1.501 370 HB2 LEU 47 2HB LEU 47 -7.486 3.376 2.143 371 HB3 LEU 47 1HB LEU 47 -8.223 4.680 1.239 372 HG LEU 47 HG LEU 47 -6.489 4.437 -0.498 373 HD11 LEU 47 1HD1 LEU 47 -5.048 2.484 -0.570 374 HD12 LEU 47 2HD1 LEU 47 -5.541 2.066 1.069 375 HD13 LEU 47 3HD1 LEU 47 -4.657 3.563 0.771 376 HD21 LEU 47 1HD2 LEU 47 -7.997 1.910 0.132 377 HD22 LEU 47 2HD2 LEU 47 -7.279 2.307 -1.428 378 HD23 LEU 47 3HD2 LEU 47 -8.589 3.292 -0.789 379 H SER 48 H SER 48 -7.021 4.956 4.735 380 HA SER 48 HA SER 48 -8.892 7.178 4.672 381 HB2 SER 48 2HB SER 48 -9.605 5.033 5.700 382 HB3 SER 48 1HB SER 48 -8.319 5.181 6.883 383 HG SER 48 HG SER 48 -9.972 7.376 6.720 384 H GLY 49 H GLY 49 -5.630 6.482 5.852 385 HA2 GLY 49 2HA GLY 49 -4.121 7.800 6.852 386 HA3 GLY 49 1HA GLY 49 -5.152 9.170 6.466 387 H ASP 50 H ASP 50 -5.454 6.336 8.652 388 HA ASP 50 HA ASP 50 -5.768 8.206 10.870 389 HB2 ASP 50 2HB ASP 50 -8.039 7.685 9.966 390 HB3 ASP 50 1HB ASP 50 -7.733 5.987 10.298 391 HA PRO 51 HA PRO 51 -2.940 5.209 12.510 392 HB2 PRO 51 2HB PRO 51 -3.025 5.978 15.129 393 HB3 PRO 51 1HB PRO 51 -2.088 6.800 13.883 394 HG2 PRO 51 2HG PRO 51 -4.781 7.503 14.990 395 HG3 PRO 51 1HG PRO 51 -3.425 8.572 14.593 396 HD2 PRO 51 2HD PRO 51 -5.551 8.307 12.965 397 HD3 PRO 51 1HD PRO 51 -3.910 8.550 12.325 398 H ALA 52 H ALA 52 -6.237 5.400 13.737 399 HA ALA 52 HA ALA 52 -6.000 3.344 15.668 400 HB1 ALA 52 1HB ALA 52 -8.494 4.253 14.263 401 HB2 ALA 52 2HB ALA 52 -7.815 4.990 15.712 402 HB3 ALA 52 3HB ALA 52 -8.418 3.333 15.766 403 H TYR 53 H TYR 53 -6.033 3.136 12.316 404 HA TYR 53 HA TYR 53 -7.322 0.660 11.993 405 HB2 TYR 53 2HB TYR 53 -5.384 2.155 10.285 406 HB3 TYR 53 1HB TYR 53 -5.904 0.526 9.848 407 HD1 TYR 53 1HD TYR 53 -8.248 0.051 9.491 408 HD2 TYR 53 2HD TYR 53 -6.861 4.013 10.016 409 HE1 TYR 53 1HE TYR 53 -10.315 0.856 8.582 410 HE2 TYR 53 2HE TYR 53 -8.971 4.877 9.092 411 HH TYR 53 HH TYR 53 -10.747 4.087 7.610 412 H ILE 54 H ILE 54 -4.254 1.443 13.315 413 HA ILE 54 HA ILE 54 -3.439 -1.369 13.111 414 HB ILE 54 HB ILE 54 -1.616 1.040 13.562 415 HG12 ILE 54 2HG1 ILE 54 -2.456 1.137 11.279 416 HG13 ILE 54 1HG1 ILE 54 -0.788 0.582 11.268 417 HG21 ILE 54 1HG2 ILE 54 0.225 -0.505 13.183 418 HG22 ILE 54 2HG2 ILE 54 -0.920 -1.835 13.032 419 HG23 ILE 54 3HG2 ILE 54 -0.752 -0.993 14.571 420 HD11 ILE 54 1HD1 ILE 54 -3.225 -1.157 10.947 421 HD12 ILE 54 2HD1 ILE 54 -1.561 -1.722 10.949 422 HD13 ILE 54 3HD1 ILE 54 -2.127 -0.651 9.662 423 HA PRO 55 HA PRO 55 -4.328 -1.381 17.454 424 HB2 PRO 55 2HB PRO 55 -3.096 -3.711 18.122 425 HB3 PRO 55 1HB PRO 55 -4.648 -3.641 17.277 426 HG2 PRO 55 2HG PRO 55 -1.903 -4.048 16.163 427 HG3 PRO 55 1HG PRO 55 -3.408 -4.903 15.768 428 HD2 PRO 55 2HD PRO 55 -2.435 -2.949 14.203 429 HD3 PRO 55 1HD PRO 55 -4.179 -3.194 14.429 430 H ARG 56 H ARG 56 -3.403 -0.844 19.304 431 HA ARG 56 HA ARG 56 -0.646 0.020 19.217 432 HB2 ARG 56 2HB ARG 56 -1.219 1.105 21.466 433 HB3 ARG 56 1HB ARG 56 -2.050 1.717 20.053 434 HG2 ARG 56 2HG ARG 56 -3.585 1.597 21.900 435 HG3 ARG 56 1HG ARG 56 -4.050 0.395 20.711 436 HD2 ARG 56 2HD ARG 56 -2.974 -1.339 22.071 437 HD3 ARG 56 1HD ARG 56 -2.507 -0.118 23.253 438 HE ARG 56 HE ARG 56 -5.267 0.027 22.872 439 HH11 ARG 56 1HH1 ARG 56 -2.878 -2.169 24.295 440 HH12 ARG 56 2HH1 ARG 56 -3.976 -2.848 25.393 441 HH21 ARG 56 1HH2 ARG 56 -6.746 -0.904 24.397 442 HH22 ARG 56 2HH2 ARG 56 -6.228 -2.128 25.463 443 H TYR 57 H TYR 57 -1.666 -2.797 19.608 444 HA TYR 57 HA TYR 57 -0.813 -3.818 22.065 445 HB2 TYR 57 2HB TYR 57 -2.161 -5.138 20.528 446 HB3 TYR 57 1HB TYR 57 -0.882 -5.110 19.329 447 HD1 TYR 57 1HD TYR 57 -1.487 -6.223 22.848 448 HD2 TYR 57 2HD TYR 57 0.500 -6.955 19.168 449 HE1 TYR 57 1HE TYR 57 -0.638 -8.349 23.739 450 HE2 TYR 57 2HE TYR 57 1.366 -9.075 20.045 451 HH TYR 57 HH TYR 57 0.147 -10.450 22.894 452 H GLN 58 H GLN 58 1.009 -3.491 19.006 453 HA GLN 58 HA GLN 58 3.438 -3.799 20.587 454 HB2 GLN 58 2HB GLN 58 2.916 -4.678 17.750 455 HB3 GLN 58 1HB GLN 58 4.533 -4.523 18.406 456 HG2 GLN 58 2HG GLN 58 4.016 -6.182 20.115 457 HG3 GLN 58 1HG GLN 58 2.375 -6.318 19.496 458 HE21 GLN 58 1HE2 GLN 58 2.016 -7.463 17.588 459 HE22 GLN 58 2HE2 GLN 58 3.239 -8.439 16.872 460 H ASP 59 H ASP 59 5.336 -2.936 19.154 461 HA ASP 59 HA ASP 59 5.145 -0.138 19.199 462 HB2 ASP 59 2HB ASP 59 7.469 -0.200 18.330 463 HB3 ASP 59 1HB ASP 59 7.226 -1.220 19.740 464 H ALA 60 H ALA 60 4.273 -2.284 16.831 465 HA ALA 60 HA ALA 60 4.887 -1.177 14.382 466 HB1 ALA 60 1HB ALA 60 3.678 -3.297 14.688 467 HB2 ALA 60 2HB ALA 60 2.896 -2.221 13.526 468 HB3 ALA 60 3HB ALA 60 2.248 -2.382 15.158 469 H ARG 61 H ARG 61 2.234 -0.237 16.551 470 HA ARG 61 HA ARG 61 0.994 1.583 14.822 471 HB2 ARG 61 2HB ARG 61 -0.032 0.539 16.860 472 HB3 ARG 61 1HB ARG 61 0.976 1.563 17.853 473 HG2 ARG 61 2HG ARG 61 -0.764 2.990 15.932 474 HG3 ARG 61 1HG ARG 61 -1.608 2.085 17.177 475 HD2 ARG 61 2HD ARG 61 -1.350 4.335 17.954 476 HD3 ARG 61 1HD ARG 61 -0.255 3.331 18.883 477 HE ARG 61 HE ARG 61 1.029 4.541 16.641 478 HH11 ARG 61 1HH1 ARG 61 -0.052 5.150 19.976 479 HH12 ARG 61 2HH1 ARG 61 1.008 6.448 20.239 480 HH21 ARG 61 1HH2 ARG 61 2.519 6.417 17.033 481 HH22 ARG 61 2HH2 ARG 61 2.464 7.168 18.530 482 H ASN 62 H ASN 62 3.673 1.923 17.039 483 HA ASN 62 HA ASN 62 3.822 4.775 16.829 484 HB2 ASN 62 2HB ASN 62 5.866 2.759 17.797 485 HB3 ASN 62 1HB ASN 62 6.060 4.502 17.916 486 HD21 ASN 62 1HD2 ASN 62 4.890 5.635 19.457 487 HD22 ASN 62 2HD2 ASN 62 4.014 4.848 20.716 488 H LEU 63 H LEU 63 5.371 2.030 15.333 489 HA LEU 63 HA LEU 63 7.325 3.422 13.843 490 HB2 LEU 63 2HB LEU 63 6.051 0.757 13.267 491 HB3 LEU 63 1HB LEU 63 7.511 1.381 12.528 492 HG LEU 63 HG LEU 63 7.170 0.674 15.434 493 HD11 LEU 63 1HD1 LEU 63 8.651 -0.706 13.198 494 HD12 LEU 63 2HD1 LEU 63 7.181 -1.268 13.993 495 HD13 LEU 63 3HD1 LEU 63 8.682 -1.168 14.899 496 HD21 LEU 63 1HD2 LEU 63 9.614 1.580 13.897 497 HD22 LEU 63 2HD2 LEU 63 9.596 1.026 15.571 498 HD23 LEU 63 3HD2 LEU 63 8.765 2.514 15.126 499 H ILE 64 H ILE 64 4.068 2.280 12.974 500 HA ILE 64 HA ILE 64 4.388 3.105 10.283 501 HB ILE 64 HB ILE 64 2.770 1.312 10.991 502 HG12 ILE 64 2HG1 ILE 64 1.486 3.586 9.456 503 HG13 ILE 64 1HG1 ILE 64 2.630 2.436 8.777 504 HG21 ILE 64 1HG2 ILE 64 1.096 3.633 11.965 505 HG22 ILE 64 2HG2 ILE 64 1.840 2.389 12.970 506 HG23 ILE 64 3HG2 ILE 64 0.551 1.964 11.845 507 HD11 ILE 64 1HD1 ILE 64 1.036 0.619 9.247 508 HD12 ILE 64 2HD1 ILE 64 0.377 1.853 8.172 509 HD13 ILE 64 3HD1 ILE 64 -0.104 1.821 9.865 510 H ARG 65 H ARG 65 3.278 4.671 13.155 511 HA ARG 65 HA ARG 65 2.319 6.966 11.693 512 HB2 ARG 65 2HB ARG 65 2.382 6.320 14.618 513 HB3 ARG 65 1HB ARG 65 1.936 7.919 14.018 514 HG2 ARG 65 2HG ARG 65 0.561 5.325 13.337 515 HG3 ARG 65 1HG ARG 65 -0.032 6.570 14.441 516 HD2 ARG 65 2HD ARG 65 0.454 6.919 11.466 517 HD3 ARG 65 1HD ARG 65 -1.097 6.805 12.243 518 HE ARG 65 HE ARG 65 -0.176 8.834 13.560 519 HH11 ARG 65 1HH1 ARG 65 0.144 8.234 10.085 520 HH12 ARG 65 2HH1 ARG 65 0.207 9.888 9.664 521 HH21 ARG 65 1HH2 ARG 65 -0.073 11.100 12.969 522 HH22 ARG 65 2HH2 ARG 65 0.105 11.546 11.332 523 H ARG 66 H ARG 66 5.238 5.928 12.218 524 HA ARG 66 HA ARG 66 6.540 8.391 13.018 525 HB2 ARG 66 2HB ARG 66 7.521 6.140 13.494 526 HB3 ARG 66 1HB ARG 66 7.646 5.849 11.772 527 HG2 ARG 66 2HG ARG 66 9.805 6.424 12.657 528 HG3 ARG 66 1HG ARG 66 9.246 7.723 11.609 529 HD2 ARG 66 2HD ARG 66 8.513 8.989 13.576 530 HD3 ARG 66 1HD ARG 66 9.081 7.674 14.610 531 HE ARG 66 HE ARG 66 11.187 8.508 12.981 532 HH11 ARG 66 1HH1 ARG 66 9.254 9.749 15.674 533 HH12 ARG 66 2HH1 ARG 66 10.526 10.707 16.296 534 HH21 ARG 66 1HH2 ARG 66 12.868 9.835 13.819 535 HH22 ARG 66 2HH2 ARG 66 12.599 10.787 15.221 536 H HIS 67 H HIS 67 4.969 7.237 10.371 537 HA HIS 67 HA HIS 67 6.218 9.130 8.524 538 HB2 HIS 67 2HB HIS 67 5.293 6.314 7.835 539 HB3 HIS 67 1HB HIS 67 5.869 7.512 6.687 540 HD1 HIS 67 1HD HIS 67 8.435 7.864 6.543 541 HD2 HIS 67 2HD HIS 67 7.260 4.993 9.313 542 HE1 HIS 67 1HE HIS 67 10.522 6.541 7.134 543 HE2 HIS 67 2HE HIS 67 9.809 5.056 9.003 544 H GLU 68 H GLU 68 4.571 9.588 6.763 545 HA GLU 68 HA GLU 68 1.978 9.703 8.054 546 HB2 GLU 68 2HB GLU 68 2.812 10.914 5.422 547 HB3 GLU 68 1HB GLU 68 1.237 11.122 6.170 548 HG2 GLU 68 2HG GLU 68 2.389 12.144 8.126 549 HG3 GLU 68 1HG GLU 68 3.891 12.079 7.201 550 H ARG 69 H ARG 69 2.559 9.106 4.624 551 HA ARG 69 HA ARG 69 1.658 6.444 4.621 552 HB2 ARG 69 2HB ARG 69 -0.697 6.672 3.688 553 HB3 ARG 69 1HB ARG 69 -0.489 7.322 5.283 554 HG2 ARG 69 2HG ARG 69 -0.436 9.549 4.481 555 HG3 ARG 69 1HG ARG 69 -0.485 8.994 2.800 556 HD2 ARG 69 2HD ARG 69 -2.656 7.961 3.213 557 HD3 ARG 69 1HD ARG 69 -2.595 8.492 4.887 558 HE ARG 69 HE ARG 69 -2.345 10.791 3.531 559 HH11 ARG 69 1HH1 ARG 69 -4.640 8.102 3.159 560 HH12 ARG 69 2HH1 ARG 69 -5.962 9.124 2.810 561 HH21 ARG 69 1HH2 ARG 69 -4.214 12.166 3.010 562 HH22 ARG 69 2HH2 ARG 69 -5.716 11.431 2.709 563 H ASP 70 H ASP 70 1.999 9.438 2.745 564 HA ASP 70 HA ASP 70 1.910 8.245 0.186 565 HB2 ASP 70 2HB ASP 70 2.884 10.348 -0.605 566 HB3 ASP 70 1HB ASP 70 1.632 10.681 0.588 567 H GLU 71 H GLU 71 4.448 8.827 2.497 568 HA GLU 71 HA GLU 71 6.782 8.210 1.122 569 HB2 GLU 71 2HB GLU 71 6.012 7.430 3.930 570 HB3 GLU 71 1HB GLU 71 7.642 7.475 3.294 571 HG2 GLU 71 2HG GLU 71 7.569 9.848 3.100 572 HG3 GLU 71 1HG GLU 71 5.849 9.872 3.504 573 H ILE 72 H ILE 72 4.406 6.160 2.644 574 HA ILE 72 HA ILE 72 5.838 3.734 2.312 575 HB ILE 72 HB ILE 72 2.890 4.151 2.857 576 HG12 ILE 72 2HG1 ILE 72 5.180 3.801 4.817 577 HG13 ILE 72 1HG1 ILE 72 4.307 5.298 4.528 578 HG21 ILE 72 1HG2 ILE 72 3.426 1.878 2.133 579 HG22 ILE 72 2HG2 ILE 72 3.017 1.885 3.850 580 HG23 ILE 72 3HG2 ILE 72 4.704 1.783 3.344 581 HD11 ILE 72 1HD1 ILE 72 3.154 2.766 5.690 582 HD12 ILE 72 2HD1 ILE 72 2.263 4.258 5.397 583 HD13 ILE 72 3HD1 ILE 72 3.569 4.231 6.579 584 H MET 73 H MET 73 3.057 5.237 0.710 585 HA MET 73 HA MET 73 2.476 3.218 -1.113 586 HB2 MET 73 2HB MET 73 2.075 6.169 -1.394 587 HB3 MET 73 1HB MET 73 1.484 5.010 -2.572 588 HG2 MET 73 2HG MET 73 0.677 5.307 0.297 589 HG3 MET 73 1HG MET 73 -0.270 5.660 -1.132 590 HE1 MET 73 1HE MET 73 0.519 3.177 -3.025 591 HE2 MET 73 2HE MET 73 -1.110 3.823 -2.871 592 HE3 MET 73 3HE MET 73 -0.813 2.094 -2.683 593 H GLU 74 H GLU 74 4.809 5.863 -1.477 594 HA GLU 74 HA GLU 74 5.211 5.221 -4.186 595 HB2 GLU 74 2HB GLU 74 7.159 6.723 -4.159 596 HB3 GLU 74 1HB GLU 74 5.735 7.479 -3.475 597 HG2 GLU 74 2HG GLU 74 7.276 8.192 -1.965 598 HG3 GLU 74 1HG GLU 74 6.897 6.650 -1.210 599 H GLU 75 H GLU 75 6.831 4.124 -1.279 600 HA GLU 75 HA GLU 75 8.662 2.620 -2.823 601 HB2 GLU 75 2HB GLU 75 9.183 3.269 -0.483 602 HB3 GLU 75 1HB GLU 75 7.939 2.140 0.059 603 HG2 GLU 75 2HG GLU 75 10.156 1.112 0.235 604 HG3 GLU 75 1HG GLU 75 9.149 0.292 -0.959 605 H LEU 76 H LEU 76 5.539 1.921 -1.389 606 HA LEU 76 HA LEU 76 5.418 -0.817 -1.926 607 HB2 LEU 76 2HB LEU 76 3.181 1.207 -2.164 608 HB3 LEU 76 1HB LEU 76 2.961 -0.527 -2.159 609 HG LEU 76 HG LEU 76 3.978 1.136 0.143 610 HD11 LEU 76 1HD1 LEU 76 1.858 0.514 1.193 611 HD12 LEU 76 2HD1 LEU 76 1.370 -0.299 -0.290 612 HD13 LEU 76 3HD1 LEU 76 1.606 1.446 -0.285 613 HD21 LEU 76 1HD2 LEU 76 3.391 -1.816 -0.035 614 HD22 LEU 76 2HD2 LEU 76 3.783 -0.932 1.437 615 HD23 LEU 76 3HD2 LEU 76 4.984 -1.081 0.159 616 H THR 77 H THR 77 4.713 1.946 -4.015 617 HA THR 77 HA THR 77 4.003 0.426 -6.272 618 HB THR 77 HB THR 77 5.177 3.214 -6.144 619 HG1 THR 77 1HG THR 77 3.333 3.106 -4.852 620 HG21 THR 77 1HG2 THR 77 5.118 2.251 -8.407 621 HG22 THR 77 2HG2 THR 77 3.948 3.560 -8.238 622 HG23 THR 77 3HG2 THR 77 3.404 1.884 -8.198 623 H LYS 78 H LYS 78 7.079 1.982 -5.298 624 HA LYS 78 HA LYS 78 8.496 1.220 -7.589 625 HB2 LYS 78 2HB LYS 78 9.463 2.127 -4.911 626 HB3 LYS 78 1HB LYS 78 10.573 1.691 -6.200 627 HG2 LYS 78 2HG LYS 78 9.405 3.339 -7.645 628 HG3 LYS 78 1HG LYS 78 8.500 3.843 -6.239 629 HD2 LYS 78 2HD LYS 78 11.505 3.883 -6.182 630 HD3 LYS 78 1HD LYS 78 10.621 5.197 -6.938 631 HE2 LYS 78 2HE LYS 78 11.150 5.811 -4.713 632 HE3 LYS 78 1HE LYS 78 9.416 5.545 -4.825 633 HZ1 LYS 78 1HZ LYS 78 11.449 3.813 -3.518 634 HZ2 LYS 78 2HZ LYS 78 9.894 3.263 -3.766 635 HZ3 LYS 78 3HZ LYS 78 10.156 4.636 -2.811 636 H TYR 79 H TYR 79 8.586 -0.239 -4.408 637 HA TYR 79 HA TYR 79 10.521 -2.157 -5.117 638 HB2 TYR 79 2HB TYR 79 9.983 -1.458 -2.796 639 HB3 TYR 79 1HB TYR 79 8.470 -2.343 -2.914 640 HD1 TYR 79 1HD TYR 79 12.118 -2.841 -3.328 641 HD2 TYR 79 2HD TYR 79 8.416 -4.514 -2.121 642 HE1 TYR 79 1HE TYR 79 13.303 -4.845 -2.520 643 HE2 TYR 79 2HE TYR 79 9.570 -6.521 -1.312 644 HH TYR 79 HH TYR 79 12.904 -6.583 -0.883 645 H TYR 80 H TYR 80 7.043 -2.167 -5.356 646 HA TYR 80 HA TYR 80 6.538 -4.869 -5.890 647 HB2 TYR 80 2HB TYR 80 4.837 -3.091 -5.459 648 HB3 TYR 80 1HB TYR 80 5.199 -2.400 -7.024 649 HD1 TYR 80 1HD TYR 80 3.465 -5.020 -5.212 650 HD2 TYR 80 2HD TYR 80 4.389 -3.533 -9.083 651 HE1 TYR 80 1HE TYR 80 1.647 -6.378 -6.154 652 HE2 TYR 80 2HE TYR 80 2.577 -4.892 -10.043 653 HH TYR 80 HH TYR 80 0.219 -6.373 -8.089 654 H LEU 81 H LEU 81 7.218 -2.158 -8.032 655 HA LEU 81 HA LEU 81 7.307 -3.722 -10.406 656 HB2 LEU 81 2HB LEU 81 8.198 -0.906 -9.864 657 HB3 LEU 81 1HB LEU 81 8.097 -1.628 -11.463 658 HG LEU 81 HG LEU 81 5.759 -1.179 -9.597 659 HD11 LEU 81 1HD1 LEU 81 5.098 0.560 -11.175 660 HD12 LEU 81 2HD1 LEU 81 6.597 0.308 -12.068 661 HD13 LEU 81 3HD1 LEU 81 6.651 0.919 -10.415 662 HD21 LEU 81 1HD2 LEU 81 4.390 -1.741 -11.556 663 HD22 LEU 81 2HD2 LEU 81 5.404 -3.094 -11.070 664 HD23 LEU 81 3HD2 LEU 81 5.851 -2.113 -12.468 665 H ALA 82 H ALA 82 9.764 -2.494 -8.179 666 HA ALA 82 HA ALA 82 12.028 -2.852 -9.762 667 HB1 ALA 82 1HB ALA 82 11.993 -1.569 -7.672 668 HB2 ALA 82 2HB ALA 82 13.286 -2.770 -7.682 669 HB3 ALA 82 3HB ALA 82 11.810 -3.068 -6.764 670 H ASN 83 H ASN 83 10.240 -5.127 -7.812 671 HA ASN 83 HA ASN 83 12.241 -7.163 -7.928 672 HB2 ASN 83 2HB ASN 83 9.333 -7.332 -7.154 673 HB3 ASN 83 1HB ASN 83 10.452 -8.687 -7.056 674 HD21 ASN 83 1HD2 ASN 83 8.968 -7.340 -4.986 675 HD22 ASN 83 2HD2 ASN 83 10.135 -6.786 -3.835 676 H HIS 84 H HIS 84 10.455 -5.993 -10.361 677 HA HIS 84 HA HIS 84 10.226 -8.598 -11.693 678 HB2 HIS 84 2HB HIS 84 9.335 -5.871 -12.680 679 HB3 HIS 84 1HB HIS 84 9.105 -7.384 -13.542 680 HD1 HIS 84 1HD HIS 84 7.891 -9.187 -11.410 681 HD2 HIS 84 2HD HIS 84 6.885 -5.173 -11.855 682 HE1 HIS 84 1HE HIS 84 5.656 -8.929 -10.346 683 HE2 HIS 84 2HE HIS 84 4.965 -6.704 -11.196 684 H GLY 85 H GLY 85 12.602 -6.634 -11.039 685 HA2 GLY 85 2HA GLY 85 14.735 -6.623 -11.924 686 HA3 GLY 85 1HA GLY 85 14.105 -7.353 -13.399 687 H ILE 86 H ILE 86 12.563 -4.608 -12.113 688 HA ILE 86 HA ILE 86 13.440 -3.072 -14.435 689 HB ILE 86 HB ILE 86 11.084 -2.685 -12.581 690 HG12 ILE 86 2HG1 ILE 86 11.220 -3.606 -15.463 691 HG13 ILE 86 1HG1 ILE 86 10.853 -4.617 -14.072 692 HG21 ILE 86 1HG2 ILE 86 10.344 -0.946 -14.154 693 HG22 ILE 86 2HG2 ILE 86 11.854 -1.129 -15.051 694 HG23 ILE 86 3HG2 ILE 86 11.874 -0.531 -13.391 695 HD11 ILE 86 1HD1 ILE 86 9.217 -2.314 -15.071 696 HD12 ILE 86 2HD1 ILE 86 8.825 -3.322 -13.676 697 HD13 ILE 86 3HD1 ILE 86 8.839 -4.026 -15.300 698 H ASP 87 H ASP 87 14.639 -1.339 -14.194 699 HA ASP 87 HA ASP 87 15.217 -0.349 -11.508 700 HB2 ASP 87 2HB ASP 87 17.213 -0.760 -12.853 701 HB3 ASP 87 1HB ASP 87 16.581 0.256 -14.145 702 H ILE 88 H ILE 88 14.258 1.329 -10.803 703 HA ILE 88 HA ILE 88 12.435 2.687 -12.574 704 HB ILE 88 HB ILE 88 12.676 2.631 -9.568 705 HG12 ILE 88 2HG1 ILE 88 10.699 1.409 -11.487 706 HG13 ILE 88 1HG1 ILE 88 11.961 0.554 -10.611 707 HG21 ILE 88 1HG2 ILE 88 10.556 3.829 -9.440 708 HG22 ILE 88 2HG2 ILE 88 10.514 3.965 -11.205 709 HG23 ILE 88 3HG2 ILE 88 11.761 4.794 -10.273 710 HD11 ILE 88 1HD1 ILE 88 9.590 1.951 -9.431 711 HD12 ILE 88 2HD1 ILE 88 10.860 1.134 -8.519 712 HD13 ILE 88 3HD1 ILE 88 9.817 0.211 -9.598 713 H LYS 89 H LYS 89 12.314 4.815 -12.853 714 HA LYS 89 HA LYS 89 14.508 6.479 -11.897 715 HB2 LYS 89 2HB LYS 89 14.682 7.604 -14.086 716 HB3 LYS 89 1HB LYS 89 15.085 5.909 -14.226 717 HG2 LYS 89 2HG LYS 89 12.392 7.059 -14.979 718 HG3 LYS 89 1HG LYS 89 13.727 6.889 -16.109 719 HD2 LYS 89 2HD LYS 89 12.465 4.594 -14.584 720 HD3 LYS 89 1HD LYS 89 12.037 5.052 -16.228 721 HE2 LYS 89 2HE LYS 89 14.347 4.599 -16.944 722 HE3 LYS 89 1HE LYS 89 14.770 4.156 -15.294 723 HZ1 LYS 89 1HZ LYS 89 13.364 2.287 -15.385 724 HZ2 LYS 89 2HZ LYS 89 14.292 2.248 -16.777 725 HZ3 LYS 89 3HZ LYS 89 12.663 2.733 -16.857 726 H1 MET 1 H MET 1 -17.397 -6.075 22.842 727 HA MET 1 HA MET 1 -15.591 -4.389 21.455 728 HB2 MET 1 2HB MET 1 -16.163 -3.806 24.359 729 HB3 MET 1 1HB MET 1 -14.835 -3.128 23.434 730 HG2 MET 1 2HG MET 1 -16.435 -2.002 21.968 731 HG3 MET 1 1HG MET 1 -17.765 -2.683 22.904 732 HE1 MET 1 1HE MET 1 -18.208 -2.084 25.488 733 HE2 MET 1 2HE MET 1 -17.231 -0.936 26.403 734 HE3 MET 1 3HE MET 1 -16.538 -2.472 25.904 735 H GLY 2 H GLY 2 -14.366 -6.144 21.092 736 HA2 GLY 2 2HA GLY 2 -12.422 -7.308 21.776 737 HA3 GLY 2 1HA GLY 2 -13.038 -7.306 23.429 738 H PHE 3 H PHE 3 -12.369 -9.299 21.038 739 HA PHE 3 HA PHE 3 -12.899 -11.386 20.467 740 HB2 PHE 3 2HB PHE 3 -14.496 -11.375 23.039 741 HB3 PHE 3 1HB PHE 3 -14.205 -12.808 22.067 742 HD1 PHE 3 1HD PHE 3 -12.553 -10.196 24.106 743 HD2 PHE 3 2HD PHE 3 -12.201 -14.024 22.285 744 HE1 PHE 3 1HE PHE 3 -10.469 -10.583 25.338 745 HE2 PHE 3 2HE PHE 3 -10.113 -14.420 23.516 746 HZ PHE 3 HZ PHE 3 -9.243 -12.703 25.045 747 H THR 4 H THR 4 -13.930 -10.815 18.617 748 HA THR 4 HA THR 4 -16.842 -10.894 18.764 749 HB THR 4 HB THR 4 -16.181 -8.704 17.953 750 HG1 THR 4 1HG THR 4 -16.894 -9.314 15.477 751 HG21 THR 4 1HG2 THR 4 -14.581 -10.137 15.827 752 HG22 THR 4 2HG2 THR 4 -13.920 -9.187 17.158 753 HG23 THR 4 3HG2 THR 4 -14.857 -8.397 15.888 754 H ASP 5 H ASP 5 -17.806 -12.508 17.766 755 HA ASP 5 HA ASP 5 -16.148 -14.250 16.111 756 HB2 ASP 5 2HB ASP 5 -17.312 -15.411 17.900 757 HB3 ASP 5 1HB ASP 5 -18.847 -14.728 17.356 758 H GLU 6 H GLU 6 -16.241 -13.933 14.053 759 HA GLU 6 HA GLU 6 -18.765 -13.635 12.827 760 HB2 GLU 6 2HB GLU 6 -18.050 -11.592 11.546 761 HB3 GLU 6 1HB GLU 6 -18.492 -11.350 13.228 762 HG2 GLU 6 2HG GLU 6 -16.080 -11.318 13.793 763 HG3 GLU 6 1HG GLU 6 -15.713 -11.434 12.073 764 H THR 7 H THR 7 -18.648 -15.262 11.646 765 HA THR 7 HA THR 7 -16.300 -16.107 10.299 766 HB THR 7 HB THR 7 -17.981 -17.759 9.248 767 HG1 THR 7 1HG THR 7 -19.724 -16.989 11.283 768 HG21 THR 7 1HG2 THR 7 -18.212 -19.024 11.347 769 HG22 THR 7 2HG2 THR 7 -17.785 -17.582 12.263 770 HG23 THR 7 3HG2 THR 7 -16.596 -18.331 11.200 771 H VAL 8 H VAL 8 -16.230 -16.374 7.896 772 HA VAL 8 HA VAL 8 -16.993 -13.844 6.781 773 HB VAL 8 HB VAL 8 -15.673 -14.500 4.761 774 HG11 VAL 8 1HG1 VAL 8 -13.475 -14.391 5.850 775 HG12 VAL 8 2HG1 VAL 8 -14.237 -14.765 7.395 776 HG13 VAL 8 3HG1 VAL 8 -14.624 -13.259 6.563 777 HG21 VAL 8 1HG2 VAL 8 -14.960 -16.953 6.377 778 HG22 VAL 8 2HG2 VAL 8 -14.249 -16.492 4.833 779 HG23 VAL 8 3HG2 VAL 8 -15.950 -16.956 4.916 780 H ARG 9 H ARG 9 -18.861 -13.492 5.976 781 HA ARG 9 HA ARG 9 -20.294 -15.650 4.590 782 HB2 ARG 9 2HB ARG 9 -21.230 -12.919 5.469 783 HB3 ARG 9 1HB ARG 9 -22.235 -14.161 4.748 784 HG2 ARG 9 2HG ARG 9 -21.898 -15.586 6.680 785 HG3 ARG 9 1HG ARG 9 -20.826 -14.379 7.400 786 HD2 ARG 9 2HD ARG 9 -23.749 -14.014 6.743 787 HD3 ARG 9 1HD ARG 9 -23.065 -14.214 8.349 788 HE ARG 9 HE ARG 9 -21.795 -12.063 7.139 789 HH11 ARG 9 1HH1 ARG 9 -25.002 -12.912 8.357 790 HH12 ARG 9 2HH1 ARG 9 -25.448 -11.314 8.727 791 HH21 ARG 9 1HH2 ARG 9 -22.400 -9.858 7.663 792 HH22 ARG 9 2HH2 ARG 9 -23.922 -9.534 8.342 793 H PHE 10 H PHE 10 -18.012 -13.854 3.691 794 HA PHE 10 HA PHE 10 -19.285 -12.863 1.242 795 HB2 PHE 10 2HB PHE 10 -16.916 -11.668 2.690 796 HB3 PHE 10 1HB PHE 10 -17.504 -11.149 1.118 797 HD1 PHE 10 1HD PHE 10 -19.560 -9.874 0.932 798 HD2 PHE 10 2HD PHE 10 -18.070 -11.112 4.716 799 HE1 PHE 10 1HE PHE 10 -21.050 -8.264 2.044 800 HE2 PHE 10 2HE PHE 10 -19.556 -9.516 5.830 801 HZ PHE 10 HZ PHE 10 -21.051 -8.085 4.499 802 H ASP 11 H ASP 11 -18.838 -14.568 -0.048 803 HA ASP 11 HA ASP 11 -16.097 -15.488 -0.299 804 HB2 ASP 11 2HB ASP 11 -17.919 -17.139 -0.608 805 HB3 ASP 11 1HB ASP 11 -18.587 -16.164 -1.913 806 H PHE 12 H PHE 12 -14.849 -13.887 -1.116 807 HA PHE 12 HA PHE 12 -15.672 -12.726 -3.638 808 HB2 PHE 12 2HB PHE 12 -16.686 -11.282 -1.925 809 HB3 PHE 12 1HB PHE 12 -15.113 -11.043 -1.189 810 HD1 PHE 12 1HD PHE 12 -13.629 -9.393 -2.016 811 HD2 PHE 12 2HD PHE 12 -17.151 -10.380 -4.187 812 HE1 PHE 12 1HE PHE 12 -13.296 -7.421 -3.439 813 HE2 PHE 12 2HE PHE 12 -16.828 -8.405 -5.616 814 HZ PHE 12 HZ PHE 12 -14.905 -6.923 -5.247 815 H ASP 13 H ASP 13 -14.049 -13.179 -4.795 816 HA ASP 13 HA ASP 13 -12.030 -13.464 -5.642 817 HB2 ASP 13 2HB ASP 13 -11.667 -10.736 -4.443 818 HB3 ASP 13 1HB ASP 13 -10.470 -11.482 -5.490 819 H ASP 14 H ASP 14 -11.586 -15.278 -4.349 820 HA ASP 14 HA ASP 14 -9.187 -14.760 -2.763 821 HB2 ASP 14 2HB ASP 14 -10.847 -16.209 -1.608 822 HB3 ASP 14 1HB ASP 14 -10.768 -17.348 -2.949 823 H ASN 15 H ASN 15 -7.877 -14.316 -4.401 824 HA ASN 15 HA ASN 15 -6.715 -16.483 -5.846 825 HB2 ASN 15 2HB ASN 15 -8.716 -16.011 -7.251 826 HB3 ASN 15 1HB ASN 15 -8.220 -14.333 -7.377 827 HD21 ASN 15 1HD2 ASN 15 -8.111 -14.459 -9.614 828 HD22 ASN 15 2HD2 ASN 15 -6.857 -15.305 -10.445 829 H ARG 16 H ARG 16 -4.820 -15.696 -6.955 830 HA ARG 16 HA ARG 16 -3.784 -13.343 -5.672 831 HB2 ARG 16 2HB ARG 16 -1.570 -13.893 -6.572 832 HB3 ARG 16 1HB ARG 16 -2.258 -15.299 -5.801 833 HG2 ARG 16 2HG ARG 16 -2.124 -14.820 -8.792 834 HG3 ARG 16 1HG ARG 16 -1.002 -15.805 -7.861 835 HD2 ARG 16 2HD ARG 16 -2.873 -17.300 -7.255 836 HD3 ARG 16 1HD ARG 16 -3.948 -16.308 -8.243 837 HE ARG 16 HE ARG 16 -1.701 -17.211 -9.706 838 HH11 ARG 16 1HH1 ARG 16 -4.890 -18.218 -8.507 839 HH12 ARG 16 2HH1 ARG 16 -5.123 -19.428 -9.664 840 HH21 ARG 16 1HH2 ARG 16 -2.008 -18.904 -11.313 841 HH22 ARG 16 2HH2 ARG 16 -3.433 -19.831 -11.315 842 H LYS 17 H LYS 17 -3.365 -11.398 -6.642 843 HA LYS 17 HA LYS 17 -4.489 -11.284 -9.258 844 HB2 LYS 17 2HB LYS 17 -4.214 -9.086 -7.249 845 HB3 LYS 17 1HB LYS 17 -4.464 -8.722 -8.946 846 HG2 LYS 17 2HG LYS 17 -6.573 -8.660 -7.853 847 HG3 LYS 17 1HG LYS 17 -6.548 -10.074 -8.893 848 HD2 LYS 17 2HD LYS 17 -7.584 -10.738 -6.849 849 HD3 LYS 17 1HD LYS 17 -5.965 -11.426 -6.836 850 HE2 LYS 17 2HE LYS 17 -6.492 -10.511 -4.667 851 HE3 LYS 17 1HE LYS 17 -5.209 -9.559 -5.408 852 HZ1 LYS 17 1HZ LYS 17 -6.873 -7.869 -5.995 853 HZ2 LYS 17 2HZ LYS 17 -6.951 -8.179 -4.320 854 HZ3 LYS 17 3HZ LYS 17 -8.089 -8.814 -5.340 855 H LYS 18 H LYS 18 -3.012 -12.027 -10.443 856 HA LYS 18 HA LYS 18 -0.436 -10.729 -10.723 857 HB2 LYS 18 2HB LYS 18 -0.082 -12.429 -12.492 858 HB3 LYS 18 1HB LYS 18 -0.557 -13.159 -10.967 859 HG2 LYS 18 2HG LYS 18 -2.876 -13.340 -11.824 860 HG3 LYS 18 1HG LYS 18 -2.323 -12.711 -13.373 861 HD2 LYS 18 2HD LYS 18 -1.374 -15.249 -12.037 862 HD3 LYS 18 1HD LYS 18 -2.513 -15.158 -13.374 863 HE2 LYS 18 2HE LYS 18 -0.770 -14.144 -14.777 864 HE3 LYS 18 1HE LYS 18 0.362 -14.251 -13.426 865 HZ1 LYS 18 1HZ LYS 18 -0.944 -16.564 -14.765 866 HZ2 LYS 18 2HZ LYS 18 0.141 -16.653 -13.480 867 HZ3 LYS 18 3HZ LYS 18 0.650 -16.083 -14.964 868 H ALA 19 H ALA 19 -3.579 -10.481 -11.876 869 HA ALA 19 HA ALA 19 -3.210 -9.368 -14.465 870 HB1 ALA 19 1HB ALA 19 -5.495 -8.574 -14.194 871 HB2 ALA 19 2HB ALA 19 -5.385 -8.938 -12.469 872 HB3 ALA 19 3HB ALA 19 -5.321 -10.257 -13.641 873 H ILE 20 H ILE 20 -3.520 -8.071 -11.242 874 HA ILE 20 HA ILE 20 -3.524 -5.365 -11.947 875 HB ILE 20 HB ILE 20 -2.775 -6.720 -9.340 876 HG12 ILE 20 2HG1 ILE 20 -5.275 -5.294 -10.256 877 HG13 ILE 20 1HG1 ILE 20 -5.086 -7.030 -10.075 878 HG21 ILE 20 1HG2 ILE 20 -1.700 -4.515 -9.425 879 HG22 ILE 20 2HG2 ILE 20 -3.011 -4.550 -8.249 880 HG23 ILE 20 3HG2 ILE 20 -3.254 -3.768 -9.814 881 HD11 ILE 20 1HD1 ILE 20 -6.315 -6.115 -8.238 882 HD12 ILE 20 2HD1 ILE 20 -5.022 -4.969 -7.883 883 HD13 ILE 20 3HD1 ILE 20 -4.759 -6.702 -7.659 884 H SER 21 H SER 21 -1.042 -7.705 -11.402 885 HA SER 21 HA SER 21 1.179 -6.003 -11.231 886 HB2 SER 21 2HB SER 21 1.027 -8.796 -12.390 887 HB3 SER 21 1HB SER 21 2.480 -7.982 -11.803 888 HG SER 21 HG SER 21 1.030 -7.796 -9.771 889 H GLU 22 H GLU 22 -0.558 -7.444 -13.959 890 HA GLU 22 HA GLU 22 1.139 -6.536 -16.030 891 HB2 GLU 22 2HB GLU 22 -1.820 -7.159 -16.100 892 HB3 GLU 22 1HB GLU 22 -0.771 -7.051 -17.498 893 HG2 GLU 22 2HG GLU 22 0.483 -8.994 -16.696 894 HG3 GLU 22 1HG GLU 22 -0.579 -9.092 -15.293 895 H THR 23 H THR 23 -1.716 -5.235 -14.425 896 HA THR 23 HA THR 23 -2.302 -3.067 -16.056 897 HB THR 23 HB THR 23 -2.620 -3.327 -13.057 898 HG1 THR 23 1HG THR 23 -3.862 -4.530 -15.170 899 HG21 THR 23 1HG2 THR 23 -4.478 -1.735 -13.325 900 HG22 THR 23 2HG2 THR 23 -4.093 -1.569 -15.034 901 HG23 THR 23 3HG2 THR 23 -2.942 -1.019 -13.818 902 H LEU 24 H LEU 24 -0.319 -3.099 -13.056 903 HA LEU 24 HA LEU 24 0.327 -0.342 -13.383 904 HB2 LEU 24 2HB LEU 24 1.283 -2.371 -11.402 905 HB3 LEU 24 1HB LEU 24 2.008 -0.783 -11.487 906 HG LEU 24 HG LEU 24 -0.203 0.226 -10.986 907 HD11 LEU 24 1HD1 LEU 24 -1.117 -2.605 -10.557 908 HD12 LEU 24 2HD1 LEU 24 -1.651 -1.515 -11.831 909 HD13 LEU 24 3HD1 LEU 24 -2.020 -1.145 -10.147 910 HD21 LEU 24 1HD2 LEU 24 -0.244 -0.412 -8.627 911 HD22 LEU 24 2HD2 LEU 24 1.400 -0.165 -9.216 912 HD23 LEU 24 3HD2 LEU 24 0.776 -1.801 -8.997 913 H GLU 25 H GLU 25 1.928 -3.252 -14.259 914 HA GLU 25 HA GLU 25 4.484 -2.159 -14.639 915 HB2 GLU 25 2HB GLU 25 3.939 -4.551 -14.518 916 HB3 GLU 25 1HB GLU 25 3.163 -4.444 -16.088 917 HG2 GLU 25 2HG GLU 25 5.264 -3.908 -17.128 918 HG3 GLU 25 1HG GLU 25 6.063 -3.893 -15.551 919 H THR 26 H THR 26 1.619 -2.421 -16.676 920 HA THR 26 HA THR 26 2.761 -1.376 -19.049 921 HB THR 26 HB THR 26 -0.147 -1.327 -18.177 922 HG1 THR 26 1HG THR 26 0.328 -3.460 -18.214 923 HG21 THR 26 1HG2 THR 26 0.444 0.106 -20.100 924 HG22 THR 26 2HG2 THR 26 -0.614 -1.233 -20.573 925 HG23 THR 26 3HG2 THR 26 1.118 -1.301 -20.919 926 H VAL 27 H VAL 27 0.889 0.031 -16.372 927 HA VAL 27 HA VAL 27 0.700 2.675 -17.249 928 HB VAL 27 HB VAL 27 0.934 1.627 -14.398 929 HG11 VAL 27 1HG1 VAL 27 1.430 4.009 -14.492 930 HG12 VAL 27 2HG1 VAL 27 -0.145 3.721 -13.734 931 HG13 VAL 27 3HG1 VAL 27 -0.055 4.276 -15.406 932 HG21 VAL 27 1HG2 VAL 27 -1.515 2.357 -16.005 933 HG22 VAL 27 2HG2 VAL 27 -1.490 1.801 -14.338 934 HG23 VAL 27 3HG2 VAL 27 -0.981 0.714 -15.624 935 H TYR 28 H TYR 28 3.186 1.040 -15.404 936 HA TYR 28 HA TYR 28 4.834 3.215 -14.857 937 HB2 TYR 28 2HB TYR 28 5.202 1.166 -13.666 938 HB3 TYR 28 1HB TYR 28 5.508 0.281 -15.160 939 HD1 TYR 28 1HD TYR 28 7.635 0.271 -16.160 940 HD2 TYR 28 2HD TYR 28 6.880 2.849 -12.873 941 HE1 TYR 28 1HE TYR 28 10.003 0.793 -16.033 942 HE2 TYR 28 2HE TYR 28 9.280 3.386 -12.744 943 HH TYR 28 HH TYR 28 11.221 2.609 -15.316 944 H ARG 29 H ARG 29 5.035 0.914 -17.556 945 HA ARG 29 HA ARG 29 7.283 2.029 -18.805 946 HB2 ARG 29 2HB ARG 29 4.971 0.529 -20.051 947 HB3 ARG 29 1HB ARG 29 6.455 0.943 -20.892 948 HG2 ARG 29 2HG ARG 29 6.270 -0.831 -18.460 949 HG3 ARG 29 1HG ARG 29 6.444 -1.387 -20.126 950 HD2 ARG 29 2HD ARG 29 8.423 0.303 -18.579 951 HD3 ARG 29 1HD ARG 29 8.600 -1.397 -18.991 952 HE ARG 29 HE ARG 29 8.310 -0.346 -21.406 953 HH11 ARG 29 1HH1 ARG 29 10.410 0.674 -18.723 954 HH12 ARG 29 2HH1 ARG 29 11.530 1.445 -19.723 955 HH21 ARG 29 1HH2 ARG 29 9.893 0.688 -22.774 956 HH22 ARG 29 2HH2 ARG 29 11.254 1.438 -22.092 957 H ALA 30 H ALA 30 3.895 2.787 -19.170 958 HA ALA 30 HA ALA 30 4.142 4.603 -21.309 959 HB1 ALA 30 1HB ALA 30 2.056 4.576 -19.117 960 HB2 ALA 30 2HB ALA 30 1.980 3.635 -20.594 961 HB3 ALA 30 3HB ALA 30 1.918 5.398 -20.668 962 H LEU 31 H LEU 31 4.239 5.063 -17.823 963 HA LEU 31 HA LEU 31 4.329 7.878 -17.946 964 HB2 LEU 31 2HB LEU 31 4.915 5.979 -15.726 965 HB3 LEU 31 1HB LEU 31 5.007 7.718 -15.565 966 HG LEU 31 HG LEU 31 2.519 6.410 -16.547 967 HD11 LEU 31 1HD1 LEU 31 3.093 5.530 -14.261 968 HD12 LEU 31 2HD1 LEU 31 1.643 6.531 -14.260 969 HD13 LEU 31 3HD1 LEU 31 3.171 7.191 -13.682 970 HD21 LEU 31 1HD2 LEU 31 2.732 8.735 -16.986 971 HD22 LEU 31 2HD2 LEU 31 3.160 9.048 -15.299 972 HD23 LEU 31 3HD2 LEU 31 1.536 8.498 -15.715 973 H GLU 32 H GLU 32 6.967 5.495 -17.783 974 HA GLU 32 HA GLU 32 8.786 7.643 -17.283 975 HB2 GLU 32 2HB GLU 32 10.635 6.118 -17.722 976 HB3 GLU 32 1HB GLU 32 9.521 5.495 -16.516 977 HG2 GLU 32 2HG GLU 32 8.709 3.866 -18.024 978 HG3 GLU 32 1HG GLU 32 9.490 4.655 -19.397 979 H GLU 33 H GLU 33 7.652 6.074 -20.116 980 HA GLU 33 HA GLU 33 9.523 7.441 -21.785 981 HB2 GLU 33 2HB GLU 33 6.944 6.077 -22.561 982 HB3 GLU 33 1HB GLU 33 8.154 6.672 -23.694 983 HG2 GLU 33 2HG GLU 33 9.805 5.137 -22.619 984 HG3 GLU 33 1HG GLU 33 8.471 4.474 -21.675 985 H LYS 34 H LYS 34 6.258 8.097 -20.722 986 HA LYS 34 HA LYS 34 6.113 10.496 -22.304 987 HB2 LYS 34 2HB LYS 34 4.336 9.437 -20.119 988 HB3 LYS 34 1HB LYS 34 4.038 10.961 -20.929 989 HG2 LYS 34 2HG LYS 34 4.164 8.276 -22.305 990 HG3 LYS 34 1HG LYS 34 2.682 9.082 -21.801 991 HD2 LYS 34 2HD LYS 34 4.682 10.208 -23.784 992 HD3 LYS 34 1HD LYS 34 3.181 9.392 -24.210 993 HE2 LYS 34 2HE LYS 34 1.904 11.133 -23.037 994 HE3 LYS 34 1HE LYS 34 3.404 11.951 -22.608 995 HZ1 LYS 34 1HZ LYS 34 3.837 12.308 -24.961 996 HZ2 LYS 34 2HZ LYS 34 2.360 12.960 -24.520 997 HZ3 LYS 34 3HZ LYS 34 2.408 11.520 -25.382 998 H GLY 35 H GLY 35 7.648 9.740 -19.427 999 HA2 GLY 35 2HA GLY 35 9.050 11.049 -18.177 1000 HA3 GLY 35 1HA GLY 35 8.673 12.381 -19.246 1001 H TYR 36 H TYR 36 6.428 10.568 -17.121 1002 HA TYR 36 HA TYR 36 5.882 13.192 -15.880 1003 HB2 TYR 36 2HB TYR 36 4.070 10.790 -16.032 1004 HB3 TYR 36 1HB TYR 36 3.689 12.280 -15.185 1005 HD1 TYR 36 1HD TYR 36 3.039 10.531 -18.042 1006 HD2 TYR 36 2HD TYR 36 4.152 14.439 -16.800 1007 HE1 TYR 36 1HE TYR 36 2.095 11.464 -20.112 1008 HE2 TYR 36 2HE TYR 36 3.205 15.376 -18.856 1009 HH TYR 36 HH TYR 36 2.720 14.619 -21.115 1010 H ASN 37 H ASN 37 7.760 10.780 -15.166 1011 HA ASN 37 HA ASN 37 8.616 9.806 -13.324 1012 HB2 ASN 37 2HB ASN 37 7.022 11.870 -11.750 1013 HB3 ASN 37 1HB ASN 37 8.247 10.835 -11.053 1014 HD21 ASN 37 1HD2 ASN 37 10.052 11.175 -13.427 1015 HD22 ASN 37 2HD2 ASN 37 10.661 12.766 -13.281 1016 HA PRO 38 HA PRO 38 5.051 6.934 -13.692 1017 HB2 PRO 38 2HB PRO 38 7.181 5.346 -12.396 1018 HB3 PRO 38 1HB PRO 38 6.081 4.915 -13.707 1019 HG2 PRO 38 2HG PRO 38 8.665 5.685 -14.091 1020 HG3 PRO 38 1HG PRO 38 7.384 5.896 -15.290 1021 HD2 PRO 38 2HD PRO 38 8.825 7.920 -13.808 1022 HD3 PRO 38 1HD PRO 38 7.634 8.090 -15.124 1023 H ILE 39 H ILE 39 7.013 7.246 -10.753 1024 HA ILE 39 HA ILE 39 5.153 5.644 -9.277 1025 HB ILE 39 HB ILE 39 7.435 7.317 -8.215 1026 HG12 ILE 39 2HG1 ILE 39 8.255 5.786 -9.906 1027 HG13 ILE 39 1HG1 ILE 39 8.744 5.228 -8.314 1028 HG21 ILE 39 1HG2 ILE 39 5.847 6.630 -6.495 1029 HG22 ILE 39 2HG2 ILE 39 7.380 5.776 -6.320 1030 HG23 ILE 39 3HG2 ILE 39 5.988 4.955 -7.030 1031 HD11 ILE 39 1HD1 ILE 39 8.055 3.376 -9.739 1032 HD12 ILE 39 2HD1 ILE 39 6.478 4.120 -9.975 1033 HD13 ILE 39 3HD1 ILE 39 6.951 3.546 -8.373 1034 H ASN 40 H ASN 40 5.824 9.037 -9.620 1035 HA ASN 40 HA ASN 40 4.340 9.998 -7.423 1036 HB2 ASN 40 2HB ASN 40 4.996 11.389 -10.036 1037 HB3 ASN 40 1HB ASN 40 4.353 12.185 -8.609 1038 HD21 ASN 40 1HD2 ASN 40 6.112 13.540 -8.440 1039 HD22 ASN 40 2HD2 ASN 40 7.671 13.000 -7.935 1040 H GLN 41 H GLN 41 3.494 9.295 -10.724 1041 HA GLN 41 HA GLN 41 0.883 10.426 -10.559 1042 HB2 GLN 41 2HB GLN 41 2.000 8.457 -12.549 1043 HB3 GLN 41 1HB GLN 41 0.501 9.350 -12.733 1044 HG2 GLN 41 2HG GLN 41 3.251 10.579 -12.541 1045 HG3 GLN 41 1HG GLN 41 2.334 10.343 -14.023 1046 HE21 GLN 41 1HE2 GLN 41 -0.201 11.090 -12.889 1047 HE22 GLN 41 2HE2 GLN 41 -0.155 12.799 -12.630 1048 H ILE 42 H ILE 42 2.221 7.222 -10.025 1049 HA ILE 42 HA ILE 42 -0.324 5.954 -9.883 1050 HB ILE 42 HB ILE 42 2.386 4.972 -8.926 1051 HG12 ILE 42 2HG1 ILE 42 0.750 4.296 -11.391 1052 HG13 ILE 42 1HG1 ILE 42 2.183 5.313 -11.361 1053 HG21 ILE 42 1HG2 ILE 42 0.606 3.849 -7.665 1054 HG22 ILE 42 2HG2 ILE 42 1.346 2.730 -8.808 1055 HG23 ILE 42 3HG2 ILE 42 -0.225 3.449 -9.163 1056 HD11 ILE 42 1HD1 ILE 42 3.529 3.385 -10.690 1057 HD12 ILE 42 2HD1 ILE 42 2.673 3.084 -12.203 1058 HD13 ILE 42 3HD1 ILE 42 2.086 2.374 -10.698 1059 H VAL 43 H VAL 43 2.000 6.976 -7.356 1060 HA VAL 43 HA VAL 43 0.288 6.314 -5.189 1061 HB VAL 43 HB VAL 43 2.660 6.707 -4.724 1062 HG11 VAL 43 1HG1 VAL 43 3.133 8.406 -6.413 1063 HG12 VAL 43 2HG1 VAL 43 3.660 8.961 -4.823 1064 HG13 VAL 43 3HG1 VAL 43 2.164 9.582 -5.528 1065 HG21 VAL 43 1HG2 VAL 43 0.994 8.859 -3.418 1066 HG22 VAL 43 2HG2 VAL 43 2.520 8.220 -2.810 1067 HG23 VAL 43 3HG2 VAL 43 1.103 7.175 -2.907 1068 H GLY 44 H GLY 44 0.522 9.206 -7.175 1069 HA2 GLY 44 2HA GLY 44 -1.269 10.842 -5.739 1070 HA3 GLY 44 1HA GLY 44 -0.923 10.972 -7.462 1071 H TYR 45 H TYR 45 -1.781 8.506 -8.340 1072 HA TYR 45 HA TYR 45 -4.552 8.819 -8.586 1073 HB2 TYR 45 2HB TYR 45 -3.434 7.609 -10.326 1074 HB3 TYR 45 1HB TYR 45 -2.765 6.446 -9.182 1075 HD1 TYR 45 1HD TYR 45 -3.983 4.510 -8.563 1076 HD2 TYR 45 2HD TYR 45 -5.921 7.580 -10.754 1077 HE1 TYR 45 1HE TYR 45 -5.931 3.049 -8.864 1078 HE2 TYR 45 2HE TYR 45 -7.869 6.150 -11.066 1079 HH TYR 45 HH TYR 45 -8.228 3.186 -9.325 1080 H LEU 46 H LEU 46 -2.665 6.569 -6.661 1081 HA LEU 46 HA LEU 46 -4.856 5.122 -5.720 1082 HB2 LEU 46 2HB LEU 46 -2.063 5.375 -4.657 1083 HB3 LEU 46 1HB LEU 46 -3.223 4.188 -4.080 1084 HG LEU 46 HG LEU 46 -2.322 4.375 -6.960 1085 HD11 LEU 46 1HD1 LEU 46 -0.999 2.394 -6.527 1086 HD12 LEU 46 2HD1 LEU 46 -1.410 2.492 -4.811 1087 HD13 LEU 46 3HD1 LEU 46 -0.455 3.772 -5.570 1088 HD21 LEU 46 1HD2 LEU 46 -3.320 2.148 -7.137 1089 HD22 LEU 46 2HD2 LEU 46 -4.512 3.359 -6.688 1090 HD23 LEU 46 3HD2 LEU 46 -3.867 2.261 -5.465 1091 H LEU 47 H LEU 47 -3.281 7.940 -4.273 1092 HA LEU 47 HA LEU 47 -5.003 7.772 -2.009 1093 HB2 LEU 47 2HB LEU 47 -3.095 9.896 -2.919 1094 HB3 LEU 47 1HB LEU 47 -4.206 10.198 -1.606 1095 HG LEU 47 HG LEU 47 -3.200 8.292 -0.377 1096 HD11 LEU 47 1HD1 LEU 47 -2.289 6.974 -2.142 1097 HD12 LEU 47 2HD1 LEU 47 -1.009 7.475 -1.025 1098 HD13 LEU 47 3HD1 LEU 47 -1.179 8.276 -2.582 1099 HD21 LEU 47 1HD2 LEU 47 -1.145 9.463 0.261 1100 HD22 LEU 47 2HD2 LEU 47 -2.522 10.553 0.117 1101 HD23 LEU 47 3HD2 LEU 47 -1.309 10.498 -1.159 1102 H SER 48 H SER 48 -5.219 9.447 -5.087 1103 HA SER 48 HA SER 48 -7.419 11.081 -4.085 1104 HB2 SER 48 2HB SER 48 -6.245 10.956 -6.853 1105 HB3 SER 48 1HB SER 48 -7.268 12.232 -6.175 1106 HG SER 48 HG SER 48 -4.590 11.674 -5.797 1107 H GLY 49 H GLY 49 -6.944 8.218 -6.018 1108 HA2 GLY 49 2HA GLY 49 -8.398 6.727 -6.926 1109 HA3 GLY 49 1HA GLY 49 -9.693 7.546 -6.060 1110 H ASP 50 H ASP 50 -7.511 8.988 -8.472 1111 HA ASP 50 HA ASP 50 -9.881 9.409 -10.161 1112 HB2 ASP 50 2HB ASP 50 -9.302 11.467 -8.904 1113 HB3 ASP 50 1HB ASP 50 -7.706 11.443 -9.645 1114 HA PRO 51 HA PRO 51 -7.406 7.367 -13.222 1115 HB2 PRO 51 2HB PRO 51 -8.875 8.016 -15.409 1116 HB3 PRO 51 1HB PRO 51 -9.342 6.793 -14.222 1117 HG2 PRO 51 2HG PRO 51 -10.219 9.653 -14.416 1118 HG3 PRO 51 1HG PRO 51 -11.209 8.202 -14.163 1119 HD2 PRO 51 2HD PRO 51 -10.524 9.780 -12.123 1120 HD3 PRO 51 1HD PRO 51 -10.578 8.013 -11.935 1121 H ALA 52 H ALA 52 -7.959 10.814 -13.409 1122 HA ALA 52 HA ALA 52 -6.702 11.293 -15.891 1123 HB1 ALA 52 1HB ALA 52 -6.694 13.630 -15.298 1124 HB2 ALA 52 2HB ALA 52 -6.973 13.224 -13.605 1125 HB3 ALA 52 3HB ALA 52 -8.219 12.892 -14.806 1126 H TYR 53 H TYR 53 -5.334 10.471 -12.937 1127 HA TYR 53 HA TYR 53 -2.857 11.796 -13.149 1128 HB2 TYR 53 2HB TYR 53 -3.737 9.406 -11.600 1129 HB3 TYR 53 1HB TYR 53 -2.055 9.935 -11.591 1130 HD1 TYR 53 1HD TYR 53 -1.510 12.197 -10.884 1131 HD2 TYR 53 2HD TYR 53 -5.376 10.562 -10.324 1132 HE1 TYR 53 1HE TYR 53 -1.961 13.908 -9.274 1133 HE2 TYR 53 2HE TYR 53 -5.875 12.300 -8.669 1134 HH TYR 53 HH TYR 53 -3.903 15.036 -8.305 1135 H ILE 54 H ILE 54 -4.112 9.203 -14.955 1136 HA ILE 54 HA ILE 54 -1.404 8.358 -15.665 1137 HB ILE 54 HB ILE 54 -3.989 6.786 -15.961 1138 HG12 ILE 54 2HG1 ILE 54 -3.434 6.927 -13.606 1139 HG13 ILE 54 1HG1 ILE 54 -3.020 5.321 -14.193 1140 HG21 ILE 54 1HG2 ILE 54 -2.556 4.872 -16.519 1141 HG22 ILE 54 2HG2 ILE 54 -1.138 5.917 -16.446 1142 HG23 ILE 54 3HG2 ILE 54 -2.368 6.186 -17.683 1143 HD11 ILE 54 1HD1 ILE 54 -1.336 6.152 -12.675 1144 HD12 ILE 54 2HD1 ILE 54 -1.082 7.568 -13.688 1145 HD13 ILE 54 3HD1 ILE 54 -0.663 5.962 -14.291 1146 HA PRO 55 HA PRO 55 -2.148 10.400 -19.528 1147 HB2 PRO 55 2HB PRO 55 -0.148 9.230 -20.974 1148 HB3 PRO 55 1HB PRO 55 0.121 10.526 -19.797 1149 HG2 PRO 55 2HG PRO 55 0.419 7.571 -19.455 1150 HG3 PRO 55 1HG PRO 55 1.509 8.869 -18.932 1151 HD2 PRO 55 2HD PRO 55 -0.165 7.695 -17.216 1152 HD3 PRO 55 1HD PRO 55 0.175 9.435 -17.127 1153 H ARG 56 H ARG 56 -2.711 9.962 -21.694 1154 HA ARG 56 HA ARG 56 -4.254 7.499 -21.908 1155 HB2 ARG 56 2HB ARG 56 -4.380 10.055 -23.542 1156 HB3 ARG 56 1HB ARG 56 -5.396 8.656 -23.817 1157 HG2 ARG 56 2HG ARG 56 -6.673 10.319 -22.631 1158 HG3 ARG 56 1HG ARG 56 -6.365 8.980 -21.535 1159 HD2 ARG 56 2HD ARG 56 -4.527 10.261 -20.509 1160 HD3 ARG 56 1HD ARG 56 -4.847 11.581 -21.631 1161 HE ARG 56 HE ARG 56 -7.213 11.173 -20.384 1162 HH11 ARG 56 1HH1 ARG 56 -3.947 11.904 -19.234 1163 HH12 ARG 56 2HH1 ARG 56 -4.480 12.768 -17.859 1164 HH21 ARG 56 1HH2 ARG 56 -7.925 12.381 -18.503 1165 HH22 ARG 56 2HH2 ARG 56 -6.759 13.052 -17.454 1166 H TYR 57 H TYR 57 -1.317 8.116 -22.460 1167 HA TYR 57 HA TYR 57 -0.614 7.740 -25.126 1168 HB2 TYR 57 2HB TYR 57 0.994 8.330 -23.367 1169 HB3 TYR 57 1HB TYR 57 0.800 6.746 -22.641 1170 HD1 TYR 57 1HD TYR 57 1.642 8.145 -26.026 1171 HD2 TYR 57 2HD TYR 57 2.567 5.292 -23.003 1172 HE1 TYR 57 1HE TYR 57 3.543 7.359 -27.357 1173 HE2 TYR 57 2HE TYR 57 4.475 4.498 -24.339 1174 HH TYR 57 HH TYR 57 5.224 4.483 -26.662 1175 H GLN 58 H GLN 58 -1.559 5.392 -22.731 1176 HA GLN 58 HA GLN 58 -1.894 3.429 -24.849 1177 HB2 GLN 58 2HB GLN 58 -0.455 2.928 -22.245 1178 HB3 GLN 58 1HB GLN 58 -1.112 1.639 -23.236 1179 HG2 GLN 58 2HG GLN 58 0.371 2.288 -25.059 1180 HG3 GLN 58 1HG GLN 58 1.021 3.594 -24.063 1181 HE21 GLN 58 1HE2 GLN 58 2.350 3.091 -22.362 1182 HE22 GLN 58 2HE2 GLN 58 3.101 1.556 -22.197 1183 H ASP 59 H ASP 59 -2.992 1.451 -23.764 1184 HA ASP 59 HA ASP 59 -5.532 2.278 -22.854 1185 HB2 ASP 59 2HB ASP 59 -6.067 -0.096 -22.834 1186 HB3 ASP 59 1HB ASP 59 -5.163 0.296 -24.293 1187 H ALA 60 H ALA 60 -2.661 1.796 -21.300 1188 HA ALA 60 HA ALA 60 -3.087 0.608 -18.857 1189 HB1 ALA 60 1HB ALA 60 -1.270 1.959 -18.008 1190 HB2 ALA 60 2HB ALA 60 -1.483 3.113 -19.330 1191 HB3 ALA 60 3HB ALA 60 -0.941 1.477 -19.673 1192 H ARG 61 H ARG 61 -3.989 3.840 -19.863 1193 HA ARG 61 HA ARG 61 -4.823 4.934 -17.427 1194 HB2 ARG 61 2HB ARG 61 -4.453 6.246 -19.481 1195 HB3 ARG 61 1HB ARG 61 -5.758 5.396 -20.266 1196 HG2 ARG 61 2HG ARG 61 -6.175 7.253 -17.916 1197 HG3 ARG 61 1HG ARG 61 -6.212 7.790 -19.588 1198 HD2 ARG 61 2HD ARG 61 -8.043 6.134 -19.998 1199 HD3 ARG 61 1HD ARG 61 -8.033 5.776 -18.277 1200 HE ARG 61 HE ARG 61 -8.403 8.545 -18.992 1201 HH11 ARG 61 1HH1 ARG 61 -9.951 5.498 -18.053 1202 HH12 ARG 61 2HH1 ARG 61 -11.460 6.190 -17.741 1203 HH21 ARG 61 1HH2 ARG 61 -10.501 9.507 -18.552 1204 HH22 ARG 61 2HH2 ARG 61 -11.784 8.523 -18.028 1205 H ASN 62 H ASN 62 -6.537 2.968 -19.805 1206 HA ASN 62 HA ASN 62 -8.996 2.970 -18.342 1207 HB2 ASN 62 2HB ASN 62 -8.098 1.237 -20.656 1208 HB3 ASN 62 1HB ASN 62 -9.732 1.278 -19.997 1209 HD21 ASN 62 1HD2 ASN 62 -11.027 3.089 -20.378 1210 HD22 ASN 62 2HD2 ASN 62 -10.642 4.258 -21.571 1211 H LEU 63 H LEU 63 -6.262 0.814 -18.716 1212 HA LEU 63 HA LEU 63 -7.256 -1.457 -17.404 1213 HB2 LEU 63 2HB LEU 63 -4.422 -0.439 -17.428 1214 HB3 LEU 63 1HB LEU 63 -4.917 -2.028 -16.893 1215 HG LEU 63 HG LEU 63 -5.125 -0.965 -19.704 1216 HD11 LEU 63 1HD1 LEU 63 -2.828 -1.429 -18.957 1217 HD12 LEU 63 2HD1 LEU 63 -3.371 -2.581 -20.176 1218 HD13 LEU 63 3HD1 LEU 63 -3.327 -3.044 -18.476 1219 HD21 LEU 63 1HD2 LEU 63 -5.750 -3.271 -20.277 1220 HD22 LEU 63 2HD2 LEU 63 -6.940 -2.527 -19.215 1221 HD23 LEU 63 3HD2 LEU 63 -5.782 -3.692 -18.565 1222 H ILE 64 H ILE 64 -5.632 1.390 -16.070 1223 HA ILE 64 HA ILE 64 -5.531 0.292 -13.460 1224 HB ILE 64 HB ILE 64 -3.990 2.105 -14.337 1225 HG12 ILE 64 2HG1 ILE 64 -5.411 2.827 -11.762 1226 HG13 ILE 64 1HG1 ILE 64 -4.200 1.561 -11.909 1227 HG21 ILE 64 1HG2 ILE 64 -4.765 4.448 -14.180 1228 HG22 ILE 64 2HG2 ILE 64 -6.391 3.860 -13.852 1229 HG23 ILE 64 3HG2 ILE 64 -5.635 3.529 -15.410 1230 HD11 ILE 64 1HD1 ILE 64 -2.547 3.245 -12.580 1231 HD12 ILE 64 2HD1 ILE 64 -3.228 3.567 -10.987 1232 HD13 ILE 64 3HD1 ILE 64 -3.769 4.504 -12.381 1233 H ARG 65 H ARG 65 -8.045 1.660 -15.273 1234 HA ARG 65 HA ARG 65 -9.630 2.116 -12.870 1235 HB2 ARG 65 2HB ARG 65 -10.142 2.930 -15.721 1236 HB3 ARG 65 1HB ARG 65 -11.324 3.098 -14.430 1237 HG2 ARG 65 2HG ARG 65 -8.642 4.444 -14.614 1238 HG3 ARG 65 1HG ARG 65 -10.248 5.176 -14.768 1239 HD2 ARG 65 2HD ARG 65 -9.087 3.910 -12.260 1240 HD3 ARG 65 1HD ARG 65 -9.342 5.613 -12.546 1241 HE ARG 65 HE ARG 65 -11.715 5.231 -12.525 1242 HH11 ARG 65 1HH1 ARG 65 -9.707 2.579 -11.174 1243 HH12 ARG 65 2HH1 ARG 65 -11.022 1.931 -10.292 1244 HH21 ARG 65 1HH2 ARG 65 -13.442 4.281 -11.129 1245 HH22 ARG 65 2HH2 ARG 65 -13.023 2.869 -10.244 1246 H ARG 66 H ARG 66 -8.822 -0.329 -14.646 1247 HA ARG 66 HA ARG 66 -11.452 -1.515 -14.916 1248 HB2 ARG 66 2HB ARG 66 -9.690 -1.802 -16.692 1249 HB3 ARG 66 1HB ARG 66 -8.710 -2.669 -15.527 1250 HG2 ARG 66 2HG ARG 66 -9.853 -4.162 -17.078 1251 HG3 ARG 66 1HG ARG 66 -10.374 -4.430 -15.411 1252 HD2 ARG 66 2HD ARG 66 -12.375 -3.122 -15.808 1253 HD3 ARG 66 1HD ARG 66 -11.841 -2.766 -17.451 1254 HE ARG 66 HE ARG 66 -11.925 -5.261 -17.733 1255 HH11 ARG 66 1HH1 ARG 66 -14.117 -3.537 -15.505 1256 HH12 ARG 66 2HH1 ARG 66 -15.382 -4.654 -15.696 1257 HH21 ARG 66 1HH2 ARG 66 -13.687 -6.743 -18.005 1258 HH22 ARG 66 2HH2 ARG 66 -15.163 -6.511 -17.186 1259 H HIS 67 H HIS 67 -9.375 -0.882 -12.573 1260 HA HIS 67 HA HIS 67 -10.385 -2.943 -10.812 1261 HB2 HIS 67 2HB HIS 67 -7.434 -2.227 -11.017 1262 HB3 HIS 67 1HB HIS 67 -8.158 -3.161 -9.719 1263 HD1 HIS 67 1HD HIS 67 -8.856 -5.597 -10.277 1264 HD2 HIS 67 2HD HIS 67 -6.929 -3.588 -13.369 1265 HE1 HIS 67 1HE HIS 67 -8.129 -7.384 -11.926 1266 HE2 HIS 67 2HE HIS 67 -7.284 -6.047 -13.912 1267 H GLU 68 H GLU 68 -10.533 -2.149 -8.726 1268 HA GLU 68 HA GLU 68 -10.479 0.723 -8.593 1269 HB2 GLU 68 2HB GLU 68 -11.374 -1.363 -6.615 1270 HB3 GLU 68 1HB GLU 68 -11.410 0.366 -6.292 1271 HG2 GLU 68 2HG GLU 68 -12.881 -1.025 -8.517 1272 HG3 GLU 68 1HG GLU 68 -13.589 -0.476 -6.999 1273 H ARG 69 H ARG 69 -9.512 1.833 -6.787 1274 HA ARG 69 HA ARG 69 -6.759 1.398 -6.754 1275 HB2 ARG 69 2HB ARG 69 -6.649 3.215 -5.137 1276 HB3 ARG 69 1HB ARG 69 -7.779 3.586 -6.425 1277 HG2 ARG 69 2HG ARG 69 -9.641 2.902 -4.943 1278 HG3 ARG 69 1HG ARG 69 -8.471 2.685 -3.643 1279 HD2 ARG 69 2HD ARG 69 -7.838 5.034 -3.829 1280 HD3 ARG 69 1HD ARG 69 -9.013 5.249 -5.127 1281 HE ARG 69 HE ARG 69 -9.542 4.915 -2.295 1282 HH11 ARG 69 1HH1 ARG 69 -10.914 5.092 -5.563 1283 HH12 ARG 69 2HH1 ARG 69 -12.451 5.560 -5.025 1284 HH21 ARG 69 1HH2 ARG 69 -11.640 5.549 -1.584 1285 HH22 ARG 69 2HH2 ARG 69 -12.902 5.795 -2.691 1286 H ASP 70 H ASP 70 -9.248 0.246 -4.562 1287 HA ASP 70 HA ASP 70 -7.488 -0.415 -2.446 1288 HB2 ASP 70 2HB ASP 70 -9.340 -1.691 -1.488 1289 HB3 ASP 70 1HB ASP 70 -9.927 -0.150 -2.080 1290 H GLU 71 H GLU 71 -8.758 -2.187 -5.217 1291 HA GLU 71 HA GLU 71 -7.740 -4.748 -4.712 1292 HB2 GLU 71 2HB GLU 71 -8.011 -3.296 -7.344 1293 HB3 GLU 71 1HB GLU 71 -7.689 -5.008 -7.182 1294 HG2 GLU 71 2HG GLU 71 -9.860 -5.318 -6.140 1295 HG3 GLU 71 1HG GLU 71 -10.173 -3.583 -6.272 1296 H ILE 72 H ILE 72 -6.356 -1.964 -6.242 1297 HA ILE 72 HA ILE 72 -3.932 -3.177 -7.029 1298 HB ILE 72 HB ILE 72 -4.635 -0.265 -6.659 1299 HG12 ILE 72 2HG1 ILE 72 -4.561 -1.985 -9.152 1300 HG13 ILE 72 1HG1 ILE 72 -6.019 -1.466 -8.315 1301 HG21 ILE 72 1HG2 ILE 72 -2.270 -1.524 -8.058 1302 HG22 ILE 72 2HG2 ILE 72 -2.223 -0.549 -6.595 1303 HG23 ILE 72 3HG2 ILE 72 -2.689 0.193 -8.125 1304 HD11 ILE 72 1HD1 ILE 72 -5.485 0.855 -8.849 1305 HD12 ILE 72 2HD1 ILE 72 -5.605 -0.137 -10.303 1306 HD13 ILE 72 3HD1 ILE 72 -4.022 0.328 -9.681 1307 H MET 73 H MET 73 -4.770 -1.031 -4.326 1308 HA MET 73 HA MET 73 -2.135 -0.919 -3.349 1309 HB2 MET 73 2HB MET 73 -3.922 0.788 -2.934 1310 HB3 MET 73 1HB MET 73 -4.672 -0.326 -1.810 1311 HG2 MET 73 2HG MET 73 -1.882 0.773 -1.514 1312 HG3 MET 73 1HG MET 73 -3.291 1.480 -0.748 1313 HE1 MET 73 1HE MET 73 -0.630 0.672 0.728 1314 HE2 MET 73 2HE MET 73 -1.251 -0.115 2.180 1315 HE3 MET 73 3HE MET 73 -2.012 1.358 1.576 1316 H GLU 74 H GLU 74 -4.881 -3.036 -2.458 1317 HA GLU 74 HA GLU 74 -3.626 -4.237 -0.243 1318 HB2 GLU 74 2HB GLU 74 -5.167 -6.144 -0.564 1319 HB3 GLU 74 1HB GLU 74 -6.022 -4.614 -0.693 1320 HG2 GLU 74 2HG GLU 74 -6.074 -4.797 -3.092 1321 HG3 GLU 74 1HG GLU 74 -5.068 -6.235 -3.039 1322 H GLU 75 H GLU 75 -3.430 -4.864 -3.665 1323 HA GLU 75 HA GLU 75 -1.975 -7.287 -3.451 1324 HB2 GLU 75 2HB GLU 75 -3.400 -6.486 -5.403 1325 HB3 GLU 75 1HB GLU 75 -2.070 -5.413 -5.801 1326 HG2 GLU 75 2HG GLU 75 -2.060 -7.457 -7.149 1327 HG3 GLU 75 1HG GLU 75 -0.609 -7.307 -6.158 1328 H LEU 76 H LEU 76 -1.152 -3.887 -3.837 1329 HA LEU 76 HA LEU 76 1.628 -4.131 -4.173 1330 HB2 LEU 76 2HB LEU 76 0.108 -1.962 -2.718 1331 HB3 LEU 76 1HB LEU 76 1.783 -1.867 -3.204 1332 HG LEU 76 HG LEU 76 -0.585 -1.999 -5.073 1333 HD11 LEU 76 1HD1 LEU 76 -0.011 0.320 -5.576 1334 HD12 LEU 76 2HD1 LEU 76 1.268 0.272 -4.364 1335 HD13 LEU 76 3HD1 LEU 76 -0.417 0.122 -3.871 1336 HD21 LEU 76 1HD2 LEU 76 1.393 -3.042 -6.045 1337 HD22 LEU 76 2HD2 LEU 76 2.352 -1.621 -5.619 1338 HD23 LEU 76 3HD2 LEU 76 1.056 -1.485 -6.805 1339 H THR 77 H THR 77 -0.353 -3.732 -1.211 1340 HA THR 77 HA THR 77 1.739 -3.764 0.608 1341 HB THR 77 HB THR 77 -1.114 -4.710 0.972 1342 HG1 THR 77 1HG THR 77 -1.266 -2.571 0.430 1343 HG21 THR 77 1HG2 THR 77 -0.761 -4.176 3.349 1344 HG22 THR 77 2HG2 THR 77 0.919 -3.763 3.009 1345 HG23 THR 77 3HG2 THR 77 0.364 -5.425 2.815 1346 H LYS 78 H LYS 78 -0.196 -6.456 -0.671 1347 HA LYS 78 HA LYS 78 0.942 -8.436 0.960 1348 HB2 LYS 78 2HB LYS 78 -0.269 -8.669 -1.750 1349 HB3 LYS 78 1HB LYS 78 0.159 -10.055 -0.757 1350 HG2 LYS 78 2HG LYS 78 -1.412 -9.246 0.957 1351 HG3 LYS 78 1HG LYS 78 -1.896 -7.945 -0.124 1352 HD2 LYS 78 2HD LYS 78 -2.171 -10.910 -0.661 1353 HD3 LYS 78 1HD LYS 78 -3.484 -9.800 -0.273 1354 HE2 LYS 78 2HE LYS 78 -3.079 -8.544 -2.276 1355 HE3 LYS 78 1HE LYS 78 -1.668 -9.543 -2.644 1356 HZ1 LYS 78 1HZ LYS 78 -4.469 -10.508 -2.573 1357 HZ2 LYS 78 2HZ LYS 78 -3.074 -11.405 -2.957 1358 HZ3 LYS 78 3HZ LYS 78 -3.526 -10.125 -3.950 1359 H TYR 79 H TYR 79 1.691 -7.569 -2.382 1360 HA TYR 79 HA TYR 79 3.711 -9.494 -2.663 1361 HB2 TYR 79 2HB TYR 79 2.575 -8.389 -4.547 1362 HB3 TYR 79 1HB TYR 79 3.407 -6.893 -4.146 1363 HD1 TYR 79 1HD TYR 79 4.157 -10.445 -4.900 1364 HD2 TYR 79 2HD TYR 79 5.326 -6.400 -5.282 1365 HE1 TYR 79 1HE TYR 79 6.018 -11.137 -6.358 1366 HE2 TYR 79 2HE TYR 79 7.196 -7.059 -6.737 1367 HH TYR 79 HH TYR 79 7.396 -10.153 -8.071 1368 H TYR 80 H TYR 80 3.772 -6.251 -1.439 1369 HA TYR 80 HA TYR 80 6.549 -5.835 -1.333 1370 HB2 TYR 80 2HB TYR 80 4.737 -4.133 -1.044 1371 HB3 TYR 80 1HB TYR 80 4.389 -4.835 0.522 1372 HD1 TYR 80 1HD TYR 80 6.840 -2.968 -1.448 1373 HD2 TYR 80 2HD TYR 80 5.724 -4.272 2.433 1374 HE1 TYR 80 1HE TYR 80 8.441 -1.402 -0.476 1375 HE2 TYR 80 2HE TYR 80 7.327 -2.706 3.427 1376 HH TYR 80 HH TYR 80 8.783 -0.222 1.611 1377 H LEU 81 H LEU 81 4.227 -7.067 1.071 1378 HA LEU 81 HA LEU 81 6.212 -7.672 2.999 1379 HB2 LEU 81 2HB LEU 81 3.341 -8.536 2.805 1380 HB3 LEU 81 1HB LEU 81 4.371 -8.838 4.192 1381 HG LEU 81 HG LEU 81 3.558 -6.116 3.166 1382 HD11 LEU 81 1HD1 LEU 81 2.710 -7.645 5.603 1383 HD12 LEU 81 2HD1 LEU 81 1.708 -7.320 4.188 1384 HD13 LEU 81 3HD1 LEU 81 2.244 -5.987 5.215 1385 HD21 LEU 81 1HD2 LEU 81 4.579 -5.292 5.243 1386 HD22 LEU 81 2HD2 LEU 81 5.764 -6.057 4.192 1387 HD23 LEU 81 3HD2 LEU 81 5.148 -6.922 5.604 1388 H ALA 82 H ALA 82 4.754 -9.469 0.405 1389 HA ALA 82 HA ALA 82 5.328 -12.079 1.187 1390 HB1 ALA 82 1HB ALA 82 5.237 -10.925 -1.596 1391 HB2 ALA 82 2HB ALA 82 3.849 -11.502 -0.679 1392 HB3 ALA 82 3HB ALA 82 5.108 -12.631 -1.182 1393 H ASN 83 H ASN 83 7.321 -9.627 -0.247 1394 HA ASN 83 HA ASN 83 9.443 -11.448 -0.845 1395 HB2 ASN 83 2HB ASN 83 9.171 -8.491 -1.108 1396 HB3 ASN 83 1HB ASN 83 10.761 -9.238 -1.263 1397 HD21 ASN 83 1HD2 ASN 83 7.541 -8.946 -2.711 1398 HD22 ASN 83 2HD2 ASN 83 8.027 -9.666 -4.206 1399 H HIS 84 H HIS 84 8.430 -10.478 2.021 1400 HA HIS 84 HA HIS 84 11.131 -10.466 3.157 1401 HB2 HIS 84 2HB HIS 84 8.446 -9.973 4.474 1402 HB3 HIS 84 1HB HIS 84 9.929 -10.166 5.387 1403 HD1 HIS 84 1HD HIS 84 11.716 -8.222 5.109 1404 HD2 HIS 84 2HD HIS 84 7.994 -7.477 3.449 1405 HE1 HIS 84 1HE HIS 84 11.655 -5.768 4.678 1406 HE2 HIS 84 2HE HIS 84 9.686 -5.562 3.194 1407 H GLY 85 H GLY 85 9.119 -12.695 2.011 1408 HA2 GLY 85 2HA GLY 85 9.273 -15.008 2.307 1409 HA3 GLY 85 1HA GLY 85 10.181 -14.722 3.790 1410 H ILE 86 H ILE 86 7.228 -13.075 3.252 1411 HA ILE 86 HA ILE 86 6.112 -14.494 5.541 1412 HB ILE 86 HB ILE 86 5.402 -11.809 4.344 1413 HG12 ILE 86 2HG1 ILE 86 6.754 -12.551 6.948 1414 HG13 ILE 86 1HG1 ILE 86 7.530 -11.823 5.549 1415 HG21 ILE 86 1HG2 ILE 86 3.917 -11.510 6.273 1416 HG22 ILE 86 2HG2 ILE 86 4.252 -13.167 6.783 1417 HG23 ILE 86 3HG2 ILE 86 3.410 -12.858 5.262 1418 HD11 ILE 86 1HD1 ILE 86 7.095 -10.195 7.311 1419 HD12 ILE 86 2HD1 ILE 86 5.369 -10.575 7.209 1420 HD13 ILE 86 3HD1 ILE 86 6.184 -9.820 5.841 1421 H ASP 87 H ASP 87 4.405 -15.743 5.371 1422 HA ASP 87 HA ASP 87 3.017 -16.062 2.839 1423 HB2 ASP 87 2HB ASP 87 3.494 -18.089 4.142 1424 HB3 ASP 87 1HB ASP 87 2.633 -17.419 5.525 1425 H ILE 88 H ILE 88 1.006 -15.239 2.450 1426 HA ILE 88 HA ILE 88 -0.017 -13.519 4.591 1427 HB ILE 88 HB ILE 88 -0.020 -13.091 1.617 1428 HG12 ILE 88 2HG1 ILE 88 1.317 -11.619 3.883 1429 HG13 ILE 88 1HG1 ILE 88 2.101 -12.696 2.738 1430 HG21 ILE 88 1HG2 ILE 88 -1.241 -11.296 3.716 1431 HG22 ILE 88 2HG2 ILE 88 -2.138 -12.261 2.537 1432 HG23 ILE 88 3HG2 ILE 88 -1.097 -10.947 1.993 1433 HD11 ILE 88 1HD1 ILE 88 2.503 -10.381 2.220 1434 HD12 ILE 88 2HD1 ILE 88 0.760 -10.103 2.102 1435 HD13 ILE 88 3HD1 ILE 88 1.564 -11.160 0.945 1436 H LYS 89 H LYS 89 -2.144 -13.376 4.995 1437 HA LYS 89 HA LYS 89 -3.960 -15.060 3.565 1438 HB2 LYS 89 2HB LYS 89 -4.878 -16.072 5.630 1439 HB3 LYS 89 1HB LYS 89 -3.212 -16.538 5.393 1440 HG2 LYS 89 2HG LYS 89 -4.123 -14.385 7.317 1441 HG3 LYS 89 1HG LYS 89 -3.869 -16.064 7.760 1442 HD2 LYS 89 2HD LYS 89 -1.744 -14.210 6.655 1443 HD3 LYS 89 1HD LYS 89 -1.972 -14.580 8.362 1444 HE2 LYS 89 2HE LYS 89 -1.545 -16.967 7.866 1445 HE3 LYS 89 1HE LYS 89 -1.253 -16.549 6.178 1446 HZ1 LYS 89 1HZ LYS 89 0.813 -16.775 7.483 1447 HZ2 LYS 89 2HZ LYS 89 0.314 -15.532 8.482 1448 HZ3 LYS 89 3HZ LYS 89 0.656 -15.213 6.883 Start of MODEL 17 1 H1 MET 1 1HT MET 1 -0.394 -27.159 -14.417 2 H2 MET 1 2HT MET 1 -1.026 -26.848 -15.949 3 H3 MET 1 3HT MET 1 -2.048 -26.983 -14.581 4 HA MET 1 HA MET 1 0.020 -24.940 -14.865 5 HB2 MET 1 2HB MET 1 -2.984 -24.704 -15.208 6 HB3 MET 1 1HB MET 1 -1.895 -23.335 -15.076 7 HG2 MET 1 2HG MET 1 -0.780 -24.018 -17.128 8 HG3 MET 1 1HG MET 1 -1.847 -25.409 -17.258 9 HE1 MET 1 1HE MET 1 -3.055 -23.098 -20.179 10 HE2 MET 1 2HE MET 1 -2.519 -24.718 -19.732 11 HE3 MET 1 3HE MET 1 -1.404 -23.355 -19.617 12 H GLY 2 H GLY 2 0.144 -23.541 -13.098 13 HA2 GLY 2 2HA GLY 2 -1.668 -23.715 -10.919 14 HA3 GLY 2 1HA GLY 2 -0.185 -24.611 -10.606 15 H PHE 3 H PHE 3 -0.672 -22.598 -8.975 16 HA PHE 3 HA PHE 3 0.903 -20.313 -9.931 17 HB2 PHE 3 2HB PHE 3 -1.308 -19.830 -8.900 18 HB3 PHE 3 1HB PHE 3 -0.799 -20.661 -7.440 19 HD1 PHE 3 1HD PHE 3 0.622 -19.569 -5.835 20 HD2 PHE 3 2HD PHE 3 -0.355 -17.662 -9.507 21 HE1 PHE 3 1HE PHE 3 1.475 -17.442 -4.950 22 HE2 PHE 3 2HE PHE 3 0.498 -15.533 -8.628 23 HZ PHE 3 HZ PHE 3 1.414 -15.419 -6.347 24 H THR 4 H THR 4 3.053 -20.450 -9.456 25 HA THR 4 HA THR 4 3.707 -21.788 -6.986 26 HB THR 4 HB THR 4 4.097 -23.490 -8.578 27 HG1 THR 4 1HG THR 4 5.769 -23.241 -7.051 28 HG21 THR 4 1HG2 THR 4 5.713 -21.517 -10.199 29 HG22 THR 4 2HG2 THR 4 4.133 -22.171 -10.629 30 HG23 THR 4 3HG2 THR 4 5.537 -23.234 -10.569 31 H ASP 5 H ASP 5 3.940 -19.818 -6.031 32 HA ASP 5 HA ASP 5 6.535 -18.568 -6.562 33 HB2 ASP 5 2HB ASP 5 3.965 -17.239 -5.652 34 HB3 ASP 5 1HB ASP 5 5.538 -16.483 -5.444 35 H GLU 6 H GLU 6 7.808 -19.375 -5.110 36 HA GLU 6 HA GLU 6 6.718 -20.396 -2.645 37 HB2 GLU 6 2HB GLU 6 9.549 -20.456 -3.670 38 HB3 GLU 6 1HB GLU 6 8.928 -21.362 -2.298 39 HG2 GLU 6 2HG GLU 6 7.419 -22.585 -3.809 40 HG3 GLU 6 1HG GLU 6 8.091 -21.696 -5.175 41 H THR 7 H THR 7 6.472 -19.130 -0.985 42 HA THR 7 HA THR 7 8.389 -16.978 -0.528 43 HB THR 7 HB THR 7 5.587 -17.366 0.585 44 HG1 THR 7 1HG THR 7 5.161 -16.723 -1.388 45 HG21 THR 7 1HG2 THR 7 7.459 -14.981 0.720 46 HG22 THR 7 2HG2 THR 7 7.050 -16.039 2.069 47 HG23 THR 7 3HG2 THR 7 5.808 -15.023 1.338 48 H VAL 8 H VAL 8 9.571 -17.017 1.352 49 HA VAL 8 HA VAL 8 9.091 -19.239 3.204 50 HB VAL 8 HB VAL 8 11.529 -19.339 3.592 51 HG11 VAL 8 1HG1 VAL 8 10.630 -20.858 1.935 52 HG12 VAL 8 2HG1 VAL 8 12.246 -20.292 1.481 53 HG13 VAL 8 3HG1 VAL 8 10.829 -19.618 0.683 54 HG21 VAL 8 1HG2 VAL 8 13.096 -18.180 2.101 55 HG22 VAL 8 2HG2 VAL 8 12.130 -17.047 3.048 56 HG23 VAL 8 3HG2 VAL 8 11.746 -17.331 1.347 57 H ARG 9 H ARG 9 9.366 -18.701 5.416 58 HA ARG 9 HA ARG 9 9.237 -15.920 5.915 59 HB2 ARG 9 2HB ARG 9 9.185 -18.247 7.822 60 HB3 ARG 9 1HB ARG 9 9.253 -16.584 8.404 61 HG2 ARG 9 2HG ARG 9 7.207 -16.064 7.186 62 HG3 ARG 9 1HG ARG 9 7.134 -17.713 6.591 63 HD2 ARG 9 2HD ARG 9 6.988 -16.878 9.480 64 HD3 ARG 9 1HD ARG 9 5.607 -17.291 8.467 65 HE ARG 9 HE ARG 9 7.758 -19.191 9.115 66 HH11 ARG 9 1HH1 ARG 9 4.294 -18.473 8.716 67 HH12 ARG 9 2HH1 ARG 9 3.805 -20.029 9.201 68 HH21 ARG 9 1HH2 ARG 9 7.059 -21.266 9.778 69 HH22 ARG 9 2HH2 ARG 9 5.377 -21.649 9.808 70 H PHE 10 H PHE 10 10.709 -14.696 5.748 71 HA PHE 10 HA PHE 10 13.400 -15.425 6.652 72 HB2 PHE 10 2HB PHE 10 13.169 -15.328 4.173 73 HB3 PHE 10 1HB PHE 10 12.622 -13.667 4.316 74 HD1 PHE 10 1HD PHE 10 15.454 -15.917 4.748 75 HD2 PHE 10 2HD PHE 10 14.149 -11.887 4.553 76 HE1 PHE 10 1HE PHE 10 17.791 -15.172 4.586 77 HE2 PHE 10 2HE PHE 10 16.476 -11.121 4.387 78 HZ PHE 10 HZ PHE 10 18.309 -12.769 4.404 79 H ASP 11 H ASP 11 13.440 -14.433 8.567 80 HA ASP 11 HA ASP 11 12.713 -11.604 8.683 81 HB2 ASP 11 2HB ASP 11 13.009 -13.620 10.929 82 HB3 ASP 11 1HB ASP 11 12.772 -11.900 11.178 83 H PHE 12 H PHE 12 14.581 -10.903 7.733 84 HA PHE 12 HA PHE 12 16.784 -10.759 9.570 85 HB2 PHE 12 2HB PHE 12 17.398 -12.673 8.206 86 HB3 PHE 12 1HB PHE 12 17.103 -11.766 6.734 87 HD1 PHE 12 1HD PHE 12 19.233 -11.748 9.789 88 HD2 PHE 12 2HD PHE 12 18.867 -10.687 5.685 89 HE1 PHE 12 1HE PHE 12 21.590 -11.046 9.760 90 HE2 PHE 12 2HE PHE 12 21.223 -9.986 5.652 91 HZ PHE 12 HZ PHE 12 22.589 -10.167 7.694 92 H ASP 13 H ASP 13 16.818 -8.667 9.873 93 HA ASP 13 HA ASP 13 16.448 -6.894 7.610 94 HB2 ASP 13 2HB ASP 13 16.248 -5.075 9.266 95 HB3 ASP 13 1HB ASP 13 15.113 -6.369 9.600 96 H ASP 14 H ASP 14 17.992 -5.684 6.798 97 HA ASP 14 HA ASP 14 20.557 -5.306 7.998 98 HB2 ASP 14 2HB ASP 14 20.911 -7.576 7.331 99 HB3 ASP 14 1HB ASP 14 20.173 -7.304 5.767 100 H ASN 15 H ASN 15 21.309 -3.449 7.234 101 HA ASN 15 HA ASN 15 21.631 -1.573 6.040 102 HB2 ASN 15 2HB ASN 15 22.413 -3.027 4.213 103 HB3 ASN 15 1HB ASN 15 20.755 -3.239 3.664 104 HD21 ASN 15 1HD2 ASN 15 21.212 -2.429 1.663 105 HD22 ASN 15 2HD2 ASN 15 21.522 -0.770 1.335 106 H ARG 16 H ARG 16 20.303 -0.063 6.677 107 HA ARG 16 HA ARG 16 17.546 -0.463 6.126 108 HB2 ARG 16 2HB ARG 16 16.953 1.544 7.522 109 HB3 ARG 16 1HB ARG 16 17.720 0.214 8.355 110 HG2 ARG 16 2HG ARG 16 19.206 2.693 7.485 111 HG3 ARG 16 1HG ARG 16 18.383 2.562 9.034 112 HD2 ARG 16 2HD ARG 16 19.783 0.613 9.587 113 HD3 ARG 16 1HD ARG 16 20.625 0.794 8.050 114 HE ARG 16 HE ARG 16 20.912 3.202 9.162 115 HH11 ARG 16 1HH1 ARG 16 21.563 -0.061 10.409 116 HH12 ARG 16 2HH1 ARG 16 22.865 0.414 11.395 117 HH21 ARG 16 1HH2 ARG 16 22.720 3.848 10.555 118 HH22 ARG 16 2HH2 ARG 16 23.509 2.668 11.496 119 H LYS 17 H LYS 17 17.864 -0.387 3.964 120 HA LYS 17 HA LYS 17 16.940 2.254 2.988 121 HB2 LYS 17 2HB LYS 17 18.156 0.000 1.358 122 HB3 LYS 17 1HB LYS 17 17.606 1.544 0.725 123 HG2 LYS 17 2HG LYS 17 19.325 2.654 2.119 124 HG3 LYS 17 1HG LYS 17 19.918 1.057 2.567 125 HD2 LYS 17 2HD LYS 17 20.282 0.529 0.254 126 HD3 LYS 17 1HD LYS 17 19.715 2.131 -0.228 127 HE2 LYS 17 2HE LYS 17 22.160 1.487 1.438 128 HE3 LYS 17 1HE LYS 17 22.163 2.116 -0.206 129 HZ1 LYS 17 1HZ LYS 17 21.235 3.526 2.239 130 HZ2 LYS 17 2HZ LYS 17 21.092 4.196 0.713 131 HZ3 LYS 17 3HZ LYS 17 22.611 3.861 1.365 132 H LYS 18 H LYS 18 16.142 -0.405 4.146 133 HA LYS 18 HA LYS 18 13.614 -0.836 2.688 134 HB2 LYS 18 2HB LYS 18 13.802 -3.220 3.331 135 HB3 LYS 18 1HB LYS 18 15.180 -2.717 2.357 136 HG2 LYS 18 2HG LYS 18 16.509 -2.469 4.440 137 HG3 LYS 18 1HG LYS 18 15.137 -3.080 5.354 138 HD2 LYS 18 2HD LYS 18 16.758 -4.855 4.964 139 HD3 LYS 18 1HD LYS 18 15.269 -5.199 4.079 140 HE2 LYS 18 2HE LYS 18 16.277 -4.395 2.022 141 HE3 LYS 18 1HE LYS 18 17.740 -3.930 2.888 142 HZ1 LYS 18 1HZ LYS 18 16.725 -6.712 2.624 143 HZ2 LYS 18 2HZ LYS 18 18.172 -6.248 3.345 144 HZ3 LYS 18 3HZ LYS 18 17.953 -6.044 1.702 145 H ALA 19 H ALA 19 14.398 0.941 4.859 146 HA ALA 19 HA ALA 19 13.877 -0.030 7.458 147 HB1 ALA 19 1HB ALA 19 15.072 2.046 6.966 148 HB2 ALA 19 2HB ALA 19 13.703 2.299 8.073 149 HB3 ALA 19 3HB ALA 19 13.548 2.722 6.369 150 H ILE 20 H ILE 20 11.869 1.365 4.997 151 HA ILE 20 HA ILE 20 9.494 1.691 6.467 152 HB ILE 20 HB ILE 20 9.876 1.069 3.524 153 HG12 ILE 20 2HG1 ILE 20 9.445 3.696 4.961 154 HG13 ILE 20 1HG1 ILE 20 10.966 3.141 4.284 155 HG21 ILE 20 1HG2 ILE 20 7.422 2.111 4.938 156 HG22 ILE 20 2HG2 ILE 20 7.606 0.519 4.197 157 HG23 ILE 20 3HG2 ILE 20 7.618 1.965 3.189 158 HD11 ILE 20 1HD1 ILE 20 9.962 4.750 2.816 159 HD12 ILE 20 2HD1 ILE 20 8.458 3.821 2.772 160 HD13 ILE 20 3HD1 ILE 20 9.928 3.163 2.053 161 H SER 21 H SER 21 11.003 -1.042 5.020 162 HA SER 21 HA SER 21 8.702 -2.758 5.122 163 HB2 SER 21 2HB SER 21 10.576 -3.037 3.456 164 HB3 SER 21 1HB SER 21 11.623 -3.516 4.785 165 HG SER 21 HG SER 21 10.123 -5.002 3.342 166 H GLU 22 H GLU 22 11.422 -1.972 7.182 167 HA GLU 22 HA GLU 22 11.179 -4.016 9.117 168 HB2 GLU 22 2HB GLU 22 11.969 -1.129 9.536 169 HB3 GLU 22 1HB GLU 22 12.245 -2.434 10.670 170 HG2 GLU 22 2HG GLU 22 13.764 -3.480 9.041 171 HG3 GLU 22 1HG GLU 22 13.508 -2.115 7.951 172 H THR 23 H THR 23 9.718 -0.846 8.763 173 HA THR 23 HA THR 23 8.229 -0.749 11.126 174 HB THR 23 HB THR 23 7.591 0.488 8.433 175 HG1 THR 23 1HG THR 23 9.566 0.981 10.233 176 HG21 THR 23 1HG2 THR 23 5.684 0.570 9.971 177 HG22 THR 23 2HG2 THR 23 6.377 2.176 9.741 178 HG23 THR 23 3HG2 THR 23 6.710 1.278 11.220 179 H LEU 24 H LEU 24 7.229 -1.734 7.831 180 HA LEU 24 HA LEU 24 4.643 -2.467 8.666 181 HB2 LEU 24 2HB LEU 24 6.095 -2.904 6.088 182 HB3 LEU 24 1HB LEU 24 4.561 -3.690 6.380 183 HG LEU 24 HG LEU 24 3.487 -1.478 6.638 184 HD11 LEU 24 1HD1 LEU 24 4.640 0.555 5.968 185 HD12 LEU 24 2HD1 LEU 24 6.156 -0.340 5.860 186 HD13 LEU 24 3HD1 LEU 24 5.348 -0.155 7.416 187 HD21 LEU 24 1HD2 LEU 24 3.581 -0.827 4.283 188 HD22 LEU 24 2HD2 LEU 24 3.456 -2.572 4.482 189 HD23 LEU 24 3HD2 LEU 24 5.009 -1.840 4.066 190 H GLU 25 H GLU 25 7.589 -4.279 8.525 191 HA GLU 25 HA GLU 25 6.665 -6.893 8.583 192 HB2 GLU 25 2HB GLU 25 9.050 -6.197 8.560 193 HB3 GLU 25 1HB GLU 25 8.895 -5.697 10.235 194 HG2 GLU 25 2HG GLU 25 8.285 -8.049 10.795 195 HG3 GLU 25 1HG GLU 25 8.703 -8.486 9.138 196 H THR 26 H THR 26 7.165 -4.619 11.279 197 HA THR 26 HA THR 26 6.192 -6.396 13.265 198 HB THR 26 HB THR 26 6.427 -3.385 13.441 199 HG1 THR 26 1HG THR 26 8.330 -5.472 13.456 200 HG21 THR 26 1HG2 THR 26 6.687 -3.800 15.833 201 HG22 THR 26 2HG2 THR 26 6.627 -5.551 15.544 202 HG23 THR 26 3HG2 THR 26 5.207 -4.575 15.229 203 H VAL 27 H VAL 27 4.789 -3.780 11.353 204 HA VAL 27 HA VAL 27 2.339 -3.561 12.732 205 HB VAL 27 HB VAL 27 2.877 -3.014 9.785 206 HG11 VAL 27 1HG1 VAL 27 0.495 -3.266 10.231 207 HG12 VAL 27 2HG1 VAL 27 0.893 -1.579 9.891 208 HG13 VAL 27 3HG1 VAL 27 0.616 -2.104 11.552 209 HG21 VAL 27 1HG2 VAL 27 2.843 -1.115 12.135 210 HG22 VAL 27 2HG2 VAL 27 3.091 -0.680 10.448 211 HG23 VAL 27 3HG2 VAL 27 4.284 -1.674 11.278 212 H TYR 28 H TYR 28 3.373 -5.650 10.130 213 HA TYR 28 HA TYR 28 0.868 -6.789 9.576 214 HB2 TYR 28 2HB TYR 28 2.818 -7.052 8.062 215 HB3 TYR 28 1HB TYR 28 3.607 -8.069 9.262 216 HD1 TYR 28 1HD TYR 28 2.888 -10.375 9.606 217 HD2 TYR 28 2HD TYR 28 0.913 -7.873 6.796 218 HE1 TYR 28 1HE TYR 28 1.740 -12.344 8.664 219 HE2 TYR 28 2HE TYR 28 -0.234 -9.822 5.855 220 HH TYR 28 HH TYR 28 -0.338 -12.805 7.405 221 H ARG 29 H ARG 29 3.497 -7.775 11.633 222 HA ARG 29 HA ARG 29 2.351 -10.112 12.667 223 HB2 ARG 29 2HB ARG 29 4.516 -8.318 13.752 224 HB3 ARG 29 1HB ARG 29 4.129 -9.914 14.398 225 HG2 ARG 29 2HG ARG 29 4.904 -9.457 11.527 226 HG3 ARG 29 1HG ARG 29 6.073 -9.824 12.789 227 HD2 ARG 29 2HD ARG 29 3.686 -11.580 12.226 228 HD3 ARG 29 1HD ARG 29 5.236 -11.786 11.418 229 HE ARG 29 HE ARG 29 6.234 -12.135 13.579 230 HH11 ARG 29 1HH1 ARG 29 2.637 -12.482 13.553 231 HH12 ARG 29 2HH1 ARG 29 2.649 -13.596 14.790 232 HH21 ARG 29 1HH2 ARG 29 6.155 -13.701 15.288 233 HH22 ARG 29 2HH2 ARG 29 4.660 -14.335 15.798 234 H ALA 30 H ALA 30 1.997 -6.794 13.596 235 HA ALA 30 HA ALA 30 0.951 -7.211 16.180 236 HB1 ALA 30 1HB ALA 30 1.705 -5.012 15.388 237 HB2 ALA 30 2HB ALA 30 0.067 -4.952 16.040 238 HB3 ALA 30 3HB ALA 30 0.326 -4.941 14.294 239 H LEU 31 H LEU 31 -0.697 -6.981 13.052 240 HA LEU 31 HA LEU 31 -3.214 -7.309 14.329 241 HB2 LEU 31 2HB LEU 31 -2.562 -7.242 11.423 242 HB3 LEU 31 1HB LEU 31 -4.180 -7.559 11.995 243 HG LEU 31 HG LEU 31 -3.796 -5.366 13.299 244 HD11 LEU 31 1HD1 LEU 31 -1.853 -4.972 11.062 245 HD12 LEU 31 2HD1 LEU 31 -1.525 -4.963 12.793 246 HD13 LEU 31 3HD1 LEU 31 -2.511 -3.689 12.076 247 HD21 LEU 31 1HD2 LEU 31 -4.801 -4.098 11.496 248 HD22 LEU 31 2HD2 LEU 31 -5.552 -5.659 11.748 249 HD23 LEU 31 3HD2 LEU 31 -4.498 -5.399 10.362 250 H GLU 32 H GLU 32 -1.176 -9.566 12.540 251 HA GLU 32 HA GLU 32 -3.326 -11.367 12.685 252 HB2 GLU 32 2HB GLU 32 -1.731 -13.099 11.769 253 HB3 GLU 32 1HB GLU 32 -2.259 -11.792 10.700 254 HG2 GLU 32 2HG GLU 32 0.029 -12.188 10.284 255 HG3 GLU 32 1HG GLU 32 -0.028 -10.725 11.256 256 H GLU 33 H GLU 33 -0.656 -10.967 14.694 257 HA GLU 33 HA GLU 33 -0.986 -13.246 16.317 258 HB2 GLU 33 2HB GLU 33 -0.362 -10.418 17.181 259 HB3 GLU 33 1HB GLU 33 -0.298 -11.796 18.263 260 HG2 GLU 33 2HG GLU 33 1.371 -11.455 15.785 261 HG3 GLU 33 1HG GLU 33 1.896 -11.111 17.432 262 H LYS 34 H LYS 34 -2.888 -10.320 16.126 263 HA LYS 34 HA LYS 34 -4.674 -11.119 18.268 264 HB2 LYS 34 2HB LYS 34 -4.483 -8.746 16.479 265 HB3 LYS 34 1HB LYS 34 -5.967 -9.063 17.352 266 HG2 LYS 34 2HG LYS 34 -3.267 -8.732 18.643 267 HG3 LYS 34 1HG LYS 34 -4.450 -7.435 18.447 268 HD2 LYS 34 2HD LYS 34 -6.094 -8.839 19.705 269 HD3 LYS 34 1HD LYS 34 -4.794 -9.991 20.013 270 HE2 LYS 34 2HE LYS 34 -3.538 -8.275 21.169 271 HE3 LYS 34 1HE LYS 34 -4.814 -7.100 20.836 272 HZ1 LYS 34 1HZ LYS 34 -5.111 -9.562 22.478 273 HZ2 LYS 34 2HZ LYS 34 -6.327 -8.437 22.165 274 HZ3 LYS 34 3HZ LYS 34 -4.980 -8.000 23.073 275 H GLY 35 H GLY 35 -4.433 -11.819 15.008 276 HA2 GLY 35 2HA GLY 35 -5.847 -13.273 13.846 277 HA3 GLY 35 1HA GLY 35 -7.065 -13.039 15.085 278 H TYR 36 H TYR 36 -5.655 -10.215 13.649 279 HA TYR 36 HA TYR 36 -8.166 -9.750 12.170 280 HB2 TYR 36 2HB TYR 36 -5.926 -7.804 12.832 281 HB3 TYR 36 1HB TYR 36 -7.407 -7.386 11.993 282 HD1 TYR 36 1HD TYR 36 -5.724 -7.561 15.105 283 HD2 TYR 36 2HD TYR 36 -9.608 -7.690 13.376 284 HE1 TYR 36 1HE TYR 36 -6.697 -6.947 17.262 285 HE2 TYR 36 2HE TYR 36 -10.586 -7.061 15.546 286 HH TYR 36 HH TYR 36 -10.009 -7.178 17.901 287 H ASN 37 H ASN 37 -7.680 -8.426 10.021 288 HA ASN 37 HA ASN 37 -5.525 -9.850 8.647 289 HB2 ASN 37 2HB ASN 37 -7.807 -8.229 7.477 290 HB3 ASN 37 1HB ASN 37 -6.525 -8.964 6.528 291 HD21 ASN 37 1HD2 ASN 37 -6.512 -11.219 6.248 292 HD22 ASN 37 2HD2 ASN 37 -7.876 -12.177 6.636 293 HA PRO 38 HA PRO 38 -3.078 -6.182 9.551 294 HB2 PRO 38 2HB PRO 38 -1.284 -7.571 7.664 295 HB3 PRO 38 1HB PRO 38 -0.988 -6.916 9.281 296 HG2 PRO 38 2HG PRO 38 -1.218 -9.558 8.834 297 HG3 PRO 38 1HG PRO 38 -1.754 -8.806 10.341 298 HD2 PRO 38 2HD PRO 38 -3.352 -9.848 8.074 299 HD3 PRO 38 1HD PRO 38 -3.749 -9.695 9.806 300 H ILE 39 H ILE 39 -3.429 -7.568 6.359 301 HA ILE 39 HA ILE 39 -2.466 -5.353 4.920 302 HB ILE 39 HB ILE 39 -4.404 -7.474 3.947 303 HG12 ILE 39 2HG1 ILE 39 -2.425 -8.511 4.929 304 HG13 ILE 39 1HG1 ILE 39 -2.403 -8.685 3.181 305 HG21 ILE 39 1HG2 ILE 39 -3.492 -6.987 1.733 306 HG22 ILE 39 2HG2 ILE 39 -2.502 -5.702 2.423 307 HG23 ILE 39 3HG2 ILE 39 -4.259 -5.568 2.443 308 HD11 ILE 39 1HD1 ILE 39 -0.774 -6.856 3.035 309 HD12 ILE 39 2HD1 ILE 39 -0.193 -8.171 4.055 310 HD13 ILE 39 3HD1 ILE 39 -0.803 -6.697 4.795 311 H ASN 40 H ASN 40 -5.678 -6.256 6.000 312 HA ASN 40 HA ASN 40 -7.188 -4.408 4.492 313 HB2 ASN 40 2HB ASN 40 -7.773 -5.778 7.111 314 HB3 ASN 40 1HB ASN 40 -8.912 -4.676 6.366 315 HD21 ASN 40 1HD2 ASN 40 -6.931 -6.805 4.362 316 HD22 ASN 40 2HD2 ASN 40 -8.233 -7.839 3.948 317 H GLN 41 H GLN 41 -5.857 -4.165 7.747 318 HA GLN 41 HA GLN 41 -6.858 -1.520 8.006 319 HB2 GLN 41 2HB GLN 41 -4.906 -3.010 9.730 320 HB3 GLN 41 1HB GLN 41 -5.528 -1.411 10.106 321 HG2 GLN 41 2HG GLN 41 -7.180 -3.931 9.841 322 HG3 GLN 41 1HG GLN 41 -6.717 -3.156 11.347 323 HE21 GLN 41 1HE2 GLN 41 -8.831 -2.865 11.995 324 HE22 GLN 41 2HE2 GLN 41 -9.886 -1.723 11.238 325 H ILE 42 H ILE 42 -3.774 -2.848 6.980 326 HA ILE 42 HA ILE 42 -2.410 -0.374 7.067 327 HB ILE 42 HB ILE 42 -1.856 -2.756 5.253 328 HG12 ILE 42 2HG1 ILE 42 -0.517 -1.863 7.827 329 HG13 ILE 42 1HG1 ILE 42 -1.630 -3.216 7.672 330 HG21 ILE 42 1HG2 ILE 42 -0.120 -0.324 5.806 331 HG22 ILE 42 2HG2 ILE 42 -0.907 -0.704 4.289 332 HG23 ILE 42 3HG2 ILE 42 0.378 -1.748 4.894 333 HD11 ILE 42 1HD1 ILE 42 -0.036 -4.361 6.219 334 HD12 ILE 42 2HD1 ILE 42 0.682 -3.968 7.781 335 HD13 ILE 42 3HD1 ILE 42 1.073 -2.997 6.357 336 H VAL 43 H VAL 43 -4.095 -1.990 4.351 337 HA VAL 43 HA VAL 43 -3.707 0.145 2.592 338 HB VAL 43 HB VAL 43 -4.417 -1.985 1.636 339 HG11 VAL 43 1HG1 VAL 43 -5.799 -2.821 3.445 340 HG12 VAL 43 2HG1 VAL 43 -6.704 -2.866 1.933 341 HG13 VAL 43 3HG1 VAL 43 -7.026 -1.594 3.118 342 HG21 VAL 43 1HG2 VAL 43 -6.596 0.064 1.233 343 HG22 VAL 43 2HG2 VAL 43 -6.250 -1.299 0.166 344 HG23 VAL 43 3HG2 VAL 43 -5.058 -0.016 0.378 345 H GLY 44 H GLY 44 -6.290 -0.396 4.951 346 HA2 GLY 44 2HA GLY 44 -7.855 1.841 4.293 347 HA3 GLY 44 1HA GLY 44 -7.795 1.055 5.866 348 H TYR 45 H TYR 45 -5.049 1.460 6.418 349 HA TYR 45 HA TYR 45 -5.108 4.005 7.543 350 HB2 TYR 45 2HB TYR 45 -3.681 2.366 8.577 351 HB3 TYR 45 1HB TYR 45 -2.736 2.176 7.099 352 HD1 TYR 45 1HD TYR 45 -0.816 3.527 6.738 353 HD2 TYR 45 2HD TYR 45 -3.638 4.680 9.694 354 HE1 TYR 45 1HE TYR 45 0.670 5.332 7.445 355 HE2 TYR 45 2HE TYR 45 -2.156 6.485 10.404 356 HH TYR 45 HH TYR 45 0.544 7.414 8.564 357 H LEU 46 H LEU 46 -3.241 2.885 4.731 358 HA LEU 46 HA LEU 46 -2.257 5.516 4.374 359 HB2 LEU 46 2HB LEU 46 -2.148 3.207 2.449 360 HB3 LEU 46 1HB LEU 46 -1.431 4.764 2.103 361 HG LEU 46 HG LEU 46 -0.006 4.370 4.238 362 HD11 LEU 46 1HD1 LEU 46 0.384 2.154 4.944 363 HD12 LEU 46 2HD1 LEU 46 -0.818 1.558 3.809 364 HD13 LEU 46 3HD1 LEU 46 -1.326 2.561 5.157 365 HD21 LEU 46 1HD2 LEU 46 0.938 4.294 2.028 366 HD22 LEU 46 2HD2 LEU 46 0.396 2.626 1.822 367 HD23 LEU 46 3HD2 LEU 46 1.616 3.013 3.034 368 H LEU 47 H LEU 47 -5.037 3.886 3.004 369 HA LEU 47 HA LEU 47 -5.476 5.908 1.065 370 HB2 LEU 47 2HB LEU 47 -7.456 3.958 2.232 371 HB3 LEU 47 1HB LEU 47 -7.757 4.986 0.849 372 HG LEU 47 HG LEU 47 -5.808 2.698 1.027 373 HD11 LEU 47 1HD1 LEU 47 -7.208 1.697 -0.699 374 HD12 LEU 47 2HD1 LEU 47 -8.308 3.072 -0.603 375 HD13 LEU 47 3HD1 LEU 47 -8.104 2.004 0.786 376 HD21 LEU 47 1HD2 LEU 47 -5.329 3.113 -1.348 377 HD22 LEU 47 2HD2 LEU 47 -4.818 4.459 -0.332 378 HD23 LEU 47 3HD2 LEU 47 -6.297 4.587 -1.282 379 H SER 48 H SER 48 -6.707 5.498 4.374 380 HA SER 48 HA SER 48 -8.269 7.933 4.046 381 HB2 SER 48 2HB SER 48 -9.294 6.030 5.206 382 HB3 SER 48 1HB SER 48 -8.012 6.063 6.407 383 HG SER 48 HG SER 48 -9.135 8.510 6.243 384 H GLY 49 H GLY 49 -5.195 6.937 5.505 385 HA2 GLY 49 2HA GLY 49 -3.579 8.179 6.437 386 HA3 GLY 49 1HA GLY 49 -4.472 9.627 5.981 387 H ASP 50 H ASP 50 -5.067 6.878 8.196 388 HA ASP 50 HA ASP 50 -5.259 8.762 10.398 389 HB2 ASP 50 2HB ASP 50 -7.556 8.630 9.488 390 HB3 ASP 50 1HB ASP 50 -7.540 6.887 9.740 391 HA PRO 51 HA PRO 51 -2.856 5.458 12.098 392 HB2 PRO 51 2HB PRO 51 -2.807 6.348 14.687 393 HB3 PRO 51 1HB PRO 51 -1.781 6.979 13.392 394 HG2 PRO 51 2HG PRO 51 -4.331 8.074 14.497 395 HG3 PRO 51 1HG PRO 51 -2.846 8.930 14.041 396 HD2 PRO 51 2HD PRO 51 -5.021 8.892 12.465 397 HD3 PRO 51 1HD PRO 51 -3.380 8.897 11.782 398 H ALA 52 H ALA 52 -6.080 6.106 13.291 399 HA ALA 52 HA ALA 52 -6.120 4.237 15.397 400 HB1 ALA 52 1HB ALA 52 -8.471 5.203 13.798 401 HB2 ALA 52 2HB ALA 52 -7.755 6.037 15.178 402 HB3 ALA 52 3HB ALA 52 -8.521 4.467 15.400 403 H TYR 53 H TYR 53 -6.071 3.613 12.094 404 HA TYR 53 HA TYR 53 -7.597 1.248 12.009 405 HB2 TYR 53 2HB TYR 53 -5.403 2.288 10.266 406 HB3 TYR 53 1HB TYR 53 -6.130 0.709 9.979 407 HD1 TYR 53 1HD TYR 53 -8.580 0.579 9.705 408 HD2 TYR 53 2HD TYR 53 -6.487 4.248 9.506 409 HE1 TYR 53 1HE TYR 53 -10.442 1.528 8.563 410 HE2 TYR 53 2HE TYR 53 -8.389 5.265 8.326 411 HH TYR 53 HH TYR 53 -10.281 4.509 6.941 412 H ILE 54 H ILE 54 -4.322 1.846 13.079 413 HA ILE 54 HA ILE 54 -3.699 -0.992 12.973 414 HB ILE 54 HB ILE 54 -1.927 1.325 13.804 415 HG12 ILE 54 2HG1 ILE 54 -2.521 1.519 11.450 416 HG13 ILE 54 1HG1 ILE 54 -0.848 1.005 11.596 417 HG21 ILE 54 1HG2 ILE 54 -0.060 -0.257 13.548 418 HG22 ILE 54 2HG2 ILE 54 -1.206 -1.551 13.207 419 HG23 ILE 54 3HG2 ILE 54 -1.188 -0.787 14.796 420 HD11 ILE 54 1HD1 ILE 54 -3.194 -0.762 10.919 421 HD12 ILE 54 2HD1 ILE 54 -1.520 -1.298 11.080 422 HD13 ILE 54 3HD1 ILE 54 -1.971 -0.174 9.797 423 HA PRO 55 HA PRO 55 -5.053 -1.624 17.199 424 HB2 PRO 55 2HB PRO 55 -3.264 -3.987 16.954 425 HB3 PRO 55 1HB PRO 55 -4.958 -3.908 17.452 426 HG2 PRO 55 2HG PRO 55 -4.321 -4.826 15.080 427 HG3 PRO 55 1HG PRO 55 -5.730 -3.772 15.277 428 HD2 PRO 55 2HD PRO 55 -3.016 -3.104 14.202 429 HD3 PRO 55 1HD PRO 55 -4.623 -2.580 13.645 430 H ARG 56 H ARG 56 -4.219 -1.547 19.233 431 HA ARG 56 HA ARG 56 -1.569 -0.376 19.472 432 HB2 ARG 56 2HB ARG 56 -3.851 -0.625 21.420 433 HB3 ARG 56 1HB ARG 56 -2.354 0.252 21.729 434 HG2 ARG 56 2HG ARG 56 -2.836 1.825 20.001 435 HG3 ARG 56 1HG ARG 56 -4.219 0.881 19.453 436 HD2 ARG 56 2HD ARG 56 -5.337 1.310 21.587 437 HD3 ARG 56 1HD ARG 56 -3.954 2.269 22.118 438 HE ARG 56 HE ARG 56 -4.421 3.798 20.320 439 HH11 ARG 56 1HH1 ARG 56 -7.077 1.612 21.229 440 HH12 ARG 56 2HH1 ARG 56 -8.290 2.603 20.591 441 HH21 ARG 56 1HH2 ARG 56 -6.087 5.157 19.463 442 HH22 ARG 56 2HH2 ARG 56 -7.722 4.715 19.556 443 H TYR 57 H TYR 57 -2.496 -3.373 19.371 444 HA TYR 57 HA TYR 57 -1.671 -4.729 21.614 445 HB2 TYR 57 2HB TYR 57 -2.737 -5.908 19.807 446 HB3 TYR 57 1HB TYR 57 -1.424 -5.516 18.704 447 HD1 TYR 57 1HD TYR 57 -1.925 -7.231 22.004 448 HD2 TYR 57 2HD TYR 57 0.068 -7.210 18.251 449 HE1 TYR 57 1HE TYR 57 -0.826 -9.352 22.579 450 HE2 TYR 57 2HE TYR 57 1.173 -9.327 18.822 451 HH TYR 57 HH TYR 57 1.779 -10.567 20.774 452 H GLN 58 H GLN 58 0.324 -3.452 19.020 453 HA GLN 58 HA GLN 58 2.598 -3.806 20.787 454 HB2 GLN 58 2HB GLN 58 2.605 -4.449 17.834 455 HB3 GLN 58 1HB GLN 58 4.063 -4.235 18.782 456 HG2 GLN 58 2HG GLN 58 3.308 -6.123 20.225 457 HG3 GLN 58 1HG GLN 58 1.975 -6.376 19.098 458 HE21 GLN 58 1HE2 GLN 58 2.429 -7.242 17.049 459 HE22 GLN 58 2HE2 GLN 58 3.976 -7.930 16.703 460 H ASP 59 H ASP 59 4.478 -2.548 19.905 461 HA ASP 59 HA ASP 59 3.750 0.164 19.765 462 HB2 ASP 59 2HB ASP 59 6.444 -1.163 19.587 463 HB3 ASP 59 1HB ASP 59 6.233 0.575 19.440 464 H ALA 60 H ALA 60 3.878 -2.073 17.408 465 HA ALA 60 HA ALA 60 4.909 -0.926 15.131 466 HB1 ALA 60 1HB ALA 60 3.864 -3.153 15.243 467 HB2 ALA 60 2HB ALA 60 3.301 -2.198 13.878 468 HB3 ALA 60 3HB ALA 60 2.277 -2.383 15.303 469 H ARG 61 H ARG 61 1.815 -0.185 16.687 470 HA ARG 61 HA ARG 61 0.901 1.599 14.761 471 HB2 ARG 61 2HB ARG 61 -0.496 2.610 16.718 472 HB3 ARG 61 1HB ARG 61 -0.804 0.963 16.219 473 HG2 ARG 61 2HG ARG 61 -0.864 1.175 18.614 474 HG3 ARG 61 1HG ARG 61 0.492 0.143 18.151 475 HD2 ARG 61 2HD ARG 61 1.932 2.208 18.422 476 HD3 ARG 61 1HD ARG 61 0.522 2.995 19.120 477 HE ARG 61 HE ARG 61 0.903 0.596 20.457 478 HH11 ARG 61 1HH1 ARG 61 2.472 3.747 20.129 479 HH12 ARG 61 2HH1 ARG 61 3.321 3.637 21.593 480 HH21 ARG 61 1HH2 ARG 61 2.077 0.477 22.542 481 HH22 ARG 61 2HH2 ARG 61 3.078 1.766 22.980 482 H ASN 62 H ASN 62 3.231 2.098 17.269 483 HA ASN 62 HA ASN 62 3.292 4.963 17.032 484 HB2 ASN 62 2HB ASN 62 4.001 3.769 19.134 485 HB3 ASN 62 1HB ASN 62 5.321 3.057 18.229 486 HD21 ASN 62 1HD2 ASN 62 6.887 3.990 19.600 487 HD22 ASN 62 2HD2 ASN 62 7.229 5.677 19.506 488 H LEU 63 H LEU 63 5.058 2.202 15.835 489 HA LEU 63 HA LEU 63 7.220 3.502 14.593 490 HB2 LEU 63 2HB LEU 63 5.927 0.906 13.784 491 HB3 LEU 63 1HB LEU 63 7.534 1.440 13.352 492 HG LEU 63 HG LEU 63 6.586 0.690 16.114 493 HD11 LEU 63 1HD1 LEU 63 8.490 -0.663 14.225 494 HD12 LEU 63 2HD1 LEU 63 6.856 -1.205 14.610 495 HD13 LEU 63 3HD1 LEU 63 8.096 -1.184 15.862 496 HD21 LEU 63 1HD2 LEU 63 9.322 1.538 15.162 497 HD22 LEU 63 2HD2 LEU 63 8.935 0.924 16.768 498 HD23 LEU 63 3HD2 LEU 63 8.263 2.461 16.229 499 H ILE 64 H ILE 64 4.119 2.372 13.289 500 HA ILE 64 HA ILE 64 4.639 3.171 10.619 501 HB ILE 64 HB ILE 64 2.882 1.487 11.295 502 HG12 ILE 64 2HG1 ILE 64 1.826 3.801 9.643 503 HG13 ILE 64 1HG1 ILE 64 2.897 2.544 9.040 504 HG21 ILE 64 1HG2 ILE 64 1.354 3.957 12.156 505 HG22 ILE 64 2HG2 ILE 64 1.930 2.692 13.205 506 HG23 ILE 64 3HG2 ILE 64 0.653 2.343 12.028 507 HD11 ILE 64 1HD1 ILE 64 1.154 0.872 9.479 508 HD12 ILE 64 2HD1 ILE 64 0.608 2.136 8.377 509 HD13 ILE 64 3HD1 ILE 64 0.092 2.158 10.062 510 H ARG 65 H ARG 65 3.504 4.783 13.400 511 HA ARG 65 HA ARG 65 2.155 6.970 12.153 512 HB2 ARG 65 2HB ARG 65 1.891 5.760 14.462 513 HB3 ARG 65 1HB ARG 65 3.169 6.824 14.981 514 HG2 ARG 65 2HG ARG 65 0.485 7.685 13.938 515 HG3 ARG 65 1HG ARG 65 0.918 7.542 15.630 516 HD2 ARG 65 2HD ARG 65 2.722 9.173 15.177 517 HD3 ARG 65 1HD ARG 65 2.019 9.441 13.585 518 HE ARG 65 HE ARG 65 0.108 9.688 15.695 519 HH11 ARG 65 1HH1 ARG 65 2.484 11.523 13.802 520 HH12 ARG 65 2HH1 ARG 65 1.863 13.035 14.251 521 HH21 ARG 65 1HH2 ARG 65 -0.724 11.784 16.316 522 HH22 ARG 65 2HH2 ARG 65 0.003 13.190 15.703 523 H ARG 66 H ARG 66 5.396 6.120 12.682 524 HA ARG 66 HA ARG 66 6.488 8.802 12.875 525 HB2 ARG 66 2HB ARG 66 7.816 6.151 12.330 526 HB3 ARG 66 1HB ARG 66 8.666 7.668 12.564 527 HG2 ARG 66 2HG ARG 66 7.858 7.798 14.834 528 HG3 ARG 66 1HG ARG 66 6.926 6.311 14.600 529 HD2 ARG 66 2HD ARG 66 8.945 5.089 14.164 530 HD3 ARG 66 1HD ARG 66 9.909 6.555 14.334 531 HE ARG 66 HE ARG 66 8.566 6.359 16.675 532 HH11 ARG 66 1HH1 ARG 66 10.571 4.111 14.835 533 HH12 ARG 66 2HH1 ARG 66 11.291 3.396 16.184 534 HH21 ARG 66 1HH2 ARG 66 9.518 5.393 18.542 535 HH22 ARG 66 2HH2 ARG 66 10.673 4.134 18.390 536 H HIS 67 H HIS 67 5.055 7.092 10.519 537 HA HIS 67 HA HIS 67 6.480 8.522 8.385 538 HB2 HIS 67 2HB HIS 67 4.968 5.890 8.126 539 HB3 HIS 67 1HB HIS 67 5.874 6.699 6.864 540 HD1 HIS 67 1HD HIS 67 8.422 6.097 6.688 541 HD2 HIS 67 2HD HIS 67 6.546 4.517 10.069 542 HE1 HIS 67 1HE HIS 67 9.995 4.418 7.614 543 HE2 HIS 67 2HE HIS 67 8.721 3.271 9.437 544 H GLU 68 H GLU 68 4.801 9.142 6.681 545 HA GLU 68 HA GLU 68 2.260 9.494 8.044 546 HB2 GLU 68 2HB GLU 68 3.190 10.778 5.463 547 HB3 GLU 68 1HB GLU 68 1.648 11.057 6.241 548 HG2 GLU 68 2HG GLU 68 2.822 11.913 8.226 549 HG3 GLU 68 1HG GLU 68 4.347 11.699 7.372 550 H ARG 69 H ARG 69 3.002 8.825 4.656 551 HA ARG 69 HA ARG 69 1.865 6.290 4.581 552 HB2 ARG 69 2HB ARG 69 -0.304 6.697 3.421 553 HB3 ARG 69 1HB ARG 69 -0.287 7.326 5.055 554 HG2 ARG 69 2HG ARG 69 0.045 9.546 4.248 555 HG3 ARG 69 1HG ARG 69 0.130 8.975 2.575 556 HD2 ARG 69 2HD ARG 69 -2.184 8.112 2.827 557 HD3 ARG 69 1HD ARG 69 -2.235 8.813 4.442 558 HE ARG 69 HE ARG 69 -1.541 10.874 2.829 559 HH11 ARG 69 1HH1 ARG 69 -4.229 8.572 2.782 560 HH12 ARG 69 2HH1 ARG 69 -5.370 9.688 2.179 561 HH21 ARG 69 1HH2 ARG 69 -3.097 12.402 1.963 562 HH22 ARG 69 2HH2 ARG 69 -4.707 11.914 1.686 563 H ASP 70 H ASP 70 2.447 9.295 2.811 564 HA ASP 70 HA ASP 70 2.429 8.174 0.244 565 HB2 ASP 70 2HB ASP 70 3.547 10.248 -0.500 566 HB3 ASP 70 1HB ASP 70 2.197 10.588 0.571 567 H GLU 71 H GLU 71 5.086 8.734 2.473 568 HA GLU 71 HA GLU 71 7.253 7.984 0.902 569 HB2 GLU 71 2HB GLU 71 7.458 8.996 3.128 570 HB3 GLU 71 1HB GLU 71 6.789 7.547 3.852 571 HG2 GLU 71 2HG GLU 71 8.722 6.285 3.066 572 HG3 GLU 71 1HG GLU 71 9.418 7.772 2.413 573 H ILE 72 H ILE 72 5.157 6.048 2.896 574 HA ILE 72 HA ILE 72 6.461 3.572 2.522 575 HB ILE 72 HB ILE 72 3.601 4.152 3.280 576 HG12 ILE 72 2HG1 ILE 72 6.009 3.625 5.043 577 HG13 ILE 72 1HG1 ILE 72 5.214 5.175 4.830 578 HG21 ILE 72 1HG2 ILE 72 3.855 1.849 2.521 579 HG22 ILE 72 2HG2 ILE 72 3.594 1.882 4.266 580 HG23 ILE 72 3HG2 ILE 72 5.214 1.617 3.623 581 HD11 ILE 72 1HD1 ILE 72 3.980 2.717 6.059 582 HD12 ILE 72 2HD1 ILE 72 3.187 4.281 5.865 583 HD13 ILE 72 3HD1 ILE 72 4.584 4.123 6.931 584 H MET 73 H MET 73 3.604 5.059 1.055 585 HA MET 73 HA MET 73 2.873 2.828 -0.496 586 HB2 MET 73 2HB MET 73 1.454 4.866 0.194 587 HB3 MET 73 1HB MET 73 2.188 5.685 -1.165 588 HG2 MET 73 2HG MET 73 0.528 3.173 -1.347 589 HG3 MET 73 1HG MET 73 -0.060 4.796 -1.651 590 HE1 MET 73 1HE MET 73 -0.083 3.184 -5.181 591 HE2 MET 73 2HE MET 73 -0.999 4.033 -3.935 592 HE3 MET 73 3HE MET 73 -0.437 2.383 -3.645 593 H GLU 74 H GLU 74 4.824 5.714 -1.292 594 HA GLU 74 HA GLU 74 5.178 5.144 -4.007 595 HB2 GLU 74 2HB GLU 74 7.099 6.503 -2.113 596 HB3 GLU 74 1HB GLU 74 7.268 6.487 -3.858 597 HG2 GLU 74 2HG GLU 74 5.137 7.692 -4.046 598 HG3 GLU 74 1HG GLU 74 5.040 7.759 -2.284 599 H GLU 75 H GLU 75 7.014 4.099 -1.191 600 HA GLU 75 HA GLU 75 8.980 2.687 -2.671 601 HB2 GLU 75 2HB GLU 75 9.270 3.470 -0.327 602 HB3 GLU 75 1HB GLU 75 8.098 2.259 0.170 603 HG2 GLU 75 2HG GLU 75 10.392 1.519 0.609 604 HG3 GLU 75 1HG GLU 75 9.582 0.481 -0.560 605 H LEU 76 H LEU 76 5.868 1.801 -1.240 606 HA LEU 76 HA LEU 76 5.948 -0.970 -1.645 607 HB2 LEU 76 2HB LEU 76 3.535 0.836 -1.961 608 HB3 LEU 76 1HB LEU 76 3.481 -0.900 -1.789 609 HG LEU 76 HG LEU 76 4.311 1.093 0.317 610 HD11 LEU 76 1HD1 LEU 76 2.297 0.347 1.468 611 HD12 LEU 76 2HD1 LEU 76 1.907 -0.707 0.112 612 HD13 LEU 76 3HD1 LEU 76 1.905 1.039 -0.107 613 HD21 LEU 76 1HD2 LEU 76 4.114 -1.911 0.479 614 HD22 LEU 76 2HD2 LEU 76 4.407 -0.823 1.835 615 HD23 LEU 76 3HD2 LEU 76 5.602 -0.967 0.546 616 H THR 77 H THR 77 4.818 1.643 -3.793 617 HA THR 77 HA THR 77 4.174 -0.017 -5.950 618 HB THR 77 HB THR 77 4.990 2.906 -5.956 619 HG1 THR 77 1HG THR 77 3.198 2.827 -4.665 620 HG21 THR 77 1HG2 THR 77 4.945 1.900 -8.209 621 HG22 THR 77 2HG2 THR 77 3.619 3.041 -7.983 622 HG23 THR 77 3HG2 THR 77 3.312 1.304 -7.905 623 H LYS 78 H LYS 78 7.166 1.716 -5.131 624 HA LYS 78 HA LYS 78 8.581 1.144 -7.490 625 HB2 LYS 78 2HB LYS 78 9.573 1.808 -4.728 626 HB3 LYS 78 1HB LYS 78 10.640 1.594 -6.110 627 HG2 LYS 78 2HG LYS 78 9.607 3.366 -7.261 628 HG3 LYS 78 1HG LYS 78 8.393 3.584 -6.009 629 HD2 LYS 78 2HD LYS 78 10.122 5.279 -5.858 630 HD3 LYS 78 1HD LYS 78 10.175 4.264 -4.430 631 HE2 LYS 78 2HE LYS 78 12.046 2.993 -5.470 632 HE3 LYS 78 1HE LYS 78 11.987 4.089 -6.853 633 HZ1 LYS 78 1HZ LYS 78 13.715 4.780 -5.318 634 HZ2 LYS 78 2HZ LYS 78 12.609 4.817 -4.049 635 HZ3 LYS 78 3HZ LYS 78 12.472 5.915 -5.295 636 H TYR 79 H TYR 79 8.736 -0.455 -4.362 637 HA TYR 79 HA TYR 79 10.613 -2.375 -5.248 638 HB2 TYR 79 2HB TYR 79 10.293 -1.698 -2.868 639 HB3 TYR 79 1HB TYR 79 8.768 -2.567 -2.873 640 HD1 TYR 79 1HD TYR 79 12.382 -3.092 -3.555 641 HD2 TYR 79 2HD TYR 79 8.754 -4.782 -2.128 642 HE1 TYR 79 1HE TYR 79 13.597 -5.119 -2.889 643 HE2 TYR 79 2HE TYR 79 9.958 -6.813 -1.454 644 HH TYR 79 HH TYR 79 13.334 -6.915 -1.311 645 H TYR 80 H TYR 80 7.127 -2.310 -5.210 646 HA TYR 80 HA TYR 80 6.525 -4.986 -5.752 647 HB2 TYR 80 2HB TYR 80 4.881 -3.188 -5.226 648 HB3 TYR 80 1HB TYR 80 5.191 -2.473 -6.792 649 HD1 TYR 80 1HD TYR 80 3.725 -5.357 -5.059 650 HD2 TYR 80 2HD TYR 80 4.058 -3.284 -8.744 651 HE1 TYR 80 1HE TYR 80 1.869 -6.694 -5.965 652 HE2 TYR 80 2HE TYR 80 2.205 -4.592 -9.658 653 HH TYR 80 HH TYR 80 0.184 -6.507 -7.697 654 H LEU 81 H LEU 81 7.033 -2.278 -8.000 655 HA LEU 81 HA LEU 81 7.070 -3.948 -10.306 656 HB2 LEU 81 2HB LEU 81 7.812 -1.075 -9.909 657 HB3 LEU 81 1HB LEU 81 7.795 -1.852 -11.487 658 HG LEU 81 HG LEU 81 5.411 -1.441 -9.671 659 HD11 LEU 81 1HD1 LEU 81 4.660 0.128 -11.385 660 HD12 LEU 81 2HD1 LEU 81 6.170 -0.110 -12.265 661 HD13 LEU 81 3HD1 LEU 81 6.189 0.632 -10.666 662 HD21 LEU 81 1HD2 LEU 81 4.097 -2.241 -11.591 663 HD22 LEU 81 2HD2 LEU 81 5.178 -3.491 -10.986 664 HD23 LEU 81 3HD2 LEU 81 5.589 -2.599 -12.453 665 H ALA 82 H ALA 82 9.516 -2.859 -8.122 666 HA ALA 82 HA ALA 82 11.776 -3.201 -9.744 667 HB1 ALA 82 1HB ALA 82 11.864 -2.127 -7.549 668 HB2 ALA 82 2HB ALA 82 13.029 -3.453 -7.675 669 HB3 ALA 82 3HB ALA 82 11.524 -3.681 -6.779 670 H ASN 83 H ASN 83 9.880 -5.479 -7.881 671 HA ASN 83 HA ASN 83 11.667 -7.668 -8.408 672 HB2 ASN 83 2HB ASN 83 8.960 -7.562 -7.120 673 HB3 ASN 83 1HB ASN 83 9.754 -9.098 -7.457 674 HD21 ASN 83 1HD2 ASN 83 9.839 -6.172 -5.523 675 HD22 ASN 83 2HD2 ASN 83 10.997 -6.777 -4.396 676 H HIS 84 H HIS 84 9.706 -6.115 -10.394 677 HA HIS 84 HA HIS 84 8.861 -8.400 -11.993 678 HB2 HIS 84 2HB HIS 84 7.544 -6.254 -11.955 679 HB3 HIS 84 1HB HIS 84 8.922 -5.425 -12.653 680 HD1 HIS 84 1HD HIS 84 9.617 -6.646 -15.182 681 HD2 HIS 84 2HD HIS 84 5.699 -6.877 -13.808 682 HE1 HIS 84 1HE HIS 84 8.243 -7.135 -17.180 683 HE2 HIS 84 2HE HIS 84 5.882 -7.020 -16.392 684 H GLY 85 H GLY 85 11.626 -6.517 -11.403 685 HA2 GLY 85 2HA GLY 85 13.740 -6.931 -12.341 686 HA3 GLY 85 1HA GLY 85 12.949 -7.553 -13.793 687 H ILE 86 H ILE 86 11.713 -4.694 -12.390 688 HA ILE 86 HA ILE 86 12.646 -3.161 -14.692 689 HB ILE 86 HB ILE 86 10.371 -2.647 -12.747 690 HG12 ILE 86 2HG1 ILE 86 10.333 -3.399 -15.678 691 HG13 ILE 86 1HG1 ILE 86 9.916 -4.460 -14.338 692 HG21 ILE 86 1HG2 ILE 86 9.746 -0.763 -14.189 693 HG22 ILE 86 2HG2 ILE 86 11.192 -1.034 -15.160 694 HG23 ILE 86 3HG2 ILE 86 11.346 -0.536 -13.478 695 HD11 ILE 86 1HD1 ILE 86 8.449 -1.956 -15.142 696 HD12 ILE 86 2HD1 ILE 86 8.014 -3.018 -13.802 697 HD13 ILE 86 3HD1 ILE 86 7.932 -3.615 -15.462 698 H ASP 87 H ASP 87 13.887 -1.382 -14.405 699 HA ASP 87 HA ASP 87 14.712 -0.802 -11.653 700 HB2 ASP 87 2HB ASP 87 16.074 -0.148 -14.271 701 HB3 ASP 87 1HB ASP 87 16.625 0.428 -12.704 702 H ILE 88 H ILE 88 13.910 0.900 -10.746 703 HA ILE 88 HA ILE 88 12.613 2.900 -12.442 704 HB ILE 88 HB ILE 88 12.213 2.340 -9.507 705 HG12 ILE 88 2HG1 ILE 88 10.554 1.427 -11.875 706 HG13 ILE 88 1HG1 ILE 88 11.556 0.403 -10.866 707 HG21 ILE 88 1HG2 ILE 88 10.152 3.674 -9.785 708 HG22 ILE 88 2HG2 ILE 88 10.578 3.968 -11.471 709 HG23 ILE 88 3HG2 ILE 88 11.592 4.613 -10.178 710 HD11 ILE 88 1HD1 ILE 88 9.134 1.921 -9.979 711 HD12 ILE 88 2HD1 ILE 88 10.125 0.884 -8.953 712 HD13 ILE 88 3HD1 ILE 88 9.220 0.194 -10.312 713 H LYS 89 H LYS 89 13.357 4.889 -12.383 714 HA LYS 89 HA LYS 89 15.545 5.549 -10.561 715 HB2 LYS 89 2HB LYS 89 16.007 5.861 -12.938 716 HB3 LYS 89 1HB LYS 89 14.588 6.887 -13.098 717 HG2 LYS 89 2HG LYS 89 15.590 8.493 -11.572 718 HG3 LYS 89 1HG LYS 89 17.027 7.477 -11.458 719 HD2 LYS 89 2HD LYS 89 17.441 7.764 -13.850 720 HD3 LYS 89 1HD LYS 89 15.968 8.725 -14.000 721 HE2 LYS 89 2HE LYS 89 17.964 10.146 -13.897 722 HE3 LYS 89 1HE LYS 89 16.906 10.416 -12.513 723 HZ1 LYS 89 1HZ LYS 89 18.383 8.951 -11.211 724 HZ2 LYS 89 2HZ LYS 89 19.201 10.284 -11.770 725 HZ3 LYS 89 3HZ LYS 89 19.407 8.786 -12.502 726 H1 MET 1 H MET 1 -41.383 6.295 -25.835 727 HA MET 1 HA MET 1 -39.189 5.891 -27.321 728 HB2 MET 1 2HB MET 1 -38.697 7.907 -25.124 729 HB3 MET 1 1HB MET 1 -37.425 7.019 -25.946 730 HG2 MET 1 2HG MET 1 -38.111 8.034 -28.068 731 HG3 MET 1 1HG MET 1 -39.354 8.949 -27.218 732 HE1 MET 1 1HE MET 1 -38.419 11.197 -28.275 733 HE2 MET 1 2HE MET 1 -37.187 10.271 -29.135 734 HE3 MET 1 3HE MET 1 -36.727 11.686 -28.187 735 H GLY 2 H GLY 2 -37.420 4.800 -25.838 736 HA2 GLY 2 2HA GLY 2 -38.789 3.508 -23.590 737 HA3 GLY 2 1HA GLY 2 -38.110 2.531 -24.883 738 H PHE 3 H PHE 3 -37.390 2.388 -22.182 739 HA PHE 3 HA PHE 3 -34.798 3.669 -21.966 740 HB2 PHE 3 2HB PHE 3 -36.302 3.509 -20.007 741 HB3 PHE 3 1HB PHE 3 -36.221 1.758 -20.105 742 HD1 PHE 3 1HD PHE 3 -34.625 4.767 -18.937 743 HD2 PHE 3 2HD PHE 3 -34.039 0.612 -19.617 744 HE1 PHE 3 1HE PHE 3 -32.675 4.796 -17.459 745 HE2 PHE 3 2HE PHE 3 -32.082 0.643 -18.137 746 HZ PHE 3 HZ PHE 3 -31.401 2.735 -17.057 747 H THR 4 H THR 4 -33.040 2.693 -22.691 748 HA THR 4 HA THR 4 -33.006 -0.219 -22.775 749 HB THR 4 HB THR 4 -33.295 0.762 -25.099 750 HG1 THR 4 1HG THR 4 -32.342 -1.098 -25.313 751 HG21 THR 4 1HG2 THR 4 -31.386 1.909 -26.137 752 HG22 THR 4 2HG2 THR 4 -30.523 1.880 -24.600 753 HG23 THR 4 3HG2 THR 4 -31.997 2.834 -24.767 754 H ASP 5 H ASP 5 -30.720 -1.007 -22.764 755 HA ASP 5 HA ASP 5 -29.076 0.848 -21.224 756 HB2 ASP 5 2HB ASP 5 -29.207 -2.156 -20.989 757 HB3 ASP 5 1HB ASP 5 -27.950 -1.182 -20.251 758 H GLU 6 H GLU 6 -28.151 1.719 -23.020 759 HA GLU 6 HA GLU 6 -26.647 -0.119 -24.642 760 HB2 GLU 6 2HB GLU 6 -27.920 1.664 -25.782 761 HB3 GLU 6 1HB GLU 6 -26.950 2.871 -24.951 762 HG2 GLU 6 2HG GLU 6 -24.961 2.098 -26.074 763 HG3 GLU 6 1HG GLU 6 -25.875 0.807 -26.851 764 H THR 7 H THR 7 -25.325 -0.789 -23.123 765 HA THR 7 HA THR 7 -22.960 0.845 -22.705 766 HB THR 7 HB THR 7 -24.306 -0.825 -20.538 767 HG1 THR 7 1HG THR 7 -24.302 1.444 -19.564 768 HG21 THR 7 1HG2 THR 7 -21.849 -0.752 -20.377 769 HG22 THR 7 2HG2 THR 7 -22.600 0.134 -19.052 770 HG23 THR 7 3HG2 THR 7 -21.901 1.012 -20.414 771 H VAL 8 H VAL 8 -21.318 -0.449 -23.445 772 HA VAL 8 HA VAL 8 -21.982 -3.211 -23.871 773 HB VAL 8 HB VAL 8 -19.770 -3.390 -25.090 774 HG11 VAL 8 1HG1 VAL 8 -21.858 -3.013 -26.267 775 HG12 VAL 8 2HG1 VAL 8 -20.530 -2.160 -27.043 776 HG13 VAL 8 3HG1 VAL 8 -21.688 -1.269 -26.046 777 HG21 VAL 8 1HG2 VAL 8 -18.635 -1.321 -25.745 778 HG22 VAL 8 2HG2 VAL 8 -18.593 -1.525 -23.995 779 HG23 VAL 8 3HG2 VAL 8 -19.726 -0.384 -24.729 780 H ARG 9 H ARG 9 -21.989 -4.292 -22.103 781 HA ARG 9 HA ARG 9 -19.884 -4.081 -20.161 782 HB2 ARG 9 2HB ARG 9 -22.210 -6.016 -20.378 783 HB3 ARG 9 1HB ARG 9 -21.085 -5.944 -19.031 784 HG2 ARG 9 2HG ARG 9 -21.812 -3.743 -18.439 785 HG3 ARG 9 1HG ARG 9 -22.821 -3.639 -19.879 786 HD2 ARG 9 2HD ARG 9 -23.188 -5.633 -17.641 787 HD3 ARG 9 1HD ARG 9 -24.120 -4.146 -17.838 788 HE ARG 9 HE ARG 9 -24.190 -5.716 -20.180 789 HH11 ARG 9 1HH1 ARG 9 -25.618 -5.585 -16.936 790 HH12 ARG 9 2HH1 ARG 9 -27.063 -6.361 -17.420 791 HH21 ARG 9 1HH2 ARG 9 -26.172 -6.767 -20.797 792 HH22 ARG 9 2HH2 ARG 9 -27.368 -7.064 -19.618 793 H PHE 10 H PHE 10 -17.997 -4.771 -20.751 794 HA PHE 10 HA PHE 10 -17.753 -7.231 -22.332 795 HB2 PHE 10 2HB PHE 10 -17.202 -5.163 -23.540 796 HB3 PHE 10 1HB PHE 10 -16.087 -4.709 -22.269 797 HD1 PHE 10 1HD PHE 10 -16.685 -6.971 -25.077 798 HD2 PHE 10 2HD PHE 10 -13.879 -5.611 -22.205 799 HE1 PHE 10 1HE PHE 10 -14.874 -8.054 -26.344 800 HE2 PHE 10 2HE PHE 10 -12.063 -6.682 -23.457 801 HZ PHE 10 HZ PHE 10 -12.557 -7.904 -25.528 802 H ASP 11 H ASP 11 -16.652 -8.819 -21.298 803 HA ASP 11 HA ASP 11 -14.895 -8.023 -19.067 804 HB2 ASP 11 2HB ASP 11 -16.484 -10.600 -19.277 805 HB3 ASP 11 1HB ASP 11 -15.375 -10.182 -17.985 806 H PHE 12 H PHE 12 -12.892 -8.187 -19.836 807 HA PHE 12 HA PHE 12 -12.159 -10.802 -20.890 808 HB2 PHE 12 2HB PHE 12 -12.396 -9.291 -22.851 809 HB3 PHE 12 1HB PHE 12 -11.216 -8.210 -22.128 810 HD1 PHE 12 1HD PHE 12 -8.866 -8.645 -22.318 811 HD2 PHE 12 2HD PHE 12 -11.698 -11.524 -23.653 812 HE1 PHE 12 1HE PHE 12 -7.068 -9.888 -23.451 813 HE2 PHE 12 2HE PHE 12 -9.909 -12.768 -24.784 814 HZ PHE 12 HZ PHE 12 -7.589 -11.952 -24.685 815 H ASP 13 H ASP 13 -11.252 -11.340 -19.005 816 HA ASP 13 HA ASP 13 -8.683 -10.076 -18.513 817 HB2 ASP 13 2HB ASP 13 -8.955 -10.326 -16.074 818 HB3 ASP 13 1HB ASP 13 -10.222 -9.294 -16.719 819 H ASP 14 H ASP 14 -7.057 -11.536 -18.144 820 HA ASP 14 HA ASP 14 -7.658 -14.332 -17.825 821 HB2 ASP 14 2HB ASP 14 -8.109 -13.913 -20.246 822 HB3 ASP 14 1HB ASP 14 -6.465 -13.322 -20.414 823 H ASN 15 H ASN 15 -5.750 -15.529 -17.426 824 HA ASN 15 HA ASN 15 -3.745 -15.926 -16.516 825 HB2 ASN 15 2HB ASN 15 -2.820 -15.262 -18.709 826 HB3 ASN 15 1HB ASN 15 -2.822 -13.580 -18.200 827 HD21 ASN 15 1HD2 ASN 15 -1.170 -12.833 -16.793 828 HD22 ASN 15 2HD2 ASN 15 0.191 -13.794 -16.435 829 H ARG 16 H ARG 16 -4.030 -15.565 -14.386 830 HA ARG 16 HA ARG 16 -3.076 -12.989 -13.571 831 HB2 ARG 16 2HB ARG 16 -4.832 -12.464 -12.002 832 HB3 ARG 16 1HB ARG 16 -5.508 -12.675 -13.595 833 HG2 ARG 16 2HG ARG 16 -5.652 -14.654 -11.326 834 HG3 ARG 16 1HG ARG 16 -6.943 -13.570 -11.827 835 HD2 ARG 16 2HD ARG 16 -7.019 -14.748 -13.999 836 HD3 ARG 16 1HD ARG 16 -5.747 -15.829 -13.435 837 HE ARG 16 HE ARG 16 -7.661 -15.964 -11.512 838 HH11 ARG 16 1HH1 ARG 16 -7.604 -16.667 -14.998 839 HH12 ARG 16 2HH1 ARG 16 -8.830 -17.830 -14.916 840 HH21 ARG 16 1HH2 ARG 16 -9.374 -17.615 -11.434 841 HH22 ARG 16 2HH2 ARG 16 -9.835 -18.381 -12.881 842 H LYS 17 H LYS 17 -1.237 -13.979 -13.030 843 HA LYS 17 HA LYS 17 -1.254 -15.538 -10.546 844 HB2 LYS 17 2HB LYS 17 1.063 -14.393 -12.153 845 HB3 LYS 17 1HB LYS 17 1.200 -15.484 -10.784 846 HG2 LYS 17 2HG LYS 17 0.125 -17.245 -12.062 847 HG3 LYS 17 1HG LYS 17 -0.052 -16.130 -13.426 848 HD2 LYS 17 2HD LYS 17 2.369 -15.899 -13.563 849 HD3 LYS 17 1HD LYS 17 2.564 -17.002 -12.200 850 HE2 LYS 17 2HE LYS 17 1.530 -18.781 -13.465 851 HE3 LYS 17 1HE LYS 17 1.248 -17.684 -14.821 852 HZ1 LYS 17 1HZ LYS 17 3.893 -18.530 -13.766 853 HZ2 LYS 17 2HZ LYS 17 3.642 -17.447 -15.048 854 HZ3 LYS 17 3HZ LYS 17 3.164 -19.055 -15.191 855 H LYS 18 H LYS 18 -0.385 -12.551 -12.006 856 HA LYS 18 HA LYS 18 -1.087 -11.013 -9.794 857 HB2 LYS 18 2HB LYS 18 1.167 -9.843 -9.637 858 HB3 LYS 18 1HB LYS 18 1.117 -11.466 -8.966 859 HG2 LYS 18 2HG LYS 18 2.122 -12.280 -11.118 860 HG3 LYS 18 1HG LYS 18 2.352 -10.592 -11.578 861 HD2 LYS 18 2HD LYS 18 3.717 -10.237 -9.578 862 HD3 LYS 18 1HD LYS 18 3.462 -11.917 -9.101 863 HE2 LYS 18 2HE LYS 18 4.561 -12.596 -11.247 864 HE3 LYS 18 1HE LYS 18 4.944 -10.900 -11.522 865 HZ1 LYS 18 1HZ LYS 18 6.818 -11.988 -10.511 866 HZ2 LYS 18 2HZ LYS 18 5.883 -12.566 -9.247 867 HZ3 LYS 18 3HZ LYS 18 6.199 -10.918 -9.389 868 H ALA 19 H ALA 19 -2.549 -10.639 -11.469 869 HA ALA 19 HA ALA 19 -1.884 -9.573 -14.013 870 HB1 ALA 19 1HB ALA 19 -4.245 -9.043 -14.153 871 HB2 ALA 19 2HB ALA 19 -4.396 -9.395 -12.427 872 HB3 ALA 19 3HB ALA 19 -3.993 -10.700 -13.552 873 H ILE 20 H ILE 20 -2.585 -8.253 -10.912 874 HA ILE 20 HA ILE 20 -2.872 -5.560 -11.618 875 HB ILE 20 HB ILE 20 -1.813 -6.815 -9.059 876 HG12 ILE 20 2HG1 ILE 20 -4.529 -5.698 -9.759 877 HG13 ILE 20 1HG1 ILE 20 -4.120 -7.403 -9.736 878 HG21 ILE 20 1HG2 ILE 20 -1.061 -4.487 -9.215 879 HG22 ILE 20 2HG2 ILE 20 -2.298 -4.667 -7.972 880 HG23 ILE 20 3HG2 ILE 20 -2.717 -3.972 -9.539 881 HD11 ILE 20 1HD1 ILE 20 -5.332 -6.727 -7.745 882 HD12 ILE 20 2HD1 ILE 20 -4.083 -5.540 -7.378 883 HD13 ILE 20 3HD1 ILE 20 -3.703 -7.262 -7.341 884 H SER 21 H SER 21 -0.116 -7.602 -11.241 885 HA SER 21 HA SER 21 1.835 -5.496 -11.255 886 HB2 SER 21 2HB SER 21 2.380 -7.704 -10.270 887 HB3 SER 21 1HB SER 21 2.175 -8.455 -11.848 888 HG SER 21 HG SER 21 4.031 -7.717 -12.474 889 H GLU 22 H GLU 22 0.380 -7.582 -13.656 890 HA GLU 22 HA GLU 22 1.913 -6.611 -15.834 891 HB2 GLU 22 2HB GLU 22 -0.835 -7.881 -15.829 892 HB3 GLU 22 1HB GLU 22 0.166 -7.642 -17.250 893 HG2 GLU 22 2HG GLU 22 1.868 -9.135 -16.291 894 HG3 GLU 22 1HG GLU 22 0.839 -9.385 -14.887 895 H THR 23 H THR 23 -1.021 -5.593 -14.276 896 HA THR 23 HA THR 23 -1.817 -3.673 -16.197 897 HB THR 23 HB THR 23 -2.418 -3.726 -13.215 898 HG1 THR 23 1HG THR 23 -3.063 -5.647 -14.399 899 HG21 THR 23 1HG2 THR 23 -4.417 -2.413 -13.824 900 HG22 THR 23 2HG2 THR 23 -3.890 -2.392 -15.507 901 HG23 THR 23 3HG2 THR 23 -2.944 -1.557 -14.275 902 H LEU 24 H LEU 24 -0.029 -3.320 -13.091 903 HA LEU 24 HA LEU 24 0.516 -0.596 -13.547 904 HB2 LEU 24 2HB LEU 24 1.646 -2.557 -11.584 905 HB3 LEU 24 1HB LEU 24 2.387 -0.984 -11.778 906 HG LEU 24 HG LEU 24 0.270 0.095 -11.125 907 HD11 LEU 24 1HD1 LEU 24 -0.746 -2.686 -10.623 908 HD12 LEU 24 2HD1 LEU 24 -1.329 -1.560 -11.847 909 HD13 LEU 24 3HD1 LEU 24 -1.542 -1.190 -10.135 910 HD21 LEU 24 1HD2 LEU 24 0.329 -0.518 -8.758 911 HD22 LEU 24 2HD2 LEU 24 1.945 -0.339 -9.442 912 HD23 LEU 24 3HD2 LEU 24 1.282 -1.949 -9.160 913 H GLU 25 H GLU 25 2.183 -3.470 -14.524 914 HA GLU 25 HA GLU 25 4.650 -2.525 -15.343 915 HB2 GLU 25 2HB GLU 25 3.882 -4.854 -15.555 916 HB3 GLU 25 1HB GLU 25 2.766 -4.370 -16.822 917 HG2 GLU 25 2HG GLU 25 4.792 -3.580 -18.103 918 HG3 GLU 25 1HG GLU 25 5.759 -4.435 -16.902 919 H THR 26 H THR 26 1.538 -2.516 -17.049 920 HA THR 26 HA THR 26 2.398 -1.181 -19.371 921 HB THR 26 HB THR 26 -0.389 -1.452 -18.220 922 HG1 THR 26 1HG THR 26 1.392 -3.208 -19.382 923 HG21 THR 26 1HG2 THR 26 -0.182 0.136 -20.068 924 HG22 THR 26 2HG2 THR 26 -1.087 -1.304 -20.563 925 HG23 THR 26 3HG2 THR 26 0.597 -1.098 -21.049 926 H VAL 27 H VAL 27 0.719 -0.118 -16.434 927 HA VAL 27 HA VAL 27 0.313 2.566 -17.149 928 HB VAL 27 HB VAL 27 0.754 1.412 -14.369 929 HG11 VAL 27 1HG1 VAL 27 1.064 3.829 -14.382 930 HG12 VAL 27 2HG1 VAL 27 -0.434 3.393 -13.555 931 HG13 VAL 27 3HG1 VAL 27 -0.487 4.024 -15.201 932 HG21 VAL 27 1HG2 VAL 27 -1.795 1.977 -15.884 933 HG22 VAL 27 2HG2 VAL 27 -1.690 1.408 -14.217 934 HG23 VAL 27 3HG2 VAL 27 -1.125 0.383 -15.535 935 H TYR 28 H TYR 28 3.042 0.966 -15.673 936 HA TYR 28 HA TYR 28 4.655 3.144 -15.014 937 HB2 TYR 28 2HB TYR 28 5.123 0.816 -14.332 938 HB3 TYR 28 1HB TYR 28 5.471 0.395 -16.000 939 HD1 TYR 28 1HD TYR 28 7.562 1.100 -17.037 940 HD2 TYR 28 2HD TYR 28 6.692 2.053 -13.001 941 HE1 TYR 28 1HE TYR 28 9.937 1.679 -16.665 942 HE2 TYR 28 2HE TYR 28 9.033 2.644 -12.613 943 HH TYR 28 HH TYR 28 11.250 3.033 -15.157 944 H ARG 29 H ARG 29 4.531 1.220 -17.951 945 HA ARG 29 HA ARG 29 6.482 2.594 -19.414 946 HB2 ARG 29 2HB ARG 29 4.182 0.852 -20.263 947 HB3 ARG 29 1HB ARG 29 5.389 1.468 -21.389 948 HG2 ARG 29 2HG ARG 29 6.103 -0.125 -18.946 949 HG3 ARG 29 1HG ARG 29 5.784 -0.861 -20.521 950 HD2 ARG 29 2HD ARG 29 7.820 1.330 -20.128 951 HD3 ARG 29 1HD ARG 29 8.223 -0.377 -20.000 952 HE ARG 29 HE ARG 29 7.309 -0.582 -22.286 953 HH11 ARG 29 1HH1 ARG 29 8.552 2.622 -21.276 954 HH12 ARG 29 2HH1 ARG 29 9.105 3.023 -22.804 955 HH21 ARG 29 1HH2 ARG 29 8.056 0.013 -24.379 956 HH22 ARG 29 2HH2 ARG 29 8.831 1.508 -24.651 957 H ALA 30 H ALA 30 3.018 3.030 -19.267 958 HA ALA 30 HA ALA 30 2.814 4.942 -21.330 959 HB1 ALA 30 1HB ALA 30 1.103 4.705 -18.857 960 HB2 ALA 30 2HB ALA 30 0.865 3.816 -20.359 961 HB3 ALA 30 3HB ALA 30 0.674 5.571 -20.334 962 H LEU 31 H LEU 31 3.521 5.248 -17.941 963 HA LEU 31 HA LEU 31 3.486 8.086 -17.922 964 HB2 LEU 31 2HB LEU 31 4.520 6.114 -15.916 965 HB3 LEU 31 1HB LEU 31 4.441 7.841 -15.645 966 HG LEU 31 HG LEU 31 2.059 6.191 -16.340 967 HD11 LEU 31 1HD1 LEU 31 2.935 5.503 -14.133 968 HD12 LEU 31 2HD1 LEU 31 1.403 6.354 -13.984 969 HD13 LEU 31 3HD1 LEU 31 2.901 7.207 -13.632 970 HD21 LEU 31 1HD2 LEU 31 1.773 8.473 -16.902 971 HD22 LEU 31 2HD2 LEU 31 2.408 8.976 -15.346 972 HD23 LEU 31 3HD2 LEU 31 0.844 8.158 -15.432 973 H GLU 32 H GLU 32 6.157 5.710 -17.916 974 HA GLU 32 HA GLU 32 7.892 7.916 -17.891 975 HB2 GLU 32 2HB GLU 32 9.768 6.276 -18.185 976 HB3 GLU 32 1HB GLU 32 8.866 6.223 -16.666 977 HG2 GLU 32 2HG GLU 32 9.304 3.997 -17.236 978 HG3 GLU 32 1HG GLU 32 7.652 4.249 -17.777 979 H GLU 33 H GLU 33 6.746 6.020 -20.463 980 HA GLU 33 HA GLU 33 8.378 7.112 -22.502 981 HB2 GLU 33 2HB GLU 33 5.468 6.312 -22.614 982 HB3 GLU 33 1HB GLU 33 6.370 6.831 -24.027 983 HG2 GLU 33 2HG GLU 33 7.073 4.466 -22.308 984 HG3 GLU 33 1HG GLU 33 6.170 4.387 -23.819 985 H LYS 34 H LYS 34 5.802 8.512 -20.685 986 HA LYS 34 HA LYS 34 5.713 10.918 -22.334 987 HB2 LYS 34 2HB LYS 34 4.167 10.021 -19.920 988 HB3 LYS 34 1HB LYS 34 3.993 11.625 -20.602 989 HG2 LYS 34 2HG LYS 34 3.513 9.082 -22.137 990 HG3 LYS 34 1HG LYS 34 2.250 9.981 -21.293 991 HD2 LYS 34 2HD LYS 34 4.006 11.138 -23.461 992 HD3 LYS 34 1HD LYS 34 2.401 10.476 -23.739 993 HE2 LYS 34 2HE LYS 34 1.459 12.129 -22.202 994 HE3 LYS 34 1HE LYS 34 3.065 12.799 -21.925 995 HZ1 LYS 34 1HZ LYS 34 3.159 13.368 -24.293 996 HZ2 LYS 34 2HZ LYS 34 1.880 14.112 -23.520 997 HZ3 LYS 34 3HZ LYS 34 1.591 12.779 -24.506 998 H GLY 35 H GLY 35 7.746 9.798 -20.121 999 HA2 GLY 35 2HA GLY 35 9.440 10.823 -18.978 1000 HA3 GLY 35 1HA GLY 35 8.858 12.362 -19.595 1001 H TYR 36 H TYR 36 6.805 10.197 -17.722 1002 HA TYR 36 HA TYR 36 6.832 12.208 -15.586 1003 HB2 TYR 36 2HB TYR 36 4.937 9.887 -16.050 1004 HB3 TYR 36 1HB TYR 36 4.826 11.020 -14.715 1005 HD1 TYR 36 1HD TYR 36 3.420 10.165 -17.720 1006 HD2 TYR 36 2HD TYR 36 4.835 13.590 -15.645 1007 HE1 TYR 36 1HE TYR 36 1.955 11.600 -19.088 1008 HE2 TYR 36 2HE TYR 36 3.369 15.017 -16.993 1009 HH TYR 36 HH TYR 36 2.261 15.008 -19.091 1010 H ASN 37 H ASN 37 6.538 11.146 -13.356 1011 HA ASN 37 HA ASN 37 8.336 8.858 -13.152 1012 HB2 ASN 37 2HB ASN 37 7.294 10.754 -11.021 1013 HB3 ASN 37 1HB ASN 37 8.210 9.304 -10.668 1014 HD21 ASN 37 1HD2 ASN 37 9.775 10.491 -9.636 1015 HD22 ASN 37 2HD2 ASN 37 10.917 11.476 -10.467 1016 HA PRO 38 HA PRO 38 4.546 6.430 -13.386 1017 HB2 PRO 38 2HB PRO 38 6.653 4.651 -12.249 1018 HB3 PRO 38 1HB PRO 38 5.359 4.257 -13.388 1019 HG2 PRO 38 2HG PRO 38 7.799 4.743 -14.296 1020 HG3 PRO 38 1HG PRO 38 6.388 5.384 -15.148 1021 HD2 PRO 38 2HD PRO 38 8.397 6.812 -13.516 1022 HD3 PRO 38 1HD PRO 38 7.329 7.375 -14.838 1023 H ILE 39 H ILE 39 6.725 6.497 -10.643 1024 HA ILE 39 HA ILE 39 4.988 5.233 -8.838 1025 HB ILE 39 HB ILE 39 7.319 7.070 -8.151 1026 HG12 ILE 39 2HG1 ILE 39 8.021 5.293 -9.650 1027 HG13 ILE 39 1HG1 ILE 39 8.597 4.979 -8.020 1028 HG21 ILE 39 1HG2 ILE 39 5.834 6.668 -6.271 1029 HG22 ILE 39 2HG2 ILE 39 7.383 5.850 -6.069 1030 HG23 ILE 39 3HG2 ILE 39 5.955 4.930 -6.545 1031 HD11 ILE 39 1HD1 ILE 39 7.814 2.929 -9.048 1032 HD12 ILE 39 2HD1 ILE 39 6.242 3.659 -9.371 1033 HD13 ILE 39 3HD1 ILE 39 6.754 3.369 -7.714 1034 H ASN 40 H ASN 40 5.632 8.682 -9.408 1035 HA ASN 40 HA ASN 40 4.062 9.720 -7.311 1036 HB2 ASN 40 2HB ASN 40 4.624 10.980 -10.006 1037 HB3 ASN 40 1HB ASN 40 3.921 11.817 -8.636 1038 HD21 ASN 40 1HD2 ASN 40 6.325 12.391 -10.110 1039 HD22 ASN 40 2HD2 ASN 40 7.608 12.362 -8.960 1040 H GLN 41 H GLN 41 3.225 8.977 -10.642 1041 HA GLN 41 HA GLN 41 0.578 9.979 -10.346 1042 HB2 GLN 41 2HB GLN 41 1.708 8.212 -12.498 1043 HB3 GLN 41 1HB GLN 41 0.128 8.965 -12.553 1044 HG2 GLN 41 2HG GLN 41 2.761 10.454 -12.467 1045 HG3 GLN 41 1HG GLN 41 1.789 10.173 -13.905 1046 HE21 GLN 41 1HE2 GLN 41 1.532 12.347 -14.321 1047 HE22 GLN 41 2HE2 GLN 41 0.536 13.367 -13.361 1048 H ILE 42 H ILE 42 2.015 6.785 -10.012 1049 HA ILE 42 HA ILE 42 -0.515 5.500 -9.835 1050 HB ILE 42 HB ILE 42 2.209 4.496 -8.935 1051 HG12 ILE 42 2HG1 ILE 42 0.510 3.803 -11.352 1052 HG13 ILE 42 1HG1 ILE 42 1.949 4.812 -11.371 1053 HG21 ILE 42 1HG2 ILE 42 0.455 3.393 -7.626 1054 HG22 ILE 42 2HG2 ILE 42 1.149 2.257 -8.779 1055 HG23 ILE 42 3HG2 ILE 42 -0.428 2.995 -9.087 1056 HD11 ILE 42 1HD1 ILE 42 3.298 2.887 -10.688 1057 HD12 ILE 42 2HD1 ILE 42 2.425 2.574 -12.189 1058 HD13 ILE 42 3HD1 ILE 42 1.849 1.883 -10.671 1059 H VAL 43 H VAL 43 1.840 6.529 -7.321 1060 HA VAL 43 HA VAL 43 0.177 5.757 -5.209 1061 HB VAL 43 HB VAL 43 2.529 6.268 -4.715 1062 HG11 VAL 43 1HG1 VAL 43 2.906 8.078 -6.302 1063 HG12 VAL 43 2HG1 VAL 43 3.375 8.586 -4.682 1064 HG13 VAL 43 3HG1 VAL 43 1.849 9.141 -5.370 1065 HG21 VAL 43 1HG2 VAL 43 0.701 8.205 -3.297 1066 HG22 VAL 43 2HG2 VAL 43 2.290 7.695 -2.726 1067 HG23 VAL 43 3HG2 VAL 43 0.984 6.519 -2.871 1068 H GLY 44 H GLY 44 0.311 8.746 -7.052 1069 HA2 GLY 44 2HA GLY 44 -1.611 10.194 -5.613 1070 HA3 GLY 44 1HA GLY 44 -1.215 10.421 -7.312 1071 H TYR 45 H TYR 45 -1.947 7.874 -8.290 1072 HA TYR 45 HA TYR 45 -4.696 8.248 -8.672 1073 HB2 TYR 45 2HB TYR 45 -3.474 7.087 -10.399 1074 HB3 TYR 45 1HB TYR 45 -3.022 5.798 -9.281 1075 HD1 TYR 45 1HD TYR 45 -4.485 3.930 -8.920 1076 HD2 TYR 45 2HD TYR 45 -5.934 7.339 -11.018 1077 HE1 TYR 45 1HE TYR 45 -6.523 2.701 -9.502 1078 HE2 TYR 45 2HE TYR 45 -7.964 6.107 -11.604 1079 HH TYR 45 HH TYR 45 -8.786 3.137 -10.143 1080 H LEU 46 H LEU 46 -3.025 5.828 -6.686 1081 HA LEU 46 HA LEU 46 -5.523 4.728 -5.956 1082 HB2 LEU 46 2HB LEU 46 -2.824 4.250 -4.728 1083 HB3 LEU 46 1HB LEU 46 -4.273 3.478 -4.128 1084 HG LEU 46 HG LEU 46 -4.542 2.477 -6.480 1085 HD11 LEU 46 1HD1 LEU 46 -2.653 2.293 -7.889 1086 HD12 LEU 46 2HD1 LEU 46 -1.705 3.277 -6.787 1087 HD13 LEU 46 3HD1 LEU 46 -3.050 4.002 -7.648 1088 HD21 LEU 46 1HD2 LEU 46 -2.926 0.706 -6.057 1089 HD22 LEU 46 2HD2 LEU 46 -3.829 1.162 -4.618 1090 HD23 LEU 46 3HD2 LEU 46 -2.163 1.710 -4.820 1091 H LEU 47 H LEU 47 -3.573 7.188 -4.435 1092 HA LEU 47 HA LEU 47 -5.159 7.163 -2.063 1093 HB2 LEU 47 2HB LEU 47 -3.341 9.329 -3.118 1094 HB3 LEU 47 1HB LEU 47 -4.046 9.289 -1.518 1095 HG LEU 47 HG LEU 47 -1.977 7.399 -2.626 1096 HD11 LEU 47 1HD1 LEU 47 -1.091 9.572 -2.045 1097 HD12 LEU 47 2HD1 LEU 47 -0.537 8.347 -0.903 1098 HD13 LEU 47 3HD1 LEU 47 -1.825 9.462 -0.443 1099 HD21 LEU 47 1HD2 LEU 47 -3.488 6.176 -1.161 1100 HD22 LEU 47 2HD2 LEU 47 -3.293 7.399 0.097 1101 HD23 LEU 47 3HD2 LEU 47 -1.922 6.400 -0.386 1102 H SER 48 H SER 48 -5.282 8.975 -5.084 1103 HA SER 48 HA SER 48 -7.431 10.626 -4.034 1104 HB2 SER 48 2HB SER 48 -5.612 11.648 -5.337 1105 HB3 SER 48 1HB SER 48 -6.083 10.675 -6.726 1106 HG SER 48 HG SER 48 -8.259 11.799 -6.306 1107 H GLY 49 H GLY 49 -7.064 7.821 -6.120 1108 HA2 GLY 49 2HA GLY 49 -8.584 6.454 -7.037 1109 HA3 GLY 49 1HA GLY 49 -9.807 7.277 -6.085 1110 H ASP 50 H ASP 50 -7.706 8.364 -8.823 1111 HA ASP 50 HA ASP 50 -10.093 8.570 -10.422 1112 HB2 ASP 50 2HB ASP 50 -9.997 10.693 -9.107 1113 HB3 ASP 50 1HB ASP 50 -8.500 11.084 -9.945 1114 HA PRO 51 HA PRO 51 -7.225 7.176 -13.495 1115 HB2 PRO 51 2HB PRO 51 -8.721 7.978 -15.683 1116 HB3 PRO 51 1HB PRO 51 -8.897 6.451 -14.814 1117 HG2 PRO 51 2HG PRO 51 -10.449 8.984 -14.527 1118 HG3 PRO 51 1HG PRO 51 -11.020 7.304 -14.499 1119 HD2 PRO 51 2HD PRO 51 -10.768 8.692 -12.264 1120 HD3 PRO 51 1HD PRO 51 -10.310 6.973 -12.309 1121 H ALA 52 H ALA 52 -8.186 10.538 -13.352 1122 HA ALA 52 HA ALA 52 -6.962 11.579 -15.633 1123 HB1 ALA 52 1HB ALA 52 -7.013 13.729 -14.546 1124 HB2 ALA 52 2HB ALA 52 -7.216 12.959 -12.973 1125 HB3 ALA 52 3HB ALA 52 -8.488 12.833 -14.183 1126 H TYR 53 H TYR 53 -5.421 10.366 -12.834 1127 HA TYR 53 HA TYR 53 -3.017 11.813 -12.996 1128 HB2 TYR 53 2HB TYR 53 -3.700 9.168 -11.775 1129 HB3 TYR 53 1HB TYR 53 -2.053 9.804 -11.752 1130 HD1 TYR 53 1HD TYR 53 -1.527 11.816 -10.600 1131 HD2 TYR 53 2HD TYR 53 -5.432 10.187 -10.435 1132 HE1 TYR 53 1HE TYR 53 -2.004 13.246 -8.748 1133 HE2 TYR 53 2HE TYR 53 -5.963 11.630 -8.543 1134 HH TYR 53 HH TYR 53 -4.833 12.857 -6.790 1135 H ILE 54 H ILE 54 -4.287 9.141 -14.831 1136 HA ILE 54 HA ILE 54 -1.637 8.498 -15.860 1137 HB ILE 54 HB ILE 54 -4.222 6.936 -16.185 1138 HG12 ILE 54 2HG1 ILE 54 -3.623 6.957 -13.830 1139 HG13 ILE 54 1HG1 ILE 54 -3.256 5.375 -14.501 1140 HG21 ILE 54 1HG2 ILE 54 -2.765 5.082 -16.879 1141 HG22 ILE 54 2HG2 ILE 54 -1.359 6.126 -16.720 1142 HG23 ILE 54 3HG2 ILE 54 -2.582 6.474 -17.947 1143 HD11 ILE 54 1HD1 ILE 54 -1.516 6.090 -12.984 1144 HD12 ILE 54 2HD1 ILE 54 -1.272 7.566 -13.920 1145 HD13 ILE 54 3HD1 ILE 54 -0.887 6.004 -14.631 1146 HA PRO 55 HA PRO 55 -2.631 10.915 -19.457 1147 HB2 PRO 55 2HB PRO 55 -0.614 10.000 -21.045 1148 HB3 PRO 55 1HB PRO 55 -0.359 11.160 -19.733 1149 HG2 PRO 55 2HG PRO 55 0.039 8.199 -19.776 1150 HG3 PRO 55 1HG PRO 55 1.099 9.459 -19.115 1151 HD2 PRO 55 2HD PRO 55 -0.493 8.009 -17.546 1152 HD3 PRO 55 1HD PRO 55 -0.188 9.728 -17.219 1153 H ARG 56 H ARG 56 -3.343 10.712 -21.590 1154 HA ARG 56 HA ARG 56 -4.616 8.154 -22.204 1155 HB2 ARG 56 2HB ARG 56 -4.915 10.859 -23.504 1156 HB3 ARG 56 1HB ARG 56 -5.851 9.429 -23.917 1157 HG2 ARG 56 2HG ARG 56 -6.779 9.380 -21.664 1158 HG3 ARG 56 1HG ARG 56 -5.821 10.799 -21.248 1159 HD2 ARG 56 2HD ARG 56 -6.998 12.093 -22.940 1160 HD3 ARG 56 1HD ARG 56 -7.951 10.668 -23.370 1161 HE ARG 56 HE ARG 56 -8.219 11.066 -20.658 1162 HH11 ARG 56 1HH1 ARG 56 -9.095 12.757 -23.632 1163 HH12 ARG 56 2HH1 ARG 56 -10.454 13.529 -22.958 1164 HH21 ARG 56 1HH2 ARG 56 -10.133 12.084 -19.739 1165 HH22 ARG 56 2HH2 ARG 56 -11.084 13.104 -20.709 1166 H TYR 57 H TYR 57 -1.751 9.170 -22.667 1167 HA TYR 57 HA TYR 57 -1.015 8.911 -25.336 1168 HB2 TYR 57 2HB TYR 57 0.532 9.625 -23.647 1169 HB3 TYR 57 1HB TYR 57 0.386 8.103 -22.793 1170 HD1 TYR 57 1HD TYR 57 1.829 9.760 -25.752 1171 HD2 TYR 57 2HD TYR 57 1.655 6.184 -23.471 1172 HE1 TYR 57 1HE TYR 57 3.787 8.911 -26.954 1173 HE2 TYR 57 2HE TYR 57 3.592 5.301 -24.650 1174 HH TYR 57 HH TYR 57 4.743 5.675 -26.849 1175 H GLN 58 H GLN 58 -1.720 6.463 -22.916 1176 HA GLN 58 HA GLN 58 -1.568 4.412 -24.981 1177 HB2 GLN 58 2HB GLN 58 0.541 4.548 -23.512 1178 HB3 GLN 58 1HB GLN 58 -0.514 4.113 -22.176 1179 HG2 GLN 58 2HG GLN 58 -1.010 1.985 -23.288 1180 HG3 GLN 58 1HG GLN 58 0.082 2.481 -24.594 1181 HE21 GLN 58 1HE2 GLN 58 2.284 2.442 -24.289 1182 HE22 GLN 58 2HE2 GLN 58 2.983 1.701 -22.893 1183 H ASP 59 H ASP 59 -2.798 2.508 -24.292 1184 HA ASP 59 HA ASP 59 -5.337 3.148 -23.278 1185 HB2 ASP 59 2HB ASP 59 -4.138 0.401 -23.655 1186 HB3 ASP 59 1HB ASP 59 -5.801 0.713 -23.243 1187 H ALA 60 H ALA 60 -2.537 2.595 -21.590 1188 HA ALA 60 HA ALA 60 -3.183 1.153 -19.347 1189 HB1 ALA 60 1HB ALA 60 -1.493 2.407 -18.170 1190 HB2 ALA 60 2HB ALA 60 -1.546 3.677 -19.391 1191 HB3 ALA 60 3HB ALA 60 -0.955 2.071 -19.817 1192 H ARG 61 H ARG 61 -4.082 4.505 -20.056 1193 HA ARG 61 HA ARG 61 -5.110 5.104 -17.510 1194 HB2 ARG 61 2HB ARG 61 -6.373 6.971 -18.603 1195 HB3 ARG 61 1HB ARG 61 -4.681 6.937 -19.039 1196 HG2 ARG 61 2HG ARG 61 -5.900 7.516 -20.970 1197 HG3 ARG 61 1HG ARG 61 -5.383 5.845 -21.229 1198 HD2 ARG 61 2HD ARG 61 -7.683 5.175 -20.439 1199 HD3 ARG 61 1HD ARG 61 -8.104 6.885 -20.448 1200 HE ARG 61 HE ARG 61 -7.041 6.180 -22.942 1201 HH11 ARG 61 1HH1 ARG 61 -9.989 5.751 -21.006 1202 HH12 ARG 61 2HH1 ARG 61 -10.977 5.370 -22.344 1203 HH21 ARG 61 1HH2 ARG 61 -8.410 5.651 -24.775 1204 HH22 ARG 61 2HH2 ARG 61 -10.049 5.302 -24.535 1205 H ASN 62 H ASN 62 -6.507 3.416 -20.169 1206 HA ASN 62 HA ASN 62 -9.174 3.218 -19.083 1207 HB2 ASN 62 2HB ASN 62 -8.589 3.057 -21.608 1208 HB3 ASN 62 1HB ASN 62 -7.791 1.577 -21.218 1209 HD21 ASN 62 1HD2 ASN 62 -10.104 2.129 -22.979 1210 HD22 ASN 62 2HD2 ASN 62 -11.334 1.050 -22.477 1211 H LEU 63 H LEU 63 -6.348 1.193 -19.418 1212 HA LEU 63 HA LEU 63 -7.349 -1.208 -18.415 1213 HB2 LEU 63 2HB LEU 63 -4.526 -0.185 -18.314 1214 HB3 LEU 63 1HB LEU 63 -5.013 -1.857 -18.128 1215 HG LEU 63 HG LEU 63 -5.385 -0.211 -20.629 1216 HD11 LEU 63 1HD1 LEU 63 -3.059 -0.668 -20.287 1217 HD12 LEU 63 2HD1 LEU 63 -3.677 -1.661 -21.594 1218 HD13 LEU 63 3HD1 LEU 63 -3.395 -2.386 -20.012 1219 HD21 LEU 63 1HD2 LEU 63 -5.986 -2.346 -21.675 1220 HD22 LEU 63 2HD2 LEU 63 -7.123 -1.896 -20.408 1221 HD23 LEU 63 3HD2 LEU 63 -5.904 -3.139 -20.102 1222 H ILE 64 H ILE 64 -5.695 1.397 -16.694 1223 HA ILE 64 HA ILE 64 -5.678 0.029 -14.187 1224 HB ILE 64 HB ILE 64 -4.113 1.915 -14.829 1225 HG12 ILE 64 2HG1 ILE 64 -5.692 2.427 -12.291 1226 HG13 ILE 64 1HG1 ILE 64 -4.444 1.200 -12.457 1227 HG21 ILE 64 1HG2 ILE 64 -4.944 4.260 -14.545 1228 HG22 ILE 64 2HG2 ILE 64 -6.578 3.617 -14.376 1229 HG23 ILE 64 3HG2 ILE 64 -5.732 3.414 -15.887 1230 HD11 ILE 64 1HD1 ILE 64 -2.790 2.947 -12.892 1231 HD12 ILE 64 2HD1 ILE 64 -3.592 3.176 -11.339 1232 HD13 ILE 64 3HD1 ILE 64 -4.048 4.171 -12.721 1233 H ARG 65 H ARG 65 -7.908 1.940 -15.919 1234 HA ARG 65 HA ARG 65 -9.506 2.874 -13.730 1235 HB2 ARG 65 2HB ARG 65 -8.948 4.027 -15.933 1236 HB3 ARG 65 1HB ARG 65 -10.027 2.907 -16.714 1237 HG2 ARG 65 2HG ARG 65 -10.846 4.880 -14.611 1238 HG3 ARG 65 1HG ARG 65 -10.894 5.207 -16.327 1239 HD2 ARG 65 2HD ARG 65 -12.377 3.288 -16.596 1240 HD3 ARG 65 1HD ARG 65 -12.414 3.100 -14.846 1241 HE ARG 65 HE ARG 65 -13.139 5.640 -15.064 1242 HH11 ARG 65 1HH1 ARG 65 -14.345 2.838 -16.844 1243 HH12 ARG 65 2HH1 ARG 65 -15.925 3.449 -17.043 1244 HH21 ARG 65 1HH2 ARG 65 -15.302 6.520 -15.344 1245 HH22 ARG 65 2HH2 ARG 65 -16.478 5.604 -16.167 1246 H ARG 66 H ARG 66 -9.179 0.049 -15.486 1247 HA ARG 66 HA ARG 66 -11.889 -0.925 -15.427 1248 HB2 ARG 66 2HB ARG 66 -9.260 -2.380 -15.762 1249 HB3 ARG 66 1HB ARG 66 -10.838 -3.111 -15.989 1250 HG2 ARG 66 2HG ARG 66 -11.272 -1.639 -17.868 1251 HG3 ARG 66 1HG ARG 66 -9.731 -0.821 -17.601 1252 HD2 ARG 66 2HD ARG 66 -9.547 -2.438 -19.412 1253 HD3 ARG 66 1HD ARG 66 -8.548 -2.915 -18.042 1254 HE ARG 66 HE ARG 66 -11.124 -4.075 -17.939 1255 HH11 ARG 66 1HH1 ARG 66 -7.930 -4.425 -19.440 1256 HH12 ARG 66 2HH1 ARG 66 -8.071 -6.082 -19.736 1257 HH21 ARG 66 1HH2 ARG 66 -11.336 -6.328 -18.351 1258 HH22 ARG 66 2HH2 ARG 66 -10.088 -7.217 -19.109 1259 H HIS 67 H HIS 67 -9.514 -0.401 -13.177 1260 HA HIS 67 HA HIS 67 -10.715 -2.265 -11.268 1261 HB2 HIS 67 2HB HIS 67 -7.865 -1.188 -11.326 1262 HB3 HIS 67 1HB HIS 67 -8.528 -2.185 -10.043 1263 HD1 HIS 67 1HD HIS 67 -8.116 -4.749 -10.324 1264 HD2 HIS 67 2HD HIS 67 -7.709 -2.613 -13.900 1265 HE1 HIS 67 1HE HIS 67 -7.284 -6.350 -11.975 1266 HE2 HIS 67 2HE HIS 67 -7.240 -5.138 -14.156 1267 H GLU 68 H GLU 68 -10.492 -1.276 -9.018 1268 HA GLU 68 HA GLU 68 -11.390 1.480 -9.217 1269 HB2 GLU 68 2HB GLU 68 -11.338 -0.393 -6.865 1270 HB3 GLU 68 1HB GLU 68 -12.091 1.190 -6.895 1271 HG2 GLU 68 2HG GLU 68 -13.700 0.440 -8.521 1272 HG3 GLU 68 1HG GLU 68 -12.892 -1.128 -8.633 1273 H ARG 69 H ARG 69 -9.692 0.153 -6.429 1274 HA ARG 69 HA ARG 69 -7.163 1.016 -7.029 1275 HB2 ARG 69 2HB ARG 69 -6.697 2.987 -5.706 1276 HB3 ARG 69 1HB ARG 69 -7.912 3.347 -6.900 1277 HG2 ARG 69 2HG ARG 69 -8.462 2.940 -3.941 1278 HG3 ARG 69 1HG ARG 69 -8.131 4.499 -4.675 1279 HD2 ARG 69 2HD ARG 69 -10.433 4.513 -4.521 1280 HD3 ARG 69 1HD ARG 69 -10.202 3.921 -6.157 1281 HE ARG 69 HE ARG 69 -10.390 1.754 -4.364 1282 HH11 ARG 69 1HH1 ARG 69 -12.477 4.245 -5.835 1283 HH12 ARG 69 2HH1 ARG 69 -13.895 3.345 -5.638 1284 HH21 ARG 69 1HH2 ARG 69 -12.346 0.552 -4.095 1285 HH22 ARG 69 2HH2 ARG 69 -13.833 1.176 -4.641 1286 H ASP 70 H ASP 70 -9.401 0.142 -4.539 1287 HA ASP 70 HA ASP 70 -7.400 -0.225 -2.574 1288 HB2 ASP 70 2HB ASP 70 -9.217 -1.410 -1.310 1289 HB3 ASP 70 1HB ASP 70 -9.617 0.228 -1.808 1290 H GLU 71 H GLU 71 -9.002 -2.431 -4.842 1291 HA GLU 71 HA GLU 71 -7.991 -4.890 -4.033 1292 HB2 GLU 71 2HB GLU 71 -9.550 -4.618 -5.895 1293 HB3 GLU 71 1HB GLU 71 -8.306 -3.814 -6.847 1294 HG2 GLU 71 2HG GLU 71 -6.994 -5.946 -6.715 1295 HG3 GLU 71 1HG GLU 71 -8.423 -6.696 -6.004 1296 H ILE 72 H ILE 72 -6.529 -2.411 -6.017 1297 HA ILE 72 HA ILE 72 -4.152 -3.756 -6.720 1298 HB ILE 72 HB ILE 72 -4.685 -0.777 -6.577 1299 HG12 ILE 72 2HG1 ILE 72 -4.948 -2.695 -8.911 1300 HG13 ILE 72 1HG1 ILE 72 -6.286 -1.974 -8.027 1301 HG21 ILE 72 1HG2 ILE 72 -2.557 -2.305 -8.091 1302 HG22 ILE 72 2HG2 ILE 72 -2.289 -1.292 -6.678 1303 HG23 ILE 72 3HG2 ILE 72 -2.838 -0.567 -8.190 1304 HD11 ILE 72 1HD1 ILE 72 -5.587 0.244 -8.796 1305 HD12 ILE 72 2HD1 ILE 72 -5.909 -0.844 -10.149 1306 HD13 ILE 72 3HD1 ILE 72 -4.247 -0.487 -9.676 1307 H MET 73 H MET 73 -4.923 -1.399 -4.209 1308 HA MET 73 HA MET 73 -2.287 -1.104 -3.261 1309 HB2 MET 73 2HB MET 73 -4.345 0.441 -2.899 1310 HB3 MET 73 1HB MET 73 -4.763 -0.658 -1.612 1311 HG2 MET 73 2HG MET 73 -2.184 0.898 -1.750 1312 HG3 MET 73 1HG MET 73 -3.604 1.391 -0.843 1313 HE1 MET 73 1HE MET 73 -0.667 1.145 0.359 1314 HE2 MET 73 2HE MET 73 -1.043 0.412 1.925 1315 HE3 MET 73 3HE MET 73 -2.096 1.663 1.257 1316 H GLU 74 H GLU 74 -4.967 -3.235 -2.238 1317 HA GLU 74 HA GLU 74 -3.793 -4.356 0.038 1318 HB2 GLU 74 2HB GLU 74 -5.537 -5.725 -2.016 1319 HB3 GLU 74 1HB GLU 74 -5.155 -6.374 -0.436 1320 HG2 GLU 74 2HG GLU 74 -6.339 -4.491 0.593 1321 HG3 GLU 74 1HG GLU 74 -6.749 -3.890 -1.020 1322 H GLU 75 H GLU 75 -3.519 -5.212 -3.350 1323 HA GLU 75 HA GLU 75 -2.007 -7.574 -2.957 1324 HB2 GLU 75 2HB GLU 75 -3.340 -6.672 -5.041 1325 HB3 GLU 75 1HB GLU 75 -1.790 -5.950 -5.444 1326 HG2 GLU 75 2HG GLU 75 -1.945 -8.054 -6.578 1327 HG3 GLU 75 1HG GLU 75 -0.761 -8.206 -5.280 1328 H LEU 76 H LEU 76 -1.212 -4.184 -3.586 1329 HA LEU 76 HA LEU 76 1.552 -4.402 -4.013 1330 HB2 LEU 76 2HB LEU 76 0.082 -2.147 -2.634 1331 HB3 LEU 76 1HB LEU 76 1.707 -2.056 -3.265 1332 HG LEU 76 HG LEU 76 -0.835 -2.337 -4.868 1333 HD11 LEU 76 1HD1 LEU 76 -0.284 -0.099 -5.670 1334 HD12 LEU 76 2HD1 LEU 76 1.115 -0.062 -4.600 1335 HD13 LEU 76 3HD1 LEU 76 -0.507 -0.122 -3.922 1336 HD21 LEU 76 1HD2 LEU 76 0.986 -3.540 -5.947 1337 HD22 LEU 76 2HD2 LEU 76 2.023 -2.122 -5.808 1338 HD23 LEU 76 3HD2 LEU 76 0.593 -2.072 -6.839 1339 H THR 77 H THR 77 -0.273 -3.812 -0.992 1340 HA THR 77 HA THR 77 1.911 -3.666 0.712 1341 HB THR 77 HB THR 77 -0.912 -4.615 1.279 1342 HG1 THR 77 1HG THR 77 -1.183 -2.559 0.556 1343 HG21 THR 77 1HG2 THR 77 -0.499 -3.822 3.551 1344 HG22 THR 77 2HG2 THR 77 1.156 -3.389 3.124 1345 HG23 THR 77 3HG2 THR 77 0.660 -5.085 3.133 1346 H LYS 78 H LYS 78 -0.037 -6.453 -0.282 1347 HA LYS 78 HA LYS 78 1.186 -8.349 1.424 1348 HB2 LYS 78 2HB LYS 78 -0.308 -8.735 -1.160 1349 HB3 LYS 78 1HB LYS 78 0.176 -10.036 -0.076 1350 HG2 LYS 78 2HG LYS 78 -1.161 -9.156 1.663 1351 HG3 LYS 78 1HG LYS 78 -1.589 -7.745 0.716 1352 HD2 LYS 78 2HD LYS 78 -3.422 -9.353 0.695 1353 HD3 LYS 78 1HD LYS 78 -2.721 -9.226 -0.915 1354 HE2 LYS 78 2HE LYS 78 -1.449 -11.289 -0.516 1355 HE3 LYS 78 1HE LYS 78 -2.129 -11.394 1.106 1356 HZ1 LYS 78 1HZ LYS 78 -4.342 -11.524 0.032 1357 HZ2 LYS 78 2HZ LYS 78 -3.347 -12.817 -0.206 1358 HZ3 LYS 78 3HZ LYS 78 -3.575 -11.692 -1.475 1359 H TYR 79 H TYR 79 1.681 -7.603 -1.961 1360 HA TYR 79 HA TYR 79 3.593 -9.615 -2.465 1361 HB2 TYR 79 2HB TYR 79 2.211 -8.384 -4.137 1362 HB3 TYR 79 1HB TYR 79 3.227 -6.985 -3.869 1363 HD1 TYR 79 1HD TYR 79 2.784 -10.037 -5.636 1364 HD2 TYR 79 2HD TYR 79 5.673 -7.157 -4.521 1365 HE1 TYR 79 1HE TYR 79 4.218 -10.803 -7.471 1366 HE2 TYR 79 2HE TYR 79 7.138 -7.893 -6.381 1367 HH TYR 79 HH TYR 79 7.452 -10.008 -7.780 1368 H TYR 80 H TYR 80 3.879 -6.276 -1.410 1369 HA TYR 80 HA TYR 80 6.652 -5.933 -1.636 1370 HB2 TYR 80 2HB TYR 80 5.027 -4.113 -1.179 1371 HB3 TYR 80 1HB TYR 80 4.743 -4.781 0.419 1372 HD1 TYR 80 1HD TYR 80 7.065 -2.937 -1.707 1373 HD2 TYR 80 2HD TYR 80 6.385 -4.437 2.204 1374 HE1 TYR 80 1HE TYR 80 8.866 -1.499 -0.852 1375 HE2 TYR 80 2HE TYR 80 8.191 -3.004 3.073 1376 HH TYR 80 HH TYR 80 9.529 -0.477 1.271 1377 H LEU 81 H LEU 81 4.660 -6.992 1.080 1378 HA LEU 81 HA LEU 81 6.896 -7.538 2.758 1379 HB2 LEU 81 2HB LEU 81 4.000 -8.232 3.002 1380 HB3 LEU 81 1HB LEU 81 5.171 -8.547 4.274 1381 HG LEU 81 HG LEU 81 4.340 -5.841 3.207 1382 HD11 LEU 81 1HD1 LEU 81 3.803 -7.178 5.854 1383 HD12 LEU 81 2HD1 LEU 81 2.627 -6.888 4.573 1384 HD13 LEU 81 3HD1 LEU 81 3.357 -5.527 5.421 1385 HD21 LEU 81 1HD2 LEU 81 5.705 -4.917 5.024 1386 HD22 LEU 81 2HD2 LEU 81 6.695 -5.828 3.888 1387 HD23 LEU 81 3HD2 LEU 81 6.256 -6.538 5.440 1388 H ALA 82 H ALA 82 5.137 -9.402 0.428 1389 HA ALA 82 HA ALA 82 5.789 -11.975 1.380 1390 HB1 ALA 82 1HB ALA 82 5.327 -11.072 -1.468 1391 HB2 ALA 82 2HB ALA 82 4.074 -11.591 -0.338 1392 HB3 ALA 82 3HB ALA 82 5.292 -12.740 -0.896 1393 H ASN 83 H ASN 83 7.427 -9.707 -0.699 1394 HA ASN 83 HA ASN 83 9.573 -11.516 -1.237 1395 HB2 ASN 83 2HB ASN 83 9.195 -8.615 -1.891 1396 HB3 ASN 83 1HB ASN 83 10.726 -9.434 -2.217 1397 HD21 ASN 83 1HD2 ASN 83 7.321 -9.219 -3.058 1398 HD22 ASN 83 2HD2 ASN 83 7.471 -10.149 -4.503 1399 H HIS 84 H HIS 84 8.875 -9.467 1.337 1400 HA HIS 84 HA HIS 84 11.569 -9.234 2.346 1401 HB2 HIS 84 2HB HIS 84 9.717 -7.748 3.195 1402 HB3 HIS 84 1HB HIS 84 8.908 -9.153 3.860 1403 HD1 HIS 84 1HD HIS 84 11.513 -10.389 5.334 1404 HD2 HIS 84 2HD HIS 84 10.253 -6.428 5.589 1405 HE1 HIS 84 1HE HIS 84 12.457 -9.523 7.460 1406 HE2 HIS 84 2HE HIS 84 11.312 -7.396 7.789 1407 H GLY 85 H GLY 85 9.158 -11.697 2.124 1408 HA2 GLY 85 2HA GLY 85 9.702 -13.946 2.613 1409 HA3 GLY 85 1HA GLY 85 10.794 -13.369 3.866 1410 H ILE 86 H ILE 86 7.677 -11.914 3.570 1411 HA ILE 86 HA ILE 86 6.924 -13.269 6.030 1412 HB ILE 86 HB ILE 86 5.780 -10.773 4.744 1413 HG12 ILE 86 2HG1 ILE 86 7.494 -11.138 7.211 1414 HG13 ILE 86 1HG1 ILE 86 8.000 -10.416 5.689 1415 HG21 ILE 86 1HG2 ILE 86 4.468 -10.520 6.806 1416 HG22 ILE 86 2HG2 ILE 86 5.101 -12.056 7.396 1417 HG23 ILE 86 3HG2 ILE 86 4.062 -12.021 5.970 1418 HD11 ILE 86 1HD1 ILE 86 7.547 -8.730 7.369 1419 HD12 ILE 86 2HD1 ILE 86 5.903 -9.372 7.539 1420 HD13 ILE 86 3HD1 ILE 86 6.403 -8.618 6.022 1421 H ASP 87 H ASP 87 5.420 -14.748 5.981 1422 HA ASP 87 HA ASP 87 4.104 -15.405 3.484 1423 HB2 ASP 87 2HB ASP 87 4.117 -16.730 6.190 1424 HB3 ASP 87 1HB ASP 87 2.910 -17.171 5.000 1425 H ILE 88 H ILE 88 2.337 -14.562 2.855 1426 HA ILE 88 HA ILE 88 0.403 -13.563 4.834 1427 HB ILE 88 HB ILE 88 0.970 -12.339 2.120 1428 HG12 ILE 88 2HG1 ILE 88 1.701 -11.316 4.874 1429 HG13 ILE 88 1HG1 ILE 88 2.834 -11.947 3.687 1430 HG21 ILE 88 1HG2 ILE 88 -0.779 -11.427 4.407 1431 HG22 ILE 88 2HG2 ILE 88 -1.341 -12.068 2.867 1432 HG23 ILE 88 3HG2 ILE 88 -0.490 -10.519 2.921 1433 HD11 ILE 88 1HD1 ILE 88 2.808 -9.511 3.811 1434 HD12 ILE 88 2HD1 ILE 88 1.113 -9.513 3.280 1435 HD13 ILE 88 3HD1 ILE 88 2.373 -10.106 2.213 1436 H LYS 89 H LYS 89 -1.662 -14.172 4.459 1437 HA LYS 89 HA LYS 89 -2.106 -15.876 2.154 1438 HB2 LYS 89 2HB LYS 89 -2.545 -16.813 4.417 1439 HB3 LYS 89 1HB LYS 89 -3.760 -15.569 4.669 1440 HG2 LYS 89 2HG LYS 89 -5.035 -16.412 2.817 1441 HG3 LYS 89 1HG LYS 89 -3.820 -17.651 2.514 1442 HD2 LYS 89 2HD LYS 89 -4.240 -18.559 4.786 1443 HD3 LYS 89 1HD LYS 89 -5.523 -17.367 4.996 1444 HE2 LYS 89 2HE LYS 89 -6.435 -19.535 4.329 1445 HE3 LYS 89 1HE LYS 89 -6.725 -18.313 3.089 1446 HZ1 LYS 89 1HZ LYS 89 -4.829 -19.197 1.855 1447 HZ2 LYS 89 2HZ LYS 89 -5.972 -20.374 2.081 1448 HZ3 LYS 89 3HZ LYS 89 -4.576 -20.381 3.017 Start of MODEL 18 1 H1 MET 1 1HT MET 1 -5.342 20.349 -0.176 2 H2 MET 1 2HT MET 1 -6.868 21.032 -0.338 3 H3 MET 1 3HT MET 1 -6.677 19.355 -0.239 4 HA MET 1 HA MET 1 -5.964 21.231 1.928 5 HB2 MET 1 2HB MET 1 -8.249 19.254 1.742 6 HB3 MET 1 1HB MET 1 -7.830 20.203 3.158 7 HG2 MET 1 2HG MET 1 -8.813 21.271 0.522 8 HG3 MET 1 1HG MET 1 -9.738 21.160 2.018 9 HE1 MET 1 1HE MET 1 -10.430 23.655 1.863 10 HE2 MET 1 2HE MET 1 -9.541 23.833 0.348 11 HE3 MET 1 3HE MET 1 -9.298 24.990 1.654 12 H GLY 2 H GLY 2 -5.108 20.199 3.771 13 HA2 GLY 2 2HA GLY 2 -4.003 17.558 3.126 14 HA3 GLY 2 1HA GLY 2 -3.230 18.746 4.167 15 H PHE 3 H PHE 3 -4.563 19.379 6.105 16 HA PHE 3 HA PHE 3 -5.460 18.919 8.072 17 HB2 PHE 3 2HB PHE 3 -6.984 16.803 6.563 18 HB3 PHE 3 1HB PHE 3 -7.207 17.073 8.286 19 HD1 PHE 3 1HD PHE 3 -8.073 19.233 9.083 20 HD2 PHE 3 2HD PHE 3 -7.949 18.249 4.946 21 HE1 PHE 3 1HE PHE 3 -9.673 21.029 8.617 22 HE2 PHE 3 2HE PHE 3 -9.556 20.052 4.475 23 HZ PHE 3 HZ PHE 3 -10.417 21.441 6.324 24 H THR 4 H THR 4 -3.152 17.320 6.870 25 HA THR 4 HA THR 4 -3.036 15.268 8.937 26 HB THR 4 HB THR 4 -2.734 14.371 6.689 27 HG1 THR 4 1HG THR 4 -1.292 13.744 8.544 28 HG21 THR 4 1HG2 THR 4 -0.837 15.049 5.257 29 HG22 THR 4 2HG2 THR 4 -0.441 16.322 6.412 30 HG23 THR 4 3HG2 THR 4 -1.965 16.378 5.531 31 H ASP 5 H ASP 5 -1.615 15.468 10.555 32 HA ASP 5 HA ASP 5 0.722 17.101 10.263 33 HB2 ASP 5 2HB ASP 5 0.308 18.534 12.195 34 HB3 ASP 5 1HB ASP 5 -0.945 18.776 10.992 35 H GLU 6 H GLU 6 2.178 16.812 12.005 36 HA GLU 6 HA GLU 6 1.564 14.616 13.831 37 HB2 GLU 6 2HB GLU 6 2.960 14.069 11.610 38 HB3 GLU 6 1HB GLU 6 4.262 14.831 12.498 39 HG2 GLU 6 2HG GLU 6 2.721 12.377 13.360 40 HG3 GLU 6 1HG GLU 6 4.329 12.392 12.668 41 H THR 7 H THR 7 2.081 15.370 15.826 42 HA THR 7 HA THR 7 3.441 17.903 16.033 43 HB THR 7 HB THR 7 2.397 16.139 18.276 44 HG1 THR 7 1HG THR 7 0.886 16.931 16.594 45 HG21 THR 7 1HG2 THR 7 3.032 19.103 18.178 46 HG22 THR 7 2HG2 THR 7 4.008 17.877 18.992 47 HG23 THR 7 3HG2 THR 7 2.378 18.234 19.565 48 H VAL 8 H VAL 8 5.492 17.515 15.420 49 HA VAL 8 HA VAL 8 7.071 15.806 17.154 50 HB VAL 8 HB VAL 8 6.483 14.467 15.208 51 HG11 VAL 8 1HG1 VAL 8 6.057 16.190 13.579 52 HG12 VAL 8 2HG1 VAL 8 7.234 15.035 12.951 53 HG13 VAL 8 3HG1 VAL 8 7.765 16.614 13.535 54 HG21 VAL 8 1HG2 VAL 8 8.742 13.860 14.458 55 HG22 VAL 8 2HG2 VAL 8 8.667 14.121 16.208 56 HG23 VAL 8 3HG2 VAL 8 9.343 15.365 15.164 57 H ARG 9 H ARG 9 8.967 16.638 17.661 58 HA ARG 9 HA ARG 9 10.043 18.826 16.051 59 HB2 ARG 9 2HB ARG 9 10.448 18.293 19.014 60 HB3 ARG 9 1HB ARG 9 11.275 19.547 18.099 61 HG2 ARG 9 2HG ARG 9 9.147 20.659 17.676 62 HG3 ARG 9 1HG ARG 9 8.300 19.382 18.549 63 HD2 ARG 9 2HD ARG 9 9.509 19.966 20.586 64 HD3 ARG 9 1HD ARG 9 10.377 21.232 19.717 65 HE ARG 9 HE ARG 9 7.772 21.841 19.309 66 HH11 ARG 9 1HH1 ARG 9 9.680 21.331 22.266 67 HH12 ARG 9 2HH1 ARG 9 8.707 22.384 23.194 68 HH21 ARG 9 1HH2 ARG 9 6.498 23.249 20.598 69 HH22 ARG 9 2HH2 ARG 9 6.881 23.496 22.252 70 H PHE 10 H PHE 10 10.955 17.376 14.690 71 HA PHE 10 HA PHE 10 13.439 16.152 15.476 72 HB2 PHE 10 2HB PHE 10 11.717 14.466 16.123 73 HB3 PHE 10 1HB PHE 10 11.074 14.529 14.501 74 HD1 PHE 10 1HD PHE 10 14.055 13.591 16.467 75 HD2 PHE 10 2HD PHE 10 11.868 13.117 12.859 76 HE1 PHE 10 1HE PHE 10 15.480 11.687 15.858 77 HE2 PHE 10 2HE PHE 10 13.274 11.233 12.237 78 HZ PHE 10 HZ PHE 10 15.095 10.498 13.734 79 H ASP 11 H ASP 11 14.684 16.725 13.816 80 HA ASP 11 HA ASP 11 13.702 18.026 11.543 81 HB2 ASP 11 2HB ASP 11 16.476 16.916 12.032 82 HB3 ASP 11 1HB ASP 11 16.031 17.998 10.720 83 H PHE 12 H PHE 12 15.386 14.910 11.700 84 HA PHE 12 HA PHE 12 13.716 13.704 9.765 85 HB2 PHE 12 2HB PHE 12 15.347 13.459 7.933 86 HB3 PHE 12 1HB PHE 12 15.014 15.163 8.212 87 HD1 PHE 12 1HD PHE 12 16.713 16.579 9.309 88 HD2 PHE 12 2HD PHE 12 17.528 12.537 8.267 89 HE1 PHE 12 1HE PHE 12 19.110 17.000 9.578 90 HE2 PHE 12 2HE PHE 12 19.931 12.949 8.534 91 HZ PHE 12 HZ PHE 12 20.731 15.183 9.191 92 H ASP 13 H ASP 13 14.398 11.521 9.411 93 HA ASP 13 HA ASP 13 16.249 10.611 11.476 94 HB2 ASP 13 2HB ASP 13 15.256 8.366 11.153 95 HB3 ASP 13 1HB ASP 13 14.043 9.532 11.632 96 H ASP 14 H ASP 14 18.133 9.696 10.929 97 HA ASP 14 HA ASP 14 18.512 9.186 8.085 98 HB2 ASP 14 2HB ASP 14 20.290 10.605 9.100 99 HB3 ASP 14 1HB ASP 14 20.629 9.338 10.272 100 H ASN 15 H ASN 15 17.365 7.406 7.982 101 HA ASN 15 HA ASN 15 18.669 5.040 8.997 102 HB2 ASN 15 2HB ASN 15 16.808 5.594 10.623 103 HB3 ASN 15 1HB ASN 15 15.673 5.485 9.287 104 HD21 ASN 15 1HD2 ASN 15 15.664 3.955 11.703 105 HD22 ASN 15 2HD2 ASN 15 15.829 2.290 11.256 106 H ARG 16 H ARG 16 19.252 5.420 6.740 107 HA ARG 16 HA ARG 16 17.128 4.557 4.987 108 HB2 ARG 16 2HB ARG 16 19.871 5.615 4.244 109 HB3 ARG 16 1HB ARG 16 18.633 5.133 3.086 110 HG2 ARG 16 2HG ARG 16 17.113 6.836 4.096 111 HG3 ARG 16 1HG ARG 16 18.458 7.376 5.086 112 HD2 ARG 16 2HD ARG 16 18.375 7.367 2.080 113 HD3 ARG 16 1HD ARG 16 18.095 8.775 3.102 114 HE ARG 16 HE ARG 16 20.607 7.588 3.624 115 HH11 ARG 16 1HH1 ARG 16 18.886 9.682 1.364 116 HH12 ARG 16 2HH1 ARG 16 20.269 10.451 0.742 117 HH21 ARG 16 1HH2 ARG 16 22.560 8.639 2.752 118 HH22 ARG 16 2HH2 ARG 16 22.414 9.815 1.537 119 H LYS 17 H LYS 17 16.882 2.681 5.613 120 HA LYS 17 HA LYS 17 18.767 0.560 5.001 121 HB2 LYS 17 2HB LYS 17 19.173 1.454 7.353 122 HB3 LYS 17 1HB LYS 17 17.512 1.072 7.737 123 HG2 LYS 17 2HG LYS 17 18.030 -1.338 7.451 124 HG3 LYS 17 1HG LYS 17 19.704 -0.907 7.074 125 HD2 LYS 17 2HD LYS 17 18.249 -0.312 9.650 126 HD3 LYS 17 1HD LYS 17 19.396 -1.628 9.409 127 HE2 LYS 17 2HE LYS 17 21.158 0.022 8.926 128 HE3 LYS 17 1HE LYS 17 20.004 1.328 9.173 129 HZ1 LYS 17 1HZ LYS 17 19.745 0.625 11.464 130 HZ2 LYS 17 2HZ LYS 17 21.350 0.956 11.131 131 HZ3 LYS 17 3HZ LYS 17 20.843 -0.635 11.243 132 H LYS 18 H LYS 18 16.993 -1.402 6.246 133 HA LYS 18 HA LYS 18 14.731 -1.278 4.494 134 HB2 LYS 18 2HB LYS 18 14.174 -3.465 5.338 135 HB3 LYS 18 1HB LYS 18 15.913 -3.400 5.165 136 HG2 LYS 18 2HG LYS 18 16.180 -3.103 7.562 137 HG3 LYS 18 1HG LYS 18 14.431 -3.036 7.767 138 HD2 LYS 18 2HD LYS 18 14.323 -5.354 6.785 139 HD3 LYS 18 1HD LYS 18 16.084 -5.397 6.871 140 HE2 LYS 18 2HE LYS 18 14.190 -5.039 9.199 141 HE3 LYS 18 1HE LYS 18 15.066 -6.511 8.802 142 HZ1 LYS 18 1HZ LYS 18 16.127 -5.300 10.563 143 HZ2 LYS 18 2HZ LYS 18 16.286 -3.925 9.598 144 HZ3 LYS 18 3HZ LYS 18 17.134 -5.331 9.216 145 H ALA 19 H ALA 19 14.787 0.907 6.385 146 HA ALA 19 HA ALA 19 13.421 0.592 8.789 147 HB1 ALA 19 1HB ALA 19 14.711 2.559 8.126 148 HB2 ALA 19 2HB ALA 19 13.097 2.945 8.762 149 HB3 ALA 19 3HB ALA 19 13.384 2.960 7.017 150 H ILE 20 H ILE 20 12.037 1.579 5.634 151 HA ILE 20 HA ILE 20 9.420 1.796 6.693 152 HB ILE 20 HB ILE 20 10.342 1.519 3.801 153 HG12 ILE 20 2HG1 ILE 20 9.412 3.917 5.403 154 HG13 ILE 20 1HG1 ILE 20 11.067 3.583 4.930 155 HG21 ILE 20 1HG2 ILE 20 7.583 2.189 4.826 156 HG22 ILE 20 2HG2 ILE 20 8.051 0.713 3.983 157 HG23 ILE 20 3HG2 ILE 20 8.100 2.261 3.140 158 HD11 ILE 20 1HD1 ILE 20 10.073 5.283 3.517 159 HD12 ILE 20 2HD1 ILE 20 8.772 4.185 3.072 160 HD13 ILE 20 3HD1 ILE 20 10.428 3.836 2.569 161 H SER 21 H SER 21 11.260 -0.715 5.227 162 HA SER 21 HA SER 21 9.168 -2.615 4.865 163 HB2 SER 21 2HB SER 21 12.120 -3.107 5.323 164 HB3 SER 21 1HB SER 21 10.969 -4.256 4.635 165 HG SER 21 HG SER 21 10.671 -2.190 3.149 166 H GLU 22 H GLU 22 11.510 -2.012 7.404 167 HA GLU 22 HA GLU 22 11.018 -3.989 9.287 168 HB2 GLU 22 2HB GLU 22 12.845 -2.287 9.281 169 HB3 GLU 22 1HB GLU 22 11.668 -1.062 9.710 170 HG2 GLU 22 2HG GLU 22 12.832 -1.629 11.670 171 HG3 GLU 22 1HG GLU 22 11.238 -2.367 11.808 172 H THR 23 H THR 23 9.639 -0.785 8.884 173 HA THR 23 HA THR 23 7.925 -0.706 11.069 174 HB THR 23 HB THR 23 7.621 0.644 8.374 175 HG1 THR 23 1HG THR 23 9.609 1.124 9.386 176 HG21 THR 23 1HG2 THR 23 5.556 0.751 9.701 177 HG22 THR 23 2HG2 THR 23 6.322 2.335 9.608 178 HG23 THR 23 3HG2 THR 23 6.462 1.374 11.078 179 H LEU 24 H LEU 24 7.195 -1.584 7.684 180 HA LEU 24 HA LEU 24 4.477 -2.150 8.243 181 HB2 LEU 24 2HB LEU 24 6.147 -2.906 5.863 182 HB3 LEU 24 1HB LEU 24 4.405 -3.069 5.964 183 HG LEU 24 HG LEU 24 5.943 -0.477 6.041 184 HD11 LEU 24 1HD1 LEU 24 4.175 -1.682 3.938 185 HD12 LEU 24 2HD1 LEU 24 5.926 -1.494 3.851 186 HD13 LEU 24 3HD1 LEU 24 4.882 -0.071 3.886 187 HD21 LEU 24 1HD2 LEU 24 3.935 -0.321 7.411 188 HD22 LEU 24 2HD2 LEU 24 2.964 -0.986 6.096 189 HD23 LEU 24 3HD2 LEU 24 3.732 0.594 5.922 190 H GLU 25 H GLU 25 7.352 -4.177 8.054 191 HA GLU 25 HA GLU 25 6.011 -6.632 8.077 192 HB2 GLU 25 2HB GLU 25 8.431 -6.365 7.589 193 HB3 GLU 25 1HB GLU 25 8.707 -5.984 9.283 194 HG2 GLU 25 2HG GLU 25 7.846 -8.196 9.899 195 HG3 GLU 25 1HG GLU 25 7.650 -8.573 8.191 196 H THR 26 H THR 26 7.104 -4.467 10.634 197 HA THR 26 HA THR 26 6.465 -6.093 12.842 198 HB THR 26 HB THR 26 6.488 -3.059 12.724 199 HG1 THR 26 1HG THR 26 8.492 -3.812 12.039 200 HG21 THR 26 1HG2 THR 26 7.004 -3.197 15.118 201 HG22 THR 26 2HG2 THR 26 6.951 -4.965 15.027 202 HG23 THR 26 3HG2 THR 26 5.487 -4.033 14.754 203 H VAL 27 H VAL 27 4.617 -3.624 11.066 204 HA VAL 27 HA VAL 27 2.311 -3.641 12.669 205 HB VAL 27 HB VAL 27 2.512 -3.076 9.681 206 HG11 VAL 27 1HG1 VAL 27 0.211 -3.514 10.354 207 HG12 VAL 27 2HG1 VAL 27 0.436 -1.800 9.979 208 HG13 VAL 27 3HG1 VAL 27 0.362 -2.336 11.657 209 HG21 VAL 27 1HG2 VAL 27 2.580 -1.174 12.026 210 HG22 VAL 27 2HG2 VAL 27 2.593 -0.716 10.322 211 HG23 VAL 27 3HG2 VAL 27 3.948 -1.613 11.005 212 H TYR 28 H TYR 28 3.307 -5.622 9.961 213 HA TYR 28 HA TYR 28 0.944 -7.020 9.550 214 HB2 TYR 28 2HB TYR 28 2.831 -7.184 7.980 215 HB3 TYR 28 1HB TYR 28 3.780 -8.030 9.195 216 HD1 TYR 28 1HD TYR 28 3.368 -10.369 9.701 217 HD2 TYR 28 2HD TYR 28 0.975 -8.314 6.847 218 HE1 TYR 28 1HE TYR 28 2.422 -12.527 8.935 219 HE2 TYR 28 2HE TYR 28 0.032 -10.447 6.079 220 HH TYR 28 HH TYR 28 0.353 -13.306 7.819 221 H ARG 29 H ARG 29 3.697 -7.779 11.590 222 HA ARG 29 HA ARG 29 2.794 -10.244 12.603 223 HB2 ARG 29 2HB ARG 29 4.638 -8.261 13.938 224 HB3 ARG 29 1HB ARG 29 4.505 -9.970 14.311 225 HG2 ARG 29 2HG ARG 29 5.369 -10.533 12.080 226 HG3 ARG 29 1HG ARG 29 5.496 -8.811 11.703 227 HD2 ARG 29 2HD ARG 29 7.003 -8.537 13.578 228 HD3 ARG 29 1HD ARG 29 6.957 -10.269 13.906 229 HE ARG 29 HE ARG 29 8.128 -8.980 11.518 230 HH11 ARG 29 1HH1 ARG 29 7.915 -11.807 13.633 231 HH12 ARG 29 2HH1 ARG 29 9.352 -12.515 13.060 232 HH21 ARG 29 1HH2 ARG 29 10.102 -9.929 10.746 233 HH22 ARG 29 2HH2 ARG 29 10.622 -11.438 11.349 234 H ALA 30 H ALA 30 2.268 -6.952 13.680 235 HA ALA 30 HA ALA 30 1.238 -7.453 16.227 236 HB1 ALA 30 1HB ALA 30 1.907 -5.225 15.444 237 HB2 ALA 30 2HB ALA 30 0.273 -5.219 16.106 238 HB3 ALA 30 3HB ALA 30 0.515 -5.194 14.361 239 H LEU 31 H LEU 31 -0.500 -7.130 13.129 240 HA LEU 31 HA LEU 31 -2.960 -7.672 14.450 241 HB2 LEU 31 2HB LEU 31 -2.403 -7.468 11.510 242 HB3 LEU 31 1HB LEU 31 -3.983 -7.896 12.128 243 HG LEU 31 HG LEU 31 -3.803 -5.736 13.453 244 HD11 LEU 31 1HD1 LEU 31 -1.725 -5.149 11.386 245 HD12 LEU 31 2HD1 LEU 31 -1.524 -5.177 13.138 246 HD13 LEU 31 3HD1 LEU 31 -2.519 -3.932 12.376 247 HD21 LEU 31 1HD2 LEU 31 -4.732 -4.409 11.629 248 HD22 LEU 31 2HD2 LEU 31 -5.423 -6.015 11.727 249 HD23 LEU 31 3HD2 LEU 31 -4.257 -5.628 10.465 250 H GLU 32 H GLU 32 -0.650 -9.683 12.893 251 HA GLU 32 HA GLU 32 -2.284 -11.966 12.699 252 HB2 GLU 32 2HB GLU 32 0.693 -11.667 13.033 253 HB3 GLU 32 1HB GLU 32 -0.081 -13.232 12.817 254 HG2 GLU 32 2HG GLU 32 -0.312 -10.946 10.880 255 HG3 GLU 32 1HG GLU 32 0.888 -12.232 10.750 256 H GLU 33 H GLU 33 -0.569 -10.529 15.367 257 HA GLU 33 HA GLU 33 -0.971 -12.698 17.207 258 HB2 GLU 33 2HB GLU 33 -0.380 -9.778 17.693 259 HB3 GLU 33 1HB GLU 33 -0.367 -11.020 18.932 260 HG2 GLU 33 2HG GLU 33 1.435 -10.932 16.529 261 HG3 GLU 33 1HG GLU 33 1.875 -10.431 18.156 262 H LYS 34 H LYS 34 -2.861 -10.058 16.096 263 HA LYS 34 HA LYS 34 -4.753 -10.286 18.317 264 HB2 LYS 34 2HB LYS 34 -4.555 -8.304 16.066 265 HB3 LYS 34 1HB LYS 34 -5.843 -8.292 17.256 266 HG2 LYS 34 2HG LYS 34 -2.910 -8.007 17.891 267 HG3 LYS 34 1HG LYS 34 -4.041 -6.667 17.724 268 HD2 LYS 34 2HD LYS 34 -4.339 -8.905 19.746 269 HD3 LYS 34 1HD LYS 34 -3.609 -7.343 20.087 270 HE2 LYS 34 2HE LYS 34 -5.679 -6.218 19.543 271 HE3 LYS 34 1HE LYS 34 -6.447 -7.750 19.119 272 HZ1 LYS 34 1HZ LYS 34 -6.142 -8.465 21.402 273 HZ2 LYS 34 2HZ LYS 34 -7.066 -7.069 21.335 274 HZ3 LYS 34 3HZ LYS 34 -5.452 -6.993 21.827 275 H GLY 35 H GLY 35 -4.351 -11.567 15.261 276 HA2 GLY 35 2HA GLY 35 -5.700 -13.191 14.298 277 HA3 GLY 35 1HA GLY 35 -6.973 -12.762 15.423 278 H TYR 36 H TYR 36 -5.657 -10.101 13.748 279 HA TYR 36 HA TYR 36 -8.140 -9.908 12.167 280 HB2 TYR 36 2HB TYR 36 -5.987 -7.833 12.617 281 HB3 TYR 36 1HB TYR 36 -7.485 -7.564 11.749 282 HD1 TYR 36 1HD TYR 36 -5.830 -6.924 14.657 283 HD2 TYR 36 2HD TYR 36 -9.634 -8.270 13.337 284 HE1 TYR 36 1HE TYR 36 -6.818 -6.130 16.747 285 HE2 TYR 36 2HE TYR 36 -10.647 -7.473 15.445 286 HH TYR 36 HH TYR 36 -9.927 -6.987 17.738 287 H ASN 37 H ASN 37 -7.592 -8.537 9.995 288 HA ASN 37 HA ASN 37 -5.552 -10.061 8.573 289 HB2 ASN 37 2HB ASN 37 -7.809 -8.306 7.533 290 HB3 ASN 37 1HB ASN 37 -6.590 -9.030 6.501 291 HD21 ASN 37 1HD2 ASN 37 -6.655 -11.228 6.112 292 HD22 ASN 37 2HD2 ASN 37 -8.020 -12.207 6.497 293 HA PRO 38 HA PRO 38 -2.919 -6.516 9.612 294 HB2 PRO 38 2HB PRO 38 -1.185 -8.010 7.738 295 HB3 PRO 38 1HB PRO 38 -0.863 -7.343 9.349 296 HG2 PRO 38 2HG PRO 38 -1.224 -9.964 8.967 297 HG3 PRO 38 1HG PRO 38 -1.769 -9.144 10.438 298 HD2 PRO 38 2HD PRO 38 -3.354 -10.158 8.143 299 HD3 PRO 38 1HD PRO 38 -3.791 -9.960 9.858 300 H ILE 39 H ILE 39 -3.298 -7.800 6.373 301 HA ILE 39 HA ILE 39 -2.131 -5.628 5.005 302 HB ILE 39 HB ILE 39 -4.186 -7.585 3.979 303 HG12 ILE 39 2HG1 ILE 39 -2.298 -8.768 4.961 304 HG13 ILE 39 1HG1 ILE 39 -2.274 -8.927 3.214 305 HG21 ILE 39 1HG2 ILE 39 -3.186 -7.133 1.766 306 HG22 ILE 39 2HG2 ILE 39 -2.130 -5.928 2.511 307 HG23 ILE 39 3HG2 ILE 39 -3.874 -5.678 2.480 308 HD11 ILE 39 1HD1 ILE 39 -0.508 -7.242 3.086 309 HD12 ILE 39 2HD1 ILE 39 -0.039 -8.573 4.155 310 HD13 ILE 39 3HD1 ILE 39 -0.564 -7.045 4.838 311 H ASN 40 H ASN 40 -5.458 -6.387 5.862 312 HA ASN 40 HA ASN 40 -6.725 -4.382 4.361 313 HB2 ASN 40 2HB ASN 40 -7.620 -5.883 6.816 314 HB3 ASN 40 1HB ASN 40 -8.638 -4.686 6.036 315 HD21 ASN 40 1HD2 ASN 40 -6.552 -6.677 4.067 316 HD22 ASN 40 2HD2 ASN 40 -7.779 -7.680 3.435 317 H GLN 41 H GLN 41 -5.456 -4.305 7.638 318 HA GLN 41 HA GLN 41 -6.449 -1.662 7.939 319 HB2 GLN 41 2HB GLN 41 -4.559 -3.177 9.703 320 HB3 GLN 41 1HB GLN 41 -5.112 -1.538 10.023 321 HG2 GLN 41 2HG GLN 41 -6.789 -4.030 9.894 322 HG3 GLN 41 1HG GLN 41 -6.456 -3.031 11.304 323 HE21 GLN 41 1HE2 GLN 41 -8.955 -3.732 10.310 324 HE22 GLN 41 2HE2 GLN 41 -9.829 -2.318 9.850 325 H ILE 42 H ILE 42 -3.390 -2.949 6.876 326 HA ILE 42 HA ILE 42 -2.000 -0.486 7.050 327 HB ILE 42 HB ILE 42 -1.475 -2.811 5.159 328 HG12 ILE 42 2HG1 ILE 42 -0.178 -2.087 7.803 329 HG13 ILE 42 1HG1 ILE 42 -1.331 -3.393 7.563 330 HG21 ILE 42 1HG2 ILE 42 0.277 -0.434 5.875 331 HG22 ILE 42 2HG2 ILE 42 -0.442 -0.765 4.314 332 HG23 ILE 42 3HG2 ILE 42 0.808 -1.839 4.938 333 HD11 ILE 42 1HD1 ILE 42 0.263 -4.522 6.094 334 HD12 ILE 42 2HD1 ILE 42 0.951 -4.225 7.690 335 HD13 ILE 42 3HD1 ILE 42 1.414 -3.205 6.327 336 H VAL 43 H VAL 43 -3.691 -2.043 4.327 337 HA VAL 43 HA VAL 43 -3.323 0.048 2.521 338 HB VAL 43 HB VAL 43 -4.121 -2.098 1.685 339 HG11 VAL 43 1HG1 VAL 43 -5.437 -2.770 3.614 340 HG12 VAL 43 2HG1 VAL 43 -6.350 -2.920 2.118 341 HG13 VAL 43 3HG1 VAL 43 -6.661 -1.563 3.211 342 HG21 VAL 43 1HG2 VAL 43 -6.263 -0.023 1.304 343 HG22 VAL 43 2HG2 VAL 43 -5.997 -1.429 0.275 344 HG23 VAL 43 3HG2 VAL 43 -4.770 -0.161 0.375 345 H GLY 44 H GLY 44 -5.788 -0.412 4.991 346 HA2 GLY 44 2HA GLY 44 -7.419 1.769 4.360 347 HA3 GLY 44 1HA GLY 44 -7.243 1.054 5.961 348 H TYR 45 H TYR 45 -4.634 1.555 6.593 349 HA TYR 45 HA TYR 45 -4.774 4.231 7.397 350 HB2 TYR 45 2HB TYR 45 -3.436 2.733 8.744 351 HB3 TYR 45 1HB TYR 45 -2.342 2.420 7.396 352 HD1 TYR 45 1HD TYR 45 -0.428 3.782 7.089 353 HD2 TYR 45 2HD TYR 45 -3.567 5.171 9.582 354 HE1 TYR 45 1HE TYR 45 0.944 5.714 7.727 355 HE2 TYR 45 2HE TYR 45 -2.210 7.108 10.221 356 HH TYR 45 HH TYR 45 0.164 7.756 10.310 357 H LEU 46 H LEU 46 -2.772 2.789 4.845 358 HA LEU 46 HA LEU 46 -1.629 5.292 4.268 359 HB2 LEU 46 2HB LEU 46 -1.621 2.756 2.680 360 HB3 LEU 46 1HB LEU 46 -0.896 4.224 2.057 361 HG LEU 46 HG LEU 46 0.604 4.206 4.112 362 HD11 LEU 46 1HD1 LEU 46 0.927 2.192 5.332 363 HD12 LEU 46 2HD1 LEU 46 -0.354 1.413 4.415 364 HD13 LEU 46 3HD1 LEU 46 -0.750 2.738 5.501 365 HD21 LEU 46 1HD2 LEU 46 1.411 3.528 1.940 366 HD22 LEU 46 2HD2 LEU 46 0.796 1.897 2.205 367 HD23 LEU 46 3HD2 LEU 46 2.104 2.523 3.210 368 H LEU 47 H LEU 47 -4.450 3.700 2.882 369 HA LEU 47 HA LEU 47 -4.586 5.721 0.863 370 HB2 LEU 47 2HB LEU 47 -6.624 3.628 1.594 371 HB3 LEU 47 1HB LEU 47 -6.746 4.705 0.223 372 HG LEU 47 HG LEU 47 -4.742 2.493 0.634 373 HD11 LEU 47 1HD1 LEU 47 -5.746 1.554 -1.371 374 HD12 LEU 47 2HD1 LEU 47 -6.885 2.895 -1.431 375 HD13 LEU 47 3HD1 LEU 47 -6.934 1.759 -0.082 376 HD21 LEU 47 1HD2 LEU 47 -3.876 3.076 -1.596 377 HD22 LEU 47 2HD2 LEU 47 -3.585 4.342 -0.409 378 HD23 LEU 47 3HD2 LEU 47 -4.881 4.523 -1.595 379 H SER 48 H SER 48 -6.161 5.271 4.002 380 HA SER 48 HA SER 48 -7.858 7.567 3.427 381 HB2 SER 48 2HB SER 48 -7.665 5.843 5.883 382 HB3 SER 48 1HB SER 48 -8.901 7.073 5.593 383 HG SER 48 HG SER 48 -8.848 5.453 3.492 384 H GLY 49 H GLY 49 -4.841 6.895 5.170 385 HA2 GLY 49 2HA GLY 49 -3.418 8.320 6.172 386 HA3 GLY 49 1HA GLY 49 -4.442 9.650 5.649 387 H ASP 50 H ASP 50 -5.460 6.949 7.723 388 HA ASP 50 HA ASP 50 -5.623 8.844 9.949 389 HB2 ASP 50 2HB ASP 50 -7.865 8.647 8.989 390 HB3 ASP 50 1HB ASP 50 -7.796 6.896 9.156 391 HA PRO 51 HA PRO 51 -3.213 5.656 11.908 392 HB2 PRO 51 2HB PRO 51 -4.024 6.954 14.430 393 HB3 PRO 51 1HB PRO 51 -2.414 6.653 13.760 394 HG2 PRO 51 2HG PRO 51 -3.468 9.112 13.783 395 HG3 PRO 51 1HG PRO 51 -2.451 8.551 12.449 396 HD2 PRO 51 2HD PRO 51 -5.425 8.826 12.582 397 HD3 PRO 51 1HD PRO 51 -4.288 9.176 11.254 398 H ALA 52 H ALA 52 -6.584 6.153 12.782 399 HA ALA 52 HA ALA 52 -6.737 4.305 14.890 400 HB1 ALA 52 1HB ALA 52 -8.946 5.184 13.062 401 HB2 ALA 52 2HB ALA 52 -8.399 6.043 14.496 402 HB3 ALA 52 3HB ALA 52 -9.138 4.448 14.649 403 H TYR 53 H TYR 53 -6.441 3.693 11.580 404 HA TYR 53 HA TYR 53 -7.790 1.181 11.357 405 HB2 TYR 53 2HB TYR 53 -5.502 2.405 9.836 406 HB3 TYR 53 1HB TYR 53 -6.209 0.840 9.439 407 HD1 TYR 53 1HD TYR 53 -8.662 0.759 8.997 408 HD2 TYR 53 2HD TYR 53 -6.494 4.377 9.017 409 HE1 TYR 53 1HE TYR 53 -10.419 1.760 7.750 410 HE2 TYR 53 2HE TYR 53 -8.276 5.462 7.735 411 HH TYR 53 HH TYR 53 -10.081 4.755 6.161 412 H ILE 54 H ILE 54 -4.574 2.047 12.607 413 HA ILE 54 HA ILE 54 -3.946 -0.786 12.632 414 HB ILE 54 HB ILE 54 -2.129 1.527 13.436 415 HG12 ILE 54 2HG1 ILE 54 -2.709 1.653 11.047 416 HG13 ILE 54 1HG1 ILE 54 -1.042 1.134 11.260 417 HG21 ILE 54 1HG2 ILE 54 -0.325 -0.104 13.261 418 HG22 ILE 54 2HG2 ILE 54 -1.495 -1.372 12.906 419 HG23 ILE 54 3HG2 ILE 54 -1.500 -0.588 14.486 420 HD11 ILE 54 1HD1 ILE 54 -3.371 -0.654 10.595 421 HD12 ILE 54 2HD1 ILE 54 -1.701 -1.174 10.811 422 HD13 ILE 54 3HD1 ILE 54 -2.125 -0.103 9.477 423 HA PRO 55 HA PRO 55 -5.425 -1.285 16.824 424 HB2 PRO 55 2HB PRO 55 -3.593 -3.634 16.612 425 HB3 PRO 55 1HB PRO 55 -5.279 -3.570 17.141 426 HG2 PRO 55 2HG PRO 55 -4.696 -4.521 14.764 427 HG3 PRO 55 1HG PRO 55 -6.097 -3.456 14.982 428 HD2 PRO 55 2HD PRO 55 -3.405 -2.822 13.842 429 HD3 PRO 55 1HD PRO 55 -5.022 -2.290 13.312 430 H ARG 56 H ARG 56 -4.631 -0.868 18.769 431 HA ARG 56 HA ARG 56 -1.947 0.193 18.892 432 HB2 ARG 56 2HB ARG 56 -4.333 0.459 20.704 433 HB3 ARG 56 1HB ARG 56 -2.763 1.165 21.058 434 HG2 ARG 56 2HG ARG 56 -2.861 2.557 19.114 435 HG3 ARG 56 1HG ARG 56 -4.318 1.743 18.545 436 HD2 ARG 56 2HD ARG 56 -4.132 3.258 21.126 437 HD3 ARG 56 1HD ARG 56 -4.686 3.983 19.614 438 HE ARG 56 HE ARG 56 -6.220 1.759 19.925 439 HH11 ARG 56 1HH1 ARG 56 -5.573 4.551 21.991 440 HH12 ARG 56 2HH1 ARG 56 -7.140 4.601 22.652 441 HH21 ARG 56 1HH2 ARG 56 -8.369 1.849 20.801 442 HH22 ARG 56 2HH2 ARG 56 -8.773 3.035 21.965 443 H TYR 57 H TYR 57 -2.701 -2.690 19.076 444 HA TYR 57 HA TYR 57 -2.045 -3.798 21.524 445 HB2 TYR 57 2HB TYR 57 -2.961 -5.085 19.679 446 HB3 TYR 57 1HB TYR 57 -1.514 -4.805 18.727 447 HD1 TYR 57 1HD TYR 57 -2.497 -6.261 22.029 448 HD2 TYR 57 2HD TYR 57 0.008 -6.540 18.608 449 HE1 TYR 57 1HE TYR 57 -1.600 -8.381 22.865 450 HE2 TYR 57 2HE TYR 57 0.919 -8.659 19.446 451 HH TYR 57 HH TYR 57 1.161 -9.862 21.478 452 H GLN 58 H GLN 58 0.138 -2.667 18.931 453 HA GLN 58 HA GLN 58 2.326 -2.833 20.839 454 HB2 GLN 58 2HB GLN 58 2.463 -3.797 17.974 455 HB3 GLN 58 1HB GLN 58 3.865 -3.555 19.000 456 HG2 GLN 58 2HG GLN 58 3.005 -5.250 20.547 457 HG3 GLN 58 1HG GLN 58 1.625 -5.499 19.487 458 HE21 GLN 58 1HE2 GLN 58 5.026 -5.986 19.927 459 HE22 GLN 58 2HE2 GLN 58 5.236 -7.126 18.652 460 H ASP 59 H ASP 59 4.290 -1.662 19.857 461 HA ASP 59 HA ASP 59 3.518 1.026 19.417 462 HB2 ASP 59 2HB ASP 59 5.914 1.581 19.253 463 HB3 ASP 59 1HB ASP 59 5.557 0.622 20.666 464 H ALA 60 H ALA 60 3.837 -1.475 17.316 465 HA ALA 60 HA ALA 60 4.790 -0.476 14.945 466 HB1 ALA 60 1HB ALA 60 3.971 -2.778 15.289 467 HB2 ALA 60 2HB ALA 60 3.311 -2.043 13.825 468 HB3 ALA 60 3HB ALA 60 2.317 -2.169 15.274 469 H ARG 61 H ARG 61 1.667 0.179 16.466 470 HA ARG 61 HA ARG 61 0.576 1.615 14.347 471 HB2 ARG 61 2HB ARG 61 -0.957 2.677 16.071 472 HB3 ARG 61 1HB ARG 61 -0.990 0.934 15.982 473 HG2 ARG 61 2HG ARG 61 -1.146 1.690 18.249 474 HG3 ARG 61 1HG ARG 61 0.384 0.824 18.056 475 HD2 ARG 61 2HD ARG 61 1.420 3.139 17.858 476 HD3 ARG 61 1HD ARG 61 -0.154 3.781 18.320 477 HE ARG 61 HE ARG 61 0.536 1.873 20.204 478 HH11 ARG 61 1HH1 ARG 61 1.613 5.113 19.214 479 HH12 ARG 61 2HH1 ARG 61 2.413 5.427 20.682 480 HH21 ARG 61 1HH2 ARG 61 1.595 2.357 22.219 481 HH22 ARG 61 2HH2 ARG 61 2.404 3.845 22.435 482 H ASN 62 H ASN 62 2.841 2.649 16.791 483 HA ASN 62 HA ASN 62 2.517 5.424 16.080 484 HB2 ASN 62 2HB ASN 62 3.259 4.733 18.384 485 HB3 ASN 62 1HB ASN 62 4.774 4.187 17.672 486 HD21 ASN 62 1HD2 ASN 62 5.992 5.665 18.844 487 HD22 ASN 62 2HD2 ASN 62 5.985 7.351 18.501 488 H LEU 63 H LEU 63 4.709 2.812 15.416 489 HA LEU 63 HA LEU 63 6.781 4.119 14.100 490 HB2 LEU 63 2HB LEU 63 5.625 1.420 13.382 491 HB3 LEU 63 1HB LEU 63 7.228 1.999 12.997 492 HG LEU 63 HG LEU 63 6.208 1.304 15.776 493 HD11 LEU 63 1HD1 LEU 63 8.281 0.001 14.037 494 HD12 LEU 63 2HD1 LEU 63 6.655 -0.621 14.290 495 HD13 LEU 63 3HD1 LEU 63 7.784 -0.503 15.643 496 HD21 LEU 63 1HD2 LEU 63 8.926 2.239 14.869 497 HD22 LEU 63 2HD2 LEU 63 8.495 1.710 16.494 498 HD23 LEU 63 3HD2 LEU 63 7.784 3.182 15.826 499 H ILE 64 H ILE 64 3.782 2.808 12.778 500 HA ILE 64 HA ILE 64 4.306 3.509 10.056 501 HB ILE 64 HB ILE 64 2.732 1.677 10.902 502 HG12 ILE 64 2HG1 ILE 64 1.505 3.666 8.967 503 HG13 ILE 64 1HG1 ILE 64 2.719 2.469 8.533 504 HG21 ILE 64 1HG2 ILE 64 0.903 4.053 11.451 505 HG22 ILE 64 2HG2 ILE 64 1.551 2.967 12.633 506 HG23 ILE 64 3HG2 ILE 64 0.383 2.372 11.450 507 HD11 ILE 64 1HD1 ILE 64 1.143 0.678 9.125 508 HD12 ILE 64 2HD1 ILE 64 0.492 1.742 7.879 509 HD13 ILE 64 3HD1 ILE 64 -0.066 1.893 9.542 510 H ARG 65 H ARG 65 3.061 5.102 12.776 511 HA ARG 65 HA ARG 65 1.370 6.950 11.360 512 HB2 ARG 65 2HB ARG 65 0.859 5.697 13.502 513 HB3 ARG 65 1HB ARG 65 2.017 6.731 14.287 514 HG2 ARG 65 2HG ARG 65 -0.440 7.742 12.907 515 HG3 ARG 65 1HG ARG 65 -0.396 7.274 14.601 516 HD2 ARG 65 2HD ARG 65 1.200 9.420 13.265 517 HD3 ARG 65 1HD ARG 65 -0.207 9.551 14.348 518 HE ARG 65 HE ARG 65 1.796 8.094 15.646 519 HH11 ARG 65 1HH1 ARG 65 1.039 11.406 14.717 520 HH12 ARG 65 2HH1 ARG 65 2.171 12.117 15.772 521 HH21 ARG 65 1HH2 ARG 65 3.319 9.042 17.155 522 HH22 ARG 65 2HH2 ARG 65 3.458 10.741 17.241 523 H ARG 66 H ARG 66 4.520 6.822 12.845 524 HA ARG 66 HA ARG 66 4.973 9.662 12.871 525 HB2 ARG 66 2HB ARG 66 6.887 7.342 12.985 526 HB3 ARG 66 1HB ARG 66 7.366 9.017 13.164 527 HG2 ARG 66 2HG ARG 66 5.963 9.169 15.173 528 HG3 ARG 66 1HG ARG 66 5.542 7.464 14.980 529 HD2 ARG 66 2HD ARG 66 7.349 7.733 16.584 530 HD3 ARG 66 1HD ARG 66 7.887 6.858 15.153 531 HE ARG 66 HE ARG 66 8.405 9.547 14.737 532 HH11 ARG 66 1HH1 ARG 66 9.506 6.982 16.886 533 HH12 ARG 66 2HH1 ARG 66 11.065 7.641 17.129 534 HH21 ARG 66 1HH2 ARG 66 10.569 10.456 15.068 535 HH22 ARG 66 2HH2 ARG 66 11.661 9.645 16.109 536 H HIS 67 H HIS 67 4.936 7.257 10.549 537 HA HIS 67 HA HIS 67 6.658 8.780 8.807 538 HB2 HIS 67 2HB HIS 67 5.678 5.971 8.654 539 HB3 HIS 67 1HB HIS 67 6.238 6.802 7.204 540 HD1 HIS 67 1HD HIS 67 8.736 7.355 7.055 541 HD2 HIS 67 2HD HIS 67 7.683 5.245 10.478 542 HE1 HIS 67 1HE HIS 67 10.880 6.428 7.960 543 HE2 HIS 67 2HE HIS 67 10.240 5.501 10.203 544 H GLU 68 H GLU 68 6.059 8.889 6.612 545 HA GLU 68 HA GLU 68 3.455 10.115 6.420 546 HB2 GLU 68 2HB GLU 68 4.470 11.140 4.342 547 HB3 GLU 68 1HB GLU 68 5.237 11.596 5.846 548 HG2 GLU 68 2HG GLU 68 6.321 9.522 3.919 549 HG3 GLU 68 1HG GLU 68 6.832 11.201 3.987 550 H ARG 69 H ARG 69 1.923 9.436 4.963 551 HA ARG 69 HA ARG 69 2.107 6.698 4.280 552 HB2 ARG 69 2HB ARG 69 -0.078 8.663 3.391 553 HB3 ARG 69 1HB ARG 69 -0.085 6.943 3.144 554 HG2 ARG 69 2HG ARG 69 -1.540 7.271 4.896 555 HG3 ARG 69 1HG ARG 69 -0.066 6.792 5.722 556 HD2 ARG 69 2HD ARG 69 -0.904 9.668 5.342 557 HD3 ARG 69 1HD ARG 69 -1.422 8.714 6.712 558 HE ARG 69 HE ARG 69 1.231 8.528 6.889 559 HH11 ARG 69 1HH1 ARG 69 -0.854 11.343 6.301 560 HH12 ARG 69 2HH1 ARG 69 0.069 12.437 7.190 561 HH21 ARG 69 1HH2 ARG 69 2.543 10.041 8.156 562 HH22 ARG 69 2HH2 ARG 69 2.081 11.679 8.259 563 H ASP 70 H ASP 70 2.648 9.628 2.556 564 HA ASP 70 HA ASP 70 2.516 8.799 -0.117 565 HB2 ASP 70 2HB ASP 70 4.468 10.779 1.071 566 HB3 ASP 70 1HB ASP 70 4.156 10.572 -0.643 567 H GLU 71 H GLU 71 5.457 9.121 1.823 568 HA GLU 71 HA GLU 71 7.225 8.022 -0.024 569 HB2 GLU 71 2HB GLU 71 7.854 9.381 1.957 570 HB3 GLU 71 1HB GLU 71 7.491 8.000 2.980 571 HG2 GLU 71 2HG GLU 71 9.870 8.180 2.636 572 HG3 GLU 71 1HG GLU 71 9.257 6.720 1.857 573 H ILE 72 H ILE 72 5.474 6.466 2.625 574 HA ILE 72 HA ILE 72 6.698 3.941 2.368 575 HB ILE 72 HB ILE 72 3.910 4.551 3.385 576 HG12 ILE 72 2HG1 ILE 72 6.516 4.224 4.899 577 HG13 ILE 72 1HG1 ILE 72 5.652 5.736 4.656 578 HG21 ILE 72 1HG2 ILE 72 4.181 2.183 2.800 579 HG22 ILE 72 2HG2 ILE 72 4.061 2.391 4.550 580 HG23 ILE 72 3HG2 ILE 72 5.629 2.104 3.801 581 HD11 ILE 72 1HD1 ILE 72 4.637 3.356 6.196 582 HD12 ILE 72 2HD1 ILE 72 3.779 4.880 5.973 583 HD13 ILE 72 3HD1 ILE 72 5.287 4.835 6.894 584 H MET 73 H MET 73 3.715 5.251 0.928 585 HA MET 73 HA MET 73 3.042 2.834 -0.363 586 HB2 MET 73 2HB MET 73 1.493 4.778 0.216 587 HB3 MET 73 1HB MET 73 2.179 5.618 -1.153 588 HG2 MET 73 2HG MET 73 0.681 3.003 -1.300 589 HG3 MET 73 1HG MET 73 -0.023 4.579 -1.604 590 HE1 MET 73 1HE MET 73 0.029 2.934 -5.129 591 HE2 MET 73 2HE MET 73 -0.935 3.711 -3.871 592 HE3 MET 73 3HE MET 73 -0.237 2.116 -3.586 593 H GLU 74 H GLU 74 4.871 5.708 -1.393 594 HA GLU 74 HA GLU 74 5.225 4.872 -4.069 595 HB2 GLU 74 2HB GLU 74 7.018 6.618 -2.380 596 HB3 GLU 74 1HB GLU 74 7.151 6.437 -4.122 597 HG2 GLU 74 2HG GLU 74 4.877 7.345 -4.318 598 HG3 GLU 74 1HG GLU 74 4.879 7.648 -2.580 599 H GLU 75 H GLU 75 6.925 4.170 -1.109 600 HA GLU 75 HA GLU 75 9.156 2.849 -2.222 601 HB2 GLU 75 2HB GLU 75 8.823 3.663 0.190 602 HB3 GLU 75 1HB GLU 75 7.852 2.224 0.433 603 HG2 GLU 75 2HG GLU 75 10.075 1.841 1.262 604 HG3 GLU 75 1HG GLU 75 9.819 0.850 -0.177 605 H LEU 76 H LEU 76 5.955 1.794 -1.134 606 HA LEU 76 HA LEU 76 6.156 -0.968 -1.579 607 HB2 LEU 76 2HB LEU 76 3.726 0.776 -2.005 608 HB3 LEU 76 1HB LEU 76 3.715 -0.959 -1.813 609 HG LEU 76 HG LEU 76 4.436 1.065 0.304 610 HD11 LEU 76 1HD1 LEU 76 2.381 0.344 1.366 611 HD12 LEU 76 2HD1 LEU 76 2.048 -0.743 0.016 612 HD13 LEU 76 3HD1 LEU 76 2.054 1.004 -0.234 613 HD21 LEU 76 1HD2 LEU 76 4.215 -1.930 0.459 614 HD22 LEU 76 2HD2 LEU 76 4.459 -0.835 1.820 615 HD23 LEU 76 3HD2 LEU 76 5.702 -0.983 0.582 616 H THR 77 H THR 77 5.002 1.657 -3.715 617 HA THR 77 HA THR 77 4.368 0.096 -5.883 618 HB THR 77 HB THR 77 5.293 2.978 -5.827 619 HG1 THR 77 1HG THR 77 3.440 2.873 -4.586 620 HG21 THR 77 1HG2 THR 77 5.309 2.011 -8.107 621 HG22 THR 77 2HG2 THR 77 4.015 3.200 -7.916 622 HG23 THR 77 3HG2 THR 77 3.647 1.476 -7.884 623 H LYS 78 H LYS 78 7.510 1.674 -5.147 624 HA LYS 78 HA LYS 78 8.684 0.893 -7.610 625 HB2 LYS 78 2HB LYS 78 10.118 1.454 -5.025 626 HB3 LYS 78 1HB LYS 78 10.892 1.302 -6.592 627 HG2 LYS 78 2HG LYS 78 9.509 3.274 -7.297 628 HG3 LYS 78 1HG LYS 78 9.070 3.482 -5.607 629 HD2 LYS 78 2HD LYS 78 11.829 3.633 -6.842 630 HD3 LYS 78 1HD LYS 78 10.954 4.920 -6.023 631 HE2 LYS 78 2HE LYS 78 12.039 2.402 -4.739 632 HE3 LYS 78 1HE LYS 78 12.752 4.001 -4.632 633 HZ1 LYS 78 1HZ LYS 78 11.375 3.311 -2.669 634 HZ2 LYS 78 2HZ LYS 78 10.028 3.374 -3.664 635 HZ3 LYS 78 3HZ LYS 78 10.905 4.780 -3.394 636 H TYR 79 H TYR 79 8.817 -0.552 -4.408 637 HA TYR 79 HA TYR 79 10.605 -2.597 -5.117 638 HB2 TYR 79 2HB TYR 79 10.161 -1.797 -2.814 639 HB3 TYR 79 1HB TYR 79 8.588 -2.570 -2.877 640 HD1 TYR 79 1HD TYR 79 12.103 -3.496 -3.600 641 HD2 TYR 79 2HD TYR 79 8.458 -4.550 -1.738 642 HE1 TYR 79 1HE TYR 79 13.158 -5.566 -2.724 643 HE2 TYR 79 2HE TYR 79 9.465 -6.599 -0.865 644 HH TYR 79 HH TYR 79 12.837 -7.167 -0.961 645 H TYR 80 H TYR 80 7.137 -2.369 -5.252 646 HA TYR 80 HA TYR 80 6.508 -5.061 -5.793 647 HB2 TYR 80 2HB TYR 80 4.854 -3.359 -5.144 648 HB3 TYR 80 1HB TYR 80 5.141 -2.502 -6.645 649 HD1 TYR 80 1HD TYR 80 3.696 -5.522 -5.146 650 HD2 TYR 80 2HD TYR 80 4.050 -3.183 -8.669 651 HE1 TYR 80 1HE TYR 80 1.846 -6.790 -6.164 652 HE2 TYR 80 2HE TYR 80 2.208 -4.434 -9.699 653 HH TYR 80 HH TYR 80 0.177 -6.475 -7.909 654 H LEU 81 H LEU 81 7.178 -2.297 -7.902 655 HA LEU 81 HA LEU 81 6.880 -3.770 -10.311 656 HB2 LEU 81 2HB LEU 81 8.084 -1.075 -9.782 657 HB3 LEU 81 1HB LEU 81 7.817 -1.722 -11.390 658 HG LEU 81 HG LEU 81 5.693 -1.049 -9.348 659 HD11 LEU 81 1HD1 LEU 81 6.443 0.270 -11.948 660 HD12 LEU 81 2HD1 LEU 81 6.717 0.915 -10.330 661 HD13 LEU 81 3HD1 LEU 81 5.071 0.709 -10.931 662 HD21 LEU 81 1HD2 LEU 81 4.096 -1.522 -11.147 663 HD22 LEU 81 2HD2 LEU 81 5.011 -2.963 -10.711 664 HD23 LEU 81 3HD2 LEU 81 5.415 -2.070 -12.178 665 H ALA 82 H ALA 82 9.697 -2.859 -8.344 666 HA ALA 82 HA ALA 82 11.678 -3.390 -10.225 667 HB1 ALA 82 1HB ALA 82 12.080 -2.207 -8.124 668 HB2 ALA 82 2HB ALA 82 13.197 -3.559 -8.337 669 HB3 ALA 82 3HB ALA 82 11.827 -3.712 -7.234 670 H ASN 83 H ASN 83 9.962 -5.516 -8.079 671 HA ASN 83 HA ASN 83 11.619 -7.783 -8.623 672 HB2 ASN 83 2HB ASN 83 9.028 -7.485 -7.158 673 HB3 ASN 83 1HB ASN 83 9.674 -9.083 -7.515 674 HD21 ASN 83 1HD2 ASN 83 10.131 -6.131 -5.659 675 HD22 ASN 83 2HD2 ASN 83 11.342 -6.796 -4.629 676 H HIS 84 H HIS 84 9.606 -6.300 -10.676 677 HA HIS 84 HA HIS 84 8.964 -8.846 -11.987 678 HB2 HIS 84 2HB HIS 84 7.814 -6.096 -12.517 679 HB3 HIS 84 1HB HIS 84 7.527 -7.483 -13.560 680 HD1 HIS 84 1HD HIS 84 6.706 -9.667 -11.805 681 HD2 HIS 84 2HD HIS 84 5.653 -5.733 -10.995 682 HE1 HIS 84 1HE HIS 84 4.755 -9.822 -10.269 683 HE2 HIS 84 2HE HIS 84 3.904 -7.524 -10.181 684 H GLY 85 H GLY 85 11.452 -6.927 -11.857 685 HA2 GLY 85 2HA GLY 85 13.286 -6.938 -13.304 686 HA3 GLY 85 1HA GLY 85 12.252 -7.591 -14.570 687 H ILE 86 H ILE 86 11.183 -4.860 -12.797 688 HA ILE 86 HA ILE 86 11.404 -3.238 -15.208 689 HB ILE 86 HB ILE 86 9.876 -2.791 -12.635 690 HG12 ILE 86 2HG1 ILE 86 8.920 -3.488 -15.412 691 HG13 ILE 86 1HG1 ILE 86 8.938 -4.567 -14.019 692 HG21 ILE 86 1HG2 ILE 86 8.829 -0.876 -13.742 693 HG22 ILE 86 2HG2 ILE 86 9.853 -1.125 -15.151 694 HG23 ILE 86 3HG2 ILE 86 10.578 -0.651 -13.612 695 HD11 ILE 86 1HD1 ILE 86 7.364 -2.038 -14.276 696 HD12 ILE 86 2HD1 ILE 86 7.350 -3.135 -12.888 697 HD13 ILE 86 3HD1 ILE 86 6.715 -3.670 -14.446 698 H ASP 87 H ASP 87 12.857 -1.731 -15.331 699 HA ASP 87 HA ASP 87 14.498 -1.113 -12.995 700 HB2 ASP 87 2HB ASP 87 15.697 -1.598 -15.080 701 HB3 ASP 87 1HB ASP 87 14.817 -0.312 -15.897 702 H ILE 88 H ILE 88 14.063 0.585 -11.796 703 HA ILE 88 HA ILE 88 12.103 2.453 -12.825 704 HB ILE 88 HB ILE 88 12.941 1.880 -9.981 705 HG12 ILE 88 2HG1 ILE 88 10.425 1.217 -11.507 706 HG13 ILE 88 1HG1 ILE 88 11.694 0.077 -11.083 707 HG21 ILE 88 1HG2 ILE 88 11.035 3.274 -9.297 708 HG22 ILE 88 2HG2 ILE 88 10.756 3.714 -10.983 709 HG23 ILE 88 3HG2 ILE 88 12.240 4.213 -10.178 710 HD11 ILE 88 1HD1 ILE 88 9.962 1.590 -9.160 711 HD12 ILE 88 2HD1 ILE 88 11.226 0.443 -8.736 712 HD13 ILE 88 3HD1 ILE 88 9.796 -0.108 -9.608 713 H LYS 89 H LYS 89 12.363 4.460 -12.944 714 HA LYS 89 HA LYS 89 14.993 5.664 -13.003 715 HB2 LYS 89 2HB LYS 89 13.396 5.979 -14.744 716 HB3 LYS 89 1HB LYS 89 12.224 6.645 -13.629 717 HG2 LYS 89 2HG LYS 89 13.694 8.575 -13.253 718 HG3 LYS 89 1HG LYS 89 14.849 7.906 -14.412 719 HD2 LYS 89 2HD LYS 89 11.976 8.610 -15.043 720 HD3 LYS 89 1HD LYS 89 13.375 9.612 -15.439 721 HE2 LYS 89 2HE LYS 89 14.256 7.875 -16.882 722 HE3 LYS 89 1HE LYS 89 12.978 6.775 -16.401 723 HZ1 LYS 89 1HZ LYS 89 12.589 7.758 -18.542 724 HZ2 LYS 89 2HZ LYS 89 12.509 9.314 -17.880 725 HZ3 LYS 89 3HZ LYS 89 11.386 8.116 -17.433 726 H1 MET 1 H MET 1 4.088 -9.454 -20.584 727 HA MET 1 HA MET 1 4.888 -8.824 -18.207 728 HB2 MET 1 2HB MET 1 7.422 -9.004 -19.863 729 HB3 MET 1 1HB MET 1 7.302 -8.283 -18.268 730 HG2 MET 1 2HG MET 1 6.806 -11.183 -18.904 731 HG3 MET 1 1HG MET 1 8.301 -10.529 -18.239 732 HE1 MET 1 1HE MET 1 6.619 -12.956 -16.942 733 HE2 MET 1 2HE MET 1 6.742 -12.536 -15.234 734 HE3 MET 1 3HE MET 1 8.138 -12.349 -16.289 735 H GLY 2 H GLY 2 3.525 -7.169 -18.748 736 HA2 GLY 2 2HA GLY 2 3.104 -4.993 -19.317 737 HA3 GLY 2 1HA GLY 2 4.689 -4.902 -20.080 738 H PHE 3 H PHE 3 2.349 -3.852 -21.208 739 HA PHE 3 HA PHE 3 1.425 -3.606 -23.245 740 HB2 PHE 3 2HB PHE 3 3.184 -5.910 -24.149 741 HB3 PHE 3 1HB PHE 3 2.257 -4.871 -25.214 742 HD1 PHE 3 1HD PHE 3 2.970 -2.548 -25.581 743 HD2 PHE 3 2HD PHE 3 5.266 -5.225 -23.208 744 HE1 PHE 3 1HE PHE 3 4.914 -1.047 -25.767 745 HE2 PHE 3 2HE PHE 3 7.209 -3.731 -23.389 746 HZ PHE 3 HZ PHE 3 7.031 -1.637 -24.672 747 H THR 4 H THR 4 -0.626 -4.072 -22.919 748 HA THR 4 HA THR 4 -1.585 -6.694 -23.642 749 HB THR 4 HB THR 4 -1.140 -6.992 -21.252 750 HG1 THR 4 1HG THR 4 -3.704 -6.960 -22.237 751 HG21 THR 4 1HG2 THR 4 -2.966 -4.621 -20.815 752 HG22 THR 4 2HG2 THR 4 -1.226 -4.658 -20.524 753 HG23 THR 4 3HG2 THR 4 -2.309 -5.649 -19.540 754 H ASP 5 H ASP 5 -1.761 -3.938 -24.677 755 HA ASP 5 HA ASP 5 -4.405 -3.108 -23.987 756 HB2 ASP 5 2HB ASP 5 -4.161 -1.192 -25.496 757 HB3 ASP 5 1HB ASP 5 -2.850 -1.311 -24.350 758 H GLU 6 H GLU 6 -5.506 -4.802 -24.476 759 HA GLU 6 HA GLU 6 -7.113 -4.531 -26.751 760 HB2 GLU 6 2HB GLU 6 -5.082 -5.892 -27.676 761 HB3 GLU 6 1HB GLU 6 -5.602 -7.175 -26.604 762 HG2 GLU 6 2HG GLU 6 -7.163 -6.020 -28.919 763 HG3 GLU 6 1HG GLU 6 -6.357 -7.582 -28.882 764 H THR 7 H THR 7 -8.683 -4.426 -25.185 765 HA THR 7 HA THR 7 -9.043 -6.837 -23.592 766 HB THR 7 HB THR 7 -9.741 -5.330 -21.681 767 HG1 THR 7 1HG THR 7 -9.828 -3.454 -23.077 768 HG21 THR 7 1HG2 THR 7 -7.590 -6.523 -21.637 769 HG22 THR 7 2HG2 THR 7 -7.430 -4.927 -20.903 770 HG23 THR 7 3HG2 THR 7 -6.835 -5.213 -22.539 771 H VAL 8 H VAL 8 -10.915 -7.630 -24.276 772 HA VAL 8 HA VAL 8 -13.088 -6.108 -25.265 773 HB VAL 8 HB VAL 8 -12.796 -8.530 -25.778 774 HG11 VAL 8 1HG1 VAL 8 -13.350 -10.254 -24.151 775 HG12 VAL 8 2HG1 VAL 8 -13.471 -9.013 -22.901 776 HG13 VAL 8 3HG1 VAL 8 -11.927 -9.317 -23.693 777 HG21 VAL 8 1HG2 VAL 8 -15.125 -9.260 -25.496 778 HG22 VAL 8 2HG2 VAL 8 -15.024 -7.584 -26.036 779 HG23 VAL 8 3HG2 VAL 8 -15.387 -7.945 -24.350 780 H ARG 9 H ARG 9 -15.011 -5.407 -24.213 781 HA ARG 9 HA ARG 9 -14.702 -5.289 -21.301 782 HB2 ARG 9 2HB ARG 9 -16.110 -3.357 -23.127 783 HB3 ARG 9 1HB ARG 9 -16.080 -3.247 -21.373 784 HG2 ARG 9 2HG ARG 9 -13.633 -3.053 -21.470 785 HG3 ARG 9 1HG ARG 9 -13.731 -3.079 -23.228 786 HD2 ARG 9 2HD ARG 9 -15.037 -1.050 -21.430 787 HD3 ARG 9 1HD ARG 9 -13.543 -0.806 -22.334 788 HE ARG 9 HE ARG 9 -15.627 -1.570 -24.068 789 HH11 ARG 9 1HH1 ARG 9 -14.537 1.196 -22.123 790 HH12 ARG 9 2HH1 ARG 9 -15.277 2.352 -23.131 791 HH21 ARG 9 1HH2 ARG 9 -16.599 0.034 -25.446 792 HH22 ARG 9 2HH2 ARG 9 -16.437 1.691 -25.054 793 H PHE 10 H PHE 10 -16.404 -5.545 -19.967 794 HA PHE 10 HA PHE 10 -18.982 -6.384 -21.041 795 HB2 PHE 10 2HB PHE 10 -17.416 -7.928 -18.933 796 HB3 PHE 10 1HB PHE 10 -19.059 -8.277 -19.448 797 HD1 PHE 10 1HD PHE 10 -19.420 -8.917 -21.888 798 HD2 PHE 10 2HD PHE 10 -15.606 -8.907 -20.002 799 HE1 PHE 10 1HE PHE 10 -18.553 -10.401 -23.640 800 HE2 PHE 10 2HE PHE 10 -14.734 -10.385 -21.751 801 HZ PHE 10 HZ PHE 10 -16.202 -11.134 -23.573 802 H ASP 11 H ASP 11 -20.275 -6.858 -18.679 803 HA ASP 11 HA ASP 11 -20.473 -4.296 -17.461 804 HB2 ASP 11 2HB ASP 11 -21.481 -6.993 -16.488 805 HB3 ASP 11 1HB ASP 11 -21.920 -5.445 -15.789 806 H PHE 12 H PHE 12 -19.265 -7.390 -16.377 807 HA PHE 12 HA PHE 12 -17.225 -6.042 -14.839 808 HB2 PHE 12 2HB PHE 12 -17.572 -7.505 -12.877 809 HB3 PHE 12 1HB PHE 12 -19.005 -6.543 -13.192 810 HD1 PHE 12 1HD PHE 12 -21.031 -7.652 -14.157 811 HD2 PHE 12 2HD PHE 12 -17.610 -9.877 -12.933 812 HE1 PHE 12 1HE PHE 12 -22.376 -9.710 -14.130 813 HE2 PHE 12 2HE PHE 12 -18.952 -11.934 -12.906 814 HZ PHE 12 HZ PHE 12 -21.340 -11.853 -13.505 815 H ASP 13 H ASP 13 -15.301 -6.991 -15.152 816 HA ASP 13 HA ASP 13 -15.361 -9.639 -16.356 817 HB2 ASP 13 2HB ASP 13 -13.387 -9.048 -17.655 818 HB3 ASP 13 1HB ASP 13 -14.697 -7.932 -17.995 819 H ASP 14 H ASP 14 -13.515 -10.925 -15.954 820 HA ASP 14 HA ASP 14 -12.413 -10.397 -13.283 821 HB2 ASP 14 2HB ASP 14 -14.022 -12.148 -13.123 822 HB3 ASP 14 1HB ASP 14 -13.376 -12.957 -14.541 823 H ASN 15 H ASN 15 -10.278 -10.411 -13.132 824 HA ASN 15 HA ASN 15 -8.722 -12.204 -14.756 825 HB2 ASN 15 2HB ASN 15 -8.907 -10.084 -16.149 826 HB3 ASN 15 1HB ASN 15 -8.086 -9.236 -14.845 827 HD21 ASN 15 1HD2 ASN 15 -7.207 -9.509 -17.582 828 HD22 ASN 15 2HD2 ASN 15 -5.693 -10.328 -17.527 829 H ARG 16 H ARG 16 -8.103 -13.178 -12.860 830 HA ARG 16 HA ARG 16 -6.347 -11.554 -11.242 831 HB2 ARG 16 2HB ARG 16 -8.077 -13.864 -10.319 832 HB3 ARG 16 1HB ARG 16 -6.776 -13.177 -9.353 833 HG2 ARG 16 2HG ARG 16 -7.895 -10.986 -9.428 834 HG3 ARG 16 1HG ARG 16 -9.216 -11.721 -10.336 835 HD2 ARG 16 2HD ARG 16 -8.365 -12.507 -7.546 836 HD3 ARG 16 1HD ARG 16 -9.721 -11.457 -7.948 837 HE ARG 16 HE ARG 16 -9.984 -13.882 -9.315 838 HH11 ARG 16 1HH1 ARG 16 -10.212 -12.609 -6.001 839 HH12 ARG 16 2HH1 ARG 16 -11.349 -13.768 -5.502 840 HH21 ARG 16 1HH2 ARG 16 -11.533 -15.454 -8.605 841 HH22 ARG 16 2HH2 ARG 16 -12.102 -15.421 -6.994 842 H LYS 17 H LYS 17 -4.432 -11.951 -11.613 843 HA LYS 17 HA LYS 17 -3.214 -14.502 -12.172 844 HB2 LYS 17 2HB LYS 17 -4.655 -13.782 -14.203 845 HB3 LYS 17 1HB LYS 17 -3.546 -12.444 -14.391 846 HG2 LYS 17 2HG LYS 17 -1.708 -14.146 -14.755 847 HG3 LYS 17 1HG LYS 17 -2.956 -15.386 -14.707 848 HD2 LYS 17 2HD LYS 17 -2.810 -13.094 -16.669 849 HD3 LYS 17 1HD LYS 17 -2.468 -14.791 -17.014 850 HE2 LYS 17 2HE LYS 17 -4.803 -15.357 -16.488 851 HE3 LYS 17 1HE LYS 17 -5.130 -13.664 -16.132 852 HZ1 LYS 17 1HZ LYS 17 -5.881 -14.195 -18.313 853 HZ2 LYS 17 2HZ LYS 17 -4.388 -14.788 -18.778 854 HZ3 LYS 17 3HZ LYS 17 -4.574 -13.142 -18.446 855 H LYS 18 H LYS 18 -1.264 -12.838 -13.863 856 HA LYS 18 HA LYS 18 -0.113 -11.219 -11.762 857 HB2 LYS 18 2HB LYS 18 1.686 -10.768 -13.392 858 HB3 LYS 18 1HB LYS 18 1.387 -12.491 -13.265 859 HG2 LYS 18 2HG LYS 18 0.099 -12.416 -15.357 860 HG3 LYS 18 1HG LYS 18 0.390 -10.682 -15.459 861 HD2 LYS 18 2HD LYS 18 2.539 -12.805 -15.471 862 HD3 LYS 18 1HD LYS 18 1.892 -12.025 -16.910 863 HE2 LYS 18 2HE LYS 18 3.381 -10.650 -14.650 864 HE3 LYS 18 1HE LYS 18 4.034 -11.037 -16.236 865 HZ1 LYS 18 1HZ LYS 18 2.224 -9.532 -17.169 866 HZ2 LYS 18 2HZ LYS 18 3.386 -8.724 -16.242 867 HZ3 LYS 18 3HZ LYS 18 1.889 -9.095 -15.605 868 H ALA 19 H ALA 19 -2.744 -10.652 -12.977 869 HA ALA 19 HA ALA 19 -2.865 -8.650 -14.894 870 HB1 ALA 19 1HB ALA 19 -5.098 -8.294 -14.141 871 HB2 ALA 19 2HB ALA 19 -4.719 -9.151 -12.639 872 HB3 ALA 19 3HB ALA 19 -4.724 -10.031 -14.171 873 H ILE 20 H ILE 20 -2.947 -8.305 -11.342 874 HA ILE 20 HA ILE 20 -3.242 -5.499 -11.434 875 HB ILE 20 HB ILE 20 -2.166 -7.266 -9.210 876 HG12 ILE 20 2HG1 ILE 20 -4.876 -6.008 -9.680 877 HG13 ILE 20 1HG1 ILE 20 -4.487 -7.714 -9.823 878 HG21 ILE 20 1HG2 ILE 20 -1.328 -4.996 -8.918 879 HG22 ILE 20 2HG2 ILE 20 -2.552 -5.372 -7.702 880 HG23 ILE 20 3HG2 ILE 20 -2.964 -4.359 -9.088 881 HD11 ILE 20 1HD1 ILE 20 -5.650 -7.298 -7.783 882 HD12 ILE 20 2HD1 ILE 20 -4.485 -6.057 -7.311 883 HD13 ILE 20 3HD1 ILE 20 -3.992 -7.755 -7.405 884 H SER 21 H SER 21 -0.543 -7.610 -11.403 885 HA SER 21 HA SER 21 1.433 -5.580 -11.201 886 HB2 SER 21 2HB SER 21 1.606 -8.379 -12.306 887 HB3 SER 21 1HB SER 21 2.991 -7.318 -12.054 888 HG SER 21 HG SER 21 1.409 -7.481 -9.841 889 H GLU 22 H GLU 22 -0.025 -7.351 -13.849 890 HA GLU 22 HA GLU 22 1.378 -6.529 -16.083 891 HB2 GLU 22 2HB GLU 22 -0.507 -8.226 -15.807 892 HB3 GLU 22 1HB GLU 22 -1.612 -6.873 -15.900 893 HG2 GLU 22 2HG GLU 22 -1.566 -7.851 -18.035 894 HG3 GLU 22 1HG GLU 22 -0.600 -6.377 -18.156 895 H THR 23 H THR 23 -1.311 -5.071 -14.377 896 HA THR 23 HA THR 23 -1.876 -2.985 -16.168 897 HB THR 23 HB THR 23 -2.332 -3.108 -13.175 898 HG1 THR 23 1HG THR 23 -3.239 -4.857 -14.442 899 HG21 THR 23 1HG2 THR 23 -4.174 -1.531 -13.616 900 HG22 THR 23 2HG2 THR 23 -3.722 -1.474 -15.318 901 HG23 THR 23 3HG2 THR 23 -2.625 -0.841 -14.091 902 H LEU 24 H LEU 24 0.003 -2.976 -13.100 903 HA LEU 24 HA LEU 24 0.770 -0.239 -13.441 904 HB2 LEU 24 2HB LEU 24 1.861 -2.309 -11.538 905 HB3 LEU 24 1HB LEU 24 2.169 -0.588 -11.456 906 HG LEU 24 HG LEU 24 -0.490 -1.947 -11.029 907 HD11 LEU 24 1HD1 LEU 24 1.043 -2.264 -9.191 908 HD12 LEU 24 2HD1 LEU 24 -0.251 -1.153 -8.737 909 HD13 LEU 24 3HD1 LEU 24 1.353 -0.530 -9.124 910 HD21 LEU 24 1HD2 LEU 24 -0.823 0.222 -12.089 911 HD22 LEU 24 2HD2 LEU 24 0.231 0.986 -10.896 912 HD23 LEU 24 3HD2 LEU 24 -1.310 0.287 -10.401 913 H GLU 25 H GLU 25 2.189 -3.300 -14.077 914 HA GLU 25 HA GLU 25 4.835 -2.711 -14.581 915 HB2 GLU 25 2HB GLU 25 3.766 -4.921 -14.330 916 HB3 GLU 25 1HB GLU 25 2.949 -4.703 -15.845 917 HG2 GLU 25 2HG GLU 25 4.986 -4.998 -17.039 918 HG3 GLU 25 1HG GLU 25 5.936 -4.975 -15.550 919 H THR 26 H THR 26 1.962 -2.663 -16.655 920 HA THR 26 HA THR 26 3.244 -1.541 -18.957 921 HB THR 26 HB THR 26 0.323 -1.704 -18.232 922 HG1 THR 26 1HG THR 26 0.913 -3.787 -18.437 923 HG21 THR 26 1HG2 THR 26 0.797 -0.103 -20.022 924 HG22 THR 26 2HG2 THR 26 -0.043 -1.515 -20.661 925 HG23 THR 26 3HG2 THR 26 1.698 -1.343 -20.899 926 H VAL 27 H VAL 27 1.095 -0.173 -16.429 927 HA VAL 27 HA VAL 27 0.892 2.395 -17.450 928 HB VAL 27 HB VAL 27 0.847 1.571 -14.517 929 HG11 VAL 27 1HG1 VAL 27 1.291 3.962 -14.712 930 HG12 VAL 27 2HG1 VAL 27 -0.346 3.668 -14.107 931 HG13 VAL 27 3HG1 VAL 27 -0.095 4.126 -15.797 932 HG21 VAL 27 1HG2 VAL 27 -1.396 2.091 -16.474 933 HG22 VAL 27 2HG2 VAL 27 -1.585 1.713 -14.766 934 HG23 VAL 27 3HG2 VAL 27 -0.894 0.519 -15.860 935 H TYR 28 H TYR 28 3.449 1.072 -15.409 936 HA TYR 28 HA TYR 28 4.855 3.365 -14.818 937 HB2 TYR 28 2HB TYR 28 5.526 1.181 -13.898 938 HB3 TYR 28 1HB TYR 28 5.993 0.623 -15.501 939 HD1 TYR 28 1HD TYR 28 8.046 1.447 -16.556 940 HD2 TYR 28 2HD TYR 28 6.955 2.710 -12.644 941 HE1 TYR 28 1HE TYR 28 10.279 2.397 -16.246 942 HE2 TYR 28 2HE TYR 28 9.211 3.664 -12.331 943 HH TYR 28 HH TYR 28 11.224 4.184 -14.948 944 H ARG 29 H ARG 29 4.876 1.465 -17.730 945 HA ARG 29 HA ARG 29 7.104 2.727 -18.986 946 HB2 ARG 29 2HB ARG 29 4.892 1.134 -20.275 947 HB3 ARG 29 1HB ARG 29 6.522 1.381 -20.892 948 HG2 ARG 29 2HG ARG 29 7.434 0.142 -19.016 949 HG3 ARG 29 1HG ARG 29 5.817 -0.096 -18.372 950 HD2 ARG 29 2HD ARG 29 5.248 -1.277 -20.504 951 HD3 ARG 29 1HD ARG 29 6.959 -1.200 -20.931 952 HE ARG 29 HE ARG 29 6.094 -2.377 -18.410 953 HH11 ARG 29 1HH1 ARG 29 7.830 -2.735 -21.495 954 HH12 ARG 29 2HH1 ARG 29 8.347 -4.320 -21.164 955 HH21 ARG 29 1HH2 ARG 29 6.850 -4.610 -17.996 956 HH22 ARG 29 2HH2 ARG 29 7.790 -5.385 -19.193 957 H ALA 30 H ALA 30 3.690 3.267 -18.932 958 HA ALA 30 HA ALA 30 3.483 4.947 -21.183 959 HB1 ALA 30 1HB ALA 30 1.771 4.978 -18.701 960 HB2 ALA 30 2HB ALA 30 1.539 3.925 -20.094 961 HB3 ALA 30 3HB ALA 30 1.346 5.670 -20.267 962 H LEU 31 H LEU 31 4.099 5.746 -17.764 963 HA LEU 31 HA LEU 31 4.196 8.504 -18.444 964 HB2 LEU 31 2HB LEU 31 4.978 7.194 -15.850 965 HB3 LEU 31 1HB LEU 31 5.135 8.915 -16.125 966 HG LEU 31 HG LEU 31 2.648 8.785 -16.716 967 HD11 LEU 31 1HD1 LEU 31 2.334 6.423 -16.750 968 HD12 LEU 31 2HD1 LEU 31 1.361 7.131 -15.457 969 HD13 LEU 31 3HD1 LEU 31 2.862 6.295 -15.071 970 HD21 LEU 31 1HD2 LEU 31 3.413 10.060 -14.879 971 HD22 LEU 31 2HD2 LEU 31 3.607 8.641 -13.857 972 HD23 LEU 31 3HD2 LEU 31 2.010 9.146 -14.378 973 H GLU 32 H GLU 32 6.573 6.041 -18.276 974 HA GLU 32 HA GLU 32 8.871 7.643 -18.370 975 HB2 GLU 32 2HB GLU 32 8.301 4.974 -19.654 976 HB3 GLU 32 1HB GLU 32 9.902 5.700 -19.584 977 HG2 GLU 32 2HG GLU 32 8.245 5.041 -17.159 978 HG3 GLU 32 1HG GLU 32 9.443 3.958 -17.856 979 H GLU 33 H GLU 33 6.647 6.627 -20.871 980 HA GLU 33 HA GLU 33 7.993 7.729 -23.113 981 HB2 GLU 33 2HB GLU 33 5.071 7.132 -22.652 982 HB3 GLU 33 1HB GLU 33 5.749 7.583 -24.203 983 HG2 GLU 33 2HG GLU 33 6.557 5.145 -22.635 984 HG3 GLU 33 1HG GLU 33 5.352 5.164 -23.921 985 H LYS 34 H LYS 34 5.728 9.046 -20.790 986 HA LYS 34 HA LYS 34 5.388 11.487 -22.349 987 HB2 LYS 34 2HB LYS 34 4.048 10.521 -19.846 988 HB3 LYS 34 1HB LYS 34 3.750 12.101 -20.546 989 HG2 LYS 34 2HG LYS 34 3.273 9.462 -21.925 990 HG3 LYS 34 1HG LYS 34 2.031 10.444 -21.148 991 HD2 LYS 34 2HD LYS 34 3.748 11.339 -23.483 992 HD3 LYS 34 1HD LYS 34 2.095 10.751 -23.604 993 HE2 LYS 34 2HE LYS 34 1.318 12.611 -22.230 994 HE3 LYS 34 1HE LYS 34 2.973 13.191 -22.055 995 HZ1 LYS 34 1HZ LYS 34 3.058 13.555 -24.430 996 HZ2 LYS 34 2HZ LYS 34 1.781 14.412 -23.769 997 HZ3 LYS 34 3HZ LYS 34 1.490 13.009 -24.634 998 H GLY 35 H GLY 35 7.469 10.483 -19.933 999 HA2 GLY 35 2HA GLY 35 9.225 11.737 -19.063 1000 HA3 GLY 35 1HA GLY 35 8.489 13.181 -19.736 1001 H TYR 36 H TYR 36 6.830 10.936 -17.631 1002 HA TYR 36 HA TYR 36 6.935 12.935 -15.448 1003 HB2 TYR 36 2HB TYR 36 4.714 10.980 -16.080 1004 HB3 TYR 36 1HB TYR 36 4.738 12.076 -14.709 1005 HD1 TYR 36 1HD TYR 36 3.562 11.501 -17.943 1006 HD2 TYR 36 2HD TYR 36 4.862 14.640 -15.396 1007 HE1 TYR 36 1HE TYR 36 2.307 13.101 -19.304 1008 HE2 TYR 36 2HE TYR 36 3.611 16.262 -16.750 1009 HH TYR 36 HH TYR 36 2.735 16.442 -19.031 1010 H ASN 37 H ASN 37 6.916 11.915 -13.282 1011 HA ASN 37 HA ASN 37 8.328 9.403 -13.338 1012 HB2 ASN 37 2HB ASN 37 7.541 11.184 -11.014 1013 HB3 ASN 37 1HB ASN 37 8.415 9.675 -10.837 1014 HD21 ASN 37 1HD2 ASN 37 10.529 9.564 -11.442 1015 HD22 ASN 37 2HD2 ASN 37 11.490 10.944 -11.791 1016 HA PRO 38 HA PRO 38 4.482 7.108 -13.435 1017 HB2 PRO 38 2HB PRO 38 6.334 4.948 -12.651 1018 HB3 PRO 38 1HB PRO 38 5.164 5.044 -13.974 1019 HG2 PRO 38 2HG PRO 38 7.804 5.257 -14.392 1020 HG3 PRO 38 1HG PRO 38 6.630 6.137 -15.373 1021 HD2 PRO 38 2HD PRO 38 8.447 7.133 -13.252 1022 HD3 PRO 38 1HD PRO 38 7.747 7.952 -14.671 1023 H ILE 39 H ILE 39 6.855 6.693 -10.888 1024 HA ILE 39 HA ILE 39 5.218 5.278 -9.106 1025 HB ILE 39 HB ILE 39 7.525 7.111 -8.408 1026 HG12 ILE 39 2HG1 ILE 39 8.223 5.452 -10.068 1027 HG13 ILE 39 1HG1 ILE 39 8.941 5.086 -8.506 1028 HG21 ILE 39 1HG2 ILE 39 6.201 6.498 -6.454 1029 HG22 ILE 39 2HG2 ILE 39 7.771 5.689 -6.409 1030 HG23 ILE 39 3HG2 ILE 39 6.328 4.794 -6.886 1031 HD11 ILE 39 1HD1 ILE 39 8.209 3.068 -9.628 1032 HD12 ILE 39 2HD1 ILE 39 6.571 3.701 -9.755 1033 HD13 ILE 39 3HD1 ILE 39 7.253 3.329 -8.169 1034 H ASN 40 H ASN 40 5.806 8.750 -9.471 1035 HA ASN 40 HA ASN 40 4.400 9.619 -7.187 1036 HB2 ASN 40 2HB ASN 40 4.851 11.123 -9.775 1037 HB3 ASN 40 1HB ASN 40 4.272 11.838 -8.283 1038 HD21 ASN 40 1HD2 ASN 40 6.212 10.208 -6.607 1039 HD22 ASN 40 2HD2 ASN 40 7.720 10.934 -6.925 1040 H GLN 41 H GLN 41 3.308 9.104 -10.526 1041 HA GLN 41 HA GLN 41 0.724 10.035 -9.823 1042 HB2 GLN 41 2HB GLN 41 1.696 8.703 -12.308 1043 HB3 GLN 41 1HB GLN 41 -0.004 9.067 -12.053 1044 HG2 GLN 41 2HG GLN 41 2.269 11.039 -12.151 1045 HG3 GLN 41 1HG GLN 41 0.999 10.823 -13.355 1046 HE21 GLN 41 1HE2 GLN 41 1.660 13.176 -11.961 1047 HE22 GLN 41 2HE2 GLN 41 0.272 13.669 -11.052 1048 H ILE 42 H ILE 42 2.144 6.840 -9.964 1049 HA ILE 42 HA ILE 42 -0.330 5.510 -9.719 1050 HB ILE 42 HB ILE 42 2.399 4.549 -8.778 1051 HG12 ILE 42 2HG1 ILE 42 0.825 3.906 -11.297 1052 HG13 ILE 42 1HG1 ILE 42 2.227 4.965 -11.215 1053 HG21 ILE 42 1HG2 ILE 42 0.621 3.355 -7.593 1054 HG22 ILE 42 2HG2 ILE 42 1.369 2.272 -8.763 1055 HG23 ILE 42 3HG2 ILE 42 -0.198 3.003 -9.103 1056 HD11 ILE 42 1HD1 ILE 42 3.615 3.066 -10.556 1057 HD12 ILE 42 2HD1 ILE 42 2.808 2.772 -12.096 1058 HD13 ILE 42 3HD1 ILE 42 2.209 2.008 -10.624 1059 H VAL 43 H VAL 43 1.990 6.575 -7.227 1060 HA VAL 43 HA VAL 43 0.450 5.659 -5.089 1061 HB VAL 43 HB VAL 43 2.769 6.276 -4.673 1062 HG11 VAL 43 1HG1 VAL 43 3.009 8.135 -6.223 1063 HG12 VAL 43 2HG1 VAL 43 3.456 8.685 -4.599 1064 HG13 VAL 43 3HG1 VAL 43 1.889 9.101 -5.275 1065 HG21 VAL 43 1HG2 VAL 43 0.919 8.104 -3.151 1066 HG22 VAL 43 2HG2 VAL 43 2.534 7.612 -2.632 1067 HG23 VAL 43 3HG2 VAL 43 1.244 6.412 -2.787 1068 H GLY 44 H GLY 44 0.419 8.879 -6.647 1069 HA2 GLY 44 2HA GLY 44 -1.542 10.020 -4.998 1070 HA3 GLY 44 1HA GLY 44 -1.176 10.517 -6.648 1071 H TYR 45 H TYR 45 -1.795 8.046 -7.900 1072 HA TYR 45 HA TYR 45 -4.520 8.359 -8.322 1073 HB2 TYR 45 2HB TYR 45 -3.214 7.393 -10.084 1074 HB3 TYR 45 1HB TYR 45 -2.691 6.070 -9.046 1075 HD1 TYR 45 1HD TYR 45 -3.725 4.031 -9.365 1076 HD2 TYR 45 2HD TYR 45 -5.889 7.581 -10.236 1077 HE1 TYR 45 1HE TYR 45 -5.631 2.684 -10.082 1078 HE2 TYR 45 2HE TYR 45 -7.793 6.253 -10.951 1079 HH TYR 45 HH TYR 45 -8.219 3.940 -11.815 1080 H LEU 46 H LEU 46 -2.871 5.742 -6.538 1081 HA LEU 46 HA LEU 46 -5.385 4.667 -5.802 1082 HB2 LEU 46 2HB LEU 46 -2.667 4.047 -4.678 1083 HB3 LEU 46 1HB LEU 46 -4.119 3.256 -4.109 1084 HG LEU 46 HG LEU 46 -4.414 2.456 -6.565 1085 HD11 LEU 46 1HD1 LEU 46 -2.519 2.290 -7.929 1086 HD12 LEU 46 2HD1 LEU 46 -1.556 3.207 -6.768 1087 HD13 LEU 46 3HD1 LEU 46 -2.909 3.978 -7.591 1088 HD21 LEU 46 1HD2 LEU 46 -2.913 0.583 -6.243 1089 HD22 LEU 46 2HD2 LEU 46 -3.782 0.974 -4.760 1090 HD23 LEU 46 3HD2 LEU 46 -2.092 1.452 -4.946 1091 H LEU 47 H LEU 47 -3.259 6.955 -4.213 1092 HA LEU 47 HA LEU 47 -4.560 6.879 -1.707 1093 HB2 LEU 47 2HB LEU 47 -3.063 9.169 -2.977 1094 HB3 LEU 47 1HB LEU 47 -3.581 9.123 -1.312 1095 HG LEU 47 HG LEU 47 -1.484 7.405 -2.622 1096 HD11 LEU 47 1HD1 LEU 47 -0.765 9.654 -2.142 1097 HD12 LEU 47 2HD1 LEU 47 0.017 8.519 -1.040 1098 HD13 LEU 47 3HD1 LEU 47 -1.331 9.507 -0.480 1099 HD21 LEU 47 1HD2 LEU 47 -2.696 6.056 -1.018 1100 HD22 LEU 47 2HD2 LEU 47 -2.518 7.307 0.216 1101 HD23 LEU 47 3HD2 LEU 47 -1.098 6.453 -0.394 1102 H SER 48 H SER 48 -5.199 8.757 -4.623 1103 HA SER 48 HA SER 48 -7.312 10.179 -3.210 1104 HB2 SER 48 2HB SER 48 -5.655 11.410 -4.614 1105 HB3 SER 48 1HB SER 48 -6.283 10.571 -6.023 1106 HG SER 48 HG SER 48 -7.477 12.498 -4.400 1107 H GLY 49 H GLY 49 -6.943 7.572 -5.596 1108 HA2 GLY 49 2HA GLY 49 -8.466 6.249 -6.557 1109 HA3 GLY 49 1HA GLY 49 -9.657 6.910 -5.444 1110 H ASP 50 H ASP 50 -7.724 8.405 -8.068 1111 HA ASP 50 HA ASP 50 -10.245 9.013 -9.399 1112 HB2 ASP 50 2HB ASP 50 -9.655 10.924 -7.877 1113 HB3 ASP 50 1HB ASP 50 -8.197 11.142 -8.834 1114 HA PRO 51 HA PRO 51 -7.901 7.675 -12.904 1115 HB2 PRO 51 2HB PRO 51 -9.471 8.798 -14.849 1116 HB3 PRO 51 1HB PRO 51 -9.841 7.290 -14.007 1117 HG2 PRO 51 2HG PRO 51 -10.844 10.058 -13.461 1118 HG3 PRO 51 1HG PRO 51 -11.747 8.529 -13.503 1119 HD2 PRO 51 2HD PRO 51 -11.036 9.645 -11.205 1120 HD3 PRO 51 1HD PRO 51 -10.972 7.879 -11.405 1121 H ALA 52 H ALA 52 -8.483 11.132 -12.413 1122 HA ALA 52 HA ALA 52 -7.215 12.084 -14.754 1123 HB1 ALA 52 1HB ALA 52 -7.167 14.259 -13.686 1124 HB2 ALA 52 2HB ALA 52 -7.496 13.512 -12.122 1125 HB3 ALA 52 3HB ALA 52 -8.712 13.460 -13.395 1126 H TYR 53 H TYR 53 -5.827 10.661 -12.075 1127 HA TYR 53 HA TYR 53 -3.290 11.996 -12.099 1128 HB2 TYR 53 2HB TYR 53 -4.271 9.439 -10.865 1129 HB3 TYR 53 1HB TYR 53 -2.593 9.981 -10.737 1130 HD1 TYR 53 1HD TYR 53 -2.045 12.024 -9.615 1131 HD2 TYR 53 2HD TYR 53 -6.019 10.574 -9.654 1132 HE1 TYR 53 1HE TYR 53 -2.564 13.544 -7.867 1133 HE2 TYR 53 2HE TYR 53 -6.605 12.133 -7.854 1134 HH TYR 53 HH TYR 53 -4.583 14.687 -6.970 1135 H ILE 54 H ILE 54 -4.705 9.409 -13.947 1136 HA ILE 54 HA ILE 54 -2.046 8.605 -14.833 1137 HB ILE 54 HB ILE 54 -4.690 7.178 -15.212 1138 HG12 ILE 54 2HG1 ILE 54 -4.033 7.229 -12.873 1139 HG13 ILE 54 1HG1 ILE 54 -3.805 5.614 -13.529 1140 HG21 ILE 54 1HG2 ILE 54 -3.329 5.272 -15.934 1141 HG22 ILE 54 2HG2 ILE 54 -1.872 6.255 -15.795 1142 HG23 ILE 54 3HG2 ILE 54 -3.094 6.659 -17.000 1143 HD11 ILE 54 1HD1 ILE 54 -1.967 6.227 -12.053 1144 HD12 ILE 54 2HD1 ILE 54 -1.635 7.660 -13.025 1145 HD13 ILE 54 3HD1 ILE 54 -1.381 6.055 -13.708 1146 HA PRO 55 HA PRO 55 -2.444 11.084 -18.530 1147 HB2 PRO 55 2HB PRO 55 -0.478 9.024 -19.450 1148 HB3 PRO 55 1HB PRO 55 -0.404 10.784 -19.574 1149 HG2 PRO 55 2HG PRO 55 1.030 9.536 -17.761 1150 HG3 PRO 55 1HG PRO 55 0.209 11.056 -17.362 1151 HD2 PRO 55 2HD PRO 55 -0.512 8.257 -16.603 1152 HD3 PRO 55 1HD PRO 55 -0.663 9.766 -15.676 1153 H ARG 56 H ARG 56 -3.233 10.929 -20.595 1154 HA ARG 56 HA ARG 56 -4.946 8.600 -21.052 1155 HB2 ARG 56 2HB ARG 56 -5.059 11.407 -22.152 1156 HB3 ARG 56 1HB ARG 56 -6.224 10.134 -22.496 1157 HG2 ARG 56 2HG ARG 56 -6.907 10.049 -20.195 1158 HG3 ARG 56 1HG ARG 56 -5.632 11.175 -19.741 1159 HD2 ARG 56 2HD ARG 56 -7.930 11.797 -21.587 1160 HD3 ARG 56 1HD ARG 56 -7.846 12.236 -19.880 1161 HE ARG 56 HE ARG 56 -5.648 13.151 -21.512 1162 HH11 ARG 56 1HH1 ARG 56 -8.817 13.958 -20.172 1163 HH12 ARG 56 2HH1 ARG 56 -8.560 15.638 -20.282 1164 HH21 ARG 56 1HH2 ARG 56 -5.311 15.423 -21.618 1165 HH22 ARG 56 2HH2 ARG 56 -6.520 16.502 -21.098 1166 H TYR 57 H TYR 57 -2.055 9.587 -21.965 1167 HA TYR 57 HA TYR 57 -1.905 9.456 -24.733 1168 HB2 TYR 57 2HB TYR 57 -0.051 10.229 -23.402 1169 HB3 TYR 57 1HB TYR 57 0.099 8.669 -22.615 1170 HD1 TYR 57 1HD TYR 57 0.247 10.172 -26.038 1171 HD2 TYR 57 2HD TYR 57 1.764 7.257 -23.354 1172 HE1 TYR 57 1HE TYR 57 1.945 9.529 -27.700 1173 HE2 TYR 57 2HE TYR 57 3.455 6.601 -25.005 1174 HH TYR 57 HH TYR 57 3.678 6.679 -27.457 1175 H GLN 58 H GLN 58 -1.983 6.817 -22.383 1176 HA GLN 58 HA GLN 58 -2.268 4.993 -24.637 1177 HB2 GLN 58 2HB GLN 58 -0.331 4.586 -22.377 1178 HB3 GLN 58 1HB GLN 58 -0.855 3.288 -23.420 1179 HG2 GLN 58 2HG GLN 58 0.040 4.490 -25.350 1180 HG3 GLN 58 1HG GLN 58 0.596 5.776 -24.283 1181 HE21 GLN 58 1HE2 GLN 58 1.068 2.525 -25.359 1182 HE22 GLN 58 2HE2 GLN 58 2.611 2.309 -24.638 1183 H ASP 59 H ASP 59 -2.522 2.763 -23.712 1184 HA ASP 59 HA ASP 59 -5.041 2.352 -22.705 1185 HB2 ASP 59 2HB ASP 59 -4.233 0.002 -22.524 1186 HB3 ASP 59 1HB ASP 59 -3.987 0.767 -24.093 1187 H ALA 60 H ALA 60 -2.236 3.105 -21.015 1188 HA ALA 60 HA ALA 60 -2.270 1.730 -18.646 1189 HB1 ALA 60 1HB ALA 60 -1.251 3.734 -17.637 1190 HB2 ALA 60 2HB ALA 60 -1.760 4.678 -19.035 1191 HB3 ALA 60 3HB ALA 60 -0.581 3.382 -19.230 1192 H ARG 61 H ARG 61 -4.234 4.593 -19.484 1193 HA ARG 61 HA ARG 61 -5.545 4.706 -16.987 1194 HB2 ARG 61 2HB ARG 61 -7.205 6.171 -18.078 1195 HB3 ARG 61 1HB ARG 61 -5.556 6.677 -18.404 1196 HG2 ARG 61 2HG ARG 61 -5.687 5.760 -20.637 1197 HG3 ARG 61 1HG ARG 61 -7.284 5.096 -20.295 1198 HD2 ARG 61 2HD ARG 61 -8.173 7.338 -19.993 1199 HD3 ARG 61 1HD ARG 61 -6.585 8.029 -20.263 1200 HE ARG 61 HE ARG 61 -7.014 6.555 -22.492 1201 HH11 ARG 61 1HH1 ARG 61 -8.976 9.093 -20.945 1202 HH12 ARG 61 2HH1 ARG 61 -9.636 9.629 -22.418 1203 HH21 ARG 61 1HH2 ARG 61 -7.908 7.291 -24.432 1204 HH22 ARG 61 2HH2 ARG 61 -9.024 8.591 -24.465 1205 H ASN 62 H ASN 62 -6.326 3.045 -19.986 1206 HA ASN 62 HA ASN 62 -8.981 2.266 -19.380 1207 HB2 ASN 62 2HB ASN 62 -8.153 2.121 -21.656 1208 HB3 ASN 62 1HB ASN 62 -6.900 0.987 -21.174 1209 HD21 ASN 62 1HD2 ASN 62 -7.540 -0.588 -22.552 1210 HD22 ASN 62 2HD2 ASN 62 -8.966 -1.529 -22.377 1211 H LEU 63 H LEU 63 -5.911 0.587 -19.074 1212 HA LEU 63 HA LEU 63 -6.807 -1.800 -17.932 1213 HB2 LEU 63 2HB LEU 63 -4.217 -0.331 -17.514 1214 HB3 LEU 63 1HB LEU 63 -4.482 -2.040 -17.176 1215 HG LEU 63 HG LEU 63 -4.526 -0.722 -19.889 1216 HD11 LEU 63 1HD1 LEU 63 -2.300 -0.853 -18.997 1217 HD12 LEU 63 2HD1 LEU 63 -2.502 -2.015 -20.302 1218 HD13 LEU 63 3HD1 LEU 63 -2.512 -2.569 -18.626 1219 HD21 LEU 63 1HD2 LEU 63 -4.693 -3.003 -20.774 1220 HD22 LEU 63 2HD2 LEU 63 -6.096 -2.584 -19.792 1221 HD23 LEU 63 3HD2 LEU 63 -4.841 -3.627 -19.128 1222 H ILE 64 H ILE 64 -5.664 1.189 -16.482 1223 HA ILE 64 HA ILE 64 -6.007 0.394 -13.845 1224 HB ILE 64 HB ILE 64 -5.175 2.732 -15.267 1225 HG12 ILE 64 2HG1 ILE 64 -4.573 1.643 -12.521 1226 HG13 ILE 64 1HG1 ILE 64 -3.699 1.303 -14.003 1227 HG21 ILE 64 1HG2 ILE 64 -5.635 4.459 -13.617 1228 HG22 ILE 64 2HG2 ILE 64 -6.719 3.343 -12.780 1229 HG23 ILE 64 3HG2 ILE 64 -7.089 3.865 -14.421 1230 HD11 ILE 64 1HD1 ILE 64 -3.021 3.683 -14.073 1231 HD12 ILE 64 2HD1 ILE 64 -2.472 2.839 -12.622 1232 HD13 ILE 64 3HD1 ILE 64 -3.859 3.909 -12.533 1233 H ARG 65 H ARG 65 -8.298 1.870 -16.037 1234 HA ARG 65 HA ARG 65 -10.263 2.494 -14.071 1235 HB2 ARG 65 2HB ARG 65 -10.621 1.834 -17.000 1236 HB3 ARG 65 1HB ARG 65 -11.881 2.473 -15.968 1237 HG2 ARG 65 2HG ARG 65 -9.306 3.863 -16.637 1238 HG3 ARG 65 1HG ARG 65 -10.841 4.184 -17.416 1239 HD2 ARG 65 2HD ARG 65 -10.177 4.576 -14.505 1240 HD3 ARG 65 1HD ARG 65 -10.343 5.848 -15.704 1241 HE ARG 65 HE ARG 65 -12.555 4.105 -14.833 1242 HH11 ARG 65 1HH1 ARG 65 -11.419 7.259 -15.978 1243 HH12 ARG 65 2HH1 ARG 65 -12.874 8.065 -15.642 1244 HH21 ARG 65 1HH2 ARG 65 -14.564 5.219 -14.359 1245 HH22 ARG 65 2HH2 ARG 65 -14.689 6.887 -14.694 1246 H ARG 66 H ARG 66 -9.305 -0.401 -15.648 1247 HA ARG 66 HA ARG 66 -11.711 -1.831 -14.874 1248 HB2 ARG 66 2HB ARG 66 -9.276 -2.739 -16.409 1249 HB3 ARG 66 1HB ARG 66 -10.715 -3.712 -16.138 1250 HG2 ARG 66 2HG ARG 66 -12.060 -2.066 -17.372 1251 HG3 ARG 66 1HG ARG 66 -10.606 -1.102 -17.629 1252 HD2 ARG 66 2HD ARG 66 -11.162 -2.427 -19.593 1253 HD3 ARG 66 1HD ARG 66 -9.611 -2.901 -18.907 1254 HE ARG 66 HE ARG 66 -11.121 -4.702 -17.767 1255 HH11 ARG 66 1HH1 ARG 66 -11.466 -3.517 -21.107 1256 HH12 ARG 66 2HH1 ARG 66 -12.017 -5.039 -21.664 1257 HH21 ARG 66 1HH2 ARG 66 -11.797 -6.711 -18.609 1258 HH22 ARG 66 2HH2 ARG 66 -12.201 -6.889 -20.259 1259 H HIS 67 H HIS 67 -9.158 -0.908 -13.184 1260 HA HIS 67 HA HIS 67 -9.286 -3.283 -11.521 1261 HB2 HIS 67 2HB HIS 67 -6.714 -1.918 -12.345 1262 HB3 HIS 67 1HB HIS 67 -6.820 -2.983 -10.952 1263 HD1 HIS 67 1HD HIS 67 -7.159 -5.499 -11.420 1264 HD2 HIS 67 2HD HIS 67 -6.716 -3.196 -14.835 1265 HE1 HIS 67 1HE HIS 67 -6.726 -7.146 -13.288 1266 HE2 HIS 67 2HE HIS 67 -6.574 -5.718 -15.374 1267 H GLU 68 H GLU 68 -9.927 -2.846 -9.603 1268 HA GLU 68 HA GLU 68 -10.232 -0.150 -8.793 1269 HB2 GLU 68 2HB GLU 68 -11.208 -1.138 -6.673 1270 HB3 GLU 68 1HB GLU 68 -12.026 -1.557 -8.162 1271 HG2 GLU 68 2HG GLU 68 -10.049 -3.352 -6.780 1272 HG3 GLU 68 1HG GLU 68 -11.780 -3.396 -6.463 1273 H ARG 69 H ARG 69 -9.319 1.000 -7.189 1274 HA ARG 69 HA ARG 69 -6.538 0.726 -6.956 1275 HB2 ARG 69 2HB ARG 69 -8.364 2.442 -5.224 1276 HB3 ARG 69 1HB ARG 69 -6.627 2.509 -5.221 1277 HG2 ARG 69 2HG ARG 69 -7.350 4.388 -6.414 1278 HG3 ARG 69 1HG ARG 69 -6.798 3.267 -7.644 1279 HD2 ARG 69 2HD ARG 69 -9.700 3.568 -6.865 1280 HD3 ARG 69 1HD ARG 69 -8.943 4.582 -8.066 1281 HE ARG 69 HE ARG 69 -8.404 2.119 -9.003 1282 HH11 ARG 69 1HH1 ARG 69 -11.456 3.543 -7.897 1283 HH12 ARG 69 2HH1 ARG 69 -12.397 2.790 -9.083 1284 HH21 ARG 69 1HH2 ARG 69 -9.695 1.107 -10.656 1285 HH22 ARG 69 2HH2 ARG 69 -11.381 1.391 -10.709 1286 H ASP 70 H ASP 70 -9.129 -0.100 -4.780 1287 HA ASP 70 HA ASP 70 -7.613 -0.571 -2.460 1288 HB2 ASP 70 2HB ASP 70 -10.230 -1.870 -3.252 1289 HB3 ASP 70 1HB ASP 70 -9.567 -1.776 -1.626 1290 H GLU 71 H GLU 71 -8.791 -2.808 -4.934 1291 HA GLU 71 HA GLU 71 -7.753 -5.212 -3.913 1292 HB2 GLU 71 2HB GLU 71 -9.400 -5.012 -5.742 1293 HB3 GLU 71 1HB GLU 71 -8.137 -4.377 -6.789 1294 HG2 GLU 71 2HG GLU 71 -8.436 -6.650 -7.362 1295 HG3 GLU 71 1HG GLU 71 -6.939 -6.537 -6.442 1296 H ILE 72 H ILE 72 -6.396 -2.782 -6.081 1297 HA ILE 72 HA ILE 72 -4.001 -4.126 -6.695 1298 HB ILE 72 HB ILE 72 -4.612 -1.176 -6.702 1299 HG12 ILE 72 2HG1 ILE 72 -4.638 -3.191 -8.968 1300 HG13 ILE 72 1HG1 ILE 72 -6.040 -2.443 -8.224 1301 HG21 ILE 72 1HG2 ILE 72 -2.283 -2.630 -7.975 1302 HG22 ILE 72 2HG2 ILE 72 -2.198 -1.509 -6.619 1303 HG23 ILE 72 3HG2 ILE 72 -2.663 -0.926 -8.218 1304 HD11 ILE 72 1HD1 ILE 72 -5.346 -0.264 -9.065 1305 HD12 ILE 72 2HD1 ILE 72 -5.503 -1.428 -10.379 1306 HD13 ILE 72 3HD1 ILE 72 -3.905 -0.993 -9.777 1307 H MET 73 H MET 73 -4.779 -1.709 -4.202 1308 HA MET 73 HA MET 73 -2.121 -1.522 -3.241 1309 HB2 MET 73 2HB MET 73 -4.148 0.096 -2.911 1310 HB3 MET 73 1HB MET 73 -4.558 -0.948 -1.568 1311 HG2 MET 73 2HG MET 73 -1.965 0.571 -1.856 1312 HG3 MET 73 1HG MET 73 -3.334 1.083 -0.887 1313 HE1 MET 73 1HE MET 73 -0.338 0.884 0.192 1314 HE2 MET 73 2HE MET 73 -0.637 0.165 1.772 1315 HE3 MET 73 3HE MET 73 -1.719 1.409 1.146 1316 H GLU 74 H GLU 74 -4.902 -3.533 -2.302 1317 HA GLU 74 HA GLU 74 -3.852 -4.944 -0.132 1318 HB2 GLU 74 2HB GLU 74 -5.656 -5.784 -2.395 1319 HB3 GLU 74 1HB GLU 74 -5.139 -6.900 -1.140 1320 HG2 GLU 74 2HG GLU 74 -6.502 -4.331 -0.451 1321 HG3 GLU 74 1HG GLU 74 -7.431 -5.750 -0.927 1322 H GLU 75 H GLU 75 -3.367 -5.346 -3.574 1323 HA GLU 75 HA GLU 75 -1.884 -7.768 -3.356 1324 HB2 GLU 75 2HB GLU 75 -3.121 -6.897 -5.407 1325 HB3 GLU 75 1HB GLU 75 -1.757 -5.809 -5.637 1326 HG2 GLU 75 2HG GLU 75 -1.487 -7.740 -7.032 1327 HG3 GLU 75 1HG GLU 75 -0.261 -7.758 -5.762 1328 H LEU 76 H LEU 76 -1.064 -4.348 -3.753 1329 HA LEU 76 HA LEU 76 1.703 -4.509 -4.035 1330 HB2 LEU 76 2HB LEU 76 0.165 -2.377 -2.554 1331 HB3 LEU 76 1HB LEU 76 1.798 -2.228 -3.151 1332 HG LEU 76 HG LEU 76 -0.704 -2.454 -4.823 1333 HD11 LEU 76 1HD1 LEU 76 -0.190 -0.162 -5.461 1334 HD12 LEU 76 2HD1 LEU 76 1.185 -0.162 -4.356 1335 HD13 LEU 76 3HD1 LEU 76 -0.455 -0.298 -3.722 1336 HD21 LEU 76 1HD2 LEU 76 1.174 -3.526 -5.940 1337 HD22 LEU 76 2HD2 LEU 76 2.166 -2.097 -5.662 1338 HD23 LEU 76 3HD2 LEU 76 0.762 -2.005 -6.724 1339 H THR 77 H THR 77 -0.220 -4.116 -1.048 1340 HA THR 77 HA THR 77 1.989 -4.084 0.652 1341 HB THR 77 HB THR 77 -0.876 -4.835 1.284 1342 HG1 THR 77 1HG THR 77 -1.115 -2.754 0.717 1343 HG21 THR 77 1HG2 THR 77 -0.322 -4.092 3.562 1344 HG22 THR 77 2HG2 THR 77 1.337 -3.762 3.055 1345 HG23 THR 77 3HG2 THR 77 0.734 -5.419 3.075 1346 H LYS 78 H LYS 78 -0.073 -6.792 -0.436 1347 HA LYS 78 HA LYS 78 1.144 -8.664 1.301 1348 HB2 LYS 78 2HB LYS 78 -0.281 -9.204 -1.301 1349 HB3 LYS 78 1HB LYS 78 0.256 -10.456 -0.192 1350 HG2 LYS 78 2HG LYS 78 -1.198 -9.356 1.538 1351 HG3 LYS 78 1HG LYS 78 -1.838 -8.365 0.266 1352 HD2 LYS 78 2HD LYS 78 -1.941 -11.397 0.329 1353 HD3 LYS 78 1HD LYS 78 -3.290 -10.323 0.673 1354 HE2 LYS 78 2HE LYS 78 -1.838 -10.502 -1.973 1355 HE3 LYS 78 1HE LYS 78 -3.365 -11.291 -1.603 1356 HZ1 LYS 78 1HZ LYS 78 -2.922 -8.353 -1.546 1357 HZ2 LYS 78 2HZ LYS 78 -4.380 -9.162 -1.284 1358 HZ3 LYS 78 3HZ LYS 78 -3.674 -9.220 -2.800 1359 H TYR 79 H TYR 79 1.752 -7.829 -2.024 1360 HA TYR 79 HA TYR 79 3.728 -9.762 -2.534 1361 HB2 TYR 79 2HB TYR 79 2.482 -8.310 -4.193 1362 HB3 TYR 79 1HB TYR 79 3.542 -7.000 -3.722 1363 HD1 TYR 79 1HD TYR 79 3.034 -9.655 -5.959 1364 HD2 TYR 79 2HD TYR 79 6.103 -7.472 -4.012 1365 HE1 TYR 79 1HE TYR 79 4.615 -10.360 -7.701 1366 HE2 TYR 79 2HE TYR 79 7.705 -8.157 -5.763 1367 HH TYR 79 HH TYR 79 7.927 -10.028 -7.392 1368 H TYR 80 H TYR 80 3.945 -6.419 -1.386 1369 HA TYR 80 HA TYR 80 6.716 -6.126 -1.259 1370 HB2 TYR 80 2HB TYR 80 5.074 -4.290 -1.020 1371 HB3 TYR 80 1HB TYR 80 4.580 -4.944 0.530 1372 HD1 TYR 80 1HD TYR 80 7.116 -3.041 -1.266 1373 HD2 TYR 80 2HD TYR 80 6.025 -4.672 2.505 1374 HE1 TYR 80 1HE TYR 80 8.780 -1.599 -0.170 1375 HE2 TYR 80 2HE TYR 80 7.682 -3.242 3.611 1376 HH TYR 80 HH TYR 80 9.202 -0.643 2.017 1377 H LEU 81 H LEU 81 4.415 -7.241 1.185 1378 HA LEU 81 HA LEU 81 6.451 -7.720 3.097 1379 HB2 LEU 81 2HB LEU 81 3.552 -8.416 3.066 1380 HB3 LEU 81 1HB LEU 81 4.600 -8.789 4.432 1381 HG LEU 81 HG LEU 81 3.938 -6.038 3.365 1382 HD11 LEU 81 1HD1 LEU 81 3.086 -7.457 5.878 1383 HD12 LEU 81 2HD1 LEU 81 2.063 -7.072 4.496 1384 HD13 LEU 81 3HD1 LEU 81 2.732 -5.772 5.484 1385 HD21 LEU 81 1HD2 LEU 81 5.094 -5.225 5.382 1386 HD22 LEU 81 2HD2 LEU 81 6.191 -6.077 4.302 1387 HD23 LEU 81 3HD2 LEU 81 5.585 -6.872 5.757 1388 H ALA 82 H ALA 82 4.906 -9.716 0.685 1389 HA ALA 82 HA ALA 82 5.463 -12.245 1.780 1390 HB1 ALA 82 1HB ALA 82 5.247 -11.475 -1.130 1391 HB2 ALA 82 2HB ALA 82 3.897 -11.902 -0.081 1392 HB3 ALA 82 3HB ALA 82 5.122 -13.108 -0.484 1393 H ASN 83 H ASN 83 7.384 -10.008 0.028 1394 HA ASN 83 HA ASN 83 9.457 -11.784 -0.704 1395 HB2 ASN 83 2HB ASN 83 9.441 -8.782 -0.485 1396 HB3 ASN 83 1HB ASN 83 10.813 -9.696 -1.095 1397 HD21 ASN 83 1HD2 ASN 83 9.132 -7.740 -2.404 1398 HD22 ASN 83 2HD2 ASN 83 8.467 -8.520 -3.798 1399 H HIS 84 H HIS 84 8.634 -10.657 2.330 1400 HA HIS 84 HA HIS 84 11.350 -10.850 3.389 1401 HB2 HIS 84 2HB HIS 84 8.721 -10.334 4.805 1402 HB3 HIS 84 1HB HIS 84 10.246 -10.512 5.649 1403 HD1 HIS 84 1HD HIS 84 12.072 -8.617 5.045 1404 HD2 HIS 84 2HD HIS 84 8.142 -7.822 4.006 1405 HE1 HIS 84 1HE HIS 84 11.992 -6.169 4.619 1406 HE2 HIS 84 2HE HIS 84 9.790 -5.938 3.457 1407 H GLY 85 H GLY 85 9.386 -13.032 2.269 1408 HA2 GLY 85 2HA GLY 85 9.450 -15.343 2.537 1409 HA3 GLY 85 1HA GLY 85 10.382 -15.117 4.018 1410 H ILE 86 H ILE 86 7.519 -13.315 3.592 1411 HA ILE 86 HA ILE 86 6.278 -14.860 5.723 1412 HB ILE 86 HB ILE 86 5.671 -12.058 4.749 1413 HG12 ILE 86 2HG1 ILE 86 6.995 -13.049 7.286 1414 HG13 ILE 86 1HG1 ILE 86 7.801 -12.237 5.950 1415 HG21 ILE 86 1HG2 ILE 86 4.185 -11.908 6.701 1416 HG22 ILE 86 2HG2 ILE 86 4.501 -13.604 7.068 1417 HG23 ILE 86 3HG2 ILE 86 3.658 -13.169 5.583 1418 HD11 ILE 86 1HD1 ILE 86 7.417 -10.732 7.816 1419 HD12 ILE 86 2HD1 ILE 86 5.684 -11.072 7.723 1420 HD13 ILE 86 3HD1 ILE 86 6.490 -10.231 6.394 1421 H ASP 87 H ASP 87 4.535 -15.986 5.355 1422 HA ASP 87 HA ASP 87 3.340 -15.935 2.681 1423 HB2 ASP 87 2HB ASP 87 2.874 -17.863 4.984 1424 HB3 ASP 87 1HB ASP 87 2.176 -18.016 3.378 1425 H ILE 88 H ILE 88 1.541 -14.817 2.344 1426 HA ILE 88 HA ILE 88 0.131 -13.835 4.708 1427 HB ILE 88 HB ILE 88 0.306 -12.608 1.940 1428 HG12 ILE 88 2HG1 ILE 88 1.611 -11.796 4.537 1429 HG13 ILE 88 1HG1 ILE 88 2.426 -12.539 3.165 1430 HG21 ILE 88 1HG2 ILE 88 -0.914 -11.549 4.500 1431 HG22 ILE 88 2HG2 ILE 88 -1.797 -12.024 3.045 1432 HG23 ILE 88 3HG2 ILE 88 -0.714 -10.631 3.010 1433 HD11 ILE 88 1HD1 ILE 88 2.777 -10.145 3.279 1434 HD12 ILE 88 2HD1 ILE 88 1.022 -9.884 3.085 1435 HD13 ILE 88 3HD1 ILE 88 1.947 -10.624 1.803 1436 H LYS 89 H LYS 89 -2.071 -13.712 4.685 1437 HA LYS 89 HA LYS 89 -3.469 -15.740 3.154 1438 HB2 LYS 89 2HB LYS 89 -4.268 -13.983 5.462 1439 HB3 LYS 89 1HB LYS 89 -5.247 -15.276 4.793 1440 HG2 LYS 89 2HG LYS 89 -3.736 -16.945 5.519 1441 HG3 LYS 89 1HG LYS 89 -2.502 -15.750 5.911 1442 HD2 LYS 89 2HD LYS 89 -5.173 -15.966 7.289 1443 HD3 LYS 89 1HD LYS 89 -3.674 -16.665 7.901 1444 HE2 LYS 89 2HE LYS 89 -2.670 -14.388 7.922 1445 HE3 LYS 89 1HE LYS 89 -4.218 -13.730 7.414 1446 HZ1 LYS 89 1HZ LYS 89 -5.203 -14.450 9.470 1447 HZ2 LYS 89 2HZ LYS 89 -3.743 -13.612 9.806 1448 HZ3 LYS 89 3HZ LYS 89 -3.798 -15.282 9.881 Start of MODEL 19 1 H1 MET 1 1HT MET 1 -13.289 16.949 33.955 2 H2 MET 1 2HT MET 1 -13.112 15.462 34.667 3 H3 MET 1 3HT MET 1 -14.660 16.120 34.501 4 HA MET 1 HA MET 1 -14.258 14.402 32.838 5 HB2 MET 1 2HB MET 1 -14.158 17.192 31.650 6 HB3 MET 1 1HB MET 1 -14.566 15.734 30.771 7 HG2 MET 1 2HG MET 1 -16.556 15.449 32.168 8 HG3 MET 1 1HG MET 1 -16.128 16.906 33.062 9 HE1 MET 1 1HE MET 1 -17.282 16.911 28.578 10 HE2 MET 1 2HE MET 1 -17.143 15.451 29.553 11 HE3 MET 1 3HE MET 1 -15.699 16.385 29.140 12 H GLY 2 H GLY 2 -13.025 13.836 30.855 13 HA2 GLY 2 2HA GLY 2 -10.877 14.847 29.742 14 HA3 GLY 2 1HA GLY 2 -10.217 14.454 31.319 15 H PHE 3 H PHE 3 -12.457 12.702 29.160 16 HA PHE 3 HA PHE 3 -10.441 10.600 29.079 17 HB2 PHE 3 2HB PHE 3 -12.279 9.910 30.582 18 HB3 PHE 3 1HB PHE 3 -13.438 10.180 29.288 19 HD1 PHE 3 1HD PHE 3 -14.017 8.421 27.889 20 HD2 PHE 3 2HD PHE 3 -10.417 8.198 30.141 21 HE1 PHE 3 1HE PHE 3 -13.715 6.092 27.168 22 HE2 PHE 3 2HE PHE 3 -10.107 5.866 29.427 23 HZ PHE 3 HZ PHE 3 -11.759 4.812 27.935 24 H THR 4 H THR 4 -9.654 11.104 27.150 25 HA THR 4 HA THR 4 -11.147 10.477 24.823 26 HB THR 4 HB THR 4 -12.100 12.688 25.194 27 HG1 THR 4 1HG THR 4 -11.803 13.460 23.266 28 HG21 THR 4 1HG2 THR 4 -9.269 13.757 25.226 29 HG22 THR 4 2HG2 THR 4 -10.377 13.703 26.597 30 HG23 THR 4 3HG2 THR 4 -10.724 14.747 25.220 31 H ASP 5 H ASP 5 -9.667 9.751 23.331 32 HA ASP 5 HA ASP 5 -6.900 10.397 23.925 33 HB2 ASP 5 2HB ASP 5 -6.244 8.454 22.504 34 HB3 ASP 5 1HB ASP 5 -7.254 8.001 23.861 35 H GLU 6 H GLU 6 -6.499 12.240 23.118 36 HA GLU 6 HA GLU 6 -6.427 12.477 20.222 37 HB2 GLU 6 2HB GLU 6 -8.566 13.538 21.172 38 HB3 GLU 6 1HB GLU 6 -7.538 14.652 22.039 39 HG2 GLU 6 2HG GLU 6 -7.648 14.416 19.029 40 HG3 GLU 6 1HG GLU 6 -8.588 15.557 19.965 41 H THR 7 H THR 7 -4.268 12.539 20.058 42 HA THR 7 HA THR 7 -2.847 14.627 21.385 43 HB THR 7 HB THR 7 -2.674 13.004 23.115 44 HG1 THR 7 1HG THR 7 -0.702 13.426 23.344 45 HG21 THR 7 1HG2 THR 7 -3.294 10.981 21.902 46 HG22 THR 7 2HG2 THR 7 -1.788 10.718 22.785 47 HG23 THR 7 3HG2 THR 7 -1.756 11.004 21.043 48 H VAL 8 H VAL 8 -2.114 15.556 19.588 49 HA VAL 8 HA VAL 8 -0.924 13.926 17.540 50 HB VAL 8 HB VAL 8 -1.279 16.948 17.608 51 HG11 VAL 8 1HG1 VAL 8 -0.420 15.148 15.329 52 HG12 VAL 8 2HG1 VAL 8 0.607 16.298 16.190 53 HG13 VAL 8 3HG1 VAL 8 -0.738 16.880 15.211 54 HG21 VAL 8 1HG2 VAL 8 -3.404 15.765 17.492 55 HG22 VAL 8 2HG2 VAL 8 -2.813 14.813 16.130 56 HG23 VAL 8 3HG2 VAL 8 -3.050 16.550 15.951 57 H ARG 9 H ARG 9 0.701 13.116 18.630 58 HA ARG 9 HA ARG 9 3.094 14.740 18.699 59 HB2 ARG 9 2HB ARG 9 2.083 14.684 21.022 60 HB3 ARG 9 1HB ARG 9 2.260 12.951 21.008 61 HG2 ARG 9 2HG ARG 9 4.575 14.898 20.806 62 HG3 ARG 9 1HG ARG 9 4.023 14.157 22.302 63 HD2 ARG 9 2HD ARG 9 4.587 11.953 21.429 64 HD3 ARG 9 1HD ARG 9 5.052 12.668 19.886 65 HE ARG 9 HE ARG 9 6.496 13.836 22.005 66 HH11 ARG 9 1HH1 ARG 9 6.332 10.814 20.127 67 HH12 ARG 9 2HH1 ARG 9 7.979 10.466 20.316 68 HH21 ARG 9 1HH2 ARG 9 8.744 13.350 22.225 69 HH22 ARG 9 2HH2 ARG 9 9.409 11.946 21.512 70 H PHE 10 H PHE 10 4.159 13.601 17.198 71 HA PHE 10 HA PHE 10 4.116 10.755 17.565 72 HB2 PHE 10 2HB PHE 10 3.826 12.153 14.896 73 HB3 PHE 10 1HB PHE 10 4.037 10.421 15.094 74 HD1 PHE 10 1HD PHE 10 2.225 9.100 16.209 75 HD2 PHE 10 2HD PHE 10 1.715 13.183 15.122 76 HE1 PHE 10 1HE PHE 10 -0.213 8.842 16.376 77 HE2 PHE 10 2HE PHE 10 -0.725 12.929 15.291 78 HZ PHE 10 HZ PHE 10 -1.692 10.754 15.920 79 H ASP 11 H ASP 11 6.091 9.759 16.946 80 HA ASP 11 HA ASP 11 8.367 11.539 16.782 81 HB2 ASP 11 2HB ASP 11 8.489 9.507 18.200 82 HB3 ASP 11 1HB ASP 11 8.235 8.506 16.776 83 H PHE 12 H PHE 12 8.359 12.455 14.809 84 HA PHE 12 HA PHE 12 8.326 10.637 12.511 85 HB2 PHE 12 2HB PHE 12 6.321 12.003 12.534 86 HB3 PHE 12 1HB PHE 12 7.281 13.466 12.676 87 HD1 PHE 12 1HD PHE 12 6.388 10.679 10.432 88 HD2 PHE 12 2HD PHE 12 8.202 14.515 10.744 89 HE1 PHE 12 1HE PHE 12 6.439 10.858 7.984 90 HE2 PHE 12 2HE PHE 12 8.260 14.697 8.300 91 HZ PHE 12 HZ PHE 12 7.377 12.865 6.911 92 H ASP 13 H ASP 13 10.267 10.422 11.733 93 HA ASP 13 HA ASP 13 11.814 12.763 11.041 94 HB2 ASP 13 2HB ASP 13 12.626 12.056 13.307 95 HB3 ASP 13 1HB ASP 13 12.964 10.464 12.645 96 H ASP 14 H ASP 14 13.088 12.330 9.191 97 HA ASP 14 HA ASP 14 12.380 9.800 7.910 98 HB2 ASP 14 2HB ASP 14 11.826 11.847 6.648 99 HB3 ASP 14 1HB ASP 14 13.523 12.306 6.647 100 H ASN 15 H ASN 15 13.779 8.263 7.899 101 HA ASN 15 HA ASN 15 16.550 8.875 7.369 102 HB2 ASN 15 2HB ASN 15 16.437 8.515 9.837 103 HB3 ASN 15 1HB ASN 15 15.715 6.935 9.556 104 HD21 ASN 15 1HD2 ASN 15 18.330 8.263 7.581 105 HD22 ASN 15 2HD2 ASN 15 19.524 7.159 8.088 106 H ARG 16 H ARG 16 16.366 8.185 5.409 107 HA ARG 16 HA ARG 16 14.768 5.905 4.875 108 HB2 ARG 16 2HB ARG 16 15.143 6.451 2.460 109 HB3 ARG 16 1HB ARG 16 14.271 7.615 3.435 110 HG2 ARG 16 2HG ARG 16 16.431 8.893 3.647 111 HG3 ARG 16 1HG ARG 16 17.095 7.802 2.422 112 HD2 ARG 16 2HD ARG 16 16.205 9.870 1.440 113 HD3 ARG 16 1HD ARG 16 15.334 8.438 0.878 114 HE ARG 16 HE ARG 16 14.292 9.962 3.158 115 HH11 ARG 16 1HH1 ARG 16 13.889 8.934 -0.227 116 HH12 ARG 16 2HH1 ARG 16 12.239 9.361 -0.259 117 HH21 ARG 16 1HH2 ARG 16 12.070 10.439 3.080 118 HH22 ARG 16 2HH2 ARG 16 11.185 10.216 1.611 119 H LYS 17 H LYS 17 15.474 4.207 5.387 120 HA LYS 17 HA LYS 17 17.686 2.985 3.899 121 HB2 LYS 17 2HB LYS 17 16.894 2.448 6.792 122 HB3 LYS 17 1HB LYS 17 18.148 1.606 5.903 123 HG2 LYS 17 2HG LYS 17 19.466 3.655 5.803 124 HG3 LYS 17 1HG LYS 17 18.185 4.517 6.658 125 HD2 LYS 17 2HD LYS 17 18.463 3.009 8.571 126 HD3 LYS 17 1HD LYS 17 19.773 2.180 7.726 127 HE2 LYS 17 2HE LYS 17 21.063 4.235 7.684 128 HE3 LYS 17 1HE LYS 17 19.735 5.100 8.463 129 HZ1 LYS 17 1HZ LYS 17 21.379 4.552 10.073 130 HZ2 LYS 17 2HZ LYS 17 21.349 2.905 9.649 131 HZ3 LYS 17 3HZ LYS 17 20.004 3.617 10.371 132 H LYS 18 H LYS 18 17.027 0.363 4.771 133 HA LYS 18 HA LYS 18 14.446 0.121 3.514 134 HB2 LYS 18 2HB LYS 18 16.510 -1.930 4.317 135 HB3 LYS 18 1HB LYS 18 15.001 -2.333 3.496 136 HG2 LYS 18 2HG LYS 18 15.594 -0.961 1.612 137 HG3 LYS 18 1HG LYS 18 17.051 -0.413 2.427 138 HD2 LYS 18 2HD LYS 18 17.946 -2.673 2.346 139 HD3 LYS 18 1HD LYS 18 16.463 -3.238 1.549 140 HE2 LYS 18 2HE LYS 18 16.865 -1.771 -0.319 141 HE3 LYS 18 1HE LYS 18 18.281 -1.085 0.476 142 HZ1 LYS 18 1HZ LYS 18 17.993 -3.894 -0.456 143 HZ2 LYS 18 2HZ LYS 18 19.346 -3.239 0.321 144 HZ3 LYS 18 3HZ LYS 18 18.896 -2.674 -1.186 145 H ALA 19 H ALA 19 14.391 1.319 5.858 146 HA ALA 19 HA ALA 19 13.777 -0.260 8.143 147 HB1 ALA 19 1HB ALA 19 14.657 1.989 8.235 148 HB2 ALA 19 2HB ALA 19 13.112 1.823 9.117 149 HB3 ALA 19 3HB ALA 19 13.140 2.551 7.507 150 H ILE 20 H ILE 20 11.909 1.211 5.530 151 HA ILE 20 HA ILE 20 9.405 1.134 6.832 152 HB ILE 20 HB ILE 20 9.930 1.044 3.818 153 HG12 ILE 20 2HG1 ILE 20 9.375 3.405 5.640 154 HG13 ILE 20 1HG1 ILE 20 10.931 3.023 4.916 155 HG21 ILE 20 1HG2 ILE 20 7.423 1.780 5.319 156 HG22 ILE 20 2HG2 ILE 20 7.672 0.318 4.362 157 HG23 ILE 20 3HG2 ILE 20 7.660 1.895 3.574 158 HD11 ILE 20 1HD1 ILE 20 9.819 4.815 3.713 159 HD12 ILE 20 2HD1 ILE 20 8.416 3.780 3.440 160 HD13 ILE 20 3HD1 ILE 20 9.964 3.387 2.689 161 H SER 21 H SER 21 11.275 -1.119 5.103 162 HA SER 21 HA SER 21 9.333 -3.157 4.690 163 HB2 SER 21 2HB SER 21 12.325 -3.455 5.092 164 HB3 SER 21 1HB SER 21 11.257 -4.671 4.393 165 HG SER 21 HG SER 21 10.830 -2.434 3.090 166 H GLU 22 H GLU 22 11.484 -2.371 7.317 167 HA GLU 22 HA GLU 22 10.873 -4.627 8.968 168 HB2 GLU 22 2HB GLU 22 12.054 -1.965 9.739 169 HB3 GLU 22 1HB GLU 22 12.190 -3.481 10.616 170 HG2 GLU 22 2HG GLU 22 13.389 -2.868 7.924 171 HG3 GLU 22 1HG GLU 22 14.247 -2.940 9.459 172 H THR 23 H THR 23 9.946 -1.220 8.815 173 HA THR 23 HA THR 23 8.328 -0.981 11.047 174 HB THR 23 HB THR 23 8.034 0.342 8.332 175 HG1 THR 23 1HG THR 23 9.925 0.550 10.175 176 HG21 THR 23 1HG2 THR 23 5.990 0.614 9.682 177 HG22 THR 23 2HG2 THR 23 6.858 2.144 9.526 178 HG23 THR 23 3HG2 THR 23 6.958 1.225 11.023 179 H LEU 24 H LEU 24 7.387 -1.842 7.705 180 HA LEU 24 HA LEU 24 4.702 -2.315 8.444 181 HB2 LEU 24 2HB LEU 24 6.209 -3.101 5.969 182 HB3 LEU 24 1HB LEU 24 4.472 -3.275 6.168 183 HG LEU 24 HG LEU 24 6.022 -0.683 6.117 184 HD11 LEU 24 1HD1 LEU 24 4.093 -1.886 4.148 185 HD12 LEU 24 2HD1 LEU 24 5.837 -1.736 3.940 186 HD13 LEU 24 3HD1 LEU 24 4.833 -0.290 4.033 187 HD21 LEU 24 1HD2 LEU 24 4.111 -0.497 7.622 188 HD22 LEU 24 2HD2 LEU 24 3.044 -1.158 6.381 189 HD23 LEU 24 3HD2 LEU 24 3.818 0.409 6.143 190 H GLU 25 H GLU 25 7.541 -4.402 8.251 191 HA GLU 25 HA GLU 25 6.183 -6.836 8.418 192 HB2 GLU 25 2HB GLU 25 8.557 -6.786 7.915 193 HB3 GLU 25 1HB GLU 25 8.911 -6.073 9.483 194 HG2 GLU 25 2HG GLU 25 8.205 -8.068 10.607 195 HG3 GLU 25 1HG GLU 25 7.712 -8.799 9.085 196 H THR 26 H THR 26 7.338 -4.598 10.884 197 HA THR 26 HA THR 26 6.629 -6.002 13.180 198 HB THR 26 HB THR 26 6.696 -3.015 12.670 199 HG1 THR 26 1HG THR 26 8.696 -4.094 12.295 200 HG21 THR 26 1HG2 THR 26 6.971 -2.787 15.102 201 HG22 THR 26 2HG2 THR 26 6.796 -4.541 15.279 202 HG23 THR 26 3HG2 THR 26 5.445 -3.577 14.685 203 H VAL 27 H VAL 27 4.824 -3.627 11.270 204 HA VAL 27 HA VAL 27 2.446 -3.659 12.770 205 HB VAL 27 HB VAL 27 2.792 -3.086 9.811 206 HG11 VAL 27 1HG1 VAL 27 0.462 -3.520 10.382 207 HG12 VAL 27 2HG1 VAL 27 0.705 -1.812 10.011 208 HG13 VAL 27 3HG1 VAL 27 0.554 -2.337 11.686 209 HG21 VAL 27 1HG2 VAL 27 2.770 -1.195 12.163 210 HG22 VAL 27 2HG2 VAL 27 2.846 -0.734 10.465 211 HG23 VAL 27 3HG2 VAL 27 4.179 -1.631 11.193 212 H TYR 28 H TYR 28 3.398 -5.498 9.950 213 HA TYR 28 HA TYR 28 1.014 -6.796 9.428 214 HB2 TYR 28 2HB TYR 28 2.889 -6.875 7.869 215 HB3 TYR 28 1HB TYR 28 3.824 -7.835 9.009 216 HD1 TYR 28 1HD TYR 28 3.510 -10.202 9.169 217 HD2 TYR 28 2HD TYR 28 0.905 -7.871 6.759 218 HE1 TYR 28 1HE TYR 28 2.572 -12.254 8.207 219 HE2 TYR 28 2HE TYR 28 -0.040 -9.915 5.794 220 HH TYR 28 HH TYR 28 0.562 -12.997 7.135 221 H ARG 29 H ARG 29 3.695 -7.940 11.401 222 HA ARG 29 HA ARG 29 2.393 -10.371 12.098 223 HB2 ARG 29 2HB ARG 29 4.806 -9.057 13.345 224 HB3 ARG 29 1HB ARG 29 4.270 -10.711 13.634 225 HG2 ARG 29 2HG ARG 29 4.556 -11.194 11.223 226 HG3 ARG 29 1HG ARG 29 5.180 -9.567 11.000 227 HD2 ARG 29 2HD ARG 29 6.402 -11.715 12.729 228 HD3 ARG 29 1HD ARG 29 6.960 -11.227 11.137 229 HE ARG 29 HE ARG 29 6.870 -9.100 13.061 230 HH11 ARG 29 1HH1 ARG 29 8.820 -11.679 11.628 231 HH12 ARG 29 2HH1 ARG 29 10.310 -11.062 12.144 232 HH21 ARG 29 1HH2 ARG 29 8.964 -8.242 13.822 233 HH22 ARG 29 2HH2 ARG 29 10.388 -9.087 13.443 234 H ALA 30 H ALA 30 2.438 -7.234 13.563 235 HA ALA 30 HA ALA 30 1.476 -7.984 16.093 236 HB1 ALA 30 1HB ALA 30 2.371 -5.745 15.610 237 HB2 ALA 30 2HB ALA 30 0.767 -5.661 16.340 238 HB3 ALA 30 3HB ALA 30 0.961 -5.405 14.607 239 H LEU 31 H LEU 31 -0.241 -7.269 13.061 240 HA LEU 31 HA LEU 31 -2.748 -7.596 14.364 241 HB2 LEU 31 2HB LEU 31 -2.204 -7.450 11.420 242 HB3 LEU 31 1HB LEU 31 -3.805 -7.699 12.078 243 HG LEU 31 HG LEU 31 -3.174 -5.511 13.390 244 HD11 LEU 31 1HD1 LEU 31 -1.640 -5.221 10.857 245 HD12 LEU 31 2HD1 LEU 31 -0.954 -5.260 12.493 246 HD13 LEU 31 3HD1 LEU 31 -2.011 -3.926 11.987 247 HD21 LEU 31 1HD2 LEU 31 -4.287 -4.227 11.644 248 HD22 LEU 31 2HD2 LEU 31 -5.117 -5.709 12.093 249 HD23 LEU 31 3HD2 LEU 31 -4.203 -5.626 10.586 250 H GLU 32 H GLU 32 -0.617 -9.816 12.795 251 HA GLU 32 HA GLU 32 -2.474 -11.895 12.406 252 HB2 GLU 32 2HB GLU 32 0.443 -12.179 13.192 253 HB3 GLU 32 1HB GLU 32 -0.568 -13.458 12.549 254 HG2 GLU 32 2HG GLU 32 -0.812 -12.114 10.465 255 HG3 GLU 32 1HG GLU 32 0.365 -10.983 11.128 256 H GLU 33 H GLU 33 -0.676 -10.842 15.183 257 HA GLU 33 HA GLU 33 -1.455 -12.893 16.985 258 HB2 GLU 33 2HB GLU 33 -0.578 -10.058 17.475 259 HB3 GLU 33 1HB GLU 33 -0.850 -11.228 18.755 260 HG2 GLU 33 2HG GLU 33 1.167 -11.479 16.538 261 HG3 GLU 33 1HG GLU 33 1.508 -11.000 18.201 262 H LYS 34 H LYS 34 -3.093 -10.077 15.845 263 HA LYS 34 HA LYS 34 -4.984 -10.138 18.082 264 HB2 LYS 34 2HB LYS 34 -4.573 -8.136 15.893 265 HB3 LYS 34 1HB LYS 34 -5.830 -7.997 17.116 266 HG2 LYS 34 2HG LYS 34 -2.867 -8.103 17.656 267 HG3 LYS 34 1HG LYS 34 -3.835 -6.628 17.591 268 HD2 LYS 34 2HD LYS 34 -4.360 -8.909 19.502 269 HD3 LYS 34 1HD LYS 34 -3.401 -7.500 19.920 270 HE2 LYS 34 2HE LYS 34 -5.304 -6.078 19.457 271 HE3 LYS 34 1HE LYS 34 -6.296 -7.492 19.067 272 HZ1 LYS 34 1HZ LYS 34 -5.872 -8.264 21.380 273 HZ2 LYS 34 2HZ LYS 34 -6.736 -6.830 21.293 274 HZ3 LYS 34 3HZ LYS 34 -5.122 -6.780 21.714 275 H GLY 35 H GLY 35 -4.783 -11.384 15.012 276 HA2 GLY 35 2HA GLY 35 -6.351 -12.696 13.920 277 HA3 GLY 35 1HA GLY 35 -7.521 -12.253 15.151 278 H TYR 36 H TYR 36 -5.741 -9.946 13.235 279 HA TYR 36 HA TYR 36 -8.236 -9.283 11.804 280 HB2 TYR 36 2HB TYR 36 -5.865 -7.519 12.433 281 HB3 TYR 36 1HB TYR 36 -7.201 -7.034 11.403 282 HD1 TYR 36 1HD TYR 36 -5.890 -7.161 14.688 283 HD2 TYR 36 2HD TYR 36 -9.522 -6.906 12.518 284 HE1 TYR 36 1HE TYR 36 -7.001 -6.251 16.682 285 HE2 TYR 36 2HE TYR 36 -10.656 -5.991 14.498 286 HH TYR 36 HH TYR 36 -10.342 -6.030 16.958 287 H ASN 37 H ASN 37 -7.520 -8.078 9.645 288 HA ASN 37 HA ASN 37 -5.559 -9.837 8.378 289 HB2 ASN 37 2HB ASN 37 -7.656 -8.038 7.103 290 HB3 ASN 37 1HB ASN 37 -6.539 -9.071 6.220 291 HD21 ASN 37 1HD2 ASN 37 -8.118 -10.241 5.258 292 HD22 ASN 37 2HD2 ASN 37 -9.161 -11.329 6.085 293 HA PRO 38 HA PRO 38 -2.944 -6.280 9.274 294 HB2 PRO 38 2HB PRO 38 -1.050 -7.802 7.630 295 HB3 PRO 38 1HB PRO 38 -0.886 -7.151 9.264 296 HG2 PRO 38 2HG PRO 38 -1.249 -9.795 8.708 297 HG3 PRO 38 1HG PRO 38 -1.708 -9.039 10.232 298 HD2 PRO 38 2HD PRO 38 -3.404 -10.038 8.065 299 HD3 PRO 38 1HD PRO 38 -3.793 -9.650 9.755 300 H ILE 39 H ILE 39 -3.076 -7.746 6.025 301 HA ILE 39 HA ILE 39 -1.945 -5.449 4.791 302 HB ILE 39 HB ILE 39 -3.546 -7.708 3.563 303 HG12 ILE 39 2HG1 ILE 39 -1.441 -8.437 4.553 304 HG13 ILE 39 1HG1 ILE 39 -1.346 -8.503 2.795 305 HG21 ILE 39 1HG2 ILE 39 -2.718 -6.972 1.389 306 HG22 ILE 39 2HG2 ILE 39 -1.917 -5.591 2.150 307 HG23 ILE 39 3HG2 ILE 39 -3.676 -5.708 2.157 308 HD11 ILE 39 1HD1 ILE 39 -0.084 -6.407 2.799 309 HD12 ILE 39 2HD1 ILE 39 0.712 -7.658 3.750 310 HD13 ILE 39 3HD1 ILE 39 -0.158 -6.364 4.562 311 H ASN 40 H ASN 40 -5.318 -6.512 5.262 312 HA ASN 40 HA ASN 40 -6.487 -4.542 3.767 313 HB2 ASN 40 2HB ASN 40 -7.683 -6.496 4.253 314 HB3 ASN 40 1HB ASN 40 -7.299 -6.388 5.968 315 HD21 ASN 40 1HD2 ASN 40 -8.494 -5.159 7.265 316 HD22 ASN 40 2HD2 ASN 40 -9.930 -4.392 6.750 317 H GLN 41 H GLN 41 -5.408 -4.667 7.151 318 HA GLN 41 HA GLN 41 -6.705 -2.215 7.758 319 HB2 GLN 41 2HB GLN 41 -4.585 -3.728 9.258 320 HB3 GLN 41 1HB GLN 41 -5.482 -2.354 9.889 321 HG2 GLN 41 2HG GLN 41 -6.697 -4.976 9.022 322 HG3 GLN 41 1HG GLN 41 -6.381 -4.500 10.681 323 HE21 GLN 41 1HE2 GLN 41 -7.233 -1.770 10.332 324 HE22 GLN 41 2HE2 GLN 41 -8.954 -1.808 10.164 325 H ILE 42 H ILE 42 -3.484 -3.118 6.672 326 HA ILE 42 HA ILE 42 -2.337 -0.563 7.074 327 HB ILE 42 HB ILE 42 -1.501 -2.751 5.128 328 HG12 ILE 42 2HG1 ILE 42 -0.365 -1.941 7.819 329 HG13 ILE 42 1HG1 ILE 42 -1.357 -3.362 7.520 330 HG21 ILE 42 1HG2 ILE 42 -0.004 -0.246 5.939 331 HG22 ILE 42 2HG2 ILE 42 -0.669 -0.589 4.349 332 HG23 ILE 42 3HG2 ILE 42 0.661 -1.565 4.971 333 HD11 ILE 42 1HD1 ILE 42 0.402 -4.269 6.069 334 HD12 ILE 42 2HD1 ILE 42 0.996 -3.947 7.698 335 HD13 ILE 42 3HD1 ILE 42 1.386 -2.840 6.383 336 H VAL 43 H VAL 43 -3.777 -2.069 4.153 337 HA VAL 43 HA VAL 43 -3.498 0.214 2.561 338 HB VAL 43 HB VAL 43 -4.044 -1.857 1.401 339 HG11 VAL 43 1HG1 VAL 43 -5.314 -2.946 3.146 340 HG12 VAL 43 2HG1 VAL 43 -6.219 -2.967 1.624 341 HG13 VAL 43 3HG1 VAL 43 -6.659 -1.833 2.907 342 HG21 VAL 43 1HG2 VAL 43 -6.403 0.004 1.199 343 HG22 VAL 43 2HG2 VAL 43 -5.948 -1.215 0.007 344 HG23 VAL 43 3HG2 VAL 43 -4.877 0.152 0.330 345 H GLY 44 H GLY 44 -6.006 -0.669 4.826 346 HA2 GLY 44 2HA GLY 44 -7.762 1.480 4.344 347 HA3 GLY 44 1HA GLY 44 -7.612 0.607 5.865 348 H TYR 45 H TYR 45 -4.964 1.165 6.502 349 HA TYR 45 HA TYR 45 -5.173 3.660 7.722 350 HB2 TYR 45 2HB TYR 45 -3.705 2.082 8.744 351 HB3 TYR 45 1HB TYR 45 -2.745 1.917 7.276 352 HD1 TYR 45 1HD TYR 45 -0.825 3.239 6.982 353 HD2 TYR 45 2HD TYR 45 -3.699 4.425 9.877 354 HE1 TYR 45 1HE TYR 45 0.668 5.020 7.707 355 HE2 TYR 45 2HE TYR 45 -2.213 6.208 10.625 356 HH TYR 45 HH TYR 45 0.577 7.091 8.798 357 H LEU 46 H LEU 46 -3.210 2.787 4.872 358 HA LEU 46 HA LEU 46 -2.302 5.463 4.692 359 HB2 LEU 46 2HB LEU 46 -2.102 3.287 2.626 360 HB3 LEU 46 1HB LEU 46 -1.456 4.892 2.371 361 HG LEU 46 HG LEU 46 -0.026 4.455 4.474 362 HD11 LEU 46 1HD1 LEU 46 0.458 2.223 5.063 363 HD12 LEU 46 2HD1 LEU 46 -0.706 1.618 3.884 364 HD13 LEU 46 3HD1 LEU 46 -1.264 2.537 5.278 365 HD21 LEU 46 1HD2 LEU 46 0.918 4.540 2.277 366 HD22 LEU 46 2HD2 LEU 46 0.447 2.865 1.971 367 HD23 LEU 46 3HD2 LEU 46 1.661 3.238 3.198 368 H LEU 47 H LEU 47 -5.027 3.876 3.197 369 HA LEU 47 HA LEU 47 -5.456 6.108 1.458 370 HB2 LEU 47 2HB LEU 47 -7.287 3.818 2.140 371 HB3 LEU 47 1HB LEU 47 -7.621 5.028 0.923 372 HG LEU 47 HG LEU 47 -5.392 2.991 0.859 373 HD11 LEU 47 1HD1 LEU 47 -6.598 2.099 -1.061 374 HD12 LEU 47 2HD1 LEU 47 -7.874 3.291 -0.817 375 HD13 LEU 47 3HD1 LEU 47 -7.579 2.052 0.402 376 HD21 LEU 47 1HD2 LEU 47 -4.934 3.845 -1.401 377 HD22 LEU 47 2HD2 LEU 47 -4.635 5.066 -0.171 378 HD23 LEU 47 3HD2 LEU 47 -6.106 5.137 -1.147 379 H SER 48 H SER 48 -6.575 5.248 4.663 380 HA SER 48 HA SER 48 -8.486 7.441 4.527 381 HB2 SER 48 2HB SER 48 -9.273 5.289 5.418 382 HB3 SER 48 1HB SER 48 -8.073 5.380 6.702 383 HG SER 48 HG SER 48 -9.373 7.633 6.863 384 H GLY 49 H GLY 49 -5.339 6.724 5.935 385 HA2 GLY 49 2HA GLY 49 -3.891 8.103 7.000 386 HA3 GLY 49 1HA GLY 49 -5.002 9.435 6.701 387 H ASP 50 H ASP 50 -5.675 6.451 8.479 388 HA ASP 50 HA ASP 50 -5.865 8.043 10.923 389 HB2 ASP 50 2HB ASP 50 -8.131 7.780 10.056 390 HB3 ASP 50 1HB ASP 50 -7.920 6.033 9.978 391 HA PRO 51 HA PRO 51 -3.164 4.825 12.293 392 HB2 PRO 51 2HB PRO 51 -3.143 5.482 14.934 393 HB3 PRO 51 1HB PRO 51 -2.193 6.322 13.710 394 HG2 PRO 51 2HG PRO 51 -4.810 7.089 14.941 395 HG3 PRO 51 1HG PRO 51 -3.423 8.115 14.531 396 HD2 PRO 51 2HD PRO 51 -5.644 7.989 13.005 397 HD3 PRO 51 1HD PRO 51 -4.029 8.255 12.310 398 H ALA 52 H ALA 52 -6.408 5.170 13.555 399 HA ALA 52 HA ALA 52 -6.256 3.002 15.397 400 HB1 ALA 52 1HB ALA 52 -8.754 4.180 14.194 401 HB2 ALA 52 2HB ALA 52 -7.945 4.751 15.658 402 HB3 ALA 52 3HB ALA 52 -8.663 3.142 15.615 403 H TYR 53 H TYR 53 -6.413 3.013 12.063 404 HA TYR 53 HA TYR 53 -7.743 0.579 11.615 405 HB2 TYR 53 2HB TYR 53 -5.741 2.132 10.049 406 HB3 TYR 53 1HB TYR 53 -6.155 0.490 9.546 407 HD1 TYR 53 1HD TYR 53 -8.343 -0.073 8.870 408 HD2 TYR 53 2HD TYR 53 -7.374 3.919 9.886 409 HE1 TYR 53 1HE TYR 53 -10.391 0.639 7.847 410 HE2 TYR 53 2HE TYR 53 -9.456 4.695 8.835 411 HH TYR 53 HH TYR 53 -11.164 3.988 7.256 412 H ILE 54 H ILE 54 -4.677 1.313 12.972 413 HA ILE 54 HA ILE 54 -3.897 -1.494 12.801 414 HB ILE 54 HB ILE 54 -2.202 0.917 13.550 415 HG12 ILE 54 2HG1 ILE 54 -2.739 1.011 11.179 416 HG13 ILE 54 1HG1 ILE 54 -1.061 0.537 11.387 417 HG21 ILE 54 1HG2 ILE 54 -0.286 -0.605 13.401 418 HG22 ILE 54 2HG2 ILE 54 -1.385 -1.951 13.107 419 HG23 ILE 54 3HG2 ILE 54 -1.427 -1.101 14.651 420 HD11 ILE 54 1HD1 ILE 54 -3.348 -1.309 10.724 421 HD12 ILE 54 2HD1 ILE 54 -1.665 -1.791 10.938 422 HD13 ILE 54 3HD1 ILE 54 -2.115 -0.725 9.605 423 HA PRO 55 HA PRO 55 -5.401 -1.513 17.073 424 HB2 PRO 55 2HB PRO 55 -4.586 -4.078 17.615 425 HB3 PRO 55 1HB PRO 55 -6.083 -3.691 16.767 426 HG2 PRO 55 2HG PRO 55 -3.436 -4.503 15.651 427 HG3 PRO 55 1HG PRO 55 -5.062 -5.027 15.177 428 HD2 PRO 55 2HD PRO 55 -3.713 -3.216 13.762 429 HD3 PRO 55 1HD PRO 55 -5.473 -3.096 13.965 430 H ARG 56 H ARG 56 -4.373 -0.968 18.959 431 HA ARG 56 HA ARG 56 -1.511 -1.077 18.837 432 HB2 ARG 56 2HB ARG 56 -1.453 0.366 20.876 433 HB3 ARG 56 1HB ARG 56 -2.260 1.082 19.499 434 HG2 ARG 56 2HG ARG 56 -4.423 0.628 20.503 435 HG3 ARG 56 1HG ARG 56 -3.643 -0.157 21.883 436 HD2 ARG 56 2HD ARG 56 -3.328 2.738 21.056 437 HD3 ARG 56 1HD ARG 56 -4.285 2.151 22.414 438 HE ARG 56 HE ARG 56 -1.699 1.194 22.733 439 HH11 ARG 56 1HH1 ARG 56 -3.290 4.392 22.742 440 HH12 ARG 56 2HH1 ARG 56 -2.185 5.058 23.842 441 HH21 ARG 56 1HH2 ARG 56 -0.217 2.130 24.206 442 HH22 ARG 56 2HH2 ARG 56 -0.377 3.750 24.711 443 H TYR 57 H TYR 57 -1.616 -3.286 18.868 444 HA TYR 57 HA TYR 57 -1.810 -4.637 21.425 445 HB2 TYR 57 2HB TYR 57 -2.406 -5.900 19.477 446 HB3 TYR 57 1HB TYR 57 -0.911 -5.474 18.671 447 HD1 TYR 57 1HD TYR 57 -2.229 -7.425 21.560 448 HD2 TYR 57 2HD TYR 57 0.988 -6.816 18.856 449 HE1 TYR 57 1HE TYR 57 -1.154 -9.446 22.400 450 HE2 TYR 57 2HE TYR 57 2.096 -8.829 19.692 451 HH TYR 57 HH TYR 57 0.528 -11.112 21.629 452 H GLN 58 H GLN 58 0.588 -3.492 19.216 453 HA GLN 58 HA GLN 58 2.729 -3.898 21.167 454 HB2 GLN 58 2HB GLN 58 2.608 -5.738 19.401 455 HB3 GLN 58 1HB GLN 58 2.831 -4.486 18.193 456 HG2 GLN 58 2HG GLN 58 5.065 -4.035 19.093 457 HG3 GLN 58 1HG GLN 58 4.800 -5.293 20.310 458 HE21 GLN 58 1HE2 GLN 58 4.832 -7.443 19.704 459 HE22 GLN 58 2HE2 GLN 58 5.434 -7.970 18.192 460 H ASP 59 H ASP 59 4.667 -2.581 20.158 461 HA ASP 59 HA ASP 59 4.044 0.095 19.854 462 HB2 ASP 59 2HB ASP 59 6.562 -1.363 19.103 463 HB3 ASP 59 1HB ASP 59 6.388 0.362 18.926 464 H ALA 60 H ALA 60 3.544 -2.214 17.542 465 HA ALA 60 HA ALA 60 4.376 -1.259 15.110 466 HB1 ALA 60 1HB ALA 60 3.241 -3.377 15.369 467 HB2 ALA 60 2HB ALA 60 2.482 -2.382 14.129 468 HB3 ALA 60 3HB ALA 60 1.724 -2.535 15.716 469 H ARG 61 H ARG 61 1.410 -0.215 16.839 470 HA ARG 61 HA ARG 61 0.509 1.527 14.812 471 HB2 ARG 61 2HB ARG 61 -0.999 0.845 16.637 472 HB3 ARG 61 1HB ARG 61 0.006 1.690 17.806 473 HG2 ARG 61 2HG ARG 61 -0.583 3.832 16.815 474 HG3 ARG 61 1HG ARG 61 -1.517 3.028 15.557 475 HD2 ARG 61 2HD ARG 61 -3.072 2.179 17.223 476 HD3 ARG 61 1HD ARG 61 -2.098 2.878 18.515 477 HE ARG 61 HE ARG 61 -2.701 4.979 16.897 478 HH11 ARG 61 1HH1 ARG 61 -4.689 2.590 18.601 479 HH12 ARG 61 2HH1 ARG 61 -5.941 3.670 18.966 480 HH21 ARG 61 1HH2 ARG 61 -4.485 6.489 17.402 481 HH22 ARG 61 2HH2 ARG 61 -5.826 5.908 18.263 482 H ASN 62 H ASN 62 2.848 1.921 17.356 483 HA ASN 62 HA ASN 62 3.173 4.731 17.033 484 HB2 ASN 62 2HB ASN 62 3.869 3.515 19.165 485 HB3 ASN 62 1HB ASN 62 5.080 2.709 18.216 486 HD21 ASN 62 1HD2 ASN 62 6.998 3.678 17.753 487 HD22 ASN 62 2HD2 ASN 62 7.422 5.247 18.291 488 H LEU 63 H LEU 63 4.958 1.848 15.918 489 HA LEU 63 HA LEU 63 6.959 3.193 14.479 490 HB2 LEU 63 2HB LEU 63 5.801 0.458 14.032 491 HB3 LEU 63 1HB LEU 63 7.030 1.100 12.968 492 HG LEU 63 HG LEU 63 8.127 -0.336 14.395 493 HD11 LEU 63 1HD1 LEU 63 9.359 1.645 14.101 494 HD12 LEU 63 2HD1 LEU 63 9.644 1.006 15.719 495 HD13 LEU 63 3HD1 LEU 63 8.585 2.395 15.502 496 HD21 LEU 63 1HD2 LEU 63 7.985 -0.319 16.835 497 HD22 LEU 63 2HD2 LEU 63 6.445 -0.689 16.063 498 HD23 LEU 63 3HD2 LEU 63 6.725 0.915 16.738 499 H ILE 64 H ILE 64 3.782 2.130 13.364 500 HA ILE 64 HA ILE 64 4.334 2.926 10.702 501 HB ILE 64 HB ILE 64 2.609 1.191 11.323 502 HG12 ILE 64 2HG1 ILE 64 1.502 3.460 9.656 503 HG13 ILE 64 1HG1 ILE 64 2.667 2.272 9.079 504 HG21 ILE 64 1HG2 ILE 64 0.948 3.582 12.114 505 HG22 ILE 64 2HG2 ILE 64 1.578 2.342 13.194 506 HG23 ILE 64 3HG2 ILE 64 0.363 1.921 11.986 507 HD11 ILE 64 1HD1 ILE 64 1.019 0.497 9.462 508 HD12 ILE 64 2HD1 ILE 64 0.422 1.723 8.343 509 HD13 ILE 64 3HD1 ILE 64 -0.139 1.710 10.012 510 H ARG 65 H ARG 65 3.095 4.570 13.500 511 HA ARG 65 HA ARG 65 2.384 6.898 11.971 512 HB2 ARG 65 2HB ARG 65 2.236 6.300 14.906 513 HB3 ARG 65 1HB ARG 65 1.973 7.923 14.279 514 HG2 ARG 65 2HG ARG 65 0.404 5.467 13.514 515 HG3 ARG 65 1HG ARG 65 -0.129 6.751 14.607 516 HD2 ARG 65 2HD ARG 65 0.530 7.094 11.662 517 HD3 ARG 65 1HD ARG 65 -1.064 7.063 12.352 518 HE ARG 65 HE ARG 65 -0.452 9.081 13.595 519 HH11 ARG 65 1HH1 ARG 65 1.347 8.333 10.593 520 HH12 ARG 65 2HH1 ARG 65 1.741 9.970 10.304 521 HH21 ARG 65 1HH2 ARG 65 0.085 11.350 13.053 522 HH22 ARG 65 2HH2 ARG 65 1.002 11.647 11.656 523 H ARG 66 H ARG 66 5.256 5.721 12.662 524 HA ARG 66 HA ARG 66 6.520 8.239 13.428 525 HB2 ARG 66 2HB ARG 66 7.791 5.632 12.547 526 HB3 ARG 66 1HB ARG 66 8.675 7.034 13.111 527 HG2 ARG 66 2HG ARG 66 7.500 6.805 15.288 528 HG3 ARG 66 1HG ARG 66 6.809 5.295 14.692 529 HD2 ARG 66 2HD ARG 66 8.731 4.746 15.981 530 HD3 ARG 66 1HD ARG 66 9.152 4.498 14.288 531 HE ARG 66 HE ARG 66 9.830 7.114 15.302 532 HH11 ARG 66 1HH1 ARG 66 11.077 3.826 14.738 533 HH12 ARG 66 2HH1 ARG 66 12.675 4.268 15.028 534 HH21 ARG 66 1HH2 ARG 66 11.912 7.682 15.664 535 HH22 ARG 66 2HH2 ARG 66 13.227 6.586 15.567 536 H HIS 67 H HIS 67 5.149 6.975 10.841 537 HA HIS 67 HA HIS 67 6.575 8.687 8.979 538 HB2 HIS 67 2HB HIS 67 5.498 5.905 8.469 539 HB3 HIS 67 1HB HIS 67 6.135 6.965 7.215 540 HD1 HIS 67 1HD HIS 67 8.749 7.092 7.038 541 HD2 HIS 67 2HD HIS 67 7.379 4.574 10.054 542 HE1 HIS 67 1HE HIS 67 10.730 5.738 7.739 543 HE2 HIS 67 2HE HIS 67 9.924 4.326 9.644 544 H GLU 68 H GLU 68 4.948 9.153 7.164 545 HA GLU 68 HA GLU 68 2.401 9.525 8.482 546 HB2 GLU 68 2HB GLU 68 3.431 10.687 5.895 547 HB3 GLU 68 1HB GLU 68 1.851 11.019 6.593 548 HG2 GLU 68 2HG GLU 68 4.455 11.567 7.978 549 HG3 GLU 68 1HG GLU 68 3.540 12.759 7.061 550 H ARG 69 H ARG 69 3.069 8.836 5.088 551 HA ARG 69 HA ARG 69 1.959 6.326 4.879 552 HB2 ARG 69 2HB ARG 69 -0.366 6.746 3.993 553 HB3 ARG 69 1HB ARG 69 -0.174 7.179 5.671 554 HG2 ARG 69 2HG ARG 69 -0.076 9.536 5.099 555 HG3 ARG 69 1HG ARG 69 -0.168 9.138 3.380 556 HD2 ARG 69 2HD ARG 69 -2.361 8.132 3.712 557 HD3 ARG 69 1HD ARG 69 -2.269 8.457 5.438 558 HE ARG 69 HE ARG 69 -2.115 10.882 4.669 559 HH11 ARG 69 1HH1 ARG 69 -4.053 8.382 3.010 560 HH12 ARG 69 2HH1 ARG 69 -5.218 9.482 2.438 561 HH21 ARG 69 1HH2 ARG 69 -3.767 12.379 3.863 562 HH22 ARG 69 2HH2 ARG 69 -5.064 11.784 2.939 563 H ASP 70 H ASP 70 2.407 9.464 3.489 564 HA ASP 70 HA ASP 70 2.007 8.845 0.814 565 HB2 ASP 70 2HB ASP 70 3.202 10.967 0.361 566 HB3 ASP 70 1HB ASP 70 1.962 11.118 1.590 567 H GLU 71 H GLU 71 5.195 9.144 2.477 568 HA GLU 71 HA GLU 71 6.729 8.354 0.236 569 HB2 GLU 71 2HB GLU 71 7.600 9.533 2.264 570 HB3 GLU 71 1HB GLU 71 7.415 8.040 3.165 571 HG2 GLU 71 2HG GLU 71 9.718 8.236 2.599 572 HG3 GLU 71 1HG GLU 71 9.040 6.980 1.567 573 H ILE 72 H ILE 72 5.205 6.593 2.830 574 HA ILE 72 HA ILE 72 6.399 4.067 2.421 575 HB ILE 72 HB ILE 72 3.621 4.660 3.485 576 HG12 ILE 72 2HG1 ILE 72 6.223 4.205 4.964 577 HG13 ILE 72 1HG1 ILE 72 5.385 5.746 4.809 578 HG21 ILE 72 1HG2 ILE 72 3.825 2.334 2.776 579 HG22 ILE 72 2HG2 ILE 72 3.752 2.432 4.537 580 HG23 ILE 72 3HG2 ILE 72 5.295 2.157 3.735 581 HD11 ILE 72 1HD1 ILE 72 4.323 3.299 6.206 582 HD12 ILE 72 2HD1 ILE 72 3.503 4.859 6.087 583 HD13 ILE 72 3HD1 ILE 72 5.014 4.717 6.989 584 H MET 73 H MET 73 3.396 5.516 1.200 585 HA MET 73 HA MET 73 2.555 3.272 -0.276 586 HB2 MET 73 2HB MET 73 1.199 5.363 0.433 587 HB3 MET 73 1HB MET 73 1.910 6.143 -0.962 588 HG2 MET 73 2HG MET 73 0.185 3.670 -1.045 589 HG3 MET 73 1HG MET 73 -0.367 5.306 -1.367 590 HE1 MET 73 1HE MET 73 -0.515 3.554 -4.842 591 HE2 MET 73 2HE MET 73 -1.396 4.391 -3.566 592 HE3 MET 73 3HE MET 73 -0.771 2.762 -3.283 593 H GLU 74 H GLU 74 4.543 6.099 -1.073 594 HA GLU 74 HA GLU 74 4.898 5.650 -3.795 595 HB2 GLU 74 2HB GLU 74 6.906 6.658 -1.805 596 HB3 GLU 74 1HB GLU 74 7.107 6.703 -3.542 597 HG2 GLU 74 2HG GLU 74 5.193 8.199 -3.739 598 HG3 GLU 74 1HG GLU 74 4.954 8.138 -1.989 599 H GLU 75 H GLU 75 6.837 4.493 -1.044 600 HA GLU 75 HA GLU 75 8.559 2.998 -2.690 601 HB2 GLU 75 2HB GLU 75 9.175 3.681 -0.380 602 HB3 GLU 75 1HB GLU 75 8.007 2.509 0.232 603 HG2 GLU 75 2HG GLU 75 9.234 0.685 -0.767 604 HG3 GLU 75 1HG GLU 75 10.367 1.806 -1.504 605 H LEU 76 H LEU 76 5.551 2.171 -1.090 606 HA LEU 76 HA LEU 76 5.614 -0.586 -1.551 607 HB2 LEU 76 2HB LEU 76 3.222 1.254 -1.586 608 HB3 LEU 76 1HB LEU 76 3.128 -0.494 -1.550 609 HG LEU 76 HG LEU 76 4.268 1.268 0.616 610 HD11 LEU 76 1HD1 LEU 76 2.356 0.504 1.918 611 HD12 LEU 76 2HD1 LEU 76 1.756 -0.381 0.520 612 HD13 LEU 76 3HD1 LEU 76 1.842 1.379 0.477 613 HD21 LEU 76 1HD2 LEU 76 3.949 -1.727 0.491 614 HD22 LEU 76 2HD2 LEU 76 4.393 -0.806 1.923 615 HD23 LEU 76 3HD2 LEU 76 5.470 -0.831 0.529 616 H THR 77 H THR 77 4.616 2.039 -3.684 617 HA THR 77 HA THR 77 3.899 0.246 -5.808 618 HB THR 77 HB THR 77 4.440 3.229 -5.880 619 HG1 THR 77 1HG THR 77 2.717 2.939 -4.497 620 HG21 THR 77 1HG2 THR 77 4.449 2.172 -8.103 621 HG22 THR 77 2HG2 THR 77 3.030 3.196 -7.889 622 HG23 THR 77 3HG2 THR 77 2.881 1.443 -7.762 623 H LYS 78 H LYS 78 6.637 2.426 -5.149 624 HA LYS 78 HA LYS 78 8.030 2.146 -7.497 625 HB2 LYS 78 2HB LYS 78 8.076 4.019 -6.092 626 HB3 LYS 78 1HB LYS 78 8.506 3.066 -4.706 627 HG2 LYS 78 2HG LYS 78 10.640 2.852 -5.423 628 HG3 LYS 78 1HG LYS 78 10.340 3.615 -7.026 629 HD2 LYS 78 2HD LYS 78 9.701 5.664 -5.879 630 HD3 LYS 78 1HD LYS 78 9.903 4.909 -4.309 631 HE2 LYS 78 2HE LYS 78 12.251 4.597 -4.813 632 HE3 LYS 78 1HE LYS 78 12.007 5.424 -6.365 633 HZ1 LYS 78 1HZ LYS 78 12.886 6.956 -4.661 634 HZ2 LYS 78 2HZ LYS 78 11.571 6.637 -3.667 635 HZ3 LYS 78 3HZ LYS 78 11.342 7.425 -5.133 636 H TYR 79 H TYR 79 8.372 0.442 -4.370 637 HA TYR 79 HA TYR 79 10.673 -1.041 -5.212 638 HB2 TYR 79 2HB TYR 79 10.051 -0.494 -2.823 639 HB3 TYR 79 1HB TYR 79 8.739 -1.645 -2.965 640 HD1 TYR 79 1HD TYR 79 12.249 -1.159 -2.385 641 HD2 TYR 79 2HD TYR 79 9.293 -4.088 -3.197 642 HE1 TYR 79 1HE TYR 79 13.772 -2.895 -1.553 643 HE2 TYR 79 2HE TYR 79 10.805 -5.859 -2.347 644 HH TYR 79 HH TYR 79 13.640 -5.104 -0.605 645 H TYR 80 H TYR 80 7.184 -1.606 -5.032 646 HA TYR 80 HA TYR 80 7.076 -4.307 -5.746 647 HB2 TYR 80 2HB TYR 80 5.075 -3.271 -4.942 648 HB3 TYR 80 1HB TYR 80 5.136 -2.032 -6.188 649 HD1 TYR 80 1HD TYR 80 4.300 -5.530 -5.475 650 HD2 TYR 80 2HD TYR 80 4.387 -2.469 -8.405 651 HE1 TYR 80 1HE TYR 80 2.912 -6.903 -6.954 652 HE2 TYR 80 2HE TYR 80 3.012 -3.812 -9.883 653 HH TYR 80 HH TYR 80 1.356 -6.504 -8.917 654 H LEU 81 H LEU 81 7.021 -1.441 -7.829 655 HA LEU 81 HA LEU 81 6.780 -2.918 -10.202 656 HB2 LEU 81 2HB LEU 81 7.802 -0.145 -9.724 657 HB3 LEU 81 1HB LEU 81 7.565 -0.818 -11.332 658 HG LEU 81 HG LEU 81 5.404 -0.375 -9.266 659 HD11 LEU 81 1HD1 LEU 81 4.627 1.359 -10.821 660 HD12 LEU 81 2HD1 LEU 81 6.077 1.087 -11.796 661 HD13 LEU 81 3HD1 LEU 81 6.228 1.701 -10.155 662 HD21 LEU 81 1HD2 LEU 81 3.875 -0.900 -11.094 663 HD22 LEU 81 2HD2 LEU 81 4.885 -2.279 -10.684 664 HD23 LEU 81 3HD2 LEU 81 5.236 -1.321 -12.127 665 H ALA 82 H ALA 82 9.528 -2.128 -8.253 666 HA ALA 82 HA ALA 82 11.521 -2.649 -10.179 667 HB1 ALA 82 1HB ALA 82 11.983 -1.459 -8.088 668 HB2 ALA 82 2HB ALA 82 13.014 -2.887 -8.225 669 HB3 ALA 82 3HB ALA 82 11.604 -2.914 -7.172 670 H ASN 83 H ASN 83 9.464 -4.627 -8.252 671 HA ASN 83 HA ASN 83 10.950 -7.062 -8.361 672 HB2 ASN 83 2HB ASN 83 8.051 -6.508 -7.790 673 HB3 ASN 83 1HB ASN 83 8.709 -8.134 -7.837 674 HD21 ASN 83 1HD2 ASN 83 10.596 -5.458 -6.569 675 HD22 ASN 83 2HD2 ASN 83 10.502 -5.980 -4.935 676 H HIS 84 H HIS 84 9.152 -5.419 -10.697 677 HA HIS 84 HA HIS 84 8.537 -7.832 -12.206 678 HB2 HIS 84 2HB HIS 84 8.032 -4.905 -12.807 679 HB3 HIS 84 1HB HIS 84 7.729 -6.166 -13.990 680 HD1 HIS 84 1HD HIS 84 5.607 -7.591 -13.668 681 HD2 HIS 84 2HD HIS 84 6.168 -4.790 -10.655 682 HE1 HIS 84 1HE HIS 84 3.450 -7.519 -12.415 683 HE2 HIS 84 2HE HIS 84 3.796 -5.941 -10.551 684 H GLY 85 H GLY 85 11.315 -6.609 -11.576 685 HA2 GLY 85 2HA GLY 85 13.359 -6.940 -12.630 686 HA3 GLY 85 1HA GLY 85 12.501 -7.351 -14.110 687 H ILE 86 H ILE 86 11.541 -4.542 -12.545 688 HA ILE 86 HA ILE 86 12.662 -2.946 -14.704 689 HB ILE 86 HB ILE 86 10.417 -2.338 -12.768 690 HG12 ILE 86 2HG1 ILE 86 10.351 -3.051 -15.709 691 HG13 ILE 86 1HG1 ILE 86 9.854 -4.098 -14.389 692 HG21 ILE 86 1HG2 ILE 86 9.972 -0.401 -14.198 693 HG22 ILE 86 2HG2 ILE 86 11.400 -0.786 -15.158 694 HG23 ILE 86 3HG2 ILE 86 11.572 -0.310 -13.469 695 HD11 ILE 86 1HD1 ILE 86 8.584 -1.490 -15.154 696 HD12 ILE 86 2HD1 ILE 86 8.062 -2.541 -13.836 697 HD13 ILE 86 3HD1 ILE 86 7.943 -3.098 -15.511 698 H ASP 87 H ASP 87 14.076 -1.383 -14.292 699 HA ASP 87 HA ASP 87 14.821 -0.856 -11.512 700 HB2 ASP 87 2HB ASP 87 16.671 -1.580 -12.949 701 HB3 ASP 87 1HB ASP 87 16.319 -0.273 -14.076 702 H ILE 88 H ILE 88 14.160 0.966 -10.649 703 HA ILE 88 HA ILE 88 13.153 3.084 -12.443 704 HB ILE 88 HB ILE 88 12.327 2.499 -9.573 705 HG12 ILE 88 2HG1 ILE 88 10.875 1.885 -12.151 706 HG13 ILE 88 1HG1 ILE 88 11.658 0.697 -11.117 707 HG21 ILE 88 1HG2 ILE 88 10.476 4.046 -10.018 708 HG22 ILE 88 2HG2 ILE 88 11.128 4.358 -11.627 709 HG23 ILE 88 3HG2 ILE 88 12.037 4.843 -10.196 710 HD11 ILE 88 1HD1 ILE 88 9.337 2.437 -10.367 711 HD12 ILE 88 2HD1 ILE 88 10.089 1.227 -9.325 712 HD13 ILE 88 3HD1 ILE 88 9.265 0.726 -10.804 713 H LYS 89 H LYS 89 13.821 5.214 -12.019 714 HA LYS 89 HA LYS 89 16.020 5.444 -10.085 715 HB2 LYS 89 2HB LYS 89 15.305 7.337 -12.336 716 HB3 LYS 89 1HB LYS 89 16.707 7.442 -11.296 717 HG2 LYS 89 2HG LYS 89 16.144 5.328 -13.363 718 HG3 LYS 89 1HG LYS 89 17.364 6.596 -13.445 719 HD2 LYS 89 2HD LYS 89 18.457 5.579 -11.453 720 HD3 LYS 89 1HD LYS 89 17.275 4.270 -11.525 721 HE2 LYS 89 2HE LYS 89 18.032 3.824 -13.865 722 HE3 LYS 89 1HE LYS 89 19.321 4.999 -13.610 723 HZ1 LYS 89 1HZ LYS 89 18.893 2.435 -12.218 724 HZ2 LYS 89 2HZ LYS 89 20.049 3.573 -11.692 725 HZ3 LYS 89 3HZ LYS 89 20.183 2.873 -13.206 726 H1 MET 1 H MET 1 -12.999 20.109 20.291 727 HA MET 1 HA MET 1 -10.558 19.205 21.172 728 HB2 MET 1 2HB MET 1 -12.711 19.162 23.291 729 HB3 MET 1 1HB MET 1 -11.245 18.194 23.347 730 HG2 MET 1 2HG MET 1 -9.911 20.238 23.372 731 HG3 MET 1 1HG MET 1 -11.385 21.197 23.338 732 HE1 MET 1 1HE MET 1 -10.838 17.825 25.363 733 HE2 MET 1 2HE MET 1 -10.182 18.454 26.877 734 HE3 MET 1 3HE MET 1 -9.259 18.608 25.384 735 H GLY 2 H GLY 2 -10.608 16.840 21.534 736 HA2 GLY 2 2HA GLY 2 -11.743 14.756 21.362 737 HA3 GLY 2 1HA GLY 2 -13.025 15.564 20.468 738 H PHE 3 H PHE 3 -11.339 13.196 19.839 739 HA PHE 3 HA PHE 3 -9.861 14.134 17.526 740 HB2 PHE 3 2HB PHE 3 -8.907 12.388 19.091 741 HB3 PHE 3 1HB PHE 3 -10.214 11.320 18.612 742 HD1 PHE 3 1HD PHE 3 -10.155 10.171 16.499 743 HD2 PHE 3 2HD PHE 3 -7.123 12.973 17.526 744 HE1 PHE 3 1HE PHE 3 -8.766 9.355 14.640 745 HE2 PHE 3 2HE PHE 3 -5.734 12.161 15.674 746 HZ PHE 3 HZ PHE 3 -6.554 10.349 14.226 747 H THR 4 H THR 4 -10.643 13.800 15.458 748 HA THR 4 HA THR 4 -13.318 12.691 15.395 749 HB THR 4 HB THR 4 -13.201 14.997 14.553 750 HG1 THR 4 1HG THR 4 -14.751 14.111 13.483 751 HG21 THR 4 1HG2 THR 4 -11.303 13.915 12.455 752 HG22 THR 4 2HG2 THR 4 -10.911 15.072 13.726 753 HG23 THR 4 3HG2 THR 4 -12.027 15.529 12.444 754 H ASP 5 H ASP 5 -13.741 10.891 14.383 755 HA ASP 5 HA ASP 5 -11.968 9.931 12.356 756 HB2 ASP 5 2HB ASP 5 -11.650 7.686 13.352 757 HB3 ASP 5 1HB ASP 5 -10.927 8.945 14.330 758 H GLU 6 H GLU 6 -13.541 10.240 10.950 759 HA GLU 6 HA GLU 6 -15.835 8.445 11.235 760 HB2 GLU 6 2HB GLU 6 -16.261 10.991 11.287 761 HB3 GLU 6 1HB GLU 6 -15.721 11.018 9.625 762 HG2 GLU 6 2HG GLU 6 -18.106 9.465 10.626 763 HG3 GLU 6 1HG GLU 6 -18.185 11.065 9.919 764 H THR 7 H THR 7 -15.071 6.732 10.153 765 HA THR 7 HA THR 7 -14.539 7.041 7.373 766 HB THR 7 HB THR 7 -12.317 7.466 8.186 767 HG1 THR 7 1HG THR 7 -11.287 6.162 6.963 768 HG21 THR 7 1HG2 THR 7 -12.484 4.878 9.749 769 HG22 THR 7 2HG2 THR 7 -12.468 6.507 10.426 770 HG23 THR 7 3HG2 THR 7 -11.044 5.890 9.594 771 H VAL 8 H VAL 8 -16.048 5.761 6.707 772 HA VAL 8 HA VAL 8 -16.225 3.046 7.798 773 HB VAL 8 HB VAL 8 -18.438 4.721 6.576 774 HG11 VAL 8 1HG1 VAL 8 -19.940 2.920 7.250 775 HG12 VAL 8 2HG1 VAL 8 -18.566 1.974 7.813 776 HG13 VAL 8 3HG1 VAL 8 -18.735 2.351 6.098 777 HG21 VAL 8 1HG2 VAL 8 -19.425 4.724 8.824 778 HG22 VAL 8 2HG2 VAL 8 -17.847 5.512 8.800 779 HG23 VAL 8 3HG2 VAL 8 -18.004 3.876 9.441 780 H ARG 9 H ARG 9 -15.155 1.812 6.369 781 HA ARG 9 HA ARG 9 -16.077 1.852 3.592 782 HB2 ARG 9 2HB ARG 9 -13.771 2.974 3.999 783 HB3 ARG 9 1HB ARG 9 -13.190 1.377 4.371 784 HG2 ARG 9 2HG ARG 9 -14.292 2.292 1.695 785 HG3 ARG 9 1HG ARG 9 -12.604 2.015 2.074 786 HD2 ARG 9 2HD ARG 9 -13.147 -0.388 2.440 787 HD3 ARG 9 1HD ARG 9 -14.801 -0.069 1.934 788 HE ARG 9 HE ARG 9 -12.409 0.161 0.218 789 HH11 ARG 9 1HH1 ARG 9 -15.919 -0.196 0.458 790 HH12 ARG 9 2HH1 ARG 9 -16.115 -0.639 -1.175 791 HH21 ARG 9 1HH2 ARG 9 -12.670 -0.441 -1.968 792 HH22 ARG 9 2HH2 ARG 9 -14.215 -0.784 -2.605 793 H PHE 10 H PHE 10 -17.198 -0.043 3.765 794 HA PHE 10 HA PHE 10 -15.616 -2.265 4.667 795 HB2 PHE 10 2HB PHE 10 -18.502 -1.803 5.445 796 HB3 PHE 10 1HB PHE 10 -17.702 -3.354 5.636 797 HD1 PHE 10 1HD PHE 10 -18.018 0.047 6.901 798 HD2 PHE 10 2HD PHE 10 -15.929 -3.636 7.299 799 HE1 PHE 10 1HE PHE 10 -17.177 0.765 9.102 800 HE2 PHE 10 2HE PHE 10 -15.088 -2.929 9.500 801 HZ PHE 10 HZ PHE 10 -15.713 -0.723 10.404 802 H ASP 11 H ASP 11 -15.191 -3.112 2.746 803 HA ASP 11 HA ASP 11 -16.997 -4.862 1.545 804 HB2 ASP 11 2HB ASP 11 -17.957 -2.969 0.365 805 HB3 ASP 11 1HB ASP 11 -16.355 -2.401 -0.112 806 H PHE 12 H PHE 12 -15.683 -6.456 1.231 807 HA PHE 12 HA PHE 12 -13.018 -5.794 0.248 808 HB2 PHE 12 2HB PHE 12 -13.038 -6.620 2.583 809 HB3 PHE 12 1HB PHE 12 -13.802 -8.107 2.024 810 HD1 PHE 12 1HD PHE 12 -10.750 -6.104 1.987 811 HD2 PHE 12 2HD PHE 12 -12.534 -9.802 0.907 812 HE1 PHE 12 1HE PHE 12 -8.536 -7.033 1.522 813 HE2 PHE 12 2HE PHE 12 -10.313 -10.743 0.440 814 HZ PHE 12 HZ PHE 12 -8.314 -9.344 0.748 815 H ASP 13 H ASP 13 -12.352 -6.784 -1.532 816 HA ASP 13 HA ASP 13 -14.035 -8.894 -2.686 817 HB2 ASP 13 2HB ASP 13 -13.811 -6.810 -4.052 818 HB3 ASP 13 1HB ASP 13 -12.065 -7.021 -4.045 819 H ASP 14 H ASP 14 -13.135 -10.844 -2.409 820 HA ASP 14 HA ASP 14 -10.394 -11.229 -1.725 821 HB2 ASP 14 2HB ASP 14 -12.057 -12.898 -1.056 822 HB3 ASP 14 1HB ASP 14 -12.466 -13.200 -2.740 823 H ASN 15 H ASN 15 -9.144 -10.266 -3.246 824 HA ASN 15 HA ASN 15 -9.566 -11.182 -5.979 825 HB2 ASN 15 2HB ASN 15 -9.525 -8.689 -5.401 826 HB3 ASN 15 1HB ASN 15 -7.790 -8.900 -5.170 827 HD21 ASN 15 1HD2 ASN 15 -10.367 -8.822 -7.398 828 HD22 ASN 15 2HD2 ASN 15 -9.439 -8.799 -8.859 829 H ARG 16 H ARG 16 -8.372 -12.766 -6.538 830 HA ARG 16 HA ARG 16 -5.605 -12.852 -5.601 831 HB2 ARG 16 2HB ARG 16 -5.779 -15.326 -5.641 832 HB3 ARG 16 1HB ARG 16 -6.816 -14.575 -4.444 833 HG2 ARG 16 2HG ARG 16 -8.711 -14.848 -6.043 834 HG3 ARG 16 1HG ARG 16 -7.627 -15.784 -7.077 835 HD2 ARG 16 2HD ARG 16 -8.928 -17.279 -5.645 836 HD3 ARG 16 1HD ARG 16 -7.212 -17.327 -5.222 837 HE ARG 16 HE ARG 16 -8.981 -15.543 -3.725 838 HH11 ARG 16 1HH1 ARG 16 -7.113 -18.562 -3.733 839 HH12 ARG 16 2HH1 ARG 16 -7.055 -18.681 -2.033 840 HH21 ARG 16 1HH2 ARG 16 -8.878 -15.685 -1.440 841 HH22 ARG 16 2HH2 ARG 16 -8.063 -16.994 -0.690 842 H LYS 17 H LYS 17 -6.893 -11.701 -7.900 843 HA LYS 17 HA LYS 17 -5.976 -13.265 -10.184 844 HB2 LYS 17 2HB LYS 17 -7.028 -10.429 -10.089 845 HB3 LYS 17 1HB LYS 17 -6.850 -11.437 -11.507 846 HG2 LYS 17 2HG LYS 17 -8.812 -11.853 -9.262 847 HG3 LYS 17 1HG LYS 17 -9.176 -11.162 -10.837 848 HD2 LYS 17 2HD LYS 17 -8.479 -13.321 -11.874 849 HD3 LYS 17 1HD LYS 17 -8.288 -13.987 -10.249 850 HE2 LYS 17 2HE LYS 17 -10.665 -13.487 -9.780 851 HE3 LYS 17 1HE LYS 17 -10.819 -12.846 -11.408 852 HZ1 LYS 17 1HZ LYS 17 -11.654 -15.064 -11.336 853 HZ2 LYS 17 2HZ LYS 17 -10.216 -15.660 -10.689 854 HZ3 LYS 17 3HZ LYS 17 -10.257 -15.045 -12.252 855 H LYS 18 H LYS 18 -4.055 -12.713 -11.240 856 HA LYS 18 HA LYS 18 -2.448 -10.661 -9.921 857 HB2 LYS 18 2HB LYS 18 -1.646 -12.751 -11.954 858 HB3 LYS 18 1HB LYS 18 -0.554 -11.589 -11.221 859 HG2 LYS 18 2HG LYS 18 -1.055 -12.548 -9.009 860 HG3 LYS 18 1HG LYS 18 -2.069 -13.757 -9.795 861 HD2 LYS 18 2HD LYS 18 -0.137 -14.542 -11.072 862 HD3 LYS 18 1HD LYS 18 0.878 -13.343 -10.274 863 HE2 LYS 18 2HE LYS 18 0.373 -14.382 -8.098 864 HE3 LYS 18 1HE LYS 18 -0.618 -15.581 -8.925 865 HZ1 LYS 18 1HZ LYS 18 1.396 -16.288 -10.135 866 HZ2 LYS 18 2HZ LYS 18 1.569 -16.472 -8.463 867 HZ3 LYS 18 3HZ LYS 18 2.301 -15.190 -9.232 868 H ALA 19 H ALA 19 -4.690 -10.230 -11.667 869 HA ALA 19 HA ALA 19 -3.957 -9.147 -14.156 870 HB1 ALA 19 1HB ALA 19 -6.070 -7.946 -13.995 871 HB2 ALA 19 2HB ALA 19 -6.120 -8.357 -12.277 872 HB3 ALA 19 3HB ALA 19 -6.262 -9.645 -13.490 873 H ILE 20 H ILE 20 -4.103 -7.898 -10.886 874 HA ILE 20 HA ILE 20 -3.738 -5.164 -11.309 875 HB ILE 20 HB ILE 20 -2.647 -6.858 -9.043 876 HG12 ILE 20 2HG1 ILE 20 -5.329 -5.471 -9.276 877 HG13 ILE 20 1HG1 ILE 20 -5.058 -7.203 -9.409 878 HG21 ILE 20 1HG2 ILE 20 -1.700 -4.612 -9.102 879 HG22 ILE 20 2HG2 ILE 20 -2.788 -4.794 -7.724 880 HG23 ILE 20 3HG2 ILE 20 -3.321 -3.920 -9.163 881 HD11 ILE 20 1HD1 ILE 20 -5.910 -6.639 -7.227 882 HD12 ILE 20 2HD1 ILE 20 -4.585 -5.506 -6.977 883 HD13 ILE 20 3HD1 ILE 20 -4.255 -7.238 -7.094 884 H SER 21 H SER 21 -1.566 -7.839 -11.126 885 HA SER 21 HA SER 21 0.879 -6.445 -11.021 886 HB2 SER 21 2HB SER 21 0.322 -9.206 -12.120 887 HB3 SER 21 1HB SER 21 1.895 -8.594 -11.615 888 HG SER 21 HG SER 21 0.208 -8.236 -9.560 889 H GLU 22 H GLU 22 -1.033 -7.741 -13.699 890 HA GLU 22 HA GLU 22 0.774 -7.033 -15.773 891 HB2 GLU 22 2HB GLU 22 -2.215 -7.461 -15.891 892 HB3 GLU 22 1HB GLU 22 -1.138 -7.414 -17.277 893 HG2 GLU 22 2HG GLU 22 -1.161 -9.458 -15.077 894 HG3 GLU 22 1HG GLU 22 -1.733 -9.682 -16.728 895 H THR 23 H THR 23 -2.026 -5.531 -14.307 896 HA THR 23 HA THR 23 -2.396 -3.312 -15.921 897 HB THR 23 HB THR 23 -2.745 -3.595 -12.925 898 HG1 THR 23 1HG THR 23 -4.019 -4.754 -14.905 899 HG21 THR 23 1HG2 THR 23 -4.342 -1.752 -13.095 900 HG22 THR 23 2HG2 THR 23 -3.955 -1.555 -14.806 901 HG23 THR 23 3HG2 THR 23 -2.726 -1.237 -13.578 902 H LEU 24 H LEU 24 -0.411 -3.587 -12.972 903 HA LEU 24 HA LEU 24 0.512 -0.905 -13.135 904 HB2 LEU 24 2HB LEU 24 1.492 -3.213 -11.488 905 HB3 LEU 24 1HB LEU 24 1.980 -1.540 -11.272 906 HG LEU 24 HG LEU 24 -0.828 -2.592 -10.927 907 HD11 LEU 24 1HD1 LEU 24 0.637 -3.380 -9.194 908 HD12 LEU 24 2HD1 LEU 24 -0.444 -2.139 -8.557 909 HD13 LEU 24 3HD1 LEU 24 1.238 -1.743 -8.933 910 HD21 LEU 24 1HD2 LEU 24 -0.824 -0.269 -11.680 911 HD22 LEU 24 2HD2 LEU 24 0.341 0.147 -10.426 912 HD23 LEU 24 3HD2 LEU 24 -1.285 -0.365 -9.980 913 H GLU 25 H GLU 25 1.837 -3.983 -14.150 914 HA GLU 25 HA GLU 25 4.446 -3.197 -14.753 915 HB2 GLU 25 2HB GLU 25 3.652 -5.534 -14.732 916 HB3 GLU 25 1HB GLU 25 2.637 -5.208 -16.122 917 HG2 GLU 25 2HG GLU 25 4.634 -4.832 -17.482 918 HG3 GLU 25 1HG GLU 25 5.646 -5.168 -16.075 919 H THR 26 H THR 26 1.422 -2.972 -16.484 920 HA THR 26 HA THR 26 2.447 -1.988 -18.934 921 HB THR 26 HB THR 26 -0.349 -1.914 -17.780 922 HG1 THR 26 1HG THR 26 0.308 -3.991 -18.022 923 HG21 THR 26 1HG2 THR 26 -0.034 -0.298 -19.585 924 HG22 THR 26 2HG2 THR 26 -1.110 -1.611 -20.080 925 HG23 THR 26 3HG2 THR 26 0.565 -1.576 -20.648 926 H VAL 27 H VAL 27 0.693 -0.458 -16.223 927 HA VAL 27 HA VAL 27 0.577 2.150 -17.178 928 HB VAL 27 HB VAL 27 0.777 1.294 -14.271 929 HG11 VAL 27 1HG1 VAL 27 1.274 3.674 -14.531 930 HG12 VAL 27 2HG1 VAL 27 -0.290 3.435 -13.749 931 HG13 VAL 27 3HG1 VAL 27 -0.214 3.892 -15.452 932 HG21 VAL 27 1HG2 VAL 27 -1.639 1.873 -15.988 933 HG22 VAL 27 2HG2 VAL 27 -1.649 1.478 -14.268 934 HG23 VAL 27 3HG2 VAL 27 -1.110 0.279 -15.441 935 H TYR 28 H TYR 28 3.196 0.720 -15.291 936 HA TYR 28 HA TYR 28 4.633 3.090 -14.869 937 HB2 TYR 28 2HB TYR 28 5.257 1.086 -13.653 938 HB3 TYR 28 1HB TYR 28 5.708 0.269 -15.143 939 HD1 TYR 28 1HD TYR 28 7.845 0.614 -16.140 940 HD2 TYR 28 2HD TYR 28 6.683 2.995 -12.822 941 HE1 TYR 28 1HE TYR 28 10.123 1.485 -15.975 942 HE2 TYR 28 2HE TYR 28 8.989 3.870 -12.648 943 HH TYR 28 HH TYR 28 11.251 3.341 -15.161 944 H ARG 29 H ARG 29 4.891 0.792 -17.510 945 HA ARG 29 HA ARG 29 7.040 2.092 -18.824 946 HB2 ARG 29 2HB ARG 29 5.035 0.108 -19.907 947 HB3 ARG 29 1HB ARG 29 6.538 0.574 -20.693 948 HG2 ARG 29 2HG ARG 29 7.814 -0.329 -18.822 949 HG3 ARG 29 1HG ARG 29 6.315 -0.784 -18.017 950 HD2 ARG 29 2HD ARG 29 7.281 -1.822 -20.677 951 HD3 ARG 29 1HD ARG 29 7.362 -2.693 -19.146 952 HE ARG 29 HE ARG 29 4.726 -1.827 -19.913 953 HH11 ARG 29 1HH1 ARG 29 7.089 -4.436 -20.164 954 HH12 ARG 29 2HH1 ARG 29 5.945 -5.650 -20.500 955 HH21 ARG 29 1HH2 ARG 29 3.160 -3.445 -20.404 956 HH22 ARG 29 2HH2 ARG 29 3.616 -5.070 -20.648 957 H ALA 30 H ALA 30 3.608 2.481 -18.953 958 HA ALA 30 HA ALA 30 3.457 3.883 -21.387 959 HB1 ALA 30 1HB ALA 30 1.661 4.142 -18.980 960 HB2 ALA 30 2HB ALA 30 1.485 2.949 -20.267 961 HB3 ALA 30 3HB ALA 30 1.281 4.665 -20.621 962 H LEU 31 H LEU 31 3.982 5.015 -18.055 963 HA LEU 31 HA LEU 31 4.006 7.702 -18.970 964 HB2 LEU 31 2HB LEU 31 4.751 6.665 -16.265 965 HB3 LEU 31 1HB LEU 31 4.887 8.356 -16.701 966 HG LEU 31 HG LEU 31 2.387 7.973 -17.372 967 HD11 LEU 31 1HD1 LEU 31 2.270 5.632 -16.799 968 HD12 LEU 31 2HD1 LEU 31 1.215 6.601 -15.748 969 HD13 LEU 31 3HD1 LEU 31 2.762 6.027 -15.143 970 HD21 LEU 31 1HD2 LEU 31 3.080 9.668 -15.922 971 HD22 LEU 31 2HD2 LEU 31 3.382 8.535 -14.606 972 HD23 LEU 31 3HD2 LEU 31 1.739 8.811 -15.181 973 H GLU 32 H GLU 32 6.491 5.363 -18.607 974 HA GLU 32 HA GLU 32 8.721 7.069 -18.581 975 HB2 GLU 32 2HB GLU 32 8.430 4.442 -20.033 976 HB3 GLU 32 1HB GLU 32 9.943 5.268 -19.719 977 HG2 GLU 32 2HG GLU 32 9.532 4.998 -17.306 978 HG3 GLU 32 1HG GLU 32 8.081 4.067 -17.700 979 H GLU 33 H GLU 33 6.930 5.696 -21.267 980 HA GLU 33 HA GLU 33 8.397 6.968 -23.301 981 HB2 GLU 33 2HB GLU 33 5.611 5.834 -23.352 982 HB3 GLU 33 1HB GLU 33 6.489 6.368 -24.776 983 HG2 GLU 33 2HG GLU 33 7.310 4.143 -22.918 984 HG3 GLU 33 1HG GLU 33 6.628 3.959 -24.535 985 H LYS 34 H LYS 34 5.856 8.096 -21.305 986 HA LYS 34 HA LYS 34 5.294 10.396 -23.018 987 HB2 LYS 34 2HB LYS 34 4.188 9.606 -20.332 988 HB3 LYS 34 1HB LYS 34 3.692 11.043 -21.209 989 HG2 LYS 34 2HG LYS 34 3.391 8.213 -22.191 990 HG3 LYS 34 1HG LYS 34 2.117 9.162 -21.426 991 HD2 LYS 34 2HD LYS 34 3.507 9.911 -24.024 992 HD3 LYS 34 1HD LYS 34 1.941 9.120 -23.895 993 HE2 LYS 34 2HE LYS 34 1.054 10.965 -22.713 994 HE3 LYS 34 1HE LYS 34 2.626 11.803 -22.784 995 HZ1 LYS 34 1HZ LYS 34 2.406 11.782 -25.224 996 HZ2 LYS 34 2HZ LYS 34 1.151 12.628 -24.500 997 HZ3 LYS 34 3HZ LYS 34 0.873 11.091 -25.094 998 H GLY 35 H GLY 35 7.534 9.608 -20.660 999 HA2 GLY 35 2HA GLY 35 9.251 10.887 -19.854 1000 HA3 GLY 35 1HA GLY 35 8.541 12.283 -20.647 1001 H TYR 36 H TYR 36 6.618 10.430 -18.456 1002 HA TYR 36 HA TYR 36 6.730 12.695 -16.581 1003 HB2 TYR 36 2HB TYR 36 4.633 10.555 -16.907 1004 HB3 TYR 36 1HB TYR 36 4.594 11.767 -15.637 1005 HD1 TYR 36 1HD TYR 36 3.336 10.888 -18.729 1006 HD2 TYR 36 2HD TYR 36 4.792 14.278 -16.631 1007 HE1 TYR 36 1HE TYR 36 2.070 12.355 -20.239 1008 HE2 TYR 36 2HE TYR 36 3.527 15.762 -18.135 1009 HH TYR 36 HH TYR 36 2.590 15.661 -20.441 1010 H ASN 37 H ASN 37 5.955 11.772 -14.265 1011 HA ASN 37 HA ASN 37 7.972 9.787 -13.519 1012 HB2 ASN 37 2HB ASN 37 6.454 11.817 -11.842 1013 HB3 ASN 37 1HB ASN 37 7.591 10.664 -11.176 1014 HD21 ASN 37 1HD2 ASN 37 7.640 13.568 -11.078 1015 HD22 ASN 37 2HD2 ASN 37 9.117 14.045 -11.814 1016 HA PRO 38 HA PRO 38 4.266 7.108 -13.674 1017 HB2 PRO 38 2HB PRO 38 6.270 5.147 -12.776 1018 HB3 PRO 38 1HB PRO 38 5.127 5.063 -14.120 1019 HG2 PRO 38 2HG PRO 38 7.764 5.491 -14.475 1020 HG3 PRO 38 1HG PRO 38 6.548 6.167 -15.559 1021 HD2 PRO 38 2HD PRO 38 8.206 7.518 -13.511 1022 HD3 PRO 38 1HD PRO 38 7.425 8.146 -14.987 1023 H ILE 39 H ILE 39 6.639 7.023 -11.000 1024 HA ILE 39 HA ILE 39 4.870 5.590 -9.288 1025 HB ILE 39 HB ILE 39 7.285 7.264 -8.456 1026 HG12 ILE 39 2HG1 ILE 39 7.935 5.516 -10.038 1027 HG13 ILE 39 1HG1 ILE 39 8.498 5.118 -8.420 1028 HG21 ILE 39 1HG2 ILE 39 5.785 6.843 -6.603 1029 HG22 ILE 39 2HG2 ILE 39 7.293 5.955 -6.423 1030 HG23 ILE 39 3HG2 ILE 39 5.829 5.111 -6.942 1031 HD11 ILE 39 1HD1 ILE 39 7.645 3.156 -9.524 1032 HD12 ILE 39 2HD1 ILE 39 6.102 3.956 -9.818 1033 HD13 ILE 39 3HD1 ILE 39 6.596 3.589 -8.171 1034 H ASN 40 H ASN 40 5.648 9.028 -9.714 1035 HA ASN 40 HA ASN 40 4.251 9.974 -7.556 1036 HB2 ASN 40 2HB ASN 40 5.912 11.316 -8.494 1037 HB3 ASN 40 1HB ASN 40 5.314 11.064 -10.125 1038 HD21 ASN 40 1HD2 ASN 40 3.748 12.318 -10.906 1039 HD22 ASN 40 2HD2 ASN 40 3.141 13.670 -10.057 1040 H GLN 41 H GLN 41 3.281 9.255 -10.901 1041 HA GLN 41 HA GLN 41 0.759 10.493 -10.543 1042 HB2 GLN 41 2HB GLN 41 1.730 8.596 -12.666 1043 HB3 GLN 41 1HB GLN 41 0.229 9.513 -12.737 1044 HG2 GLN 41 2HG GLN 41 3.001 10.700 -12.613 1045 HG3 GLN 41 1HG GLN 41 2.019 10.558 -14.061 1046 HE21 GLN 41 1HE2 GLN 41 -0.426 11.284 -12.741 1047 HE22 GLN 41 2HE2 GLN 41 -0.328 12.978 -12.405 1048 H ILE 42 H ILE 42 1.969 7.172 -10.302 1049 HA ILE 42 HA ILE 42 -0.597 6.012 -10.016 1050 HB ILE 42 HB ILE 42 2.088 4.906 -9.121 1051 HG12 ILE 42 2HG1 ILE 42 0.419 4.304 -11.580 1052 HG13 ILE 42 1HG1 ILE 42 1.877 5.285 -11.562 1053 HG21 ILE 42 1HG2 ILE 42 0.265 3.840 -7.878 1054 HG22 ILE 42 2HG2 ILE 42 0.945 2.706 -9.043 1055 HG23 ILE 42 3HG2 ILE 42 -0.595 3.511 -9.369 1056 HD11 ILE 42 1HD1 ILE 42 3.177 3.320 -10.883 1057 HD12 ILE 42 2HD1 ILE 42 2.319 3.045 -12.399 1058 HD13 ILE 42 3HD1 ILE 42 1.706 2.347 -10.901 1059 H VAL 43 H VAL 43 1.840 6.943 -7.544 1060 HA VAL 43 HA VAL 43 0.265 6.146 -5.368 1061 HB VAL 43 HB VAL 43 2.647 6.655 -5.010 1062 HG11 VAL 43 1HG1 VAL 43 2.919 8.531 -6.534 1063 HG12 VAL 43 2HG1 VAL 43 3.474 8.985 -4.918 1064 HG13 VAL 43 3HG1 VAL 43 1.906 9.539 -5.507 1065 HG21 VAL 43 1HG2 VAL 43 0.886 8.498 -3.397 1066 HG22 VAL 43 2HG2 VAL 43 2.512 7.985 -2.944 1067 HG23 VAL 43 3HG2 VAL 43 1.212 6.799 -3.060 1068 H GLY 44 H GLY 44 0.317 9.167 -7.142 1069 HA2 GLY 44 2HA GLY 44 -1.518 10.585 -5.520 1070 HA3 GLY 44 1HA GLY 44 -1.188 10.912 -7.219 1071 H TYR 45 H TYR 45 -1.941 8.405 -8.266 1072 HA TYR 45 HA TYR 45 -4.663 8.781 -8.651 1073 HB2 TYR 45 2HB TYR 45 -3.446 7.607 -10.346 1074 HB3 TYR 45 1HB TYR 45 -2.932 6.369 -9.206 1075 HD1 TYR 45 1HD TYR 45 -4.239 4.438 -8.860 1076 HD2 TYR 45 2HD TYR 45 -5.951 7.756 -10.891 1077 HE1 TYR 45 1HE TYR 45 -6.202 3.093 -9.377 1078 HE2 TYR 45 2HE TYR 45 -7.918 6.398 -11.427 1079 HH TYR 45 HH TYR 45 -8.415 3.355 -9.934 1080 H LEU 46 H LEU 46 -3.057 6.293 -6.680 1081 HA LEU 46 HA LEU 46 -5.585 5.317 -5.881 1082 HB2 LEU 46 2HB LEU 46 -2.903 4.711 -4.696 1083 HB3 LEU 46 1HB LEU 46 -4.375 3.964 -4.113 1084 HG LEU 46 HG LEU 46 -4.630 3.119 -6.573 1085 HD11 LEU 46 1HD1 LEU 46 -2.652 2.826 -7.841 1086 HD12 LEU 46 2HD1 LEU 46 -1.708 3.666 -6.607 1087 HD13 LEU 46 3HD1 LEU 46 -2.912 4.550 -7.502 1088 HD21 LEU 46 1HD2 LEU 46 -3.240 1.170 -6.113 1089 HD22 LEU 46 2HD2 LEU 46 -4.207 1.653 -4.725 1090 HD23 LEU 46 3HD2 LEU 46 -2.483 2.034 -4.769 1091 H LEU 47 H LEU 47 -3.482 7.681 -4.434 1092 HA LEU 47 HA LEU 47 -4.931 7.749 -2.001 1093 HB2 LEU 47 2HB LEU 47 -3.191 9.859 -3.270 1094 HB3 LEU 47 1HB LEU 47 -3.847 9.963 -1.651 1095 HG LEU 47 HG LEU 47 -1.861 7.904 -2.623 1096 HD11 LEU 47 1HD1 LEU 47 -0.890 10.123 -2.392 1097 HD12 LEU 47 2HD1 LEU 47 -0.299 9.039 -1.134 1098 HD13 LEU 47 3HD1 LEU 47 -1.530 10.242 -0.753 1099 HD21 LEU 47 1HD2 LEU 47 -3.337 6.971 -0.910 1100 HD22 LEU 47 2HD2 LEU 47 -3.018 8.354 0.135 1101 HD23 LEU 47 3HD2 LEU 47 -1.718 7.233 -0.266 1102 H SER 48 H SER 48 -5.264 9.587 -5.024 1103 HA SER 48 HA SER 48 -7.428 11.108 -3.798 1104 HB2 SER 48 2HB SER 48 -5.730 12.340 -5.043 1105 HB3 SER 48 1HB SER 48 -6.100 11.399 -6.482 1106 HG SER 48 HG SER 48 -8.344 12.515 -5.499 1107 H GLY 49 H GLY 49 -7.087 8.450 -6.116 1108 HA2 GLY 49 2HA GLY 49 -8.708 7.178 -7.090 1109 HA3 GLY 49 1HA GLY 49 -9.917 8.083 -6.182 1110 H ASP 50 H ASP 50 -7.512 9.301 -8.446 1111 HA ASP 50 HA ASP 50 -9.693 10.301 -10.133 1112 HB2 ASP 50 2HB ASP 50 -8.763 12.147 -8.900 1113 HB3 ASP 50 1HB ASP 50 -7.129 11.687 -9.352 1114 HA PRO 51 HA PRO 51 -7.518 7.750 -13.111 1115 HB2 PRO 51 2HB PRO 51 -9.365 8.855 -15.101 1116 HB3 PRO 51 1HB PRO 51 -9.172 7.191 -14.544 1117 HG2 PRO 51 2HG PRO 51 -11.328 8.711 -13.910 1118 HG3 PRO 51 1HG PRO 51 -10.711 7.423 -12.868 1119 HD2 PRO 51 2HD PRO 51 -10.412 10.378 -12.614 1120 HD3 PRO 51 1HD PRO 51 -10.599 9.129 -11.361 1121 H ALA 52 H ALA 52 -8.032 11.185 -13.418 1122 HA ALA 52 HA ALA 52 -6.684 11.594 -15.855 1123 HB1 ALA 52 1HB ALA 52 -6.651 13.956 -15.275 1124 HB2 ALA 52 2HB ALA 52 -7.060 13.565 -13.605 1125 HB3 ALA 52 3HB ALA 52 -8.222 13.248 -14.892 1126 H TYR 53 H TYR 53 -5.443 10.753 -12.838 1127 HA TYR 53 HA TYR 53 -2.914 11.963 -13.020 1128 HB2 TYR 53 2HB TYR 53 -3.918 9.600 -11.505 1129 HB3 TYR 53 1HB TYR 53 -2.193 9.952 -11.559 1130 HD1 TYR 53 1HD TYR 53 -1.501 12.321 -10.968 1131 HD2 TYR 53 2HD TYR 53 -5.253 10.668 -9.898 1132 HE1 TYR 53 1HE TYR 53 -1.682 13.961 -9.229 1133 HE2 TYR 53 2HE TYR 53 -5.469 12.342 -8.100 1134 HH TYR 53 HH TYR 53 -3.507 15.057 -7.899 1135 H ILE 54 H ILE 54 -4.249 9.256 -14.754 1136 HA ILE 54 HA ILE 54 -1.530 8.572 -15.631 1137 HB ILE 54 HB ILE 54 -4.022 6.828 -15.911 1138 HG12 ILE 54 2HG1 ILE 54 -3.375 7.043 -13.535 1139 HG13 ILE 54 1HG1 ILE 54 -3.025 5.433 -14.147 1140 HG21 ILE 54 1HG2 ILE 54 -2.475 5.060 -16.526 1141 HG22 ILE 54 2HG2 ILE 54 -1.130 6.199 -16.440 1142 HG23 ILE 54 3HG2 ILE 54 -2.391 6.417 -17.651 1143 HD11 ILE 54 1HD1 ILE 54 -1.258 6.244 -12.691 1144 HD12 ILE 54 2HD1 ILE 54 -1.012 7.640 -13.736 1145 HD13 ILE 54 3HD1 ILE 54 -0.663 6.016 -14.334 1146 HA PRO 55 HA PRO 55 -2.940 10.468 -19.462 1147 HB2 PRO 55 2HB PRO 55 -0.536 10.454 -20.708 1148 HB3 PRO 55 1HB PRO 55 -0.929 11.640 -19.459 1149 HG2 PRO 55 2HG PRO 55 0.697 9.142 -19.256 1150 HG3 PRO 55 1HG PRO 55 0.981 10.726 -18.517 1151 HD2 PRO 55 2HD PRO 55 -0.106 8.587 -17.195 1152 HD3 PRO 55 1HD PRO 55 -0.409 10.277 -16.745 1153 H ARG 56 H ARG 56 -3.646 9.521 -21.356 1154 HA ARG 56 HA ARG 56 -3.093 6.706 -21.489 1155 HB2 ARG 56 2HB ARG 56 -4.910 6.475 -23.132 1156 HB3 ARG 56 1HB ARG 56 -5.438 7.234 -21.647 1157 HG2 ARG 56 2HG ARG 56 -5.479 9.401 -22.728 1158 HG3 ARG 56 1HG ARG 56 -4.817 8.701 -24.206 1159 HD2 ARG 56 2HD ARG 56 -7.490 8.038 -22.955 1160 HD3 ARG 56 1HD ARG 56 -7.222 9.001 -24.411 1161 HE ARG 56 HE ARG 56 -6.241 6.246 -24.368 1162 HH11 ARG 56 1HH1 ARG 56 -8.626 8.523 -25.611 1163 HH12 ARG 56 2HH1 ARG 56 -9.179 7.476 -26.853 1164 HH21 ARG 56 1HH2 ARG 56 -6.996 4.824 -26.026 1165 HH22 ARG 56 2HH2 ARG 56 -8.218 5.304 -27.097 1166 H TYR 57 H TYR 57 -1.010 6.829 -22.065 1167 HA TYR 57 HA TYR 57 -0.240 7.508 -24.764 1168 HB2 TYR 57 2HB TYR 57 1.473 7.493 -22.996 1169 HB3 TYR 57 1HB TYR 57 1.123 5.811 -22.666 1170 HD1 TYR 57 1HD TYR 57 2.474 8.055 -25.321 1171 HD2 TYR 57 2HD TYR 57 2.167 4.085 -23.834 1172 HE1 TYR 57 1HE TYR 57 4.056 7.371 -26.944 1173 HE2 TYR 57 2HE TYR 57 3.776 3.330 -25.494 1174 HH TYR 57 HH TYR 57 4.522 4.089 -27.705 1175 H GLN 58 H GLN 58 -1.114 4.725 -22.957 1176 HA GLN 58 HA GLN 58 -1.480 3.107 -25.348 1177 HB2 GLN 58 2HB GLN 58 0.807 2.727 -24.211 1178 HB3 GLN 58 1HB GLN 58 -0.098 2.194 -22.804 1179 HG2 GLN 58 2HG GLN 58 -1.025 0.341 -24.176 1180 HG3 GLN 58 1HG GLN 58 -0.025 0.934 -25.515 1181 HE21 GLN 58 1HE2 GLN 58 2.173 0.594 -25.485 1182 HE22 GLN 58 2HE2 GLN 58 2.931 -0.444 -24.336 1183 H ASP 59 H ASP 59 -2.581 0.994 -24.248 1184 HA ASP 59 HA ASP 59 -5.067 1.623 -23.250 1185 HB2 ASP 59 2HB ASP 59 -3.569 -0.940 -22.864 1186 HB3 ASP 59 1HB ASP 59 -5.291 -0.769 -22.759 1187 H ALA 60 H ALA 60 -2.231 1.789 -21.522 1188 HA ALA 60 HA ALA 60 -2.530 0.545 -19.095 1189 HB1 ALA 60 1HB ALA 60 -1.041 2.177 -18.169 1190 HB2 ALA 60 2HB ALA 60 -1.315 3.253 -19.532 1191 HB3 ALA 60 3HB ALA 60 -0.506 1.703 -19.787 1192 H ARG 61 H ARG 61 -3.877 3.777 -19.939 1193 HA ARG 61 HA ARG 61 -4.833 4.308 -17.349 1194 HB2 ARG 61 2HB ARG 61 -4.564 6.103 -18.985 1195 HB3 ARG 61 1HB ARG 61 -5.774 5.376 -20.026 1196 HG2 ARG 61 2HG ARG 61 -7.510 5.833 -18.397 1197 HG3 ARG 61 1HG ARG 61 -6.309 6.473 -17.270 1198 HD2 ARG 61 2HD ARG 61 -5.759 8.245 -18.844 1199 HD3 ARG 61 1HD ARG 61 -6.909 7.587 -20.003 1200 HE ARG 61 HE ARG 61 -8.628 8.056 -18.242 1201 HH11 ARG 61 1HH1 ARG 61 -5.631 9.977 -18.346 1202 HH12 ARG 61 2HH1 ARG 61 -6.368 11.425 -17.874 1203 HH21 ARG 61 1HH2 ARG 61 -9.642 10.065 -17.526 1204 HH22 ARG 61 2HH2 ARG 61 -8.725 11.470 -17.367 1205 H ASN 62 H ASN 62 -6.143 2.566 -20.074 1206 HA ASN 62 HA ASN 62 -8.751 2.233 -18.984 1207 HB2 ASN 62 2HB ASN 62 -8.181 1.907 -21.487 1208 HB3 ASN 62 1HB ASN 62 -7.353 0.474 -20.986 1209 HD21 ASN 62 1HD2 ASN 62 -8.402 -1.395 -20.655 1210 HD22 ASN 62 2HD2 ASN 62 -10.116 -1.568 -20.764 1211 H LEU 63 H LEU 63 -5.816 0.259 -19.043 1212 HA LEU 63 HA LEU 63 -6.845 -1.949 -17.639 1213 HB2 LEU 63 2HB LEU 63 -4.024 -0.930 -17.809 1214 HB3 LEU 63 1HB LEU 63 -4.420 -2.303 -16.805 1215 HG LEU 63 HG LEU 63 -3.502 -3.151 -18.792 1216 HD11 LEU 63 1HD1 LEU 63 -5.377 -4.384 -18.009 1217 HD12 LEU 63 2HD1 LEU 63 -5.234 -4.470 -19.764 1218 HD13 LEU 63 3HD1 LEU 63 -6.459 -3.434 -19.030 1219 HD21 LEU 63 1HD2 LEU 63 -3.678 -1.226 -20.192 1220 HD22 LEU 63 2HD2 LEU 63 -5.422 -1.448 -20.336 1221 HD23 LEU 63 3HD2 LEU 63 -4.312 -2.643 -21.023 1222 H ILE 64 H ILE 64 -5.270 0.947 -16.363 1223 HA ILE 64 HA ILE 64 -5.415 -0.025 -13.709 1224 HB ILE 64 HB ILE 64 -3.762 1.721 -14.412 1225 HG12 ILE 64 2HG1 ILE 64 -5.547 2.606 -12.134 1226 HG13 ILE 64 1HG1 ILE 64 -4.307 1.364 -12.026 1227 HG21 ILE 64 1HG2 ILE 64 -4.444 4.066 -14.575 1228 HG22 ILE 64 2HG2 ILE 64 -6.135 3.590 -14.398 1229 HG23 ILE 64 3HG2 ILE 64 -5.219 3.073 -15.810 1230 HD11 ILE 64 1HD1 ILE 64 -2.598 3.045 -12.556 1231 HD12 ILE 64 2HD1 ILE 64 -3.516 3.461 -11.106 1232 HD13 ILE 64 3HD1 ILE 64 -3.857 4.278 -12.632 1233 H ARG 65 H ARG 65 -7.592 1.833 -15.694 1234 HA ARG 65 HA ARG 65 -9.325 2.375 -13.505 1235 HB2 ARG 65 2HB ARG 65 -9.538 2.952 -16.424 1236 HB3 ARG 65 1HB ARG 65 -10.892 3.219 -15.331 1237 HG2 ARG 65 2HG ARG 65 -8.156 4.470 -15.105 1238 HG3 ARG 65 1HG ARG 65 -9.645 5.277 -15.611 1239 HD2 ARG 65 2HD ARG 65 -9.064 4.107 -12.874 1240 HD3 ARG 65 1HD ARG 65 -9.241 5.788 -13.274 1241 HE ARG 65 HE ARG 65 -11.566 5.110 -14.031 1242 HH11 ARG 65 1HH1 ARG 65 -9.878 3.753 -11.225 1243 HH12 ARG 65 2HH1 ARG 65 -11.312 3.251 -10.457 1244 HH21 ARG 65 1HH2 ARG 65 -13.536 4.396 -12.897 1245 HH22 ARG 65 2HH2 ARG 65 -13.334 3.596 -11.389 1246 H ARG 66 H ARG 66 -8.756 -0.413 -14.929 1247 HA ARG 66 HA ARG 66 -11.478 -1.419 -15.008 1248 HB2 ARG 66 2HB ARG 66 -8.822 -2.876 -14.990 1249 HB3 ARG 66 1HB ARG 66 -10.374 -3.677 -15.118 1250 HG2 ARG 66 2HG ARG 66 -10.776 -2.540 -17.251 1251 HG3 ARG 66 1HG ARG 66 -9.220 -1.726 -17.102 1252 HD2 ARG 66 2HD ARG 66 -9.092 -3.702 -18.571 1253 HD3 ARG 66 1HD ARG 66 -8.053 -3.854 -17.156 1254 HE ARG 66 HE ARG 66 -10.630 -4.981 -16.746 1255 HH11 ARG 66 1HH1 ARG 66 -7.527 -5.686 -18.301 1256 HH12 ARG 66 2HH1 ARG 66 -7.602 -7.361 -18.058 1257 HH21 ARG 66 1HH2 ARG 66 -10.753 -7.317 -16.419 1258 HH22 ARG 66 2HH2 ARG 66 -9.476 -8.313 -16.951 1259 H HIS 67 H HIS 67 -9.408 -0.452 -12.650 1260 HA HIS 67 HA HIS 67 -10.609 -2.156 -10.579 1261 HB2 HIS 67 2HB HIS 67 -7.821 -0.992 -10.463 1262 HB3 HIS 67 1HB HIS 67 -8.513 -2.208 -9.407 1263 HD1 HIS 67 1HD HIS 67 -8.184 -4.702 -10.139 1264 HD2 HIS 67 2HD HIS 67 -6.896 -1.928 -12.967 1265 HE1 HIS 67 1HE HIS 67 -6.867 -5.998 -11.829 1266 HE2 HIS 67 2HE HIS 67 -5.860 -4.243 -13.330 1267 H GLU 68 H GLU 68 -10.818 -0.811 -8.547 1268 HA GLU 68 HA GLU 68 -10.904 1.976 -9.211 1269 HB2 GLU 68 2HB GLU 68 -11.764 0.516 -6.715 1270 HB3 GLU 68 1HB GLU 68 -11.762 2.269 -6.829 1271 HG2 GLU 68 2HG GLU 68 -13.328 0.391 -8.582 1272 HG3 GLU 68 1HG GLU 68 -13.974 1.319 -7.231 1273 H ARG 69 H ARG 69 -9.595 0.558 -6.194 1274 HA ARG 69 HA ARG 69 -6.984 1.408 -6.815 1275 HB2 ARG 69 2HB ARG 69 -6.741 3.240 -5.095 1276 HB3 ARG 69 1HB ARG 69 -7.673 3.642 -6.523 1277 HG2 ARG 69 2HG ARG 69 -9.713 3.351 -5.318 1278 HG3 ARG 69 1HG ARG 69 -8.816 2.870 -3.864 1279 HD2 ARG 69 2HD ARG 69 -7.764 5.062 -3.815 1280 HD3 ARG 69 1HD ARG 69 -8.641 5.530 -5.270 1281 HE ARG 69 HE ARG 69 -10.658 4.971 -3.800 1282 HH11 ARG 69 1HH1 ARG 69 -7.672 6.560 -2.711 1283 HH12 ARG 69 2HH1 ARG 69 -8.433 7.489 -1.504 1284 HH21 ARG 69 1HH2 ARG 69 -11.709 6.255 -2.105 1285 HH22 ARG 69 2HH2 ARG 69 -10.800 7.315 -1.157 1286 H ASP 70 H ASP 70 -9.096 0.663 -4.010 1287 HA ASP 70 HA ASP 70 -6.860 -0.006 -2.403 1288 HB2 ASP 70 2HB ASP 70 -8.428 -1.031 -0.761 1289 HB3 ASP 70 1HB ASP 70 -8.889 0.595 -1.227 1290 H GLU 71 H GLU 71 -8.823 -1.937 -4.486 1291 HA GLU 71 HA GLU 71 -8.003 -4.528 -3.883 1292 HB2 GLU 71 2HB GLU 71 -9.699 -3.865 -5.575 1293 HB3 GLU 71 1HB GLU 71 -8.413 -3.273 -6.609 1294 HG2 GLU 71 2HG GLU 71 -7.547 -5.594 -6.709 1295 HG3 GLU 71 1HG GLU 71 -8.977 -6.115 -5.811 1296 H ILE 72 H ILE 72 -6.515 -2.082 -5.911 1297 HA ILE 72 HA ILE 72 -4.234 -3.590 -6.739 1298 HB ILE 72 HB ILE 72 -4.711 -0.611 -6.705 1299 HG12 ILE 72 2HG1 ILE 72 -4.985 -2.612 -8.963 1300 HG13 ILE 72 1HG1 ILE 72 -6.299 -1.789 -8.134 1301 HG21 ILE 72 1HG2 ILE 72 -2.545 -2.155 -8.131 1302 HG22 ILE 72 2HG2 ILE 72 -2.324 -1.052 -6.773 1303 HG23 ILE 72 3HG2 ILE 72 -2.867 -0.433 -8.333 1304 HD11 ILE 72 1HD1 ILE 72 -5.535 0.352 -9.010 1305 HD12 ILE 72 2HD1 ILE 72 -5.819 -0.798 -10.325 1306 HD13 ILE 72 3HD1 ILE 72 -4.178 -0.451 -9.797 1307 H MET 73 H MET 73 -4.891 -1.240 -4.227 1308 HA MET 73 HA MET 73 -2.229 -0.775 -3.480 1309 HB2 MET 73 2HB MET 73 -4.288 0.649 -2.961 1310 HB3 MET 73 1HB MET 73 -4.625 -0.482 -1.672 1311 HG2 MET 73 2HG MET 73 -2.113 1.182 -1.886 1312 HG3 MET 73 1HG MET 73 -3.518 1.616 -0.931 1313 HE1 MET 73 1HE MET 73 -0.541 1.506 0.180 1314 HE2 MET 73 2HE MET 73 -0.823 0.741 1.747 1315 HE3 MET 73 3HE MET 73 -1.953 1.956 1.134 1316 H GLU 74 H GLU 74 -4.602 -3.197 -2.330 1317 HA GLU 74 HA GLU 74 -3.055 -4.191 -0.236 1318 HB2 GLU 74 2HB GLU 74 -4.805 -5.766 -2.088 1319 HB3 GLU 74 1HB GLU 74 -4.031 -6.430 -0.669 1320 HG2 GLU 74 2HG GLU 74 -5.318 -4.729 0.669 1321 HG3 GLU 74 1HG GLU 74 -6.232 -4.393 -0.814 1322 H GLU 75 H GLU 75 -3.010 -5.108 -3.671 1323 HA GLU 75 HA GLU 75 -1.095 -7.128 -3.343 1324 HB2 GLU 75 2HB GLU 75 -2.455 -6.823 -5.432 1325 HB3 GLU 75 1HB GLU 75 -1.437 -5.428 -5.807 1326 HG2 GLU 75 2HG GLU 75 0.533 -6.841 -5.945 1327 HG3 GLU 75 1HG GLU 75 -0.408 -8.250 -5.475 1328 H LEU 76 H LEU 76 -0.736 -3.692 -3.965 1329 HA LEU 76 HA LEU 76 2.028 -3.579 -4.301 1330 HB2 LEU 76 2HB LEU 76 0.250 -1.589 -2.885 1331 HB3 LEU 76 1HB LEU 76 1.895 -1.273 -3.388 1332 HG LEU 76 HG LEU 76 -0.413 -1.854 -5.241 1333 HD11 LEU 76 1HD1 LEU 76 -0.210 0.495 -5.856 1334 HD12 LEU 76 2HD1 LEU 76 1.059 0.710 -4.659 1335 HD13 LEU 76 3HD1 LEU 76 -0.584 0.335 -4.140 1336 HD21 LEU 76 1HD2 LEU 76 1.690 -2.628 -6.163 1337 HD22 LEU 76 2HD2 LEU 76 2.450 -1.099 -5.757 1338 HD23 LEU 76 3HD2 LEU 76 1.181 -1.150 -6.981 1339 H THR 77 H THR 77 0.135 -3.398 -1.294 1340 HA THR 77 HA THR 77 2.419 -3.161 0.396 1341 HB THR 77 HB THR 77 -0.423 -3.963 1.064 1342 HG1 THR 77 1HG THR 77 -0.642 -1.929 0.309 1343 HG21 THR 77 1HG2 THR 77 0.102 -3.121 3.304 1344 HG22 THR 77 2HG2 THR 77 1.769 -2.809 2.809 1345 HG23 THR 77 3HG2 THR 77 1.162 -4.465 2.874 1346 H LYS 78 H LYS 78 0.247 -5.896 -0.445 1347 HA LYS 78 HA LYS 78 1.243 -7.707 1.373 1348 HB2 LYS 78 2HB LYS 78 -0.983 -7.527 0.484 1349 HB3 LYS 78 1HB LYS 78 -0.391 -7.827 -1.124 1350 HG2 LYS 78 2HG LYS 78 0.093 -9.964 -0.649 1351 HG3 LYS 78 1HG LYS 78 -0.205 -9.809 1.106 1352 HD2 LYS 78 2HD LYS 78 -2.556 -9.135 0.500 1353 HD3 LYS 78 1HD LYS 78 -2.182 -9.556 -1.172 1354 HE2 LYS 78 2HE LYS 78 -1.663 -11.794 -0.478 1355 HE3 LYS 78 1HE LYS 78 -2.013 -11.338 1.191 1356 HZ1 LYS 78 1HZ LYS 78 -4.318 -10.885 0.548 1357 HZ2 LYS 78 2HZ LYS 78 -3.891 -12.486 0.230 1358 HZ3 LYS 78 3HZ LYS 78 -4.007 -11.382 -1.038 1359 H TYR 79 H TYR 79 1.864 -7.121 -2.103 1360 HA TYR 79 HA TYR 79 3.509 -9.434 -2.360 1361 HB2 TYR 79 2HB TYR 79 2.230 -8.327 -4.226 1362 HB3 TYR 79 1HB TYR 79 3.363 -6.992 -4.134 1363 HD1 TYR 79 1HD TYR 79 2.776 -10.366 -5.286 1364 HD2 TYR 79 2HD TYR 79 5.683 -7.316 -4.866 1365 HE1 TYR 79 1HE TYR 79 4.192 -11.516 -6.932 1366 HE2 TYR 79 2HE TYR 79 7.110 -8.427 -6.510 1367 HH TYR 79 HH TYR 79 6.006 -10.926 -8.517 1368 H TYR 80 H TYR 80 4.000 -6.037 -1.631 1369 HA TYR 80 HA TYR 80 6.768 -5.804 -1.795 1370 HB2 TYR 80 2HB TYR 80 5.362 -3.875 -1.405 1371 HB3 TYR 80 1HB TYR 80 4.758 -4.558 0.089 1372 HD1 TYR 80 1HD TYR 80 7.641 -2.916 -1.522 1373 HD2 TYR 80 2HD TYR 80 5.975 -4.310 2.130 1374 HE1 TYR 80 1HE TYR 80 9.335 -1.644 -0.257 1375 HE2 TYR 80 2HE TYR 80 7.650 -3.057 3.393 1376 HH TYR 80 HH TYR 80 9.607 -0.672 2.004 1377 H LEU 81 H LEU 81 4.777 -6.690 0.997 1378 HA LEU 81 HA LEU 81 6.946 -7.251 2.712 1379 HB2 LEU 81 2HB LEU 81 4.067 -8.072 2.860 1380 HB3 LEU 81 1HB LEU 81 5.223 -8.387 4.140 1381 HG LEU 81 HG LEU 81 4.367 -5.662 3.157 1382 HD11 LEU 81 1HD1 LEU 81 3.755 -7.138 5.714 1383 HD12 LEU 81 2HD1 LEU 81 2.621 -6.817 4.403 1384 HD13 LEU 81 3HD1 LEU 81 3.287 -5.479 5.340 1385 HD21 LEU 81 1HD2 LEU 81 5.623 -4.827 5.081 1386 HD22 LEU 81 2HD2 LEU 81 6.678 -5.642 3.934 1387 HD23 LEU 81 3HD2 LEU 81 6.197 -6.455 5.427 1388 H ALA 82 H ALA 82 5.394 -9.170 0.299 1389 HA ALA 82 HA ALA 82 6.018 -11.723 1.251 1390 HB1 ALA 82 1HB ALA 82 5.863 -10.777 -1.609 1391 HB2 ALA 82 2HB ALA 82 4.500 -11.318 -0.630 1392 HB3 ALA 82 3HB ALA 82 5.781 -12.450 -1.060 1393 H ASN 83 H ASN 83 7.946 -9.299 -0.290 1394 HA ASN 83 HA ASN 83 10.157 -10.950 -1.029 1395 HB2 ASN 83 2HB ASN 83 10.039 -7.977 -0.572 1396 HB3 ASN 83 1HB ASN 83 11.438 -8.834 -1.208 1397 HD21 ASN 83 1HD2 ASN 83 8.265 -7.626 -1.852 1398 HD22 ASN 83 2HD2 ASN 83 8.334 -7.949 -3.554 1399 H HIS 84 H HIS 84 9.119 -9.706 1.949 1400 HA HIS 84 HA HIS 84 11.784 -9.622 3.104 1401 HB2 HIS 84 2HB HIS 84 9.727 -8.143 3.751 1402 HB3 HIS 84 1HB HIS 84 9.191 -9.542 4.662 1403 HD1 HIS 84 1HD HIS 84 12.171 -10.233 5.771 1404 HD2 HIS 84 2HD HIS 84 10.220 -6.569 5.947 1405 HE1 HIS 84 1HE HIS 84 13.327 -8.940 7.558 1406 HE2 HIS 84 2HE HIS 84 12.396 -6.634 7.335 1407 H GLY 85 H GLY 85 9.827 -12.009 2.125 1408 HA2 GLY 85 2HA GLY 85 10.154 -14.302 2.479 1409 HA3 GLY 85 1HA GLY 85 10.930 -13.921 4.017 1410 H ILE 86 H ILE 86 8.009 -12.364 3.235 1411 HA ILE 86 HA ILE 86 6.712 -13.820 5.393 1412 HB ILE 86 HB ILE 86 6.035 -11.152 4.142 1413 HG12 ILE 86 2HG1 ILE 86 7.216 -11.848 6.833 1414 HG13 ILE 86 1HG1 ILE 86 8.090 -11.133 5.485 1415 HG21 ILE 86 1HG2 ILE 86 4.414 -10.910 5.960 1416 HG22 ILE 86 2HG2 ILE 86 4.803 -12.534 6.527 1417 HG23 ILE 86 3HG2 ILE 86 4.035 -12.315 4.959 1418 HD11 ILE 86 1HD1 ILE 86 7.528 -9.472 7.144 1419 HD12 ILE 86 2HD1 ILE 86 5.818 -9.907 7.002 1420 HD13 ILE 86 3HD1 ILE 86 6.656 -9.157 5.637 1421 H ASP 87 H ASP 87 5.119 -15.096 5.012 1422 HA ASP 87 HA ASP 87 3.907 -15.242 2.347 1423 HB2 ASP 87 2HB ASP 87 4.716 -17.370 3.114 1424 HB3 ASP 87 1HB ASP 87 3.922 -17.158 4.671 1425 H ILE 88 H ILE 88 2.032 -14.374 2.040 1426 HA ILE 88 HA ILE 88 0.366 -13.714 4.360 1427 HB ILE 88 HB ILE 88 0.606 -12.145 1.760 1428 HG12 ILE 88 2HG1 ILE 88 1.843 -11.566 4.463 1429 HG13 ILE 88 1HG1 ILE 88 2.725 -12.099 3.039 1430 HG21 ILE 88 1HG2 ILE 88 -0.589 -11.427 4.432 1431 HG22 ILE 88 2HG2 ILE 88 -1.533 -11.929 3.033 1432 HG23 ILE 88 3HG2 ILE 88 -0.616 -10.413 3.001 1433 HD11 ILE 88 1HD1 ILE 88 2.961 -9.721 3.451 1434 HD12 ILE 88 2HD1 ILE 88 1.216 -9.524 3.327 1435 HD13 ILE 88 3HD1 ILE 88 2.150 -10.023 1.911 1436 H LYS 89 H LYS 89 -1.919 -13.899 3.976 1437 HA LYS 89 HA LYS 89 -2.494 -15.881 1.936 1438 HB2 LYS 89 2HB LYS 89 -4.290 -14.916 4.172 1439 HB3 LYS 89 1HB LYS 89 -4.535 -16.331 3.164 1440 HG2 LYS 89 2HG LYS 89 -2.410 -15.932 5.268 1441 HG3 LYS 89 1HG LYS 89 -3.763 -17.057 5.312 1442 HD2 LYS 89 2HD LYS 89 -2.792 -18.276 3.405 1443 HD3 LYS 89 1HD LYS 89 -1.434 -17.147 3.393 1444 HE2 LYS 89 2HE LYS 89 -0.963 -17.815 5.742 1445 HE3 LYS 89 1HE LYS 89 -2.200 -19.055 5.591 1446 HZ1 LYS 89 1HZ LYS 89 -0.867 -19.976 3.688 1447 HZ2 LYS 89 2HZ LYS 89 -0.037 -20.018 5.160 1448 HZ3 LYS 89 3HZ LYS 89 0.322 -18.837 4.054 Start of MODEL 20 1 H1 MET 1 1HT MET 1 -19.285 12.722 27.716 2 H2 MET 1 2HT MET 1 -18.279 13.202 29.009 3 H3 MET 1 3HT MET 1 -18.047 11.714 28.295 4 HA MET 1 HA MET 1 -17.327 12.703 26.290 5 HB2 MET 1 2HB MET 1 -17.843 15.328 27.728 6 HB3 MET 1 1HB MET 1 -16.912 15.188 26.253 7 HG2 MET 1 2HG MET 1 -19.131 15.963 25.748 8 HG3 MET 1 1HG MET 1 -18.918 14.345 25.096 9 HE1 MET 1 1HE MET 1 -22.719 14.420 26.020 10 HE2 MET 1 2HE MET 1 -21.532 14.094 24.755 11 HE3 MET 1 3HE MET 1 -21.743 15.736 25.365 12 H GLY 2 H GLY 2 -15.153 13.461 26.015 13 HA2 GLY 2 2HA GLY 2 -13.483 14.102 28.162 14 HA3 GLY 2 1HA GLY 2 -13.427 12.363 27.871 15 H PHE 3 H PHE 3 -13.118 15.471 26.314 16 HA PHE 3 HA PHE 3 -12.039 14.385 23.928 17 HB2 PHE 3 2HB PHE 3 -13.287 16.536 24.006 18 HB3 PHE 3 1HB PHE 3 -11.963 17.245 24.913 19 HD1 PHE 3 1HD PHE 3 -9.807 17.712 23.797 20 HD2 PHE 3 2HD PHE 3 -13.147 16.190 21.650 21 HE1 PHE 3 1HE PHE 3 -8.742 18.371 21.680 22 HE2 PHE 3 2HE PHE 3 -12.083 16.840 19.528 23 HZ PHE 3 HZ PHE 3 -9.878 17.932 19.543 24 H THR 4 H THR 4 -10.261 13.232 24.308 25 HA THR 4 HA THR 4 -7.871 14.741 24.731 26 HB THR 4 HB THR 4 -8.413 12.291 26.452 27 HG1 THR 4 1HG THR 4 -8.890 14.914 26.781 28 HG21 THR 4 1HG2 THR 4 -6.029 14.157 26.326 29 HG22 THR 4 2HG2 THR 4 -6.064 12.505 25.712 30 HG23 THR 4 3HG2 THR 4 -6.219 12.810 27.443 31 H ASP 5 H ASP 5 -7.394 14.368 22.702 32 HA ASP 5 HA ASP 5 -7.114 11.580 21.820 33 HB2 ASP 5 2HB ASP 5 -8.755 12.805 20.502 34 HB3 ASP 5 1HB ASP 5 -7.598 14.099 20.217 35 H GLU 6 H GLU 6 -5.123 10.912 21.406 36 HA GLU 6 HA GLU 6 -2.928 12.707 21.860 37 HB2 GLU 6 2HB GLU 6 -2.918 9.835 20.933 38 HB3 GLU 6 1HB GLU 6 -1.527 10.735 21.509 39 HG2 GLU 6 2HG GLU 6 -2.560 10.894 23.725 40 HG3 GLU 6 1HG GLU 6 -3.946 9.976 23.134 41 H THR 7 H THR 7 -2.996 14.169 20.188 42 HA THR 7 HA THR 7 -2.623 13.032 17.547 43 HB THR 7 HB THR 7 -4.704 14.207 17.567 44 HG1 THR 7 1HG THR 7 -3.262 14.547 15.788 45 HG21 THR 7 1HG2 THR 7 -3.218 16.593 18.686 46 HG22 THR 7 2HG2 THR 7 -4.431 15.627 19.528 47 HG23 THR 7 3HG2 THR 7 -4.897 16.618 18.148 48 H VAL 8 H VAL 8 -0.544 12.986 17.102 49 HA VAL 8 HA VAL 8 0.953 15.328 16.783 50 HB VAL 8 HB VAL 8 1.121 15.156 19.262 51 HG11 VAL 8 1HG1 VAL 8 0.840 12.795 19.580 52 HG12 VAL 8 2HG1 VAL 8 2.347 13.323 20.331 53 HG13 VAL 8 3HG1 VAL 8 2.384 12.466 18.791 54 HG21 VAL 8 1HG2 VAL 8 3.715 14.545 17.842 55 HG22 VAL 8 2HG2 VAL 8 3.579 15.222 19.466 56 HG23 VAL 8 3HG2 VAL 8 2.998 16.138 18.078 57 H ARG 9 H ARG 9 2.792 14.885 15.549 58 HA ARG 9 HA ARG 9 2.989 12.163 14.541 59 HB2 ARG 9 2HB ARG 9 4.636 14.611 13.779 60 HB3 ARG 9 1HB ARG 9 4.750 13.046 13.010 61 HG2 ARG 9 2HG ARG 9 3.537 14.456 11.538 62 HG3 ARG 9 1HG ARG 9 2.357 13.369 12.268 63 HD2 ARG 9 2HD ARG 9 1.683 15.112 13.820 64 HD3 ARG 9 1HD ARG 9 2.923 16.183 13.171 65 HE ARG 9 HE ARG 9 1.141 15.264 11.166 66 HH11 ARG 9 1HH1 ARG 9 1.444 17.603 13.791 67 HH12 ARG 9 2HH1 ARG 9 0.382 18.740 13.098 68 HH21 ARG 9 1HH2 ARG 9 -0.311 16.816 10.214 69 HH22 ARG 9 2HH2 ARG 9 -0.630 18.289 11.025 70 H PHE 10 H PHE 10 4.490 10.764 15.274 71 HA PHE 10 HA PHE 10 6.350 11.859 17.238 72 HB2 PHE 10 2HB PHE 10 4.746 10.210 18.128 73 HB3 PHE 10 1HB PHE 10 5.325 9.025 16.966 74 HD1 PHE 10 1HD PHE 10 6.264 11.003 19.936 75 HD2 PHE 10 2HD PHE 10 7.268 7.746 17.399 76 HE1 PHE 10 1HE PHE 10 7.963 10.267 21.553 77 HE2 PHE 10 2HE PHE 10 8.966 7.010 19.003 78 HZ PHE 10 HZ PHE 10 9.317 8.271 21.091 79 H ASP 11 H ASP 11 8.059 12.398 16.101 80 HA ASP 11 HA ASP 11 10.039 12.263 15.070 81 HB2 ASP 11 2HB ASP 11 10.541 10.540 16.722 82 HB3 ASP 11 1HB ASP 11 9.839 9.311 15.687 83 H PHE 12 H PHE 12 10.014 12.807 13.034 84 HA PHE 12 HA PHE 12 8.990 10.860 11.101 85 HB2 PHE 12 2HB PHE 12 8.744 12.749 9.523 86 HB3 PHE 12 1HB PHE 12 7.850 13.047 11.003 87 HD1 PHE 12 1HD PHE 12 8.725 14.710 12.628 88 HD2 PHE 12 2HD PHE 12 10.488 14.165 8.800 89 HE1 PHE 12 1HE PHE 12 9.834 16.889 12.837 90 HE2 PHE 12 2HE PHE 12 11.603 16.350 8.995 91 HZ PHE 12 HZ PHE 12 11.276 17.717 11.022 92 H ASP 13 H ASP 13 10.197 11.004 8.901 93 HA ASP 13 HA ASP 13 13.005 11.622 9.259 94 HB2 ASP 13 2HB ASP 13 12.655 9.201 9.941 95 HB3 ASP 13 1HB ASP 13 12.172 8.883 8.279 96 H ASP 14 H ASP 14 13.992 12.140 7.383 97 HA ASP 14 HA ASP 14 12.234 12.793 5.187 98 HB2 ASP 14 2HB ASP 14 13.807 14.471 5.983 99 HB3 ASP 14 1HB ASP 14 15.158 13.396 5.668 100 H ASN 15 H ASN 15 14.267 10.143 5.906 101 HA ASN 15 HA ASN 15 15.008 9.770 3.121 102 HB2 ASN 15 2HB ASN 15 15.803 8.160 5.548 103 HB3 ASN 15 1HB ASN 15 16.442 7.958 3.923 104 HD21 ASN 15 1HD2 ASN 15 16.428 9.830 6.772 105 HD22 ASN 15 2HD2 ASN 15 17.796 10.835 6.401 106 H ARG 16 H ARG 16 14.437 8.014 1.957 107 HA ARG 16 HA ARG 16 12.247 6.390 3.014 108 HB2 ARG 16 2HB ARG 16 13.050 7.014 0.173 109 HB3 ARG 16 1HB ARG 16 11.797 5.868 0.609 110 HG2 ARG 16 2HG ARG 16 10.473 7.669 1.584 111 HG3 ARG 16 1HG ARG 16 11.758 8.826 1.195 112 HD2 ARG 16 2HD ARG 16 11.519 8.411 -1.131 113 HD3 ARG 16 1HD ARG 16 10.372 7.105 -0.848 114 HE ARG 16 HE ARG 16 9.469 9.556 0.237 115 HH11 ARG 16 1HH1 ARG 16 10.047 8.059 -2.881 116 HH12 ARG 16 2HH1 ARG 16 8.638 8.638 -3.641 117 HH21 ARG 16 1HH2 ARG 16 7.499 10.425 -0.787 118 HH22 ARG 16 2HH2 ARG 16 7.106 10.010 -2.387 119 H LYS 17 H LYS 17 13.456 4.864 4.016 120 HA LYS 17 HA LYS 17 15.303 3.322 2.335 121 HB2 LYS 17 2HB LYS 17 16.402 4.583 4.194 122 HB3 LYS 17 1HB LYS 17 15.359 3.771 5.341 123 HG2 LYS 17 2HG LYS 17 16.423 1.646 4.844 124 HG3 LYS 17 1HG LYS 17 17.424 2.412 3.606 125 HD2 LYS 17 2HD LYS 17 18.443 3.830 5.311 126 HD3 LYS 17 1HD LYS 17 17.433 3.090 6.548 127 HE2 LYS 17 2HE LYS 17 19.485 1.637 4.861 128 HE3 LYS 17 1HE LYS 17 19.729 2.167 6.523 129 HZ1 LYS 17 1HZ LYS 17 19.143 -0.158 6.485 130 HZ2 LYS 17 2HZ LYS 17 17.734 0.128 5.623 131 HZ3 LYS 17 3HZ LYS 17 17.924 0.691 7.201 132 H LYS 18 H LYS 18 15.435 0.975 3.306 133 HA LYS 18 HA LYS 18 12.766 -0.001 3.302 134 HB2 LYS 18 2HB LYS 18 15.410 -1.445 3.480 135 HB3 LYS 18 1HB LYS 18 13.848 -2.256 3.398 136 HG2 LYS 18 2HG LYS 18 13.382 -1.231 1.270 137 HG3 LYS 18 1HG LYS 18 14.887 -0.325 1.349 138 HD2 LYS 18 2HD LYS 18 16.155 -2.398 1.249 139 HD3 LYS 18 1HD LYS 18 14.654 -3.328 1.249 140 HE2 LYS 18 2HE LYS 18 15.605 -3.070 -1.017 141 HE3 LYS 18 1HE LYS 18 14.000 -2.362 -0.876 142 HZ1 LYS 18 1HZ LYS 18 16.583 -0.879 -0.827 143 HZ2 LYS 18 2HZ LYS 18 15.075 -0.181 -0.632 144 HZ3 LYS 18 3HZ LYS 18 15.475 -0.909 -2.093 145 H ALA 19 H ALA 19 13.931 1.527 5.625 146 HA ALA 19 HA ALA 19 13.557 -0.091 7.943 147 HB1 ALA 19 1HB ALA 19 14.719 2.090 7.974 148 HB2 ALA 19 2HB ALA 19 13.325 2.067 9.078 149 HB3 ALA 19 3HB ALA 19 13.190 2.843 7.498 150 H ILE 20 H ILE 20 11.631 1.730 5.712 151 HA ILE 20 HA ILE 20 9.143 1.731 7.013 152 HB ILE 20 HB ILE 20 9.761 1.561 4.039 153 HG12 ILE 20 2HG1 ILE 20 9.246 3.983 5.787 154 HG13 ILE 20 1HG1 ILE 20 10.806 3.496 5.140 155 HG21 ILE 20 1HG2 ILE 20 7.234 2.436 5.443 156 HG22 ILE 20 2HG2 ILE 20 7.452 0.953 4.508 157 HG23 ILE 20 3HG2 ILE 20 7.531 2.524 3.705 158 HD11 ILE 20 1HD1 ILE 20 9.850 5.329 3.866 159 HD12 ILE 20 2HD1 ILE 20 8.414 4.365 3.526 160 HD13 ILE 20 3HD1 ILE 20 9.980 3.880 2.869 161 H SER 21 H SER 21 10.936 -0.623 5.200 162 HA SER 21 HA SER 21 8.827 -2.497 4.789 163 HB2 SER 21 2HB SER 21 11.814 -3.020 4.871 164 HB3 SER 21 1HB SER 21 10.591 -4.033 4.104 165 HG SER 21 HG SER 21 10.178 -1.791 2.965 166 H GLU 22 H GLU 22 11.435 -2.143 7.154 167 HA GLU 22 HA GLU 22 10.978 -4.373 8.778 168 HB2 GLU 22 2HB GLU 22 11.872 -1.609 9.631 169 HB3 GLU 22 1HB GLU 22 12.117 -3.096 10.527 170 HG2 GLU 22 2HG GLU 22 13.322 -2.449 7.846 171 HG3 GLU 22 1HG GLU 22 14.142 -2.308 9.396 172 H THR 23 H THR 23 9.727 -1.112 8.861 173 HA THR 23 HA THR 23 8.202 -1.210 11.188 174 HB THR 23 HB THR 23 7.705 0.425 8.685 175 HG1 THR 23 1HG THR 23 9.830 0.675 9.681 176 HG21 THR 23 1HG2 THR 23 5.784 0.431 10.211 177 HG22 THR 23 2HG2 THR 23 6.587 2.002 10.199 178 HG23 THR 23 3HG2 THR 23 6.837 0.890 11.546 179 H LEU 24 H LEU 24 7.159 -1.708 7.794 180 HA LEU 24 HA LEU 24 4.477 -2.239 8.539 181 HB2 LEU 24 2HB LEU 24 5.893 -2.806 5.945 182 HB3 LEU 24 1HB LEU 24 4.161 -2.905 6.192 183 HG LEU 24 HG LEU 24 5.845 -0.408 6.347 184 HD11 LEU 24 1HD1 LEU 24 3.785 -1.298 4.344 185 HD12 LEU 24 2HD1 LEU 24 5.527 -1.205 4.086 186 HD13 LEU 24 3HD1 LEU 24 4.596 0.268 4.370 187 HD21 LEU 24 1HD2 LEU 24 4.013 -0.287 7.947 188 HD22 LEU 24 2HD2 LEU 24 2.861 -0.757 6.698 189 HD23 LEU 24 3HD2 LEU 24 3.711 0.784 6.586 190 H GLU 25 H GLU 25 7.253 -4.320 7.994 191 HA GLU 25 HA GLU 25 5.859 -6.753 7.873 192 HB2 GLU 25 2HB GLU 25 8.255 -6.298 7.216 193 HB3 GLU 25 1HB GLU 25 8.655 -6.186 8.910 194 HG2 GLU 25 2HG GLU 25 7.539 -8.691 7.669 195 HG3 GLU 25 1HG GLU 25 9.253 -8.322 7.657 196 H THR 26 H THR 26 7.130 -4.802 10.510 197 HA THR 26 HA THR 26 6.464 -6.548 12.637 198 HB THR 26 HB THR 26 6.765 -3.529 12.660 199 HG1 THR 26 1HG THR 26 8.687 -4.534 11.946 200 HG21 THR 26 1HG2 THR 26 7.274 -3.820 15.051 201 HG22 THR 26 2HG2 THR 26 6.944 -5.548 14.907 202 HG23 THR 26 3HG2 THR 26 5.647 -4.381 14.653 203 H VAL 27 H VAL 27 4.786 -3.779 11.154 204 HA VAL 27 HA VAL 27 2.509 -3.712 12.802 205 HB VAL 27 HB VAL 27 2.706 -2.976 9.854 206 HG11 VAL 27 1HG1 VAL 27 0.402 -3.285 10.544 207 HG12 VAL 27 2HG1 VAL 27 0.745 -1.571 10.274 208 HG13 VAL 27 3HG1 VAL 27 0.661 -2.210 11.917 209 HG21 VAL 27 1HG2 VAL 27 2.921 -1.216 12.298 210 HG22 VAL 27 2HG2 VAL 27 2.983 -0.688 10.621 211 HG23 VAL 27 3HG2 VAL 27 4.269 -1.708 11.270 212 H TYR 28 H TYR 28 3.193 -5.545 9.899 213 HA TYR 28 HA TYR 28 0.714 -6.745 9.508 214 HB2 TYR 28 2HB TYR 28 2.553 -6.860 7.872 215 HB3 TYR 28 1HB TYR 28 3.469 -7.883 8.969 216 HD1 TYR 28 1HD TYR 28 2.720 -10.215 9.381 217 HD2 TYR 28 2HD TYR 28 0.805 -7.762 6.494 218 HE1 TYR 28 1HE TYR 28 1.693 -12.212 8.376 219 HE2 TYR 28 2HE TYR 28 -0.231 -9.763 5.480 220 HH TYR 28 HH TYR 28 -0.239 -12.770 7.028 221 H ARG 29 H ARG 29 3.479 -7.764 11.467 222 HA ARG 29 HA ARG 29 2.466 -10.258 12.266 223 HB2 ARG 29 2HB ARG 29 4.347 -8.511 13.846 224 HB3 ARG 29 1HB ARG 29 4.088 -10.231 14.063 225 HG2 ARG 29 2HG ARG 29 5.392 -8.842 11.742 226 HG3 ARG 29 1HG ARG 29 6.134 -9.916 12.923 227 HD2 ARG 29 2HD ARG 29 4.139 -10.641 10.779 228 HD3 ARG 29 1HD ARG 29 5.828 -11.112 10.844 229 HE ARG 29 HE ARG 29 3.655 -12.104 12.557 230 HH11 ARG 29 1HH1 ARG 29 7.016 -12.440 11.433 231 HH12 ARG 29 2HH1 ARG 29 7.142 -14.074 11.909 232 HH21 ARG 29 1HH2 ARG 29 3.857 -14.324 13.187 233 HH22 ARG 29 2HH2 ARG 29 5.332 -15.155 12.925 234 H ALA 30 H ALA 30 2.236 -7.105 13.756 235 HA ALA 30 HA ALA 30 0.992 -7.874 16.148 236 HB1 ALA 30 1HB ALA 30 1.936 -5.637 15.804 237 HB2 ALA 30 2HB ALA 30 0.250 -5.536 16.317 238 HB3 ALA 30 3HB ALA 30 0.673 -5.283 14.628 239 H LEU 31 H LEU 31 -0.328 -6.919 13.081 240 HA LEU 31 HA LEU 31 -3.024 -7.207 13.895 241 HB2 LEU 31 2HB LEU 31 -1.741 -6.770 11.258 242 HB3 LEU 31 1HB LEU 31 -3.484 -6.897 11.470 243 HG LEU 31 HG LEU 31 -1.849 -4.940 13.010 244 HD11 LEU 31 1HD1 LEU 31 -3.316 -4.533 10.407 245 HD12 LEU 31 2HD1 LEU 31 -1.556 -4.518 10.578 246 HD13 LEU 31 3HD1 LEU 31 -2.536 -3.260 11.341 247 HD21 LEU 31 1HD2 LEU 31 -4.043 -3.792 13.145 248 HD22 LEU 31 2HD2 LEU 31 -3.997 -5.382 13.918 249 HD23 LEU 31 3HD2 LEU 31 -4.747 -5.195 12.339 250 H GLU 32 H GLU 32 -0.766 -9.431 12.360 251 HA GLU 32 HA GLU 32 -2.955 -11.125 11.730 252 HB2 GLU 32 2HB GLU 32 -1.260 -12.883 11.151 253 HB3 GLU 32 1HB GLU 32 -1.242 -11.434 10.156 254 HG2 GLU 32 2HG GLU 32 1.005 -12.023 10.450 255 HG3 GLU 32 1HG GLU 32 0.726 -10.741 11.620 256 H GLU 33 H GLU 33 -0.867 -10.916 14.359 257 HA GLU 33 HA GLU 33 -1.793 -13.244 15.731 258 HB2 GLU 33 2HB GLU 33 -0.629 -10.653 16.729 259 HB3 GLU 33 1HB GLU 33 -1.075 -11.967 17.807 260 HG2 GLU 33 2HG GLU 33 0.855 -12.277 15.537 261 HG3 GLU 33 1HG GLU 33 1.342 -11.853 17.182 262 H LYS 34 H LYS 34 -3.070 -10.068 15.289 263 HA LYS 34 HA LYS 34 -5.176 -10.471 17.266 264 HB2 LYS 34 2HB LYS 34 -4.365 -8.158 15.561 265 HB3 LYS 34 1HB LYS 34 -5.864 -8.165 16.466 266 HG2 LYS 34 2HG LYS 34 -3.122 -8.471 17.666 267 HG3 LYS 34 1HG LYS 34 -4.030 -6.958 17.583 268 HD2 LYS 34 2HD LYS 34 -5.866 -8.078 18.844 269 HD3 LYS 34 1HD LYS 34 -4.816 -9.476 19.049 270 HE2 LYS 34 2HE LYS 34 -3.188 -8.088 20.188 271 HE3 LYS 34 1HE LYS 34 -4.235 -6.682 20.005 272 HZ1 LYS 34 1HZ LYS 34 -4.830 -9.146 21.526 273 HZ2 LYS 34 2HZ LYS 34 -5.923 -7.885 21.295 274 HZ3 LYS 34 3HZ LYS 34 -4.501 -7.616 22.187 275 H GLY 35 H GLY 35 -4.731 -11.020 13.954 276 HA2 GLY 35 2HA GLY 35 -6.152 -11.770 12.325 277 HA3 GLY 35 1HA GLY 35 -7.303 -12.099 13.604 278 H TYR 36 H TYR 36 -6.028 -8.914 12.650 279 HA TYR 36 HA TYR 36 -8.839 -8.100 12.186 280 HB2 TYR 36 2HB TYR 36 -6.416 -6.365 12.678 281 HB3 TYR 36 1HB TYR 36 -8.023 -5.751 12.344 282 HD1 TYR 36 1HD TYR 36 -5.836 -5.812 14.812 283 HD2 TYR 36 2HD TYR 36 -9.749 -7.327 14.081 284 HE1 TYR 36 1HE TYR 36 -6.310 -5.780 17.235 285 HE2 TYR 36 2HE TYR 36 -10.225 -7.288 16.495 286 HH TYR 36 HH TYR 36 -9.021 -7.337 18.586 287 H ASN 37 H ASN 37 -6.910 -9.430 10.226 288 HA ASN 37 HA ASN 37 -6.231 -9.309 8.097 289 HB2 ASN 37 2HB ASN 37 -8.367 -7.160 7.846 290 HB3 ASN 37 1HB ASN 37 -7.455 -7.785 6.482 291 HD21 ASN 37 1HD2 ASN 37 -9.302 -8.503 5.475 292 HD22 ASN 37 2HD2 ASN 37 -10.197 -9.871 6.018 293 HA PRO 38 HA PRO 38 -3.133 -6.183 9.471 294 HB2 PRO 38 2HB PRO 38 -1.302 -7.468 7.724 295 HB3 PRO 38 1HB PRO 38 -1.379 -7.609 9.478 296 HG2 PRO 38 2HG PRO 38 -2.508 -9.387 7.383 297 HG3 PRO 38 1HG PRO 38 -1.893 -9.792 8.995 298 HD2 PRO 38 2HD PRO 38 -4.478 -9.822 8.521 299 HD3 PRO 38 1HD PRO 38 -3.850 -9.136 10.040 300 H ILE 39 H ILE 39 -3.725 -7.336 6.210 301 HA ILE 39 HA ILE 39 -2.346 -5.232 4.941 302 HB ILE 39 HB ILE 39 -4.463 -7.070 3.807 303 HG12 ILE 39 2HG1 ILE 39 -2.598 -8.306 4.774 304 HG13 ILE 39 1HG1 ILE 39 -2.567 -8.411 3.020 305 HG21 ILE 39 1HG2 ILE 39 -3.446 -6.544 1.639 306 HG22 ILE 39 2HG2 ILE 39 -2.354 -5.408 2.430 307 HG23 ILE 39 3HG2 ILE 39 -4.090 -5.094 2.411 308 HD11 ILE 39 1HD1 ILE 39 -0.786 -6.725 2.960 309 HD12 ILE 39 2HD1 ILE 39 -0.324 -8.109 3.953 310 HD13 ILE 39 3HD1 ILE 39 -0.830 -6.612 4.719 311 H ASN 40 H ASN 40 -5.888 -5.690 5.664 312 HA ASN 40 HA ASN 40 -6.782 -3.508 4.294 313 HB2 ASN 40 2HB ASN 40 -8.290 -5.193 4.854 314 HB3 ASN 40 1HB ASN 40 -7.753 -5.246 6.525 315 HD21 ASN 40 1HD2 ASN 40 -8.633 -3.882 7.989 316 HD22 ASN 40 2HD2 ASN 40 -9.933 -2.844 7.589 317 H GLN 41 H GLN 41 -5.488 -3.902 7.494 318 HA GLN 41 HA GLN 41 -6.318 -1.327 8.407 319 HB2 GLN 41 2HB GLN 41 -4.134 -3.084 9.475 320 HB3 GLN 41 1HB GLN 41 -4.924 -1.776 10.341 321 HG2 GLN 41 2HG GLN 41 -6.277 -4.310 9.407 322 HG3 GLN 41 1HG GLN 41 -5.747 -3.980 11.050 323 HE21 GLN 41 1HE2 GLN 41 -6.590 -1.234 11.075 324 HE22 GLN 41 2HE2 GLN 41 -8.308 -1.243 11.121 325 H ILE 42 H ILE 42 -3.323 -2.661 7.053 326 HA ILE 42 HA ILE 42 -1.801 -0.288 7.334 327 HB ILE 42 HB ILE 42 -1.393 -2.607 5.409 328 HG12 ILE 42 2HG1 ILE 42 -0.064 -1.977 8.061 329 HG13 ILE 42 1HG1 ILE 42 -1.285 -3.217 7.803 330 HG21 ILE 42 1HG2 ILE 42 0.510 -0.384 6.173 331 HG22 ILE 42 2HG2 ILE 42 -0.265 -0.584 4.606 332 HG23 ILE 42 3HG2 ILE 42 0.913 -1.774 5.165 333 HD11 ILE 42 1HD1 ILE 42 0.248 -4.413 6.322 334 HD12 ILE 42 2HD1 ILE 42 0.955 -4.170 7.921 335 HD13 ILE 42 3HD1 ILE 42 1.465 -3.162 6.568 336 H VAL 43 H VAL 43 -3.509 -1.684 4.507 337 HA VAL 43 HA VAL 43 -2.968 0.472 2.796 338 HB VAL 43 HB VAL 43 -3.794 -1.660 1.839 339 HG11 VAL 43 1HG1 VAL 43 -5.336 -2.314 3.585 340 HG12 VAL 43 2HG1 VAL 43 -6.159 -2.313 2.026 341 HG13 VAL 43 3HG1 VAL 43 -6.422 -0.990 3.168 342 HG21 VAL 43 1HG2 VAL 43 -5.727 0.588 1.320 343 HG22 VAL 43 2HG2 VAL 43 -5.479 -0.817 0.286 344 HG23 VAL 43 3HG2 VAL 43 -4.170 0.344 0.526 345 H GLY 44 H GLY 44 -5.503 -0.036 5.124 346 HA2 GLY 44 2HA GLY 44 -7.129 2.170 4.473 347 HA3 GLY 44 1HA GLY 44 -7.045 1.397 6.053 348 H TYR 45 H TYR 45 -4.447 1.848 6.777 349 HA TYR 45 HA TYR 45 -4.475 4.490 7.718 350 HB2 TYR 45 2HB TYR 45 -3.163 2.826 8.891 351 HB3 TYR 45 1HB TYR 45 -2.165 2.542 7.469 352 HD1 TYR 45 1HD TYR 45 -0.266 3.908 7.021 353 HD2 TYR 45 2HD TYR 45 -2.963 5.030 10.106 354 HE1 TYR 45 1HE TYR 45 1.325 5.612 7.777 355 HE2 TYR 45 2HE TYR 45 -1.378 6.740 10.877 356 HH TYR 45 HH TYR 45 1.307 7.661 9.009 357 H LEU 46 H LEU 46 -2.773 3.013 5.044 358 HA LEU 46 HA LEU 46 -1.432 5.370 4.302 359 HB2 LEU 46 2HB LEU 46 -1.991 2.858 2.758 360 HB3 LEU 46 1HB LEU 46 -0.869 4.117 2.258 361 HG LEU 46 HG LEU 46 -0.611 2.521 4.809 362 HD11 LEU 46 1HD1 LEU 46 1.254 1.412 3.728 363 HD12 LEU 46 2HD1 LEU 46 0.892 2.265 2.222 364 HD13 LEU 46 3HD1 LEU 46 -0.271 1.113 2.901 365 HD21 LEU 46 1HD2 LEU 46 0.366 4.719 4.997 366 HD22 LEU 46 2HD2 LEU 46 1.252 4.485 3.485 367 HD23 LEU 46 3HD2 LEU 46 1.628 3.501 4.901 368 H LEU 47 H LEU 47 -4.529 4.022 3.304 369 HA LEU 47 HA LEU 47 -4.854 5.936 1.226 370 HB2 LEU 47 2HB LEU 47 -6.906 4.204 2.582 371 HB3 LEU 47 1HB LEU 47 -7.236 5.228 1.204 372 HG LEU 47 HG LEU 47 -5.406 2.830 1.258 373 HD11 LEU 47 1HD1 LEU 47 -7.054 1.846 -0.256 374 HD12 LEU 47 2HD1 LEU 47 -8.056 3.285 -0.095 375 HD13 LEU 47 3HD1 LEU 47 -7.765 2.252 1.305 376 HD21 LEU 47 1HD2 LEU 47 -5.232 3.170 -1.174 377 HD22 LEU 47 2HD2 LEU 47 -4.518 4.500 -0.267 378 HD23 LEU 47 3HD2 LEU 47 -6.104 4.688 -1.019 379 H SER 48 H SER 48 -5.664 5.958 4.649 380 HA SER 48 HA SER 48 -7.140 8.451 4.151 381 HB2 SER 48 2HB SER 48 -8.428 6.614 5.191 382 HB3 SER 48 1HB SER 48 -7.330 6.647 6.568 383 HG SER 48 HG SER 48 -9.508 7.995 6.304 384 H GLY 49 H GLY 49 -4.199 7.322 5.816 385 HA2 GLY 49 2HA GLY 49 -2.653 8.485 6.925 386 HA3 GLY 49 1HA GLY 49 -3.517 9.956 6.513 387 H ASP 50 H ASP 50 -4.661 7.170 8.485 388 HA ASP 50 HA ASP 50 -4.579 8.960 10.801 389 HB2 ASP 50 2HB ASP 50 -6.907 8.967 9.880 390 HB3 ASP 50 1HB ASP 50 -6.994 7.234 10.183 391 HA PRO 51 HA PRO 51 -2.324 5.515 12.523 392 HB2 PRO 51 2HB PRO 51 -3.064 6.965 15.014 393 HB3 PRO 51 1HB PRO 51 -1.490 6.368 14.481 394 HG2 PRO 51 2HG PRO 51 -2.054 8.942 14.306 395 HG3 PRO 51 1HG PRO 51 -1.182 8.122 12.997 396 HD2 PRO 51 2HD PRO 51 -4.037 8.992 13.114 397 HD3 PRO 51 1HD PRO 51 -2.882 9.008 11.764 398 H ALA 52 H ALA 52 -5.655 6.238 13.454 399 HA ALA 52 HA ALA 52 -5.972 4.308 15.484 400 HB1 ALA 52 1HB ALA 52 -8.118 5.342 13.636 401 HB2 ALA 52 2HB ALA 52 -7.567 6.146 15.105 402 HB3 ALA 52 3HB ALA 52 -8.365 4.576 15.204 403 H TYR 53 H TYR 53 -5.549 3.805 12.207 404 HA TYR 53 HA TYR 53 -6.997 1.425 11.847 405 HB2 TYR 53 2HB TYR 53 -4.744 2.701 10.427 406 HB3 TYR 53 1HB TYR 53 -5.145 1.024 10.061 407 HD1 TYR 53 1HD TYR 53 -7.358 0.448 9.306 408 HD2 TYR 53 2HD TYR 53 -6.135 4.486 9.658 409 HE1 TYR 53 1HE TYR 53 -9.173 1.078 7.877 410 HE2 TYR 53 2HE TYR 53 -7.984 5.171 8.186 411 HH TYR 53 HH TYR 53 -9.420 4.190 6.466 412 H ILE 54 H ILE 54 -4.101 2.016 13.641 413 HA ILE 54 HA ILE 54 -3.585 -0.871 13.616 414 HB ILE 54 HB ILE 54 -1.552 1.283 14.275 415 HG12 ILE 54 2HG1 ILE 54 -2.146 1.479 11.901 416 HG13 ILE 54 1HG1 ILE 54 -0.534 0.800 12.067 417 HG21 ILE 54 1HG2 ILE 54 0.083 -0.545 14.042 418 HG22 ILE 54 2HG2 ILE 54 -1.233 -1.675 13.725 419 HG23 ILE 54 3HG2 ILE 54 -1.104 -0.894 15.303 420 HD11 ILE 54 1HD1 ILE 54 -3.050 -0.738 11.447 421 HD12 ILE 54 2HD1 ILE 54 -1.431 -1.423 11.602 422 HD13 ILE 54 3HD1 ILE 54 -1.788 -0.293 10.298 423 HA PRO 55 HA PRO 55 -4.909 -0.370 17.913 424 HB2 PRO 55 2HB PRO 55 -5.106 -3.000 18.434 425 HB3 PRO 55 1HB PRO 55 -6.347 -2.135 17.503 426 HG2 PRO 55 2HG PRO 55 -4.120 -3.895 16.568 427 HG3 PRO 55 1HG PRO 55 -5.789 -3.789 15.976 428 HD2 PRO 55 2HD PRO 55 -3.653 -2.622 14.749 429 HD3 PRO 55 1HD PRO 55 -5.315 -2.007 14.616 430 H ARG 56 H ARG 56 -4.100 -1.079 20.027 431 HA ARG 56 HA ARG 56 -1.236 -1.247 19.954 432 HB2 ARG 56 2HB ARG 56 -2.278 0.325 21.516 433 HB3 ARG 56 1HB ARG 56 -3.040 -1.013 22.365 434 HG2 ARG 56 2HG ARG 56 -0.834 -1.908 22.944 435 HG3 ARG 56 1HG ARG 56 -0.071 -0.558 22.113 436 HD2 ARG 56 2HD ARG 56 -1.187 0.991 23.678 437 HD3 ARG 56 1HD ARG 56 -1.865 -0.400 24.529 438 HE ARG 56 HE ARG 56 0.834 -0.850 24.439 439 HH11 ARG 56 1HH1 ARG 56 -1.238 1.665 25.858 440 HH12 ARG 56 2HH1 ARG 56 -0.090 2.068 27.049 441 HH21 ARG 56 1HH2 ARG 56 2.335 -0.277 26.068 442 HH22 ARG 56 2HH2 ARG 56 1.967 0.973 27.177 443 H TYR 57 H TYR 57 -0.907 -3.276 19.206 444 HA TYR 57 HA TYR 57 -1.127 -5.359 21.287 445 HB2 TYR 57 2HB TYR 57 -1.952 -6.224 19.192 446 HB3 TYR 57 1HB TYR 57 -0.570 -5.587 18.314 447 HD1 TYR 57 1HD TYR 57 -1.475 -8.125 20.922 448 HD2 TYR 57 2HD TYR 57 1.302 -6.927 17.942 449 HE1 TYR 57 1HE TYR 57 -0.303 -10.275 21.155 450 HE2 TYR 57 2HE TYR 57 2.484 -9.065 18.166 451 HH TYR 57 HH TYR 57 1.207 -11.722 19.751 452 H GLN 58 H GLN 58 1.050 -3.558 19.258 453 HA GLN 58 HA GLN 58 3.231 -4.122 21.000 454 HB2 GLN 58 2HB GLN 58 3.119 -6.013 19.299 455 HB3 GLN 58 1HB GLN 58 3.269 -4.833 18.023 456 HG2 GLN 58 2HG GLN 58 5.422 -5.238 20.089 457 HG3 GLN 58 1HG GLN 58 5.313 -6.249 18.659 458 HE21 GLN 58 1HE2 GLN 58 7.418 -4.436 19.535 459 HE22 GLN 58 2HE2 GLN 58 7.604 -3.302 18.248 460 H ASP 59 H ASP 59 5.120 -2.666 20.019 461 HA ASP 59 HA ASP 59 4.348 0.001 19.980 462 HB2 ASP 59 2HB ASP 59 6.899 -1.058 18.768 463 HB3 ASP 59 1HB ASP 59 6.588 0.565 19.305 464 H ALA 60 H ALA 60 4.038 -2.154 17.449 465 HA ALA 60 HA ALA 60 4.759 -0.950 15.127 466 HB1 ALA 60 1HB ALA 60 3.830 -3.199 15.308 467 HB2 ALA 60 2HB ALA 60 3.058 -2.257 14.034 468 HB3 ALA 60 3HB ALA 60 2.228 -2.507 15.570 469 H ARG 61 H ARG 61 1.828 -0.173 16.992 470 HA ARG 61 HA ARG 61 0.719 1.504 14.989 471 HB2 ARG 61 2HB ARG 61 -0.704 2.466 16.773 472 HB3 ARG 61 1HB ARG 61 -0.715 0.713 16.789 473 HG2 ARG 61 2HG ARG 61 0.838 0.723 18.671 474 HG3 ARG 61 1HG ARG 61 0.862 2.485 18.637 475 HD2 ARG 61 2HD ARG 61 -1.569 0.772 19.085 476 HD3 ARG 61 1HD ARG 61 -0.681 1.580 20.363 477 HE ARG 61 HE ARG 61 -2.061 2.993 18.177 478 HH11 ARG 61 1HH1 ARG 61 -1.170 2.781 21.607 479 HH12 ARG 61 2HH1 ARG 61 -2.130 4.092 22.091 480 HH21 ARG 61 1HH2 ARG 61 -3.379 4.758 18.832 481 HH22 ARG 61 2HH2 ARG 61 -3.435 5.265 20.468 482 H ASN 62 H ASN 62 3.030 2.054 17.504 483 HA ASN 62 HA ASN 62 3.223 4.903 17.155 484 HB2 ASN 62 2HB ASN 62 3.900 3.617 19.304 485 HB3 ASN 62 1HB ASN 62 5.189 2.963 18.359 486 HD21 ASN 62 1HD2 ASN 62 3.981 5.919 19.753 487 HD22 ASN 62 2HD2 ASN 62 5.476 6.766 19.687 488 H LEU 63 H LEU 63 4.966 2.036 16.137 489 HA LEU 63 HA LEU 63 7.168 3.235 14.874 490 HB2 LEU 63 2HB LEU 63 5.862 0.620 14.146 491 HB3 LEU 63 1HB LEU 63 7.477 1.120 13.714 492 HG LEU 63 HG LEU 63 6.473 0.497 16.481 493 HD11 LEU 63 1HD1 LEU 63 8.448 -0.920 14.711 494 HD12 LEU 63 2HD1 LEU 63 6.826 -1.473 15.125 495 HD13 LEU 63 3HD1 LEU 63 8.067 -1.352 16.376 496 HD21 LEU 63 1HD2 LEU 63 9.197 1.398 15.574 497 HD22 LEU 63 2HD2 LEU 63 8.798 0.813 17.189 498 HD23 LEU 63 3HD2 LEU 63 8.080 2.311 16.593 499 H ILE 64 H ILE 64 4.040 2.244 13.539 500 HA ILE 64 HA ILE 64 4.674 2.944 10.854 501 HB ILE 64 HB ILE 64 2.760 1.412 11.612 502 HG12 ILE 64 2HG1 ILE 64 1.986 3.676 9.752 503 HG13 ILE 64 1HG1 ILE 64 2.970 2.294 9.291 504 HG21 ILE 64 1HG2 ILE 64 1.461 4.090 12.238 505 HG22 ILE 64 2HG2 ILE 64 1.804 2.814 13.376 506 HG23 ILE 64 3HG2 ILE 64 0.573 2.569 12.126 507 HD11 ILE 64 1HD1 ILE 64 1.087 0.803 9.751 508 HD12 ILE 64 2HD1 ILE 64 0.672 2.027 8.550 509 HD13 ILE 64 3HD1 ILE 64 0.105 2.195 10.211 510 H ARG 65 H ARG 65 3.699 4.625 13.644 511 HA ARG 65 HA ARG 65 2.548 6.884 12.301 512 HB2 ARG 65 2HB ARG 65 1.817 5.781 14.499 513 HB3 ARG 65 1HB ARG 65 3.191 6.613 15.216 514 HG2 ARG 65 2HG ARG 65 2.315 8.666 14.314 515 HG3 ARG 65 1HG ARG 65 0.886 7.793 13.797 516 HD2 ARG 65 2HD ARG 65 0.490 7.061 16.128 517 HD3 ARG 65 1HD ARG 65 1.810 8.115 16.646 518 HE ARG 65 HE ARG 65 0.187 9.735 15.217 519 HH11 ARG 65 1HH1 ARG 65 -0.232 7.698 18.074 520 HH12 ARG 65 2HH1 ARG 65 -1.571 8.575 18.664 521 HH21 ARG 65 1HH2 ARG 65 -1.659 10.933 16.036 522 HH22 ARG 65 2HH2 ARG 65 -2.373 10.479 17.507 523 H ARG 66 H ARG 66 5.589 5.790 13.063 524 HA ARG 66 HA ARG 66 6.810 8.387 13.416 525 HB2 ARG 66 2HB ARG 66 8.063 5.660 12.989 526 HB3 ARG 66 1HB ARG 66 8.958 7.134 13.332 527 HG2 ARG 66 2HG ARG 66 7.800 7.304 15.485 528 HG3 ARG 66 1HG ARG 66 6.986 5.773 15.154 529 HD2 ARG 66 2HD ARG 66 8.916 5.425 16.589 530 HD3 ARG 66 1HD ARG 66 9.183 4.670 15.016 531 HE ARG 66 HE ARG 66 10.206 7.266 14.960 532 HH11 ARG 66 1HH1 ARG 66 10.961 4.155 16.519 533 HH12 ARG 66 2HH1 ARG 66 12.626 4.444 16.602 534 HH21 ARG 66 1HH2 ARG 66 12.442 7.664 15.095 535 HH22 ARG 66 2HH2 ARG 66 13.526 6.512 15.765 536 H HIS 67 H HIS 67 5.380 6.894 11.021 537 HA HIS 67 HA HIS 67 6.967 8.240 9.003 538 HB2 HIS 67 2HB HIS 67 5.527 5.574 8.748 539 HB3 HIS 67 1HB HIS 67 6.217 6.454 7.387 540 HD1 HIS 67 1HD HIS 67 8.743 6.181 6.987 541 HD2 HIS 67 2HD HIS 67 7.474 4.458 10.553 542 HE1 HIS 67 1HE HIS 67 10.700 4.895 7.848 543 HE2 HIS 67 2HE HIS 67 10.013 4.334 10.174 544 H GLU 68 H GLU 68 5.243 8.458 6.965 545 HA GLU 68 HA GLU 68 3.054 9.736 8.375 546 HB2 GLU 68 2HB GLU 68 2.967 11.418 6.552 547 HB3 GLU 68 1HB GLU 68 4.463 11.456 7.468 548 HG2 GLU 68 2HG GLU 68 4.008 10.411 4.665 549 HG3 GLU 68 1HG GLU 68 4.921 11.828 5.144 550 H ARG 69 H ARG 69 3.472 8.795 4.956 551 HA ARG 69 HA ARG 69 1.341 7.020 4.821 552 HB2 ARG 69 2HB ARG 69 -0.149 8.675 5.528 553 HB3 ARG 69 1HB ARG 69 0.418 9.927 4.500 554 HG2 ARG 69 2HG ARG 69 -0.487 8.538 2.582 555 HG3 ARG 69 1HG ARG 69 -1.256 7.545 3.833 556 HD2 ARG 69 2HD ARG 69 -2.318 9.517 4.770 557 HD3 ARG 69 1HD ARG 69 -1.544 10.530 3.559 558 HE ARG 69 HE ARG 69 -3.328 8.393 2.699 559 HH11 ARG 69 1HH1 ARG 69 -2.630 11.865 3.010 560 HH12 ARG 69 2HH1 ARG 69 -4.002 12.372 2.145 561 HH21 ARG 69 1HH2 ARG 69 -5.306 9.159 1.507 562 HH22 ARG 69 2HH2 ARG 69 -5.502 10.834 1.278 563 H ASP 70 H ASP 70 2.243 9.881 2.781 564 HA ASP 70 HA ASP 70 1.970 8.182 0.474 565 HB2 ASP 70 2HB ASP 70 2.490 10.090 -0.966 566 HB3 ASP 70 1HB ASP 70 1.283 10.509 0.233 567 H GLU 71 H GLU 71 4.779 9.441 2.143 568 HA GLU 71 HA GLU 71 6.796 8.750 0.349 569 HB2 GLU 71 2HB GLU 71 6.768 8.485 3.354 570 HB3 GLU 71 1HB GLU 71 8.213 8.420 2.365 571 HG2 GLU 71 2HG GLU 71 6.368 10.793 2.519 572 HG3 GLU 71 1HG GLU 71 7.809 10.590 3.511 573 H ILE 72 H ILE 72 5.197 6.825 2.792 574 HA ILE 72 HA ILE 72 6.512 4.372 2.493 575 HB ILE 72 HB ILE 72 3.622 4.873 3.250 576 HG12 ILE 72 2HG1 ILE 72 6.059 4.597 5.031 577 HG13 ILE 72 1HG1 ILE 72 5.208 6.101 4.689 578 HG21 ILE 72 1HG2 ILE 72 3.991 2.546 2.667 579 HG22 ILE 72 2HG2 ILE 72 3.746 2.707 4.407 580 HG23 ILE 72 3HG2 ILE 72 5.367 2.466 3.766 581 HD11 ILE 72 1HD1 ILE 72 4.063 3.705 6.113 582 HD12 ILE 72 2HD1 ILE 72 3.208 5.209 5.772 583 HD13 ILE 72 3HD1 ILE 72 4.587 5.210 6.870 584 H MET 73 H MET 73 3.562 5.635 1.013 585 HA MET 73 HA MET 73 2.856 3.283 -0.355 586 HB2 MET 73 2HB MET 73 1.410 5.333 0.206 587 HB3 MET 73 1HB MET 73 2.100 6.067 -1.229 588 HG2 MET 73 2HG MET 73 0.505 3.524 -1.148 589 HG3 MET 73 1HG MET 73 -0.123 5.091 -1.631 590 HE1 MET 73 1HE MET 73 -0.124 3.087 -4.969 591 HE2 MET 73 2HE MET 73 -1.063 4.026 -3.810 592 HE3 MET 73 3HE MET 73 -0.449 2.436 -3.360 593 H GLU 74 H GLU 74 4.617 6.192 -1.485 594 HA GLU 74 HA GLU 74 4.999 5.220 -4.099 595 HB2 GLU 74 2HB GLU 74 6.617 7.222 -2.534 596 HB3 GLU 74 1HB GLU 74 6.930 6.821 -4.214 597 HG2 GLU 74 2HG GLU 74 4.655 7.550 -4.772 598 HG3 GLU 74 1HG GLU 74 4.429 8.045 -3.093 599 H GLU 75 H GLU 75 6.706 4.606 -1.159 600 HA GLU 75 HA GLU 75 8.942 3.408 -2.431 601 HB2 GLU 75 2HB GLU 75 8.804 4.335 -0.055 602 HB3 GLU 75 1HB GLU 75 7.954 2.846 0.342 603 HG2 GLU 75 2HG GLU 75 10.361 2.772 0.899 604 HG3 GLU 75 1HG GLU 75 9.865 1.524 -0.248 605 H LEU 76 H LEU 76 5.847 2.275 -1.193 606 HA LEU 76 HA LEU 76 6.190 -0.512 -1.477 607 HB2 LEU 76 2HB LEU 76 3.651 1.060 -1.931 608 HB3 LEU 76 1HB LEU 76 3.763 -0.648 -1.586 609 HG LEU 76 HG LEU 76 4.373 1.615 0.309 610 HD11 LEU 76 1HD1 LEU 76 2.422 0.795 1.513 611 HD12 LEU 76 2HD1 LEU 76 2.146 -0.404 0.250 612 HD13 LEU 76 3HD1 LEU 76 2.005 1.314 -0.120 613 HD21 LEU 76 1HD2 LEU 76 4.436 -1.358 0.771 614 HD22 LEU 76 2HD2 LEU 76 4.614 -0.112 2.010 615 HD23 LEU 76 3HD2 LEU 76 5.830 -0.283 0.748 616 H THR 77 H THR 77 4.797 1.951 -3.676 617 HA THR 77 HA THR 77 4.193 0.222 -5.756 618 HB THR 77 HB THR 77 4.863 3.179 -5.878 619 HG1 THR 77 1HG THR 77 3.055 3.133 -4.632 620 HG21 THR 77 1HG2 THR 77 4.850 2.101 -8.108 621 HG22 THR 77 2HG2 THR 77 3.475 3.187 -7.911 622 HG23 THR 77 3HG2 THR 77 3.248 1.445 -7.772 623 H LYS 78 H LYS 78 7.184 2.019 -5.091 624 HA LYS 78 HA LYS 78 8.424 1.331 -7.521 625 HB2 LYS 78 2HB LYS 78 9.709 2.059 -4.906 626 HB3 LYS 78 1HB LYS 78 10.614 1.791 -6.387 627 HG2 LYS 78 2HG LYS 78 9.202 3.558 -7.411 628 HG3 LYS 78 1HG LYS 78 8.628 3.954 -5.792 629 HD2 LYS 78 2HD LYS 78 11.514 4.000 -6.721 630 HD3 LYS 78 1HD LYS 78 10.506 5.411 -6.425 631 HE2 LYS 78 2HE LYS 78 11.289 3.363 -4.357 632 HE3 LYS 78 1HE LYS 78 12.065 4.925 -4.586 633 HZ1 LYS 78 1HZ LYS 78 10.455 4.924 -2.794 634 HZ2 LYS 78 2HZ LYS 78 9.199 4.559 -3.893 635 HZ3 LYS 78 3HZ LYS 78 10.050 6.022 -4.031 636 H TYR 79 H TYR 79 8.519 -0.226 -4.396 637 HA TYR 79 HA TYR 79 10.443 -2.155 -5.154 638 HB2 TYR 79 2HB TYR 79 10.020 -1.756 -2.799 639 HB3 TYR 79 1HB TYR 79 8.360 -2.324 -2.976 640 HD1 TYR 79 1HD TYR 79 11.877 -3.422 -3.364 641 HD2 TYR 79 2HD TYR 79 7.860 -4.574 -2.630 642 HE1 TYR 79 1HE TYR 79 12.621 -5.723 -2.910 643 HE2 TYR 79 2HE TYR 79 8.597 -6.872 -2.171 644 HH TYR 79 HH TYR 79 11.843 -7.667 -1.710 645 H TYR 80 H TYR 80 6.955 -2.210 -5.242 646 HA TYR 80 HA TYR 80 6.495 -4.862 -5.966 647 HB2 TYR 80 2HB TYR 80 4.797 -3.191 -5.269 648 HB3 TYR 80 1HB TYR 80 5.007 -2.365 -6.799 649 HD1 TYR 80 1HD TYR 80 3.579 -5.256 -5.102 650 HD2 TYR 80 2HD TYR 80 4.028 -3.298 -8.850 651 HE1 TYR 80 1HE TYR 80 1.745 -6.607 -6.019 652 HE2 TYR 80 2HE TYR 80 2.192 -4.636 -9.774 653 HH TYR 80 HH TYR 80 0.123 -6.458 -7.793 654 H LEU 81 H LEU 81 6.953 -1.988 -7.982 655 HA LEU 81 HA LEU 81 6.953 -3.464 -10.412 656 HB2 LEU 81 2HB LEU 81 7.709 -0.614 -9.838 657 HB3 LEU 81 1HB LEU 81 7.578 -1.308 -11.448 658 HG LEU 81 HG LEU 81 5.307 -1.067 -9.466 659 HD11 LEU 81 1HD1 LEU 81 4.424 0.605 -11.000 660 HD12 LEU 81 2HD1 LEU 81 5.885 0.460 -11.980 661 HD13 LEU 81 3HD1 LEU 81 5.987 1.096 -10.338 662 HD21 LEU 81 1HD2 LEU 81 3.901 -1.746 -11.348 663 HD22 LEU 81 2HD2 LEU 81 5.053 -3.011 -10.931 664 HD23 LEU 81 3HD2 LEU 81 5.336 -1.994 -12.339 665 H ALA 82 H ALA 82 9.471 -2.470 -8.211 666 HA ALA 82 HA ALA 82 11.653 -2.565 -9.941 667 HB1 ALA 82 1HB ALA 82 11.731 -1.613 -7.676 668 HB2 ALA 82 2HB ALA 82 13.029 -2.776 -7.961 669 HB3 ALA 82 3HB ALA 82 11.622 -3.242 -7.006 670 H ASN 83 H ASN 83 10.046 -5.146 -8.169 671 HA ASN 83 HA ASN 83 12.044 -7.077 -8.873 672 HB2 ASN 83 2HB ASN 83 9.240 -7.576 -7.852 673 HB3 ASN 83 1HB ASN 83 10.450 -8.823 -8.087 674 HD21 ASN 83 1HD2 ASN 83 9.145 -8.277 -5.736 675 HD22 ASN 83 2HD2 ASN 83 10.288 -7.755 -4.534 676 H HIS 84 H HIS 84 9.992 -5.554 -10.813 677 HA HIS 84 HA HIS 84 9.439 -7.806 -12.601 678 HB2 HIS 84 2HB HIS 84 8.633 -4.889 -12.641 679 HB3 HIS 84 1HB HIS 84 8.439 -5.906 -14.059 680 HD1 HIS 84 1HD HIS 84 7.243 -5.824 -10.390 681 HD2 HIS 84 2HD HIS 84 6.109 -7.220 -14.144 682 HE1 HIS 84 1HE HIS 84 4.989 -6.812 -10.078 683 HE2 HIS 84 2HE HIS 84 4.661 -8.083 -12.244 684 H GLY 85 H GLY 85 12.123 -6.475 -11.894 685 HA2 GLY 85 2HA GLY 85 14.129 -6.342 -13.028 686 HA3 GLY 85 1HA GLY 85 13.266 -6.716 -14.517 687 H ILE 86 H ILE 86 12.105 -4.199 -12.572 688 HA ILE 86 HA ILE 86 12.880 -2.276 -14.623 689 HB ILE 86 HB ILE 86 10.792 -2.055 -12.448 690 HG12 ILE 86 2HG1 ILE 86 10.481 -2.457 -15.426 691 HG13 ILE 86 1HG1 ILE 86 10.166 -3.673 -14.191 692 HG21 ILE 86 1HG2 ILE 86 10.076 -0.022 -13.626 693 HG22 ILE 86 2HG2 ILE 86 11.430 -0.198 -14.741 694 HG23 ILE 86 3HG2 ILE 86 11.731 0.114 -13.031 695 HD11 ILE 86 1HD1 ILE 86 8.731 -1.071 -14.528 696 HD12 ILE 86 2HD1 ILE 86 8.382 -2.279 -13.294 697 HD13 ILE 86 3HD1 ILE 86 8.103 -2.665 -14.998 698 H ASP 87 H ASP 87 14.336 -0.840 -14.168 699 HA ASP 87 HA ASP 87 15.059 -0.403 -11.370 700 HB2 ASP 87 2HB ASP 87 16.964 -0.934 -12.824 701 HB3 ASP 87 1HB ASP 87 16.533 0.394 -13.897 702 H ILE 88 H ILE 88 14.318 1.336 -10.419 703 HA ILE 88 HA ILE 88 12.867 3.177 -12.139 704 HB ILE 88 HB ILE 88 12.623 2.739 -9.184 705 HG12 ILE 88 2HG1 ILE 88 10.865 1.830 -11.472 706 HG13 ILE 88 1HG1 ILE 88 11.939 0.799 -10.536 707 HG21 ILE 88 1HG2 ILE 88 10.546 4.068 -9.365 708 HG22 ILE 88 2HG2 ILE 88 10.896 4.360 -11.073 709 HG23 ILE 88 3HG2 ILE 88 11.962 5.009 -9.827 710 HD11 ILE 88 1HD1 ILE 88 9.575 2.288 -9.464 711 HD12 ILE 88 2HD1 ILE 88 10.605 1.184 -8.566 712 HD13 ILE 88 3HD1 ILE 88 9.598 0.573 -9.886 713 H LYS 89 H LYS 89 13.482 5.048 -12.420 714 HA LYS 89 HA LYS 89 15.650 6.233 -10.837 715 HB2 LYS 89 2HB LYS 89 16.062 5.982 -13.239 716 HB3 LYS 89 1HB LYS 89 14.608 6.901 -13.590 717 HG2 LYS 89 2HG LYS 89 15.571 8.842 -12.523 718 HG3 LYS 89 1HG LYS 89 17.048 7.936 -12.181 719 HD2 LYS 89 2HD LYS 89 17.359 7.579 -14.594 720 HD3 LYS 89 1HD LYS 89 15.911 8.538 -14.914 721 HE2 LYS 89 2HE LYS 89 16.985 10.468 -13.835 722 HE3 LYS 89 1HE LYS 89 18.431 9.497 -13.568 723 HZ1 LYS 89 1HZ LYS 89 18.599 9.225 -15.984 724 HZ2 LYS 89 2HZ LYS 89 18.685 10.851 -15.529 725 HZ3 LYS 89 3HZ LYS 89 17.264 10.218 -16.195 726 H1 MET 1 H MET 1 -13.635 8.906 19.979 727 HA MET 1 HA MET 1 -15.389 10.808 18.773 728 HB2 MET 1 2HB MET 1 -12.865 9.930 17.336 729 HB3 MET 1 1HB MET 1 -14.218 10.727 16.568 730 HG2 MET 1 2HG MET 1 -12.490 12.331 16.881 731 HG3 MET 1 1HG MET 1 -13.779 12.717 18.009 732 HE1 MET 1 1HE MET 1 -10.514 13.867 19.848 733 HE2 MET 1 2HE MET 1 -12.090 14.351 19.227 734 HE3 MET 1 3HE MET 1 -10.803 13.902 18.109 735 H GLY 2 H GLY 2 -16.054 9.730 16.538 736 HA2 GLY 2 2HA GLY 2 -16.273 6.831 16.974 737 HA3 GLY 2 1HA GLY 2 -17.545 7.823 16.264 738 H PHE 3 H PHE 3 -14.127 7.105 15.815 739 HA PHE 3 HA PHE 3 -14.026 7.931 13.127 740 HB2 PHE 3 2HB PHE 3 -12.015 7.916 14.467 741 HB3 PHE 3 1HB PHE 3 -12.160 6.187 14.737 742 HD1 PHE 3 1HD PHE 3 -11.597 8.720 12.081 743 HD2 PHE 3 2HD PHE 3 -11.146 4.659 13.262 744 HE1 PHE 3 1HE PHE 3 -10.207 8.303 10.100 745 HE2 PHE 3 2HE PHE 3 -9.755 4.233 11.284 746 HZ PHE 3 HZ PHE 3 -9.284 6.057 9.700 747 H THR 4 H THR 4 -14.838 7.007 11.436 748 HA THR 4 HA THR 4 -14.436 4.213 10.984 749 HB THR 4 HB THR 4 -17.217 5.434 10.696 750 HG1 THR 4 1HG THR 4 -15.982 4.182 12.770 751 HG21 THR 4 1HG2 THR 4 -16.663 3.740 8.987 752 HG22 THR 4 2HG2 THR 4 -17.894 3.142 10.096 753 HG23 THR 4 3HG2 THR 4 -16.224 2.603 10.259 754 H ASP 5 H ASP 5 -13.050 4.764 9.385 755 HA ASP 5 HA ASP 5 -13.681 6.790 7.442 756 HB2 ASP 5 2HB ASP 5 -11.362 6.381 8.222 757 HB3 ASP 5 1HB ASP 5 -11.432 4.768 7.540 758 H GLU 6 H GLU 6 -14.885 6.443 5.713 759 HA GLU 6 HA GLU 6 -15.902 3.790 5.308 760 HB2 GLU 6 2HB GLU 6 -17.428 5.665 5.370 761 HB3 GLU 6 1HB GLU 6 -16.645 6.378 3.971 762 HG2 GLU 6 2HG GLU 6 -17.337 4.448 2.623 763 HG3 GLU 6 1HG GLU 6 -18.159 3.777 4.033 764 H THR 7 H THR 7 -14.707 2.463 4.203 765 HA THR 7 HA THR 7 -14.158 3.237 1.483 766 HB THR 7 HB THR 7 -11.994 3.145 2.623 767 HG1 THR 7 1HG THR 7 -12.386 0.916 0.913 768 HG21 THR 7 1HG2 THR 7 -12.663 0.300 3.410 769 HG22 THR 7 2HG2 THR 7 -12.513 1.676 4.500 770 HG23 THR 7 3HG2 THR 7 -11.092 1.069 3.644 771 H VAL 8 H VAL 8 -15.992 2.423 0.760 772 HA VAL 8 HA VAL 8 -16.799 -0.180 1.715 773 HB VAL 8 HB VAL 8 -18.439 1.572 2.021 774 HG11 VAL 8 1HG1 VAL 8 -18.439 1.895 -0.965 775 HG12 VAL 8 2HG1 VAL 8 -17.861 3.062 0.226 776 HG13 VAL 8 3HG1 VAL 8 -19.576 2.656 0.149 777 HG21 VAL 8 1HG2 VAL 8 -19.329 -0.415 -0.077 778 HG22 VAL 8 2HG2 VAL 8 -20.405 0.520 0.964 779 HG23 VAL 8 3HG2 VAL 8 -19.313 -0.670 1.669 780 H ARG 9 H ARG 9 -16.930 -1.920 0.521 781 HA ARG 9 HA ARG 9 -16.299 -1.689 -2.304 782 HB2 ARG 9 2HB ARG 9 -16.168 -4.049 -0.440 783 HB3 ARG 9 1HB ARG 9 -16.015 -4.212 -2.179 784 HG2 ARG 9 2HG ARG 9 -14.068 -2.736 -2.137 785 HG3 ARG 9 1HG ARG 9 -14.221 -2.603 -0.384 786 HD2 ARG 9 2HD ARG 9 -13.789 -4.948 -0.109 787 HD3 ARG 9 1HD ARG 9 -13.836 -5.209 -1.856 788 HE ARG 9 HE ARG 9 -11.895 -3.332 -1.512 789 HH11 ARG 9 1HH1 ARG 9 -12.293 -6.608 -0.176 790 HH12 ARG 9 2HH1 ARG 9 -10.612 -6.841 -0.087 791 HH21 ARG 9 1HH2 ARG 9 -9.841 -3.661 -1.372 792 HH22 ARG 9 2HH2 ARG 9 -9.087 -5.091 -0.767 793 H PHE 10 H PHE 10 -18.216 -1.056 -3.089 794 HA PHE 10 HA PHE 10 -20.589 -2.653 -2.612 795 HB2 PHE 10 2HB PHE 10 -20.719 -0.157 -2.969 796 HB3 PHE 10 1HB PHE 10 -20.158 -0.410 -4.617 797 HD1 PHE 10 1HD PHE 10 -22.929 -0.980 -2.268 798 HD2 PHE 10 2HD PHE 10 -21.664 -1.145 -6.328 799 HE1 PHE 10 1HE PHE 10 -25.259 -1.296 -2.976 800 HE2 PHE 10 2HE PHE 10 -23.997 -1.462 -7.041 801 HZ PHE 10 HZ PHE 10 -25.797 -1.536 -5.366 802 H ASP 11 H ASP 11 -18.306 -1.944 -5.156 803 HA ASP 11 HA ASP 11 -18.896 -4.539 -6.354 804 HB2 ASP 11 2HB ASP 11 -19.788 -2.843 -7.884 805 HB3 ASP 11 1HB ASP 11 -18.254 -1.977 -7.849 806 H PHE 12 H PHE 12 -17.160 -5.780 -6.447 807 HA PHE 12 HA PHE 12 -14.530 -4.615 -6.593 808 HB2 PHE 12 2HB PHE 12 -13.711 -5.706 -4.551 809 HB3 PHE 12 1HB PHE 12 -14.977 -4.551 -4.168 810 HD1 PHE 12 1HD PHE 12 -17.274 -5.415 -3.587 811 HD2 PHE 12 2HD PHE 12 -13.917 -7.998 -4.007 812 HE1 PHE 12 1HE PHE 12 -18.477 -7.173 -2.363 813 HE2 PHE 12 2HE PHE 12 -15.120 -9.762 -2.784 814 HZ PHE 12 HZ PHE 12 -17.403 -9.349 -1.959 815 H ASP 13 H ASP 13 -12.946 -6.261 -6.929 816 HA ASP 13 HA ASP 13 -14.109 -8.635 -8.161 817 HB2 ASP 13 2HB ASP 13 -12.794 -7.310 -9.674 818 HB3 ASP 13 1HB ASP 13 -11.449 -7.256 -8.540 819 H ASP 14 H ASP 14 -13.036 -10.666 -7.805 820 HA ASP 14 HA ASP 14 -11.409 -10.739 -5.362 821 HB2 ASP 14 2HB ASP 14 -13.784 -11.247 -4.816 822 HB3 ASP 14 1HB ASP 14 -13.757 -12.559 -5.984 823 H ASN 15 H ASN 15 -11.203 -11.124 -8.453 824 HA ASN 15 HA ASN 15 -10.154 -13.852 -8.504 825 HB2 ASN 15 2HB ASN 15 -10.696 -11.962 -10.815 826 HB3 ASN 15 1HB ASN 15 -10.164 -13.631 -10.950 827 HD21 ASN 15 1HD2 ASN 15 -12.772 -11.511 -10.265 828 HD22 ASN 15 2HD2 ASN 15 -14.037 -12.669 -10.279 829 H ARG 16 H ARG 16 -8.332 -13.172 -7.245 830 HA ARG 16 HA ARG 16 -6.728 -11.189 -8.517 831 HB2 ARG 16 2HB ARG 16 -6.415 -12.457 -5.850 832 HB3 ARG 16 1HB ARG 16 -5.182 -11.429 -6.559 833 HG2 ARG 16 2HG ARG 16 -6.909 -9.645 -6.785 834 HG3 ARG 16 1HG ARG 16 -7.999 -10.677 -5.851 835 HD2 ARG 16 2HD ARG 16 -6.452 -10.711 -4.020 836 HD3 ARG 16 1HD ARG 16 -5.281 -9.793 -4.959 837 HE ARG 16 HE ARG 16 -7.883 -8.600 -4.475 838 HH11 ARG 16 1HH1 ARG 16 -4.394 -8.537 -4.074 839 HH12 ARG 16 2HH1 ARG 16 -4.388 -7.182 -3.020 840 HH21 ARG 16 1HH2 ARG 16 -7.913 -6.772 -3.091 841 HH22 ARG 16 2HH2 ARG 16 -6.521 -6.119 -2.401 842 H LYS 17 H LYS 17 -6.037 -11.968 -10.221 843 HA LYS 17 HA LYS 17 -3.877 -13.958 -10.136 844 HB2 LYS 17 2HB LYS 17 -5.543 -14.006 -12.029 845 HB3 LYS 17 1HB LYS 17 -5.108 -12.354 -12.416 846 HG2 LYS 17 2HG LYS 17 -2.786 -13.159 -12.900 847 HG3 LYS 17 1HG LYS 17 -3.374 -14.808 -12.677 848 HD2 LYS 17 2HD LYS 17 -5.026 -14.433 -14.466 849 HD3 LYS 17 1HD LYS 17 -4.384 -12.809 -14.695 850 HE2 LYS 17 2HE LYS 17 -2.885 -15.400 -15.103 851 HE3 LYS 17 1HE LYS 17 -3.507 -14.356 -16.367 852 HZ1 LYS 17 1HZ LYS 17 -1.340 -13.634 -14.439 853 HZ2 LYS 17 2HZ LYS 17 -1.917 -12.609 -15.643 854 HZ3 LYS 17 3HZ LYS 17 -1.170 -14.060 -16.044 855 H LYS 18 H LYS 18 -1.761 -13.046 -11.045 856 HA LYS 18 HA LYS 18 -1.340 -10.389 -10.124 857 HB2 LYS 18 2HB LYS 18 0.483 -12.415 -11.375 858 HB3 LYS 18 1HB LYS 18 1.011 -10.749 -11.163 859 HG2 LYS 18 2HG LYS 18 0.528 -10.943 -8.751 860 HG3 LYS 18 1HG LYS 18 0.106 -12.639 -9.002 861 HD2 LYS 18 2HD LYS 18 2.336 -13.161 -9.689 862 HD3 LYS 18 1HD LYS 18 2.777 -11.451 -9.731 863 HE2 LYS 18 2HE LYS 18 3.661 -12.550 -7.734 864 HE3 LYS 18 1HE LYS 18 2.497 -11.303 -7.320 865 HZ1 LYS 18 1HZ LYS 18 2.175 -13.278 -6.010 866 HZ2 LYS 18 2HZ LYS 18 1.935 -14.219 -7.393 867 HZ3 LYS 18 3HZ LYS 18 0.833 -13.008 -6.970 868 H ALA 19 H ALA 19 -3.236 -10.569 -12.133 869 HA ALA 19 HA ALA 19 -2.376 -9.490 -14.603 870 HB1 ALA 19 1HB ALA 19 -4.712 -8.836 -14.834 871 HB2 ALA 19 2HB ALA 19 -4.937 -9.190 -13.115 872 HB3 ALA 19 3HB ALA 19 -4.574 -10.511 -14.242 873 H ILE 20 H ILE 20 -3.115 -8.279 -11.447 874 HA ILE 20 HA ILE 20 -3.227 -5.516 -11.995 875 HB ILE 20 HB ILE 20 -2.320 -6.941 -9.466 876 HG12 ILE 20 2HG1 ILE 20 -5.043 -5.864 -10.252 877 HG13 ILE 20 1HG1 ILE 20 -4.601 -7.560 -10.131 878 HG21 ILE 20 1HG2 ILE 20 -1.577 -4.620 -9.491 879 HG22 ILE 20 2HG2 ILE 20 -2.862 -4.847 -8.302 880 HG23 ILE 20 3HG2 ILE 20 -3.218 -4.087 -9.855 881 HD11 ILE 20 1HD1 ILE 20 -5.895 -6.847 -8.206 882 HD12 ILE 20 2HD1 ILE 20 -4.718 -5.586 -7.857 883 HD13 ILE 20 3HD1 ILE 20 -4.257 -7.283 -7.714 884 H SER 21 H SER 21 -0.675 -7.802 -11.498 885 HA SER 21 HA SER 21 1.461 -5.906 -11.201 886 HB2 SER 21 2HB SER 21 1.605 -8.805 -12.080 887 HB3 SER 21 1HB SER 21 2.931 -7.831 -11.445 888 HG SER 21 HG SER 21 1.242 -7.632 -9.567 889 H GLU 22 H GLU 22 0.129 -7.905 -13.757 890 HA GLU 22 HA GLU 22 1.805 -7.195 -15.863 891 HB2 GLU 22 2HB GLU 22 -1.121 -7.964 -15.935 892 HB3 GLU 22 1HB GLU 22 -0.027 -7.998 -17.306 893 HG2 GLU 22 2HG GLU 22 1.311 -9.721 -16.206 894 HG3 GLU 22 1HG GLU 22 0.240 -9.673 -14.812 895 H THR 23 H THR 23 -1.149 -5.754 -14.645 896 HA THR 23 HA THR 23 -1.496 -3.822 -16.662 897 HB THR 23 HB THR 23 -2.417 -3.801 -13.778 898 HG1 THR 23 1HG THR 23 -3.157 -5.570 -15.062 899 HG21 THR 23 1HG2 THR 23 -4.148 -2.224 -14.551 900 HG22 THR 23 2HG2 THR 23 -3.398 -2.190 -16.150 901 HG23 THR 23 3HG2 THR 23 -2.529 -1.557 -14.755 902 H LEU 24 H LEU 24 -0.044 -3.529 -13.390 903 HA LEU 24 HA LEU 24 0.584 -0.805 -13.707 904 HB2 LEU 24 2HB LEU 24 1.759 -2.806 -11.783 905 HB3 LEU 24 1HB LEU 24 1.991 -1.070 -11.703 906 HG LEU 24 HG LEU 24 -0.638 -2.513 -11.370 907 HD11 LEU 24 1HD1 LEU 24 0.834 -2.827 -9.479 908 HD12 LEU 24 2HD1 LEU 24 -0.495 -1.744 -9.061 909 HD13 LEU 24 3HD1 LEU 24 1.109 -1.088 -9.386 910 HD21 LEU 24 1HD2 LEU 24 -0.978 -0.329 -12.403 911 HD22 LEU 24 2HD2 LEU 24 0.024 0.428 -11.164 912 HD23 LEU 24 3HD2 LEU 24 -1.517 -0.303 -10.724 913 H GLU 25 H GLU 25 2.332 -3.691 -14.533 914 HA GLU 25 HA GLU 25 4.878 -2.721 -14.979 915 HB2 GLU 25 2HB GLU 25 4.238 -5.082 -15.064 916 HB3 GLU 25 1HB GLU 25 3.220 -4.788 -16.449 917 HG2 GLU 25 2HG GLU 25 6.214 -4.481 -16.487 918 HG3 GLU 25 1HG GLU 25 5.395 -5.994 -16.850 919 H THR 26 H THR 26 2.050 -2.777 -17.145 920 HA THR 26 HA THR 26 3.371 -1.402 -19.247 921 HB THR 26 HB THR 26 0.408 -1.810 -18.821 922 HG1 THR 26 1HG THR 26 2.467 -3.555 -19.374 923 HG21 THR 26 1HG2 THR 26 1.030 -0.144 -20.523 924 HG22 THR 26 2HG2 THR 26 0.292 -1.571 -21.268 925 HG23 THR 26 3HG2 THR 26 2.044 -1.333 -21.324 926 H VAL 27 H VAL 27 1.186 -0.437 -16.630 927 HA VAL 27 HA VAL 27 0.684 2.207 -17.448 928 HB VAL 27 HB VAL 27 0.853 1.153 -14.592 929 HG11 VAL 27 1HG1 VAL 27 0.989 3.582 -14.700 930 HG12 VAL 27 2HG1 VAL 27 -0.565 3.061 -14.023 931 HG13 VAL 27 3HG1 VAL 27 -0.466 3.601 -15.705 932 HG21 VAL 27 1HG2 VAL 27 -1.544 1.507 -16.388 933 HG22 VAL 27 2HG2 VAL 27 -1.565 0.950 -14.720 934 HG23 VAL 27 3HG2 VAL 27 -0.804 -0.038 -15.969 935 H TYR 28 H TYR 28 3.328 0.808 -15.600 936 HA TYR 28 HA TYR 28 4.647 3.189 -14.907 937 HB2 TYR 28 2HB TYR 28 5.216 0.994 -13.905 938 HB3 TYR 28 1HB TYR 28 5.852 0.453 -15.451 939 HD1 TYR 28 1HD TYR 28 7.954 1.503 -16.343 940 HD2 TYR 28 2HD TYR 28 6.531 2.350 -12.430 941 HE1 TYR 28 1HE TYR 28 10.167 2.399 -15.733 942 HE2 TYR 28 2HE TYR 28 8.738 3.241 -11.814 943 HH TYR 28 HH TYR 28 11.137 3.936 -14.096 944 H ARG 29 H ARG 29 4.893 1.069 -17.709 945 HA ARG 29 HA ARG 29 7.069 2.328 -18.963 946 HB2 ARG 29 2HB ARG 29 4.803 0.857 -20.302 947 HB3 ARG 29 1HB ARG 29 6.352 1.205 -21.031 948 HG2 ARG 29 2HG ARG 29 5.721 -0.705 -18.804 949 HG3 ARG 29 1HG ARG 29 6.384 -1.059 -20.396 950 HD2 ARG 29 2HD ARG 29 7.758 0.379 -18.128 951 HD3 ARG 29 1HD ARG 29 8.106 -1.235 -18.722 952 HE ARG 29 HE ARG 29 8.401 0.744 -20.742 953 HH11 ARG 29 1HH1 ARG 29 10.000 -0.814 -18.007 954 HH12 ARG 29 2HH1 ARG 29 11.571 -0.354 -18.446 955 HH21 ARG 29 1HH2 ARG 29 10.571 1.420 -21.380 956 HH22 ARG 29 2HH2 ARG 29 11.898 0.970 -20.427 957 H ALA 30 H ALA 30 3.625 2.796 -19.264 958 HA ALA 30 HA ALA 30 3.609 4.679 -21.330 959 HB1 ALA 30 1HB ALA 30 1.701 4.438 -19.002 960 HB2 ALA 30 2HB ALA 30 1.582 3.566 -20.526 961 HB3 ALA 30 3HB ALA 30 1.384 5.320 -20.492 962 H LEU 31 H LEU 31 3.770 5.136 -17.851 963 HA LEU 31 HA LEU 31 3.833 7.962 -18.044 964 HB2 LEU 31 2HB LEU 31 4.252 6.099 -15.773 965 HB3 LEU 31 1HB LEU 31 4.392 7.836 -15.609 966 HG LEU 31 HG LEU 31 1.921 6.605 -16.742 967 HD11 LEU 31 1HD1 LEU 31 2.306 5.654 -14.471 968 HD12 LEU 31 2HD1 LEU 31 0.946 6.777 -14.488 969 HD13 LEU 31 3HD1 LEU 31 2.502 7.294 -13.851 970 HD21 LEU 31 1HD2 LEU 31 2.236 8.942 -17.132 971 HD22 LEU 31 2HD2 LEU 31 2.567 9.207 -15.421 972 HD23 LEU 31 3HD2 LEU 31 0.954 8.718 -15.936 973 H GLU 32 H GLU 32 6.411 5.577 -17.912 974 HA GLU 32 HA GLU 32 8.265 7.652 -17.292 975 HB2 GLU 32 2HB GLU 32 10.066 6.017 -17.666 976 HB3 GLU 32 1HB GLU 32 8.864 5.454 -16.510 977 HG2 GLU 32 2HG GLU 32 9.425 3.560 -17.740 978 HG3 GLU 32 1HG GLU 32 7.951 4.122 -18.525 979 H GLU 33 H GLU 33 7.085 6.282 -20.124 980 HA GLU 33 HA GLU 33 8.711 7.700 -21.986 981 HB2 GLU 33 2HB GLU 33 5.984 6.474 -22.153 982 HB3 GLU 33 1HB GLU 33 6.645 7.391 -23.496 983 HG2 GLU 33 2HG GLU 33 8.008 5.025 -22.254 984 HG3 GLU 33 1HG GLU 33 6.926 4.927 -23.647 985 H LYS 34 H LYS 34 5.770 8.492 -20.281 986 HA LYS 34 HA LYS 34 5.467 10.987 -21.738 987 HB2 LYS 34 2HB LYS 34 3.824 9.843 -19.487 988 HB3 LYS 34 1HB LYS 34 3.435 11.306 -20.372 989 HG2 LYS 34 2HG LYS 34 3.633 8.544 -21.568 990 HG3 LYS 34 1HG LYS 34 2.134 9.358 -21.129 991 HD2 LYS 34 2HD LYS 34 4.111 10.434 -23.159 992 HD3 LYS 34 1HD LYS 34 2.709 9.447 -23.545 993 HE2 LYS 34 2HE LYS 34 1.233 11.012 -22.716 994 HE3 LYS 34 1HE LYS 34 2.521 12.059 -22.073 995 HZ1 LYS 34 1HZ LYS 34 3.255 12.382 -24.386 996 HZ2 LYS 34 2HZ LYS 34 1.683 12.923 -24.183 997 HZ3 LYS 34 3HZ LYS 34 1.975 11.452 -24.947 998 H GLY 35 H GLY 35 7.122 9.989 -19.009 999 HA2 GLY 35 2HA GLY 35 8.501 11.139 -17.612 1000 HA3 GLY 35 1HA GLY 35 8.236 12.539 -18.620 1001 H TYR 36 H TYR 36 5.780 10.800 -16.684 1002 HA TYR 36 HA TYR 36 5.391 13.365 -15.248 1003 HB2 TYR 36 2HB TYR 36 3.406 11.117 -15.615 1004 HB3 TYR 36 1HB TYR 36 3.104 12.617 -14.759 1005 HD1 TYR 36 1HD TYR 36 2.286 10.975 -17.571 1006 HD2 TYR 36 2HD TYR 36 3.917 14.735 -16.431 1007 HE1 TYR 36 1HE TYR 36 1.451 11.986 -19.665 1008 HE2 TYR 36 2HE TYR 36 3.080 15.742 -18.514 1009 HH TYR 36 HH TYR 36 2.470 15.010 -20.748 1010 H ASN 37 H ASN 37 7.175 10.933 -14.703 1011 HA ASN 37 HA ASN 37 7.874 9.645 -13.060 1012 HB2 ASN 37 2HB ASN 37 6.352 11.598 -11.336 1013 HB3 ASN 37 1HB ASN 37 7.268 10.270 -10.639 1014 HD21 ASN 37 1HD2 ASN 37 9.499 10.301 -10.829 1015 HD22 ASN 37 2HD2 ASN 37 10.379 11.749 -11.151 1016 HA PRO 38 HA PRO 38 4.342 6.868 -13.663 1017 HB2 PRO 38 2HB PRO 38 5.985 4.707 -12.870 1018 HB3 PRO 38 1HB PRO 38 5.563 5.176 -14.513 1019 HG2 PRO 38 2HG PRO 38 7.993 5.811 -12.926 1020 HG3 PRO 38 1HG PRO 38 7.822 5.553 -14.671 1021 HD2 PRO 38 2HD PRO 38 8.199 7.959 -13.705 1022 HD3 PRO 38 1HD PRO 38 7.046 7.700 -15.034 1023 H ILE 39 H ILE 39 6.542 6.771 -10.921 1024 HA ILE 39 HA ILE 39 4.832 5.197 -9.286 1025 HB ILE 39 HB ILE 39 7.098 7.021 -8.458 1026 HG12 ILE 39 2HG1 ILE 39 7.837 5.390 -10.107 1027 HG13 ILE 39 1HG1 ILE 39 8.494 4.997 -8.527 1028 HG21 ILE 39 1HG2 ILE 39 5.674 6.404 -6.583 1029 HG22 ILE 39 2HG2 ILE 39 7.234 5.588 -6.465 1030 HG23 ILE 39 3HG2 ILE 39 5.813 4.700 -7.020 1031 HD11 ILE 39 1HD1 ILE 39 7.760 2.993 -9.717 1032 HD12 ILE 39 2HD1 ILE 39 6.141 3.655 -9.862 1033 HD13 ILE 39 3HD1 ILE 39 6.784 3.248 -8.271 1034 H ASN 40 H ASN 40 5.360 8.712 -9.651 1035 HA ASN 40 HA ASN 40 3.925 9.468 -7.423 1036 HB2 ASN 40 2HB ASN 40 5.598 10.892 -8.220 1037 HB3 ASN 40 1HB ASN 40 5.024 10.773 -9.873 1038 HD21 ASN 40 1HD2 ASN 40 3.454 12.063 -10.566 1039 HD22 ASN 40 2HD2 ASN 40 2.834 13.344 -9.600 1040 H GLN 41 H GLN 41 3.066 9.023 -10.826 1041 HA GLN 41 HA GLN 41 0.449 10.114 -10.444 1042 HB2 GLN 41 2HB GLN 41 1.455 8.357 -12.671 1043 HB3 GLN 41 1HB GLN 41 -0.074 9.213 -12.680 1044 HG2 GLN 41 2HG GLN 41 2.655 10.503 -12.604 1045 HG3 GLN 41 1HG GLN 41 1.618 10.359 -14.016 1046 HE21 GLN 41 1HE2 GLN 41 -0.826 10.964 -12.570 1047 HE22 GLN 41 2HE2 GLN 41 -0.766 12.649 -12.203 1048 H ILE 42 H ILE 42 1.813 6.859 -10.342 1049 HA ILE 42 HA ILE 42 -0.676 5.537 -10.159 1050 HB ILE 42 HB ILE 42 2.076 4.596 -9.274 1051 HG12 ILE 42 2HG1 ILE 42 0.399 3.882 -11.698 1052 HG13 ILE 42 1HG1 ILE 42 1.792 4.956 -11.701 1053 HG21 ILE 42 1HG2 ILE 42 0.387 3.406 -7.979 1054 HG22 ILE 42 2HG2 ILE 42 1.105 2.319 -9.165 1055 HG23 ILE 42 3HG2 ILE 42 -0.496 3.001 -9.445 1056 HD11 ILE 42 1HD1 ILE 42 3.227 3.082 -11.054 1057 HD12 ILE 42 2HD1 ILE 42 2.367 2.757 -12.558 1058 HD13 ILE 42 3HD1 ILE 42 1.830 2.009 -11.053 1059 H VAL 43 H VAL 43 1.631 6.552 -7.600 1060 HA VAL 43 HA VAL 43 0.083 5.656 -5.471 1061 HB VAL 43 HB VAL 43 2.381 6.396 -5.028 1062 HG11 VAL 43 1HG1 VAL 43 2.505 8.232 -6.632 1063 HG12 VAL 43 2HG1 VAL 43 2.982 8.796 -5.025 1064 HG13 VAL 43 3HG1 VAL 43 1.382 9.181 -5.660 1065 HG21 VAL 43 1HG2 VAL 43 0.424 8.173 -3.579 1066 HG22 VAL 43 2HG2 VAL 43 2.061 7.799 -3.043 1067 HG23 VAL 43 3HG2 VAL 43 0.853 6.519 -3.143 1068 H GLY 44 H GLY 44 -0.145 8.635 -7.299 1069 HA2 GLY 44 2HA GLY 44 -2.080 9.945 -5.749 1070 HA3 GLY 44 1HA GLY 44 -1.827 10.189 -7.473 1071 H TYR 45 H TYR 45 -2.472 7.729 -8.518 1072 HA TYR 45 HA TYR 45 -5.266 7.833 -8.648 1073 HB2 TYR 45 2HB TYR 45 -4.044 6.775 -10.476 1074 HB3 TYR 45 1HB TYR 45 -3.454 5.513 -9.398 1075 HD1 TYR 45 1HD TYR 45 -4.807 3.557 -8.929 1076 HD2 TYR 45 2HD TYR 45 -6.507 6.853 -11.013 1077 HE1 TYR 45 1HE TYR 45 -6.781 2.216 -9.417 1078 HE2 TYR 45 2HE TYR 45 -8.500 5.494 -11.503 1079 HH TYR 45 HH TYR 45 -9.153 2.623 -9.924 1080 H LEU 46 H LEU 46 -3.215 5.583 -6.883 1081 HA LEU 46 HA LEU 46 -5.483 4.261 -5.861 1082 HB2 LEU 46 2HB LEU 46 -2.610 4.045 -5.043 1083 HB3 LEU 46 1HB LEU 46 -3.873 3.128 -4.246 1084 HG LEU 46 HG LEU 46 -4.388 2.121 -6.551 1085 HD11 LEU 46 1HD1 LEU 46 -2.737 2.160 -8.233 1086 HD12 LEU 46 2HD1 LEU 46 -1.714 3.223 -7.268 1087 HD13 LEU 46 3HD1 LEU 46 -3.256 3.807 -7.881 1088 HD21 LEU 46 1HD2 LEU 46 -2.563 0.541 -6.433 1089 HD22 LEU 46 2HD2 LEU 46 -3.234 0.887 -4.840 1090 HD23 LEU 46 3HD2 LEU 46 -1.702 1.613 -5.330 1091 H LEU 47 H LEU 47 -3.595 6.913 -4.561 1092 HA LEU 47 HA LEU 47 -4.881 6.726 -2.023 1093 HB2 LEU 47 2HB LEU 47 -3.434 9.055 -3.270 1094 HB3 LEU 47 1HB LEU 47 -4.027 9.028 -1.629 1095 HG LEU 47 HG LEU 47 -1.846 7.289 -2.776 1096 HD11 LEU 47 1HD1 LEU 47 -1.176 9.590 -2.414 1097 HD12 LEU 47 2HD1 LEU 47 -0.407 8.521 -1.237 1098 HD13 LEU 47 3HD1 LEU 47 -1.778 9.521 -0.757 1099 HD21 LEU 47 1HD2 LEU 47 -3.118 6.044 -1.106 1100 HD22 LEU 47 2HD2 LEU 47 -2.966 7.389 0.029 1101 HD23 LEU 47 3HD2 LEU 47 -1.536 6.491 -0.469 1102 H SER 48 H SER 48 -5.710 8.337 -5.023 1103 HA SER 48 HA SER 48 -7.859 9.696 -3.585 1104 HB2 SER 48 2HB SER 48 -6.314 11.161 -4.778 1105 HB3 SER 48 1HB SER 48 -6.691 10.332 -6.287 1106 HG SER 48 HG SER 48 -8.471 11.800 -4.649 1107 H GLY 49 H GLY 49 -7.509 7.024 -5.871 1108 HA2 GLY 49 2HA GLY 49 -9.073 5.854 -7.016 1109 HA3 GLY 49 1HA GLY 49 -10.305 6.684 -6.064 1110 H ASP 50 H ASP 50 -7.918 8.255 -8.048 1111 HA ASP 50 HA ASP 50 -10.078 9.409 -9.672 1112 HB2 ASP 50 2HB ASP 50 -8.946 11.017 -8.204 1113 HB3 ASP 50 1HB ASP 50 -7.405 10.557 -8.911 1114 HA PRO 51 HA PRO 51 -7.994 6.959 -12.847 1115 HB2 PRO 51 2HB PRO 51 -10.085 8.163 -14.542 1116 HB3 PRO 51 1HB PRO 51 -9.695 6.461 -14.260 1117 HG2 PRO 51 2HG PRO 51 -11.896 7.574 -13.222 1118 HG3 PRO 51 1HG PRO 51 -10.972 6.349 -12.334 1119 HD2 PRO 51 2HD PRO 51 -11.015 9.320 -11.982 1120 HD3 PRO 51 1HD PRO 51 -10.966 8.023 -10.762 1121 H ALA 52 H ALA 52 -8.663 10.360 -12.899 1122 HA ALA 52 HA ALA 52 -7.642 10.991 -15.435 1123 HB1 ALA 52 1HB ALA 52 -7.665 13.280 -14.704 1124 HB2 ALA 52 2HB ALA 52 -7.857 12.766 -13.026 1125 HB3 ALA 52 3HB ALA 52 -9.135 12.449 -14.203 1126 H TYR 53 H TYR 53 -5.951 10.063 -12.663 1127 HA TYR 53 HA TYR 53 -3.608 11.582 -12.961 1128 HB2 TYR 53 2HB TYR 53 -4.148 8.969 -11.630 1129 HB3 TYR 53 1HB TYR 53 -2.505 9.581 -11.767 1130 HD1 TYR 53 1HD TYR 53 -2.047 11.888 -10.916 1131 HD2 TYR 53 2HD TYR 53 -5.542 9.738 -9.905 1132 HE1 TYR 53 1HE TYR 53 -2.323 13.311 -9.007 1133 HE2 TYR 53 2HE TYR 53 -5.850 11.182 -7.926 1134 HH TYR 53 HH TYR 53 -4.455 12.549 -6.469 1135 H ILE 54 H ILE 54 -4.686 8.708 -14.681 1136 HA ILE 54 HA ILE 54 -1.982 8.379 -15.766 1137 HB ILE 54 HB ILE 54 -4.347 6.494 -16.135 1138 HG12 ILE 54 2HG1 ILE 54 -3.757 6.611 -13.749 1139 HG13 ILE 54 1HG1 ILE 54 -3.264 5.069 -14.435 1140 HG21 ILE 54 1HG2 ILE 54 -2.642 4.867 -16.810 1141 HG22 ILE 54 2HG2 ILE 54 -1.391 6.091 -16.606 1142 HG23 ILE 54 3HG2 ILE 54 -2.615 6.290 -17.858 1143 HD11 ILE 54 1HD1 ILE 54 -1.595 5.938 -12.903 1144 HD12 ILE 54 2HD1 ILE 54 -1.446 7.403 -13.870 1145 HD13 ILE 54 3HD1 ILE 54 -0.961 5.845 -14.545 1146 HA PRO 55 HA PRO 55 -3.459 10.467 -19.480 1147 HB2 PRO 55 2HB PRO 55 -1.110 10.752 -20.660 1148 HB3 PRO 55 1HB PRO 55 -1.447 11.582 -19.132 1149 HG2 PRO 55 2HG PRO 55 0.070 9.044 -19.599 1150 HG3 PRO 55 1HG PRO 55 0.512 10.438 -18.595 1151 HD2 PRO 55 2HD PRO 55 -0.645 8.158 -17.611 1152 HD3 PRO 55 1HD PRO 55 -0.795 9.757 -16.855 1153 H ARG 56 H ARG 56 -3.432 10.147 -21.826 1154 HA ARG 56 HA ARG 56 -3.568 7.333 -22.487 1155 HB2 ARG 56 2HB ARG 56 -5.409 8.770 -23.203 1156 HB3 ARG 56 1HB ARG 56 -4.303 9.747 -24.153 1157 HG2 ARG 56 2HG ARG 56 -3.812 7.748 -25.550 1158 HG3 ARG 56 1HG ARG 56 -5.036 6.857 -24.645 1159 HD2 ARG 56 2HD ARG 56 -6.730 8.488 -25.359 1160 HD3 ARG 56 1HD ARG 56 -5.491 9.368 -26.243 1161 HE ARG 56 HE ARG 56 -5.595 6.676 -27.088 1162 HH11 ARG 56 1HH1 ARG 56 -7.332 9.745 -27.359 1163 HH12 ARG 56 2HH1 ARG 56 -8.053 9.365 -28.854 1164 HH21 ARG 56 1HH2 ARG 56 -6.578 6.188 -29.194 1165 HH22 ARG 56 2HH2 ARG 56 -7.613 7.343 -29.905 1166 H TYR 57 H TYR 57 -1.293 7.046 -22.318 1167 HA TYR 57 HA TYR 57 0.113 7.690 -24.812 1168 HB2 TYR 57 2HB TYR 57 1.462 7.830 -22.759 1169 HB3 TYR 57 1HB TYR 57 1.039 6.171 -22.357 1170 HD1 TYR 57 1HD TYR 57 2.858 8.218 -24.898 1171 HD2 TYR 57 2HD TYR 57 2.372 4.378 -23.129 1172 HE1 TYR 57 1HE TYR 57 4.813 7.473 -26.058 1173 HE2 TYR 57 2HE TYR 57 4.370 3.581 -24.321 1174 HH TYR 57 HH TYR 57 6.578 5.652 -25.810 1175 H GLN 58 H GLN 58 -1.354 5.092 -23.023 1176 HA GLN 58 HA GLN 58 -1.565 3.445 -25.341 1177 HB2 GLN 58 2HB GLN 58 0.799 3.099 -24.310 1178 HB3 GLN 58 1HB GLN 58 -0.018 2.510 -22.883 1179 HG2 GLN 58 2HG GLN 58 -0.320 1.187 -25.572 1180 HG3 GLN 58 1HG GLN 58 0.999 0.807 -24.476 1181 HE21 GLN 58 1HE2 GLN 58 -1.156 -0.849 -25.492 1182 HE22 GLN 58 2HE2 GLN 58 -1.965 -1.448 -24.084 1183 H ASP 59 H ASP 59 -2.911 1.472 -24.544 1184 HA ASP 59 HA ASP 59 -5.232 2.322 -23.249 1185 HB2 ASP 59 2HB ASP 59 -4.374 -0.539 -23.677 1186 HB3 ASP 59 1HB ASP 59 -5.968 -0.026 -23.186 1187 H ALA 60 H ALA 60 -2.405 1.513 -21.744 1188 HA ALA 60 HA ALA 60 -3.003 0.212 -19.431 1189 HB1 ALA 60 1HB ALA 60 -1.133 1.340 -18.422 1190 HB2 ALA 60 2HB ALA 60 -1.196 2.609 -19.647 1191 HB3 ALA 60 3HB ALA 60 -0.763 0.958 -20.099 1192 H ARG 61 H ARG 61 -3.863 3.574 -20.185 1193 HA ARG 61 HA ARG 61 -4.611 4.182 -17.521 1194 HB2 ARG 61 2HB ARG 61 -5.700 6.161 -18.349 1195 HB3 ARG 61 1HB ARG 61 -4.225 5.949 -19.264 1196 HG2 ARG 61 2HG ARG 61 -5.530 5.064 -21.141 1197 HG3 ARG 61 1HG ARG 61 -7.013 5.305 -20.210 1198 HD2 ARG 61 2HD ARG 61 -5.067 7.425 -21.116 1199 HD3 ARG 61 1HD ARG 61 -6.703 7.194 -21.716 1200 HE ARG 61 HE ARG 61 -6.678 7.614 -18.914 1201 HH11 ARG 61 1HH1 ARG 61 -6.632 9.355 -21.980 1202 HH12 ARG 61 2HH1 ARG 61 -6.867 10.883 -21.306 1203 HH21 ARG 61 1HH2 ARG 61 -7.044 9.656 -17.973 1204 HH22 ARG 61 2HH2 ARG 61 -7.138 11.085 -18.903 1205 H ASN 62 H ASN 62 -6.270 2.645 -20.172 1206 HA ASN 62 HA ASN 62 -8.835 2.581 -18.876 1207 HB2 ASN 62 2HB ASN 62 -8.502 2.407 -21.412 1208 HB3 ASN 62 1HB ASN 62 -7.811 0.835 -21.116 1209 HD21 ASN 62 1HD2 ASN 62 -10.767 2.671 -21.007 1210 HD22 ASN 62 2HD2 ASN 62 -11.834 1.327 -20.943 1211 H LEU 63 H LEU 63 -6.087 0.460 -19.313 1212 HA LEU 63 HA LEU 63 -7.054 -1.922 -18.221 1213 HB2 LEU 63 2HB LEU 63 -4.228 -0.867 -18.093 1214 HB3 LEU 63 1HB LEU 63 -4.710 -2.516 -17.779 1215 HG LEU 63 HG LEU 63 -4.908 -1.113 -20.451 1216 HD11 LEU 63 1HD1 LEU 63 -2.583 -1.623 -19.807 1217 HD12 LEU 63 2HD1 LEU 63 -3.137 -2.643 -21.132 1218 HD13 LEU 63 3HD1 LEU 63 -3.049 -3.290 -19.500 1219 HD21 LEU 63 1HD2 LEU 63 -5.469 -3.322 -21.318 1220 HD22 LEU 63 2HD2 LEU 63 -6.681 -2.776 -20.153 1221 HD23 LEU 63 3HD2 LEU 63 -5.460 -3.968 -19.679 1222 H ILE 64 H ILE 64 -5.494 0.810 -16.582 1223 HA ILE 64 HA ILE 64 -5.467 -0.491 -14.055 1224 HB ILE 64 HB ILE 64 -3.910 1.387 -14.672 1225 HG12 ILE 64 2HG1 ILE 64 -5.557 1.976 -12.201 1226 HG13 ILE 64 1HG1 ILE 64 -4.278 0.769 -12.296 1227 HG21 ILE 64 1HG2 ILE 64 -4.697 3.712 -14.498 1228 HG22 ILE 64 2HG2 ILE 64 -6.349 3.129 -14.332 1229 HG23 ILE 64 3HG2 ILE 64 -5.462 2.844 -15.826 1230 HD11 ILE 64 1HD1 ILE 64 -2.655 2.543 -12.779 1231 HD12 ILE 64 2HD1 ILE 64 -3.476 2.807 -11.236 1232 HD13 ILE 64 3HD1 ILE 64 -3.940 3.741 -12.662 1233 H ARG 65 H ARG 65 -7.807 1.313 -15.803 1234 HA ARG 65 HA ARG 65 -9.514 1.894 -13.565 1235 HB2 ARG 65 2HB ARG 65 -9.936 2.135 -16.533 1236 HB3 ARG 65 1HB ARG 65 -11.138 2.600 -15.345 1237 HG2 ARG 65 2HG ARG 65 -9.603 4.269 -14.449 1238 HG3 ARG 65 1HG ARG 65 -8.385 3.781 -15.630 1239 HD2 ARG 65 2HD ARG 65 -9.578 5.780 -16.376 1240 HD3 ARG 65 1HD ARG 65 -9.886 4.415 -17.450 1241 HE ARG 65 HE ARG 65 -11.847 4.607 -15.419 1242 HH11 ARG 65 1HH1 ARG 65 -10.900 6.048 -18.510 1243 HH12 ARG 65 2HH1 ARG 65 -12.468 6.566 -18.914 1244 HH21 ARG 65 1HH2 ARG 65 -14.026 5.322 -15.978 1245 HH22 ARG 65 2HH2 ARG 65 -14.290 6.134 -17.444 1246 H ARG 66 H ARG 66 -8.795 -0.918 -14.981 1247 HA ARG 66 HA ARG 66 -11.482 -1.968 -15.106 1248 HB2 ARG 66 2HB ARG 66 -8.822 -3.383 -15.358 1249 HB3 ARG 66 1HB ARG 66 -10.384 -4.160 -15.580 1250 HG2 ARG 66 2HG ARG 66 -10.854 -2.596 -17.433 1251 HG3 ARG 66 1HG ARG 66 -9.234 -1.930 -17.250 1252 HD2 ARG 66 2HD ARG 66 -9.283 -3.556 -19.065 1253 HD3 ARG 66 1HD ARG 66 -8.290 -4.153 -17.735 1254 HE ARG 66 HE ARG 66 -10.677 -5.217 -17.172 1255 HH11 ARG 66 1HH1 ARG 66 -8.888 -5.189 -20.264 1256 HH12 ARG 66 2HH1 ARG 66 -9.456 -6.714 -20.730 1257 HH21 ARG 66 1HH2 ARG 66 -11.446 -7.292 -17.872 1258 HH22 ARG 66 2HH2 ARG 66 -10.929 -7.949 -19.360 1259 H HIS 67 H HIS 67 -9.541 -1.143 -12.690 1260 HA HIS 67 HA HIS 67 -10.928 -2.951 -10.866 1261 HB2 HIS 67 2HB HIS 67 -8.093 -1.896 -10.521 1262 HB3 HIS 67 1HB HIS 67 -8.993 -2.715 -9.257 1263 HD1 HIS 67 1HD HIS 67 -8.801 -5.295 -9.209 1264 HD2 HIS 67 2HD HIS 67 -7.454 -3.594 -12.765 1265 HE1 HIS 67 1HE HIS 67 -7.693 -7.133 -10.460 1266 HE2 HIS 67 2HE HIS 67 -7.287 -6.168 -12.718 1267 H GLU 68 H GLU 68 -10.548 -1.667 -8.496 1268 HA GLU 68 HA GLU 68 -11.810 0.857 -9.154 1269 HB2 GLU 68 2HB GLU 68 -12.784 0.836 -6.891 1270 HB3 GLU 68 1HB GLU 68 -13.190 -0.636 -7.760 1271 HG2 GLU 68 2HG GLU 68 -11.273 -0.260 -5.458 1272 HG3 GLU 68 1HG GLU 68 -12.758 -1.203 -5.486 1273 H ARG 69 H ARG 69 -9.546 -0.303 -6.655 1274 HA ARG 69 HA ARG 69 -7.699 1.808 -6.847 1275 HB2 ARG 69 2HB ARG 69 -9.421 3.315 -6.236 1276 HB3 ARG 69 1HB ARG 69 -10.035 2.319 -4.963 1277 HG2 ARG 69 2HG ARG 69 -7.851 2.747 -3.765 1278 HG3 ARG 69 1HG ARG 69 -7.537 3.962 -5.014 1279 HD2 ARG 69 2HD ARG 69 -9.601 5.090 -4.495 1280 HD3 ARG 69 1HD ARG 69 -10.013 3.862 -3.306 1281 HE ARG 69 HE ARG 69 -7.578 5.419 -2.962 1282 HH11 ARG 69 1HH1 ARG 69 -10.822 4.519 -1.819 1283 HH12 ARG 69 2HH1 ARG 69 -10.779 5.492 -0.438 1284 HH21 ARG 69 1HH2 ARG 69 -7.546 6.817 -0.980 1285 HH22 ARG 69 2HH2 ARG 69 -8.921 6.801 0.034 1286 H ASP 70 H ASP 70 -9.535 0.094 -4.309 1287 HA ASP 70 HA ASP 70 -7.143 -0.153 -2.791 1288 HB2 ASP 70 2HB ASP 70 -8.599 -1.242 -1.040 1289 HB3 ASP 70 1HB ASP 70 -8.995 0.414 -1.475 1290 H GLU 71 H GLU 71 -8.888 -2.441 -4.825 1291 HA GLU 71 HA GLU 71 -7.685 -4.778 -3.851 1292 HB2 GLU 71 2HB GLU 71 -8.686 -3.951 -6.555 1293 HB3 GLU 71 1HB GLU 71 -7.839 -5.477 -6.369 1294 HG2 GLU 71 2HG GLU 71 -10.280 -4.724 -4.776 1295 HG3 GLU 71 1HG GLU 71 -10.338 -5.607 -6.301 1296 H ILE 72 H ILE 72 -6.558 -2.435 -6.171 1297 HA ILE 72 HA ILE 72 -4.153 -3.771 -6.872 1298 HB ILE 72 HB ILE 72 -4.715 -0.792 -6.960 1299 HG12 ILE 72 2HG1 ILE 72 -5.105 -2.892 -9.113 1300 HG13 ILE 72 1HG1 ILE 72 -6.395 -2.089 -8.229 1301 HG21 ILE 72 1HG2 ILE 72 -2.689 -2.432 -8.486 1302 HG22 ILE 72 2HG2 ILE 72 -2.329 -1.336 -7.153 1303 HG23 ILE 72 3HG2 ILE 72 -2.964 -0.700 -8.668 1304 HD11 ILE 72 1HD1 ILE 72 -5.737 0.048 -9.220 1305 HD12 ILE 72 2HD1 ILE 72 -6.106 -1.147 -10.461 1306 HD13 ILE 72 3HD1 ILE 72 -4.431 -0.754 -10.089 1307 H MET 73 H MET 73 -4.974 -1.360 -4.433 1308 HA MET 73 HA MET 73 -2.323 -0.795 -3.666 1309 HB2 MET 73 2HB MET 73 -4.558 0.524 -3.235 1310 HB3 MET 73 1HB MET 73 -4.643 -0.471 -1.795 1311 HG2 MET 73 2HG MET 73 -2.389 1.402 -2.504 1312 HG3 MET 73 1HG MET 73 -3.657 1.716 -1.337 1313 HE1 MET 73 1HE MET 73 -0.549 1.964 -0.854 1314 HE2 MET 73 2HE MET 73 -0.404 1.313 0.778 1315 HE3 MET 73 3HE MET 73 -1.756 2.382 0.361 1316 H GLU 74 H GLU 74 -4.789 -2.993 -2.237 1317 HA GLU 74 HA GLU 74 -3.133 -3.923 -0.151 1318 HB2 GLU 74 2HB GLU 74 -5.290 -5.377 -1.622 1319 HB3 GLU 74 1HB GLU 74 -4.511 -5.998 -0.186 1320 HG2 GLU 74 2HG GLU 74 -5.377 -4.016 1.037 1321 HG3 GLU 74 1HG GLU 74 -6.281 -3.583 -0.423 1322 H GLU 75 H GLU 75 -3.350 -4.803 -3.527 1323 HA GLU 75 HA GLU 75 -1.913 -7.230 -3.305 1324 HB2 GLU 75 2HB GLU 75 -3.366 -6.434 -5.252 1325 HB3 GLU 75 1HB GLU 75 -1.999 -5.441 -5.736 1326 HG2 GLU 75 2HG GLU 75 -2.070 -7.521 -6.983 1327 HG3 GLU 75 1HG GLU 75 -0.626 -7.440 -5.969 1328 H LEU 76 H LEU 76 -1.017 -3.866 -3.831 1329 HA LEU 76 HA LEU 76 1.750 -4.205 -4.261 1330 HB2 LEU 76 2HB LEU 76 0.377 -1.937 -2.816 1331 HB3 LEU 76 1HB LEU 76 1.980 -1.894 -3.506 1332 HG LEU 76 HG LEU 76 -0.623 -2.047 -5.023 1333 HD11 LEU 76 1HD1 LEU 76 -0.013 0.181 -5.782 1334 HD12 LEU 76 2HD1 LEU 76 1.411 0.153 -4.738 1335 HD13 LEU 76 3HD1 LEU 76 -0.207 0.119 -4.032 1336 HD21 LEU 76 1HD2 LEU 76 1.128 -3.262 -6.190 1337 HD22 LEU 76 2HD2 LEU 76 2.206 -1.874 -6.044 1338 HD23 LEU 76 3HD2 LEU 76 0.741 -1.754 -7.020 1339 H THR 77 H THR 77 -0.161 -3.581 -1.327 1340 HA THR 77 HA THR 77 1.908 -3.513 0.501 1341 HB THR 77 HB THR 77 -0.951 -4.409 0.953 1342 HG1 THR 77 1HG THR 77 -1.061 -2.339 0.059 1343 HG21 THR 77 1HG2 THR 77 -0.602 -3.554 3.236 1344 HG22 THR 77 2HG2 THR 77 1.067 -3.148 2.833 1345 HG23 THR 77 3HG2 THR 77 0.557 -4.834 2.872 1346 H LYS 78 H LYS 78 -0.106 -6.290 -0.532 1347 HA LYS 78 HA LYS 78 1.035 -8.098 1.296 1348 HB2 LYS 78 2HB LYS 78 -0.376 -8.694 -1.295 1349 HB3 LYS 78 1HB LYS 78 0.063 -9.908 -0.098 1350 HG2 LYS 78 2HG LYS 78 -1.271 -8.708 1.537 1351 HG3 LYS 78 1HG LYS 78 -1.822 -7.604 0.296 1352 HD2 LYS 78 2HD LYS 78 -2.297 -10.593 0.433 1353 HD3 LYS 78 1HD LYS 78 -3.501 -9.329 0.660 1354 HE2 LYS 78 2HE LYS 78 -3.180 -8.656 -1.696 1355 HE3 LYS 78 1HE LYS 78 -2.024 -9.974 -1.894 1356 HZ1 LYS 78 1HZ LYS 78 -4.914 -10.225 -1.263 1357 HZ2 LYS 78 2HZ LYS 78 -3.853 -11.478 -1.147 1358 HZ3 LYS 78 3HZ LYS 78 -4.132 -10.786 -2.663 1359 H TYR 79 H TYR 79 1.713 -7.599 -2.131 1360 HA TYR 79 HA TYR 79 3.685 -9.587 -2.272 1361 HB2 TYR 79 2HB TYR 79 2.639 -8.671 -4.263 1362 HB3 TYR 79 1HB TYR 79 3.362 -7.097 -3.953 1363 HD1 TYR 79 1HD TYR 79 4.269 -10.636 -4.531 1364 HD2 TYR 79 2HD TYR 79 5.386 -6.576 -4.940 1365 HE1 TYR 79 1HE TYR 79 6.232 -11.322 -5.869 1366 HE2 TYR 79 2HE TYR 79 7.347 -7.230 -6.266 1367 HH TYR 79 HH TYR 79 7.733 -10.320 -7.540 1368 H TYR 80 H TYR 80 3.876 -6.201 -1.420 1369 HA TYR 80 HA TYR 80 6.645 -5.834 -1.329 1370 HB2 TYR 80 2HB TYR 80 4.948 -4.043 -1.141 1371 HB3 TYR 80 1HB TYR 80 4.467 -4.668 0.420 1372 HD1 TYR 80 1HD TYR 80 7.033 -2.832 -1.431 1373 HD2 TYR 80 2HD TYR 80 5.771 -4.170 2.399 1374 HE1 TYR 80 1HE TYR 80 8.606 -1.261 -0.374 1375 HE2 TYR 80 2HE TYR 80 7.324 -2.608 3.470 1376 HH TYR 80 HH TYR 80 8.834 -0.096 1.764 1377 H LEU 81 H LEU 81 4.386 -6.836 1.204 1378 HA LEU 81 HA LEU 81 6.412 -7.317 3.118 1379 HB2 LEU 81 2HB LEU 81 3.519 -8.120 3.093 1380 HB3 LEU 81 1HB LEU 81 4.589 -8.296 4.470 1381 HG LEU 81 HG LEU 81 3.800 -5.676 3.188 1382 HD11 LEU 81 1HD1 LEU 81 2.992 -6.926 5.800 1383 HD12 LEU 81 2HD1 LEU 81 1.959 -6.703 4.389 1384 HD13 LEU 81 3HD1 LEU 81 2.569 -5.298 5.265 1385 HD21 LEU 81 1HD2 LEU 81 4.920 -4.659 5.116 1386 HD22 LEU 81 2HD2 LEU 81 6.046 -5.577 4.126 1387 HD23 LEU 81 3HD2 LEU 81 5.453 -6.253 5.645 1388 H ALA 82 H ALA 82 4.752 -9.346 0.777 1389 HA ALA 82 HA ALA 82 5.102 -11.845 1.892 1390 HB1 ALA 82 1HB ALA 82 5.112 -11.155 -1.037 1391 HB2 ALA 82 2HB ALA 82 3.674 -11.359 -0.038 1392 HB3 ALA 82 3HB ALA 82 4.749 -12.727 -0.327 1393 H ASN 83 H ASN 83 7.344 -9.966 0.022 1394 HA ASN 83 HA ASN 83 9.144 -12.130 -0.386 1395 HB2 ASN 83 2HB ASN 83 9.530 -9.174 -0.784 1396 HB3 ASN 83 1HB ASN 83 10.809 -10.341 -1.081 1397 HD21 ASN 83 1HD2 ASN 83 7.705 -9.127 -2.194 1398 HD22 ASN 83 2HD2 ASN 83 7.767 -9.933 -3.708 1399 H HIS 84 H HIS 84 8.484 -10.599 2.436 1400 HA HIS 84 HA HIS 84 11.219 -10.823 3.420 1401 HB2 HIS 84 2HB HIS 84 8.703 -9.977 4.895 1402 HB3 HIS 84 1HB HIS 84 10.290 -10.088 5.640 1403 HD1 HIS 84 1HD HIS 84 12.151 -8.438 4.488 1404 HD2 HIS 84 2HD HIS 84 8.157 -7.561 3.824 1405 HE1 HIS 84 1HE HIS 84 12.120 -6.079 3.665 1406 HE2 HIS 84 2HE HIS 84 9.780 -5.795 2.856 1407 H GLY 85 H GLY 85 9.008 -12.994 2.680 1408 HA2 GLY 85 2HA GLY 85 9.442 -15.286 3.170 1409 HA3 GLY 85 1HA GLY 85 9.979 -14.809 4.773 1410 H ILE 86 H ILE 86 7.256 -13.137 3.888 1411 HA ILE 86 HA ILE 86 5.599 -14.897 5.531 1412 HB ILE 86 HB ILE 86 5.167 -11.997 4.761 1413 HG12 ILE 86 2HG1 ILE 86 5.985 -13.244 7.397 1414 HG13 ILE 86 1HG1 ILE 86 7.025 -12.300 6.336 1415 HG21 ILE 86 1HG2 ILE 86 3.331 -12.052 6.392 1416 HG22 ILE 86 2HG2 ILE 86 3.601 -13.777 6.634 1417 HG23 ILE 86 3HG2 ILE 86 3.054 -13.181 5.066 1418 HD11 ILE 86 1HD1 ILE 86 6.234 -11.001 8.240 1419 HD12 ILE 86 2HD1 ILE 86 4.569 -11.316 7.733 1420 HD13 ILE 86 3HD1 ILE 86 5.625 -10.344 6.710 1421 H ASP 87 H ASP 87 3.917 -15.915 4.642 1422 HA ASP 87 HA ASP 87 3.288 -15.272 1.853 1423 HB2 ASP 87 2HB ASP 87 3.890 -17.628 2.191 1424 HB3 ASP 87 1HB ASP 87 2.611 -17.798 3.385 1425 H ILE 88 H ILE 88 1.558 -14.213 1.426 1426 HA ILE 88 HA ILE 88 -0.534 -13.986 3.490 1427 HB ILE 88 HB ILE 88 0.083 -11.944 1.319 1428 HG12 ILE 88 2HG1 ILE 88 1.008 -11.870 4.201 1429 HG13 ILE 88 1HG1 ILE 88 2.053 -12.254 2.837 1430 HG21 ILE 88 1HG2 ILE 88 -1.438 -11.763 3.925 1431 HG22 ILE 88 2HG2 ILE 88 -2.154 -11.848 2.317 1432 HG23 ILE 88 3HG2 ILE 88 -1.194 -10.443 2.784 1433 HD11 ILE 88 1HD1 ILE 88 2.277 -9.916 3.582 1434 HD12 ILE 88 2HD1 ILE 88 0.565 -9.660 3.170 1435 HD13 ILE 88 3HD1 ILE 88 1.714 -10.057 1.919 1436 H LYS 89 H LYS 89 -2.718 -14.008 2.714 1437 HA LYS 89 HA LYS 89 -3.221 -15.472 0.334 1438 HB2 LYS 89 2HB LYS 89 -4.702 -15.634 2.295 1439 HB3 LYS 89 1HB LYS 89 -5.085 -13.922 2.149 1440 HG2 LYS 89 2HG LYS 89 -6.050 -14.368 -0.075 1441 HG3 LYS 89 1HG LYS 89 -5.762 -16.089 0.178 1442 HD2 LYS 89 2HD LYS 89 -7.242 -16.056 2.121 1443 HD3 LYS 89 1HD LYS 89 -7.492 -14.318 1.905 1444 HE2 LYS 89 2HE LYS 89 -8.439 -14.743 -0.314 1445 HE3 LYS 89 1HE LYS 89 -8.218 -16.473 -0.061 1446 HZ1 LYS 89 1HZ LYS 89 -10.472 -15.751 0.367 1447 HZ2 LYS 89 2HZ LYS 89 -9.941 -14.693 1.564 1448 HZ3 LYS 89 3HZ LYS 89 -9.784 -16.372 1.769
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