NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
651074 | 6tze | 30653 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 1H MET 1 -0.334 -0.943 0.000 2 HA MET 1 HA MET 1 1.804 -0.488 0.911 3 HB2 MET 1 1HB MET 1 1.612 -1.799 -1.170 4 HB3 MET 1 2HB MET 1 1.612 -0.322 -2.123 5 HG2 MET 1 1HG MET 1 3.909 0.174 -1.292 6 HG3 MET 1 2HG MET 1 3.901 -1.369 -0.435 7 HE1 MET 1 1HE MET 1 3.907 -0.846 -5.027 8 HE2 MET 1 2HE MET 1 2.539 -0.314 -4.018 9 HE3 MET 1 3HE MET 1 4.129 0.470 -3.849 10 H ALA 2 H ALA 2 1.832 1.502 -2.014 11 HA ALA 2 HA ALA 2 3.580 3.412 -0.733 12 HB1 ALA 2 1HB ALA 2 3.420 4.638 -2.875 13 HB2 ALA 2 2HB ALA 2 3.758 2.909 -3.128 14 HB3 ALA 2 3HB ALA 2 2.118 3.544 -3.395 15 H GLY 3 H GLY 3 0.132 3.248 -1.384 16 HA2 GLY 3 1HA GLY 3 -1.567 4.548 -0.412 17 HA3 GLY 3 2HA GLY 3 -0.354 5.552 0.358 18 H LEU 4 H LEU 4 -0.004 4.929 -3.040 19 HA LEU 4 HA LEU 4 -0.814 7.753 -3.578 20 HB2 LEU 4 1HB LEU 4 1.161 6.011 -5.095 21 HB3 LEU 4 2HB LEU 4 0.786 7.703 -5.436 22 HG LEU 4 HG LEU 4 2.129 6.675 -2.911 23 HD11 LEU 4 1HD1 LEU 4 4.133 7.744 -3.842 24 HD12 LEU 4 2HD1 LEU 4 3.536 6.438 -4.892 25 HD13 LEU 4 3HD1 LEU 4 3.233 8.137 -5.326 26 HD21 LEU 4 1HD2 LEU 4 2.507 9.077 -2.471 27 HD22 LEU 4 2HD2 LEU 4 1.584 9.491 -3.936 28 HD23 LEU 4 3HD2 LEU 4 0.768 8.709 -2.561 29 H THR 5 H THR 5 -1.834 8.256 -5.560 30 HA THR 5 HA THR 5 -3.810 6.332 -6.378 31 HB THR 5 HB THR 5 -2.979 8.952 -7.699 32 HG1 THR 5 HG1 THR 5 -5.065 9.524 -6.564 33 HG21 THR 5 1HG2 THR 5 -5.209 8.857 -8.741 34 HG22 THR 5 2HG2 THR 5 -4.221 7.458 -9.225 35 HG23 THR 5 3HG2 THR 5 -5.494 7.267 -7.997 36 H VAL 6 H VAL 6 -3.706 4.749 -7.786 37 HA VAL 6 HA VAL 6 -1.591 4.892 -9.894 38 HB VAL 6 HB VAL 6 -2.618 2.419 -8.434 39 HG11 VAL 6 1HG1 VAL 6 -0.916 1.206 -9.707 40 HG12 VAL 6 2HG1 VAL 6 -2.140 1.945 -10.767 41 HG13 VAL 6 3HG1 VAL 6 -0.531 2.692 -10.608 42 HG21 VAL 6 1HG2 VAL 6 -0.305 2.294 -7.562 43 HG22 VAL 6 2HG2 VAL 6 0.090 3.817 -8.396 44 HG23 VAL 6 3HG2 VAL 6 -1.098 3.810 -7.070 45 H ARG 7 H ARG 7 -2.305 4.845 -11.905 46 HA ARG 7 HA ARG 7 -5.169 4.246 -12.355 47 HB2 ARG 7 1HB ARG 7 -3.047 5.497 -14.130 48 HB3 ARG 7 2HB ARG 7 -4.703 5.197 -14.637 49 HG2 ARG 7 1HG ARG 7 -5.528 6.720 -12.898 50 HG3 ARG 7 2HG ARG 7 -3.854 7.016 -12.369 51 HD2 ARG 7 1HD ARG 7 -3.318 7.900 -14.565 52 HD3 ARG 7 2HD ARG 7 -4.991 7.605 -15.092 53 HE ARG 7 HE ARG 7 -5.088 9.171 -12.761 54 HH11 ARG 7 1HH1 ARG 7 -3.970 9.424 -16.081 55 HH12 ARG 7 2HH1 ARG 7 -4.222 11.153 -16.166 56 HH21 ARG 7 1HH2 ARG 7 -5.411 11.415 -12.883 57 HH22 ARG 7 2HH2 ARG 7 -5.037 12.281 -14.356 58 H ASP 8 H ASP 8 -2.092 2.791 -12.709 59 HA ASP 8 HA ASP 8 -3.004 0.981 -14.862 60 HB2 ASP 8 1HB ASP 8 -0.665 1.886 -14.853 61 HB3 ASP 8 2HB ASP 8 -0.365 1.034 -13.345 62 HA PRO 9 HA PRO 9 -4.536 -1.595 -11.631 63 HB2 PRO 9 1HB PRO 9 -5.799 -3.431 -13.261 64 HB3 PRO 9 2HB PRO 9 -6.471 -1.832 -12.918 65 HG2 PRO 9 1HG PRO 9 -4.820 -2.737 -15.317 66 HG3 PRO 9 2HG PRO 9 -6.330 -1.821 -15.312 67 HD2 PRO 9 1HD PRO 9 -3.952 -0.551 -15.566 68 HD3 PRO 9 2HD PRO 9 -5.291 0.182 -14.595 69 H ALA 10 H ALA 10 -2.366 -2.393 -14.207 70 HA ALA 10 HA ALA 10 -1.859 -5.135 -13.568 71 HB1 ALA 10 1HB ALA 10 0.240 -4.813 -14.836 72 HB2 ALA 10 2HB ALA 10 -1.161 -4.130 -15.695 73 HB3 ALA 10 3HB ALA 10 -0.036 -3.056 -14.832 74 H VAL 11 H VAL 11 -0.911 -2.155 -12.072 75 HA VAL 11 HA VAL 11 1.361 -3.152 -10.624 76 HB VAL 11 HB VAL 11 -0.581 -0.882 -10.018 77 HG11 VAL 11 1HG1 VAL 11 1.112 -0.060 -8.454 78 HG12 VAL 11 2HG1 VAL 11 0.463 -1.643 -7.962 79 HG13 VAL 11 3HG1 VAL 11 2.071 -1.536 -8.718 80 HG21 VAL 11 1HG2 VAL 11 1.271 0.527 -10.860 81 HG22 VAL 11 2HG2 VAL 11 2.227 -0.935 -11.199 82 HG23 VAL 11 3HG2 VAL 11 0.724 -0.625 -12.101 83 H ASP 12 H ASP 12 -2.087 -2.759 -9.739 84 HA ASP 12 HA ASP 12 -1.845 -3.950 -7.153 85 HB2 ASP 12 1HB ASP 12 -4.193 -3.623 -9.052 86 HB3 ASP 12 2HB ASP 12 -4.362 -4.363 -7.466 87 H ARG 13 H ARG 13 -2.473 -5.300 -10.369 88 HA ARG 13 HA ARG 13 -3.016 -7.971 -9.502 89 HB2 ARG 13 1HB ARG 13 -1.906 -6.867 -12.100 90 HB3 ARG 13 2HB ARG 13 -2.270 -8.569 -11.858 91 HG2 ARG 13 1HG ARG 13 -4.643 -7.901 -11.330 92 HG3 ARG 13 2HG ARG 13 -4.211 -6.253 -11.844 93 HD2 ARG 13 1HD ARG 13 -5.207 -7.368 -13.677 94 HD3 ARG 13 2HD ARG 13 -3.467 -7.212 -14.009 95 HE ARG 13 HE ARG 13 -4.112 -9.717 -12.751 96 HH11 ARG 13 1HH1 ARG 13 -4.113 -8.003 -15.818 97 HH12 ARG 13 2HH1 ARG 13 -3.995 -9.462 -16.776 98 HH21 ARG 13 1HH2 ARG 13 -3.959 -11.604 -14.006 99 HH22 ARG 13 2HH2 ARG 13 -3.908 -11.500 -15.752 100 H SER 14 H SER 14 -0.014 -6.253 -10.306 101 HA SER 14 HA SER 14 1.701 -8.546 -10.057 102 HB2 SER 14 1HB SER 14 2.258 -5.579 -9.744 103 HB3 SER 14 2HB SER 14 3.500 -6.820 -9.787 104 HG SER 14 HG SER 14 1.678 -6.064 -11.776 105 H LEU 15 H LEU 15 0.493 -6.126 -7.772 106 HA LEU 15 HA LEU 15 2.220 -6.895 -5.606 107 HB2 LEU 15 1HB LEU 15 -0.441 -5.443 -5.705 108 HB3 LEU 15 2HB LEU 15 0.451 -5.711 -4.205 109 HG LEU 15 HG LEU 15 1.554 -4.182 -6.586 110 HD11 LEU 15 1HD1 LEU 15 1.069 -2.173 -5.262 111 HD12 LEU 15 2HD1 LEU 15 -0.415 -3.065 -5.673 112 HD13 LEU 15 3HD1 LEU 15 0.266 -3.177 -4.033 113 HD21 LEU 15 1HD2 LEU 15 3.217 -3.426 -4.921 114 HD22 LEU 15 2HD2 LEU 15 2.445 -4.448 -3.685 115 HD23 LEU 15 3HD2 LEU 15 3.240 -5.198 -5.090 116 H ARG 16 H ARG 16 -0.996 -7.927 -6.672 117 HA ARG 16 HA ARG 16 -1.316 -9.648 -4.306 118 HB2 ARG 16 1HB ARG 16 -3.509 -10.090 -5.110 119 HB3 ARG 16 2HB ARG 16 -3.224 -8.378 -5.384 120 HG2 ARG 16 1HG ARG 16 -2.646 -8.941 -7.772 121 HG3 ARG 16 2HG ARG 16 -3.201 -10.598 -7.434 122 HD2 ARG 16 1HD ARG 16 -5.368 -9.640 -6.705 123 HD3 ARG 16 2HD ARG 16 -4.793 -8.054 -7.271 124 HE ARG 16 HE ARG 16 -4.452 -9.877 -9.376 125 HH11 ARG 16 1HH1 ARG 16 -7.071 -8.452 -7.518 126 HH12 ARG 16 2HH1 ARG 16 -8.223 -8.548 -8.832 127 HH21 ARG 16 1HH2 ARG 16 -5.956 -9.996 -11.074 128 HH22 ARG 16 2HH2 ARG 16 -7.592 -9.421 -10.845 129 H SER 17 H SER 17 0.421 -9.881 -7.090 130 HA SER 17 HA SER 17 0.033 -12.826 -7.280 131 HB2 SER 17 1HB SER 17 1.600 -10.876 -8.999 132 HB3 SER 17 2HB SER 17 1.586 -12.616 -9.241 133 HG SER 17 HG SER 17 -0.459 -10.748 -9.526 134 H VAL 18 H VAL 18 1.732 -14.274 -7.008 135 HA VAL 18 HA VAL 18 4.178 -13.135 -5.723 136 HB VAL 18 HB VAL 18 4.253 -15.105 -4.244 137 HG11 VAL 18 1HG1 VAL 18 2.356 -14.552 -2.801 138 HG12 VAL 18 2HG1 VAL 18 3.152 -13.095 -3.442 139 HG13 VAL 18 3HG1 VAL 18 1.607 -13.643 -4.134 140 HG21 VAL 18 1HG2 VAL 18 2.315 -16.640 -4.140 141 HG22 VAL 18 2HG2 VAL 18 1.572 -15.794 -5.518 142 HG23 VAL 18 3HG2 VAL 18 3.092 -16.693 -5.740 143 H PHE 19 H PHE 19 6.124 -14.297 -6.026 144 HA PHE 19 HA PHE 19 6.097 -16.079 -8.406 145 HB2 PHE 19 1HB PHE 19 7.658 -14.143 -8.413 146 HB3 PHE 19 2HB PHE 19 8.426 -14.756 -6.958 147 HD1 PHE 19 HD1 PHE 19 8.354 -14.853 -10.526 148 HD2 PHE 19 HD2 PHE 19 9.522 -17.067 -7.064 149 HE1 PHE 19 HE1 PHE 19 9.896 -16.202 -11.910 150 HE2 PHE 19 HE2 PHE 19 11.066 -18.417 -8.444 151 HZ PHE 19 HZ PHE 19 11.251 -17.984 -10.869 152 H VAL 20 H VAL 20 6.284 -18.193 -8.225 153 HA VAL 20 HA VAL 20 7.026 -19.263 -5.537 154 HB VAL 20 HB VAL 20 5.279 -20.533 -7.688 155 HG11 VAL 20 1HG1 VAL 20 4.697 -22.147 -5.943 156 HG12 VAL 20 2HG1 VAL 20 6.435 -22.176 -6.326 157 HG13 VAL 20 3HG1 VAL 20 5.863 -21.376 -4.842 158 HG21 VAL 20 1HG2 VAL 20 3.414 -20.033 -6.139 159 HG22 VAL 20 2HG2 VAL 20 4.545 -19.194 -5.051 160 HG23 VAL 20 3HG2 VAL 20 4.223 -18.541 -6.676 161 H GLY 21 H GLY 21 8.760 -20.503 -5.353 162 HA2 GLY 21 1HA GLY 21 9.838 -21.815 -7.822 163 HA3 GLY 21 2HA GLY 21 10.890 -20.926 -6.737 164 H ASN 22 H ASN 22 11.817 -23.278 -6.953 165 HA ASN 22 HA ASN 22 12.249 -25.330 -6.005 166 HB2 ASN 22 1HB ASN 22 10.918 -23.989 -3.631 167 HB3 ASN 22 2HB ASN 22 11.710 -25.557 -3.551 168 HD21 ASN 22 1HD2 ASN 22 13.954 -22.598 -2.675 169 HD22 ASN 22 2HD2 ASN 22 12.296 -22.918 -2.290 170 H ILE 23 H ILE 23 10.035 -25.242 -7.650 171 HA ILE 23 HA ILE 23 8.000 -26.908 -6.290 172 HB ILE 23 HB ILE 23 8.120 -25.811 -9.132 173 HG12 ILE 23 1HG1 ILE 23 6.323 -24.979 -6.848 174 HG13 ILE 23 2HG1 ILE 23 7.830 -24.164 -7.238 175 HG21 ILE 23 1HG2 ILE 23 5.777 -26.552 -9.283 176 HG22 ILE 23 2HG2 ILE 23 6.867 -27.931 -9.011 177 HG23 ILE 23 3HG2 ILE 23 5.899 -27.284 -7.666 178 HD11 ILE 23 1HD1 ILE 23 5.927 -23.002 -8.208 179 HD12 ILE 23 2HD1 ILE 23 6.984 -23.649 -9.487 180 HD13 ILE 23 3HD1 ILE 23 5.456 -24.472 -9.091 181 HA PRO 24 HA PRO 24 10.075 -30.625 -7.446 182 HB2 PRO 24 1HB PRO 24 7.234 -31.644 -7.069 183 HB3 PRO 24 2HB PRO 24 8.748 -32.320 -6.454 184 HG2 PRO 24 1HG PRO 24 7.214 -30.940 -4.775 185 HG3 PRO 24 2HG PRO 24 8.959 -30.671 -4.750 186 HD2 PRO 24 1HD PRO 24 6.778 -28.997 -6.059 187 HD3 PRO 24 2HD PRO 24 8.221 -28.452 -5.114 188 H TYR 25 H TYR 25 10.347 -31.593 -9.400 189 HA TYR 25 HA TYR 25 8.838 -30.650 -11.667 190 HB2 TYR 25 1HB TYR 25 10.312 -31.987 -12.996 191 HB3 TYR 25 2HB TYR 25 11.279 -31.330 -11.683 192 HD1 TYR 25 HD1 TYR 25 9.783 -34.356 -13.115 193 HD2 TYR 25 HD2 TYR 25 12.137 -32.751 -9.906 194 HE1 TYR 25 HE1 TYR 25 10.514 -36.638 -12.510 195 HE2 TYR 25 HE2 TYR 25 12.868 -35.033 -9.301 196 HH TYR 25 HH TYR 25 11.476 -37.870 -10.803 197 H GLU 26 H GLU 26 8.365 -33.208 -9.444 198 HA GLU 26 HA GLU 26 6.686 -34.776 -11.278 199 HB2 GLU 26 1HB GLU 26 7.205 -35.007 -8.286 200 HB3 GLU 26 2HB GLU 26 6.194 -36.115 -9.203 201 HG2 GLU 26 1HG GLU 26 8.133 -36.741 -10.586 202 HG3 GLU 26 2HG GLU 26 9.146 -35.632 -9.665 203 H ALA 27 H ALA 27 6.344 -31.995 -9.381 204 HA ALA 27 HA ALA 27 3.533 -32.440 -8.695 205 HB1 ALA 27 1HB ALA 27 3.632 -30.125 -7.831 206 HB2 ALA 27 2HB ALA 27 4.964 -31.122 -7.199 207 HB3 ALA 27 3HB ALA 27 5.270 -29.952 -8.504 208 H THR 28 H THR 28 1.748 -31.479 -9.572 209 HA THR 28 HA THR 28 2.183 -30.297 -12.278 210 HB THR 28 HB THR 28 -0.063 -31.042 -12.850 211 HG1 THR 28 HG1 THR 28 -1.133 -32.381 -11.130 212 HG21 THR 28 1HG2 THR 28 0.206 -33.481 -12.629 213 HG22 THR 28 2HG2 THR 28 1.751 -32.706 -13.054 214 HG23 THR 28 3HG2 THR 28 1.451 -33.235 -11.383 215 H GLU 29 H GLU 29 0.335 -28.809 -12.964 216 HA GLU 29 HA GLU 29 0.237 -26.563 -11.183 217 HB2 GLU 29 1HB GLU 29 -1.295 -27.257 -13.714 218 HB3 GLU 29 2HB GLU 29 -1.539 -25.747 -12.847 219 HG2 GLU 29 1HG GLU 29 0.847 -25.192 -13.157 220 HG3 GLU 29 2HG GLU 29 1.071 -26.694 -14.050 221 H GLU 30 H GLU 30 -1.871 -29.313 -11.714 222 HA GLU 30 HA GLU 30 -4.134 -28.230 -10.279 223 HB2 GLU 30 1HB GLU 30 -3.313 -31.078 -10.965 224 HB3 GLU 30 2HB GLU 30 -4.818 -30.676 -10.150 225 HG2 GLU 30 1HG GLU 30 -3.994 -29.715 -12.900 226 HG3 GLU 30 2HG GLU 30 -5.109 -31.036 -12.557 227 H GLN 31 H GLN 31 -1.310 -30.183 -9.381 228 HA GLN 31 HA GLN 31 -2.054 -30.507 -6.625 229 HB2 GLN 31 1HB GLN 31 0.646 -30.519 -8.025 230 HB3 GLN 31 2HB GLN 31 0.450 -30.860 -6.312 231 HG2 GLN 31 1HG GLN 31 -0.995 -32.770 -6.845 232 HG3 GLN 31 2HG GLN 31 -0.790 -32.424 -8.586 233 HE21 GLN 31 1HE2 GLN 31 1.755 -34.831 -8.495 234 HE22 GLN 31 2HE2 GLN 31 0.146 -34.440 -9.005 235 H LEU 32 H LEU 32 -0.120 -28.060 -8.349 236 HA LEU 32 HA LEU 32 0.470 -26.477 -6.041 237 HB2 LEU 32 1HB LEU 32 0.235 -25.779 -8.985 238 HB3 LEU 32 2HB LEU 32 0.764 -24.627 -7.755 239 HG LEU 32 HG LEU 32 2.182 -27.246 -8.358 240 HD11 LEU 32 1HD1 LEU 32 3.824 -25.847 -9.529 241 HD12 LEU 32 2HD1 LEU 32 2.222 -25.764 -10.298 242 HD13 LEU 32 3HD1 LEU 32 2.791 -24.422 -9.277 243 HD21 LEU 32 1HD2 LEU 32 3.996 -26.195 -7.049 244 HD22 LEU 32 2HD2 LEU 32 2.965 -24.772 -6.761 245 HD23 LEU 32 3HD2 LEU 32 2.514 -26.352 -6.076 246 H LYS 33 H LYS 33 -2.252 -26.505 -8.318 247 HA LYS 33 HA LYS 33 -3.633 -24.222 -7.482 248 HB2 LYS 33 1HB LYS 33 -4.343 -25.721 -9.341 249 HB3 LYS 33 2HB LYS 33 -4.829 -26.937 -8.167 250 HG2 LYS 33 1HG LYS 33 -6.494 -25.335 -7.236 251 HG3 LYS 33 2HG LYS 33 -6.039 -24.178 -8.495 252 HD2 LYS 33 1HD LYS 33 -7.945 -25.273 -9.359 253 HD3 LYS 33 2HD LYS 33 -6.582 -26.046 -10.182 254 HE2 LYS 33 1HE LYS 33 -6.652 -27.897 -8.525 255 HE3 LYS 33 2HE LYS 33 -8.042 -27.135 -7.747 256 HZ1 LYS 33 1HZ LYS 33 -8.711 -28.845 -9.269 257 HZ2 LYS 33 2HZ LYS 33 -9.255 -27.382 -9.803 258 HZ3 LYS 33 3HZ LYS 33 -7.957 -28.095 -10.529 259 H ASP 34 H ASP 34 -3.866 -27.510 -6.084 260 HA ASP 34 HA ASP 34 -5.589 -26.829 -3.941 261 HB2 ASP 34 1HB ASP 34 -3.448 -28.969 -4.211 262 HB3 ASP 34 2HB ASP 34 -4.485 -28.839 -2.796 263 H ILE 35 H ILE 35 -2.021 -26.873 -4.103 264 HA ILE 35 HA ILE 35 -1.515 -26.127 -1.430 265 HB ILE 35 HB ILE 35 0.036 -25.540 -3.982 266 HG12 ILE 35 1HG1 ILE 35 -0.203 -27.903 -3.421 267 HG13 ILE 35 2HG1 ILE 35 1.460 -27.360 -3.252 268 HG21 ILE 35 1HG2 ILE 35 1.939 -25.010 -2.514 269 HG22 ILE 35 2HG2 ILE 35 0.600 -23.867 -2.262 270 HG23 ILE 35 3HG2 ILE 35 0.889 -25.171 -1.087 271 HD11 ILE 35 1HD1 ILE 35 0.832 -28.842 -1.430 272 HD12 ILE 35 2HD1 ILE 35 1.176 -27.206 -0.816 273 HD13 ILE 35 3HD1 ILE 35 -0.507 -27.758 -0.987 274 H PHE 36 H PHE 36 -2.267 -24.137 -4.269 275 HA PHE 36 HA PHE 36 -1.792 -21.631 -2.888 276 HB2 PHE 36 1HB PHE 36 -3.319 -22.233 -5.453 277 HB3 PHE 36 2HB PHE 36 -2.899 -20.625 -4.885 278 HD1 PHE 36 HD1 PHE 36 -0.106 -21.539 -3.798 279 HD2 PHE 36 HD2 PHE 36 -2.135 -22.006 -7.529 280 HE1 PHE 36 HE1 PHE 36 2.070 -21.694 -4.960 281 HE2 PHE 36 HE2 PHE 36 0.040 -22.164 -8.694 282 HZ PHE 36 HZ PHE 36 2.143 -22.006 -7.408 283 H SER 37 H SER 37 -4.596 -23.695 -3.493 284 HA SER 37 HA SER 37 -6.561 -21.722 -2.767 285 HB2 SER 37 1HB SER 37 -8.135 -23.525 -2.835 286 HB3 SER 37 2HB SER 37 -6.986 -23.779 -4.140 287 HG SER 37 HG SER 37 -5.845 -25.017 -2.347 288 H GLU 38 H GLU 38 -4.536 -23.901 -0.955 289 HA GLU 38 HA GLU 38 -6.008 -23.886 1.498 290 HB2 GLU 38 1HB GLU 38 -3.050 -24.212 0.879 291 HB3 GLU 38 2HB GLU 38 -3.692 -24.324 2.512 292 HG2 GLU 38 1HG GLU 38 -5.177 -26.178 1.756 293 HG3 GLU 38 2HG GLU 38 -4.412 -26.099 0.171 294 H VAL 39 H VAL 39 -3.949 -21.532 -0.058 295 HA VAL 39 HA VAL 39 -3.623 -19.902 2.341 296 HB VAL 39 HB VAL 39 -3.133 -19.306 -0.608 297 HG11 VAL 39 1HG1 VAL 39 -1.866 -17.362 0.169 298 HG12 VAL 39 2HG1 VAL 39 -3.589 -17.251 0.601 299 HG13 VAL 39 3HG1 VAL 39 -2.387 -17.691 1.838 300 HG21 VAL 39 1HG2 VAL 39 -0.758 -19.578 0.030 301 HG22 VAL 39 2HG2 VAL 39 -1.251 -19.978 1.692 302 HG23 VAL 39 3HG2 VAL 39 -1.683 -21.063 0.349 303 H GLY 40 H GLY 40 -5.501 -19.630 -0.698 304 HA2 GLY 40 1HA GLY 40 -7.875 -18.673 0.453 305 HA3 GLY 40 2HA GLY 40 -6.907 -17.245 0.137 306 HA PRO 41 HA PRO 41 -9.425 -18.450 -3.596 307 HB2 PRO 41 1HB PRO 41 -9.714 -15.428 -3.583 308 HB3 PRO 41 2HB PRO 41 -10.928 -16.661 -3.947 309 HG2 PRO 41 1HG PRO 41 -11.009 -15.466 -1.567 310 HG3 PRO 41 2HG PRO 41 -11.265 -17.211 -1.657 311 HD2 PRO 41 1HD PRO 41 -8.743 -15.680 -0.898 312 HD3 PRO 41 2HD PRO 41 -9.468 -17.142 -0.115 313 H VAL 42 H VAL 42 -8.679 -18.363 -5.697 314 HA VAL 42 HA VAL 42 -6.194 -16.755 -6.123 315 HB VAL 42 HB VAL 42 -6.771 -19.589 -7.089 316 HG11 VAL 42 1HG1 VAL 42 -4.460 -19.560 -7.893 317 HG12 VAL 42 2HG1 VAL 42 -5.461 -18.329 -8.698 318 HG13 VAL 42 3HG1 VAL 42 -4.317 -17.851 -7.420 319 HG21 VAL 42 1HG2 VAL 42 -4.939 -20.217 -5.549 320 HG22 VAL 42 2HG2 VAL 42 -4.819 -18.527 -5.004 321 HG23 VAL 42 3HG2 VAL 42 -6.291 -19.469 -4.668 322 H VAL 43 H VAL 43 -6.066 -15.596 -7.939 323 HA VAL 43 HA VAL 43 -8.311 -15.620 -9.816 324 HB VAL 43 HB VAL 43 -5.696 -14.053 -9.777 325 HG11 VAL 43 1HG1 VAL 43 -6.709 -12.639 -11.498 326 HG12 VAL 43 2HG1 VAL 43 -6.481 -14.312 -12.060 327 HG13 VAL 43 3HG1 VAL 43 -8.101 -13.745 -11.586 328 HG21 VAL 43 1HG2 VAL 43 -7.167 -12.182 -9.102 329 HG22 VAL 43 2HG2 VAL 43 -8.568 -13.280 -9.115 330 HG23 VAL 43 3HG2 VAL 43 -7.256 -13.523 -7.936 331 H SER 44 H SER 44 -4.783 -16.226 -10.019 332 HA SER 44 HA SER 44 -5.216 -18.180 -12.159 333 HB2 SER 44 1HB SER 44 -3.999 -17.044 -13.867 334 HB3 SER 44 2HB SER 44 -5.242 -15.936 -13.304 335 HG SER 44 HG SER 44 -3.799 -14.661 -12.593 336 H PHE 45 H PHE 45 -3.126 -19.109 -12.930 337 HA PHE 45 HA PHE 45 -0.690 -18.543 -11.512 338 HB2 PHE 45 1HB PHE 45 -0.509 -20.685 -10.263 339 HB3 PHE 45 2HB PHE 45 -1.780 -19.647 -9.636 340 HD1 PHE 45 HD1 PHE 45 -1.022 -22.771 -11.375 341 HD2 PHE 45 HD2 PHE 45 -4.132 -20.223 -9.929 342 HE1 PHE 45 HE1 PHE 45 -2.646 -24.619 -11.616 343 HE2 PHE 45 HE2 PHE 45 -5.758 -22.069 -10.166 344 HZ PHE 45 HZ PHE 45 -5.015 -24.268 -11.011 345 H ARG 46 H ARG 46 1.065 -19.984 -12.103 346 HA ARG 46 HA ARG 46 0.540 -21.792 -14.371 347 HB2 ARG 46 1HB ARG 46 0.707 -19.555 -15.419 348 HB3 ARG 46 2HB ARG 46 2.277 -19.317 -14.668 349 HG2 ARG 46 1HG ARG 46 3.159 -21.251 -15.946 350 HG3 ARG 46 2HG ARG 46 1.578 -21.400 -16.750 351 HD2 ARG 46 1HD ARG 46 3.307 -18.939 -16.787 352 HD3 ARG 46 2HD ARG 46 3.249 -20.173 -18.067 353 HE ARG 46 HE ARG 46 0.628 -19.438 -17.733 354 HH11 ARG 46 1HH1 ARG 46 3.611 -17.706 -18.398 355 HH12 ARG 46 2HH1 ARG 46 2.821 -16.445 -19.317 356 HH21 ARG 46 1HH2 ARG 46 -0.386 -17.795 -18.928 357 HH22 ARG 46 2HH2 ARG 46 0.559 -16.494 -19.618 358 H LEU 47 H LEU 47 1.975 -23.419 -14.474 359 HA LEU 47 HA LEU 47 4.525 -23.101 -12.959 360 HB2 LEU 47 1HB LEU 47 3.215 -25.010 -12.231 361 HB3 LEU 47 2HB LEU 47 3.036 -25.578 -13.894 362 HG LEU 47 HG LEU 47 5.494 -26.000 -13.979 363 HD11 LEU 47 1HD1 LEU 47 6.765 -25.955 -11.879 364 HD12 LEU 47 2HD1 LEU 47 6.180 -24.336 -12.328 365 HD13 LEU 47 3HD1 LEU 47 5.360 -25.254 -11.043 366 HD21 LEU 47 1HD2 LEU 47 5.419 -27.980 -12.502 367 HD22 LEU 47 2HD2 LEU 47 3.994 -27.308 -11.673 368 HD23 LEU 47 3HD2 LEU 47 3.887 -27.782 -13.386 369 H VAL 48 H VAL 48 6.291 -22.701 -14.073 370 HA VAL 48 HA VAL 48 6.200 -22.868 -16.998 371 HB VAL 48 HB VAL 48 8.401 -21.929 -15.108 372 HG11 VAL 48 1HG1 VAL 48 9.382 -20.877 -17.088 373 HG12 VAL 48 2HG1 VAL 48 9.311 -22.648 -17.241 374 HG13 VAL 48 3HG1 VAL 48 8.134 -21.632 -18.107 375 HG21 VAL 48 1HG2 VAL 48 7.650 -19.670 -15.783 376 HG22 VAL 48 2HG2 VAL 48 6.349 -20.395 -16.756 377 HG23 VAL 48 3HG2 VAL 48 6.340 -20.572 -14.985 378 H TYR 49 H TYR 49 7.307 -24.226 -18.301 379 HA TYR 49 HA TYR 49 9.030 -26.280 -17.015 380 HB2 TYR 49 1HB TYR 49 7.828 -28.101 -18.102 381 HB3 TYR 49 2HB TYR 49 6.723 -27.196 -17.076 382 HD1 TYR 49 HD1 TYR 49 7.585 -28.134 -20.496 383 HD2 TYR 49 HD2 TYR 49 5.004 -25.733 -18.049 384 HE1 TYR 49 HE1 TYR 49 6.054 -27.826 -22.411 385 HE2 TYR 49 HE2 TYR 49 3.474 -25.426 -19.965 386 HH TYR 49 HH TYR 49 3.075 -25.889 -22.094 387 H ALA 50 H ALA 50 10.213 -27.611 -18.572 388 HA ALA 50 HA ALA 50 11.366 -25.888 -20.601 389 HB1 ALA 50 1HB ALA 50 12.859 -27.811 -21.041 390 HB2 ALA 50 2HB ALA 50 12.763 -27.434 -19.304 391 HB3 ALA 50 3HB ALA 50 11.864 -28.819 -19.966 392 H ARG 51 H ARG 51 11.016 -25.787 -22.709 393 HA ARG 51 HA ARG 51 8.707 -27.200 -23.778 394 HB2 ARG 51 1HB ARG 51 10.701 -25.313 -25.078 395 HB3 ARG 51 2HB ARG 51 9.268 -25.946 -25.874 396 HG2 ARG 51 1HG ARG 51 7.836 -24.824 -24.228 397 HG3 ARG 51 2HG ARG 51 9.283 -24.196 -23.402 398 HD2 ARG 51 1HD ARG 51 9.922 -23.025 -25.441 399 HD3 ARG 51 2HD ARG 51 8.452 -23.631 -26.238 400 HE ARG 51 HE ARG 51 7.707 -22.332 -23.846 401 HH11 ARG 51 1HH1 ARG 51 9.065 -21.585 -26.998 402 HH12 ARG 51 2HH1 ARG 51 8.408 -19.964 -27.037 403 HH21 ARG 51 1HH2 ARG 51 6.859 -20.226 -23.907 404 HH22 ARG 51 2HH2 ARG 51 7.159 -19.194 -25.287 405 H GLU 52 H GLU 52 9.950 -29.313 -23.242 406 HA GLU 52 HA GLU 52 10.938 -30.357 -25.796 407 HB2 GLU 52 1HB GLU 52 13.002 -29.432 -24.764 408 HB3 GLU 52 2HB GLU 52 12.719 -30.402 -23.325 409 HG2 GLU 52 1HG GLU 52 12.980 -32.455 -24.623 410 HG3 GLU 52 2HG GLU 52 13.190 -31.515 -26.099 411 H THR 53 H THR 53 11.691 -31.648 -22.596 412 HA THR 53 HA THR 53 10.085 -34.032 -23.164 413 HB THR 53 HB THR 53 10.956 -34.874 -21.018 414 HG1 THR 53 HG1 THR 53 12.554 -33.356 -19.990 415 HG21 THR 53 1HG2 THR 53 13.361 -34.821 -21.552 416 HG22 THR 53 2HG2 THR 53 12.388 -35.053 -23.024 417 HG23 THR 53 3HG2 THR 53 13.089 -33.459 -22.662 418 H GLY 54 H GLY 54 9.672 -31.021 -21.541 419 HA2 GLY 54 1HA GLY 54 7.486 -30.252 -20.895 420 HA3 GLY 54 2HA GLY 54 6.979 -31.912 -20.645 421 H LYS 55 H LYS 55 10.012 -31.767 -19.372 422 HA LYS 55 HA LYS 55 9.135 -32.001 -16.674 423 HB2 LYS 55 1HB LYS 55 11.274 -32.933 -17.556 424 HB3 LYS 55 2HB LYS 55 11.912 -31.302 -17.712 425 HG2 LYS 55 1HG LYS 55 11.748 -30.988 -15.278 426 HG3 LYS 55 2HG LYS 55 11.077 -32.616 -15.110 427 HD2 LYS 55 1HD LYS 55 13.146 -33.575 -16.060 428 HD3 LYS 55 2HD LYS 55 13.817 -31.949 -16.249 429 HE2 LYS 55 1HE LYS 55 13.641 -31.612 -13.790 430 HE3 LYS 55 2HE LYS 55 13.030 -33.259 -13.621 431 HZ1 LYS 55 1HZ LYS 55 15.373 -33.139 -13.192 432 HZ2 LYS 55 2HZ LYS 55 15.100 -34.059 -14.534 433 HZ3 LYS 55 3HZ LYS 55 15.671 -32.520 -14.691 434 HA PRO 56 HA PRO 56 8.348 -27.773 -15.704 435 HB2 PRO 56 1HB PRO 56 8.640 -28.962 -12.922 436 HB3 PRO 56 2HB PRO 56 7.379 -27.891 -13.547 437 HG2 PRO 56 1HG PRO 56 6.821 -30.480 -13.298 438 HG3 PRO 56 2HG PRO 56 6.299 -29.634 -14.758 439 HD2 PRO 56 1HD PRO 56 8.715 -31.444 -14.349 440 HD3 PRO 56 2HD PRO 56 7.554 -31.389 -15.736 441 H LYS 57 H LYS 57 9.654 -26.061 -15.149 442 HA LYS 57 HA LYS 57 12.476 -26.603 -14.635 443 HB2 LYS 57 1HB LYS 57 10.894 -24.017 -14.891 444 HB3 LYS 57 2HB LYS 57 12.632 -24.074 -14.627 445 HG2 LYS 57 1HG LYS 57 12.886 -25.339 -16.758 446 HG3 LYS 57 2HG LYS 57 11.145 -25.175 -17.028 447 HD2 LYS 57 1HD LYS 57 11.381 -22.702 -16.964 448 HD3 LYS 57 2HD LYS 57 13.127 -22.887 -16.736 449 HE2 LYS 57 1HE LYS 57 13.282 -24.072 -18.904 450 HE3 LYS 57 2HE LYS 57 11.542 -23.882 -19.133 451 HZ1 LYS 57 1HZ LYS 57 12.773 -22.203 -20.296 452 HZ2 LYS 57 2HZ LYS 57 11.857 -21.503 -19.115 453 HZ3 LYS 57 3HZ LYS 57 13.483 -21.681 -18.902 454 H GLY 58 H GLY 58 9.680 -25.995 -12.734 455 HA2 GLY 58 1HA GLY 58 9.681 -26.436 -10.378 456 HA3 GLY 58 2HA GLY 58 11.391 -26.053 -10.307 457 H TYR 59 H TYR 59 9.637 -23.849 -12.228 458 HA TYR 59 HA TYR 59 9.260 -21.988 -9.930 459 HB2 TYR 59 1HB TYR 59 10.584 -21.258 -12.573 460 HB3 TYR 59 2HB TYR 59 10.240 -20.153 -11.250 461 HD1 TYR 59 HD1 TYR 59 12.502 -22.660 -12.561 462 HD2 TYR 59 HD2 TYR 59 11.449 -20.386 -9.079 463 HE1 TYR 59 HE1 TYR 59 14.708 -23.162 -11.565 464 HE2 TYR 59 HE2 TYR 59 13.655 -20.887 -8.084 465 HH TYR 59 HH TYR 59 16.054 -22.853 -9.825 466 H GLY 60 H GLY 60 7.717 -20.362 -10.199 467 HA2 GLY 60 1HA GLY 60 6.233 -20.017 -12.652 468 HA3 GLY 60 2HA GLY 60 5.350 -21.055 -11.548 469 H PHE 61 H PHE 61 3.718 -19.404 -11.439 470 HA PHE 61 HA PHE 61 4.240 -17.556 -9.221 471 HB2 PHE 61 1HB PHE 61 3.444 -15.559 -10.397 472 HB3 PHE 61 2HB PHE 61 4.889 -16.188 -11.171 473 HD1 PHE 61 HD1 PHE 61 1.240 -15.808 -11.468 474 HD2 PHE 61 HD2 PHE 61 4.836 -17.062 -13.403 475 HE1 PHE 61 HE1 PHE 61 0.050 -15.870 -13.634 476 HE2 PHE 61 HE2 PHE 61 3.651 -17.123 -15.572 477 HZ PHE 61 HZ PHE 61 1.256 -16.528 -15.687 478 H CYS 62 H CYS 62 2.250 -16.477 -8.473 479 HA CYS 62 HA CYS 62 -0.251 -17.782 -9.382 480 HB2 CYS 62 1HB CYS 62 0.598 -19.201 -7.539 481 HB3 CYS 62 2HB CYS 62 0.695 -17.794 -6.489 482 HG CYS 62 HG CYS 62 -1.865 -17.222 -6.643 483 H GLU 63 H GLU 63 -1.764 -16.306 -9.652 484 HA GLU 63 HA GLU 63 -1.503 -13.718 -8.216 485 HB2 GLU 63 1HB GLU 63 -1.766 -13.670 -10.688 486 HB3 GLU 63 2HB GLU 63 -3.299 -14.517 -10.543 487 HG2 GLU 63 1HG GLU 63 -4.226 -12.624 -9.268 488 HG3 GLU 63 2HG GLU 63 -2.689 -11.774 -9.419 489 H TYR 64 H TYR 64 -2.606 -13.375 -6.440 490 HA TYR 64 HA TYR 64 -4.953 -15.101 -5.870 491 HB2 TYR 64 1HB TYR 64 -3.254 -13.292 -4.112 492 HB3 TYR 64 2HB TYR 64 -4.718 -14.084 -3.547 493 HD1 TYR 64 HD1 TYR 64 -1.218 -14.525 -4.494 494 HD2 TYR 64 HD2 TYR 64 -4.820 -16.520 -3.289 495 HE1 TYR 64 HE1 TYR 64 0.087 -16.552 -3.948 496 HE2 TYR 64 HE2 TYR 64 -3.515 -18.547 -2.743 497 HH TYR 64 HH TYR 64 -1.507 -19.479 -2.675 498 H GLN 65 H GLN 65 -6.820 -14.124 -4.762 499 HA GLN 65 HA GLN 65 -7.772 -11.930 -6.435 500 HB2 GLN 65 1HB GLN 65 -9.087 -13.543 -4.215 501 HB3 GLN 65 2HB GLN 65 -9.911 -12.279 -5.118 502 HG2 GLN 65 1HG GLN 65 -9.498 -13.540 -7.213 503 HG3 GLN 65 2HG GLN 65 -8.769 -14.846 -6.236 504 HE21 GLN 65 1HE2 GLN 65 -12.101 -16.100 -6.669 505 HE22 GLN 65 2HE2 GLN 65 -10.561 -16.010 -7.459 506 H ASP 66 H ASP 66 -6.028 -12.066 -3.597 507 HA ASP 66 HA ASP 66 -6.667 -9.236 -3.052 508 HB2 ASP 66 1HB ASP 66 -8.126 -10.761 -1.563 509 HB3 ASP 66 2HB ASP 66 -6.633 -11.224 -0.759 510 H GLN 67 H GLN 67 -5.002 -8.073 -2.179 511 HA GLN 67 HA GLN 67 -2.373 -9.108 -2.657 512 HB2 GLN 67 1HB GLN 67 -3.337 -6.606 -1.221 513 HB3 GLN 67 2HB GLN 67 -1.641 -6.955 -1.520 514 HG2 GLN 67 1HG GLN 67 -2.006 -6.916 -3.918 515 HG3 GLN 67 2HG GLN 67 -3.757 -6.674 -3.663 516 HE21 GLN 67 1HE2 GLN 67 -2.744 -3.314 -4.348 517 HE22 GLN 67 2HE2 GLN 67 -3.221 -4.791 -5.117 518 H GLU 68 H GLU 68 -4.331 -8.735 0.260 519 HA GLU 68 HA GLU 68 -2.195 -9.376 2.092 520 HB2 GLU 68 1HB GLU 68 -4.273 -8.173 2.762 521 HB3 GLU 68 2HB GLU 68 -5.209 -9.627 2.448 522 HG2 GLU 68 1HG GLU 68 -4.819 -9.387 4.812 523 HG3 GLU 68 2HG GLU 68 -3.978 -10.814 4.210 524 H THR 69 H THR 69 -4.659 -11.271 0.388 525 HA THR 69 HA THR 69 -4.039 -13.789 1.585 526 HB THR 69 HB THR 69 -5.061 -13.173 -1.222 527 HG1 THR 69 HG1 THR 69 -6.289 -12.536 0.790 528 HG21 THR 69 1HG2 THR 69 -5.884 -15.495 -1.183 529 HG22 THR 69 2HG2 THR 69 -4.110 -15.446 -1.039 530 HG23 THR 69 3HG2 THR 69 -5.112 -15.747 0.400 531 H ALA 70 H ALA 70 -2.679 -12.087 -1.230 532 HA ALA 70 HA ALA 70 -0.794 -14.094 -1.947 533 HB1 ALA 70 1HB ALA 70 0.438 -12.250 -3.042 534 HB2 ALA 70 2HB ALA 70 -1.306 -12.177 -3.392 535 HB3 ALA 70 3HB ALA 70 -0.591 -11.071 -2.197 536 H LEU 71 H LEU 71 -0.622 -11.422 0.390 537 HA LEU 71 HA LEU 71 2.092 -11.893 1.174 538 HB2 LEU 71 1HB LEU 71 -0.262 -10.637 2.618 539 HB3 LEU 71 2HB LEU 71 1.370 -10.686 3.289 540 HG LEU 71 HG LEU 71 0.619 -9.322 0.680 541 HD11 LEU 71 1HD1 LEU 71 0.872 -7.240 1.955 542 HD12 LEU 71 2HD1 LEU 71 -0.446 -8.248 2.597 543 HD13 LEU 71 3HD1 LEU 71 1.117 -8.182 3.445 544 HD21 LEU 71 1HD2 LEU 71 2.872 -8.332 0.903 545 HD22 LEU 71 2HD2 LEU 71 3.148 -9.289 2.378 546 HD23 LEU 71 3HD2 LEU 71 2.960 -10.107 0.809 547 H SER 72 H SER 72 -1.004 -13.244 2.225 548 HA SER 72 HA SER 72 -0.032 -14.704 4.470 549 HB2 SER 72 1HB SER 72 -2.311 -15.284 2.551 550 HB3 SER 72 2HB SER 72 -2.027 -16.172 4.040 551 HG SER 72 HG SER 72 -2.577 -13.436 3.717 552 H ALA 73 H ALA 73 -0.214 -15.518 1.009 553 HA ALA 73 HA ALA 73 0.870 -18.138 1.216 554 HB1 ALA 73 1HB ALA 73 1.521 -17.831 -1.151 555 HB2 ALA 73 2HB ALA 73 -0.143 -17.279 -0.848 556 HB3 ALA 73 3HB ALA 73 1.172 -16.093 -1.013 557 H MET 74 H MET 74 2.460 -14.969 0.857 558 HA MET 74 HA MET 74 5.131 -15.973 0.808 559 HB2 MET 74 1HB MET 74 3.986 -13.308 1.713 560 HB3 MET 74 2HB MET 74 5.710 -13.632 1.620 561 HG2 MET 74 1HG MET 74 5.561 -13.994 -0.781 562 HG3 MET 74 2HG MET 74 3.805 -13.821 -0.730 563 HE1 MET 74 1HE MET 74 6.842 -10.406 -0.027 564 HE2 MET 74 2HE MET 74 6.681 -11.779 1.096 565 HE3 MET 74 3HE MET 74 7.269 -12.049 -0.563 566 H ARG 75 H ARG 75 2.900 -15.298 3.442 567 HA ARG 75 HA ARG 75 4.907 -15.617 5.518 568 HB2 ARG 75 1HB ARG 75 1.879 -15.586 5.520 569 HB3 ARG 75 2HB ARG 75 2.810 -15.898 6.978 570 HG2 ARG 75 1HG ARG 75 3.973 -13.674 6.568 571 HG3 ARG 75 2HG ARG 75 2.732 -13.373 5.327 572 HD2 ARG 75 1HD ARG 75 2.101 -14.097 8.173 573 HD3 ARG 75 2HD ARG 75 2.263 -12.426 7.585 574 HE ARG 75 HE ARG 75 0.135 -14.350 6.916 575 HH11 ARG 75 1HH1 ARG 75 1.550 -11.159 6.519 576 HH12 ARG 75 2HH1 ARG 75 0.096 -10.462 5.840 577 HH21 ARG 75 1HH2 ARG 75 -1.746 -13.434 6.034 578 HH22 ARG 75 2HH2 ARG 75 -1.770 -11.749 5.565 579 H ASN 76 H ASN 76 2.545 -17.727 3.906 580 HA ASN 76 HA ASN 76 3.042 -19.811 5.959 581 HB2 ASN 76 1HB ASN 76 0.909 -19.474 3.832 582 HB3 ASN 76 2HB ASN 76 1.082 -20.939 4.790 583 HD21 ASN 76 1HD2 ASN 76 -1.408 -18.638 6.347 584 HD22 ASN 76 2HD2 ASN 76 -1.207 -19.320 4.768 585 H LEU 77 H LEU 77 3.003 -19.449 2.402 586 HA LEU 77 HA LEU 77 3.766 -22.237 2.059 587 HB2 LEU 77 1HB LEU 77 3.481 -19.924 0.113 588 HB3 LEU 77 2HB LEU 77 3.897 -21.569 -0.376 589 HG LEU 77 HG LEU 77 1.303 -20.695 0.944 590 HD11 LEU 77 1HD1 LEU 77 0.327 -21.260 -1.236 591 HD12 LEU 77 2HD1 LEU 77 1.532 -19.959 -1.373 592 HD13 LEU 77 3HD1 LEU 77 1.950 -21.615 -1.871 593 HD21 LEU 77 1HD2 LEU 77 0.600 -23.027 0.526 594 HD22 LEU 77 2HD2 LEU 77 2.229 -23.409 -0.085 595 HD23 LEU 77 3HD2 LEU 77 2.000 -22.967 1.624 596 H ASN 78 H ASN 78 5.382 -19.107 2.009 597 HA ASN 78 HA ASN 78 7.849 -20.042 0.864 598 HB2 ASN 78 1HB ASN 78 7.147 -17.645 1.005 599 HB3 ASN 78 2HB ASN 78 7.400 -17.701 2.745 600 HD21 ASN 78 1HD2 ASN 78 10.406 -16.546 0.630 601 HD22 ASN 78 2HD2 ASN 78 8.713 -16.294 0.365 602 H GLY 79 H GLY 79 8.987 -21.636 1.666 603 HA2 GLY 79 1HA GLY 79 10.620 -22.363 3.294 604 HA3 GLY 79 2HA GLY 79 9.736 -21.513 4.548 605 H ARG 80 H ARG 80 7.406 -22.917 2.693 606 HA ARG 80 HA ARG 80 7.082 -25.132 4.614 607 HB2 ARG 80 1HB ARG 80 5.146 -23.707 4.107 608 HB3 ARG 80 2HB ARG 80 5.270 -24.108 2.401 609 HG2 ARG 80 1HG ARG 80 4.761 -26.463 2.914 610 HG3 ARG 80 2HG ARG 80 4.617 -26.042 4.638 611 HD2 ARG 80 1HD ARG 80 2.788 -24.566 4.163 612 HD3 ARG 80 2HD ARG 80 2.971 -24.855 2.418 613 HE ARG 80 HE ARG 80 2.601 -27.319 3.812 614 HH11 ARG 80 1HH1 ARG 80 0.872 -24.462 2.721 615 HH12 ARG 80 2HH1 ARG 80 -0.666 -25.287 2.597 616 HH21 ARG 80 1HH2 ARG 80 0.599 -28.378 3.647 617 HH22 ARG 80 2HH2 ARG 80 -0.821 -27.503 3.120 618 H GLU 81 H GLU 81 7.643 -27.150 4.222 619 HA GLU 81 HA GLU 81 8.898 -27.940 1.784 620 HB2 GLU 81 1HB GLU 81 9.322 -29.009 3.994 621 HB3 GLU 81 2HB GLU 81 7.699 -29.684 3.975 622 HG2 GLU 81 1HG GLU 81 8.252 -30.991 1.972 623 HG3 GLU 81 2HG GLU 81 9.872 -30.299 1.961 624 H PHE 82 H PHE 82 8.083 -28.462 -0.107 625 HA PHE 82 HA PHE 82 5.356 -29.691 -0.154 626 HB2 PHE 82 1HB PHE 82 5.430 -27.459 -1.247 627 HB3 PHE 82 2HB PHE 82 6.705 -28.024 -2.315 628 HD1 PHE 82 HD1 PHE 82 3.748 -30.000 -1.262 629 HD2 PHE 82 HD2 PHE 82 5.624 -27.776 -4.390 630 HE1 PHE 82 HE1 PHE 82 2.048 -30.818 -2.860 631 HE2 PHE 82 HE2 PHE 82 3.924 -28.589 -5.991 632 HZ PHE 82 HZ PHE 82 2.136 -30.112 -5.225 633 H SER 83 H SER 83 5.816 -31.818 -0.144 634 HA SER 83 HA SER 83 6.623 -33.855 -0.860 635 HB2 SER 83 1HB SER 83 6.689 -32.397 -3.523 636 HB3 SER 83 2HB SER 83 6.798 -34.139 -3.320 637 HG SER 83 HG SER 83 4.690 -33.106 -3.743 638 H GLY 84 H GLY 84 8.563 -31.979 0.171 639 HA2 GLY 84 1HA GLY 84 10.795 -32.912 0.628 640 HA3 GLY 84 2HA GLY 84 10.950 -33.283 -1.079 641 H ARG 85 H ARG 85 9.624 -30.620 -1.734 642 HA ARG 85 HA ARG 85 12.151 -29.051 -1.506 643 HB2 ARG 85 1HB ARG 85 9.943 -28.968 -3.588 644 HB3 ARG 85 2HB ARG 85 11.297 -27.850 -3.538 645 HG2 ARG 85 1HG ARG 85 11.600 -30.849 -3.814 646 HG3 ARG 85 2HG ARG 85 11.548 -29.704 -5.176 647 HD2 ARG 85 1HD ARG 85 13.533 -29.626 -2.917 648 HD3 ARG 85 2HD ARG 85 13.821 -30.333 -4.524 649 HE ARG 85 HE ARG 85 13.657 -27.496 -3.826 650 HH11 ARG 85 1HH1 ARG 85 13.742 -29.923 -6.365 651 HH12 ARG 85 2HH1 ARG 85 14.255 -28.795 -7.599 652 HH21 ARG 85 1HH2 ARG 85 14.324 -26.041 -5.437 653 HH22 ARG 85 2HH2 ARG 85 14.585 -26.598 -7.075 654 H ALA 86 H ALA 86 12.055 -27.564 0.030 655 HA ALA 86 HA ALA 86 9.640 -26.340 0.960 656 HB1 ALA 86 1HB ALA 86 11.149 -24.745 2.100 657 HB2 ALA 86 2HB ALA 86 11.677 -26.430 2.326 658 HB3 ALA 86 3HB ALA 86 12.518 -25.382 1.160 659 H LEU 87 H LEU 87 8.390 -24.889 0.052 660 HA LEU 87 HA LEU 87 9.079 -23.872 -2.558 661 HB2 LEU 87 1HB LEU 87 6.750 -23.287 -0.699 662 HB3 LEU 87 2HB LEU 87 6.877 -22.667 -2.348 663 HG LEU 87 HG LEU 87 6.755 -25.612 -1.604 664 HD11 LEU 87 1HD1 LEU 87 4.468 -25.500 -2.488 665 HD12 LEU 87 2HD1 LEU 87 4.677 -24.446 -1.070 666 HD13 LEU 87 3HD1 LEU 87 4.637 -23.743 -2.704 667 HD21 LEU 87 1HD2 LEU 87 6.404 -25.903 -4.033 668 HD22 LEU 87 2HD2 LEU 87 6.600 -24.150 -4.273 669 HD23 LEU 87 3HD2 LEU 87 7.973 -25.129 -3.702 670 H ARG 88 H ARG 88 9.737 -21.900 -3.223 671 HA ARG 88 HA ARG 88 10.055 -19.792 -1.140 672 HB2 ARG 88 1HB ARG 88 12.086 -20.287 -2.403 673 HB3 ARG 88 2HB ARG 88 11.242 -20.041 -3.924 674 HG2 ARG 88 1HG ARG 88 11.027 -17.692 -3.527 675 HG3 ARG 88 2HG ARG 88 11.600 -17.867 -1.851 676 HD2 ARG 88 1HD ARG 88 13.370 -17.019 -3.191 677 HD3 ARG 88 2HD ARG 88 13.750 -18.697 -2.740 678 HE ARG 88 HE ARG 88 13.547 -19.342 -4.953 679 HH11 ARG 88 1HH1 ARG 88 12.503 -16.011 -4.560 680 HH12 ARG 88 2HH1 ARG 88 12.474 -15.686 -6.279 681 HH21 ARG 88 1HH2 ARG 88 13.506 -18.908 -7.181 682 HH22 ARG 88 2HH2 ARG 88 13.041 -17.325 -7.763 683 H VAL 89 H VAL 89 8.476 -18.373 -0.983 684 HA VAL 89 HA VAL 89 7.016 -17.624 -3.483 685 HB VAL 89 HB VAL 89 5.928 -17.764 -0.638 686 HG11 VAL 89 1HG1 VAL 89 3.764 -17.259 -1.662 687 HG12 VAL 89 2HG1 VAL 89 4.936 -15.942 -1.898 688 HG13 VAL 89 3HG1 VAL 89 4.559 -17.050 -3.239 689 HG21 VAL 89 1HG2 VAL 89 4.544 -19.611 -1.529 690 HG22 VAL 89 2HG2 VAL 89 5.371 -19.471 -3.099 691 HG23 VAL 89 3HG2 VAL 89 6.278 -19.987 -1.657 692 H ASP 90 H ASP 90 7.719 -15.688 -4.084 693 HA ASP 90 HA ASP 90 8.065 -13.619 -1.954 694 HB2 ASP 90 1HB ASP 90 9.433 -13.801 -4.670 695 HB3 ASP 90 2HB ASP 90 9.646 -12.499 -3.508 696 H ASN 91 H ASN 91 7.779 -11.346 -2.799 697 HA ASN 91 HA ASN 91 5.177 -11.145 -4.086 698 HB2 ASN 91 1HB ASN 91 5.989 -9.613 -2.267 699 HB3 ASN 91 2HB ASN 91 7.144 -8.936 -3.406 700 HD21 ASN 91 1HD2 ASN 91 3.998 -6.902 -3.265 701 HD22 ASN 91 2HD2 ASN 91 5.077 -7.523 -2.061 702 H ALA 92 H ALA 92 4.756 -11.138 -6.150 703 HA ALA 92 HA ALA 92 6.870 -11.382 -8.057 704 HB1 ALA 92 1HB ALA 92 5.059 -11.363 -9.741 705 HB2 ALA 92 2HB ALA 92 4.679 -12.440 -8.377 706 HB3 ALA 92 3HB ALA 92 3.910 -10.840 -8.488 707 H ALA 93 H ALA 93 5.241 -8.647 -6.739 708 HA ALA 93 HA ALA 93 5.655 -6.857 -8.957 709 HB1 ALA 93 1HB ALA 93 5.178 -5.076 -7.308 710 HB2 ALA 93 2HB ALA 93 3.990 -6.398 -7.213 711 HB3 ALA 93 3HB ALA 93 5.282 -6.273 -5.997 712 H SER 94 H SER 94 7.724 -8.150 -6.532 713 HA SER 94 HA SER 94 9.637 -6.040 -6.355 714 HB2 SER 94 1HB SER 94 9.612 -7.893 -4.777 715 HB3 SER 94 2HB SER 94 9.944 -9.045 -6.061 716 HG SER 94 HG SER 94 11.775 -8.430 -4.875 717 H GLU 95 H GLU 95 11.402 -5.493 -7.513 718 HA GLU 95 HA GLU 95 11.385 -5.941 -10.293 719 HB2 GLU 95 1HB GLU 95 12.531 -4.035 -9.201 720 HB3 GLU 95 2HB GLU 95 13.726 -5.131 -8.521 721 HG2 GLU 95 1HG GLU 95 14.492 -5.719 -10.776 722 HG3 GLU 95 2HG GLU 95 13.276 -4.652 -11.474 723 H LYS 96 H LYS 96 13.400 -7.474 -7.774 724 HA LYS 96 HA LYS 96 14.992 -9.054 -9.486 725 HB2 LYS 96 1HB LYS 96 15.439 -8.777 -7.072 726 HB3 LYS 96 2HB LYS 96 13.990 -9.693 -6.682 727 HG2 LYS 96 1HG LYS 96 14.945 -11.706 -7.683 728 HG3 LYS 96 2HG LYS 96 16.378 -10.799 -8.188 729 HD2 LYS 96 1HD LYS 96 16.831 -10.263 -5.781 730 HD3 LYS 96 2HD LYS 96 15.464 -11.293 -5.331 731 HE2 LYS 96 1HE LYS 96 17.804 -12.287 -6.987 732 HE3 LYS 96 2HE LYS 96 17.764 -12.381 -5.225 733 HZ1 LYS 96 1HZ LYS 96 17.003 -14.404 -6.234 734 HZ2 LYS 96 2HZ LYS 96 15.767 -13.700 -5.399 735 HZ3 LYS 96 3HZ LYS 96 15.805 -13.613 -7.046 736 H ASN 97 H ASN 97 11.837 -9.799 -7.997 737 HA ASN 97 HA ASN 97 11.792 -12.492 -9.055 738 HB2 ASN 97 1HB ASN 97 9.639 -10.726 -7.851 739 HB3 ASN 97 2HB ASN 97 9.359 -12.387 -8.355 740 HD21 ASN 97 1HD2 ASN 97 11.578 -13.732 -5.814 741 HD22 ASN 97 2HD2 ASN 97 11.297 -13.877 -7.517 742 H LYS 98 H LYS 98 10.624 -9.369 -10.173 743 HA LYS 98 HA LYS 98 9.093 -10.363 -12.384 744 HB2 LYS 98 1HB LYS 98 8.907 -8.039 -11.594 745 HB3 LYS 98 2HB LYS 98 10.580 -7.729 -12.034 746 HG2 LYS 98 1HG LYS 98 9.137 -6.785 -13.709 747 HG3 LYS 98 2HG LYS 98 10.003 -8.154 -14.419 748 HD2 LYS 98 1HD LYS 98 8.057 -9.587 -14.183 749 HD3 LYS 98 2HD LYS 98 7.192 -8.336 -13.278 750 HE2 LYS 98 1HE LYS 98 7.216 -6.868 -15.257 751 HE3 LYS 98 2HE LYS 98 8.119 -8.084 -16.164 752 HZ1 LYS 98 1HZ LYS 98 5.785 -8.178 -16.646 753 HZ2 LYS 98 2HZ LYS 98 6.256 -9.575 -15.907 754 HZ3 LYS 98 3HZ LYS 98 5.412 -8.439 -15.061 755 H GLU 99 H GLU 99 12.522 -9.503 -12.012 756 HA GLU 99 HA GLU 99 13.227 -10.022 -14.748 757 HB2 GLU 99 1HB GLU 99 14.870 -10.052 -12.187 758 HB3 GLU 99 2HB GLU 99 15.566 -10.252 -13.789 759 HG2 GLU 99 1HG GLU 99 14.032 -7.827 -12.826 760 HG3 GLU 99 2HG GLU 99 15.785 -7.964 -12.943 761 H GLU 100 H GLU 100 12.956 -12.054 -11.869 762 HA GLU 100 HA GLU 100 14.016 -14.439 -13.053 763 HB2 GLU 100 1HB GLU 100 11.993 -14.001 -10.824 764 HB3 GLU 100 2HB GLU 100 12.597 -15.587 -11.280 765 HG2 GLU 100 1HG GLU 100 14.854 -14.967 -10.676 766 HG3 GLU 100 2HG GLU 100 14.360 -13.302 -10.376 767 H LEU 101 H LEU 101 10.760 -13.016 -12.971 768 HA LEU 101 HA LEU 101 9.462 -15.139 -14.385 769 HB2 LEU 101 1HB LEU 101 8.862 -12.178 -14.122 770 HB3 LEU 101 2HB LEU 101 7.811 -13.295 -14.999 771 HG LEU 101 HG LEU 101 8.513 -13.566 -12.056 772 HD11 LEU 101 1HD1 LEU 101 6.248 -12.709 -11.654 773 HD12 LEU 101 2HD1 LEU 101 7.269 -11.508 -12.478 774 HD13 LEU 101 3HD1 LEU 101 6.048 -12.419 -13.398 775 HD21 LEU 101 1HD2 LEU 101 6.620 -15.156 -12.077 776 HD22 LEU 101 2HD2 LEU 101 6.425 -14.901 -13.828 777 HD23 LEU 101 3HD2 LEU 101 7.901 -15.671 -13.200 778 H LYS 102 H LYS 102 11.208 -12.239 -15.446 779 HA LYS 102 HA LYS 102 10.688 -12.531 -18.238 780 HB2 LYS 102 1HB LYS 102 13.004 -11.284 -16.717 781 HB3 LYS 102 2HB LYS 102 12.877 -11.230 -18.469 782 HG2 LYS 102 1HG LYS 102 10.746 -10.011 -18.291 783 HG3 LYS 102 2HG LYS 102 10.851 -10.082 -16.527 784 HD2 LYS 102 1HD LYS 102 13.021 -8.843 -16.643 785 HD3 LYS 102 2HD LYS 102 12.815 -8.704 -18.395 786 HE2 LYS 102 1HE LYS 102 10.725 -7.451 -18.071 787 HE3 LYS 102 2HE LYS 102 10.867 -7.632 -16.321 788 HZ1 LYS 102 1HZ LYS 102 11.656 -5.504 -17.055 789 HZ2 LYS 102 2HZ LYS 102 12.905 -6.370 -16.414 790 HZ3 LYS 102 3HZ LYS 102 12.772 -6.200 -18.049 791 H SER 103 H SER 103 13.237 -13.857 -16.141 792 HA SER 103 HA SER 103 14.696 -15.184 -18.200 793 HB2 SER 103 1HB SER 103 14.334 -15.863 -15.264 794 HB3 SER 103 2HB SER 103 15.495 -16.648 -16.323 795 HG SER 103 HG SER 103 15.341 -13.939 -15.600 796 H LEU 104 H LEU 104 11.910 -16.185 -16.232 797 HA LEU 104 HA LEU 104 11.760 -18.841 -17.335 798 HB2 LEU 104 1HB LEU 104 9.681 -17.073 -16.003 799 HB3 LEU 104 2HB LEU 104 9.401 -18.759 -16.450 800 HG LEU 104 HG LEU 104 11.496 -17.806 -14.465 801 HD11 LEU 104 1HD1 LEU 104 9.991 -18.767 -12.781 802 HD12 LEU 104 2HD1 LEU 104 9.220 -17.428 -13.663 803 HD13 LEU 104 3HD1 LEU 104 8.792 -19.112 -14.049 804 HD21 LEU 104 1HD2 LEU 104 11.678 -20.215 -13.946 805 HD22 LEU 104 2HD2 LEU 104 10.502 -20.582 -15.231 806 HD23 LEU 104 3HD2 LEU 104 12.090 -19.894 -15.648 807 H GLY 105 H GLY 105 10.502 -15.694 -18.296 808 HA2 GLY 105 1HA GLY 105 9.957 -15.110 -20.531 809 HA3 GLY 105 2HA GLY 105 9.871 -16.809 -20.957 810 H THR 106 H THR 106 8.265 -15.275 -18.187 811 HA THR 106 HA THR 106 5.676 -16.268 -19.222 812 HB THR 106 HB THR 106 4.812 -15.807 -16.968 813 HG1 THR 106 HG1 THR 106 6.208 -13.928 -16.631 814 HG21 THR 106 1HG2 THR 106 6.236 -17.357 -15.687 815 HG22 THR 106 2HG2 THR 106 5.995 -17.943 -17.350 816 HG23 THR 106 3HG2 THR 106 7.531 -17.171 -16.892 817 H GLY 107 H GLY 107 7.454 -13.327 -18.830 818 HA2 GLY 107 1HA GLY 107 6.521 -11.488 -20.306 819 HA3 GLY 107 2HA GLY 107 4.985 -11.765 -19.507 Start of MODEL 2 1 H MET 1 1H MET 1 -8.950 -6.390 5.829 2 HA MET 1 HA MET 1 -7.220 -7.913 5.291 3 HB2 MET 1 1HB MET 1 -8.090 -6.078 3.025 4 HB3 MET 1 2HB MET 1 -7.401 -7.680 2.812 5 HG2 MET 1 1HG MET 1 -10.007 -7.067 4.235 6 HG3 MET 1 2HG MET 1 -9.847 -7.673 2.584 7 HE1 MET 1 1HE MET 1 -8.577 -11.291 3.029 8 HE2 MET 1 2HE MET 1 -9.293 -10.093 1.923 9 HE3 MET 1 3HE MET 1 -7.663 -9.829 2.589 10 H ALA 2 H ALA 2 -6.122 -6.454 2.614 11 HA ALA 2 HA ALA 2 -3.410 -6.413 3.567 12 HB1 ALA 2 1HB ALA 2 -2.866 -5.599 1.295 13 HB2 ALA 2 2HB ALA 2 -3.966 -6.998 1.249 14 HB3 ALA 2 3HB ALA 2 -4.600 -5.359 0.976 15 H GLY 3 H GLY 3 -5.849 -3.931 3.011 16 HA2 GLY 3 1HA GLY 3 -5.857 -1.797 4.061 17 HA3 GLY 3 2HA GLY 3 -4.160 -1.983 4.459 18 H LEU 4 H LEU 4 -4.754 -2.915 1.259 19 HA LEU 4 HA LEU 4 -3.245 -0.690 0.206 20 HB2 LEU 4 1HB LEU 4 -3.150 -2.978 -0.740 21 HB3 LEU 4 2HB LEU 4 -4.839 -2.840 -1.237 22 HG LEU 4 HG LEU 4 -4.177 -0.931 -2.735 23 HD11 LEU 4 1HD1 LEU 4 -1.789 -0.642 -3.228 24 HD12 LEU 4 2HD1 LEU 4 -2.163 -0.251 -1.533 25 HD13 LEU 4 3HD1 LEU 4 -1.383 -1.799 -1.939 26 HD21 LEU 4 1HD2 LEU 4 -3.125 -2.401 -4.421 27 HD22 LEU 4 2HD2 LEU 4 -2.737 -3.584 -3.149 28 HD23 LEU 4 3HD2 LEU 4 -4.435 -3.247 -3.562 29 H THR 5 H THR 5 -3.915 1.228 -0.426 30 HA THR 5 HA THR 5 -6.829 1.711 -0.607 31 HB THR 5 HB THR 5 -6.232 4.104 -0.582 32 HG1 THR 5 HG1 THR 5 -4.318 4.430 -1.475 33 HG21 THR 5 1HG2 THR 5 -5.210 4.197 1.658 34 HG22 THR 5 2HG2 THR 5 -6.438 2.912 1.572 35 HG23 THR 5 3HG2 THR 5 -4.710 2.497 1.505 36 H VAL 6 H VAL 6 -4.197 1.079 -2.650 37 HA VAL 6 HA VAL 6 -4.940 2.691 -4.908 38 HB VAL 6 HB VAL 6 -3.399 0.065 -4.752 39 HG11 VAL 6 1HG1 VAL 6 -2.543 0.637 -6.972 40 HG12 VAL 6 2HG1 VAL 6 -4.305 0.389 -6.981 41 HG13 VAL 6 3HG1 VAL 6 -3.638 2.039 -7.032 42 HG21 VAL 6 1HG2 VAL 6 -1.423 1.542 -4.951 43 HG22 VAL 6 2HG2 VAL 6 -2.489 2.967 -4.944 44 HG23 VAL 6 3HG2 VAL 6 -2.375 1.933 -3.500 45 H ARG 7 H ARG 7 -6.294 2.350 -6.578 46 HA ARG 7 HA ARG 7 -7.807 -0.224 -6.603 47 HB2 ARG 7 1HB ARG 7 -8.941 2.577 -6.903 48 HB3 ARG 7 2HB ARG 7 -9.836 1.103 -7.239 49 HG2 ARG 7 1HG ARG 7 -8.635 1.755 -4.539 50 HG3 ARG 7 2HG ARG 7 -10.309 2.126 -5.018 51 HD2 ARG 7 1HD ARG 7 -10.708 -0.238 -5.426 52 HD3 ARG 7 2HD ARG 7 -9.040 -0.601 -4.925 53 HE ARG 7 HE ARG 7 -11.291 0.169 -3.213 54 HH11 ARG 7 1HH1 ARG 7 -7.840 -0.420 -3.505 55 HH12 ARG 7 2HH1 ARG 7 -7.606 -0.642 -1.786 56 HH21 ARG 7 1HH2 ARG 7 -10.974 -0.121 -0.984 57 HH22 ARG 7 2HH2 ARG 7 -9.379 -0.473 -0.358 58 H ASP 8 H ASP 8 -6.039 -0.578 -8.249 59 HA ASP 8 HA ASP 8 -7.116 0.047 -10.906 60 HB2 ASP 8 1HB ASP 8 -5.650 2.012 -10.366 61 HB3 ASP 8 2HB ASP 8 -4.291 0.913 -10.170 62 HA PRO 9 HA PRO 9 -5.827 -4.200 -10.788 63 HB2 PRO 9 1HB PRO 9 -6.795 -3.886 -13.662 64 HB3 PRO 9 2HB PRO 9 -7.098 -5.211 -12.530 65 HG2 PRO 9 1HG PRO 9 -9.019 -3.408 -12.898 66 HG3 PRO 9 2HG PRO 9 -8.666 -3.952 -11.255 67 HD2 PRO 9 1HD PRO 9 -7.835 -1.383 -12.647 68 HD3 PRO 9 2HD PRO 9 -8.372 -1.635 -10.938 69 H ALA 10 H ALA 10 -4.956 -1.692 -13.094 70 HA ALA 10 HA ALA 10 -3.134 -3.083 -14.725 71 HB1 ALA 10 1HB ALA 10 -2.119 -0.871 -15.168 72 HB2 ALA 10 2HB ALA 10 -3.897 -0.800 -15.206 73 HB3 ALA 10 3HB ALA 10 -3.012 -0.193 -13.787 74 H VAL 11 H VAL 11 -2.813 -1.989 -11.433 75 HA VAL 11 HA VAL 11 -0.011 -3.032 -11.454 76 HB VAL 11 HB VAL 11 0.483 -1.455 -9.605 77 HG11 VAL 11 1HG1 VAL 11 0.524 0.601 -10.930 78 HG12 VAL 11 2HG1 VAL 11 1.019 -0.817 -11.885 79 HG13 VAL 11 3HG1 VAL 11 -0.609 -0.127 -12.093 80 HG21 VAL 11 1HG2 VAL 11 -1.129 0.352 -9.096 81 HG22 VAL 11 2HG2 VAL 11 -2.309 -0.392 -10.201 82 HG23 VAL 11 3HG2 VAL 11 -1.814 -1.246 -8.720 83 H ASP 12 H ASP 12 -3.166 -2.997 -9.980 84 HA ASP 12 HA ASP 12 -2.411 -4.129 -7.448 85 HB2 ASP 12 1HB ASP 12 -5.048 -3.998 -8.949 86 HB3 ASP 12 2HB ASP 12 -4.901 -4.752 -7.367 87 H ARG 13 H ARG 13 -3.198 -5.485 -10.593 88 HA ARG 13 HA ARG 13 -3.614 -8.183 -9.704 89 HB2 ARG 13 1HB ARG 13 -2.821 -6.990 -12.373 90 HB3 ARG 13 2HB ARG 13 -3.024 -8.719 -12.139 91 HG2 ARG 13 1HG ARG 13 -5.378 -8.272 -11.387 92 HG3 ARG 13 2HG ARG 13 -5.134 -6.572 -11.856 93 HD2 ARG 13 1HD ARG 13 -6.228 -7.780 -13.617 94 HD3 ARG 13 2HD ARG 13 -4.590 -7.306 -14.125 95 HE ARG 13 HE ARG 13 -4.661 -9.950 -12.989 96 HH11 ARG 13 1HH1 ARG 13 -5.287 -8.096 -15.907 97 HH12 ARG 13 2HH1 ARG 13 -5.036 -9.458 -16.976 98 HH21 ARG 13 1HH2 ARG 13 -4.338 -11.710 -14.388 99 HH22 ARG 13 2HH2 ARG 13 -4.499 -11.504 -16.117 100 H SER 14 H SER 14 -0.758 -6.290 -10.500 101 HA SER 14 HA SER 14 1.020 -8.609 -10.457 102 HB2 SER 14 1HB SER 14 2.794 -7.017 -10.739 103 HB3 SER 14 2HB SER 14 1.468 -6.535 -11.786 104 HG SER 14 HG SER 14 0.817 -5.210 -9.917 105 H LEU 15 H LEU 15 -0.201 -6.247 -8.178 106 HA LEU 15 HA LEU 15 1.729 -6.789 -6.102 107 HB2 LEU 15 1HB LEU 15 -1.076 -5.632 -6.049 108 HB3 LEU 15 2HB LEU 15 -0.050 -5.761 -4.617 109 HG LEU 15 HG LEU 15 0.639 -4.154 -7.103 110 HD11 LEU 15 1HD1 LEU 15 0.118 -2.204 -5.706 111 HD12 LEU 15 2HD1 LEU 15 -1.306 -3.244 -5.941 112 HD13 LEU 15 3HD1 LEU 15 -0.419 -3.284 -4.398 113 HD21 LEU 15 1HD2 LEU 15 2.409 -3.228 -5.647 114 HD22 LEU 15 2HD2 LEU 15 1.905 -4.323 -4.337 115 HD23 LEU 15 3HD2 LEU 15 2.593 -4.989 -5.837 116 H ARG 16 H ARG 16 -1.375 -8.188 -7.045 117 HA ARG 16 HA ARG 16 -1.399 -9.934 -4.670 118 HB2 ARG 16 1HB ARG 16 -3.543 -10.685 -5.451 119 HB3 ARG 16 2HB ARG 16 -3.500 -8.934 -5.593 120 HG2 ARG 16 1HG ARG 16 -2.948 -9.229 -8.035 121 HG3 ARG 16 2HG ARG 16 -3.262 -10.968 -7.816 122 HD2 ARG 16 1HD ARG 16 -5.506 -10.337 -6.914 123 HD3 ARG 16 2HD ARG 16 -5.166 -8.676 -7.450 124 HE ARG 16 HE ARG 16 -4.685 -10.243 -9.667 125 HH11 ARG 16 1HH1 ARG 16 -7.409 -9.716 -7.511 126 HH12 ARG 16 2HH1 ARG 16 -8.608 -10.036 -8.745 127 HH21 ARG 16 1HH2 ARG 16 -6.251 -10.656 -11.259 128 HH22 ARG 16 2HH2 ARG 16 -7.953 -10.568 -10.866 129 H SER 17 H SER 17 0.290 -9.943 -7.468 130 HA SER 17 HA SER 17 0.133 -12.884 -7.842 131 HB2 SER 17 1HB SER 17 1.602 -10.703 -9.356 132 HB3 SER 17 2HB SER 17 1.750 -12.416 -9.718 133 HG SER 17 HG SER 17 -0.423 -10.704 -9.983 134 H VAL 18 H VAL 18 1.849 -14.262 -7.525 135 HA VAL 18 HA VAL 18 4.197 -13.096 -6.092 136 HB VAL 18 HB VAL 18 4.218 -15.068 -4.614 137 HG11 VAL 18 1HG1 VAL 18 2.243 -14.540 -3.271 138 HG12 VAL 18 2HG1 VAL 18 3.054 -13.073 -3.868 139 HG13 VAL 18 3HG1 VAL 18 1.553 -13.638 -4.641 140 HG21 VAL 18 1HG2 VAL 18 2.296 -16.627 -4.613 141 HG22 VAL 18 2HG2 VAL 18 1.617 -15.787 -6.027 142 HG23 VAL 18 3HG2 VAL 18 3.157 -16.668 -6.170 143 H PHE 19 H PHE 19 6.142 -14.390 -6.175 144 HA PHE 19 HA PHE 19 6.229 -16.161 -8.577 145 HB2 PHE 19 1HB PHE 19 7.735 -14.234 -8.720 146 HB3 PHE 19 2HB PHE 19 8.442 -14.625 -7.161 147 HD1 PHE 19 HD1 PHE 19 7.905 -16.085 -10.556 148 HD2 PHE 19 HD2 PHE 19 10.357 -15.920 -7.062 149 HE1 PHE 19 HE1 PHE 19 9.598 -17.493 -11.680 150 HE2 PHE 19 HE2 PHE 19 12.054 -17.325 -8.183 151 HZ PHE 19 HZ PHE 19 11.673 -18.113 -10.493 152 H VAL 20 H VAL 20 6.740 -18.247 -8.403 153 HA VAL 20 HA VAL 20 7.333 -19.221 -5.638 154 HB VAL 20 HB VAL 20 5.706 -20.626 -7.798 155 HG11 VAL 20 1HG1 VAL 20 5.092 -22.167 -5.999 156 HG12 VAL 20 2HG1 VAL 20 6.845 -22.162 -6.303 157 HG13 VAL 20 3HG1 VAL 20 6.183 -21.305 -4.890 158 HG21 VAL 20 1HG2 VAL 20 3.759 -20.106 -6.362 159 HG22 VAL 20 2HG2 VAL 20 4.815 -19.178 -5.270 160 HG23 VAL 20 3HG2 VAL 20 4.549 -18.619 -6.939 161 H GLY 21 H GLY 21 8.930 -20.663 -5.348 162 HA2 GLY 21 1HA GLY 21 10.244 -21.793 -7.791 163 HA3 GLY 21 2HA GLY 21 11.193 -21.019 -6.536 164 H ASN 22 H ASN 22 12.039 -23.417 -6.926 165 HA ASN 22 HA ASN 22 12.395 -25.499 -6.013 166 HB2 ASN 22 1HB ASN 22 10.836 -24.324 -3.687 167 HB3 ASN 22 2HB ASN 22 11.732 -25.836 -3.636 168 HD21 ASN 22 1HD2 ASN 22 13.692 -22.805 -2.417 169 HD22 ASN 22 2HD2 ASN 22 12.042 -23.268 -2.171 170 H ILE 23 H ILE 23 10.263 -25.234 -7.806 171 HA ILE 23 HA ILE 23 8.063 -26.843 -6.657 172 HB ILE 23 HB ILE 23 8.405 -25.582 -9.412 173 HG12 ILE 23 1HG1 ILE 23 6.594 -24.774 -7.127 174 HG13 ILE 23 2HG1 ILE 23 8.139 -24.015 -7.479 175 HG21 ILE 23 1HG2 ILE 23 6.029 -26.144 -9.725 176 HG22 ILE 23 2HG2 ILE 23 7.007 -27.611 -9.494 177 HG23 ILE 23 3HG2 ILE 23 6.016 -26.984 -8.156 178 HD11 ILE 23 1HD1 ILE 23 6.297 -22.720 -8.396 179 HD12 ILE 23 2HD1 ILE 23 7.325 -23.358 -9.702 180 HD13 ILE 23 3HD1 ILE 23 5.759 -24.125 -9.345 181 HA PRO 24 HA PRO 24 10.035 -30.573 -8.013 182 HB2 PRO 24 1HB PRO 24 7.218 -31.560 -7.458 183 HB3 PRO 24 2HB PRO 24 8.762 -32.250 -6.940 184 HG2 PRO 24 1HG PRO 24 7.330 -30.878 -5.163 185 HG3 PRO 24 2HG PRO 24 9.077 -30.625 -5.230 186 HD2 PRO 24 1HD PRO 24 6.847 -28.922 -6.419 187 HD3 PRO 24 2HD PRO 24 8.324 -28.395 -5.517 188 H TYR 25 H TYR 25 10.024 -31.689 -9.946 189 HA TYR 25 HA TYR 25 8.593 -30.460 -12.123 190 HB2 TYR 25 1HB TYR 25 10.331 -32.951 -11.960 191 HB3 TYR 25 2HB TYR 25 9.640 -32.358 -13.464 192 HD1 TYR 25 HD1 TYR 25 10.364 -29.625 -11.328 193 HD2 TYR 25 HD2 TYR 25 12.190 -32.436 -14.006 194 HE1 TYR 25 HE1 TYR 25 12.290 -28.103 -11.613 195 HE2 TYR 25 HE2 TYR 25 14.116 -30.914 -14.291 196 HH TYR 25 HH TYR 25 14.199 -27.736 -12.707 197 H GLU 26 H GLU 26 8.048 -33.295 -10.144 198 HA GLU 26 HA GLU 26 5.994 -34.385 -11.904 199 HB2 GLU 26 1HB GLU 26 5.605 -35.995 -10.129 200 HB3 GLU 26 2HB GLU 26 7.339 -35.808 -10.354 201 HG2 GLU 26 1HG GLU 26 5.951 -34.169 -8.263 202 HG3 GLU 26 2HG GLU 26 6.275 -35.875 -7.960 203 H ALA 27 H ALA 27 6.138 -31.791 -9.744 204 HA ALA 27 HA ALA 27 3.340 -31.962 -8.894 205 HB1 ALA 27 1HB ALA 27 3.781 -29.766 -7.844 206 HB2 ALA 27 2HB ALA 27 5.011 -30.971 -7.394 207 HB3 ALA 27 3HB ALA 27 5.385 -29.730 -8.612 208 H THR 28 H THR 28 1.665 -30.604 -9.493 209 HA THR 28 HA THR 28 2.107 -29.196 -12.094 210 HB THR 28 HB THR 28 -0.117 -29.870 -12.813 211 HG1 THR 28 HG1 THR 28 -1.262 -31.393 -11.369 212 HG21 THR 28 1HG2 THR 28 0.172 -32.314 -12.945 213 HG22 THR 28 2HG2 THR 28 1.717 -31.475 -13.221 214 HG23 THR 28 3HG2 THR 28 1.390 -32.244 -11.650 215 H GLU 29 H GLU 29 0.206 -27.667 -12.575 216 HA GLU 29 HA GLU 29 0.105 -25.675 -10.523 217 HB2 GLU 29 1HB GLU 29 -1.532 -26.066 -13.057 218 HB3 GLU 29 2HB GLU 29 -1.692 -24.659 -12.015 219 HG2 GLU 29 1HG GLU 29 0.639 -24.060 -12.411 220 HG3 GLU 29 2HG GLU 29 0.868 -25.511 -13.385 221 H GLU 30 H GLU 30 -2.026 -28.334 -11.399 222 HA GLU 30 HA GLU 30 -4.245 -27.502 -9.762 223 HB2 GLU 30 1HB GLU 30 -3.397 -30.223 -10.824 224 HB3 GLU 30 2HB GLU 30 -4.886 -29.958 -9.929 225 HG2 GLU 30 1HG GLU 30 -5.671 -28.405 -11.650 226 HG3 GLU 30 2HG GLU 30 -4.161 -28.604 -12.537 227 H GLN 31 H GLN 31 -1.409 -29.571 -9.197 228 HA GLN 31 HA GLN 31 -2.097 -30.273 -6.503 229 HB2 GLN 31 1HB GLN 31 0.578 -30.100 -7.938 230 HB3 GLN 31 2HB GLN 31 0.404 -30.695 -6.293 231 HG2 GLN 31 1HG GLN 31 -1.077 -32.486 -7.089 232 HG3 GLN 31 2HG GLN 31 -0.879 -31.886 -8.760 233 HE21 GLN 31 1HE2 GLN 31 1.661 -34.261 -9.097 234 HE22 GLN 31 2HE2 GLN 31 0.071 -33.748 -9.555 235 H LEU 32 H LEU 32 -0.216 -27.594 -7.899 236 HA LEU 32 HA LEU 32 0.437 -26.363 -5.398 237 HB2 LEU 32 1HB LEU 32 0.106 -25.231 -8.195 238 HB3 LEU 32 2HB LEU 32 0.684 -24.282 -6.822 239 HG LEU 32 HG LEU 32 2.066 -26.767 -7.895 240 HD11 LEU 32 1HD1 LEU 32 3.685 -25.188 -8.849 241 HD12 LEU 32 2HD1 LEU 32 2.062 -24.966 -9.544 242 HD13 LEU 32 3HD1 LEU 32 2.669 -23.826 -8.319 243 HD21 LEU 32 1HD2 LEU 32 3.924 -25.968 -6.476 244 HD22 LEU 32 2HD2 LEU 32 2.913 -24.616 -5.911 245 HD23 LEU 32 3HD2 LEU 32 2.469 -26.291 -5.503 246 H LYS 33 H LYS 33 -2.369 -26.147 -7.546 247 HA LYS 33 HA LYS 33 -3.676 -23.960 -6.315 248 HB2 LYS 33 1HB LYS 33 -4.404 -25.011 -8.446 249 HB3 LYS 33 2HB LYS 33 -4.915 -26.445 -7.566 250 HG2 LYS 33 1HG LYS 33 -6.610 -25.137 -6.369 251 HG3 LYS 33 2HG LYS 33 -6.074 -23.667 -7.195 252 HD2 LYS 33 1HD LYS 33 -6.675 -24.654 -9.372 253 HD3 LYS 33 2HD LYS 33 -7.178 -26.147 -8.566 254 HE2 LYS 33 1HE LYS 33 -8.908 -24.891 -7.320 255 HE3 LYS 33 2HE LYS 33 -8.408 -23.401 -8.124 256 HZ1 LYS 33 1HZ LYS 33 -10.305 -24.383 -9.185 257 HZ2 LYS 33 2HZ LYS 33 -9.020 -24.396 -10.220 258 HZ3 LYS 33 3HZ LYS 33 -9.488 -25.787 -9.469 259 H ASP 34 H ASP 34 -3.894 -27.449 -5.575 260 HA ASP 34 HA ASP 34 -5.720 -27.247 -3.429 261 HB2 ASP 34 1HB ASP 34 -3.456 -29.199 -3.974 262 HB3 ASP 34 2HB ASP 34 -4.544 -29.376 -2.605 263 H ILE 35 H ILE 35 -2.158 -27.042 -3.433 264 HA ILE 35 HA ILE 35 -1.898 -26.701 -0.604 265 HB ILE 35 HB ILE 35 -0.090 -25.923 -2.924 266 HG12 ILE 35 1HG1 ILE 35 0.215 -28.114 -0.863 267 HG13 ILE 35 2HG1 ILE 35 -0.545 -28.354 -2.429 268 HG21 ILE 35 1HG2 ILE 35 1.667 -25.566 -1.238 269 HG22 ILE 35 2HG2 ILE 35 0.328 -24.416 -1.019 270 HG23 ILE 35 3HG2 ILE 35 0.478 -25.822 0.061 271 HD11 ILE 35 1HD1 ILE 35 1.781 -29.063 -2.465 272 HD12 ILE 35 2HD1 ILE 35 1.532 -27.678 -3.555 273 HD13 ILE 35 3HD1 ILE 35 2.302 -27.436 -1.969 274 H PHE 36 H PHE 36 -2.118 -24.354 -3.288 275 HA PHE 36 HA PHE 36 -1.529 -22.115 -1.551 276 HB2 PHE 36 1HB PHE 36 -2.506 -22.348 -4.414 277 HB3 PHE 36 2HB PHE 36 -2.317 -20.791 -3.623 278 HD1 PHE 36 HD1 PHE 36 -0.098 -23.701 -3.065 279 HD2 PHE 36 HD2 PHE 36 -0.599 -19.924 -4.999 280 HE1 PHE 36 HE1 PHE 36 2.302 -23.689 -3.659 281 HE2 PHE 36 HE2 PHE 36 1.800 -19.910 -5.598 282 HZ PHE 36 HZ PHE 36 3.251 -21.793 -4.926 283 H SER 37 H SER 37 -4.400 -23.831 -2.435 284 HA SER 37 HA SER 37 -6.341 -21.790 -2.079 285 HB2 SER 37 1HB SER 37 -7.927 -23.561 -1.829 286 HB3 SER 37 2HB SER 37 -6.732 -24.097 -3.000 287 HG SER 37 HG SER 37 -5.777 -25.326 -1.477 288 H GLU 38 H GLU 38 -4.365 -23.506 0.206 289 HA GLU 38 HA GLU 38 -6.090 -23.233 2.488 290 HB2 GLU 38 1HB GLU 38 -3.086 -23.642 2.240 291 HB3 GLU 38 2HB GLU 38 -3.935 -23.635 3.779 292 HG2 GLU 38 1HG GLU 38 -5.330 -25.535 2.973 293 HG3 GLU 38 2HG GLU 38 -4.369 -25.571 1.495 294 H VAL 39 H VAL 39 -3.966 -21.053 0.831 295 HA VAL 39 HA VAL 39 -4.121 -19.161 3.140 296 HB VAL 39 HB VAL 39 -2.086 -18.094 2.182 297 HG11 VAL 39 1HG1 VAL 39 -0.500 -19.853 2.798 298 HG12 VAL 39 2HG1 VAL 39 -1.860 -19.752 3.941 299 HG13 VAL 39 3HG1 VAL 39 -1.810 -21.056 2.731 300 HG21 VAL 39 1HG2 VAL 39 -0.839 -19.284 0.407 301 HG22 VAL 39 2HG2 VAL 39 -2.164 -20.463 0.268 302 HG23 VAL 39 3HG2 VAL 39 -2.438 -18.760 -0.171 303 H GLY 40 H GLY 40 -5.948 -19.725 0.710 304 HA2 GLY 40 1HA GLY 40 -7.547 -17.755 0.512 305 HA3 GLY 40 2HA GLY 40 -6.168 -16.835 -0.058 306 HA PRO 41 HA PRO 41 -8.507 -19.337 -3.425 307 HB2 PRO 41 1HB PRO 41 -9.572 -16.577 -4.091 308 HB3 PRO 41 2HB PRO 41 -10.388 -18.142 -4.199 309 HG2 PRO 41 1HG PRO 41 -10.987 -16.540 -2.157 310 HG3 PRO 41 2HG PRO 41 -10.772 -18.266 -1.855 311 HD2 PRO 41 1HD PRO 41 -8.801 -15.983 -1.406 312 HD3 PRO 41 2HD PRO 41 -9.204 -17.369 -0.315 313 H VAL 42 H VAL 42 -7.639 -19.448 -5.483 314 HA VAL 42 HA VAL 42 -5.693 -17.296 -6.205 315 HB VAL 42 HB VAL 42 -5.621 -20.270 -6.874 316 HG11 VAL 42 1HG1 VAL 42 -3.436 -19.798 -7.869 317 HG12 VAL 42 2HG1 VAL 42 -4.750 -18.936 -8.705 318 HG13 VAL 42 3HG1 VAL 42 -3.682 -18.059 -7.582 319 HG21 VAL 42 1HG2 VAL 42 -3.605 -20.269 -5.439 320 HG22 VAL 42 2HG2 VAL 42 -3.865 -18.546 -5.078 321 HG23 VAL 42 3HG2 VAL 42 -5.045 -19.759 -4.526 322 H VAL 43 H VAL 43 -5.773 -16.392 -8.184 323 HA VAL 43 HA VAL 43 -8.190 -16.781 -9.742 324 HB VAL 43 HB VAL 43 -5.686 -15.114 -10.227 325 HG11 VAL 43 1HG1 VAL 43 -6.966 -13.968 -11.969 326 HG12 VAL 43 2HG1 VAL 43 -6.704 -15.686 -12.355 327 HG13 VAL 43 3HG1 VAL 43 -8.291 -15.138 -11.763 328 HG21 VAL 43 1HG2 VAL 43 -7.180 -13.242 -9.606 329 HG22 VAL 43 2HG2 VAL 43 -8.506 -14.395 -9.326 330 HG23 VAL 43 3HG2 VAL 43 -7.059 -14.432 -8.289 331 H SER 44 H SER 44 -4.699 -17.263 -10.404 332 HA SER 44 HA SER 44 -5.197 -19.599 -12.025 333 HB2 SER 44 1HB SER 44 -5.980 -17.825 -13.582 334 HB3 SER 44 2HB SER 44 -4.403 -17.056 -13.482 335 HG SER 44 HG SER 44 -5.013 -19.634 -14.425 336 H PHE 45 H PHE 45 -3.288 -20.607 -12.768 337 HA PHE 45 HA PHE 45 -0.856 -19.593 -11.374 338 HB2 PHE 45 1HB PHE 45 -1.728 -22.359 -12.260 339 HB3 PHE 45 2HB PHE 45 -0.057 -22.011 -11.845 340 HD1 PHE 45 HD1 PHE 45 -3.506 -22.174 -10.547 341 HD2 PHE 45 HD2 PHE 45 0.630 -21.719 -9.578 342 HE1 PHE 45 HE1 PHE 45 -4.028 -22.534 -8.157 343 HE2 PHE 45 HE2 PHE 45 0.112 -22.081 -7.187 344 HZ PHE 45 HZ PHE 45 -2.218 -22.487 -6.477 345 H ARG 46 H ARG 46 1.163 -19.589 -12.402 346 HA ARG 46 HA ARG 46 1.119 -20.061 -15.346 347 HB2 ARG 46 1HB ARG 46 2.391 -17.709 -13.907 348 HB3 ARG 46 2HB ARG 46 2.696 -18.122 -15.587 349 HG2 ARG 46 1HG ARG 46 -0.049 -17.468 -14.494 350 HG3 ARG 46 2HG ARG 46 1.049 -16.285 -15.246 351 HD2 ARG 46 1HD ARG 46 1.068 -17.639 -17.283 352 HD3 ARG 46 2HD ARG 46 -0.088 -18.760 -16.526 353 HE ARG 46 HE ARG 46 -0.619 -16.078 -17.557 354 HH11 ARG 46 1HH1 ARG 46 -1.763 -18.778 -15.622 355 HH12 ARG 46 2HH1 ARG 46 -3.446 -18.312 -15.740 356 HH21 ARG 46 1HH2 ARG 46 -2.806 -15.483 -17.703 357 HH22 ARG 46 2HH2 ARG 46 -4.037 -16.447 -16.918 358 H LEU 47 H LEU 47 1.924 -22.150 -14.290 359 HA LEU 47 HA LEU 47 4.597 -22.161 -13.195 360 HB2 LEU 47 1HB LEU 47 2.975 -23.945 -12.721 361 HB3 LEU 47 2HB LEU 47 2.935 -24.387 -14.430 362 HG LEU 47 HG LEU 47 5.354 -25.021 -14.273 363 HD11 LEU 47 1HD1 LEU 47 6.342 -25.270 -12.040 364 HD12 LEU 47 2HD1 LEU 47 5.959 -23.571 -12.403 365 HD13 LEU 47 3HD1 LEU 47 4.905 -24.509 -11.319 366 HD21 LEU 47 1HD2 LEU 47 4.922 -27.099 -13.007 367 HD22 LEU 47 2HD2 LEU 47 3.463 -26.365 -12.299 368 HD23 LEU 47 3HD2 LEU 47 3.539 -26.684 -14.048 369 H VAL 48 H VAL 48 6.473 -22.008 -14.187 370 HA VAL 48 HA VAL 48 6.521 -21.978 -17.130 371 HB VAL 48 HB VAL 48 8.700 -21.425 -15.071 372 HG11 VAL 48 1HG1 VAL 48 9.955 -20.459 -16.936 373 HG12 VAL 48 2HG1 VAL 48 9.652 -22.198 -17.166 374 HG13 VAL 48 3HG1 VAL 48 8.691 -21.000 -18.066 375 HG21 VAL 48 1HG2 VAL 48 8.318 -19.063 -15.701 376 HG22 VAL 48 2HG2 VAL 48 7.002 -19.567 -16.787 377 HG23 VAL 48 3HG2 VAL 48 6.843 -19.796 -15.029 378 H TYR 49 H TYR 49 7.378 -23.484 -18.423 379 HA TYR 49 HA TYR 49 8.933 -25.700 -17.212 380 HB2 TYR 49 1HB TYR 49 7.501 -27.414 -18.163 381 HB3 TYR 49 2HB TYR 49 6.534 -26.378 -17.123 382 HD1 TYR 49 HD1 TYR 49 7.165 -27.475 -20.551 383 HD2 TYR 49 HD2 TYR 49 4.899 -24.813 -18.063 384 HE1 TYR 49 HE1 TYR 49 5.584 -27.083 -22.410 385 HE2 TYR 49 HE2 TYR 49 3.318 -24.421 -19.922 386 HH TYR 49 HH TYR 49 2.735 -24.983 -21.991 387 H ALA 50 H ALA 50 9.905 -27.134 -18.811 388 HA ALA 50 HA ALA 50 10.691 -25.562 -21.196 389 HB1 ALA 50 1HB ALA 50 12.543 -27.191 -21.381 390 HB2 ALA 50 2HB ALA 50 12.500 -26.421 -19.777 391 HB3 ALA 50 3HB ALA 50 11.890 -28.079 -19.985 392 H ARG 51 H ARG 51 10.281 -26.123 -23.237 393 HA ARG 51 HA ARG 51 8.268 -28.165 -23.709 394 HB2 ARG 51 1HB ARG 51 9.858 -26.377 -25.574 395 HB3 ARG 51 2HB ARG 51 8.641 -27.516 -26.131 396 HG2 ARG 51 1HG ARG 51 6.916 -26.334 -24.863 397 HG3 ARG 51 2HG ARG 51 8.140 -25.200 -24.243 398 HD2 ARG 51 1HD ARG 51 8.624 -24.486 -26.513 399 HD3 ARG 51 2HD ARG 51 7.398 -25.617 -27.130 400 HE ARG 51 HE ARG 51 6.127 -24.016 -25.230 401 HH11 ARG 51 1HH1 ARG 51 7.757 -23.596 -28.313 402 HH12 ARG 51 2HH1 ARG 51 6.806 -22.201 -28.769 403 HH21 ARG 51 1HH2 ARG 51 4.898 -22.203 -25.832 404 HH22 ARG 51 2HH2 ARG 51 5.187 -21.411 -27.365 405 H GLU 52 H GLU 52 11.738 -27.987 -23.843 406 HA GLU 52 HA GLU 52 12.144 -30.139 -25.714 407 HB2 GLU 52 1HB GLU 52 13.938 -28.926 -23.578 408 HB3 GLU 52 2HB GLU 52 14.472 -30.173 -24.696 409 HG2 GLU 52 1HG GLU 52 14.035 -28.694 -26.593 410 HG3 GLU 52 2HG GLU 52 13.427 -27.450 -25.503 411 H THR 53 H THR 53 11.757 -29.960 -22.207 412 HA THR 53 HA THR 53 12.146 -32.911 -22.056 413 HB THR 53 HB THR 53 12.401 -32.595 -19.627 414 HG1 THR 53 HG1 THR 53 12.479 -30.348 -18.889 415 HG21 THR 53 1HG2 THR 53 14.490 -31.289 -19.639 416 HG22 THR 53 2HG2 THR 53 14.400 -32.357 -21.060 417 HG23 THR 53 3HG2 THR 53 14.067 -30.618 -21.231 418 H GLY 54 H GLY 54 9.818 -30.341 -21.676 419 HA2 GLY 54 1HA GLY 54 7.482 -30.534 -21.520 420 HA3 GLY 54 2HA GLY 54 7.638 -32.276 -21.391 421 H LYS 55 H LYS 55 9.736 -30.602 -19.281 422 HA LYS 55 HA LYS 55 7.851 -31.110 -17.016 423 HB2 LYS 55 1HB LYS 55 10.879 -31.413 -17.113 424 HB3 LYS 55 2HB LYS 55 9.913 -31.545 -15.649 425 HG2 LYS 55 1HG LYS 55 8.705 -33.474 -16.632 426 HG3 LYS 55 2HG LYS 55 9.720 -33.352 -18.076 427 HD2 LYS 55 1HD LYS 55 11.739 -33.712 -16.682 428 HD3 LYS 55 2HD LYS 55 10.715 -33.853 -15.246 429 HE2 LYS 55 1HE LYS 55 9.581 -35.810 -16.238 430 HE3 LYS 55 2HE LYS 55 10.583 -35.666 -17.685 431 HZ1 LYS 55 1HZ LYS 55 11.438 -37.305 -16.178 432 HZ2 LYS 55 2HZ LYS 55 12.513 -36.062 -16.315 433 HZ3 LYS 55 3HZ LYS 55 11.576 -36.197 -14.964 434 HA PRO 56 HA PRO 56 8.119 -26.972 -15.698 435 HB2 PRO 56 1HB PRO 56 8.704 -28.158 -12.961 436 HB3 PRO 56 2HB PRO 56 7.508 -26.935 -13.411 437 HG2 PRO 56 1HG PRO 56 6.670 -29.427 -12.989 438 HG3 PRO 56 2HG PRO 56 6.025 -28.532 -14.368 439 HD2 PRO 56 1HD PRO 56 8.216 -30.645 -14.309 440 HD3 PRO 56 2HD PRO 56 6.860 -30.442 -15.489 441 H LYS 57 H LYS 57 9.686 -25.413 -15.199 442 HA LYS 57 HA LYS 57 12.472 -26.349 -15.139 443 HB2 LYS 57 1HB LYS 57 11.246 -23.565 -15.231 444 HB3 LYS 57 2HB LYS 57 12.977 -23.874 -15.220 445 HG2 LYS 57 1HG LYS 57 12.691 -25.204 -17.333 446 HG3 LYS 57 2HG LYS 57 10.998 -24.692 -17.362 447 HD2 LYS 57 1HD LYS 57 11.732 -22.317 -17.379 448 HD3 LYS 57 2HD LYS 57 13.419 -22.852 -17.399 449 HE2 LYS 57 1HE LYS 57 13.025 -24.020 -19.543 450 HE3 LYS 57 2HE LYS 57 11.340 -23.492 -19.525 451 HZ1 LYS 57 1HZ LYS 57 12.693 -22.076 -20.886 452 HZ2 LYS 57 2HZ LYS 57 12.111 -21.221 -19.601 453 HZ3 LYS 57 3HZ LYS 57 13.685 -21.714 -19.619 454 H GLY 58 H GLY 58 10.087 -25.707 -12.862 455 HA2 GLY 58 1HA GLY 58 10.577 -26.367 -10.578 456 HA3 GLY 58 2HA GLY 58 12.200 -25.726 -10.755 457 H TYR 59 H TYR 59 9.955 -23.674 -12.231 458 HA TYR 59 HA TYR 59 9.255 -22.165 -9.813 459 HB2 TYR 59 1HB TYR 59 10.394 -20.109 -10.477 460 HB3 TYR 59 2HB TYR 59 11.569 -21.398 -10.261 461 HD1 TYR 59 HD1 TYR 59 9.828 -19.280 -12.720 462 HD2 TYR 59 HD2 TYR 59 12.838 -22.275 -12.108 463 HE1 TYR 59 HE1 TYR 59 10.705 -18.863 -14.993 464 HE2 TYR 59 HE2 TYR 59 13.716 -21.858 -14.381 465 HH TYR 59 HH TYR 59 12.331 -19.328 -16.451 466 H GLY 60 H GLY 60 7.963 -20.222 -10.311 467 HA2 GLY 60 1HA GLY 60 7.015 -19.627 -12.930 468 HA3 GLY 60 2HA GLY 60 5.898 -20.769 -12.205 469 H PHE 61 H PHE 61 4.517 -18.748 -12.589 470 HA PHE 61 HA PHE 61 4.655 -17.026 -10.148 471 HB2 PHE 61 1HB PHE 61 3.664 -16.381 -12.948 472 HB3 PHE 61 2HB PHE 61 3.310 -15.374 -11.554 473 HD1 PHE 61 HD1 PHE 61 5.981 -16.618 -13.765 474 HD2 PHE 61 HD2 PHE 61 4.973 -13.952 -10.582 475 HE1 PHE 61 HE1 PHE 61 8.133 -15.441 -14.072 476 HE2 PHE 61 HE2 PHE 61 7.122 -12.770 -10.888 477 HZ PHE 61 HZ PHE 61 8.703 -13.516 -12.633 478 H CYS 62 H CYS 62 2.551 -16.205 -9.393 479 HA CYS 62 HA CYS 62 0.196 -17.789 -10.177 480 HB2 CYS 62 1HB CYS 62 1.259 -19.223 -8.476 481 HB3 CYS 62 2HB CYS 62 1.317 -17.876 -7.349 482 HG CYS 62 HG CYS 62 -1.426 -18.999 -8.745 483 H GLU 63 H GLU 63 -1.551 -16.555 -10.162 484 HA GLU 63 HA GLU 63 -1.365 -13.939 -8.750 485 HB2 GLU 63 1HB GLU 63 -1.727 -13.878 -11.211 486 HB3 GLU 63 2HB GLU 63 -3.199 -14.820 -11.018 487 HG2 GLU 63 1HG GLU 63 -4.266 -13.035 -9.802 488 HG3 GLU 63 2HG GLU 63 -2.767 -12.110 -9.750 489 H TYR 64 H TYR 64 -2.370 -13.764 -6.889 490 HA TYR 64 HA TYR 64 -4.663 -15.504 -6.264 491 HB2 TYR 64 1HB TYR 64 -3.061 -13.462 -4.696 492 HB3 TYR 64 2HB TYR 64 -4.576 -14.103 -4.076 493 HD1 TYR 64 HD1 TYR 64 -1.216 -15.136 -5.321 494 HD2 TYR 64 HD2 TYR 64 -4.647 -16.148 -2.952 495 HE1 TYR 64 HE1 TYR 64 -0.019 -17.106 -4.429 496 HE2 TYR 64 HE2 TYR 64 -3.450 -18.118 -2.060 497 HH TYR 64 HH TYR 64 -1.610 -19.361 -2.176 498 H GLN 65 H GLN 65 -6.582 -14.468 -5.167 499 HA GLN 65 HA GLN 65 -7.705 -12.442 -6.933 500 HB2 GLN 65 1HB GLN 65 -8.750 -13.805 -4.424 501 HB3 GLN 65 2HB GLN 65 -9.669 -12.605 -5.320 502 HG2 GLN 65 1HG GLN 65 -9.540 -14.048 -7.334 503 HG3 GLN 65 2HG GLN 65 -8.713 -15.284 -6.344 504 HE21 GLN 65 1HE2 GLN 65 -12.327 -16.120 -6.517 505 HE22 GLN 65 2HE2 GLN 65 -11.044 -15.912 -7.663 506 H ASP 66 H ASP 66 -6.627 -12.572 -3.542 507 HA ASP 66 HA ASP 66 -6.878 -9.594 -3.471 508 HB2 ASP 66 1HB ASP 66 -7.022 -11.624 -1.206 509 HB3 ASP 66 2HB ASP 66 -6.965 -9.882 -0.967 510 H GLN 67 H GLN 67 -5.240 -8.371 -2.525 511 HA GLN 67 HA GLN 67 -2.572 -9.390 -2.902 512 HB2 GLN 67 1HB GLN 67 -3.601 -6.857 -1.566 513 HB3 GLN 67 2HB GLN 67 -1.898 -7.199 -1.832 514 HG2 GLN 67 1HG GLN 67 -2.451 -5.837 -3.614 515 HG3 GLN 67 2HG GLN 67 -2.559 -7.474 -4.321 516 HE21 GLN 67 1HE2 GLN 67 -5.604 -6.331 -5.657 517 HE22 GLN 67 2HE2 GLN 67 -3.937 -6.680 -5.972 518 H GLU 68 H GLU 68 -4.734 -9.155 -0.159 519 HA GLU 68 HA GLU 68 -2.745 -9.584 1.874 520 HB2 GLU 68 1HB GLU 68 -4.974 -8.693 2.405 521 HB3 GLU 68 2HB GLU 68 -5.732 -10.178 1.849 522 HG2 GLU 68 1HG GLU 68 -5.659 -10.121 4.260 523 HG3 GLU 68 2HG GLU 68 -4.647 -11.429 3.654 524 H THR 69 H THR 69 -4.726 -11.739 -0.120 525 HA THR 69 HA THR 69 -3.866 -14.143 1.259 526 HB THR 69 HB THR 69 -4.897 -15.337 -0.670 527 HG1 THR 69 HG1 THR 69 -4.592 -12.857 -1.808 528 HG21 THR 69 1HG2 THR 69 -7.194 -14.509 -0.341 529 HG22 THR 69 2HG2 THR 69 -6.313 -14.573 1.204 530 HG23 THR 69 3HG2 THR 69 -6.557 -13.014 0.383 531 H ALA 70 H ALA 70 -2.728 -12.273 -1.501 532 HA ALA 70 HA ALA 70 -0.733 -14.143 -2.356 533 HB1 ALA 70 1HB ALA 70 0.329 -12.180 -3.423 534 HB2 ALA 70 2HB ALA 70 -1.421 -12.235 -3.738 535 HB3 ALA 70 3HB ALA 70 -0.771 -11.107 -2.527 536 H LEU 71 H LEU 71 -0.650 -11.433 -0.038 537 HA LEU 71 HA LEU 71 2.097 -11.823 0.701 538 HB2 LEU 71 1HB LEU 71 -0.242 -10.529 2.139 539 HB3 LEU 71 2HB LEU 71 1.410 -10.517 2.764 540 HG LEU 71 HG LEU 71 0.571 -9.306 0.106 541 HD11 LEU 71 1HD1 LEU 71 0.796 -7.154 1.265 542 HD12 LEU 71 2HD1 LEU 71 -0.487 -8.156 1.983 543 HD13 LEU 71 3HD1 LEU 71 1.089 -8.009 2.797 544 HD21 LEU 71 1HD2 LEU 71 2.803 -8.254 0.235 545 HD22 LEU 71 2HD2 LEU 71 3.127 -9.125 1.754 546 HD23 LEU 71 3HD2 LEU 71 2.932 -10.029 0.233 547 H SER 72 H SER 72 -0.971 -13.117 1.917 548 HA SER 72 HA SER 72 0.040 -14.451 4.207 549 HB2 SER 72 1HB SER 72 -2.234 -15.187 2.336 550 HB3 SER 72 2HB SER 72 -1.931 -15.973 3.878 551 HG SER 72 HG SER 72 -2.695 -13.348 3.325 552 H ALA 73 H ALA 73 -0.260 -15.550 0.822 553 HA ALA 73 HA ALA 73 0.918 -18.107 1.199 554 HB1 ALA 73 1HB ALA 73 1.427 -18.002 -1.220 555 HB2 ALA 73 2HB ALA 73 -0.233 -17.465 -0.872 556 HB3 ALA 73 3HB ALA 73 1.035 -16.267 -1.219 557 H MET 74 H MET 74 2.394 -14.951 0.442 558 HA MET 74 HA MET 74 5.070 -15.880 0.232 559 HB2 MET 74 1HB MET 74 4.374 -13.640 -0.498 560 HB3 MET 74 2HB MET 74 3.998 -13.186 1.157 561 HG2 MET 74 1HG MET 74 6.783 -14.076 0.451 562 HG3 MET 74 2HG MET 74 6.246 -12.438 0.067 563 HE1 MET 74 1HE MET 74 5.527 -10.867 3.531 564 HE2 MET 74 2HE MET 74 5.750 -10.579 1.788 565 HE3 MET 74 3HE MET 74 4.374 -11.554 2.361 566 H ARG 75 H ARG 75 3.090 -15.077 3.033 567 HA ARG 75 HA ARG 75 5.418 -15.098 4.824 568 HB2 ARG 75 1HB ARG 75 2.442 -14.768 5.307 569 HB3 ARG 75 2HB ARG 75 3.632 -14.787 6.599 570 HG2 ARG 75 1HG ARG 75 4.696 -12.792 5.715 571 HG3 ARG 75 2HG ARG 75 3.595 -12.798 4.315 572 HD2 ARG 75 1HD ARG 75 2.712 -12.596 7.183 573 HD3 ARG 75 2HD ARG 75 2.969 -11.211 6.097 574 HE ARG 75 HE ARG 75 1.206 -13.140 4.924 575 HH11 ARG 75 1HH1 ARG 75 1.355 -10.579 7.324 576 HH12 ARG 75 2HH1 ARG 75 -0.348 -10.195 7.203 577 HH21 ARG 75 1HH2 ARG 75 -1.002 -12.633 4.776 578 HH22 ARG 75 2HH2 ARG 75 -1.683 -11.358 5.761 579 H ASN 76 H ASN 76 2.839 -17.253 3.816 580 HA ASN 76 HA ASN 76 3.349 -19.018 6.153 581 HB2 ASN 76 1HB ASN 76 1.103 -18.891 4.121 582 HB3 ASN 76 2HB ASN 76 1.273 -20.204 5.279 583 HD21 ASN 76 1HD2 ASN 76 -0.999 -17.519 6.574 584 HD22 ASN 76 2HD2 ASN 76 -0.917 -18.406 5.088 585 H LEU 77 H LEU 77 3.135 -19.160 2.590 586 HA LEU 77 HA LEU 77 3.761 -22.005 2.608 587 HB2 LEU 77 1HB LEU 77 3.507 -19.990 0.349 588 HB3 LEU 77 2HB LEU 77 3.757 -21.723 0.116 589 HG LEU 77 HG LEU 77 1.332 -20.439 1.423 590 HD11 LEU 77 1HD1 LEU 77 0.171 -21.188 -0.606 591 HD12 LEU 77 2HD1 LEU 77 1.466 -20.027 -0.980 592 HD13 LEU 77 3HD1 LEU 77 1.715 -21.764 -1.277 593 HD21 LEU 77 1HD2 LEU 77 0.417 -22.735 1.356 594 HD22 LEU 77 2HD2 LEU 77 1.965 -23.333 0.713 595 HD23 LEU 77 3HD2 LEU 77 1.886 -22.660 2.359 596 H ASN 78 H ASN 78 5.543 -19.044 2.422 597 HA ASN 78 HA ASN 78 7.818 -20.067 0.973 598 HB2 ASN 78 1HB ASN 78 7.280 -17.650 1.181 599 HB3 ASN 78 2HB ASN 78 7.647 -17.726 2.899 600 HD21 ASN 78 1HD2 ASN 78 10.549 -16.774 0.506 601 HD22 ASN 78 2HD2 ASN 78 8.853 -16.487 0.304 602 H GLY 79 H GLY 79 8.934 -21.742 1.636 603 HA2 GLY 79 1HA GLY 79 10.688 -22.638 2.976 604 HA3 GLY 79 2HA GLY 79 10.228 -21.577 4.294 605 H ARG 80 H ARG 80 7.458 -22.937 2.960 606 HA ARG 80 HA ARG 80 7.113 -24.716 5.256 607 HB2 ARG 80 1HB ARG 80 5.246 -23.337 4.412 608 HB3 ARG 80 2HB ARG 80 5.311 -24.177 2.870 609 HG2 ARG 80 1HG ARG 80 4.613 -26.249 3.895 610 HG3 ARG 80 2HG ARG 80 4.704 -25.518 5.516 611 HD2 ARG 80 1HD ARG 80 2.934 -24.007 4.989 612 HD3 ARG 80 2HD ARG 80 2.906 -24.566 3.301 613 HE ARG 80 HE ARG 80 2.511 -26.737 5.132 614 HH11 ARG 80 1HH1 ARG 80 0.897 -23.999 3.636 615 HH12 ARG 80 2HH1 ARG 80 -0.696 -24.711 3.758 616 HH21 ARG 80 1HH2 ARG 80 0.438 -27.651 5.285 617 HH22 ARG 80 2HH2 ARG 80 -0.957 -26.778 4.691 618 H GLU 81 H GLU 81 7.474 -26.822 5.335 619 HA GLU 81 HA GLU 81 8.485 -28.137 2.900 620 HB2 GLU 81 1HB GLU 81 9.713 -28.353 5.051 621 HB3 GLU 81 2HB GLU 81 8.312 -29.131 5.774 622 HG2 GLU 81 1HG GLU 81 8.511 -30.995 4.193 623 HG3 GLU 81 2HG GLU 81 9.893 -30.211 3.430 624 H PHE 82 H PHE 82 7.494 -29.658 1.749 625 HA PHE 82 HA PHE 82 4.901 -30.702 2.815 626 HB2 PHE 82 1HB PHE 82 5.666 -30.162 -0.083 627 HB3 PHE 82 2HB PHE 82 4.153 -30.876 0.454 628 HD1 PHE 82 HD1 PHE 82 6.120 -27.799 0.222 629 HD2 PHE 82 HD2 PHE 82 2.446 -29.533 1.543 630 HE1 PHE 82 HE1 PHE 82 5.136 -25.541 0.443 631 HE2 PHE 82 HE2 PHE 82 1.457 -27.278 1.763 632 HZ PHE 82 HZ PHE 82 2.804 -25.281 1.214 633 H SER 83 H SER 83 6.168 -32.413 3.790 634 HA SER 83 HA SER 83 7.091 -34.522 3.838 635 HB2 SER 83 1HB SER 83 5.700 -34.757 1.149 636 HB3 SER 83 2HB SER 83 6.323 -36.101 2.092 637 HG SER 83 HG SER 83 4.408 -36.056 2.859 638 H GLY 84 H GLY 84 8.771 -32.452 2.893 639 HA2 GLY 84 1HA GLY 84 11.101 -32.809 2.287 640 HA3 GLY 84 2HA GLY 84 10.601 -34.067 1.172 641 H ARG 85 H ARG 85 8.299 -32.410 0.201 642 HA ARG 85 HA ARG 85 9.871 -31.015 -1.865 643 HB2 ARG 85 1HB ARG 85 6.915 -31.666 -1.634 644 HB3 ARG 85 2HB ARG 85 7.624 -30.793 -2.984 645 HG2 ARG 85 1HG ARG 85 8.949 -32.716 -3.611 646 HG3 ARG 85 2HG ARG 85 8.403 -33.602 -2.166 647 HD2 ARG 85 1HD ARG 85 6.160 -33.632 -2.962 648 HD3 ARG 85 2HD ARG 85 6.583 -32.573 -4.327 649 HE ARG 85 HE ARG 85 7.549 -34.368 -5.427 650 HH11 ARG 85 1HH1 ARG 85 6.646 -35.283 -2.157 651 HH12 ARG 85 2HH1 ARG 85 6.860 -36.995 -2.443 652 HH21 ARG 85 1HH2 ARG 85 7.823 -36.593 -5.786 653 HH22 ARG 85 2HH2 ARG 85 7.526 -37.738 -4.497 654 H ALA 86 H ALA 86 10.459 -29.429 -0.043 655 HA ALA 86 HA ALA 86 8.440 -27.606 0.883 656 HB1 ALA 86 1HB ALA 86 10.353 -26.237 1.649 657 HB2 ALA 86 2HB ALA 86 10.543 -27.948 2.101 658 HB3 ALA 86 3HB ALA 86 11.459 -27.283 0.729 659 H LEU 87 H LEU 87 7.850 -25.594 0.230 660 HA LEU 87 HA LEU 87 8.792 -24.824 -2.500 661 HB2 LEU 87 1HB LEU 87 6.123 -24.244 -1.166 662 HB3 LEU 87 2HB LEU 87 6.599 -23.737 -2.789 663 HG LEU 87 HG LEU 87 6.244 -26.618 -1.885 664 HD11 LEU 87 1HD1 LEU 87 4.228 -26.547 -3.284 665 HD12 LEU 87 2HD1 LEU 87 4.137 -25.384 -1.940 666 HD13 LEU 87 3HD1 LEU 87 4.499 -24.815 -3.587 667 HD21 LEU 87 1HD2 LEU 87 6.455 -27.101 -4.300 668 HD22 LEU 87 2HD2 LEU 87 6.758 -25.376 -4.620 669 HD23 LEU 87 3HD2 LEU 87 7.928 -26.325 -3.672 670 H ARG 88 H ARG 88 8.864 -22.545 -2.995 671 HA ARG 88 HA ARG 88 8.967 -20.784 -0.586 672 HB2 ARG 88 1HB ARG 88 11.263 -21.285 -1.367 673 HB3 ARG 88 2HB ARG 88 10.850 -20.696 -2.970 674 HG2 ARG 88 1HG ARG 88 10.372 -18.451 -1.939 675 HG3 ARG 88 2HG ARG 88 11.030 -19.092 -0.414 676 HD2 ARG 88 1HD ARG 88 13.143 -19.514 -1.454 677 HD3 ARG 88 2HD ARG 88 12.500 -19.023 -3.038 678 HE ARG 88 HE ARG 88 12.506 -16.778 -2.345 679 HH11 ARG 88 1HH1 ARG 88 13.676 -18.941 0.164 680 HH12 ARG 88 2HH1 ARG 88 14.413 -17.660 1.100 681 HH21 ARG 88 1HH2 ARG 88 13.467 -15.124 -1.121 682 HH22 ARG 88 2HH2 ARG 88 14.295 -15.499 0.374 683 H VAL 89 H VAL 89 7.677 -19.089 -0.695 684 HA VAL 89 HA VAL 89 6.783 -18.192 -3.404 685 HB VAL 89 HB VAL 89 5.199 -18.171 -0.799 686 HG11 VAL 89 1HG1 VAL 89 3.325 -17.433 -2.188 687 HG12 VAL 89 2HG1 VAL 89 4.666 -16.263 -2.202 688 HG13 VAL 89 3HG1 VAL 89 4.407 -17.339 -3.597 689 HG21 VAL 89 1HG2 VAL 89 3.789 -19.857 -1.936 690 HG22 VAL 89 2HG2 VAL 89 4.892 -19.836 -3.332 691 HG23 VAL 89 3HG2 VAL 89 5.462 -20.434 -1.755 692 H ASP 90 H ASP 90 7.497 -16.248 -3.908 693 HA ASP 90 HA ASP 90 7.765 -14.246 -1.703 694 HB2 ASP 90 1HB ASP 90 9.328 -14.470 -4.306 695 HB3 ASP 90 2HB ASP 90 9.434 -13.106 -3.201 696 H ASN 91 H ASN 91 6.926 -12.224 -1.967 697 HA ASN 91 HA ASN 91 4.797 -11.922 -3.910 698 HB2 ASN 91 1HB ASN 91 4.712 -10.928 -1.640 699 HB3 ASN 91 2HB ASN 91 6.055 -9.872 -2.057 700 HD21 ASN 91 1HD2 ASN 91 2.297 -9.162 -3.513 701 HD22 ASN 91 2HD2 ASN 91 2.717 -10.704 -2.845 702 H ALA 92 H ALA 92 4.843 -11.191 -5.889 703 HA ALA 92 HA ALA 92 7.362 -10.515 -7.106 704 HB1 ALA 92 1HB ALA 92 6.014 -10.147 -9.147 705 HB2 ALA 92 2HB ALA 92 5.593 -11.680 -8.346 706 HB3 ALA 92 3HB ALA 92 4.528 -10.265 -8.177 707 H ALA 93 H ALA 93 8.120 -8.733 -5.911 708 HA ALA 93 HA ALA 93 6.671 -6.191 -6.470 709 HB1 ALA 93 1HB ALA 93 8.080 -5.220 -4.684 710 HB2 ALA 93 2HB ALA 93 7.138 -6.611 -4.098 711 HB3 ALA 93 3HB ALA 93 8.869 -6.798 -4.459 712 H SER 94 H SER 94 9.422 -8.053 -7.314 713 HA SER 94 HA SER 94 11.146 -5.900 -8.143 714 HB2 SER 94 1HB SER 94 12.020 -8.135 -7.740 715 HB3 SER 94 2HB SER 94 10.988 -8.809 -8.992 716 HG SER 94 HG SER 94 13.373 -7.734 -9.207 717 H GLU 95 H GLU 95 11.452 -4.931 -10.094 718 HA GLU 95 HA GLU 95 9.114 -4.619 -11.726 719 HB2 GLU 95 1HB GLU 95 12.003 -3.772 -12.183 720 HB3 GLU 95 2HB GLU 95 10.657 -3.279 -13.202 721 HG2 GLU 95 1HG GLU 95 10.999 -2.648 -10.262 722 HG3 GLU 95 2HG GLU 95 11.253 -1.542 -11.610 723 H LYS 96 H LYS 96 12.062 -6.540 -12.050 724 HA LYS 96 HA LYS 96 11.655 -7.440 -14.716 725 HB2 LYS 96 1HB LYS 96 13.741 -7.828 -13.439 726 HB3 LYS 96 2HB LYS 96 12.887 -8.915 -12.353 727 HG2 LYS 96 1HG LYS 96 12.463 -10.471 -14.201 728 HG3 LYS 96 2HG LYS 96 13.262 -9.366 -15.328 729 HD2 LYS 96 1HD LYS 96 15.371 -9.584 -14.071 730 HD3 LYS 96 2HD LYS 96 14.578 -10.659 -12.910 731 HE2 LYS 96 1HE LYS 96 14.112 -12.275 -14.724 732 HE3 LYS 96 2HE LYS 96 14.903 -11.205 -15.884 733 HZ1 LYS 96 1HZ LYS 96 16.371 -12.926 -15.129 734 HZ2 LYS 96 2HZ LYS 96 16.939 -11.456 -14.640 735 HZ3 LYS 96 3HZ LYS 96 16.200 -12.457 -13.557 736 H ASN 97 H ASN 97 10.492 -8.757 -11.611 737 HA ASN 97 HA ASN 97 9.098 -10.974 -12.765 738 HB2 ASN 97 1HB ASN 97 8.808 -9.476 -10.152 739 HB3 ASN 97 2HB ASN 97 7.756 -10.821 -10.573 740 HD21 ASN 97 1HD2 ASN 97 10.663 -12.032 -8.586 741 HD22 ASN 97 2HD2 ASN 97 9.448 -10.819 -8.357 742 H LYS 98 H LYS 98 8.158 -7.624 -12.136 743 HA LYS 98 HA LYS 98 5.397 -7.906 -12.780 744 HB2 LYS 98 1HB LYS 98 7.303 -5.552 -13.036 745 HB3 LYS 98 2HB LYS 98 5.581 -5.431 -13.367 746 HG2 LYS 98 1HG LYS 98 5.070 -6.081 -11.053 747 HG3 LYS 98 2HG LYS 98 6.798 -6.250 -10.713 748 HD2 LYS 98 1HD LYS 98 7.108 -3.839 -11.324 749 HD3 LYS 98 2HD LYS 98 5.355 -3.699 -11.522 750 HE2 LYS 98 1HE LYS 98 5.016 -4.323 -9.169 751 HE3 LYS 98 2HE LYS 98 6.755 -4.540 -8.957 752 HZ1 LYS 98 1HZ LYS 98 6.029 -2.411 -8.165 753 HZ2 LYS 98 2HZ LYS 98 7.048 -2.210 -9.447 754 HZ3 LYS 98 3HZ LYS 98 5.423 -2.006 -9.644 755 H GLU 99 H GLU 99 8.240 -7.251 -14.815 756 HA GLU 99 HA GLU 99 6.748 -6.904 -17.243 757 HB2 GLU 99 1HB GLU 99 9.643 -7.671 -16.717 758 HB3 GLU 99 2HB GLU 99 8.998 -7.407 -18.330 759 HG2 GLU 99 1HG GLU 99 9.075 -5.361 -16.101 760 HG3 GLU 99 2HG GLU 99 10.183 -5.449 -17.469 761 H GLU 100 H GLU 100 8.177 -9.722 -15.640 762 HA GLU 100 HA GLU 100 7.601 -11.606 -17.716 763 HB2 GLU 100 1HB GLU 100 7.873 -11.917 -14.703 764 HB3 GLU 100 2HB GLU 100 7.644 -13.278 -15.791 765 HG2 GLU 100 1HG GLU 100 9.946 -11.321 -15.957 766 HG3 GLU 100 2HG GLU 100 10.002 -12.875 -15.127 767 H LEU 101 H LEU 101 5.721 -10.474 -14.910 768 HA LEU 101 HA LEU 101 3.488 -12.191 -15.271 769 HB2 LEU 101 1HB LEU 101 3.762 -9.414 -14.086 770 HB3 LEU 101 2HB LEU 101 2.233 -10.298 -14.087 771 HG LEU 101 HG LEU 101 4.780 -11.318 -12.785 772 HD11 LEU 101 1HD1 LEU 101 3.731 -10.640 -10.672 773 HD12 LEU 101 2HD1 LEU 101 4.038 -9.244 -11.731 774 HD13 LEU 101 3HD1 LEU 101 2.390 -9.898 -11.576 775 HD21 LEU 101 1HD2 LEU 101 3.210 -12.877 -11.685 776 HD22 LEU 101 2HD2 LEU 101 1.860 -12.167 -12.603 777 HD23 LEU 101 3HD2 LEU 101 3.149 -13.050 -13.455 778 H LYS 102 H LYS 102 4.275 -9.027 -16.681 779 HA LYS 102 HA LYS 102 1.825 -8.533 -17.994 780 HB2 LYS 102 1HB LYS 102 4.683 -7.824 -18.738 781 HB3 LYS 102 2HB LYS 102 3.297 -7.265 -19.664 782 HG2 LYS 102 1HG LYS 102 2.421 -6.092 -17.697 783 HG3 LYS 102 2HG LYS 102 3.772 -6.693 -16.724 784 HD2 LYS 102 1HD LYS 102 5.361 -5.524 -18.239 785 HD3 LYS 102 2HD LYS 102 3.993 -4.894 -19.167 786 HE2 LYS 102 1HE LYS 102 3.162 -3.714 -17.173 787 HE3 LYS 102 2HE LYS 102 4.487 -4.374 -16.211 788 HZ1 LYS 102 1HZ LYS 102 4.952 -2.153 -16.946 789 HZ2 LYS 102 2HZ LYS 102 6.025 -3.202 -17.632 790 HZ3 LYS 102 3HZ LYS 102 4.787 -2.584 -18.530 791 H SER 103 H SER 103 4.671 -10.371 -19.109 792 HA SER 103 HA SER 103 3.517 -11.019 -21.668 793 HB2 SER 103 1HB SER 103 5.377 -12.504 -21.928 794 HB3 SER 103 2HB SER 103 5.964 -11.063 -21.112 795 HG SER 103 HG SER 103 5.338 -12.406 -19.153 796 H LEU 104 H LEU 104 3.132 -12.285 -18.472 797 HA LEU 104 HA LEU 104 2.046 -14.849 -19.421 798 HB2 LEU 104 1HB LEU 104 2.232 -13.606 -16.656 799 HB3 LEU 104 2HB LEU 104 1.577 -15.213 -16.983 800 HG LEU 104 HG LEU 104 4.432 -14.376 -17.600 801 HD11 LEU 104 1HD1 LEU 104 5.023 -15.681 -15.607 802 HD12 LEU 104 2HD1 LEU 104 3.991 -14.290 -15.200 803 HD13 LEU 104 3HD1 LEU 104 3.296 -15.927 -15.257 804 HD21 LEU 104 1HD2 LEU 104 4.760 -16.815 -17.831 805 HD22 LEU 104 2HD2 LEU 104 3.029 -17.078 -17.512 806 HD23 LEU 104 3HD2 LEU 104 3.541 -16.221 -18.985 807 H GLY 105 H GLY 105 0.924 -11.729 -19.258 808 HA2 GLY 105 1HA GLY 105 -1.252 -11.115 -19.995 809 HA3 GLY 105 2HA GLY 105 -1.853 -12.702 -19.552 810 H THR 106 H THR 106 0.172 -11.001 -17.286 811 HA THR 106 HA THR 106 -2.252 -10.284 -15.689 812 HB THR 106 HB THR 106 0.508 -11.137 -14.718 813 HG1 THR 106 HG1 THR 106 -1.845 -12.398 -13.913 814 HG21 THR 106 1HG2 THR 106 -0.444 -10.907 -12.457 815 HG22 THR 106 2HG2 THR 106 -0.436 -9.343 -13.306 816 HG23 THR 106 3HG2 THR 106 -1.950 -10.264 -13.151 817 H GLY 107 H GLY 107 -2.553 -8.242 -15.150 818 HA2 GLY 107 1HA GLY 107 -0.916 -6.177 -16.281 819 HA3 GLY 107 2HA GLY 107 -2.234 -5.943 -15.148 Start of MODEL 3 1 H MET 1 1H MET 1 6.551 -2.812 -2.690 2 HA MET 1 HA MET 1 4.730 -1.666 -1.701 3 HB2 MET 1 1HB MET 1 4.337 -4.658 -2.096 4 HB3 MET 1 2HB MET 1 3.039 -3.474 -2.051 5 HG2 MET 1 1HG MET 1 5.273 -3.564 -4.098 6 HG3 MET 1 2HG MET 1 3.616 -4.120 -4.343 7 HE1 MET 1 1HE MET 1 1.549 -0.827 -4.269 8 HE2 MET 1 2HE MET 1 1.535 -2.577 -4.598 9 HE3 MET 1 3HE MET 1 1.818 -1.984 -2.943 10 H ALA 2 H ALA 2 3.309 -1.370 -0.046 11 HA ALA 2 HA ALA 2 4.140 -2.611 2.505 12 HB1 ALA 2 1HB ALA 2 2.741 -0.856 3.545 13 HB2 ALA 2 2HB ALA 2 3.944 -0.165 2.431 14 HB3 ALA 2 3HB ALA 2 2.244 -0.305 1.928 15 H GLY 3 H GLY 3 2.054 -3.381 0.109 16 HA2 GLY 3 1HA GLY 3 0.412 -5.069 0.134 17 HA3 GLY 3 2HA GLY 3 0.412 -5.043 1.887 18 H LEU 4 H LEU 4 0.128 -2.070 0.049 19 HA LEU 4 HA LEU 4 -2.614 -1.743 1.150 20 HB2 LEU 4 1HB LEU 4 -0.701 0.311 -0.017 21 HB3 LEU 4 2HB LEU 4 -2.275 0.659 0.706 22 HG LEU 4 HG LEU 4 0.122 -0.490 2.179 23 HD11 LEU 4 1HD1 LEU 4 0.214 1.724 3.236 24 HD12 LEU 4 2HD1 LEU 4 0.461 1.824 1.477 25 HD13 LEU 4 3HD1 LEU 4 -1.107 2.281 2.183 26 HD21 LEU 4 1HD2 LEU 4 -1.263 -0.072 4.183 27 HD22 LEU 4 2HD2 LEU 4 -2.606 0.461 3.144 28 HD23 LEU 4 3HD2 LEU 4 -2.055 -1.230 3.088 29 H THR 5 H THR 5 -4.344 -1.055 -0.098 30 HA THR 5 HA THR 5 -4.378 -2.058 -2.799 31 HB THR 5 HB THR 5 -6.400 -0.314 -1.327 32 HG1 THR 5 HG1 THR 5 -7.436 -2.531 -1.327 33 HG21 THR 5 1HG2 THR 5 -7.988 -1.120 -3.030 34 HG22 THR 5 2HG2 THR 5 -6.660 -0.203 -3.781 35 HG23 THR 5 3HG2 THR 5 -6.669 -1.980 -3.858 36 H VAL 6 H VAL 6 -4.157 -1.093 -4.712 37 HA VAL 6 HA VAL 6 -3.510 1.826 -4.649 38 HB VAL 6 HB VAL 6 -1.965 1.405 -6.524 39 HG11 VAL 6 1HG1 VAL 6 -0.244 0.164 -5.305 40 HG12 VAL 6 2HG1 VAL 6 -1.091 1.330 -4.260 41 HG13 VAL 6 3HG1 VAL 6 -1.473 -0.406 -4.151 42 HG21 VAL 6 1HG2 VAL 6 -1.443 -0.921 -7.187 43 HG22 VAL 6 2HG2 VAL 6 -2.713 -1.517 -6.093 44 HG23 VAL 6 3HG2 VAL 6 -3.149 -0.528 -7.507 45 H ARG 7 H ARG 7 -3.768 2.905 -6.804 46 HA ARG 7 HA ARG 7 -6.323 1.980 -8.027 47 HB2 ARG 7 1HB ARG 7 -5.011 4.718 -7.999 48 HB3 ARG 7 2HB ARG 7 -6.498 4.333 -8.853 49 HG2 ARG 7 1HG ARG 7 -7.591 3.786 -6.717 50 HG3 ARG 7 2HG ARG 7 -6.085 4.189 -5.856 51 HD2 ARG 7 1HD ARG 7 -6.201 6.455 -6.719 52 HD3 ARG 7 2HD ARG 7 -7.708 6.052 -7.574 53 HE ARG 7 HE ARG 7 -8.010 5.404 -4.839 54 HH11 ARG 7 1HH1 ARG 7 -7.673 8.211 -6.925 55 HH12 ARG 7 2HH1 ARG 7 -8.580 9.265 -5.863 56 HH21 ARG 7 1HH2 ARG 7 -9.185 6.782 -3.469 57 HH22 ARG 7 2HH2 ARG 7 -9.436 8.457 -3.906 58 H ASP 8 H ASP 8 -3.146 1.641 -8.574 59 HA ASP 8 HA ASP 8 -3.360 2.073 -11.513 60 HB2 ASP 8 1HB ASP 8 -1.376 3.032 -10.335 61 HB3 ASP 8 2HB ASP 8 -0.917 1.415 -9.817 62 HA PRO 9 HA PRO 9 -4.450 -2.219 -11.689 63 HB2 PRO 9 1HB PRO 9 -3.896 -1.567 -14.614 64 HB3 PRO 9 2HB PRO 9 -5.235 -2.489 -13.919 65 HG2 PRO 9 1HG PRO 9 -5.691 0.027 -14.641 66 HG3 PRO 9 2HG PRO 9 -6.336 -0.541 -13.098 67 HD2 PRO 9 1HD PRO 9 -3.862 1.142 -13.641 68 HD3 PRO 9 2HD PRO 9 -5.092 1.311 -12.325 69 H ALA 10 H ALA 10 -1.704 -0.671 -13.342 70 HA ALA 10 HA ALA 10 -0.315 -3.075 -14.020 71 HB1 ALA 10 1HB ALA 10 1.646 -1.599 -14.320 72 HB2 ALA 10 2HB ALA 10 0.188 -0.920 -15.081 73 HB3 ALA 10 3HB ALA 10 0.762 -0.276 -13.526 74 H VAL 11 H VAL 11 -0.083 -0.895 -11.211 75 HA VAL 11 HA VAL 11 1.977 -2.424 -9.902 76 HB VAL 11 HB VAL 11 -0.080 -0.456 -8.816 77 HG11 VAL 11 1HG1 VAL 11 1.334 -0.319 -6.824 78 HG12 VAL 11 2HG1 VAL 11 0.649 -1.947 -7.045 79 HG13 VAL 11 3HG1 VAL 11 2.352 -1.634 -7.457 80 HG21 VAL 11 1HG2 VAL 11 1.850 1.092 -8.798 81 HG22 VAL 11 2HG2 VAL 11 2.877 -0.182 -9.497 82 HG23 VAL 11 3HG2 VAL 11 1.525 0.488 -10.440 83 H ASP 12 H ASP 12 -1.580 -2.328 -9.619 84 HA ASP 12 HA ASP 12 -1.844 -4.201 -7.517 85 HB2 ASP 12 1HB ASP 12 -3.693 -2.788 -8.445 86 HB3 ASP 12 2HB ASP 12 -3.716 -3.795 -9.886 87 H ARG 13 H ARG 13 -1.542 -4.687 -11.025 88 HA ARG 13 HA ARG 13 -1.956 -7.473 -11.110 89 HB2 ARG 13 1HB ARG 13 -1.726 -6.107 -13.127 90 HB3 ARG 13 2HB ARG 13 -0.048 -5.761 -12.739 91 HG2 ARG 13 1HG ARG 13 0.570 -8.075 -13.088 92 HG3 ARG 13 2HG ARG 13 -1.135 -8.525 -13.332 93 HD2 ARG 13 1HD ARG 13 -1.244 -7.124 -15.292 94 HD3 ARG 13 2HD ARG 13 0.438 -6.606 -15.035 95 HE ARG 13 HE ARG 13 -0.494 -9.226 -15.991 96 HH11 ARG 13 1HH1 ARG 13 2.176 -7.167 -15.006 97 HH12 ARG 13 2HH1 ARG 13 3.394 -8.172 -15.761 98 HH21 ARG 13 1HH2 ARG 13 1.095 -10.522 -16.966 99 HH22 ARG 13 2HH2 ARG 13 2.782 -10.071 -16.870 100 H SER 14 H SER 14 1.117 -5.682 -10.679 101 HA SER 14 HA SER 14 2.649 -8.102 -10.277 102 HB2 SER 14 1HB SER 14 4.485 -6.629 -9.778 103 HB3 SER 14 2HB SER 14 3.590 -5.952 -11.129 104 HG SER 14 HG SER 14 2.402 -4.894 -9.226 105 H LEU 15 H LEU 15 0.753 -6.031 -8.234 106 HA LEU 15 HA LEU 15 2.027 -6.741 -5.742 107 HB2 LEU 15 1HB LEU 15 0.673 -4.711 -5.977 108 HB3 LEU 15 2HB LEU 15 -0.758 -5.680 -6.341 109 HG LEU 15 HG LEU 15 -0.707 -6.612 -4.051 110 HD11 LEU 15 1HD1 LEU 15 0.831 -5.660 -2.392 111 HD12 LEU 15 2HD1 LEU 15 1.706 -6.507 -3.690 112 HD13 LEU 15 3HD1 LEU 15 1.638 -4.728 -3.675 113 HD21 LEU 15 1HD2 LEU 15 -1.348 -4.522 -2.899 114 HD22 LEU 15 2HD2 LEU 15 -0.572 -3.572 -4.189 115 HD23 LEU 15 3HD2 LEU 15 -2.002 -4.567 -4.554 116 H ARG 16 H ARG 16 -0.891 -7.894 -7.446 117 HA ARG 16 HA ARG 16 -1.381 -9.909 -5.371 118 HB2 ARG 16 1HB ARG 16 -2.743 -9.282 -8.008 119 HB3 ARG 16 2HB ARG 16 -3.234 -10.606 -6.961 120 HG2 ARG 16 1HG ARG 16 -3.637 -8.935 -5.137 121 HG3 ARG 16 2HG ARG 16 -3.309 -7.650 -6.325 122 HD2 ARG 16 1HD ARG 16 -5.387 -9.786 -6.705 123 HD3 ARG 16 2HD ARG 16 -5.710 -8.199 -5.969 124 HE ARG 16 HE ARG 16 -5.188 -7.157 -8.065 125 HH11 ARG 16 1HH1 ARG 16 -5.403 -10.662 -8.174 126 HH12 ARG 16 2HH1 ARG 16 -5.663 -10.717 -9.903 127 HH21 ARG 16 1HH2 ARG 16 -5.526 -7.242 -10.309 128 HH22 ARG 16 2HH2 ARG 16 -5.732 -8.783 -11.113 129 H SER 17 H SER 17 0.378 -9.669 -8.320 130 HA SER 17 HA SER 17 0.476 -12.524 -8.857 131 HB2 SER 17 1HB SER 17 0.932 -10.923 -10.632 132 HB3 SER 17 2HB SER 17 2.255 -10.219 -9.714 133 HG SER 17 HG SER 17 3.195 -12.340 -9.747 134 H VAL 18 H VAL 18 1.819 -14.042 -8.113 135 HA VAL 18 HA VAL 18 3.934 -13.157 -6.196 136 HB VAL 18 HB VAL 18 2.048 -15.535 -5.909 137 HG11 VAL 18 1HG1 VAL 18 3.142 -15.893 -3.750 138 HG12 VAL 18 2HG1 VAL 18 4.277 -16.071 -5.109 139 HG13 VAL 18 3HG1 VAL 18 4.297 -14.591 -4.120 140 HG21 VAL 18 1HG2 VAL 18 1.237 -14.312 -3.917 141 HG22 VAL 18 2HG2 VAL 18 2.332 -12.963 -4.301 142 HG23 VAL 18 3HG2 VAL 18 0.990 -13.361 -5.400 143 H PHE 19 H PHE 19 5.893 -13.981 -6.511 144 HA PHE 19 HA PHE 19 6.324 -15.884 -8.686 145 HB2 PHE 19 1HB PHE 19 7.892 -14.004 -8.254 146 HB3 PHE 19 2HB PHE 19 8.280 -14.686 -6.682 147 HD1 PHE 19 HD1 PHE 19 8.596 -15.153 -10.324 148 HD2 PHE 19 HD2 PHE 19 9.764 -16.549 -6.459 149 HE1 PHE 19 HE1 PHE 19 10.385 -16.510 -11.357 150 HE2 PHE 19 HE2 PHE 19 11.556 -17.906 -7.488 151 HZ PHE 19 HZ PHE 19 11.865 -17.887 -9.939 152 H VAL 20 H VAL 20 6.550 -18.005 -8.571 153 HA VAL 20 HA VAL 20 6.896 -19.213 -5.857 154 HB VAL 20 HB VAL 20 5.359 -20.369 -8.223 155 HG11 VAL 20 1HG1 VAL 20 4.622 -22.066 -6.622 156 HG12 VAL 20 2HG1 VAL 20 6.388 -22.080 -6.841 157 HG13 VAL 20 3HG1 VAL 20 5.676 -21.352 -5.380 158 HG21 VAL 20 1HG2 VAL 20 3.357 -19.942 -6.834 159 HG22 VAL 20 2HG2 VAL 20 4.378 -19.160 -5.605 160 HG23 VAL 20 3HG2 VAL 20 4.208 -18.428 -7.218 161 H GLY 21 H GLY 21 8.548 -20.557 -5.578 162 HA2 GLY 21 1HA GLY 21 9.902 -21.671 -8.003 163 HA3 GLY 21 2HA GLY 21 10.833 -20.823 -6.783 164 H ASN 22 H ASN 22 11.835 -23.133 -7.019 165 HA ASN 22 HA ASN 22 12.246 -25.208 -6.107 166 HB2 ASN 22 1HB ASN 22 10.697 -24.024 -3.779 167 HB3 ASN 22 2HB ASN 22 11.648 -25.501 -3.708 168 HD21 ASN 22 1HD2 ASN 22 13.772 -22.832 -2.394 169 HD22 ASN 22 2HD2 ASN 22 12.302 -23.637 -1.960 170 H ILE 23 H ILE 23 10.207 -25.219 -7.907 171 HA ILE 23 HA ILE 23 8.084 -26.895 -6.685 172 HB ILE 23 HB ILE 23 8.346 -25.750 -9.499 173 HG12 ILE 23 1HG1 ILE 23 6.448 -24.945 -7.288 174 HG13 ILE 23 2HG1 ILE 23 7.965 -24.121 -7.613 175 HG21 ILE 23 1HG2 ILE 23 6.014 -26.489 -9.775 176 HG22 ILE 23 2HG2 ILE 23 7.090 -27.871 -9.466 177 HG23 ILE 23 3HG2 ILE 23 6.057 -27.240 -8.162 178 HD11 ILE 23 1HD1 ILE 23 6.096 -22.959 -8.647 179 HD12 ILE 23 2HD1 ILE 23 7.205 -23.592 -9.889 180 HD13 ILE 23 3HD1 ILE 23 5.667 -24.425 -9.559 181 HA PRO 24 HA PRO 24 10.304 -30.550 -7.864 182 HB2 PRO 24 1HB PRO 24 7.512 -31.648 -7.392 183 HB3 PRO 24 2HB PRO 24 9.063 -32.269 -6.815 184 HG2 PRO 24 1HG PRO 24 7.527 -30.932 -5.103 185 HG3 PRO 24 2HG PRO 24 9.263 -30.605 -5.124 186 HD2 PRO 24 1HD PRO 24 6.997 -29.015 -6.398 187 HD3 PRO 24 2HD PRO 24 8.431 -28.413 -5.473 188 H TYR 25 H TYR 25 10.467 -31.627 -9.796 189 HA TYR 25 HA TYR 25 8.963 -30.577 -12.025 190 HB2 TYR 25 1HB TYR 25 10.376 -31.925 -13.402 191 HB3 TYR 25 2HB TYR 25 11.382 -31.339 -12.085 192 HD1 TYR 25 HD1 TYR 25 9.758 -34.269 -13.575 193 HD2 TYR 25 HD2 TYR 25 12.210 -32.838 -10.359 194 HE1 TYR 25 HE1 TYR 25 10.413 -36.592 -13.040 195 HE2 TYR 25 HE2 TYR 25 12.865 -35.160 -9.824 196 HH TYR 25 HH TYR 25 11.338 -37.900 -11.353 197 H GLU 26 H GLU 26 8.397 -33.116 -9.825 198 HA GLU 26 HA GLU 26 6.612 -34.559 -11.684 199 HB2 GLU 26 1HB GLU 26 7.267 -34.999 -8.742 200 HB3 GLU 26 2HB GLU 26 6.180 -36.014 -9.679 201 HG2 GLU 26 1HG GLU 26 8.037 -36.599 -11.193 202 HG3 GLU 26 2HG GLU 26 9.124 -35.593 -10.238 203 H ALA 27 H ALA 27 6.467 -31.852 -9.699 204 HA ALA 27 HA ALA 27 3.772 -32.298 -8.669 205 HB1 ALA 27 1HB ALA 27 3.983 -29.988 -7.811 206 HB2 ALA 27 2HB ALA 27 5.392 -30.984 -7.376 207 HB3 ALA 27 3HB ALA 27 5.511 -29.804 -8.703 208 H THR 28 H THR 28 1.890 -31.235 -9.235 209 HA THR 28 HA THR 28 1.920 -30.155 -12.016 210 HB THR 28 HB THR 28 -0.416 -30.802 -12.180 211 HG1 THR 28 HG1 THR 28 -1.163 -32.069 -10.177 212 HG21 THR 28 1HG2 THR 28 -0.239 -33.240 -11.878 213 HG22 THR 28 2HG2 THR 28 1.254 -32.577 -12.583 214 HG23 THR 28 3HG2 THR 28 1.202 -33.014 -10.860 215 H GLU 29 H GLU 29 0.125 -28.562 -12.470 216 HA GLU 29 HA GLU 29 0.476 -26.270 -10.780 217 HB2 GLU 29 1HB GLU 29 -1.474 -26.864 -13.037 218 HB3 GLU 29 2HB GLU 29 -1.390 -25.307 -12.227 219 HG2 GLU 29 1HG GLU 29 0.908 -25.002 -12.953 220 HG3 GLU 29 2HG GLU 29 0.927 -26.613 -13.669 221 H GLU 30 H GLU 30 -1.986 -28.777 -10.989 222 HA GLU 30 HA GLU 30 -3.972 -27.328 -9.469 223 HB2 GLU 30 1HB GLU 30 -3.653 -30.275 -10.152 224 HB3 GLU 30 2HB GLU 30 -5.028 -29.637 -9.262 225 HG2 GLU 30 1HG GLU 30 -4.219 -28.828 -12.064 226 HG3 GLU 30 2HG GLU 30 -5.506 -29.957 -11.645 227 H GLN 31 H GLN 31 -1.419 -29.645 -8.672 228 HA GLN 31 HA GLN 31 -2.164 -30.062 -5.948 229 HB2 GLN 31 1HB GLN 31 0.514 -30.207 -7.378 230 HB3 GLN 31 2HB GLN 31 0.323 -30.614 -5.679 231 HG2 GLN 31 1HG GLN 31 -1.221 -32.402 -6.231 232 HG3 GLN 31 2HG GLN 31 -1.148 -31.954 -7.958 233 HE21 GLN 31 1HE2 GLN 31 1.309 -34.722 -6.698 234 HE22 GLN 31 2HE2 GLN 31 -0.261 -34.332 -6.077 235 H LEU 32 H LEU 32 0.045 -27.695 -7.458 236 HA LEU 32 HA LEU 32 0.595 -26.276 -5.025 237 HB2 LEU 32 1HB LEU 32 0.714 -25.519 -7.955 238 HB3 LEU 32 2HB LEU 32 1.124 -24.373 -6.675 239 HG LEU 32 HG LEU 32 2.518 -27.045 -7.037 240 HD11 LEU 32 1HD1 LEU 32 4.320 -25.754 -8.092 241 HD12 LEU 32 2HD1 LEU 32 2.812 -25.670 -9.033 242 HD13 LEU 32 3HD1 LEU 32 3.310 -24.291 -8.024 243 HD21 LEU 32 1HD2 LEU 32 4.215 -25.975 -5.594 244 HD22 LEU 32 2HD2 LEU 32 3.205 -24.513 -5.490 245 HD23 LEU 32 3HD2 LEU 32 2.633 -26.042 -4.781 246 H LYS 33 H LYS 33 -1.893 -25.939 -7.540 247 HA LYS 33 HA LYS 33 -3.063 -23.531 -6.643 248 HB2 LYS 33 1HB LYS 33 -3.626 -24.715 -8.777 249 HB3 LYS 33 2HB LYS 33 -4.483 -25.939 -7.850 250 HG2 LYS 33 1HG LYS 33 -6.047 -24.207 -7.021 251 HG3 LYS 33 2HG LYS 33 -5.195 -22.995 -7.988 252 HD2 LYS 33 1HD LYS 33 -6.403 -25.506 -9.193 253 HD3 LYS 33 2HD LYS 33 -7.299 -23.988 -9.032 254 HE2 LYS 33 1HE LYS 33 -5.614 -22.826 -10.396 255 HE3 LYS 33 2HE LYS 33 -4.668 -24.311 -10.522 256 HZ1 LYS 33 1HZ LYS 33 -6.018 -23.958 -12.456 257 HZ2 LYS 33 2HZ LYS 33 -6.515 -25.322 -11.672 258 HZ3 LYS 33 3HZ LYS 33 -7.399 -23.934 -11.555 259 H ASP 34 H ASP 34 -3.550 -26.868 -5.544 260 HA ASP 34 HA ASP 34 -5.768 -26.412 -3.850 261 HB2 ASP 34 1HB ASP 34 -3.472 -28.394 -3.702 262 HB3 ASP 34 2HB ASP 34 -4.786 -28.397 -2.533 263 H ILE 35 H ILE 35 -2.274 -26.333 -3.070 264 HA ILE 35 HA ILE 35 -2.782 -25.544 -0.326 265 HB ILE 35 HB ILE 35 -0.337 -25.305 -0.161 266 HG12 ILE 35 1HG1 ILE 35 -0.229 -25.808 -3.141 267 HG13 ILE 35 2HG1 ILE 35 -0.081 -24.218 -2.409 268 HG21 ILE 35 1HG2 ILE 35 0.305 -27.590 -0.816 269 HG22 ILE 35 2HG2 ILE 35 -1.303 -27.571 -0.056 270 HG23 ILE 35 3HG2 ILE 35 -1.156 -27.716 -1.823 271 HD11 ILE 35 1HD1 ILE 35 2.103 -25.153 -2.927 272 HD12 ILE 35 2HD1 ILE 35 1.906 -24.961 -1.168 273 HD13 ILE 35 3HD1 ILE 35 1.757 -26.571 -1.911 274 H PHE 36 H PHE 36 -2.522 -23.878 -3.330 275 HA PHE 36 HA PHE 36 -1.892 -21.281 -2.190 276 HB2 PHE 36 1HB PHE 36 -3.104 -22.134 -4.845 277 HB3 PHE 36 2HB PHE 36 -2.796 -20.456 -4.426 278 HD1 PHE 36 HD1 PHE 36 -0.236 -21.879 -2.772 279 HD2 PHE 36 HD2 PHE 36 -1.576 -21.386 -6.799 280 HE1 PHE 36 HE1 PHE 36 2.092 -22.105 -3.573 281 HE2 PHE 36 HE2 PHE 36 0.751 -21.613 -7.603 282 HZ PHE 36 HZ PHE 36 2.586 -21.971 -5.989 283 H SER 37 H SER 37 -4.804 -23.165 -2.749 284 HA SER 37 HA SER 37 -6.588 -20.934 -2.128 285 HB2 SER 37 1HB SER 37 -8.356 -22.533 -2.321 286 HB3 SER 37 2HB SER 37 -7.205 -22.872 -3.605 287 HG SER 37 HG SER 37 -6.263 -24.337 -1.925 288 H GLU 38 H GLU 38 -4.844 -23.375 -0.377 289 HA GLU 38 HA GLU 38 -6.425 -23.424 2.002 290 HB2 GLU 38 1HB GLU 38 -3.469 -23.918 1.495 291 HB3 GLU 38 2HB GLU 38 -4.201 -24.106 3.082 292 HG2 GLU 38 1HG GLU 38 -5.768 -25.785 2.116 293 HG3 GLU 38 2HG GLU 38 -4.922 -25.640 0.577 294 H VAL 39 H VAL 39 -4.243 -21.065 0.691 295 HA VAL 39 HA VAL 39 -4.193 -19.642 3.314 296 HB VAL 39 HB VAL 39 -2.280 -18.368 2.359 297 HG11 VAL 39 1HG1 VAL 39 -0.643 -20.186 2.415 298 HG12 VAL 39 2HG1 VAL 39 -1.857 -20.342 3.707 299 HG13 VAL 39 3HG1 VAL 39 -1.959 -21.374 2.260 300 HG21 VAL 39 1HG2 VAL 39 -1.260 -19.152 0.246 301 HG22 VAL 39 2HG2 VAL 39 -2.600 -20.303 0.028 302 HG23 VAL 39 3HG2 VAL 39 -2.913 -18.552 -0.022 303 H GLY 40 H GLY 40 -6.335 -19.733 1.127 304 HA2 GLY 40 1HA GLY 40 -7.919 -17.791 1.390 305 HA3 GLY 40 2HA GLY 40 -6.587 -16.751 0.920 306 HA PRO 41 HA PRO 41 -9.338 -18.319 -2.678 307 HB2 PRO 41 1HB PRO 41 -9.605 -15.289 -2.872 308 HB3 PRO 41 2HB PRO 41 -10.787 -16.535 -3.292 309 HG2 PRO 41 1HG PRO 41 -11.085 -15.257 -0.981 310 HG3 PRO 41 2HG PRO 41 -11.308 -17.009 -1.015 311 HD2 PRO 41 1HD PRO 41 -8.904 -15.399 -0.081 312 HD3 PRO 41 2HD PRO 41 -9.645 -16.876 0.656 313 H VAL 42 H VAL 42 -8.307 -18.629 -4.578 314 HA VAL 42 HA VAL 42 -6.168 -16.697 -5.357 315 HB VAL 42 HB VAL 42 -5.143 -18.714 -4.336 316 HG11 VAL 42 1HG1 VAL 42 -5.375 -20.900 -5.411 317 HG12 VAL 42 2HG1 VAL 42 -6.925 -20.304 -4.772 318 HG13 VAL 42 3HG1 VAL 42 -6.593 -20.224 -6.519 319 HG21 VAL 42 1HG2 VAL 42 -3.670 -19.297 -6.236 320 HG22 VAL 42 2HG2 VAL 42 -4.837 -18.567 -7.363 321 HG23 VAL 42 3HG2 VAL 42 -3.985 -17.547 -6.180 322 H VAL 43 H VAL 43 -5.831 -16.406 -7.560 323 HA VAL 43 HA VAL 43 -8.336 -16.804 -9.039 324 HB VAL 43 HB VAL 43 -5.807 -15.234 -9.696 325 HG11 VAL 43 1HG1 VAL 43 -7.114 -14.206 -11.490 326 HG12 VAL 43 2HG1 VAL 43 -6.905 -15.956 -11.737 327 HG13 VAL 43 3HG1 VAL 43 -8.459 -15.319 -11.147 328 HG21 VAL 43 1HG2 VAL 43 -7.236 -13.278 -9.193 329 HG22 VAL 43 2HG2 VAL 43 -8.579 -14.368 -8.776 330 HG23 VAL 43 3HG2 VAL 43 -7.102 -14.356 -7.784 331 H SER 44 H SER 44 -4.846 -17.275 -9.743 332 HA SER 44 HA SER 44 -5.340 -19.731 -11.198 333 HB2 SER 44 1HB SER 44 -6.207 -18.161 -12.860 334 HB3 SER 44 2HB SER 44 -4.736 -17.204 -12.769 335 HG SER 44 HG SER 44 -3.611 -18.792 -13.677 336 H PHE 45 H PHE 45 -3.462 -20.810 -11.777 337 HA PHE 45 HA PHE 45 -0.907 -19.387 -11.177 338 HB2 PHE 45 1HB PHE 45 -1.224 -20.797 -9.278 339 HB3 PHE 45 2HB PHE 45 -1.801 -22.135 -10.259 340 HD1 PHE 45 HD1 PHE 45 1.233 -20.023 -9.724 341 HD2 PHE 45 HD2 PHE 45 -0.344 -23.827 -10.862 342 HE1 PHE 45 HE1 PHE 45 3.525 -20.945 -9.812 343 HE2 PHE 45 HE2 PHE 45 1.947 -24.753 -10.948 344 HZ PHE 45 HZ PHE 45 3.882 -23.310 -10.424 345 H ARG 46 H ARG 46 0.819 -19.836 -12.474 346 HA ARG 46 HA ARG 46 0.357 -21.820 -14.658 347 HB2 ARG 46 1HB ARG 46 1.598 -19.058 -14.901 348 HB3 ARG 46 2HB ARG 46 1.630 -20.277 -16.166 349 HG2 ARG 46 1HG ARG 46 -0.921 -19.151 -14.991 350 HG3 ARG 46 2HG ARG 46 -0.116 -18.521 -16.448 351 HD2 ARG 46 1HD ARG 46 -0.330 -20.714 -17.494 352 HD3 ARG 46 2HD ARG 46 -1.176 -21.308 -16.046 353 HE ARG 46 HE ARG 46 -2.216 -19.518 -18.110 354 HH11 ARG 46 1HH1 ARG 46 -2.640 -20.900 -14.909 355 HH12 ARG 46 2HH1 ARG 46 -4.360 -20.582 -14.862 356 HH21 ARG 46 1HH2 ARG 46 -4.448 -19.110 -18.038 357 HH22 ARG 46 2HH2 ARG 46 -5.384 -19.569 -16.633 358 H LEU 47 H LEU 47 1.854 -23.332 -14.763 359 HA LEU 47 HA LEU 47 4.444 -22.854 -13.383 360 HB2 LEU 47 1HB LEU 47 3.234 -24.840 -12.672 361 HB3 LEU 47 2HB LEU 47 3.084 -25.396 -14.342 362 HG LEU 47 HG LEU 47 5.572 -25.660 -14.430 363 HD11 LEU 47 1HD1 LEU 47 6.821 -25.600 -12.318 364 HD12 LEU 47 2HD1 LEU 47 6.145 -24.006 -12.726 365 HD13 LEU 47 3HD1 LEU 47 5.370 -25.008 -11.476 366 HD21 LEU 47 1HD2 LEU 47 5.602 -27.683 -13.010 367 HD22 LEU 47 2HD2 LEU 47 4.133 -27.120 -12.177 368 HD23 LEU 47 3HD2 LEU 47 4.068 -27.550 -13.903 369 H VAL 48 H VAL 48 6.214 -22.435 -14.484 370 HA VAL 48 HA VAL 48 6.140 -22.641 -17.421 371 HB VAL 48 HB VAL 48 8.256 -21.519 -15.535 372 HG11 VAL 48 1HG1 VAL 48 9.214 -20.485 -17.535 373 HG12 VAL 48 2HG1 VAL 48 9.243 -22.262 -17.625 374 HG13 VAL 48 3HG1 VAL 48 8.028 -21.344 -18.546 375 HG21 VAL 48 1HG2 VAL 48 7.396 -19.330 -16.304 376 HG22 VAL 48 2HG2 VAL 48 6.154 -20.159 -17.271 377 HG23 VAL 48 3HG2 VAL 48 6.123 -20.273 -15.495 378 H TYR 49 H TYR 49 7.325 -23.986 -18.664 379 HA TYR 49 HA TYR 49 9.154 -25.888 -17.293 380 HB2 TYR 49 1HB TYR 49 8.074 -27.814 -18.297 381 HB3 TYR 49 2HB TYR 49 6.882 -26.919 -17.365 382 HD1 TYR 49 HD1 TYR 49 7.926 -27.998 -20.690 383 HD2 TYR 49 HD2 TYR 49 5.128 -25.607 -18.484 384 HE1 TYR 49 HE1 TYR 49 6.458 -27.883 -22.675 385 HE2 TYR 49 HE2 TYR 49 3.660 -25.492 -20.469 386 HH TYR 49 HH TYR 49 3.343 -26.151 -22.563 387 H ALA 50 H ALA 50 10.436 -27.194 -18.790 388 HA ALA 50 HA ALA 50 11.239 -25.519 -21.087 389 HB1 ALA 50 1HB ALA 50 13.230 -26.985 -21.159 390 HB2 ALA 50 2HB ALA 50 12.990 -26.277 -19.544 391 HB3 ALA 50 3HB ALA 50 12.541 -27.971 -19.848 392 H ARG 51 H ARG 51 11.025 -26.032 -23.167 393 HA ARG 51 HA ARG 51 9.227 -28.213 -23.849 394 HB2 ARG 51 1HB ARG 51 10.770 -26.218 -25.536 395 HB3 ARG 51 2HB ARG 51 9.691 -27.428 -26.213 396 HG2 ARG 51 1HG ARG 51 7.797 -26.449 -25.013 397 HG3 ARG 51 2HG ARG 51 8.882 -25.244 -24.277 398 HD2 ARG 51 1HD ARG 51 9.437 -24.399 -26.484 399 HD3 ARG 51 2HD ARG 51 8.350 -25.601 -27.217 400 HE ARG 51 HE ARG 51 6.838 -24.189 -25.343 401 HH11 ARG 51 1HH1 ARG 51 8.604 -23.513 -28.304 402 HH12 ARG 51 2HH1 ARG 51 7.565 -22.184 -28.769 403 HH21 ARG 51 1HH2 ARG 51 5.497 -22.462 -25.957 404 HH22 ARG 51 2HH2 ARG 51 5.806 -21.588 -27.440 405 H GLU 52 H GLU 52 12.666 -27.749 -23.717 406 HA GLU 52 HA GLU 52 13.386 -29.747 -25.663 407 HB2 GLU 52 1HB GLU 52 14.916 -28.515 -23.340 408 HB3 GLU 52 2HB GLU 52 15.633 -29.646 -24.479 409 HG2 GLU 52 1HG GLU 52 15.199 -28.101 -26.324 410 HG3 GLU 52 2HG GLU 52 14.413 -26.977 -25.218 411 H THR 53 H THR 53 12.745 -29.804 -22.189 412 HA THR 53 HA THR 53 13.346 -32.727 -22.184 413 HB THR 53 HB THR 53 13.510 -32.537 -19.731 414 HG1 THR 53 HG1 THR 53 13.548 -30.198 -18.999 415 HG21 THR 53 1HG2 THR 53 15.532 -31.134 -19.611 416 HG22 THR 53 2HG2 THR 53 15.534 -32.127 -21.088 417 HG23 THR 53 3HG2 THR 53 15.120 -30.399 -21.177 418 H GLY 54 H GLY 54 10.859 -30.326 -21.752 419 HA2 GLY 54 1HA GLY 54 8.534 -30.676 -21.688 420 HA3 GLY 54 2HA GLY 54 8.799 -32.407 -21.588 421 H LYS 55 H LYS 55 10.750 -30.716 -19.380 422 HA LYS 55 HA LYS 55 8.875 -31.472 -17.181 423 HB2 LYS 55 1HB LYS 55 11.916 -31.315 -17.211 424 HB3 LYS 55 2HB LYS 55 10.952 -31.633 -15.776 425 HG2 LYS 55 1HG LYS 55 10.079 -33.696 -16.813 426 HG3 LYS 55 2HG LYS 55 11.054 -33.376 -18.255 427 HD2 LYS 55 1HD LYS 55 13.112 -33.453 -16.868 428 HD3 LYS 55 2HD LYS 55 12.126 -33.807 -15.441 429 HE2 LYS 55 1HE LYS 55 11.333 -35.889 -16.476 430 HE3 LYS 55 2HE LYS 55 12.243 -35.529 -17.946 431 HZ1 LYS 55 1HZ LYS 55 13.414 -37.054 -16.535 432 HZ2 LYS 55 2HZ LYS 55 14.262 -35.644 -16.655 433 HZ3 LYS 55 3HZ LYS 55 13.413 -35.982 -15.282 434 HA PRO 56 HA PRO 56 8.428 -27.357 -15.868 435 HB2 PRO 56 1HB PRO 56 8.889 -28.523 -13.097 436 HB3 PRO 56 2HB PRO 56 7.598 -27.449 -13.649 437 HG2 PRO 56 1HG PRO 56 7.043 -30.034 -13.350 438 HG3 PRO 56 2HG PRO 56 6.437 -29.194 -14.781 439 HD2 PRO 56 1HD PRO 56 8.857 -31.020 -14.511 440 HD3 PRO 56 2HD PRO 56 7.620 -30.954 -15.830 441 H LYS 57 H LYS 57 9.753 -25.630 -15.387 442 HA LYS 57 HA LYS 57 12.601 -26.135 -15.032 443 HB2 LYS 57 1HB LYS 57 10.970 -23.569 -15.127 444 HB3 LYS 57 2HB LYS 57 12.721 -23.607 -14.972 445 HG2 LYS 57 1HG LYS 57 12.856 -24.821 -17.146 446 HG3 LYS 57 2HG LYS 57 11.101 -24.664 -17.305 447 HD2 LYS 57 1HD LYS 57 11.321 -22.193 -17.193 448 HD3 LYS 57 2HD LYS 57 13.078 -22.366 -17.071 449 HE2 LYS 57 1HE LYS 57 13.109 -23.506 -19.275 450 HE3 LYS 57 2HE LYS 57 11.360 -23.302 -19.399 451 HZ1 LYS 57 1HZ LYS 57 12.533 -21.598 -20.585 452 HZ2 LYS 57 2HZ LYS 57 11.690 -20.927 -19.336 453 HZ3 LYS 57 3HZ LYS 57 13.325 -21.117 -19.221 454 H GLY 58 H GLY 58 9.944 -25.797 -12.942 455 HA2 GLY 58 1HA GLY 58 10.157 -26.260 -10.596 456 HA3 GLY 58 2HA GLY 58 11.809 -25.671 -10.632 457 H TYR 59 H TYR 59 9.916 -23.590 -12.449 458 HA TYR 59 HA TYR 59 9.287 -21.857 -10.110 459 HB2 TYR 59 1HB TYR 59 10.778 -20.940 -12.603 460 HB3 TYR 59 2HB TYR 59 10.256 -19.909 -11.278 461 HD1 TYR 59 HD1 TYR 59 12.747 -22.281 -12.449 462 HD2 TYR 59 HD2 TYR 59 11.308 -20.110 -9.039 463 HE1 TYR 59 HE1 TYR 59 14.885 -22.697 -11.281 464 HE2 TYR 59 HE2 TYR 59 13.447 -20.526 -7.872 465 HH TYR 59 HH TYR 59 16.058 -22.380 -9.421 466 H GLY 60 H GLY 60 7.703 -20.268 -10.451 467 HA2 GLY 60 1HA GLY 60 6.417 -19.972 -13.046 468 HA3 GLY 60 2HA GLY 60 5.451 -20.930 -11.940 469 H PHE 61 H PHE 61 3.873 -19.197 -12.098 470 HA PHE 61 HA PHE 61 4.302 -17.236 -9.945 471 HB2 PHE 61 1HB PHE 61 3.584 -15.317 -11.308 472 HB3 PHE 61 2HB PHE 61 5.080 -16.000 -11.923 473 HD1 PHE 61 HD1 PHE 61 1.587 -15.312 -12.609 474 HD2 PHE 61 HD2 PHE 61 5.070 -17.360 -13.998 475 HE1 PHE 61 HE1 PHE 61 0.565 -15.529 -14.849 476 HE2 PHE 61 HE2 PHE 61 4.051 -17.577 -16.240 477 HZ PHE 61 HZ PHE 61 1.797 -16.661 -16.665 478 H CYS 62 H CYS 62 2.357 -16.277 -9.168 479 HA CYS 62 HA CYS 62 -0.106 -17.719 -10.016 480 HB2 CYS 62 1HB CYS 62 0.936 -18.970 -8.126 481 HB3 CYS 62 2HB CYS 62 0.879 -17.513 -7.144 482 HG CYS 62 HG CYS 62 -1.719 -17.231 -7.282 483 H GLU 63 H GLU 63 -1.870 -16.486 -10.070 484 HA GLU 63 HA GLU 63 -1.713 -13.774 -8.866 485 HB2 GLU 63 1HB GLU 63 -2.362 -13.944 -11.255 486 HB3 GLU 63 2HB GLU 63 -3.726 -14.964 -10.819 487 HG2 GLU 63 1HG GLU 63 -4.709 -13.117 -9.532 488 HG3 GLU 63 2HG GLU 63 -3.336 -12.093 -9.945 489 H TYR 64 H TYR 64 -2.716 -13.272 -7.061 490 HA TYR 64 HA TYR 64 -4.750 -15.196 -6.026 491 HB2 TYR 64 1HB TYR 64 -2.886 -13.260 -4.604 492 HB3 TYR 64 2HB TYR 64 -4.226 -14.061 -3.795 493 HD1 TYR 64 HD1 TYR 64 -1.003 -14.605 -5.533 494 HD2 TYR 64 HD2 TYR 64 -4.104 -16.341 -3.129 495 HE1 TYR 64 HE1 TYR 64 0.429 -16.573 -5.106 496 HE2 TYR 64 HE2 TYR 64 -2.671 -18.309 -2.702 497 HH TYR 64 HH TYR 64 0.558 -18.585 -4.163 498 H GLN 65 H GLN 65 -6.444 -14.228 -4.613 499 HA GLN 65 HA GLN 65 -7.981 -12.495 -6.278 500 HB2 GLN 65 1HB GLN 65 -8.946 -14.177 -4.704 501 HB3 GLN 65 2HB GLN 65 -8.420 -13.193 -3.346 502 HG2 GLN 65 1HG GLN 65 -10.758 -12.833 -3.745 503 HG3 GLN 65 2HG GLN 65 -9.860 -11.345 -4.158 504 HE21 GLN 65 1HE2 GLN 65 -11.380 -11.148 -7.257 505 HE22 GLN 65 2HE2 GLN 65 -10.780 -10.369 -5.830 506 H ASP 66 H ASP 66 -6.118 -11.910 -3.313 507 HA ASP 66 HA ASP 66 -5.976 -9.065 -4.071 508 HB2 ASP 66 1HB ASP 66 -6.638 -8.261 -1.847 509 HB3 ASP 66 2HB ASP 66 -7.958 -9.140 -2.606 510 H GLN 67 H GLN 67 -4.605 -7.893 -2.251 511 HA GLN 67 HA GLN 67 -2.041 -9.219 -2.498 512 HB2 GLN 67 1HB GLN 67 -1.100 -7.196 -1.633 513 HB3 GLN 67 2HB GLN 67 -2.431 -6.720 -2.678 514 HG2 GLN 67 1HG GLN 67 -3.019 -7.072 0.222 515 HG3 GLN 67 2HG GLN 67 -2.060 -5.655 -0.288 516 HE21 GLN 67 1HE2 GLN 67 -5.102 -3.987 -0.689 517 HE22 GLN 67 2HE2 GLN 67 -3.620 -4.131 0.197 518 H GLU 68 H GLU 68 -4.485 -9.085 -0.068 519 HA GLU 68 HA GLU 68 -2.777 -9.719 2.180 520 HB2 GLU 68 1HB GLU 68 -5.031 -8.735 2.462 521 HB3 GLU 68 2HB GLU 68 -5.760 -10.174 1.764 522 HG2 GLU 68 1HG GLU 68 -5.979 -10.230 4.156 523 HG3 GLU 68 2HG GLU 68 -4.899 -11.522 3.634 524 H THR 69 H THR 69 -4.766 -11.646 -0.066 525 HA THR 69 HA THR 69 -3.984 -14.174 1.111 526 HB THR 69 HB THR 69 -4.918 -15.149 -1.017 527 HG1 THR 69 HG1 THR 69 -5.424 -12.405 -1.640 528 HG21 THR 69 1HG2 THR 69 -7.237 -14.426 -0.606 529 HG22 THR 69 2HG2 THR 69 -6.373 -14.693 0.927 530 HG23 THR 69 3HG2 THR 69 -6.643 -13.038 0.334 531 H ALA 70 H ALA 70 -2.698 -12.079 -1.406 532 HA ALA 70 HA ALA 70 -0.757 -13.922 -2.419 533 HB1 ALA 70 1HB ALA 70 0.401 -11.902 -3.253 534 HB2 ALA 70 2HB ALA 70 -1.344 -11.852 -3.600 535 HB3 ALA 70 3HB ALA 70 -0.674 -10.887 -2.264 536 H LEU 71 H LEU 71 -0.594 -11.456 0.155 537 HA LEU 71 HA LEU 71 2.144 -12.074 0.835 538 HB2 LEU 71 1HB LEU 71 -0.069 -10.614 2.310 539 HB3 LEU 71 2HB LEU 71 1.571 -10.780 2.945 540 HG LEU 71 HG LEU 71 0.865 -9.404 0.329 541 HD11 LEU 71 1HD1 LEU 71 1.311 -7.328 1.561 542 HD12 LEU 71 2HD1 LEU 71 -0.066 -8.219 2.251 543 HD13 LEU 71 3HD1 LEU 71 1.519 -8.263 3.061 544 HD21 LEU 71 1HD2 LEU 71 3.194 -8.591 0.483 545 HD22 LEU 71 2HD2 LEU 71 3.429 -9.543 1.968 546 HD23 LEU 71 3HD2 LEU 71 3.140 -10.369 0.418 547 H SER 72 H SER 72 -1.020 -13.171 1.971 548 HA SER 72 HA SER 72 -0.164 -14.647 4.233 549 HB2 SER 72 1HB SER 72 -2.420 -15.154 2.269 550 HB3 SER 72 2HB SER 72 -2.209 -16.047 3.766 551 HG SER 72 HG SER 72 -2.916 -13.409 3.328 552 H ALA 73 H ALA 73 -0.427 -15.615 0.804 553 HA ALA 73 HA ALA 73 0.607 -18.239 1.113 554 HB1 ALA 73 1HB ALA 73 1.213 -18.064 -1.279 555 HB2 ALA 73 2HB ALA 73 -0.429 -17.452 -0.968 556 HB3 ALA 73 3HB ALA 73 0.913 -16.312 -1.219 557 H MET 74 H MET 74 2.278 -15.142 0.530 558 HA MET 74 HA MET 74 4.908 -16.211 0.401 559 HB2 MET 74 1HB MET 74 4.365 -13.915 -0.287 560 HB3 MET 74 2HB MET 74 3.942 -13.490 1.365 561 HG2 MET 74 1HG MET 74 6.704 -14.510 0.746 562 HG3 MET 74 2HG MET 74 6.272 -12.835 0.395 563 HE1 MET 74 1HE MET 74 5.491 -11.333 3.876 564 HE2 MET 74 2HE MET 74 5.805 -11.004 2.154 565 HE3 MET 74 3HE MET 74 4.355 -11.918 2.636 566 H ARG 75 H ARG 75 2.882 -15.304 3.151 567 HA ARG 75 HA ARG 75 5.127 -15.465 5.019 568 HB2 ARG 75 1HB ARG 75 2.145 -15.063 5.397 569 HB3 ARG 75 2HB ARG 75 3.280 -15.146 6.735 570 HG2 ARG 75 1HG ARG 75 4.443 -13.167 5.928 571 HG3 ARG 75 2HG ARG 75 3.381 -13.104 4.500 572 HD2 ARG 75 1HD ARG 75 2.420 -12.952 7.345 573 HD3 ARG 75 2HD ARG 75 2.762 -11.544 6.313 574 HE ARG 75 HE ARG 75 0.976 -13.351 5.005 575 HH11 ARG 75 1HH1 ARG 75 1.115 -10.938 7.554 576 HH12 ARG 75 2HH1 ARG 75 -0.573 -10.503 7.406 577 HH21 ARG 75 1HH2 ARG 75 -1.213 -12.778 4.823 578 HH22 ARG 75 2HH2 ARG 75 -1.892 -11.544 5.861 579 H ASN 76 H ASN 76 2.574 -17.553 3.850 580 HA ASN 76 HA ASN 76 2.952 -19.388 6.159 581 HB2 ASN 76 1HB ASN 76 0.813 -19.191 4.019 582 HB3 ASN 76 2HB ASN 76 0.916 -20.533 5.151 583 HD21 ASN 76 1HD2 ASN 76 -1.411 -17.884 6.403 584 HD22 ASN 76 2HD2 ASN 76 -1.261 -18.745 4.908 585 H LEU 77 H LEU 77 2.976 -19.393 2.587 586 HA LEU 77 HA LEU 77 3.470 -22.278 2.582 587 HB2 LEU 77 1HB LEU 77 3.289 -20.238 0.336 588 HB3 LEU 77 2HB LEU 77 3.473 -21.978 0.096 589 HG LEU 77 HG LEU 77 1.100 -20.651 1.453 590 HD11 LEU 77 1HD1 LEU 77 -0.097 -21.219 -0.614 591 HD12 LEU 77 2HD1 LEU 77 1.240 -20.086 -0.919 592 HD13 LEU 77 3HD1 LEU 77 1.421 -21.808 -1.331 593 HD21 LEU 77 1HD2 LEU 77 0.097 -22.900 1.240 594 HD22 LEU 77 2HD2 LEU 77 1.618 -23.514 0.549 595 HD23 LEU 77 3HD2 LEU 77 1.572 -22.948 2.236 596 H ASN 78 H ASN 78 5.331 -19.360 2.410 597 HA ASN 78 HA ASN 78 7.594 -20.446 0.991 598 HB2 ASN 78 1HB ASN 78 7.111 -18.012 1.213 599 HB3 ASN 78 2HB ASN 78 7.484 -18.111 2.928 600 HD21 ASN 78 1HD2 ASN 78 10.400 -17.235 0.516 601 HD22 ASN 78 2HD2 ASN 78 8.712 -16.903 0.321 602 H GLY 79 H GLY 79 8.691 -22.129 1.654 603 HA2 GLY 79 1HA GLY 79 10.416 -22.983 3.137 604 HA3 GLY 79 2HA GLY 79 9.650 -22.155 4.481 605 H ARG 80 H ARG 80 7.061 -23.259 2.902 606 HA ARG 80 HA ARG 80 6.713 -25.536 4.684 607 HB2 ARG 80 1HB ARG 80 4.836 -24.042 4.122 608 HB3 ARG 80 2HB ARG 80 4.969 -24.487 2.427 609 HG2 ARG 80 1HG ARG 80 4.353 -26.797 2.963 610 HG3 ARG 80 2HG ARG 80 4.246 -26.369 4.688 611 HD2 ARG 80 1HD ARG 80 2.463 -24.841 4.245 612 HD3 ARG 80 2HD ARG 80 2.624 -25.104 2.493 613 HE ARG 80 HE ARG 80 2.189 -27.594 3.766 614 HH11 ARG 80 1HH1 ARG 80 0.508 -24.598 3.032 615 HH12 ARG 80 2HH1 ARG 80 -1.070 -25.352 2.971 616 HH21 ARG 80 1HH2 ARG 80 0.136 -28.561 3.684 617 HH22 ARG 80 2HH2 ARG 80 -1.282 -27.595 3.339 618 H GLU 81 H GLU 81 7.350 -27.532 4.317 619 HA GLU 81 HA GLU 81 8.582 -28.443 1.960 620 HB2 GLU 81 1HB GLU 81 8.746 -29.567 4.175 621 HB3 GLU 81 2HB GLU 81 7.074 -30.090 4.032 622 HG2 GLU 81 1HG GLU 81 7.653 -31.420 2.046 623 HG3 GLU 81 2HG GLU 81 9.328 -30.889 2.178 624 H PHE 82 H PHE 82 7.859 -28.812 0.003 625 HA PHE 82 HA PHE 82 5.019 -29.702 -0.293 626 HB2 PHE 82 1HB PHE 82 5.401 -27.405 -1.170 627 HB3 PHE 82 2HB PHE 82 6.664 -28.020 -2.225 628 HD1 PHE 82 HD1 PHE 82 3.111 -28.883 -1.394 629 HD2 PHE 82 HD2 PHE 82 6.075 -28.315 -4.417 630 HE1 PHE 82 HE1 PHE 82 1.423 -29.358 -3.136 631 HE2 PHE 82 HE2 PHE 82 4.389 -28.787 -6.162 632 HZ PHE 82 HZ PHE 82 2.062 -29.310 -5.520 633 H SER 83 H SER 83 5.136 -31.837 -0.564 634 HA SER 83 HA SER 83 5.767 -33.891 -1.394 635 HB2 SER 83 1HB SER 83 6.484 -32.225 -3.830 636 HB3 SER 83 2HB SER 83 6.317 -33.973 -3.810 637 HG SER 83 HG SER 83 4.454 -32.899 -4.496 638 H GLY 84 H GLY 84 7.728 -32.403 0.129 639 HA2 GLY 84 1HA GLY 84 9.755 -33.526 0.857 640 HA3 GLY 84 2HA GLY 84 10.091 -33.967 -0.807 641 H ARG 85 H ARG 85 9.202 -31.130 -1.602 642 HA ARG 85 HA ARG 85 11.879 -29.918 -1.065 643 HB2 ARG 85 1HB ARG 85 11.483 -30.540 -3.421 644 HB3 ARG 85 2HB ARG 85 10.028 -29.555 -3.448 645 HG2 ARG 85 1HG ARG 85 11.323 -27.531 -3.165 646 HG3 ARG 85 2HG ARG 85 12.817 -28.478 -2.963 647 HD2 ARG 85 1HD ARG 85 11.083 -28.538 -5.419 648 HD3 ARG 85 2HD ARG 85 12.513 -27.500 -5.212 649 HE ARG 85 HE ARG 85 13.331 -30.104 -4.639 650 HH11 ARG 85 1HH1 ARG 85 12.021 -28.338 -7.379 651 HH12 ARG 85 2HH1 ARG 85 12.824 -29.339 -8.568 652 HH21 ARG 85 1HH2 ARG 85 14.367 -31.397 -6.192 653 HH22 ARG 85 2HH2 ARG 85 14.152 -31.070 -7.897 654 H ALA 86 H ALA 86 11.900 -28.199 0.186 655 HA ALA 86 HA ALA 86 9.584 -26.875 1.127 656 HB1 ALA 86 1HB ALA 86 11.147 -25.152 1.967 657 HB2 ALA 86 2HB ALA 86 11.739 -26.797 2.301 658 HB3 ALA 86 3HB ALA 86 12.442 -25.851 0.968 659 H LEU 87 H LEU 87 8.188 -25.645 0.118 660 HA LEU 87 HA LEU 87 8.759 -24.683 -2.557 661 HB2 LEU 87 1HB LEU 87 6.528 -25.541 -1.750 662 HB3 LEU 87 2HB LEU 87 6.366 -24.067 -0.790 663 HG LEU 87 HG LEU 87 6.533 -22.757 -2.959 664 HD11 LEU 87 1HD1 LEU 87 6.085 -23.994 -5.031 665 HD12 LEU 87 2HD1 LEU 87 7.626 -24.486 -4.292 666 HD13 LEU 87 3HD1 LEU 87 6.193 -25.529 -4.138 667 HD21 LEU 87 1HD2 LEU 87 4.187 -23.246 -3.567 668 HD22 LEU 87 2HD2 LEU 87 4.268 -24.772 -2.654 669 HD23 LEU 87 3HD2 LEU 87 4.397 -23.215 -1.800 670 H ARG 88 H ARG 88 9.307 -22.718 -3.257 671 HA ARG 88 HA ARG 88 9.634 -20.570 -1.234 672 HB2 ARG 88 1HB ARG 88 11.567 -21.023 -2.660 673 HB3 ARG 88 2HB ARG 88 10.595 -20.798 -4.106 674 HG2 ARG 88 1HG ARG 88 10.226 -18.419 -3.425 675 HG3 ARG 88 2HG ARG 88 11.363 -18.686 -2.082 676 HD2 ARG 88 1HD ARG 88 13.124 -19.201 -3.607 677 HD3 ARG 88 2HD ARG 88 12.004 -19.128 -4.987 678 HE ARG 88 HE ARG 88 12.011 -16.678 -3.489 679 HH11 ARG 88 1HH1 ARG 88 13.804 -18.527 -5.878 680 HH12 ARG 88 2HH1 ARG 88 14.546 -17.115 -6.597 681 HH21 ARG 88 1HH2 ARG 88 12.980 -14.853 -4.431 682 HH22 ARG 88 2HH2 ARG 88 14.080 -15.035 -5.779 683 H VAL 89 H VAL 89 8.139 -19.076 -0.994 684 HA VAL 89 HA VAL 89 6.577 -18.258 -3.403 685 HB VAL 89 HB VAL 89 5.493 -18.565 -0.570 686 HG11 VAL 89 1HG1 VAL 89 3.328 -18.014 -1.567 687 HG12 VAL 89 2HG1 VAL 89 4.496 -16.682 -1.734 688 HG13 VAL 89 3HG1 VAL 89 4.124 -17.721 -3.131 689 HG21 VAL 89 1HG2 VAL 89 4.115 -20.367 -1.556 690 HG22 VAL 89 2HG2 VAL 89 4.943 -20.144 -3.116 691 HG23 VAL 89 3HG2 VAL 89 5.851 -20.731 -1.702 692 H ASP 90 H ASP 90 7.154 -16.258 -3.883 693 HA ASP 90 HA ASP 90 7.283 -14.269 -1.676 694 HB2 ASP 90 1HB ASP 90 9.397 -14.659 -3.832 695 HB3 ASP 90 2HB ASP 90 9.295 -13.238 -2.801 696 H ASN 91 H ASN 91 6.480 -12.299 -2.144 697 HA ASN 91 HA ASN 91 4.651 -12.118 -4.318 698 HB2 ASN 91 1HB ASN 91 4.557 -10.867 -2.113 699 HB3 ASN 91 2HB ASN 91 5.800 -9.795 -2.745 700 HD21 ASN 91 1HD2 ASN 91 2.069 -8.899 -3.463 701 HD22 ASN 91 2HD2 ASN 91 2.695 -9.829 -2.143 702 H ALA 92 H ALA 92 4.755 -11.399 -6.332 703 HA ALA 92 HA ALA 92 7.461 -11.177 -7.395 704 HB1 ALA 92 1HB ALA 92 6.337 -11.230 -9.598 705 HB2 ALA 92 2HB ALA 92 5.782 -12.551 -8.542 706 HB3 ALA 92 3HB ALA 92 4.758 -11.118 -8.786 707 H ALA 93 H ALA 93 5.425 -8.966 -6.058 708 HA ALA 93 HA ALA 93 5.736 -6.728 -7.804 709 HB1 ALA 93 1HB ALA 93 5.284 -5.368 -5.788 710 HB2 ALA 93 2HB ALA 93 4.148 -6.731 -5.933 711 HB3 ALA 93 3HB ALA 93 5.495 -6.814 -4.775 712 H SER 94 H SER 94 7.919 -8.329 -5.615 713 HA SER 94 HA SER 94 9.848 -6.223 -5.376 714 HB2 SER 94 1HB SER 94 9.888 -8.156 -3.903 715 HB3 SER 94 2HB SER 94 10.136 -9.241 -5.263 716 HG SER 94 HG SER 94 11.946 -8.197 -3.856 717 H GLU 95 H GLU 95 11.583 -5.642 -6.576 718 HA GLU 95 HA GLU 95 11.321 -6.041 -9.404 719 HB2 GLU 95 1HB GLU 95 13.562 -4.816 -7.749 720 HB3 GLU 95 2HB GLU 95 13.499 -4.768 -9.505 721 HG2 GLU 95 1HG GLU 95 11.486 -3.536 -7.611 722 HG3 GLU 95 2HG GLU 95 12.727 -2.681 -8.526 723 H LYS 96 H LYS 96 13.347 -7.508 -6.925 724 HA LYS 96 HA LYS 96 15.148 -8.861 -8.688 725 HB2 LYS 96 1HB LYS 96 14.193 -9.496 -5.873 726 HB3 LYS 96 2HB LYS 96 15.418 -10.444 -6.705 727 HG2 LYS 96 1HG LYS 96 16.858 -8.454 -6.877 728 HG3 LYS 96 2HG LYS 96 15.622 -7.488 -6.059 729 HD2 LYS 96 1HD LYS 96 15.797 -8.955 -4.069 730 HD3 LYS 96 2HD LYS 96 17.042 -9.910 -4.888 731 HE2 LYS 96 1HE LYS 96 18.496 -7.926 -5.022 732 HE3 LYS 96 2HE LYS 96 17.250 -6.945 -4.246 733 HZ1 LYS 96 1HZ LYS 96 18.902 -7.668 -2.686 734 HZ2 LYS 96 2HZ LYS 96 17.445 -8.339 -2.302 735 HZ3 LYS 96 3HZ LYS 96 18.610 -9.254 -3.027 736 H ASN 97 H ASN 97 11.981 -9.752 -7.350 737 HA ASN 97 HA ASN 97 11.978 -12.398 -8.504 738 HB2 ASN 97 1HB ASN 97 9.769 -10.595 -7.475 739 HB3 ASN 97 2HB ASN 97 9.470 -12.212 -8.098 740 HD21 ASN 97 1HD2 ASN 97 9.912 -12.244 -4.379 741 HD22 ASN 97 2HD2 ASN 97 8.933 -11.314 -5.462 742 H LYS 98 H LYS 98 10.939 -9.220 -9.633 743 HA LYS 98 HA LYS 98 9.636 -10.091 -12.015 744 HB2 LYS 98 1HB LYS 98 11.143 -7.535 -11.350 745 HB3 LYS 98 2HB LYS 98 10.289 -7.777 -12.867 746 HG2 LYS 98 1HG LYS 98 8.170 -8.054 -11.656 747 HG3 LYS 98 2HG LYS 98 9.019 -7.859 -10.115 748 HD2 LYS 98 1HD LYS 98 9.764 -5.589 -10.854 749 HD3 LYS 98 2HD LYS 98 8.812 -5.789 -12.333 750 HE2 LYS 98 1HE LYS 98 6.755 -6.004 -11.011 751 HE3 LYS 98 2HE LYS 98 7.681 -5.892 -9.512 752 HZ1 LYS 98 1HZ LYS 98 6.699 -3.800 -10.101 753 HZ2 LYS 98 2HZ LYS 98 8.343 -3.677 -10.155 754 HZ3 LYS 98 3HZ LYS 98 7.477 -3.782 -11.555 755 H GLU 99 H GLU 99 13.047 -9.365 -11.315 756 HA GLU 99 HA GLU 99 13.956 -9.741 -14.012 757 HB2 GLU 99 1HB GLU 99 15.395 -9.926 -11.337 758 HB3 GLU 99 2HB GLU 99 16.214 -10.053 -12.888 759 HG2 GLU 99 1HG GLU 99 14.634 -7.662 -11.916 760 HG3 GLU 99 2HG GLU 99 16.389 -7.814 -11.920 761 H GLU 100 H GLU 100 13.520 -11.927 -11.260 762 HA GLU 100 HA GLU 100 14.667 -14.244 -12.474 763 HB2 GLU 100 1HB GLU 100 12.497 -13.887 -10.378 764 HB3 GLU 100 2HB GLU 100 13.062 -15.471 -10.889 765 HG2 GLU 100 1HG GLU 100 15.316 -14.956 -10.130 766 HG3 GLU 100 2HG GLU 100 14.829 -13.315 -9.713 767 H LEU 101 H LEU 101 11.373 -12.895 -12.544 768 HA LEU 101 HA LEU 101 10.214 -14.988 -14.102 769 HB2 LEU 101 1HB LEU 101 9.521 -12.055 -13.767 770 HB3 LEU 101 2HB LEU 101 8.548 -13.161 -14.741 771 HG LEU 101 HG LEU 101 9.101 -13.540 -11.778 772 HD11 LEU 101 1HD1 LEU 101 6.803 -12.739 -11.459 773 HD12 LEU 101 2HD1 LEU 101 7.843 -11.486 -12.177 774 HD13 LEU 101 3HD1 LEU 101 6.688 -12.376 -13.197 775 HD21 LEU 101 1HD2 LEU 101 7.242 -15.158 -11.965 776 HD22 LEU 101 2HD2 LEU 101 7.132 -14.830 -13.711 777 HD23 LEU 101 3HD2 LEU 101 8.588 -15.603 -13.041 778 H LYS 102 H LYS 102 11.964 -12.034 -14.972 779 HA LYS 102 HA LYS 102 11.505 -12.145 -17.780 780 HB2 LYS 102 1HB LYS 102 13.809 -11.037 -16.137 781 HB3 LYS 102 2HB LYS 102 13.725 -10.870 -17.885 782 HG2 LYS 102 1HG LYS 102 11.617 -9.624 -17.686 783 HG3 LYS 102 2HG LYS 102 11.661 -9.819 -15.928 784 HD2 LYS 102 1HD LYS 102 13.845 -8.609 -15.878 785 HD3 LYS 102 2HD LYS 102 13.717 -8.356 -17.625 786 HE2 LYS 102 1HE LYS 102 11.628 -7.093 -17.307 787 HE3 LYS 102 2HE LYS 102 11.704 -7.378 -15.566 788 HZ1 LYS 102 1HZ LYS 102 12.550 -5.225 -16.145 789 HZ2 LYS 102 2HZ LYS 102 13.763 -6.147 -15.513 790 HZ3 LYS 102 3HZ LYS 102 13.691 -5.880 -17.139 791 H SER 103 H SER 103 14.051 -13.604 -15.759 792 HA SER 103 HA SER 103 15.351 -14.862 -18.031 793 HB2 SER 103 1HB SER 103 16.752 -15.927 -16.397 794 HB3 SER 103 2HB SER 103 16.506 -14.262 -15.895 795 HG SER 103 HG SER 103 14.574 -15.400 -14.791 796 H LEU 104 H LEU 104 12.760 -15.687 -15.841 797 HA LEU 104 HA LEU 104 12.765 -18.522 -16.386 798 HB2 LEU 104 1HB LEU 104 11.677 -17.546 -14.402 799 HB3 LEU 104 2HB LEU 104 10.534 -16.686 -15.438 800 HG LEU 104 HG LEU 104 9.581 -18.835 -16.185 801 HD11 LEU 104 1HD1 LEU 104 10.277 -20.920 -15.093 802 HD12 LEU 104 2HD1 LEU 104 11.607 -20.187 -16.019 803 HD13 LEU 104 3HD1 LEU 104 11.573 -20.044 -14.245 804 HD21 LEU 104 1HD2 LEU 104 8.547 -19.448 -14.025 805 HD22 LEU 104 2HD2 LEU 104 9.819 -18.551 -13.161 806 HD23 LEU 104 3HD2 LEU 104 8.665 -17.680 -14.199 807 H GLY 105 H GLY 105 10.989 -15.739 -17.732 808 HA2 GLY 105 1HA GLY 105 10.594 -15.873 -20.215 809 HA3 GLY 105 2HA GLY 105 10.081 -17.531 -19.960 810 H THR 106 H THR 106 9.322 -14.903 -17.729 811 HA THR 106 HA THR 106 6.456 -15.146 -18.544 812 HB THR 106 HB THR 106 7.637 -14.508 -15.806 813 HG1 THR 106 HG1 THR 106 6.566 -16.786 -17.040 814 HG21 THR 106 1HG2 THR 106 5.296 -14.502 -15.038 815 HG22 THR 106 2HG2 THR 106 5.573 -13.222 -16.243 816 HG23 THR 106 3HG2 THR 106 4.741 -14.723 -16.713 817 H GLY 107 H GLY 107 5.404 -13.408 -19.207 818 HA2 GLY 107 1HA GLY 107 6.614 -10.727 -18.620 819 HA3 GLY 107 2HA GLY 107 5.947 -11.121 -20.193 Start of MODEL 4 1 H MET 1 1H MET 1 3.702 9.582 5.960 2 HA MET 1 HA MET 1 2.269 8.316 7.357 3 HB2 MET 1 1HB MET 1 1.161 10.898 6.195 4 HB3 MET 1 2HB MET 1 0.505 10.124 7.630 5 HG2 MET 1 1HG MET 1 2.630 10.407 8.798 6 HG3 MET 1 2HG MET 1 3.365 11.091 7.346 7 HE1 MET 1 1HE MET 1 0.124 13.130 9.934 8 HE2 MET 1 2HE MET 1 -0.197 11.629 9.031 9 HE3 MET 1 3HE MET 1 0.983 11.632 10.365 10 H ALA 2 H ALA 2 -0.233 9.856 5.489 11 HA ALA 2 HA ALA 2 -1.857 7.494 5.570 12 HB1 ALA 2 1HB ALA 2 -3.430 8.800 4.178 13 HB2 ALA 2 2HB ALA 2 -2.826 9.749 5.558 14 HB3 ALA 2 3HB ALA 2 -2.172 10.033 3.928 15 H GLY 3 H GLY 3 0.162 8.971 3.068 16 HA2 GLY 3 1HA GLY 3 1.207 7.746 1.315 17 HA3 GLY 3 2HA GLY 3 0.089 6.420 1.570 18 H LEU 4 H LEU 4 0.288 6.821 -0.934 19 HA LEU 4 HA LEU 4 -1.847 8.746 -1.746 20 HB2 LEU 4 1HB LEU 4 0.365 7.506 -3.422 21 HB3 LEU 4 2HB LEU 4 -0.843 8.662 -3.992 22 HG LEU 4 HG LEU 4 1.301 9.235 -1.914 23 HD11 LEU 4 1HD1 LEU 4 2.297 10.606 -3.690 24 HD12 LEU 4 2HD1 LEU 4 2.216 8.890 -4.152 25 HD13 LEU 4 3HD1 LEU 4 1.044 10.049 -4.823 26 HD21 LEU 4 1HD2 LEU 4 0.539 11.572 -2.180 27 HD22 LEU 4 2HD2 LEU 4 -0.740 11.028 -3.294 28 HD23 LEU 4 3HD2 LEU 4 -0.778 10.533 -1.585 29 H THR 5 H THR 5 -3.415 8.110 -3.251 30 HA THR 5 HA THR 5 -4.081 5.246 -3.072 31 HB THR 5 HB THR 5 -5.620 7.592 -4.266 32 HG1 THR 5 HG1 THR 5 -6.259 6.123 -1.926 33 HG21 THR 5 1HG2 THR 5 -7.529 6.035 -4.296 34 HG22 THR 5 2HG2 THR 5 -6.210 5.444 -5.335 35 HG23 THR 5 3HG2 THR 5 -6.472 4.721 -3.731 36 H VAL 6 H VAL 6 -3.614 3.802 -4.549 37 HA VAL 6 HA VAL 6 -3.013 4.775 -7.311 38 HB VAL 6 HB VAL 6 -1.971 2.293 -5.879 39 HG11 VAL 6 1HG1 VAL 6 -0.531 2.018 -7.838 40 HG12 VAL 6 2HG1 VAL 6 -2.257 1.908 -8.259 41 HG13 VAL 6 3HG1 VAL 6 -1.344 3.391 -8.627 42 HG21 VAL 6 1HG2 VAL 6 0.204 3.471 -5.966 43 HG22 VAL 6 2HG2 VAL 6 -0.593 4.886 -6.692 44 HG23 VAL 6 3HG2 VAL 6 -0.992 4.396 -5.028 45 H ARG 7 H ARG 7 -4.472 4.272 -8.779 46 HA ARG 7 HA ARG 7 -6.225 1.911 -8.271 47 HB2 ARG 7 1HB ARG 7 -6.665 4.358 -10.016 48 HB3 ARG 7 2HB ARG 7 -7.770 2.996 -9.906 49 HG2 ARG 7 1HG ARG 7 -8.121 3.467 -7.515 50 HG3 ARG 7 2HG ARG 7 -7.012 4.855 -7.638 51 HD2 ARG 7 1HD ARG 7 -8.471 5.876 -9.285 52 HD3 ARG 7 2HD ARG 7 -9.577 4.487 -9.170 53 HE ARG 7 HE ARG 7 -9.172 5.541 -6.580 54 HH11 ARG 7 1HH1 ARG 7 -10.678 6.404 -9.635 55 HH12 ARG 7 2HH1 ARG 7 -11.896 7.416 -8.892 56 HH21 ARG 7 1HH2 ARG 7 -10.759 6.857 -5.628 57 HH22 ARG 7 2HH2 ARG 7 -11.943 7.673 -6.624 58 H ASP 8 H ASP 8 -3.459 2.480 -9.776 59 HA ASP 8 HA ASP 8 -3.936 1.694 -12.489 60 HB2 ASP 8 1HB ASP 8 -1.839 2.791 -11.657 61 HB3 ASP 8 2HB ASP 8 -1.420 1.304 -10.819 62 HA PRO 9 HA PRO 9 -5.179 -2.467 -11.686 63 HB2 PRO 9 1HB PRO 9 -4.539 -2.574 -14.663 64 HB3 PRO 9 2HB PRO 9 -5.941 -3.229 -13.806 65 HG2 PRO 9 1HG PRO 9 -6.242 -0.948 -15.134 66 HG3 PRO 9 2HG PRO 9 -6.944 -1.086 -13.519 67 HD2 PRO 9 1HD PRO 9 -4.365 0.279 -14.380 68 HD3 PRO 9 2HD PRO 9 -5.612 0.839 -13.195 69 H ALA 10 H ALA 10 -2.326 -1.471 -13.562 70 HA ALA 10 HA ALA 10 -1.015 -4.005 -13.602 71 HB1 ALA 10 1HB ALA 10 1.024 -2.701 -14.111 72 HB2 ALA 10 2HB ALA 10 -0.365 -2.158 -15.082 73 HB3 ALA 10 3HB ALA 10 0.166 -1.205 -13.677 74 H VAL 11 H VAL 11 -0.851 -1.280 -11.318 75 HA VAL 11 HA VAL 11 1.094 -2.525 -9.599 76 HB VAL 11 HB VAL 11 -0.971 -0.347 -9.071 77 HG11 VAL 11 1HG1 VAL 11 0.334 0.189 -7.073 78 HG12 VAL 11 2HG1 VAL 11 -0.377 -1.440 -6.987 79 HG13 VAL 11 3HG1 VAL 11 1.353 -1.242 -7.356 80 HG21 VAL 11 1HG2 VAL 11 0.991 1.147 -9.265 81 HG22 VAL 11 2HG2 VAL 11 2.024 -0.259 -9.619 82 HG23 VAL 11 3HG2 VAL 11 0.742 0.214 -10.760 83 H ASP 12 H ASP 12 -2.465 -2.390 -9.614 84 HA ASP 12 HA ASP 12 -2.932 -3.711 -7.162 85 HB2 ASP 12 1HB ASP 12 -4.680 -2.606 -8.578 86 HB3 ASP 12 2HB ASP 12 -4.567 -3.937 -9.721 87 H ARG 13 H ARG 13 -2.596 -5.093 -10.445 88 HA ARG 13 HA ARG 13 -2.859 -7.814 -9.613 89 HB2 ARG 13 1HB ARG 13 -3.088 -7.038 -11.962 90 HB3 ARG 13 2HB ARG 13 -1.368 -6.686 -12.008 91 HG2 ARG 13 1HG ARG 13 -0.806 -9.011 -11.806 92 HG3 ARG 13 2HG ARG 13 -2.506 -9.444 -11.501 93 HD2 ARG 13 1HD ARG 13 -3.085 -8.613 -13.729 94 HD3 ARG 13 2HD ARG 13 -1.365 -8.275 -14.027 95 HE ARG 13 HE ARG 13 -2.666 -10.905 -13.876 96 HH11 ARG 13 1HH1 ARG 13 0.297 -9.041 -14.172 97 HH12 ARG 13 2HH1 ARG 13 1.226 -10.383 -14.802 98 HH21 ARG 13 1HH2 ARG 13 -1.450 -12.639 -14.695 99 HH22 ARG 13 2HH2 ARG 13 0.238 -12.420 -15.099 100 H SER 14 H SER 14 -0.020 -5.712 -10.085 101 HA SER 14 HA SER 14 2.007 -7.602 -9.623 102 HB2 SER 14 1HB SER 14 1.860 -4.677 -8.824 103 HB3 SER 14 2HB SER 14 3.326 -5.643 -8.764 104 HG SER 14 HG SER 14 1.757 -4.954 -10.984 105 H LEU 15 H LEU 15 0.156 -5.668 -7.262 106 HA LEU 15 HA LEU 15 1.523 -6.655 -4.954 107 HB2 LEU 15 1HB LEU 15 -1.268 -5.519 -5.325 108 HB3 LEU 15 2HB LEU 15 -0.572 -5.902 -3.748 109 HG LEU 15 HG LEU 15 0.589 -3.883 -5.700 110 HD11 LEU 15 1HD1 LEU 15 -0.317 -2.204 -4.154 111 HD12 LEU 15 2HD1 LEU 15 -1.606 -3.189 -4.885 112 HD13 LEU 15 3HD1 LEU 15 -1.094 -3.495 -3.208 113 HD21 LEU 15 1HD2 LEU 15 1.940 -3.223 -3.738 114 HD22 LEU 15 2HD2 LEU 15 1.194 -4.528 -2.784 115 HD23 LEU 15 3HD2 LEU 15 2.233 -4.923 -4.174 116 H ARG 16 H ARG 16 -1.144 -7.900 -6.876 117 HA ARG 16 HA ARG 16 -1.702 -10.004 -4.877 118 HB2 ARG 16 1HB ARG 16 -2.978 -9.324 -7.546 119 HB3 ARG 16 2HB ARG 16 -3.462 -10.690 -6.553 120 HG2 ARG 16 1HG ARG 16 -4.042 -9.115 -4.719 121 HG3 ARG 16 2HG ARG 16 -3.645 -7.762 -5.806 122 HD2 ARG 16 1HD ARG 16 -5.640 -9.891 -6.510 123 HD3 ARG 16 2HD ARG 16 -6.068 -8.405 -5.631 124 HE ARG 16 HE ARG 16 -5.492 -7.123 -7.555 125 HH11 ARG 16 1HH1 ARG 16 -5.389 -10.597 -8.071 126 HH12 ARG 16 2HH1 ARG 16 -5.484 -10.467 -9.813 127 HH21 ARG 16 1HH2 ARG 16 -5.616 -6.968 -9.817 128 HH22 ARG 16 2HH2 ARG 16 -5.613 -8.413 -10.802 129 H SER 17 H SER 17 0.676 -9.590 -6.999 130 HA SER 17 HA SER 17 0.538 -12.249 -8.283 131 HB2 SER 17 1HB SER 17 2.542 -9.978 -8.475 132 HB3 SER 17 2HB SER 17 2.697 -11.501 -9.337 133 HG SER 17 HG SER 17 0.515 -9.728 -9.482 134 H VAL 18 H VAL 18 1.704 -13.984 -7.735 135 HA VAL 18 HA VAL 18 3.697 -13.645 -5.534 136 HB VAL 18 HB VAL 18 1.702 -15.920 -5.909 137 HG11 VAL 18 1HG1 VAL 18 2.618 -16.814 -3.824 138 HG12 VAL 18 2HG1 VAL 18 3.840 -16.752 -5.115 139 HG13 VAL 18 3HG1 VAL 18 3.852 -15.533 -3.818 140 HG21 VAL 18 1HG2 VAL 18 0.801 -15.126 -3.746 141 HG22 VAL 18 2HG2 VAL 18 1.979 -13.793 -3.746 142 HG23 VAL 18 3HG2 VAL 18 0.706 -13.856 -4.988 143 H PHE 19 H PHE 19 5.650 -14.452 -5.912 144 HA PHE 19 HA PHE 19 6.031 -16.163 -8.304 145 HB2 PHE 19 1HB PHE 19 7.486 -14.162 -7.994 146 HB3 PHE 19 2HB PHE 19 8.080 -14.835 -6.484 147 HD1 PHE 19 HD1 PHE 19 8.402 -14.804 -10.065 148 HD2 PHE 19 HD2 PHE 19 9.361 -17.009 -6.534 149 HE1 PHE 19 HE1 PHE 19 10.169 -16.012 -11.302 150 HE2 PHE 19 HE2 PHE 19 11.131 -18.218 -7.767 151 HZ PHE 19 HZ PHE 19 11.533 -17.720 -10.153 152 H VAL 20 H VAL 20 6.274 -18.272 -8.182 153 HA VAL 20 HA VAL 20 6.980 -19.436 -5.519 154 HB VAL 20 HB VAL 20 5.176 -20.618 -7.674 155 HG11 VAL 20 1HG1 VAL 20 4.700 -22.359 -6.022 156 HG12 VAL 20 2HG1 VAL 20 6.419 -22.328 -6.481 157 HG13 VAL 20 3HG1 VAL 20 5.901 -21.642 -4.922 158 HG21 VAL 20 1HG2 VAL 20 3.376 -20.261 -6.015 159 HG22 VAL 20 2HG2 VAL 20 4.541 -19.476 -4.922 160 HG23 VAL 20 3HG2 VAL 20 4.136 -18.721 -6.482 161 H GLY 21 H GLY 21 8.739 -20.649 -5.433 162 HA2 GLY 21 1HA GLY 21 9.754 -21.866 -7.976 163 HA3 GLY 21 2HA GLY 21 10.831 -21.012 -6.887 164 H ASN 22 H ASN 22 11.820 -23.296 -7.145 165 HA ASN 22 HA ASN 22 12.264 -25.403 -6.323 166 HB2 ASN 22 1HB ASN 22 11.007 -24.174 -3.849 167 HB3 ASN 22 2HB ASN 22 11.851 -25.717 -3.867 168 HD21 ASN 22 1HD2 ASN 22 14.282 -23.226 -2.759 169 HD22 ASN 22 2HD2 ASN 22 12.807 -23.930 -2.187 170 H ILE 23 H ILE 23 9.972 -25.250 -7.870 171 HA ILE 23 HA ILE 23 7.899 -26.813 -6.481 172 HB ILE 23 HB ILE 23 8.120 -25.807 -9.349 173 HG12 ILE 23 1HG1 ILE 23 6.291 -24.926 -7.105 174 HG13 ILE 23 2HG1 ILE 23 7.789 -24.113 -7.534 175 HG21 ILE 23 1HG2 ILE 23 5.775 -26.522 -9.579 176 HG22 ILE 23 2HG2 ILE 23 6.837 -27.911 -9.252 177 HG23 ILE 23 3HG2 ILE 23 5.829 -27.237 -7.950 178 HD11 ILE 23 1HD1 ILE 23 5.869 -22.994 -8.522 179 HD12 ILE 23 2HD1 ILE 23 6.919 -23.673 -9.790 180 HD13 ILE 23 3HD1 ILE 23 5.401 -24.494 -9.355 181 HA PRO 24 HA PRO 24 9.798 -30.676 -7.492 182 HB2 PRO 24 1HB PRO 24 6.954 -31.573 -6.923 183 HB3 PRO 24 2HB PRO 24 8.474 -32.237 -6.311 184 HG2 PRO 24 1HG PRO 24 7.025 -30.698 -4.692 185 HG3 PRO 24 2HG PRO 24 8.776 -30.477 -4.739 186 HD2 PRO 24 1HD PRO 24 6.602 -28.850 -6.121 187 HD3 PRO 24 2HD PRO 24 8.068 -28.269 -5.235 188 H TYR 25 H TYR 25 9.911 -31.791 -9.388 189 HA TYR 25 HA TYR 25 8.427 -30.780 -11.638 190 HB2 TYR 25 1HB TYR 25 10.329 -33.137 -11.341 191 HB3 TYR 25 2HB TYR 25 9.634 -32.642 -12.878 192 HD1 TYR 25 HD1 TYR 25 10.068 -29.744 -10.947 193 HD2 TYR 25 HD2 TYR 25 12.260 -32.625 -13.250 194 HE1 TYR 25 HE1 TYR 25 11.897 -28.110 -11.250 195 HE2 TYR 25 HE2 TYR 25 14.089 -30.990 -13.553 196 HH TYR 25 HH TYR 25 13.840 -27.690 -12.265 197 H GLU 26 H GLU 26 8.024 -33.507 -9.498 198 HA GLU 26 HA GLU 26 6.174 -34.904 -11.269 199 HB2 GLU 26 1HB GLU 26 5.904 -36.467 -9.464 200 HB3 GLU 26 2HB GLU 26 7.608 -36.044 -9.534 201 HG2 GLU 26 1HG GLU 26 5.803 -34.536 -7.677 202 HG3 GLU 26 2HG GLU 26 6.325 -36.164 -7.251 203 H ALA 27 H ALA 27 5.962 -32.184 -9.278 204 HA ALA 27 HA ALA 27 3.201 -32.611 -8.426 205 HB1 ALA 27 1HB ALA 27 3.367 -30.296 -7.569 206 HB2 ALA 27 2HB ALA 27 4.737 -31.298 -7.033 207 HB3 ALA 27 3HB ALA 27 4.953 -30.128 -8.355 208 H THR 28 H THR 28 1.361 -31.654 -9.181 209 HA THR 28 HA THR 28 1.586 -30.556 -11.940 210 HB THR 28 HB THR 28 -0.752 -31.165 -12.234 211 HG1 THR 28 HG1 THR 28 -1.573 -32.444 -10.230 212 HG21 THR 28 1HG2 THR 28 -0.622 -33.604 -11.913 213 HG22 THR 28 2HG2 THR 28 0.916 -32.962 -12.537 214 HG23 THR 28 3HG2 THR 28 0.764 -33.391 -10.818 215 H GLU 29 H GLU 29 -0.123 -28.932 -12.535 216 HA GLU 29 HA GLU 29 0.168 -26.614 -10.891 217 HB2 GLU 29 1HB GLU 29 -1.690 -27.259 -13.209 218 HB3 GLU 29 2HB GLU 29 -1.660 -25.685 -12.426 219 HG2 GLU 29 1HG GLU 29 0.681 -25.386 -13.041 220 HG3 GLU 29 2HG GLU 29 0.721 -26.997 -13.753 221 H GLU 30 H GLU 30 -2.380 -29.045 -11.179 222 HA GLU 30 HA GLU 30 -4.343 -27.574 -9.672 223 HB2 GLU 30 1HB GLU 30 -4.040 -30.531 -10.315 224 HB3 GLU 30 2HB GLU 30 -5.411 -29.879 -9.428 225 HG2 GLU 30 1HG GLU 30 -4.604 -29.096 -12.238 226 HG3 GLU 30 2HG GLU 30 -5.890 -30.222 -11.810 227 H GLN 31 H GLN 31 -1.893 -30.001 -8.815 228 HA GLN 31 HA GLN 31 -2.606 -30.209 -6.054 229 HB2 GLN 31 1HB GLN 31 0.024 -30.634 -7.518 230 HB3 GLN 31 2HB GLN 31 -0.171 -30.943 -5.798 231 HG2 GLN 31 1HG GLN 31 -1.844 -32.637 -6.237 232 HG3 GLN 31 2HG GLN 31 -1.785 -32.272 -7.985 233 HE21 GLN 31 1HE2 GLN 31 0.456 -35.189 -6.729 234 HE22 GLN 31 2HE2 GLN 31 -1.089 -34.678 -6.135 235 H LEU 32 H LEU 32 -0.415 -28.024 -7.805 236 HA LEU 32 HA LEU 32 0.471 -26.613 -5.461 237 HB2 LEU 32 1HB LEU 32 0.341 -25.829 -8.391 238 HB3 LEU 32 2HB LEU 32 1.071 -24.816 -7.142 239 HG LEU 32 HG LEU 32 2.014 -27.636 -7.749 240 HD11 LEU 32 1HD1 LEU 32 3.813 -26.573 -9.037 241 HD12 LEU 32 2HD1 LEU 32 2.216 -26.254 -9.752 242 HD13 LEU 32 3HD1 LEU 32 3.038 -24.988 -8.811 243 HD21 LEU 32 1HD2 LEU 32 4.028 -26.851 -6.551 244 HD22 LEU 32 2HD2 LEU 32 3.257 -25.268 -6.290 245 HD23 LEU 32 3HD2 LEU 32 2.582 -26.725 -5.522 246 H LYS 33 H LYS 33 -2.198 -26.133 -7.758 247 HA LYS 33 HA LYS 33 -3.094 -23.632 -6.734 248 HB2 LYS 33 1HB LYS 33 -4.478 -25.888 -8.210 249 HB3 LYS 33 2HB LYS 33 -5.366 -24.466 -7.682 250 HG2 LYS 33 1HG LYS 33 -4.118 -23.025 -9.097 251 HG3 LYS 33 2HG LYS 33 -2.884 -24.257 -9.396 252 HD2 LYS 33 1HD LYS 33 -4.349 -24.083 -11.334 253 HD3 LYS 33 2HD LYS 33 -4.587 -25.654 -10.555 254 HE2 LYS 33 1HE LYS 33 -6.615 -24.846 -9.456 255 HE3 LYS 33 2HE LYS 33 -6.357 -23.224 -10.102 256 HZ1 LYS 33 1HZ LYS 33 -7.949 -24.442 -11.392 257 HZ2 LYS 33 2HZ LYS 33 -6.617 -24.124 -12.311 258 HZ3 LYS 33 3HZ LYS 33 -6.860 -25.639 -11.708 259 H ASP 34 H ASP 34 -3.683 -26.955 -5.698 260 HA ASP 34 HA ASP 34 -5.779 -26.431 -3.853 261 HB2 ASP 34 1HB ASP 34 -3.592 -28.537 -3.915 262 HB3 ASP 34 2HB ASP 34 -4.824 -28.502 -2.661 263 H ILE 35 H ILE 35 -2.237 -26.525 -3.357 264 HA ILE 35 HA ILE 35 -2.479 -25.795 -0.560 265 HB ILE 35 HB ILE 35 -0.021 -25.643 -0.602 266 HG12 ILE 35 1HG1 ILE 35 -0.179 -26.087 -3.589 267 HG13 ILE 35 2HG1 ILE 35 0.068 -24.513 -2.849 268 HG21 ILE 35 1HG2 ILE 35 0.477 -27.932 -1.360 269 HG22 ILE 35 2HG2 ILE 35 -1.057 -27.876 -0.463 270 HG23 ILE 35 3HG2 ILE 35 -1.069 -27.982 -2.238 271 HD11 ILE 35 1HD1 ILE 35 2.178 -25.490 -3.559 272 HD12 ILE 35 2HD1 ILE 35 2.131 -25.323 -1.787 273 HD13 ILE 35 3HD1 ILE 35 1.881 -26.917 -2.538 274 H PHE 36 H PHE 36 -2.529 -24.049 -3.504 275 HA PHE 36 HA PHE 36 -1.820 -21.494 -2.247 276 HB2 PHE 36 1HB PHE 36 -3.108 -22.131 -4.931 277 HB3 PHE 36 2HB PHE 36 -2.622 -20.526 -4.409 278 HD1 PHE 36 HD1 PHE 36 -1.658 -21.871 -6.899 279 HD2 PHE 36 HD2 PHE 36 -0.083 -21.835 -2.927 280 HE1 PHE 36 HE1 PHE 36 0.611 -22.268 -7.797 281 HE2 PHE 36 HE2 PHE 36 2.188 -22.229 -3.822 282 HZ PHE 36 HZ PHE 36 2.534 -22.446 -6.258 283 H SER 37 H SER 37 -4.753 -23.273 -3.160 284 HA SER 37 HA SER 37 -6.518 -21.031 -2.751 285 HB2 SER 37 1HB SER 37 -8.298 -22.610 -3.074 286 HB3 SER 37 2HB SER 37 -7.010 -23.013 -4.199 287 HG SER 37 HG SER 37 -6.291 -24.444 -2.415 288 H GLU 38 H GLU 38 -5.192 -23.515 -0.677 289 HA GLU 38 HA GLU 38 -7.064 -23.173 1.487 290 HB2 GLU 38 1HB GLU 38 -5.543 -24.482 2.789 291 HB3 GLU 38 2HB GLU 38 -5.503 -25.144 1.161 292 HG2 GLU 38 1HG GLU 38 -3.409 -23.930 0.714 293 HG3 GLU 38 2HG GLU 38 -3.450 -23.261 2.344 294 H VAL 39 H VAL 39 -4.438 -21.290 0.299 295 HA VAL 39 HA VAL 39 -4.106 -19.791 2.800 296 HB VAL 39 HB VAL 39 -3.102 -19.274 -0.032 297 HG11 VAL 39 1HG1 VAL 39 -1.613 -17.620 0.984 298 HG12 VAL 39 2HG1 VAL 39 -3.327 -17.185 1.184 299 HG13 VAL 39 3HG1 VAL 39 -2.414 -17.864 2.554 300 HG21 VAL 39 1HG2 VAL 39 -0.933 -20.005 0.909 301 HG22 VAL 39 2HG2 VAL 39 -1.721 -20.324 2.473 302 HG23 VAL 39 3HG2 VAL 39 -2.158 -21.289 1.042 303 H GLY 40 H GLY 40 -5.573 -19.272 -0.415 304 HA2 GLY 40 1HA GLY 40 -7.777 -17.783 0.599 305 HA3 GLY 40 2HA GLY 40 -6.555 -16.637 0.081 306 HA PRO 41 HA PRO 41 -9.354 -18.158 -3.412 307 HB2 PRO 41 1HB PRO 41 -9.648 -15.146 -3.665 308 HB3 PRO 41 2HB PRO 41 -10.863 -16.406 -3.910 309 HG2 PRO 41 1HG PRO 41 -10.924 -15.014 -1.641 310 HG3 PRO 41 2HG PRO 41 -11.171 -16.761 -1.577 311 HD2 PRO 41 1HD PRO 41 -8.652 -15.158 -0.978 312 HD3 PRO 41 2HD PRO 41 -9.357 -16.554 -0.068 313 H VAL 42 H VAL 42 -8.537 -18.387 -5.445 314 HA VAL 42 HA VAL 42 -6.157 -16.710 -6.129 315 HB VAL 42 HB VAL 42 -6.645 -19.656 -6.746 316 HG11 VAL 42 1HG1 VAL 42 -4.373 -19.637 -7.654 317 HG12 VAL 42 2HG1 VAL 42 -5.459 -18.551 -8.552 318 HG13 VAL 42 3HG1 VAL 42 -4.285 -17.879 -7.395 319 HG21 VAL 42 1HG2 VAL 42 -4.725 -20.023 -5.228 320 HG22 VAL 42 2HG2 VAL 42 -4.657 -18.276 -4.896 321 HG23 VAL 42 3HG2 VAL 42 -6.072 -19.225 -4.382 322 H VAL 43 H VAL 43 -6.104 -15.759 -8.065 323 HA VAL 43 HA VAL 43 -8.424 -15.884 -9.796 324 HB VAL 43 HB VAL 43 -5.688 -14.588 -10.139 325 HG11 VAL 43 1HG1 VAL 43 -6.682 -13.336 -11.992 326 HG12 VAL 43 2HG1 VAL 43 -6.634 -15.084 -12.319 327 HG13 VAL 43 3HG1 VAL 43 -8.166 -14.307 -11.851 328 HG21 VAL 43 1HG2 VAL 43 -6.947 -12.511 -9.667 329 HG22 VAL 43 2HG2 VAL 43 -8.435 -13.463 -9.452 330 HG23 VAL 43 3HG2 VAL 43 -7.077 -13.663 -8.318 331 H SER 44 H SER 44 -4.996 -16.857 -10.177 332 HA SER 44 HA SER 44 -5.693 -19.196 -11.708 333 HB2 SER 44 1HB SER 44 -4.893 -18.554 -13.878 334 HB3 SER 44 2HB SER 44 -6.128 -17.400 -13.398 335 HG SER 44 HG SER 44 -4.630 -15.925 -12.974 336 H PHE 45 H PHE 45 -3.731 -20.259 -12.646 337 HA PHE 45 HA PHE 45 -1.156 -19.247 -11.627 338 HB2 PHE 45 1HB PHE 45 -1.834 -20.560 -9.727 339 HB3 PHE 45 2HB PHE 45 -2.384 -21.882 -10.745 340 HD1 PHE 45 HD1 PHE 45 0.688 -19.978 -9.824 341 HD2 PHE 45 HD2 PHE 45 -0.968 -23.660 -11.223 342 HE1 PHE 45 HE1 PHE 45 2.908 -21.048 -9.631 343 HE2 PHE 45 HE2 PHE 45 1.250 -24.734 -11.029 344 HZ PHE 45 HZ PHE 45 3.189 -23.426 -10.234 345 H ARG 46 H ARG 46 0.566 -19.846 -12.833 346 HA ARG 46 HA ARG 46 0.129 -21.983 -14.868 347 HB2 ARG 46 1HB ARG 46 1.435 -19.280 -15.325 348 HB3 ARG 46 2HB ARG 46 1.492 -20.616 -16.464 349 HG2 ARG 46 1HG ARG 46 -1.081 -19.343 -15.509 350 HG3 ARG 46 2HG ARG 46 -0.205 -18.864 -16.983 351 HD2 ARG 46 1HD ARG 46 -0.414 -21.148 -17.822 352 HD3 ARG 46 2HD ARG 46 -1.342 -21.581 -16.368 353 HE ARG 46 HE ARG 46 -2.236 -19.972 -18.642 354 HH11 ARG 46 1HH1 ARG 46 -2.853 -21.062 -15.360 355 HH12 ARG 46 2HH1 ARG 46 -4.566 -20.716 -15.433 356 HH21 ARG 46 1HH2 ARG 46 -4.461 -19.527 -18.725 357 HH22 ARG 46 2HH2 ARG 46 -5.478 -19.847 -17.337 358 H LEU 47 H LEU 47 1.579 -23.536 -14.712 359 HA LEU 47 HA LEU 47 4.135 -23.004 -13.323 360 HB2 LEU 47 1HB LEU 47 2.891 -25.007 -12.686 361 HB3 LEU 47 2HB LEU 47 2.872 -25.566 -14.362 362 HG LEU 47 HG LEU 47 5.373 -25.763 -14.265 363 HD11 LEU 47 1HD1 LEU 47 6.446 -25.709 -12.058 364 HD12 LEU 47 2HD1 LEU 47 5.768 -24.124 -12.499 365 HD13 LEU 47 3HD1 LEU 47 4.919 -25.162 -11.328 366 HD21 LEU 47 1HD2 LEU 47 5.336 -27.807 -12.875 367 HD22 LEU 47 2HD2 LEU 47 3.792 -27.290 -12.156 368 HD23 LEU 47 3HD2 LEU 47 3.876 -27.694 -13.887 369 H VAL 48 H VAL 48 6.038 -22.782 -14.291 370 HA VAL 48 HA VAL 48 5.997 -22.621 -17.229 371 HB VAL 48 HB VAL 48 8.182 -21.911 -15.224 372 HG11 VAL 48 1HG1 VAL 48 9.181 -20.656 -17.072 373 HG12 VAL 48 2HG1 VAL 48 9.092 -22.398 -17.421 374 HG13 VAL 48 3HG1 VAL 48 7.929 -21.279 -18.171 375 HG21 VAL 48 1HG2 VAL 48 7.458 -19.582 -15.645 376 HG22 VAL 48 2HG2 VAL 48 6.152 -20.180 -16.696 377 HG23 VAL 48 3HG2 VAL 48 6.135 -20.553 -14.956 378 H TYR 49 H TYR 49 6.678 -24.170 -18.525 379 HA TYR 49 HA TYR 49 8.381 -26.324 -17.373 380 HB2 TYR 49 1HB TYR 49 6.557 -26.218 -19.801 381 HB3 TYR 49 2HB TYR 49 7.698 -27.530 -19.536 382 HD1 TYR 49 HD1 TYR 49 4.814 -25.751 -17.984 383 HD2 TYR 49 HD2 TYR 49 7.161 -29.338 -18.154 384 HE1 TYR 49 HE1 TYR 49 3.160 -26.901 -16.552 385 HE2 TYR 49 HE2 TYR 49 5.507 -30.488 -16.723 386 HH TYR 49 HH TYR 49 3.621 -30.301 -15.575 387 H ALA 50 H ALA 50 10.250 -27.036 -18.359 388 HA ALA 50 HA ALA 50 11.631 -25.076 -20.028 389 HB1 ALA 50 1HB ALA 50 13.516 -26.675 -19.916 390 HB2 ALA 50 2HB ALA 50 12.859 -26.315 -18.302 391 HB3 ALA 50 3HB ALA 50 12.459 -27.852 -19.103 392 H ARG 51 H ARG 51 11.857 -25.044 -22.153 393 HA ARG 51 HA ARG 51 10.162 -26.790 -23.719 394 HB2 ARG 51 1HB ARG 51 12.172 -24.652 -24.487 395 HB3 ARG 51 2HB ARG 51 11.208 -25.534 -25.662 396 HG2 ARG 51 1HG ARG 51 9.151 -24.655 -24.673 397 HG3 ARG 51 2HG ARG 51 10.105 -23.792 -23.443 398 HD2 ARG 51 1HD ARG 51 11.206 -22.519 -25.194 399 HD3 ARG 51 2HD ARG 51 10.246 -23.378 -26.421 400 HE ARG 51 HE ARG 51 8.431 -22.284 -24.604 401 HH11 ARG 51 1HH1 ARG 51 10.871 -21.135 -26.855 402 HH12 ARG 51 2HH1 ARG 51 10.051 -19.622 -27.167 403 HH21 ARG 51 1HH2 ARG 51 7.376 -20.316 -25.017 404 HH22 ARG 51 2HH2 ARG 51 8.072 -19.157 -26.127 405 H GLU 52 H GLU 52 13.555 -26.711 -22.882 406 HA GLU 52 HA GLU 52 14.317 -28.510 -25.073 407 HB2 GLU 52 1HB GLU 52 15.866 -27.385 -22.706 408 HB3 GLU 52 2HB GLU 52 16.569 -28.440 -23.925 409 HG2 GLU 52 1HG GLU 52 16.075 -26.781 -25.664 410 HG3 GLU 52 2HG GLU 52 15.338 -25.727 -24.459 411 H THR 53 H THR 53 13.439 -28.713 -21.695 412 HA THR 53 HA THR 53 14.427 -31.507 -21.547 413 HB THR 53 HB THR 53 13.258 -29.703 -19.383 414 HG1 THR 53 HG1 THR 53 15.939 -30.609 -19.626 415 HG21 THR 53 1HG2 THR 53 14.079 -31.432 -17.832 416 HG22 THR 53 2HG2 THR 53 12.865 -32.103 -18.947 417 HG23 THR 53 3HG2 THR 53 14.593 -32.432 -19.211 418 H GLY 54 H GLY 54 11.425 -29.634 -21.035 419 HA2 GLY 54 1HA GLY 54 9.265 -30.506 -21.744 420 HA3 GLY 54 2HA GLY 54 9.880 -32.137 -21.550 421 H LYS 55 H LYS 55 11.220 -30.892 -18.964 422 HA LYS 55 HA LYS 55 8.849 -31.387 -17.235 423 HB2 LYS 55 1HB LYS 55 11.809 -31.324 -16.523 424 HB3 LYS 55 2HB LYS 55 10.497 -31.727 -15.424 425 HG2 LYS 55 1HG LYS 55 11.233 -33.301 -17.910 426 HG3 LYS 55 2HG LYS 55 11.689 -33.716 -16.252 427 HD2 LYS 55 1HD LYS 55 9.260 -33.834 -15.656 428 HD3 LYS 55 2HD LYS 55 8.862 -33.533 -17.354 429 HE2 LYS 55 1HE LYS 55 10.130 -35.579 -17.991 430 HE3 LYS 55 2HE LYS 55 10.458 -35.890 -16.284 431 HZ1 LYS 55 1HZ LYS 55 8.583 -37.141 -17.064 432 HZ2 LYS 55 2HZ LYS 55 8.092 -36.059 -15.920 433 HZ3 LYS 55 3HZ LYS 55 7.785 -35.770 -17.514 434 HA PRO 56 HA PRO 56 8.389 -27.342 -15.737 435 HB2 PRO 56 1HB PRO 56 8.937 -28.462 -12.963 436 HB3 PRO 56 2HB PRO 56 7.606 -27.431 -13.502 437 HG2 PRO 56 1HG PRO 56 7.129 -30.026 -13.162 438 HG3 PRO 56 2HG PRO 56 6.472 -29.220 -14.590 439 HD2 PRO 56 1HD PRO 56 8.947 -30.975 -14.347 440 HD3 PRO 56 2HD PRO 56 7.682 -30.960 -15.641 441 H LYS 57 H LYS 57 9.674 -25.570 -15.281 442 HA LYS 57 HA LYS 57 12.532 -25.940 -14.956 443 HB2 LYS 57 1HB LYS 57 10.758 -23.471 -14.866 444 HB3 LYS 57 2HB LYS 57 12.509 -23.412 -14.711 445 HG2 LYS 57 1HG LYS 57 12.694 -24.497 -16.963 446 HG3 LYS 57 2HG LYS 57 10.936 -24.378 -17.113 447 HD2 LYS 57 1HD LYS 57 11.107 -21.907 -16.800 448 HD3 LYS 57 2HD LYS 57 12.869 -22.060 -16.744 449 HE2 LYS 57 1HE LYS 57 12.857 -23.021 -19.024 450 HE3 LYS 57 2HE LYS 57 11.099 -22.867 -19.082 451 HZ1 LYS 57 1HZ LYS 57 12.180 -21.044 -20.175 452 HZ2 LYS 57 2HZ LYS 57 11.358 -20.492 -18.855 453 HZ3 LYS 57 3HZ LYS 57 13.000 -20.636 -18.803 454 H GLY 58 H GLY 58 9.908 -25.895 -12.802 455 HA2 GLY 58 1HA GLY 58 10.177 -26.364 -10.458 456 HA3 GLY 58 2HA GLY 58 11.772 -25.635 -10.498 457 H TYR 59 H TYR 59 9.699 -23.718 -12.298 458 HA TYR 59 HA TYR 59 8.953 -22.049 -9.944 459 HB2 TYR 59 1HB TYR 59 10.233 -20.972 -12.488 460 HB3 TYR 59 2HB TYR 59 9.722 -20.029 -11.095 461 HD1 TYR 59 HD1 TYR 59 12.267 -22.276 -12.455 462 HD2 TYR 59 HD2 TYR 59 10.982 -20.083 -8.999 463 HE1 TYR 59 HE1 TYR 59 14.508 -22.549 -11.449 464 HE2 TYR 59 HE2 TYR 59 13.223 -20.355 -7.993 465 HH TYR 59 HH TYR 59 15.792 -22.145 -9.681 466 H GLY 60 H GLY 60 7.214 -20.625 -10.240 467 HA2 GLY 60 1HA GLY 60 5.732 -20.714 -12.787 468 HA3 GLY 60 2HA GLY 60 4.934 -21.500 -11.438 469 H PHE 61 H PHE 61 3.465 -19.584 -12.310 470 HA PHE 61 HA PHE 61 3.988 -17.251 -10.523 471 HB2 PHE 61 1HB PHE 61 4.529 -16.544 -12.795 472 HB3 PHE 61 2HB PHE 61 3.012 -17.186 -13.404 473 HD1 PHE 61 HD1 PHE 61 4.581 -14.496 -11.457 474 HD2 PHE 61 HD2 PHE 61 0.933 -16.006 -13.088 475 HE1 PHE 61 HE1 PHE 61 3.499 -12.308 -11.060 476 HE2 PHE 61 HE2 PHE 61 -0.152 -13.820 -12.695 477 HZ PHE 61 HZ PHE 61 1.133 -11.971 -11.678 478 H CYS 62 H CYS 62 2.395 -16.822 -9.177 479 HA CYS 62 HA CYS 62 -0.314 -17.897 -9.847 480 HB2 CYS 62 1HB CYS 62 0.766 -19.079 -7.946 481 HB3 CYS 62 2HB CYS 62 0.950 -17.549 -7.100 482 HG CYS 62 HG CYS 62 -1.891 -18.792 -8.168 483 H GLU 63 H GLU 63 -2.044 -16.583 -9.679 484 HA GLU 63 HA GLU 63 -1.561 -13.851 -8.563 485 HB2 GLU 63 1HB GLU 63 -1.905 -13.814 -11.018 486 HB3 GLU 63 2HB GLU 63 -3.431 -14.665 -10.826 487 HG2 GLU 63 1HG GLU 63 -4.369 -12.780 -9.598 488 HG3 GLU 63 2HG GLU 63 -2.826 -11.931 -9.679 489 H TYR 64 H TYR 64 -2.635 -13.411 -6.790 490 HA TYR 64 HA TYR 64 -4.960 -15.102 -6.072 491 HB2 TYR 64 1HB TYR 64 -3.165 -13.214 -4.527 492 HB3 TYR 64 2HB TYR 64 -4.707 -13.739 -3.864 493 HD1 TYR 64 HD1 TYR 64 -1.458 -14.989 -5.186 494 HD2 TYR 64 HD2 TYR 64 -4.935 -15.822 -2.814 495 HE1 TYR 64 HE1 TYR 64 -0.398 -17.063 -4.360 496 HE2 TYR 64 HE2 TYR 64 -3.874 -17.896 -1.987 497 HH TYR 64 HH TYR 64 -2.103 -19.224 -2.092 498 H GLN 65 H GLN 65 -6.854 -14.100 -5.073 499 HA GLN 65 HA GLN 65 -7.744 -11.812 -6.688 500 HB2 GLN 65 1HB GLN 65 -9.182 -13.508 -4.608 501 HB3 GLN 65 2HB GLN 65 -9.937 -12.222 -5.538 502 HG2 GLN 65 1HG GLN 65 -9.510 -13.428 -7.613 503 HG3 GLN 65 2HG GLN 65 -8.686 -14.721 -6.697 504 HE21 GLN 65 1HE2 GLN 65 -11.903 -16.217 -7.120 505 HE22 GLN 65 2HE2 GLN 65 -10.363 -16.014 -7.889 506 H ASP 66 H ASP 66 -6.092 -12.184 -3.819 507 HA ASP 66 HA ASP 66 -6.745 -9.426 -3.013 508 HB2 ASP 66 1HB ASP 66 -8.383 -10.898 -1.789 509 HB3 ASP 66 2HB ASP 66 -7.025 -11.729 -1.042 510 H GLN 67 H GLN 67 -4.958 -8.386 -2.496 511 HA GLN 67 HA GLN 67 -2.440 -9.743 -2.670 512 HB2 GLN 67 1HB GLN 67 -1.441 -7.574 -2.265 513 HB3 GLN 67 2HB GLN 67 -2.818 -7.362 -3.336 514 HG2 GLN 67 1HG GLN 67 -3.237 -7.029 -0.395 515 HG3 GLN 67 2HG GLN 67 -2.403 -5.746 -1.316 516 HE21 GLN 67 1HE2 GLN 67 -5.606 -4.397 -1.784 517 HE22 GLN 67 2HE2 GLN 67 -4.090 -4.269 -0.957 518 H GLU 68 H GLU 68 -4.579 -9.144 -0.041 519 HA GLU 68 HA GLU 68 -2.640 -9.379 2.082 520 HB2 GLU 68 1HB GLU 68 -5.634 -9.916 1.984 521 HB3 GLU 68 2HB GLU 68 -4.679 -10.012 3.456 522 HG2 GLU 68 1HG GLU 68 -5.023 -7.545 1.738 523 HG3 GLU 68 2HG GLU 68 -5.874 -7.885 3.243 524 H THR 69 H THR 69 -4.462 -11.677 0.125 525 HA THR 69 HA THR 69 -3.500 -13.955 1.719 526 HB THR 69 HB THR 69 -4.702 -15.342 0.063 527 HG1 THR 69 HG1 THR 69 -4.663 -12.933 -1.341 528 HG21 THR 69 1HG2 THR 69 -6.975 -14.490 0.481 529 HG22 THR 69 2HG2 THR 69 -5.968 -14.359 1.942 530 HG23 THR 69 3HG2 THR 69 -6.301 -12.915 0.959 531 H ALA 70 H ALA 70 -2.624 -12.202 -1.180 532 HA ALA 70 HA ALA 70 -0.690 -14.081 -2.148 533 HB1 ALA 70 1HB ALA 70 0.297 -12.129 -3.303 534 HB2 ALA 70 2HB ALA 70 -1.470 -12.187 -3.500 535 HB3 ALA 70 3HB ALA 70 -0.741 -11.047 -2.346 536 H LEU 71 H LEU 71 -0.452 -11.347 0.131 537 HA LEU 71 HA LEU 71 2.331 -11.758 0.714 538 HB2 LEU 71 1HB LEU 71 0.088 -10.416 2.257 539 HB3 LEU 71 2HB LEU 71 1.768 -10.428 2.804 540 HG LEU 71 HG LEU 71 0.833 -9.227 0.174 541 HD11 LEU 71 1HD1 LEU 71 1.132 -7.067 1.302 542 HD12 LEU 71 2HD1 LEU 71 -0.133 -8.046 2.081 543 HD13 LEU 71 3HD1 LEU 71 1.476 -7.912 2.829 544 HD21 LEU 71 1HD2 LEU 71 3.082 -8.204 0.203 545 HD22 LEU 71 2HD2 LEU 71 3.455 -9.065 1.716 546 HD23 LEU 71 3HD2 LEU 71 3.187 -9.981 0.214 547 H SER 72 H SER 72 -0.679 -12.972 2.152 548 HA SER 72 HA SER 72 0.519 -14.377 4.327 549 HB2 SER 72 1HB SER 72 -2.003 -14.951 2.738 550 HB3 SER 72 2HB SER 72 -1.566 -15.769 4.230 551 HG SER 72 HG SER 72 -2.284 -13.122 3.775 552 H ALA 73 H ALA 73 -0.162 -15.326 0.963 553 HA ALA 73 HA ALA 73 0.704 -18.013 1.149 554 HB1 ALA 73 1HB ALA 73 1.096 -17.851 -1.288 555 HB2 ALA 73 2HB ALA 73 -0.456 -17.116 -0.820 556 HB3 ALA 73 3HB ALA 73 0.944 -16.082 -1.186 557 H MET 74 H MET 74 2.557 -15.045 0.459 558 HA MET 74 HA MET 74 5.104 -16.253 0.195 559 HB2 MET 74 1HB MET 74 4.755 -13.910 -0.346 560 HB3 MET 74 2HB MET 74 4.288 -13.543 1.308 561 HG2 MET 74 1HG MET 74 6.598 -14.144 2.048 562 HG3 MET 74 2HG MET 74 7.041 -14.375 0.355 563 HE1 MET 74 1HE MET 74 5.878 -10.335 2.280 564 HE2 MET 74 2HE MET 74 4.713 -11.669 2.098 565 HE3 MET 74 3HE MET 74 6.117 -11.855 3.176 566 H ARG 75 H ARG 75 3.439 -15.066 3.126 567 HA ARG 75 HA ARG 75 5.736 -15.582 4.801 568 HB2 ARG 75 1HB ARG 75 2.830 -15.018 5.472 569 HB3 ARG 75 2HB ARG 75 4.106 -15.148 6.672 570 HG2 ARG 75 1HG ARG 75 5.255 -13.222 5.705 571 HG3 ARG 75 2HG ARG 75 4.012 -13.107 4.436 572 HD2 ARG 75 1HD ARG 75 3.491 -12.898 7.392 573 HD3 ARG 75 2HD ARG 75 3.683 -11.523 6.279 574 HE ARG 75 HE ARG 75 1.706 -13.165 5.191 575 HH11 ARG 75 1HH1 ARG 75 2.205 -11.282 8.115 576 HH12 ARG 75 2HH1 ARG 75 0.502 -10.954 8.344 577 HH21 ARG 75 1HH2 ARG 75 -0.502 -12.732 5.499 578 HH22 ARG 75 2HH2 ARG 75 -1.031 -11.774 6.864 579 H ASN 76 H ASN 76 3.105 -17.499 3.641 580 HA ASN 76 HA ASN 76 3.415 -19.460 5.849 581 HB2 ASN 76 1HB ASN 76 1.388 -19.165 3.615 582 HB3 ASN 76 2HB ASN 76 1.456 -20.578 4.660 583 HD21 ASN 76 1HD2 ASN 76 -0.986 -18.076 5.972 584 HD22 ASN 76 2HD2 ASN 76 -0.749 -18.849 4.440 585 H LEU 77 H LEU 77 3.643 -19.270 2.291 586 HA LEU 77 HA LEU 77 4.157 -22.143 2.142 587 HB2 LEU 77 1HB LEU 77 4.153 -19.969 0.019 588 HB3 LEU 77 2HB LEU 77 4.341 -21.694 -0.310 589 HG LEU 77 HG LEU 77 1.883 -20.433 0.956 590 HD11 LEU 77 1HD1 LEU 77 0.838 -20.826 -1.230 591 HD12 LEU 77 2HD1 LEU 77 2.201 -19.688 -1.348 592 HD13 LEU 77 3HD1 LEU 77 2.401 -21.375 -1.879 593 HD21 LEU 77 1HD2 LEU 77 0.884 -22.647 0.496 594 HD22 LEU 77 2HD2 LEU 77 2.448 -23.224 -0.129 595 HD23 LEU 77 3HD2 LEU 77 2.282 -22.790 1.590 596 H ASN 78 H ASN 78 6.017 -19.198 2.194 597 HA ASN 78 HA ASN 78 8.384 -20.216 0.929 598 HB2 ASN 78 1HB ASN 78 7.909 -17.802 1.245 599 HB3 ASN 78 2HB ASN 78 8.099 -17.997 2.982 600 HD21 ASN 78 1HD2 ASN 78 11.267 -17.227 0.741 601 HD22 ASN 78 2HD2 ASN 78 9.617 -17.010 0.261 602 H GLY 79 H GLY 79 9.470 -21.912 1.562 603 HA2 GLY 79 1HA GLY 79 11.045 -22.940 3.042 604 HA3 GLY 79 2HA GLY 79 10.356 -22.055 4.391 605 H ARG 80 H ARG 80 7.728 -23.070 2.725 606 HA ARG 80 HA ARG 80 7.188 -25.209 4.634 607 HB2 ARG 80 1HB ARG 80 5.438 -23.603 3.928 608 HB3 ARG 80 2HB ARG 80 5.549 -24.205 2.281 609 HG2 ARG 80 1HG ARG 80 4.729 -26.385 2.974 610 HG3 ARG 80 2HG ARG 80 4.714 -25.862 4.676 611 HD2 ARG 80 1HD ARG 80 3.070 -24.171 4.158 612 HD3 ARG 80 2HD ARG 80 3.108 -24.641 2.442 613 HE ARG 80 HE ARG 80 2.532 -26.931 3.988 614 HH11 ARG 80 1HH1 ARG 80 1.075 -23.865 3.084 615 HH12 ARG 80 2HH1 ARG 80 -0.564 -24.465 3.205 616 HH21 ARG 80 1HH2 ARG 80 0.400 -27.698 4.141 617 HH22 ARG 80 2HH2 ARG 80 -0.947 -26.634 3.803 618 H GLU 81 H GLU 81 7.186 -27.352 4.327 619 HA GLU 81 HA GLU 81 8.622 -28.397 2.047 620 HB2 GLU 81 1HB GLU 81 8.771 -29.391 4.322 621 HB3 GLU 81 2HB GLU 81 7.079 -29.857 4.229 622 HG2 GLU 81 1HG GLU 81 7.573 -31.338 2.338 623 HG3 GLU 81 2HG GLU 81 9.266 -30.851 2.390 624 H PHE 82 H PHE 82 7.926 -29.203 0.190 625 HA PHE 82 HA PHE 82 5.129 -30.176 0.018 626 HB2 PHE 82 1HB PHE 82 5.153 -27.804 -0.793 627 HB3 PHE 82 2HB PHE 82 6.345 -28.252 -2.003 628 HD1 PHE 82 HD1 PHE 82 3.039 -29.546 -0.795 629 HD2 PHE 82 HD2 PHE 82 5.537 -28.565 -4.120 630 HE1 PHE 82 HE1 PHE 82 1.223 -30.186 -2.346 631 HE2 PHE 82 HE2 PHE 82 3.722 -29.202 -5.674 632 HZ PHE 82 HZ PHE 82 1.565 -30.015 -4.785 633 H SER 83 H SER 83 5.455 -32.256 -0.415 634 HA SER 83 HA SER 83 6.319 -34.177 -1.340 635 HB2 SER 83 1HB SER 83 5.603 -32.793 -3.441 636 HB3 SER 83 2HB SER 83 7.329 -32.568 -3.680 637 HG SER 83 HG SER 83 7.197 -34.399 -4.595 638 H GLY 84 H GLY 84 7.949 -32.726 0.466 639 HA2 GLY 84 1HA GLY 84 10.070 -33.159 1.347 640 HA3 GLY 84 2HA GLY 84 10.455 -34.098 -0.083 641 H ARG 85 H ARG 85 9.219 -30.843 -0.416 642 HA ARG 85 HA ARG 85 11.959 -29.800 -0.908 643 HB2 ARG 85 1HB ARG 85 9.650 -29.664 -2.875 644 HB3 ARG 85 2HB ARG 85 11.125 -28.720 -3.014 645 HG2 ARG 85 1HG ARG 85 11.074 -31.745 -2.965 646 HG3 ARG 85 2HG ARG 85 11.045 -30.759 -4.447 647 HD2 ARG 85 1HD ARG 85 13.160 -29.728 -3.761 648 HD3 ARG 85 2HD ARG 85 13.196 -30.803 -2.344 649 HE ARG 85 HE ARG 85 13.724 -31.506 -5.127 650 HH11 ARG 85 1HH1 ARG 85 13.013 -32.655 -1.885 651 HH12 ARG 85 2HH1 ARG 85 13.659 -34.255 -2.175 652 HH21 ARG 85 1HH2 ARG 85 14.560 -33.585 -5.492 653 HH22 ARG 85 2HH2 ARG 85 14.535 -34.782 -4.216 654 H ALA 86 H ALA 86 12.217 -28.006 0.210 655 HA ALA 86 HA ALA 86 9.999 -26.479 1.245 656 HB1 ALA 86 1HB ALA 86 11.746 -24.901 2.006 657 HB2 ALA 86 2HB ALA 86 12.153 -26.584 2.417 658 HB3 ALA 86 3HB ALA 86 12.953 -25.786 1.044 659 H LEU 87 H LEU 87 8.835 -24.952 0.336 660 HA LEU 87 HA LEU 87 9.326 -24.345 -2.461 661 HB2 LEU 87 1HB LEU 87 7.229 -23.332 -0.509 662 HB3 LEU 87 2HB LEU 87 7.238 -22.984 -2.241 663 HG LEU 87 HG LEU 87 6.985 -25.760 -1.028 664 HD11 LEU 87 1HD1 LEU 87 4.637 -25.595 -1.726 665 HD12 LEU 87 2HD1 LEU 87 5.053 -24.356 -0.518 666 HD13 LEU 87 3HD1 LEU 87 4.907 -23.911 -2.236 667 HD21 LEU 87 1HD2 LEU 87 6.386 -26.391 -3.341 668 HD22 LEU 87 2HD2 LEU 87 6.680 -24.719 -3.875 669 HD23 LEU 87 3HD2 LEU 87 8.029 -25.710 -3.269 670 H ARG 88 H ARG 88 9.884 -22.445 -3.423 671 HA ARG 88 HA ARG 88 10.923 -20.329 -1.598 672 HB2 ARG 88 1HB ARG 88 12.558 -21.272 -3.179 673 HB3 ARG 88 2HB ARG 88 11.512 -20.865 -4.530 674 HG2 ARG 88 1HG ARG 88 11.793 -18.491 -4.094 675 HG3 ARG 88 2HG ARG 88 12.762 -18.851 -2.645 676 HD2 ARG 88 1HD ARG 88 14.409 -19.977 -4.041 677 HD3 ARG 88 2HD ARG 88 13.446 -19.582 -5.483 678 HE ARG 88 HE ARG 88 15.008 -17.719 -3.820 679 HH11 ARG 88 1HH1 ARG 88 12.881 -18.252 -6.564 680 HH12 ARG 88 2HH1 ARG 88 13.246 -16.711 -7.306 681 HH21 ARG 88 1HH2 ARG 88 15.474 -15.721 -4.793 682 HH22 ARG 88 2HH2 ARG 88 14.713 -15.277 -6.305 683 H VAL 89 H VAL 89 9.028 -19.216 -1.162 684 HA VAL 89 HA VAL 89 7.544 -18.189 -3.545 685 HB VAL 89 HB VAL 89 6.514 -18.750 -0.730 686 HG11 VAL 89 1HG1 VAL 89 4.306 -18.242 -1.654 687 HG12 VAL 89 2HG1 VAL 89 5.399 -16.839 -1.728 688 HG13 VAL 89 3HG1 VAL 89 5.059 -17.782 -3.199 689 HG21 VAL 89 1HG2 VAL 89 5.219 -20.542 -1.841 690 HG22 VAL 89 2HG2 VAL 89 6.007 -20.150 -3.388 691 HG23 VAL 89 3HG2 VAL 89 6.969 -20.797 -2.037 692 H ASP 90 H ASP 90 7.251 -16.059 -3.779 693 HA ASP 90 HA ASP 90 7.739 -14.246 -1.504 694 HB2 ASP 90 1HB ASP 90 9.944 -14.849 -2.879 695 HB3 ASP 90 2HB ASP 90 9.293 -13.678 -4.018 696 H ASN 91 H ASN 91 7.541 -11.892 -2.292 697 HA ASN 91 HA ASN 91 5.012 -11.751 -3.777 698 HB2 ASN 91 1HB ASN 91 5.423 -10.424 -1.702 699 HB3 ASN 91 2HB ASN 91 6.676 -9.528 -2.550 700 HD21 ASN 91 1HD2 ASN 91 3.577 -7.548 -2.687 701 HD22 ASN 91 2HD2 ASN 91 4.627 -8.165 -1.456 702 H ALA 92 H ALA 92 4.870 -11.575 -5.873 703 HA ALA 92 HA ALA 92 7.317 -11.114 -7.396 704 HB1 ALA 92 1HB ALA 92 5.911 -11.668 -9.354 705 HB2 ALA 92 2HB ALA 92 5.755 -12.885 -8.065 706 HB3 ALA 92 3HB ALA 92 4.472 -11.677 -8.308 707 H ALA 93 H ALA 93 5.194 -9.046 -6.000 708 HA ALA 93 HA ALA 93 4.829 -7.044 -7.976 709 HB1 ALA 93 1HB ALA 93 4.682 -5.475 -6.069 710 HB2 ALA 93 2HB ALA 93 3.743 -6.958 -5.777 711 HB3 ALA 93 3HB ALA 93 5.324 -6.736 -4.992 712 H SER 94 H SER 94 7.640 -7.975 -6.092 713 HA SER 94 HA SER 94 9.183 -5.608 -6.578 714 HB2 SER 94 1HB SER 94 9.784 -7.153 -4.808 715 HB3 SER 94 2HB SER 94 9.997 -8.464 -5.958 716 HG SER 94 HG SER 94 11.753 -6.748 -5.148 717 H GLU 95 H GLU 95 10.553 -5.023 -8.166 718 HA GLU 95 HA GLU 95 10.163 -6.096 -10.779 719 HB2 GLU 95 1HB GLU 95 10.893 -3.760 -10.312 720 HB3 GLU 95 2HB GLU 95 12.443 -4.363 -9.743 721 HG2 GLU 95 1HG GLU 95 12.673 -3.532 -11.983 722 HG3 GLU 95 2HG GLU 95 12.909 -5.279 -11.981 723 H LYS 96 H LYS 96 12.473 -6.821 -8.243 724 HA LYS 96 HA LYS 96 14.366 -8.229 -9.871 725 HB2 LYS 96 1HB LYS 96 13.679 -8.413 -6.915 726 HB3 LYS 96 2HB LYS 96 14.982 -9.333 -7.654 727 HG2 LYS 96 1HG LYS 96 16.095 -7.239 -8.324 728 HG3 LYS 96 2HG LYS 96 14.779 -6.308 -7.594 729 HD2 LYS 96 1HD LYS 96 15.291 -7.312 -5.390 730 HD3 LYS 96 2HD LYS 96 16.610 -8.238 -6.121 731 HE2 LYS 96 1HE LYS 96 17.746 -6.145 -6.755 732 HE3 LYS 96 2HE LYS 96 16.421 -5.204 -6.067 733 HZ1 LYS 96 1HZ LYS 96 18.256 -5.379 -4.554 734 HZ2 LYS 96 2HZ LYS 96 16.940 -6.147 -3.923 735 HZ3 LYS 96 3HZ LYS 96 18.179 -7.026 -4.565 736 H ASN 97 H ASN 97 11.456 -9.260 -8.110 737 HA ASN 97 HA ASN 97 11.754 -12.042 -8.882 738 HB2 ASN 97 1HB ASN 97 9.455 -10.428 -7.751 739 HB3 ASN 97 2HB ASN 97 9.300 -12.130 -8.166 740 HD21 ASN 97 1HD2 ASN 97 10.262 -11.591 -4.556 741 HD22 ASN 97 2HD2 ASN 97 9.067 -10.859 -5.573 742 H LYS 98 H LYS 98 10.131 -9.218 -10.232 743 HA LYS 98 HA LYS 98 8.757 -10.619 -12.324 744 HB2 LYS 98 1HB LYS 98 9.757 -7.760 -12.081 745 HB3 LYS 98 2HB LYS 98 8.860 -8.337 -13.479 746 HG2 LYS 98 1HG LYS 98 6.949 -8.905 -12.023 747 HG3 LYS 98 2HG LYS 98 7.852 -8.318 -10.619 748 HD2 LYS 98 1HD LYS 98 7.949 -6.068 -11.572 749 HD3 LYS 98 2HD LYS 98 7.162 -6.632 -13.054 750 HE2 LYS 98 1HE LYS 98 5.149 -7.244 -11.741 751 HE3 LYS 98 2HE LYS 98 5.932 -6.655 -10.273 752 HZ1 LYS 98 1HZ LYS 98 4.472 -5.019 -11.210 753 HZ2 LYS 98 2HZ LYS 98 6.028 -4.474 -11.268 754 HZ3 LYS 98 3HZ LYS 98 5.295 -5.024 -12.639 755 H GLU 99 H GLU 99 12.019 -9.237 -12.071 756 HA GLU 99 HA GLU 99 12.893 -9.762 -14.706 757 HB2 GLU 99 1HB GLU 99 14.208 -8.498 -13.022 758 HB3 GLU 99 2HB GLU 99 14.468 -9.976 -12.107 759 HG2 GLU 99 1HG GLU 99 15.724 -10.937 -13.977 760 HG3 GLU 99 2HG GLU 99 15.431 -9.486 -14.934 761 H GLU 100 H GLU 100 12.856 -11.886 -11.839 762 HA GLU 100 HA GLU 100 13.985 -14.168 -13.119 763 HB2 GLU 100 1HB GLU 100 12.045 -13.924 -10.787 764 HB3 GLU 100 2HB GLU 100 12.767 -15.446 -11.291 765 HG2 GLU 100 1HG GLU 100 15.016 -14.493 -10.872 766 HG3 GLU 100 2HG GLU 100 14.260 -13.003 -10.314 767 H LEU 101 H LEU 101 10.616 -13.059 -12.797 768 HA LEU 101 HA LEU 101 9.403 -15.278 -14.102 769 HB2 LEU 101 1HB LEU 101 8.596 -12.360 -13.899 770 HB3 LEU 101 2HB LEU 101 7.572 -13.599 -14.631 771 HG LEU 101 HG LEU 101 8.534 -13.667 -11.750 772 HD11 LEU 101 1HD1 LEU 101 6.253 -12.955 -11.190 773 HD12 LEU 101 2HD1 LEU 101 7.108 -11.726 -12.151 774 HD13 LEU 101 3HD1 LEU 101 5.887 -12.766 -12.921 775 HD21 LEU 101 1HD2 LEU 101 6.771 -15.386 -11.537 776 HD22 LEU 101 2HD2 LEU 101 6.411 -15.232 -13.274 777 HD23 LEU 101 3HD2 LEU 101 7.988 -15.864 -12.745 778 H LYS 102 H LYS 102 10.847 -12.289 -15.354 779 HA LYS 102 HA LYS 102 10.039 -12.643 -18.071 780 HB2 LYS 102 1HB LYS 102 12.387 -11.178 -16.814 781 HB3 LYS 102 2HB LYS 102 12.061 -11.148 -18.542 782 HG2 LYS 102 1HG LYS 102 9.910 -10.079 -18.172 783 HG3 LYS 102 2HG LYS 102 10.104 -10.222 -16.419 784 HD2 LYS 102 1HD LYS 102 12.149 -8.796 -16.560 785 HD3 LYS 102 2HD LYS 102 11.865 -8.602 -18.296 786 HE2 LYS 102 1HE LYS 102 9.703 -7.534 -17.854 787 HE3 LYS 102 2HE LYS 102 9.902 -7.794 -16.119 788 HZ1 LYS 102 1HZ LYS 102 10.499 -5.574 -16.752 789 HZ2 LYS 102 2HZ LYS 102 11.829 -6.367 -16.184 790 HZ3 LYS 102 3HZ LYS 102 11.643 -6.123 -17.805 791 H SER 103 H SER 103 12.862 -13.784 -16.251 792 HA SER 103 HA SER 103 14.154 -14.954 -18.559 793 HB2 SER 103 1HB SER 103 15.669 -15.935 -16.982 794 HB3 SER 103 2HB SER 103 15.309 -14.306 -16.431 795 HG SER 103 HG SER 103 13.505 -15.583 -15.297 796 H LEU 104 H LEU 104 11.716 -16.010 -16.274 797 HA LEU 104 HA LEU 104 11.805 -18.799 -17.057 798 HB2 LEU 104 1HB LEU 104 9.688 -17.105 -15.692 799 HB3 LEU 104 2HB LEU 104 9.506 -18.837 -15.988 800 HG LEU 104 HG LEU 104 11.720 -17.612 -14.306 801 HD11 LEU 104 1HD1 LEU 104 10.425 -18.431 -12.389 802 HD12 LEU 104 2HD1 LEU 104 9.527 -17.204 -13.313 803 HD13 LEU 104 3HD1 LEU 104 9.115 -18.927 -13.486 804 HD21 LEU 104 1HD2 LEU 104 12.031 -19.953 -13.576 805 HD22 LEU 104 2HD2 LEU 104 10.743 -20.471 -14.690 806 HD23 LEU 104 3HD2 LEU 104 12.258 -19.795 -15.334 807 H GLY 105 H GLY 105 10.015 -15.931 -18.111 808 HA2 GLY 105 1HA GLY 105 9.284 -15.734 -20.420 809 HA3 GLY 105 2HA GLY 105 9.100 -17.476 -20.495 810 H THR 106 H THR 106 8.011 -15.380 -17.844 811 HA THR 106 HA THR 106 5.209 -15.549 -18.718 812 HB THR 106 HB THR 106 5.634 -17.738 -17.537 813 HG1 THR 106 HG1 THR 106 3.570 -17.349 -17.240 814 HG21 THR 106 1HG2 THR 106 5.917 -17.685 -15.090 815 HG22 THR 106 2HG2 THR 106 7.300 -16.918 -15.907 816 HG23 THR 106 3HG2 THR 106 6.050 -15.912 -15.139 817 H GLY 107 H GLY 107 3.928 -14.909 -16.403 818 HA2 GLY 107 1HA GLY 107 4.378 -13.263 -14.505 819 HA3 GLY 107 2HA GLY 107 5.176 -12.272 -15.711 Start of MODEL 5 1 H MET 1 1H MET 1 -4.182 -5.517 -28.566 2 HA MET 1 HA MET 1 -5.691 -4.321 -27.188 3 HB2 MET 1 1HB MET 1 -3.506 -5.887 -25.766 4 HB3 MET 1 2HB MET 1 -5.040 -5.447 -25.029 5 HG2 MET 1 1HG MET 1 -6.243 -6.772 -26.718 6 HG3 MET 1 2HG MET 1 -4.711 -7.197 -27.484 7 HE1 MET 1 1HE MET 1 -6.104 -8.627 -23.314 8 HE2 MET 1 2HE MET 1 -5.749 -6.916 -23.658 9 HE3 MET 1 3HE MET 1 -7.113 -7.723 -24.470 10 H ALA 2 H ALA 2 -5.729 -3.386 -24.871 11 HA ALA 2 HA ALA 2 -3.522 -1.650 -24.163 12 HB1 ALA 2 1HB ALA 2 -4.711 0.490 -24.516 13 HB2 ALA 2 2HB ALA 2 -4.407 -0.356 -26.051 14 HB3 ALA 2 3HB ALA 2 -6.030 -0.386 -25.325 15 H GLY 3 H GLY 3 -4.324 0.017 -22.447 16 HA2 GLY 3 1HA GLY 3 -5.425 -1.522 -20.291 17 HA3 GLY 3 2HA GLY 3 -5.099 0.201 -20.266 18 H LEU 4 H LEU 4 -6.868 0.299 -22.840 19 HA LEU 4 HA LEU 4 -9.393 0.746 -21.411 20 HB2 LEU 4 1HB LEU 4 -8.627 1.092 -24.332 21 HB3 LEU 4 2HB LEU 4 -10.187 1.546 -23.638 22 HG LEU 4 HG LEU 4 -7.507 2.756 -22.866 23 HD11 LEU 4 1HD1 LEU 4 -8.327 4.727 -24.078 24 HD12 LEU 4 2HD1 LEU 4 -8.164 3.317 -25.150 25 HD13 LEU 4 3HD1 LEU 4 -9.773 3.820 -24.577 26 HD21 LEU 4 1HD2 LEU 4 -8.917 4.390 -21.661 27 HD22 LEU 4 2HD2 LEU 4 -10.373 3.478 -22.127 28 HD23 LEU 4 3HD2 LEU 4 -9.172 2.743 -21.038 29 H THR 5 H THR 5 -7.895 -1.872 -22.868 30 HA THR 5 HA THR 5 -10.522 -3.120 -23.547 31 HB THR 5 HB THR 5 -9.252 -4.760 -24.870 32 HG1 THR 5 HG1 THR 5 -7.154 -3.651 -23.480 33 HG21 THR 5 1HG2 THR 5 -8.402 -3.253 -26.624 34 HG22 THR 5 2HG2 THR 5 -9.943 -2.655 -25.964 35 HG23 THR 5 3HG2 THR 5 -8.410 -1.899 -25.471 36 H VAL 6 H VAL 6 -7.733 -3.261 -21.469 37 HA VAL 6 HA VAL 6 -8.445 -5.932 -20.453 38 HB VAL 6 HB VAL 6 -6.311 -3.932 -19.595 39 HG11 VAL 6 1HG1 VAL 6 -5.367 -5.767 -18.281 40 HG12 VAL 6 2HG1 VAL 6 -6.991 -5.309 -17.716 41 HG13 VAL 6 3HG1 VAL 6 -6.770 -6.782 -18.692 42 HG21 VAL 6 1HG2 VAL 6 -4.773 -5.539 -20.679 43 HG22 VAL 6 2HG2 VAL 6 -6.162 -6.539 -21.165 44 HG23 VAL 6 3HG2 VAL 6 -5.963 -4.904 -21.840 45 H ARG 7 H ARG 7 -9.537 -6.375 -18.640 46 HA ARG 7 HA ARG 7 -11.027 -4.260 -17.347 47 HB2 ARG 7 1HB ARG 7 -10.684 -7.196 -16.656 48 HB3 ARG 7 2HB ARG 7 -11.789 -6.109 -15.828 49 HG2 ARG 7 1HG ARG 7 -13.021 -5.750 -17.926 50 HG3 ARG 7 2HG ARG 7 -11.903 -6.854 -18.762 51 HD2 ARG 7 1HD ARG 7 -12.569 -8.651 -17.264 52 HD3 ARG 7 2HD ARG 7 -13.698 -7.545 -16.447 53 HE ARG 7 HE ARG 7 -14.289 -7.493 -19.192 54 HH11 ARG 7 1HH1 ARG 7 -14.363 -9.761 -16.510 55 HH12 ARG 7 2HH1 ARG 7 -15.695 -10.686 -17.165 56 HH21 ARG 7 1HH2 ARG 7 -16.019 -8.701 -20.032 57 HH22 ARG 7 2HH2 ARG 7 -16.634 -10.086 -19.159 58 H ASP 8 H ASP 8 -10.844 -3.402 -15.315 59 HA ASP 8 HA ASP 8 -8.160 -3.007 -14.425 60 HB2 ASP 8 1HB ASP 8 -10.857 -2.331 -13.205 61 HB3 ASP 8 2HB ASP 8 -9.344 -1.922 -12.408 62 HA PRO 9 HA PRO 9 -9.702 -5.872 -10.717 63 HB2 PRO 9 1HB PRO 9 -11.202 -7.693 -12.653 64 HB3 PRO 9 2HB PRO 9 -11.483 -7.446 -10.924 65 HG2 PRO 9 1HG PRO 9 -13.091 -6.198 -12.615 66 HG3 PRO 9 2HG PRO 9 -12.446 -5.283 -11.249 67 HD2 PRO 9 1HD PRO 9 -11.539 -5.290 -14.154 68 HD3 PRO 9 2HD PRO 9 -11.728 -3.892 -13.022 69 H ALA 10 H ALA 10 -9.265 -7.034 -14.079 70 HA ALA 10 HA ALA 10 -7.659 -9.300 -13.412 71 HB1 ALA 10 1HB ALA 10 -7.013 -9.272 -15.799 72 HB2 ALA 10 2HB ALA 10 -8.768 -9.066 -15.588 73 HB3 ALA 10 3HB ALA 10 -7.747 -7.660 -15.970 74 H VAL 11 H VAL 11 -6.820 -5.953 -14.286 75 HA VAL 11 HA VAL 11 -3.997 -6.276 -14.232 76 HB VAL 11 HB VAL 11 -5.749 -3.872 -13.573 77 HG11 VAL 11 1HG1 VAL 11 -3.741 -2.507 -13.875 78 HG12 VAL 11 2HG1 VAL 11 -3.592 -3.613 -12.490 79 HG13 VAL 11 3HG1 VAL 11 -2.759 -3.983 -14.019 80 HG21 VAL 11 1HG2 VAL 11 -5.094 -3.159 -15.850 81 HG22 VAL 11 2HG2 VAL 11 -4.159 -4.660 -16.050 82 HG23 VAL 11 3HG2 VAL 11 -5.930 -4.729 -15.883 83 H ASP 12 H ASP 12 -6.318 -5.432 -11.654 84 HA ASP 12 HA ASP 12 -4.357 -5.019 -9.618 85 HB2 ASP 12 1HB ASP 12 -7.297 -5.781 -9.497 86 HB3 ASP 12 2HB ASP 12 -6.330 -5.490 -8.057 87 H ARG 13 H ARG 13 -6.084 -7.903 -10.736 88 HA ARG 13 HA ARG 13 -5.217 -9.628 -8.621 89 HB2 ARG 13 1HB ARG 13 -6.159 -10.131 -11.452 90 HB3 ARG 13 2HB ARG 13 -5.670 -11.445 -10.393 91 HG2 ARG 13 1HG ARG 13 -7.434 -10.952 -8.838 92 HG3 ARG 13 2HG ARG 13 -7.850 -9.458 -9.713 93 HD2 ARG 13 1HD ARG 13 -8.596 -10.680 -11.595 94 HD3 ARG 13 2HD ARG 13 -7.961 -12.203 -10.931 95 HE ARG 13 HE ARG 13 -9.697 -11.431 -9.008 96 HH11 ARG 13 1HH1 ARG 13 -10.004 -11.689 -12.498 97 HH12 ARG 13 2HH1 ARG 13 -11.713 -12.060 -12.446 98 HH21 ARG 13 1HH2 ARG 13 -11.916 -11.912 -8.953 99 HH22 ARG 13 2HH2 ARG 13 -12.796 -12.186 -10.440 100 H SER 14 H SER 14 -3.830 -8.765 -11.773 101 HA SER 14 HA SER 14 -1.609 -10.588 -11.606 102 HB2 SER 14 1HB SER 14 -2.009 -7.997 -13.133 103 HB3 SER 14 2HB SER 14 -0.599 -9.029 -13.317 104 HG SER 14 HG SER 14 -2.215 -10.737 -13.681 105 H LEU 15 H LEU 15 -2.103 -7.211 -10.611 106 HA LEU 15 HA LEU 15 0.562 -6.778 -9.659 107 HB2 LEU 15 1HB LEU 15 -2.102 -5.563 -8.856 108 HB3 LEU 15 2HB LEU 15 -0.546 -5.001 -8.237 109 HG LEU 15 HG LEU 15 -1.314 -4.998 -11.177 110 HD11 LEU 15 1HD1 LEU 15 -1.631 -2.583 -10.876 111 HD12 LEU 15 2HD1 LEU 15 -2.773 -3.524 -9.888 112 HD13 LEU 15 3HD1 LEU 15 -1.354 -2.764 -9.128 113 HD21 LEU 15 1HD2 LEU 15 0.651 -3.510 -11.360 114 HD22 LEU 15 2HD2 LEU 15 0.961 -3.703 -9.618 115 HD23 LEU 15 3HD2 LEU 15 1.112 -5.101 -10.709 116 H ARG 16 H ARG 16 -2.363 -8.102 -8.143 117 HA ARG 16 HA ARG 16 -0.970 -8.445 -5.576 118 HB2 ARG 16 1HB ARG 16 -3.739 -9.283 -6.500 119 HB3 ARG 16 2HB ARG 16 -3.122 -9.503 -4.870 120 HG2 ARG 16 1HG ARG 16 -3.031 -7.143 -4.490 121 HG3 ARG 16 2HG ARG 16 -3.369 -6.799 -6.204 122 HD2 ARG 16 1HD ARG 16 -5.560 -7.768 -5.996 123 HD3 ARG 16 2HD ARG 16 -5.227 -8.212 -4.306 124 HE ARG 16 HE ARG 16 -4.832 -5.413 -4.707 125 HH11 ARG 16 1HH1 ARG 16 -7.351 -7.843 -4.398 126 HH12 ARG 16 2HH1 ARG 16 -8.532 -6.719 -3.766 127 HH21 ARG 16 1HH2 ARG 16 -6.375 -3.963 -3.885 128 HH22 ARG 16 2HH2 ARG 16 -7.981 -4.522 -3.475 129 H SER 17 H SER 17 0.712 -9.781 -6.766 130 HA SER 17 HA SER 17 -0.109 -12.636 -6.737 131 HB2 SER 17 1HB SER 17 0.931 -13.070 -8.872 132 HB3 SER 17 2HB SER 17 -0.278 -11.811 -9.077 133 HG SER 17 HG SER 17 1.192 -10.515 -9.651 134 H VAL 18 H VAL 18 1.768 -14.117 -6.832 135 HA VAL 18 HA VAL 18 4.219 -12.853 -5.686 136 HB VAL 18 HB VAL 18 4.423 -14.743 -4.116 137 HG11 VAL 18 1HG1 VAL 18 2.591 -14.158 -2.604 138 HG12 VAL 18 2HG1 VAL 18 3.315 -12.720 -3.360 139 HG13 VAL 18 3HG1 VAL 18 1.751 -13.338 -3.941 140 HG21 VAL 18 1HG2 VAL 18 2.533 -16.314 -3.831 141 HG22 VAL 18 2HG2 VAL 18 1.699 -15.559 -5.209 142 HG23 VAL 18 3HG2 VAL 18 3.228 -16.433 -5.464 143 H PHE 19 H PHE 19 6.161 -14.160 -5.875 144 HA PHE 19 HA PHE 19 6.078 -15.919 -8.275 145 HB2 PHE 19 1HB PHE 19 7.671 -14.068 -8.409 146 HB3 PHE 19 2HB PHE 19 8.392 -14.525 -6.874 147 HD1 PHE 19 HD1 PHE 19 7.682 -15.956 -10.256 148 HD2 PHE 19 HD2 PHE 19 10.292 -15.831 -6.876 149 HE1 PHE 19 HE1 PHE 19 9.289 -17.409 -11.446 150 HE2 PHE 19 HE2 PHE 19 11.903 -17.281 -8.064 151 HZ PHE 19 HZ PHE 19 11.400 -18.071 -10.349 152 H VAL 20 H VAL 20 6.452 -18.030 -8.175 153 HA VAL 20 HA VAL 20 7.132 -19.136 -5.485 154 HB VAL 20 HB VAL 20 5.573 -20.449 -7.753 155 HG11 VAL 20 1HG1 VAL 20 5.023 -22.153 -6.085 156 HG12 VAL 20 2HG1 VAL 20 6.774 -22.055 -6.385 157 HG13 VAL 20 3HG1 VAL 20 6.083 -21.342 -4.908 158 HG21 VAL 20 1HG2 VAL 20 3.611 -20.122 -6.281 159 HG22 VAL 20 2HG2 VAL 20 4.632 -19.246 -5.116 160 HG23 VAL 20 3HG2 VAL 20 4.341 -18.564 -6.735 161 H GLY 21 H GLY 21 8.851 -20.414 -5.248 162 HA2 GLY 21 1HA GLY 21 10.124 -21.549 -7.708 163 HA3 GLY 21 2HA GLY 21 11.090 -20.684 -6.528 164 H ASN 22 H ASN 22 12.048 -23.039 -6.845 165 HA ASN 22 HA ASN 22 12.438 -25.145 -5.992 166 HB2 ASN 22 1HB ASN 22 11.212 -23.881 -3.518 167 HB3 ASN 22 2HB ASN 22 12.100 -25.399 -3.540 168 HD21 ASN 22 1HD2 ASN 22 14.410 -22.712 -2.515 169 HD22 ASN 22 2HD2 ASN 22 12.926 -23.382 -1.926 170 H ILE 23 H ILE 23 10.271 -25.145 -7.576 171 HA ILE 23 HA ILE 23 8.134 -26.592 -6.129 172 HB ILE 23 HB ILE 23 8.381 -25.695 -9.030 173 HG12 ILE 23 1HG1 ILE 23 6.547 -24.727 -6.826 174 HG13 ILE 23 2HG1 ILE 23 8.037 -23.927 -7.300 175 HG21 ILE 23 1HG2 ILE 23 6.038 -26.417 -9.253 176 HG22 ILE 23 2HG2 ILE 23 7.096 -27.792 -8.865 177 HG23 ILE 23 3HG2 ILE 23 6.077 -27.070 -7.598 178 HD11 ILE 23 1HD1 ILE 23 6.106 -22.862 -8.323 179 HD12 ILE 23 2HD1 ILE 23 7.151 -23.591 -9.567 180 HD13 ILE 23 3HD1 ILE 23 5.640 -24.399 -9.086 181 HA PRO 24 HA PRO 24 9.991 -30.529 -7.025 182 HB2 PRO 24 1HB PRO 24 7.124 -31.317 -6.410 183 HB3 PRO 24 2HB PRO 24 8.627 -32.023 -5.803 184 HG2 PRO 24 1HG PRO 24 7.257 -30.412 -4.192 185 HG3 PRO 24 2HG PRO 24 9.013 -30.241 -4.271 186 HD2 PRO 24 1HD PRO 24 6.862 -28.583 -5.656 187 HD3 PRO 24 2HD PRO 24 8.349 -28.022 -4.791 188 H TYR 25 H TYR 25 10.197 -31.338 -9.027 189 HA TYR 25 HA TYR 25 8.566 -30.428 -11.185 190 HB2 TYR 25 1HB TYR 25 9.980 -31.683 -12.591 191 HB3 TYR 25 2HB TYR 25 11.013 -31.252 -11.235 192 HD1 TYR 25 HD1 TYR 25 9.254 -33.970 -12.952 193 HD2 TYR 25 HD2 TYR 25 11.748 -32.921 -9.622 194 HE1 TYR 25 HE1 TYR 25 9.788 -36.358 -12.599 195 HE2 TYR 25 HE2 TYR 25 12.283 -35.309 -9.270 196 HH TYR 25 HH TYR 25 11.837 -37.403 -9.883 197 H GLU 26 H GLU 26 8.249 -33.102 -9.019 198 HA GLU 26 HA GLU 26 6.650 -34.778 -10.739 199 HB2 GLU 26 1HB GLU 26 6.924 -34.644 -7.710 200 HB3 GLU 26 2HB GLU 26 5.983 -35.868 -8.551 201 HG2 GLU 26 1HG GLU 26 8.006 -36.647 -9.705 202 HG3 GLU 26 2HG GLU 26 8.955 -35.407 -8.889 203 H ALA 27 H ALA 27 5.997 -31.986 -8.765 204 HA ALA 27 HA ALA 27 3.151 -32.481 -8.518 205 HB1 ALA 27 1HB ALA 27 3.064 -30.156 -7.680 206 HB2 ALA 27 2HB ALA 27 4.348 -31.096 -6.883 207 HB3 ALA 27 3HB ALA 27 4.761 -29.928 -8.159 208 H THR 28 H THR 28 1.456 -31.677 -9.651 209 HA THR 28 HA THR 28 2.118 -30.687 -12.361 210 HB THR 28 HB THR 28 -0.200 -31.204 -12.933 211 HG1 THR 28 HG1 THR 28 -1.233 -32.368 -10.883 212 HG21 THR 28 1HG2 THR 28 -0.224 -33.622 -12.462 213 HG22 THR 28 2HG2 THR 28 1.409 -33.079 -12.915 214 HG23 THR 28 3HG2 THR 28 1.018 -33.395 -11.209 215 H GLU 29 H GLU 29 0.681 -29.016 -13.321 216 HA GLU 29 HA GLU 29 0.977 -26.604 -11.839 217 HB2 GLU 29 1HB GLU 29 0.914 -26.740 -14.329 218 HB3 GLU 29 2HB GLU 29 -0.795 -27.145 -14.257 219 HG2 GLU 29 1HG GLU 29 -1.302 -24.973 -13.271 220 HG3 GLU 29 2HG GLU 29 0.412 -24.565 -13.237 221 H GLU 30 H GLU 30 -1.930 -28.542 -12.591 222 HA GLU 30 HA GLU 30 -3.744 -26.803 -11.211 223 HB2 GLU 30 1HB GLU 30 -3.925 -29.742 -11.976 224 HB3 GLU 30 2HB GLU 30 -5.253 -28.855 -11.241 225 HG2 GLU 30 1HG GLU 30 -5.315 -27.319 -13.137 226 HG3 GLU 30 2HG GLU 30 -3.930 -28.129 -13.864 227 H GLN 31 H GLN 31 -1.957 -29.717 -10.221 228 HA GLN 31 HA GLN 31 -3.034 -29.996 -7.627 229 HB2 GLN 31 1HB GLN 31 -1.531 -31.661 -8.636 230 HB3 GLN 31 2HB GLN 31 -0.198 -30.516 -8.606 231 HG2 GLN 31 1HG GLN 31 -0.268 -30.483 -6.152 232 HG3 GLN 31 2HG GLN 31 -1.615 -31.655 -6.188 233 HE21 GLN 31 1HE2 GLN 31 1.092 -33.897 -5.594 234 HE22 GLN 31 2HE2 GLN 31 -0.066 -32.880 -4.803 235 H LEU 32 H LEU 32 -0.258 -28.037 -8.728 236 HA LEU 32 HA LEU 32 0.422 -27.007 -6.166 237 HB2 LEU 32 1HB LEU 32 0.785 -25.855 -8.952 238 HB3 LEU 32 2HB LEU 32 1.488 -25.141 -7.498 239 HG LEU 32 HG LEU 32 2.082 -27.978 -8.394 240 HD11 LEU 32 1HD1 LEU 32 4.159 -27.069 -9.335 241 HD12 LEU 32 2HD1 LEU 32 2.723 -26.418 -10.160 242 HD13 LEU 32 3HD1 LEU 32 3.599 -25.419 -8.976 243 HD21 LEU 32 1HD2 LEU 32 4.028 -27.671 -6.901 244 HD22 LEU 32 2HD2 LEU 32 3.467 -26.028 -6.507 245 HD23 LEU 32 3HD2 LEU 32 2.500 -27.440 -6.017 246 H LYS 33 H LYS 33 -1.725 -25.732 -8.715 247 HA LYS 33 HA LYS 33 -2.448 -23.319 -7.437 248 HB2 LYS 33 1HB LYS 33 -3.037 -23.895 -9.780 249 HB3 LYS 33 2HB LYS 33 -4.168 -25.110 -9.201 250 HG2 LYS 33 1HG LYS 33 -5.524 -23.362 -8.128 251 HG3 LYS 33 2HG LYS 33 -4.375 -22.131 -8.673 252 HD2 LYS 33 1HD LYS 33 -4.842 -22.704 -11.020 253 HD3 LYS 33 2HD LYS 33 -5.949 -23.983 -10.501 254 HE2 LYS 33 1HE LYS 33 -7.353 -22.262 -9.361 255 HE3 LYS 33 2HE LYS 33 -6.274 -21.006 -9.974 256 HZ1 LYS 33 1HZ LYS 33 -8.197 -21.272 -11.360 257 HZ2 LYS 33 2HZ LYS 33 -6.842 -21.689 -12.204 258 HZ3 LYS 33 3HZ LYS 33 -7.851 -22.861 -11.631 259 H ASP 34 H ASP 34 -3.805 -26.589 -7.095 260 HA ASP 34 HA ASP 34 -6.026 -25.847 -5.477 261 HB2 ASP 34 1HB ASP 34 -4.460 -28.437 -5.732 262 HB3 ASP 34 2HB ASP 34 -5.869 -28.288 -4.691 263 H ILE 35 H ILE 35 -2.720 -26.864 -4.613 264 HA ILE 35 HA ILE 35 -3.310 -26.742 -1.759 265 HB ILE 35 HB ILE 35 -0.923 -27.268 -1.458 266 HG12 ILE 35 1HG1 ILE 35 -0.643 -27.003 -4.459 267 HG13 ILE 35 2HG1 ILE 35 -0.134 -25.776 -3.308 268 HG21 ILE 35 1HG2 ILE 35 -0.855 -29.400 -2.687 269 HG22 ILE 35 2HG2 ILE 35 -2.470 -29.109 -2.002 270 HG23 ILE 35 3HG2 ILE 35 -2.180 -28.842 -3.736 271 HD11 ILE 35 1HD1 ILE 35 1.744 -27.150 -4.014 272 HD12 ILE 35 2HD1 ILE 35 1.424 -27.371 -2.277 273 HD13 ILE 35 3HD1 ILE 35 0.910 -28.614 -3.443 274 H PHE 36 H PHE 36 -2.336 -24.513 -4.182 275 HA PHE 36 HA PHE 36 -1.175 -22.605 -2.280 276 HB2 PHE 36 1HB PHE 36 -1.922 -22.427 -5.220 277 HB3 PHE 36 2HB PHE 36 -1.314 -21.053 -4.310 278 HD1 PHE 36 HD1 PHE 36 0.349 -23.529 -2.736 279 HD2 PHE 36 HD2 PHE 36 0.163 -21.733 -6.608 280 HE1 PHE 36 HE1 PHE 36 2.668 -24.258 -3.183 281 HE2 PHE 36 HE2 PHE 36 2.482 -22.463 -7.059 282 HZ PHE 36 HZ PHE 36 3.735 -23.724 -5.345 283 H SER 37 H SER 37 -4.297 -23.382 -3.613 284 HA SER 37 HA SER 37 -5.564 -20.878 -2.886 285 HB2 SER 37 1HB SER 37 -7.604 -21.944 -3.453 286 HB3 SER 37 2HB SER 37 -6.410 -22.568 -4.581 287 HG SER 37 HG SER 37 -6.168 -24.350 -3.171 288 H GLU 38 H GLU 38 -4.330 -23.447 -1.082 289 HA GLU 38 HA GLU 38 -6.262 -23.553 1.041 290 HB2 GLU 38 1HB GLU 38 -3.291 -24.206 0.962 291 HB3 GLU 38 2HB GLU 38 -4.311 -24.498 2.364 292 HG2 GLU 38 1HG GLU 38 -5.691 -26.043 1.089 293 HG3 GLU 38 2HG GLU 38 -4.774 -25.696 -0.375 294 H VAL 39 H VAL 39 -3.787 -21.276 0.187 295 HA VAL 39 HA VAL 39 -3.854 -20.140 2.949 296 HB VAL 39 HB VAL 39 -1.655 -19.133 2.399 297 HG11 VAL 39 1HG1 VAL 39 -0.339 -21.196 2.409 298 HG12 VAL 39 2HG1 VAL 39 -1.729 -21.286 3.517 299 HG13 VAL 39 3HG1 VAL 39 -1.787 -22.120 1.945 300 HG21 VAL 39 1HG2 VAL 39 -0.485 -19.840 0.336 301 HG22 VAL 39 2HG2 VAL 39 -1.943 -20.717 -0.187 302 HG23 VAL 39 3HG2 VAL 39 -1.975 -18.943 -0.043 303 H GLY 40 H GLY 40 -5.267 -19.705 0.055 304 HA2 GLY 40 1HA GLY 40 -6.439 -17.262 0.561 305 HA3 GLY 40 2HA GLY 40 -4.946 -16.811 -0.240 306 HA PRO 41 HA PRO 41 -8.521 -18.425 -3.095 307 HB2 PRO 41 1HB PRO 41 -8.890 -15.432 -3.478 308 HB3 PRO 41 2HB PRO 41 -10.103 -16.717 -3.533 309 HG2 PRO 41 1HG PRO 41 -9.960 -15.218 -1.341 310 HG3 PRO 41 2HG PRO 41 -10.156 -16.964 -1.165 311 HD2 PRO 41 1HD PRO 41 -7.629 -15.283 -0.912 312 HD3 PRO 41 2HD PRO 41 -8.200 -16.646 0.132 313 H VAL 42 H VAL 42 -7.227 -19.129 -4.706 314 HA VAL 42 HA VAL 42 -5.416 -17.259 -6.097 315 HB VAL 42 HB VAL 42 -5.961 -20.231 -6.506 316 HG11 VAL 42 1HG1 VAL 42 -3.964 -20.216 -7.919 317 HG12 VAL 42 2HG1 VAL 42 -5.256 -19.188 -8.582 318 HG13 VAL 42 3HG1 VAL 42 -3.863 -18.447 -7.757 319 HG21 VAL 42 1HG2 VAL 42 -3.732 -20.500 -5.465 320 HG22 VAL 42 2HG2 VAL 42 -3.633 -18.739 -5.227 321 HG23 VAL 42 3HG2 VAL 42 -4.864 -19.687 -4.360 322 H VAL 43 H VAL 43 -5.847 -16.266 -7.947 323 HA VAL 43 HA VAL 43 -8.422 -16.940 -9.287 324 HB VAL 43 HB VAL 43 -8.311 -14.666 -10.233 325 HG11 VAL 43 1HG1 VAL 43 -8.610 -13.396 -8.164 326 HG12 VAL 43 2HG1 VAL 43 -9.416 -14.981 -8.095 327 HG13 VAL 43 3HG1 VAL 43 -7.875 -14.728 -7.241 328 HG21 VAL 43 1HG2 VAL 43 -6.534 -13.112 -9.493 329 HG22 VAL 43 2HG2 VAL 43 -5.738 -14.441 -8.618 330 HG23 VAL 43 3HG2 VAL 43 -5.852 -14.487 -10.393 331 H SER 44 H SER 44 -4.996 -16.989 -9.666 332 HA SER 44 HA SER 44 -5.280 -18.458 -12.141 333 HB2 SER 44 1HB SER 44 -5.479 -16.189 -13.052 334 HB3 SER 44 2HB SER 44 -3.991 -15.711 -12.248 335 HG SER 44 HG SER 44 -3.399 -16.238 -14.225 336 H PHE 45 H PHE 45 -3.448 -19.604 -12.696 337 HA PHE 45 HA PHE 45 -0.949 -19.037 -11.220 338 HB2 PHE 45 1HB PHE 45 -2.092 -20.589 -9.726 339 HB3 PHE 45 2HB PHE 45 -2.442 -21.682 -11.055 340 HD1 PHE 45 HD1 PHE 45 0.499 -20.032 -9.429 341 HD2 PHE 45 HD2 PHE 45 -1.076 -23.507 -11.352 342 HE1 PHE 45 HE1 PHE 45 2.620 -21.227 -9.003 343 HE2 PHE 45 HE2 PHE 45 1.044 -24.706 -10.925 344 HZ PHE 45 HZ PHE 45 2.893 -23.564 -9.751 345 H ARG 46 H ARG 46 0.828 -19.433 -12.376 346 HA ARG 46 HA ARG 46 0.522 -21.094 -14.840 347 HB2 ARG 46 1HB ARG 46 0.575 -18.641 -15.350 348 HB3 ARG 46 2HB ARG 46 2.159 -18.548 -14.597 349 HG2 ARG 46 1HG ARG 46 3.056 -20.104 -16.283 350 HG3 ARG 46 2HG ARG 46 1.452 -20.174 -17.052 351 HD2 ARG 46 1HD ARG 46 2.692 -18.622 -18.277 352 HD3 ARG 46 2HD ARG 46 1.599 -17.665 -17.249 353 HE ARG 46 HE ARG 46 4.381 -18.174 -16.374 354 HH11 ARG 46 1HH1 ARG 46 1.863 -15.952 -17.405 355 HH12 ARG 46 2HH1 ARG 46 2.756 -14.524 -16.933 356 HH21 ARG 46 1HH2 ARG 46 5.530 -16.313 -15.765 357 HH22 ARG 46 2HH2 ARG 46 4.832 -14.727 -16.005 358 H LEU 47 H LEU 47 1.690 -22.862 -14.573 359 HA LEU 47 HA LEU 47 4.236 -22.719 -13.069 360 HB2 LEU 47 1HB LEU 47 2.734 -24.568 -12.545 361 HB3 LEU 47 2HB LEU 47 2.684 -25.054 -14.243 362 HG LEU 47 HG LEU 47 5.128 -25.592 -14.110 363 HD11 LEU 47 1HD1 LEU 47 6.159 -25.749 -11.888 364 HD12 LEU 47 2HD1 LEU 47 5.706 -24.075 -12.287 365 HD13 LEU 47 3HD1 LEU 47 4.705 -25.024 -11.162 366 HD21 LEU 47 1HD2 LEU 47 4.794 -27.653 -12.787 367 HD22 LEU 47 2HD2 LEU 47 3.319 -26.956 -12.073 368 HD23 LEU 47 3HD2 LEU 47 3.380 -27.316 -13.815 369 H VAL 48 H VAL 48 6.108 -22.430 -14.032 370 HA VAL 48 HA VAL 48 6.263 -22.558 -16.962 371 HB VAL 48 HB VAL 48 8.356 -21.815 -14.873 372 HG11 VAL 48 1HG1 VAL 48 9.593 -20.841 -16.746 373 HG12 VAL 48 2HG1 VAL 48 9.388 -22.599 -16.926 374 HG13 VAL 48 3HG1 VAL 48 8.381 -21.483 -17.880 375 HG21 VAL 48 1HG2 VAL 48 7.861 -19.497 -15.584 376 HG22 VAL 48 2HG2 VAL 48 6.594 -20.105 -16.677 377 HG23 VAL 48 3HG2 VAL 48 6.414 -20.288 -14.915 378 H TYR 49 H TYR 49 7.188 -24.102 -18.150 379 HA TYR 49 HA TYR 49 8.816 -26.177 -16.794 380 HB2 TYR 49 1HB TYR 49 7.472 -27.999 -17.657 381 HB3 TYR 49 2HB TYR 49 6.437 -26.939 -16.710 382 HD1 TYR 49 HD1 TYR 49 7.179 -28.258 -20.029 383 HD2 TYR 49 HD2 TYR 49 4.790 -25.475 -17.804 384 HE1 TYR 49 HE1 TYR 49 5.634 -28.051 -21.947 385 HE2 TYR 49 HE2 TYR 49 3.245 -25.268 -19.722 386 HH TYR 49 HH TYR 49 2.748 -25.963 -21.768 387 H ALA 50 H ALA 50 9.856 -27.670 -18.304 388 HA ALA 50 HA ALA 50 10.716 -26.177 -20.702 389 HB1 ALA 50 1HB ALA 50 12.506 -27.878 -20.830 390 HB2 ALA 50 2HB ALA 50 12.449 -27.101 -19.230 391 HB3 ALA 50 3HB ALA 50 11.780 -28.734 -19.450 392 H ARG 51 H ARG 51 10.324 -26.719 -22.748 393 HA ARG 51 HA ARG 51 8.231 -28.668 -23.257 394 HB2 ARG 51 1HB ARG 51 9.925 -26.948 -25.094 395 HB3 ARG 51 2HB ARG 51 8.665 -28.027 -25.670 396 HG2 ARG 51 1HG ARG 51 6.980 -26.771 -24.419 397 HG3 ARG 51 2HG ARG 51 8.248 -25.696 -23.781 398 HD2 ARG 51 1HD ARG 51 8.792 -25.002 -26.044 399 HD3 ARG 51 2HD ARG 51 7.519 -26.071 -26.677 400 HE ARG 51 HE ARG 51 6.309 -24.412 -24.785 401 HH11 ARG 51 1HH1 ARG 51 7.984 -24.070 -27.854 402 HH12 ARG 51 2HH1 ARG 51 7.105 -22.630 -28.316 403 HH21 ARG 51 1HH2 ARG 51 5.175 -22.543 -25.396 404 HH22 ARG 51 2HH2 ARG 51 5.515 -21.765 -26.926 405 H GLU 52 H GLU 52 11.701 -28.660 -23.309 406 HA GLU 52 HA GLU 52 12.048 -30.785 -25.224 407 HB2 GLU 52 1HB GLU 52 13.854 -29.697 -23.031 408 HB3 GLU 52 2HB GLU 52 14.354 -30.942 -24.167 409 HG2 GLU 52 1HG GLU 52 14.016 -29.406 -26.038 410 HG3 GLU 52 2HG GLU 52 13.442 -28.160 -24.932 411 H THR 53 H THR 53 11.604 -30.664 -21.721 412 HA THR 53 HA THR 53 11.811 -33.642 -21.659 413 HB THR 53 HB THR 53 12.231 -33.423 -19.237 414 HG1 THR 53 HG1 THR 53 12.707 -31.062 -18.650 415 HG21 THR 53 1HG2 THR 53 14.440 -32.338 -19.353 416 HG22 THR 53 2HG2 THR 53 14.155 -33.355 -20.785 417 HG23 THR 53 3HG2 THR 53 13.995 -31.587 -20.903 418 H GLY 54 H GLY 54 9.755 -30.889 -21.071 419 HA2 GLY 54 1HA GLY 54 7.411 -30.910 -20.814 420 HA3 GLY 54 2HA GLY 54 7.446 -32.655 -20.637 421 H LYS 55 H LYS 55 9.824 -31.248 -18.697 422 HA LYS 55 HA LYS 55 8.100 -31.677 -16.307 423 HB2 LYS 55 1HB LYS 55 11.128 -31.690 -16.623 424 HB3 LYS 55 2HB LYS 55 10.290 -31.879 -15.089 425 HG2 LYS 55 1HG LYS 55 9.224 -33.943 -15.915 426 HG3 LYS 55 2HG LYS 55 10.057 -33.751 -17.464 427 HD2 LYS 55 1HD LYS 55 12.242 -33.875 -16.297 428 HD3 LYS 55 2HD LYS 55 11.400 -34.088 -14.756 429 HE2 LYS 55 1HE LYS 55 10.384 -36.173 -15.579 430 HE3 LYS 55 2HE LYS 55 11.169 -35.955 -17.145 431 HZ1 LYS 55 1HZ LYS 55 12.382 -37.464 -15.753 432 HZ2 LYS 55 2HZ LYS 55 13.292 -36.118 -16.038 433 HZ3 LYS 55 3HZ LYS 55 12.558 -36.323 -14.575 434 HA PRO 56 HA PRO 56 7.988 -27.459 -15.240 435 HB2 PRO 56 1HB PRO 56 8.466 -28.517 -12.430 436 HB3 PRO 56 2HB PRO 56 7.232 -27.384 -12.997 437 HG2 PRO 56 1HG PRO 56 6.511 -29.904 -12.540 438 HG3 PRO 56 2HG PRO 56 5.911 -29.097 -13.991 439 HD2 PRO 56 1HD PRO 56 8.213 -31.070 -13.707 440 HD3 PRO 56 2HD PRO 56 6.928 -30.994 -14.979 441 H LYS 57 H LYS 57 9.473 -25.836 -14.951 442 HA LYS 57 HA LYS 57 12.280 -26.568 -14.631 443 HB2 LYS 57 1HB LYS 57 10.873 -23.892 -14.962 444 HB3 LYS 57 2HB LYS 57 12.617 -24.058 -14.817 445 HG2 LYS 57 1HG LYS 57 12.587 -25.529 -16.853 446 HG3 LYS 57 2HG LYS 57 10.865 -25.164 -17.026 447 HD2 LYS 57 1HD LYS 57 11.406 -22.741 -17.152 448 HD3 LYS 57 2HD LYS 57 13.127 -23.132 -17.026 449 HE2 LYS 57 1HE LYS 57 12.978 -24.458 -19.109 450 HE3 LYS 57 2HE LYS 57 11.261 -24.070 -19.236 451 HZ1 LYS 57 1HZ LYS 57 12.593 -22.633 -20.596 452 HZ2 LYS 57 2HZ LYS 57 11.857 -21.752 -19.411 453 HZ3 LYS 57 3HZ LYS 57 13.462 -22.115 -19.293 454 H GLY 58 H GLY 58 9.715 -25.582 -12.552 455 HA2 GLY 58 1HA GLY 58 10.004 -26.242 -10.223 456 HA3 GLY 58 2HA GLY 58 11.686 -25.756 -10.314 457 H TYR 59 H TYR 59 9.461 -23.661 -11.906 458 HA TYR 59 HA TYR 59 8.879 -22.033 -9.539 459 HB2 TYR 59 1HB TYR 59 9.997 -20.016 -10.334 460 HB3 TYR 59 2HB TYR 59 11.178 -21.302 -10.128 461 HD1 TYR 59 HD1 TYR 59 9.363 -19.226 -12.557 462 HD2 TYR 59 HD2 TYR 59 12.311 -22.298 -12.020 463 HE1 TYR 59 HE1 TYR 59 10.128 -18.900 -14.884 464 HE2 TYR 59 HE2 TYR 59 13.075 -21.971 -14.348 465 HH TYR 59 HH TYR 59 11.620 -19.484 -16.430 466 H GLY 60 H GLY 60 7.574 -20.110 -10.073 467 HA2 GLY 60 1HA GLY 60 6.447 -19.706 -12.669 468 HA3 GLY 60 2HA GLY 60 5.387 -20.775 -11.767 469 H PHE 61 H PHE 61 3.942 -18.835 -12.158 470 HA PHE 61 HA PHE 61 4.266 -16.921 -9.885 471 HB2 PHE 61 1HB PHE 61 3.256 -16.387 -12.702 472 HB3 PHE 61 2HB PHE 61 2.973 -15.287 -11.361 473 HD1 PHE 61 HD1 PHE 61 5.557 -16.797 -13.516 474 HD2 PHE 61 HD2 PHE 61 4.705 -13.877 -10.516 475 HE1 PHE 61 HE1 PHE 61 7.756 -15.742 -13.921 476 HE2 PHE 61 HE2 PHE 61 6.902 -12.818 -10.920 477 HZ PHE 61 HZ PHE 61 8.428 -13.752 -12.622 478 H CYS 62 H CYS 62 2.421 -16.302 -8.779 479 HA CYS 62 HA CYS 62 -0.078 -17.762 -9.485 480 HB2 CYS 62 1HB CYS 62 1.134 -19.046 -7.726 481 HB3 CYS 62 2HB CYS 62 1.134 -17.621 -6.697 482 HG CYS 62 HG CYS 62 -0.547 -19.237 -5.735 483 H GLU 63 H GLU 63 -1.778 -16.474 -9.537 484 HA GLU 63 HA GLU 63 -1.519 -13.780 -8.307 485 HB2 GLU 63 1HB GLU 63 -3.443 -14.852 -10.411 486 HB3 GLU 63 2HB GLU 63 -3.473 -13.213 -9.777 487 HG2 GLU 63 1HG GLU 63 -1.169 -12.867 -10.632 488 HG3 GLU 63 2HG GLU 63 -1.207 -14.488 -11.323 489 H TYR 64 H TYR 64 -2.837 -13.026 -6.762 490 HA TYR 64 HA TYR 64 -5.029 -14.849 -5.859 491 HB2 TYR 64 1HB TYR 64 -3.176 -13.085 -4.211 492 HB3 TYR 64 2HB TYR 64 -4.628 -13.838 -3.567 493 HD1 TYR 64 HD1 TYR 64 -1.317 -14.544 -5.094 494 HD2 TYR 64 HD2 TYR 64 -4.652 -16.096 -2.885 495 HE1 TYR 64 HE1 TYR 64 -0.036 -16.600 -4.602 496 HE2 TYR 64 HE2 TYR 64 -3.371 -18.152 -2.394 497 HH TYR 64 HH TYR 64 -1.477 -19.260 -2.714 498 H GLN 65 H GLN 65 -6.834 -13.820 -4.780 499 HA GLN 65 HA GLN 65 -7.801 -11.610 -6.355 500 HB2 GLN 65 1HB GLN 65 -9.277 -13.394 -5.443 501 HB3 GLN 65 2HB GLN 65 -8.943 -12.834 -3.811 502 HG2 GLN 65 1HG GLN 65 -11.087 -12.022 -4.538 503 HG3 GLN 65 2HG GLN 65 -9.958 -10.649 -4.368 504 HE21 GLN 65 1HE2 GLN 65 -10.784 -9.486 -7.520 505 HE22 GLN 65 2HE2 GLN 65 -10.481 -9.173 -5.843 506 H ASP 66 H ASP 66 -6.648 -11.931 -3.006 507 HA ASP 66 HA ASP 66 -6.770 -8.951 -2.797 508 HB2 ASP 66 1HB ASP 66 -7.006 -11.080 -0.635 509 HB3 ASP 66 2HB ASP 66 -6.826 -9.363 -0.300 510 H GLN 67 H GLN 67 -5.059 -7.840 -1.877 511 HA GLN 67 HA GLN 67 -2.458 -8.934 -2.385 512 HB2 GLN 67 1HB GLN 67 -3.016 -6.496 -2.476 513 HB3 GLN 67 2HB GLN 67 -3.212 -6.492 -0.729 514 HG2 GLN 67 1HG GLN 67 -1.060 -5.606 -1.278 515 HG3 GLN 67 2HG GLN 67 -0.837 -7.198 -0.498 516 HE21 GLN 67 1HE2 GLN 67 1.225 -8.282 -3.053 517 HE22 GLN 67 2HE2 GLN 67 0.852 -8.199 -1.364 518 H GLU 68 H GLU 68 -4.423 -8.610 0.531 519 HA GLU 68 HA GLU 68 -2.339 -9.285 2.386 520 HB2 GLU 68 1HB GLU 68 -4.447 -8.191 3.074 521 HB3 GLU 68 2HB GLU 68 -5.358 -9.621 2.611 522 HG2 GLU 68 1HG GLU 68 -5.083 -9.566 4.998 523 HG3 GLU 68 2HG GLU 68 -4.187 -10.930 4.334 524 H THR 69 H THR 69 -4.629 -11.200 0.492 525 HA THR 69 HA THR 69 -3.904 -13.702 1.789 526 HB THR 69 HB THR 69 -5.213 -14.763 -0.035 527 HG1 THR 69 HG1 THR 69 -4.543 -13.074 -1.611 528 HG21 THR 69 1HG2 THR 69 -7.379 -13.703 0.467 529 HG22 THR 69 2HG2 THR 69 -6.391 -13.859 1.939 530 HG23 THR 69 3HG2 THR 69 -6.536 -12.283 1.127 531 H ALA 70 H ALA 70 -2.806 -11.872 -1.007 532 HA ALA 70 HA ALA 70 -1.042 -13.905 -2.016 533 HB1 ALA 70 1HB ALA 70 0.095 -12.029 -3.158 534 HB2 ALA 70 2HB ALA 70 -1.672 -11.947 -3.355 535 HB3 ALA 70 3HB ALA 70 -0.856 -10.876 -2.193 536 H LEU 71 H LEU 71 -0.618 -11.246 0.316 537 HA LEU 71 HA LEU 71 2.150 -11.843 0.843 538 HB2 LEU 71 1HB LEU 71 0.042 -10.352 2.440 539 HB3 LEU 71 2HB LEU 71 1.738 -10.461 2.920 540 HG LEU 71 HG LEU 71 0.756 -9.208 0.332 541 HD11 LEU 71 1HD1 LEU 71 1.267 -7.074 1.433 542 HD12 LEU 71 2HD1 LEU 71 -0.017 -7.963 2.285 543 HD13 LEU 71 3HD1 LEU 71 1.637 -7.942 2.942 544 HD21 LEU 71 1HD2 LEU 71 3.069 -8.344 0.231 545 HD22 LEU 71 2HD2 LEU 71 3.466 -9.229 1.724 546 HD23 LEU 71 3HD2 LEU 71 3.051 -10.123 0.242 547 H SER 72 H SER 72 -0.921 -12.866 2.292 548 HA SER 72 HA SER 72 0.192 -14.384 4.437 549 HB2 SER 72 1HB SER 72 -2.358 -14.773 2.837 550 HB3 SER 72 2HB SER 72 -1.969 -15.652 4.308 551 HG SER 72 HG SER 72 -2.501 -12.945 3.922 552 H ALA 73 H ALA 73 -0.595 -15.251 1.067 553 HA ALA 73 HA ALA 73 0.212 -17.963 1.200 554 HB1 ALA 73 1HB ALA 73 0.529 -17.782 -1.247 555 HB2 ALA 73 2HB ALA 73 -0.992 -17.022 -0.721 556 HB3 ALA 73 3HB ALA 73 0.415 -16.011 -1.122 557 H MET 74 H MET 74 2.102 -15.029 0.453 558 HA MET 74 HA MET 74 4.615 -16.263 0.099 559 HB2 MET 74 1HB MET 74 4.259 -13.893 -0.357 560 HB3 MET 74 2HB MET 74 3.901 -13.576 1.334 561 HG2 MET 74 1HG MET 74 6.252 -14.294 1.887 562 HG3 MET 74 2HG MET 74 6.570 -14.381 0.153 563 HE1 MET 74 1HE MET 74 5.596 -10.514 2.493 564 HE2 MET 74 2HE MET 74 4.404 -11.820 2.280 565 HE3 MET 74 3HE MET 74 5.878 -12.106 3.237 566 H ARG 75 H ARG 75 3.047 -15.158 3.111 567 HA ARG 75 HA ARG 75 5.389 -15.794 4.698 568 HB2 ARG 75 1HB ARG 75 2.537 -15.090 5.460 569 HB3 ARG 75 2HB ARG 75 3.824 -15.342 6.630 570 HG2 ARG 75 1HG ARG 75 5.055 -13.446 5.779 571 HG3 ARG 75 2HG ARG 75 3.889 -13.241 4.450 572 HD2 ARG 75 1HD ARG 75 3.184 -13.082 7.368 573 HD3 ARG 75 2HD ARG 75 3.582 -11.683 6.345 574 HE ARG 75 HE ARG 75 1.513 -13.290 5.176 575 HH11 ARG 75 1HH1 ARG 75 2.139 -10.882 7.656 576 HH12 ARG 75 2HH1 ARG 75 0.507 -10.254 7.636 577 HH21 ARG 75 1HH2 ARG 75 -0.603 -12.466 5.159 578 HH22 ARG 75 2HH2 ARG 75 -1.046 -11.150 6.223 579 H ASN 76 H ASN 76 2.631 -17.549 3.578 580 HA ASN 76 HA ASN 76 2.912 -19.586 5.716 581 HB2 ASN 76 1HB ASN 76 0.857 -19.140 3.536 582 HB3 ASN 76 2HB ASN 76 0.893 -20.595 4.521 583 HD21 ASN 76 1HD2 ASN 76 -1.432 -18.072 5.987 584 HD22 ASN 76 2HD2 ASN 76 -1.256 -18.797 4.424 585 H LEU 77 H LEU 77 2.987 -19.351 2.153 586 HA LEU 77 HA LEU 77 3.534 -22.170 1.844 587 HB2 LEU 77 1HB LEU 77 3.758 -19.823 -0.070 588 HB3 LEU 77 2HB LEU 77 4.019 -21.505 -0.543 589 HG LEU 77 HG LEU 77 1.414 -20.397 0.563 590 HD11 LEU 77 1HD1 LEU 77 0.615 -20.606 -1.748 591 HD12 LEU 77 2HD1 LEU 77 1.959 -19.447 -1.620 592 HD13 LEU 77 3HD1 LEU 77 2.249 -21.078 -2.270 593 HD21 LEU 77 1HD2 LEU 77 0.515 -22.572 -0.191 594 HD22 LEU 77 2HD2 LEU 77 2.148 -23.074 -0.692 595 HD23 LEU 77 3HD2 LEU 77 1.792 -22.795 1.030 596 H ASN 78 H ASN 78 5.502 -19.253 2.040 597 HA ASN 78 HA ASN 78 7.941 -20.468 1.113 598 HB2 ASN 78 1HB ASN 78 7.510 -18.007 1.194 599 HB3 ASN 78 2HB ASN 78 7.588 -18.076 2.949 600 HD21 ASN 78 1HD2 ASN 78 10.896 -17.325 1.091 601 HD22 ASN 78 2HD2 ASN 78 9.277 -16.908 0.639 602 H GLY 79 H GLY 79 8.852 -22.152 2.009 603 HA2 GLY 79 1HA GLY 79 10.241 -22.888 3.934 604 HA3 GLY 79 2HA GLY 79 9.011 -22.237 5.001 605 H ARG 80 H ARG 80 7.058 -23.350 2.770 606 HA ARG 80 HA ARG 80 6.359 -25.759 4.153 607 HB2 ARG 80 1HB ARG 80 4.780 -24.350 2.814 608 HB3 ARG 80 2HB ARG 80 5.572 -24.904 1.346 609 HG2 ARG 80 1HG ARG 80 4.844 -27.165 1.716 610 HG3 ARG 80 2HG ARG 80 4.219 -26.747 3.330 611 HD2 ARG 80 1HD ARG 80 2.671 -25.152 2.232 612 HD3 ARG 80 2HD ARG 80 3.217 -25.788 0.663 613 HE ARG 80 HE ARG 80 2.479 -28.027 2.057 614 HH11 ARG 80 1HH1 ARG 80 0.889 -25.001 1.248 615 HH12 ARG 80 2HH1 ARG 80 -0.710 -25.709 1.201 616 HH21 ARG 80 1HH2 ARG 80 0.398 -28.934 1.993 617 HH22 ARG 80 2HH2 ARG 80 -0.989 -27.935 1.623 618 H GLU 81 H GLU 81 7.755 -27.413 4.230 619 HA GLU 81 HA GLU 81 9.541 -27.906 1.952 620 HB2 GLU 81 1HB GLU 81 10.378 -27.966 4.299 621 HB3 GLU 81 2HB GLU 81 9.319 -29.328 4.636 622 HG2 GLU 81 1HG GLU 81 10.517 -30.686 2.978 623 HG3 GLU 81 2HG GLU 81 11.567 -29.319 2.611 624 H PHE 82 H PHE 82 9.223 -29.321 0.393 625 HA PHE 82 HA PHE 82 7.291 -31.542 0.882 626 HB2 PHE 82 1HB PHE 82 8.355 -30.376 -1.720 627 HB3 PHE 82 2HB PHE 82 7.301 -31.777 -1.618 628 HD1 PHE 82 HD1 PHE 82 7.451 -28.247 -1.883 629 HD2 PHE 82 HD2 PHE 82 5.034 -31.440 -0.395 630 HE1 PHE 82 HE1 PHE 82 5.477 -26.759 -1.902 631 HE2 PHE 82 HE2 PHE 82 3.057 -29.955 -0.416 632 HZ PHE 82 HZ PHE 82 3.280 -27.613 -1.168 633 H SER 83 H SER 83 7.870 -33.547 -0.510 634 HA SER 83 HA SER 83 10.295 -34.574 0.667 635 HB2 SER 83 1HB SER 83 9.701 -36.656 -0.396 636 HB3 SER 83 2HB SER 83 8.244 -35.925 0.260 637 HG SER 83 HG SER 83 9.120 -36.116 -2.381 638 H GLY 84 H GLY 84 9.679 -32.813 -2.166 639 HA2 GLY 84 1HA GLY 84 12.130 -33.905 -3.498 640 HA3 GLY 84 2HA GLY 84 10.804 -33.121 -4.338 641 H ARG 85 H ARG 85 10.349 -30.893 -2.737 642 HA ARG 85 HA ARG 85 12.938 -29.446 -2.677 643 HB2 ARG 85 1HB ARG 85 10.537 -28.608 -4.337 644 HB3 ARG 85 2HB ARG 85 11.914 -27.573 -3.990 645 HG2 ARG 85 1HG ARG 85 12.144 -30.225 -5.427 646 HG3 ARG 85 2HG ARG 85 11.944 -28.654 -6.240 647 HD2 ARG 85 1HD ARG 85 13.985 -27.867 -5.110 648 HD3 ARG 85 2HD ARG 85 14.202 -29.501 -4.443 649 HE ARG 85 HE ARG 85 14.616 -28.632 -7.202 650 HH11 ARG 85 1HH1 ARG 85 14.267 -31.325 -4.974 651 HH12 ARG 85 2HH1 ARG 85 15.058 -32.469 -6.035 652 HH21 ARG 85 1HH2 ARG 85 15.641 -30.126 -8.571 653 HH22 ARG 85 2HH2 ARG 85 15.836 -31.791 -8.072 654 H ALA 86 H ALA 86 12.955 -27.580 -1.414 655 HA ALA 86 HA ALA 86 10.700 -27.350 0.475 656 HB1 ALA 86 1HB ALA 86 12.194 -25.805 1.700 657 HB2 ALA 86 2HB ALA 86 12.981 -27.369 1.381 658 HB3 ALA 86 3HB ALA 86 13.396 -25.947 0.397 659 H LEU 87 H LEU 87 9.031 -26.132 -0.049 660 HA LEU 87 HA LEU 87 9.051 -24.535 -2.395 661 HB2 LEU 87 1HB LEU 87 7.053 -25.645 -1.332 662 HB3 LEU 87 2HB LEU 87 7.071 -24.383 -0.096 663 HG LEU 87 HG LEU 87 6.747 -22.688 -1.949 664 HD11 LEU 87 1HD1 LEU 87 5.925 -23.535 -4.101 665 HD12 LEU 87 2HD1 LEU 87 7.598 -24.053 -3.786 666 HD13 LEU 87 3HD1 LEU 87 6.254 -25.201 -3.572 667 HD21 LEU 87 1HD2 LEU 87 4.342 -23.209 -2.180 668 HD22 LEU 87 2HD2 LEU 87 4.648 -24.872 -1.624 669 HD23 LEU 87 3HD2 LEU 87 4.903 -23.502 -0.517 670 H ARG 88 H ARG 88 9.627 -22.520 -2.802 671 HA ARG 88 HA ARG 88 9.766 -20.621 -0.497 672 HB2 ARG 88 1HB ARG 88 12.016 -21.100 -1.283 673 HB3 ARG 88 2HB ARG 88 11.551 -20.786 -2.948 674 HG2 ARG 88 1HG ARG 88 11.169 -18.423 -2.414 675 HG3 ARG 88 2HG ARG 88 11.616 -18.735 -0.720 676 HD2 ARG 88 1HD ARG 88 13.828 -19.331 -1.349 677 HD3 ARG 88 2HD ARG 88 13.408 -19.263 -3.076 678 HE ARG 88 HE ARG 88 12.804 -16.755 -2.053 679 HH11 ARG 88 1HH1 ARG 88 15.656 -18.789 -2.321 680 HH12 ARG 88 2HH1 ARG 88 16.763 -17.438 -2.421 681 HH21 ARG 88 1HH2 ARG 88 14.251 -15.010 -2.184 682 HH22 ARG 88 2HH2 ARG 88 15.969 -15.299 -2.343 683 H VAL 89 H VAL 89 8.345 -19.042 -0.604 684 HA VAL 89 HA VAL 89 7.507 -18.091 -3.311 685 HB VAL 89 HB VAL 89 5.782 -18.330 -0.808 686 HG11 VAL 89 1HG1 VAL 89 3.946 -17.590 -2.247 687 HG12 VAL 89 2HG1 VAL 89 5.217 -16.354 -2.100 688 HG13 VAL 89 3HG1 VAL 89 5.096 -17.334 -3.581 689 HG21 VAL 89 1HG2 VAL 89 4.534 -19.999 -2.142 690 HG22 VAL 89 2HG2 VAL 89 5.708 -19.815 -3.467 691 HG23 VAL 89 3HG2 VAL 89 6.226 -20.498 -1.907 692 H ASP 90 H ASP 90 7.864 -16.020 -3.689 693 HA ASP 90 HA ASP 90 8.073 -14.180 -1.345 694 HB2 ASP 90 1HB ASP 90 9.840 -14.225 -3.824 695 HB3 ASP 90 2HB ASP 90 9.849 -12.947 -2.616 696 H ASN 91 H ASN 91 7.292 -12.117 -1.589 697 HA ASN 91 HA ASN 91 5.148 -11.704 -3.395 698 HB2 ASN 91 1HB ASN 91 5.520 -10.477 -1.243 699 HB3 ASN 91 2HB ASN 91 6.821 -9.581 -2.015 700 HD21 ASN 91 1HD2 ASN 91 4.574 -7.135 -2.959 701 HD22 ASN 91 2HD2 ASN 91 6.068 -7.577 -2.202 702 H ALA 92 H ALA 92 4.980 -11.114 -5.422 703 HA ALA 92 HA ALA 92 7.348 -10.999 -7.038 704 HB1 ALA 92 1HB ALA 92 5.783 -10.547 -8.899 705 HB2 ALA 92 2HB ALA 92 5.229 -11.901 -7.886 706 HB3 ALA 92 3HB ALA 92 4.470 -10.301 -7.725 707 H ALA 93 H ALA 93 8.387 -9.361 -8.047 708 HA ALA 93 HA ALA 93 8.230 -6.761 -6.824 709 HB1 ALA 93 1HB ALA 93 9.922 -6.121 -8.511 710 HB2 ALA 93 2HB ALA 93 10.337 -7.655 -7.710 711 HB3 ALA 93 3HB ALA 93 9.655 -7.664 -9.353 712 H SER 94 H SER 94 7.620 -4.778 -7.679 713 HA SER 94 HA SER 94 5.160 -4.834 -9.127 714 HB2 SER 94 1HB SER 94 5.279 -2.419 -9.063 715 HB3 SER 94 2HB SER 94 5.817 -3.061 -7.519 716 HG SER 94 HG SER 94 7.307 -1.981 -9.621 717 H GLU 95 H GLU 95 8.505 -4.406 -10.124 718 HA GLU 95 HA GLU 95 7.865 -3.502 -12.801 719 HB2 GLU 95 1HB GLU 95 10.387 -4.715 -11.605 720 HB3 GLU 95 2HB GLU 95 10.278 -4.118 -13.255 721 HG2 GLU 95 1HG GLU 95 9.895 -2.483 -10.738 722 HG3 GLU 95 2HG GLU 95 11.320 -2.491 -11.774 723 H LYS 96 H LYS 96 8.512 -6.646 -11.292 724 HA LYS 96 HA LYS 96 8.357 -8.171 -13.721 725 HB2 LYS 96 1HB LYS 96 7.843 -8.897 -10.814 726 HB3 LYS 96 2HB LYS 96 7.773 -10.070 -12.122 727 HG2 LYS 96 1HG LYS 96 10.131 -9.638 -12.662 728 HG3 LYS 96 2HG LYS 96 10.208 -8.422 -11.379 729 HD2 LYS 96 1HD LYS 96 9.641 -10.162 -9.704 730 HD3 LYS 96 2HD LYS 96 9.589 -11.375 -10.992 731 HE2 LYS 96 1HE LYS 96 11.962 -10.954 -11.504 732 HE3 LYS 96 2HE LYS 96 12.023 -9.707 -10.255 733 HZ1 LYS 96 1HZ LYS 96 12.884 -11.787 -9.468 734 HZ2 LYS 96 2HZ LYS 96 11.520 -11.395 -8.626 735 HZ3 LYS 96 3HZ LYS 96 11.464 -12.560 -9.793 736 H ASN 97 H ASN 97 5.935 -7.016 -11.410 737 HA ASN 97 HA ASN 97 3.705 -8.378 -12.585 738 HB2 ASN 97 1HB ASN 97 3.920 -5.825 -10.966 739 HB3 ASN 97 2HB ASN 97 2.382 -6.490 -11.500 740 HD21 ASN 97 1HD2 ASN 97 3.245 -7.661 -8.049 741 HD22 ASN 97 2HD2 ASN 97 3.184 -6.105 -8.809 742 H LYS 98 H LYS 98 5.228 -5.246 -13.262 743 HA LYS 98 HA LYS 98 3.384 -4.352 -15.224 744 HB2 LYS 98 1HB LYS 98 6.371 -3.906 -14.895 745 HB3 LYS 98 2HB LYS 98 5.433 -3.127 -16.161 746 HG2 LYS 98 1HG LYS 98 4.044 -2.003 -14.499 747 HG3 LYS 98 2HG LYS 98 4.885 -2.850 -13.192 748 HD2 LYS 98 1HD LYS 98 7.021 -1.785 -13.905 749 HD3 LYS 98 2HD LYS 98 6.141 -0.901 -15.161 750 HE2 LYS 98 1HE LYS 98 4.781 0.223 -13.459 751 HE3 LYS 98 2HE LYS 98 5.564 -0.710 -12.181 752 HZ1 LYS 98 1HZ LYS 98 6.513 1.468 -12.390 753 HZ2 LYS 98 2HZ LYS 98 7.643 0.330 -12.775 754 HZ3 LYS 98 3HZ LYS 98 6.911 1.203 -13.968 755 H GLU 99 H GLU 99 6.201 -6.504 -15.486 756 HA GLU 99 HA GLU 99 6.065 -6.799 -18.335 757 HB2 GLU 99 1HB GLU 99 7.211 -8.595 -16.163 758 HB3 GLU 99 2HB GLU 99 7.390 -8.918 -17.882 759 HG2 GLU 99 1HG GLU 99 8.401 -6.464 -16.427 760 HG3 GLU 99 2HG GLU 99 9.369 -7.849 -16.926 761 H GLU 100 H GLU 100 4.514 -8.496 -15.643 762 HA GLU 100 HA GLU 100 3.247 -10.506 -17.264 763 HB2 GLU 100 1HB GLU 100 2.541 -9.330 -14.549 764 HB3 GLU 100 2HB GLU 100 1.659 -10.662 -15.283 765 HG2 GLU 100 1HG GLU 100 4.606 -10.684 -14.594 766 HG3 GLU 100 2HG GLU 100 3.318 -11.398 -13.626 767 H LEU 101 H LEU 101 2.377 -7.215 -16.305 768 HA LEU 101 HA LEU 101 -0.298 -7.326 -17.378 769 HB2 LEU 101 1HB LEU 101 1.564 -5.014 -16.743 770 HB3 LEU 101 2HB LEU 101 -0.100 -4.801 -17.296 771 HG LEU 101 HG LEU 101 0.714 -6.226 -14.738 772 HD11 LEU 101 1HD1 LEU 101 -0.157 -4.219 -13.623 773 HD12 LEU 101 2HD1 LEU 101 1.233 -3.841 -14.668 774 HD13 LEU 101 3HD1 LEU 101 -0.419 -3.453 -15.208 775 HD21 LEU 101 1HD2 LEU 101 -1.705 -6.095 -14.245 776 HD22 LEU 101 2HD2 LEU 101 -1.990 -5.354 -15.839 777 HD23 LEU 101 3HD2 LEU 101 -1.404 -7.031 -15.729 778 H LYS 102 H LYS 102 2.875 -6.605 -18.713 779 HA LYS 102 HA LYS 102 1.986 -5.599 -21.240 780 HB2 LYS 102 1HB LYS 102 4.505 -7.070 -20.391 781 HB3 LYS 102 2HB LYS 102 4.254 -6.489 -22.031 782 HG2 LYS 102 1HG LYS 102 4.081 -4.182 -21.215 783 HG3 LYS 102 2HG LYS 102 4.273 -4.747 -19.549 784 HD2 LYS 102 1HD LYS 102 6.504 -5.679 -20.142 785 HD3 LYS 102 2HD LYS 102 6.311 -5.052 -21.786 786 HE2 LYS 102 1HE LYS 102 6.175 -2.756 -20.917 787 HE3 LYS 102 2HE LYS 102 6.302 -3.357 -19.261 788 HZ1 LYS 102 1HZ LYS 102 8.403 -2.584 -20.083 789 HZ2 LYS 102 2HZ LYS 102 8.480 -4.207 -19.799 790 HZ3 LYS 102 3HZ LYS 102 8.362 -3.644 -21.345 791 H SER 103 H SER 103 2.621 -8.896 -20.062 792 HA SER 103 HA SER 103 1.925 -10.127 -22.595 793 HB2 SER 103 1HB SER 103 2.098 -12.207 -21.418 794 HB3 SER 103 2HB SER 103 3.392 -11.167 -20.845 795 HG SER 103 HG SER 103 1.538 -10.572 -19.272 796 H LEU 104 H LEU 104 0.175 -9.081 -19.749 797 HA LEU 104 HA LEU 104 -2.282 -10.448 -20.303 798 HB2 LEU 104 1HB LEU 104 -1.791 -9.369 -18.144 799 HB3 LEU 104 2HB LEU 104 -1.781 -7.785 -18.925 800 HG LEU 104 HG LEU 104 -4.184 -8.022 -19.446 801 HD11 LEU 104 1HD1 LEU 104 -5.452 -9.894 -18.490 802 HD12 LEU 104 2HD1 LEU 104 -4.248 -10.453 -19.674 803 HD13 LEU 104 3HD1 LEU 104 -3.935 -10.637 -17.932 804 HD21 LEU 104 1HD2 LEU 104 -4.986 -7.847 -17.114 805 HD22 LEU 104 2HD2 LEU 104 -3.462 -8.561 -16.536 806 HD23 LEU 104 3HD2 LEU 104 -3.452 -6.969 -17.332 807 H GLY 105 H GLY 105 -1.082 -7.202 -21.200 808 HA2 GLY 105 1HA GLY 105 -1.427 -6.706 -23.646 809 HA3 GLY 105 2HA GLY 105 -3.085 -7.236 -23.433 810 H THR 106 H THR 106 -1.261 -5.332 -21.069 811 HA THR 106 HA THR 106 -3.327 -3.242 -21.178 812 HB THR 106 HB THR 106 -2.195 -2.295 -19.218 813 HG1 THR 106 HG1 THR 106 -0.212 -4.243 -19.850 814 HG21 THR 106 1HG2 THR 106 -2.404 -4.209 -17.680 815 HG22 THR 106 2HG2 THR 106 -3.734 -4.194 -18.862 816 HG23 THR 106 3HG2 THR 106 -2.378 -5.328 -19.063 817 H GLY 107 H GLY 107 -2.566 -0.919 -21.004 818 HA2 GLY 107 1HA GLY 107 -0.151 0.005 -22.138 819 HA3 GLY 107 2HA GLY 107 -1.252 -0.257 -23.477 Start of MODEL 6 1 H MET 1 1H MET 1 2.531 17.073 -7.865 2 HA MET 1 HA MET 1 0.620 18.290 -7.178 3 HB2 MET 1 1HB MET 1 1.200 18.155 -9.575 4 HB3 MET 1 2HB MET 1 0.281 16.665 -9.731 5 HG2 MET 1 1HG MET 1 -1.785 17.924 -9.105 6 HG3 MET 1 2HG MET 1 -0.831 19.410 -9.086 7 HE1 MET 1 1HE MET 1 -1.849 16.891 -12.822 8 HE2 MET 1 2HE MET 1 -0.862 16.239 -11.491 9 HE3 MET 1 3HE MET 1 -2.565 16.673 -11.207 10 H ALA 2 H ALA 2 -0.806 15.483 -8.808 11 HA ALA 2 HA ALA 2 -3.165 15.648 -7.180 12 HB1 ALA 2 1HB ALA 2 -3.837 13.570 -8.342 13 HB2 ALA 2 2HB ALA 2 -3.223 14.794 -9.480 14 HB3 ALA 2 3HB ALA 2 -2.194 13.422 -9.008 15 H GLY 3 H GLY 3 -0.273 13.618 -7.087 16 HA2 GLY 3 1HA GLY 3 0.581 12.423 -5.261 17 HA3 GLY 3 2HA GLY 3 -0.811 12.902 -4.307 18 H LEU 4 H LEU 4 -1.246 11.465 -7.471 19 HA LEU 4 HA LEU 4 -2.395 9.061 -6.125 20 HB2 LEU 4 1HB LEU 4 -3.051 10.237 -8.850 21 HB3 LEU 4 2HB LEU 4 -3.835 8.841 -8.102 22 HG LEU 4 HG LEU 4 -3.955 11.695 -7.062 23 HD11 LEU 4 1HD1 LEU 4 -6.289 11.603 -7.817 24 HD12 LEU 4 2HD1 LEU 4 -5.152 11.403 -9.170 25 HD13 LEU 4 3HD1 LEU 4 -6.003 9.988 -8.506 26 HD21 LEU 4 1HD2 LEU 4 -5.663 10.768 -5.534 27 HD22 LEU 4 2HD2 LEU 4 -5.368 9.140 -6.190 28 HD23 LEU 4 3HD2 LEU 4 -4.086 9.980 -5.285 29 H THR 5 H THR 5 -2.122 7.008 -7.054 30 HA THR 5 HA THR 5 0.469 6.722 -8.425 31 HB THR 5 HB THR 5 0.205 4.315 -7.994 32 HG1 THR 5 HG1 THR 5 -1.849 3.734 -8.048 33 HG21 THR 5 1HG2 THR 5 0.123 4.377 -5.533 34 HG22 THR 5 2HG2 THR 5 1.070 5.742 -6.172 35 HG23 THR 5 3HG2 THR 5 -0.592 6.005 -5.593 36 H VAL 6 H VAL 6 0.640 5.022 -10.157 37 HA VAL 6 HA VAL 6 -1.170 5.793 -12.313 38 HB VAL 6 HB VAL 6 1.145 3.810 -12.237 39 HG11 VAL 6 1HG1 VAL 6 1.091 3.936 -14.679 40 HG12 VAL 6 2HG1 VAL 6 -0.414 3.258 -14.014 41 HG13 VAL 6 3HG1 VAL 6 -0.376 4.940 -14.595 42 HG21 VAL 6 1HG2 VAL 6 2.375 5.622 -13.389 43 HG22 VAL 6 2HG2 VAL 6 0.945 6.674 -13.256 44 HG23 VAL 6 3HG2 VAL 6 1.803 6.149 -11.788 45 H ARG 7 H ARG 7 -2.959 4.796 -12.911 46 HA ARG 7 HA ARG 7 -3.754 2.296 -11.643 47 HB2 ARG 7 1HB ARG 7 -5.387 4.080 -12.150 48 HB3 ARG 7 2HB ARG 7 -5.068 3.894 -13.868 49 HG2 ARG 7 1HG ARG 7 -5.964 1.618 -13.814 50 HG3 ARG 7 2HG ARG 7 -6.254 1.770 -12.064 51 HD2 ARG 7 1HD ARG 7 -7.775 3.611 -12.471 52 HD3 ARG 7 2HD ARG 7 -7.478 3.477 -14.219 53 HE ARG 7 HE ARG 7 -8.308 0.958 -13.250 54 HH11 ARG 7 1HH1 ARG 7 -9.576 4.195 -13.761 55 HH12 ARG 7 2HH1 ARG 7 -11.218 3.648 -14.010 56 HH21 ARG 7 1HH2 ARG 7 -10.445 0.260 -13.575 57 HH22 ARG 7 2HH2 ARG 7 -11.711 1.421 -13.904 58 H ASP 8 H ASP 8 -3.133 0.364 -12.280 59 HA ASP 8 HA ASP 8 -3.170 -0.312 -15.137 60 HB2 ASP 8 1HB ASP 8 -0.860 0.591 -14.747 61 HB3 ASP 8 2HB ASP 8 -0.609 -0.646 -13.523 62 HA PRO 9 HA PRO 9 -5.004 -3.668 -12.846 63 HB2 PRO 9 1HB PRO 9 -5.115 -4.653 -15.729 64 HB3 PRO 9 2HB PRO 9 -6.361 -4.746 -14.477 65 HG2 PRO 9 1HG PRO 9 -6.586 -2.853 -16.328 66 HG3 PRO 9 2HG PRO 9 -6.901 -2.431 -14.642 67 HD2 PRO 9 1HD PRO 9 -4.416 -1.919 -16.317 68 HD3 PRO 9 2HD PRO 9 -5.228 -0.835 -15.117 69 H ALA 10 H ALA 10 -2.561 -3.880 -15.427 70 HA ALA 10 HA ALA 10 -1.768 -6.574 -14.989 71 HB1 ALA 10 1HB ALA 10 0.310 -5.937 -16.169 72 HB2 ALA 10 2HB ALA 10 -1.136 -5.312 -16.997 73 HB3 ALA 10 3HB ALA 10 -0.135 -4.222 -16.011 74 H VAL 11 H VAL 11 -0.602 -3.526 -13.570 75 HA VAL 11 HA VAL 11 1.413 -4.726 -11.926 76 HB VAL 11 HB VAL 11 -0.191 -2.156 -11.601 77 HG11 VAL 11 1HG1 VAL 11 1.519 -1.467 -9.992 78 HG12 VAL 11 2HG1 VAL 11 0.610 -2.890 -9.430 79 HG13 VAL 11 3HG1 VAL 11 2.255 -3.084 -10.083 80 HG21 VAL 11 1HG2 VAL 11 1.897 -1.109 -12.418 81 HG22 VAL 11 2HG2 VAL 11 2.637 -2.719 -12.585 82 HG23 VAL 11 3HG2 VAL 11 1.250 -2.266 -13.605 83 H ASP 12 H ASP 12 -2.013 -3.915 -11.350 84 HA ASP 12 HA ASP 12 -2.121 -4.651 -8.620 85 HB2 ASP 12 1HB ASP 12 -4.219 -4.715 -10.817 86 HB3 ASP 12 2HB ASP 12 -4.590 -5.124 -9.148 87 H ARG 13 H ARG 13 -2.376 -6.609 -11.562 88 HA ARG 13 HA ARG 13 -3.138 -9.039 -10.239 89 HB2 ARG 13 1HB ARG 13 -1.777 -8.491 -12.892 90 HB3 ARG 13 2HB ARG 13 -2.198 -10.110 -12.354 91 HG2 ARG 13 1HG ARG 13 -4.589 -9.366 -12.193 92 HG3 ARG 13 2HG ARG 13 -4.092 -7.824 -12.932 93 HD2 ARG 13 1HD ARG 13 -4.928 -9.224 -14.642 94 HD3 ARG 13 2HD ARG 13 -3.162 -9.136 -14.828 95 HE ARG 13 HE ARG 13 -3.955 -11.390 -13.235 96 HH11 ARG 13 1HH1 ARG 13 -3.706 -10.220 -16.538 97 HH12 ARG 13 2HH1 ARG 13 -3.548 -11.820 -17.226 98 HH21 ARG 13 1HH2 ARG 13 -3.749 -13.462 -14.139 99 HH22 ARG 13 2HH2 ARG 13 -3.572 -13.656 -15.869 100 H SER 14 H SER 14 -0.015 -7.565 -11.038 101 HA SER 14 HA SER 14 1.534 -9.854 -10.158 102 HB2 SER 14 1HB SER 14 3.446 -8.441 -10.460 103 HB3 SER 14 2HB SER 14 2.333 -8.114 -11.779 104 HG SER 14 HG SER 14 1.556 -6.484 -10.040 105 H LEU 15 H LEU 15 0.133 -7.039 -8.628 106 HA LEU 15 HA LEU 15 1.644 -7.270 -6.168 107 HB2 LEU 15 1HB LEU 15 -0.984 -5.921 -6.862 108 HB3 LEU 15 2HB LEU 15 -0.253 -5.847 -5.256 109 HG LEU 15 HG LEU 15 1.047 -4.809 -7.799 110 HD11 LEU 15 1HD1 LEU 15 0.499 -2.591 -6.900 111 HD12 LEU 15 2HD1 LEU 15 -0.965 -3.549 -7.226 112 HD13 LEU 15 3HD1 LEU 15 -0.382 -3.354 -5.556 113 HD21 LEU 15 1HD2 LEU 15 2.614 -3.752 -6.207 114 HD22 LEU 15 2HD2 LEU 15 1.763 -4.531 -4.851 115 HD23 LEU 15 3HD2 LEU 15 2.635 -5.524 -6.044 116 H ARG 16 H ARG 16 -1.382 -8.608 -7.404 117 HA ARG 16 HA ARG 16 -1.792 -10.060 -4.852 118 HB2 ARG 16 1HB ARG 16 -3.938 -10.656 -5.679 119 HB3 ARG 16 2HB ARG 16 -3.710 -8.964 -6.093 120 HG2 ARG 16 1HG ARG 16 -3.053 -9.682 -8.405 121 HG3 ARG 16 2HG ARG 16 -3.503 -11.343 -7.948 122 HD2 ARG 16 1HD ARG 16 -5.752 -10.489 -7.353 123 HD3 ARG 16 2HD ARG 16 -5.271 -8.914 -8.025 124 HE ARG 16 HE ARG 16 -4.788 -10.996 -9.914 125 HH11 ARG 16 1HH1 ARG 16 -7.380 -9.126 -8.457 126 HH12 ARG 16 2HH1 ARG 16 -8.442 -9.286 -9.839 127 HH21 ARG 16 1HH2 ARG 16 -6.175 -11.197 -11.701 128 HH22 ARG 16 2HH2 ARG 16 -7.760 -10.458 -11.675 129 H SER 17 H SER 17 0.551 -10.791 -6.075 130 HA SER 17 HA SER 17 0.001 -13.601 -6.734 131 HB2 SER 17 1HB SER 17 -0.152 -12.533 -8.932 132 HB3 SER 17 2HB SER 17 1.397 -11.742 -8.686 133 HG SER 17 HG SER 17 2.341 -13.781 -8.537 134 H VAL 18 H VAL 18 1.710 -14.966 -6.355 135 HA VAL 18 HA VAL 18 4.197 -13.660 -5.331 136 HB VAL 18 HB VAL 18 4.403 -15.553 -3.738 137 HG11 VAL 18 1HG1 VAL 18 2.621 -14.876 -2.204 138 HG12 VAL 18 2HG1 VAL 18 3.383 -13.478 -2.998 139 HG13 VAL 18 3HG1 VAL 18 1.786 -14.050 -3.539 140 HG21 VAL 18 1HG2 VAL 18 2.464 -17.050 -3.390 141 HG22 VAL 18 2HG2 VAL 18 1.632 -16.288 -4.767 142 HG23 VAL 18 3HG2 VAL 18 3.123 -17.222 -5.034 143 H PHE 19 H PHE 19 6.162 -14.718 -5.699 144 HA PHE 19 HA PHE 19 6.109 -16.534 -8.038 145 HB2 PHE 19 1HB PHE 19 7.611 -14.604 -8.160 146 HB3 PHE 19 2HB PHE 19 8.387 -15.065 -6.653 147 HD1 PHE 19 HD1 PHE 19 7.577 -16.636 -9.958 148 HD2 PHE 19 HD2 PHE 19 10.426 -16.095 -6.821 149 HE1 PHE 19 HE1 PHE 19 9.218 -17.989 -11.218 150 HE2 PHE 19 HE2 PHE 19 12.071 -17.445 -8.079 151 HZ PHE 19 HZ PHE 19 11.465 -18.394 -10.278 152 H VAL 20 H VAL 20 6.429 -18.638 -7.919 153 HA VAL 20 HA VAL 20 7.335 -19.734 -5.292 154 HB VAL 20 HB VAL 20 5.612 -21.044 -7.439 155 HG11 VAL 20 1HG1 VAL 20 5.243 -22.795 -5.770 156 HG12 VAL 20 2HG1 VAL 20 6.957 -22.660 -6.226 157 HG13 VAL 20 3HG1 VAL 20 6.393 -21.993 -4.675 158 HG21 VAL 20 1HG2 VAL 20 3.788 -20.785 -5.787 159 HG22 VAL 20 2HG2 VAL 20 4.899 -19.918 -4.700 160 HG23 VAL 20 3HG2 VAL 20 4.450 -19.205 -6.268 161 H GLY 21 H GLY 21 9.065 -21.020 -5.183 162 HA2 GLY 21 1HA GLY 21 10.224 -22.038 -7.751 163 HA3 GLY 21 2HA GLY 21 11.232 -21.227 -6.568 164 H ASN 22 H ASN 22 12.146 -23.591 -7.109 165 HA ASN 22 HA ASN 22 12.673 -25.677 -6.293 166 HB2 ASN 22 1HB ASN 22 11.244 -24.684 -3.803 167 HB3 ASN 22 2HB ASN 22 12.244 -26.127 -3.892 168 HD21 ASN 22 1HD2 ASN 22 14.106 -23.054 -2.670 169 HD22 ASN 22 2HD2 ASN 22 12.532 -23.673 -2.297 170 H ILE 23 H ILE 23 10.262 -25.299 -7.816 171 HA ILE 23 HA ILE 23 8.202 -26.960 -6.576 172 HB ILE 23 HB ILE 23 8.469 -25.814 -9.388 173 HG12 ILE 23 1HG1 ILE 23 6.652 -24.971 -7.122 174 HG13 ILE 23 2HG1 ILE 23 8.195 -24.209 -7.472 175 HG21 ILE 23 1HG2 ILE 23 6.100 -26.429 -9.650 176 HG22 ILE 23 2HG2 ILE 23 7.109 -27.871 -9.389 177 HG23 ILE 23 3HG2 ILE 23 6.125 -27.222 -8.057 178 HD11 ILE 23 1HD1 ILE 23 6.355 -22.946 -8.435 179 HD12 ILE 23 2HD1 ILE 23 7.402 -23.602 -9.717 180 HD13 ILE 23 3HD1 ILE 23 5.838 -24.373 -9.362 181 HA PRO 24 HA PRO 24 9.931 -30.756 -7.997 182 HB2 PRO 24 1HB PRO 24 7.822 -32.376 -7.281 183 HB3 PRO 24 2HB PRO 24 8.969 -31.730 -6.100 184 HG2 PRO 24 1HG PRO 24 6.223 -30.660 -6.879 185 HG3 PRO 24 2HG PRO 24 6.876 -30.922 -5.259 186 HD2 PRO 24 1HD PRO 24 6.918 -28.456 -6.403 187 HD3 PRO 24 2HD PRO 24 8.277 -29.022 -5.350 188 H TYR 25 H TYR 25 9.718 -32.004 -9.861 189 HA TYR 25 HA TYR 25 8.241 -30.608 -11.924 190 HB2 TYR 25 1HB TYR 25 9.963 -33.118 -12.019 191 HB3 TYR 25 2HB TYR 25 9.294 -32.321 -13.437 192 HD1 TYR 25 HD1 TYR 25 9.912 -29.692 -11.310 193 HD2 TYR 25 HD2 TYR 25 12.017 -32.610 -13.648 194 HE1 TYR 25 HE1 TYR 25 11.880 -28.200 -11.401 195 HE2 TYR 25 HE2 TYR 25 13.985 -31.118 -13.738 196 HH TYR 25 HH TYR 25 13.922 -27.897 -12.237 197 H GLU 26 H GLU 26 7.701 -33.461 -10.022 198 HA GLU 26 HA GLU 26 5.813 -34.676 -11.868 199 HB2 GLU 26 1HB GLU 26 5.353 -36.235 -10.055 200 HB3 GLU 26 2HB GLU 26 7.089 -35.997 -10.191 201 HG2 GLU 26 1HG GLU 26 5.577 -34.295 -8.254 202 HG3 GLU 26 2HG GLU 26 5.840 -35.993 -7.861 203 H ALA 27 H ALA 27 5.676 -32.016 -9.786 204 HA ALA 27 HA ALA 27 2.822 -32.300 -9.165 205 HB1 ALA 27 1HB ALA 27 3.084 -30.083 -8.099 206 HB2 ALA 27 2HB ALA 27 4.315 -31.237 -7.532 207 HB3 ALA 27 3HB ALA 27 4.747 -29.988 -8.723 208 H THR 28 H THR 28 1.139 -31.179 -10.023 209 HA THR 28 HA THR 28 1.731 -29.765 -12.580 210 HB THR 28 HB THR 28 -0.580 -30.197 -13.212 211 HG1 THR 28 HG1 THR 28 -1.533 -31.763 -11.363 212 HG21 THR 28 1HG2 THR 28 -0.588 -32.661 -13.215 213 HG22 THR 28 2HG2 THR 28 1.037 -32.030 -13.571 214 HG23 THR 28 3HG2 THR 28 0.667 -32.671 -11.954 215 H GLU 29 H GLU 29 0.117 -28.005 -13.129 216 HA GLU 29 HA GLU 29 0.364 -25.911 -11.210 217 HB2 GLU 29 1HB GLU 29 -1.363 -26.203 -13.695 218 HB3 GLU 29 2HB GLU 29 -1.316 -24.730 -12.737 219 HG2 GLU 29 1HG GLU 29 1.077 -24.492 -13.170 220 HG3 GLU 29 2HG GLU 29 1.080 -26.004 -14.075 221 H GLU 30 H GLU 30 -2.288 -28.128 -11.984 222 HA GLU 30 HA GLU 30 -4.262 -26.812 -10.372 223 HB2 GLU 30 1HB GLU 30 -4.007 -29.691 -11.323 224 HB3 GLU 30 2HB GLU 30 -5.410 -29.077 -10.459 225 HG2 GLU 30 1HG GLU 30 -4.397 -28.031 -13.112 226 HG3 GLU 30 2HG GLU 30 -5.729 -29.164 -12.897 227 H GLN 31 H GLN 31 -1.933 -29.417 -9.712 228 HA GLN 31 HA GLN 31 -2.831 -29.916 -7.032 229 HB2 GLN 31 1HB GLN 31 -0.172 -30.407 -8.422 230 HB3 GLN 31 2HB GLN 31 -0.494 -30.909 -6.769 231 HG2 GLN 31 1HG GLN 31 -2.277 -32.370 -7.499 232 HG3 GLN 31 2HG GLN 31 -2.096 -31.790 -9.179 233 HE21 GLN 31 1HE2 GLN 31 -0.178 -35.037 -8.213 234 HE22 GLN 31 2HE2 GLN 31 -1.694 -34.461 -7.605 235 H LEU 32 H LEU 32 -0.397 -27.733 -8.416 236 HA LEU 32 HA LEU 32 0.667 -26.811 -5.935 237 HB2 LEU 32 1HB LEU 32 0.470 -25.529 -8.676 238 HB3 LEU 32 2HB LEU 32 1.305 -24.767 -7.318 239 HG LEU 32 HG LEU 32 2.050 -27.488 -8.445 240 HD11 LEU 32 1HD1 LEU 32 3.899 -26.309 -9.547 241 HD12 LEU 32 2HD1 LEU 32 2.317 -25.756 -10.146 242 HD13 LEU 32 3HD1 LEU 32 3.235 -24.753 -8.997 243 HD21 LEU 32 1HD2 LEU 32 4.127 -27.081 -7.169 244 HD22 LEU 32 2HD2 LEU 32 3.467 -25.534 -6.585 245 HD23 LEU 32 3HD2 LEU 32 2.706 -27.068 -6.098 246 H LYS 33 H LYS 33 -2.003 -25.613 -7.971 247 HA LYS 33 HA LYS 33 -2.647 -23.349 -6.369 248 HB2 LYS 33 1HB LYS 33 -4.303 -25.077 -8.237 249 HB3 LYS 33 2HB LYS 33 -4.976 -23.677 -7.414 250 HG2 LYS 33 1HG LYS 33 -3.150 -22.285 -8.480 251 HG3 LYS 33 2HG LYS 33 -2.728 -23.711 -9.440 252 HD2 LYS 33 1HD LYS 33 -5.524 -22.528 -9.358 253 HD3 LYS 33 2HD LYS 33 -4.307 -22.066 -10.557 254 HE2 LYS 33 1HE LYS 33 -4.128 -24.457 -11.250 255 HE3 LYS 33 2HE LYS 33 -5.412 -24.863 -10.107 256 HZ1 LYS 33 1HZ LYS 33 -6.260 -24.562 -12.315 257 HZ2 LYS 33 2HZ LYS 33 -6.875 -23.399 -11.320 258 HZ3 LYS 33 3HZ LYS 33 -5.677 -23.021 -12.389 259 H ASP 34 H ASP 34 -3.645 -26.744 -6.169 260 HA ASP 34 HA ASP 34 -5.688 -26.395 -4.220 261 HB2 ASP 34 1HB ASP 34 -3.889 -28.744 -4.902 262 HB3 ASP 34 2HB ASP 34 -5.131 -28.846 -3.662 263 H ILE 35 H ILE 35 -2.198 -27.034 -3.881 264 HA ILE 35 HA ILE 35 -2.379 -27.194 -0.980 265 HB ILE 35 HB ILE 35 0.088 -27.344 -1.055 266 HG12 ILE 35 1HG1 ILE 35 -0.154 -26.884 -4.036 267 HG13 ILE 35 2HG1 ILE 35 0.364 -25.663 -2.884 268 HG21 ILE 35 1HG2 ILE 35 0.267 -29.378 -2.430 269 HG22 ILE 35 2HG2 ILE 35 -1.245 -29.371 -1.494 270 HG23 ILE 35 3HG2 ILE 35 -1.272 -28.979 -3.229 271 HD11 ILE 35 1HD1 ILE 35 2.271 -26.706 -3.973 272 HD12 ILE 35 2HD1 ILE 35 2.269 -27.069 -2.230 273 HD13 ILE 35 3HD1 ILE 35 1.746 -28.306 -3.398 274 H PHE 36 H PHE 36 -2.133 -24.668 -3.277 275 HA PHE 36 HA PHE 36 -1.012 -22.785 -1.282 276 HB2 PHE 36 1HB PHE 36 -1.765 -22.448 -4.211 277 HB3 PHE 36 2HB PHE 36 -1.177 -21.141 -3.195 278 HD1 PHE 36 HD1 PHE 36 0.075 -22.192 -5.764 279 HD2 PHE 36 HD2 PHE 36 0.774 -23.099 -1.648 280 HE1 PHE 36 HE1 PHE 36 2.404 -22.826 -6.300 281 HE2 PHE 36 HE2 PHE 36 3.104 -23.730 -2.180 282 HZ PHE 36 HZ PHE 36 3.918 -23.595 -4.508 283 H SER 37 H SER 37 -4.014 -23.959 -2.356 284 HA SER 37 HA SER 37 -5.567 -21.545 -2.012 285 HB2 SER 37 1HB SER 37 -7.473 -22.947 -2.248 286 HB3 SER 37 2HB SER 37 -6.249 -23.594 -3.329 287 HG SER 37 HG SER 37 -5.771 -25.145 -1.837 288 H GLU 38 H GLU 38 -3.987 -23.590 0.169 289 HA GLU 38 HA GLU 38 -5.719 -23.570 2.407 290 HB2 GLU 38 1HB GLU 38 -2.686 -23.470 2.211 291 HB3 GLU 38 2HB GLU 38 -3.538 -23.618 3.741 292 HG2 GLU 38 1HG GLU 38 -4.575 -25.715 2.956 293 HG3 GLU 38 2HG GLU 38 -3.701 -25.568 1.433 294 H VAL 39 H VAL 39 -3.682 -21.051 1.038 295 HA VAL 39 HA VAL 39 -3.945 -19.302 3.357 296 HB VAL 39 HB VAL 39 -2.962 -18.788 0.518 297 HG11 VAL 39 1HG1 VAL 39 -2.026 -16.705 1.397 298 HG12 VAL 39 2HG1 VAL 39 -3.802 -16.732 1.499 299 HG13 VAL 39 3HG1 VAL 39 -2.822 -17.007 2.959 300 HG21 VAL 39 1HG2 VAL 39 -0.735 -18.814 1.596 301 HG22 VAL 39 2HG2 VAL 39 -1.498 -19.186 3.160 302 HG23 VAL 39 3HG2 VAL 39 -1.580 -20.363 1.828 303 H GLY 40 H GLY 40 -5.284 -19.382 0.040 304 HA2 GLY 40 1HA GLY 40 -7.852 -18.409 0.815 305 HA3 GLY 40 2HA GLY 40 -6.895 -17.043 0.274 306 HA PRO 41 HA PRO 41 -9.079 -19.260 -3.234 307 HB2 PRO 41 1HB PRO 41 -9.626 -16.340 -3.881 308 HB3 PRO 41 2HB PRO 41 -10.691 -17.739 -4.071 309 HG2 PRO 41 1HG PRO 41 -11.094 -16.122 -1.997 310 HG3 PRO 41 2HG PRO 41 -11.175 -17.868 -1.744 311 HD2 PRO 41 1HD PRO 41 -8.894 -15.945 -1.134 312 HD3 PRO 41 2HD PRO 41 -9.534 -17.310 -0.132 313 H VAL 42 H VAL 42 -7.882 -19.778 -4.973 314 HA VAL 42 HA VAL 42 -5.754 -17.873 -5.835 315 HB VAL 42 HB VAL 42 -6.000 -20.879 -6.286 316 HG11 VAL 42 1HG1 VAL 42 -3.714 -20.732 -7.147 317 HG12 VAL 42 2HG1 VAL 42 -4.858 -19.786 -8.129 318 HG13 VAL 42 3HG1 VAL 42 -3.769 -18.961 -6.988 319 HG21 VAL 42 1HG2 VAL 42 -4.095 -21.009 -4.711 320 HG22 VAL 42 2HG2 VAL 42 -4.170 -19.246 -4.478 321 HG23 VAL 42 3HG2 VAL 42 -5.520 -20.273 -3.939 322 H VAL 43 H VAL 43 -5.845 -16.944 -7.763 323 HA VAL 43 HA VAL 43 -8.127 -17.411 -9.491 324 HB VAL 43 HB VAL 43 -5.621 -15.712 -9.831 325 HG11 VAL 43 1HG1 VAL 43 -6.796 -14.621 -11.679 326 HG12 VAL 43 2HG1 VAL 43 -6.483 -16.341 -12.011 327 HG13 VAL 43 3HG1 VAL 43 -8.115 -15.807 -11.540 328 HG21 VAL 43 1HG2 VAL 43 -7.181 -13.852 -9.351 329 HG22 VAL 43 2HG2 VAL 43 -8.506 -15.021 -9.138 330 HG23 VAL 43 3HG2 VAL 43 -7.133 -15.015 -8.005 331 H SER 44 H SER 44 -4.591 -17.866 -9.856 332 HA SER 44 HA SER 44 -4.946 -20.220 -11.496 333 HB2 SER 44 1HB SER 44 -4.202 -19.383 -13.607 334 HB3 SER 44 2HB SER 44 -5.552 -18.379 -13.099 335 HG SER 44 HG SER 44 -4.188 -16.802 -12.520 336 H PHE 45 H PHE 45 -2.734 -20.715 -12.653 337 HA PHE 45 HA PHE 45 -0.449 -19.597 -11.138 338 HB2 PHE 45 1HB PHE 45 -1.262 -21.682 -9.944 339 HB3 PHE 45 2HB PHE 45 -0.884 -22.597 -11.395 340 HD1 PHE 45 HD1 PHE 45 0.435 -21.001 -8.428 341 HD2 PHE 45 HD2 PHE 45 1.477 -22.768 -12.176 342 HE1 PHE 45 HE1 PHE 45 2.770 -21.257 -7.657 343 HE2 PHE 45 HE2 PHE 45 3.812 -23.028 -11.407 344 HZ PHE 45 HZ PHE 45 4.458 -22.271 -9.147 345 H ARG 46 H ARG 46 1.310 -19.308 -12.344 346 HA ARG 46 HA ARG 46 1.246 -20.442 -15.104 347 HB2 ARG 46 1HB ARG 46 2.610 -17.967 -13.997 348 HB3 ARG 46 2HB ARG 46 2.858 -18.578 -15.626 349 HG2 ARG 46 1HG ARG 46 0.509 -18.209 -16.162 350 HG3 ARG 46 2HG ARG 46 0.199 -17.667 -14.494 351 HD2 ARG 46 1HD ARG 46 0.449 -15.800 -16.017 352 HD3 ARG 46 2HD ARG 46 1.746 -15.828 -14.800 353 HE ARG 46 HE ARG 46 3.288 -16.164 -16.465 354 HH11 ARG 46 1HH1 ARG 46 0.068 -16.740 -17.746 355 HH12 ARG 46 2HH1 ARG 46 0.612 -16.851 -19.405 356 HH21 ARG 46 1HH2 ARG 46 3.981 -16.310 -18.622 357 HH22 ARG 46 2HH2 ARG 46 2.827 -16.608 -19.902 358 H LEU 47 H LEU 47 2.202 -22.426 -14.633 359 HA LEU 47 HA LEU 47 4.803 -22.518 -13.306 360 HB2 LEU 47 1HB LEU 47 3.186 -24.369 -13.104 361 HB3 LEU 47 2HB LEU 47 3.260 -24.637 -14.848 362 HG LEU 47 HG LEU 47 5.690 -25.220 -14.598 363 HD11 LEU 47 1HD1 LEU 47 6.531 -25.693 -12.341 364 HD12 LEU 47 2HD1 LEU 47 6.121 -23.974 -12.542 365 HD13 LEU 47 3HD1 LEU 47 5.025 -25.051 -11.645 366 HD21 LEU 47 1HD2 LEU 47 5.237 -27.436 -13.601 367 HD22 LEU 47 2HD2 LEU 47 3.711 -26.819 -12.922 368 HD23 LEU 47 3HD2 LEU 47 3.916 -26.939 -14.686 369 H VAL 48 H VAL 48 6.691 -22.150 -14.209 370 HA VAL 48 HA VAL 48 6.886 -21.905 -17.130 371 HB VAL 48 HB VAL 48 8.967 -21.515 -14.936 372 HG11 VAL 48 1HG1 VAL 48 10.282 -20.372 -16.654 373 HG12 VAL 48 2HG1 VAL 48 10.011 -22.086 -17.052 374 HG13 VAL 48 3HG1 VAL 48 9.070 -20.820 -17.878 375 HG21 VAL 48 1HG2 VAL 48 8.579 -19.109 -15.365 376 HG22 VAL 48 2HG2 VAL 48 7.313 -19.525 -16.544 377 HG23 VAL 48 3HG2 VAL 48 7.088 -19.915 -14.822 378 H TYR 49 H TYR 49 7.744 -23.332 -18.494 379 HA TYR 49 HA TYR 49 9.401 -25.546 -17.454 380 HB2 TYR 49 1HB TYR 49 7.992 -27.288 -18.383 381 HB3 TYR 49 2HB TYR 49 7.041 -26.333 -17.255 382 HD1 TYR 49 HD1 TYR 49 7.473 -27.363 -20.717 383 HD2 TYR 49 HD2 TYR 49 5.341 -24.734 -18.080 384 HE1 TYR 49 HE1 TYR 49 5.774 -26.980 -22.471 385 HE2 TYR 49 HE2 TYR 49 3.642 -24.352 -19.834 386 HH TYR 49 HH TYR 49 2.966 -24.862 -21.882 387 H ALA 50 H ALA 50 10.364 -26.855 -19.149 388 HA ALA 50 HA ALA 50 11.206 -25.204 -21.381 389 HB1 ALA 50 1HB ALA 50 12.556 -27.176 -22.018 390 HB2 ALA 50 2HB ALA 50 12.762 -26.763 -20.299 391 HB3 ALA 50 3HB ALA 50 11.731 -28.134 -20.767 392 H ARG 51 H ARG 51 10.343 -25.012 -23.308 393 HA ARG 51 HA ARG 51 7.935 -26.480 -23.970 394 HB2 ARG 51 1HB ARG 51 9.636 -24.517 -25.538 395 HB3 ARG 51 2HB ARG 51 8.153 -25.224 -26.162 396 HG2 ARG 51 1HG ARG 51 6.870 -24.195 -24.351 397 HG3 ARG 51 2HG ARG 51 8.367 -23.508 -23.675 398 HD2 ARG 51 1HD ARG 51 8.716 -22.259 -25.730 399 HD3 ARG 51 2HD ARG 51 7.215 -22.941 -26.397 400 HE ARG 51 HE ARG 51 6.551 -21.767 -23.952 401 HH11 ARG 51 1HH1 ARG 51 7.834 -20.759 -27.063 402 HH12 ARG 51 2HH1 ARG 51 7.145 -19.154 -26.968 403 HH21 ARG 51 1HH2 ARG 51 5.662 -19.681 -23.840 404 HH22 ARG 51 2HH2 ARG 51 5.915 -18.543 -25.144 405 H GLU 52 H GLU 52 11.319 -26.902 -24.583 406 HA GLU 52 HA GLU 52 10.996 -28.431 -27.034 407 HB2 GLU 52 1HB GLU 52 13.339 -28.075 -25.125 408 HB3 GLU 52 2HB GLU 52 13.430 -29.017 -26.607 409 HG2 GLU 52 1HG GLU 52 12.911 -27.028 -27.932 410 HG3 GLU 52 2HG GLU 52 12.747 -26.072 -26.461 411 H THR 53 H THR 53 11.315 -29.171 -23.590 412 HA THR 53 HA THR 53 11.201 -32.076 -24.280 413 HB THR 53 HB THR 53 12.293 -32.506 -22.108 414 HG1 THR 53 HG1 THR 53 13.201 -30.429 -21.144 415 HG21 THR 53 1HG2 THR 53 14.504 -31.552 -22.627 416 HG22 THR 53 2HG2 THR 53 13.709 -32.153 -24.101 417 HG23 THR 53 3HG2 THR 53 13.749 -30.408 -23.761 418 H GLY 54 H GLY 54 9.753 -29.461 -22.483 419 HA2 GLY 54 1HA GLY 54 7.524 -29.460 -21.660 420 HA3 GLY 54 2HA GLY 54 7.477 -31.209 -21.775 421 H LYS 55 H LYS 55 10.395 -30.295 -20.389 422 HA LYS 55 HA LYS 55 9.504 -31.280 -17.776 423 HB2 LYS 55 1HB LYS 55 11.661 -32.010 -18.809 424 HB3 LYS 55 2HB LYS 55 12.259 -30.361 -18.689 425 HG2 LYS 55 1HG LYS 55 12.056 -30.468 -16.226 426 HG3 LYS 55 2HG LYS 55 11.479 -32.135 -16.357 427 HD2 LYS 55 1HD LYS 55 14.148 -31.201 -17.467 428 HD3 LYS 55 2HD LYS 55 13.948 -31.880 -15.845 429 HE2 LYS 55 1HE LYS 55 12.973 -33.943 -16.877 430 HE3 LYS 55 2HE LYS 55 13.306 -33.267 -18.473 431 HZ1 LYS 55 1HZ LYS 55 15.035 -34.750 -17.764 432 HZ2 LYS 55 2HZ LYS 55 15.637 -33.220 -17.903 433 HZ3 LYS 55 3HZ LYS 55 15.325 -33.852 -16.411 434 HA PRO 56 HA PRO 56 8.627 -27.304 -16.129 435 HB2 PRO 56 1HB PRO 56 9.126 -28.853 -13.562 436 HB3 PRO 56 2HB PRO 56 7.782 -27.779 -13.969 437 HG2 PRO 56 1HG PRO 56 7.368 -30.405 -14.067 438 HG3 PRO 56 2HG PRO 56 6.727 -29.393 -15.365 439 HD2 PRO 56 1HD PRO 56 9.247 -31.102 -15.333 440 HD3 PRO 56 2HD PRO 56 8.012 -30.918 -16.642 441 H LYS 57 H LYS 57 9.859 -25.615 -15.341 442 HA LYS 57 HA LYS 57 12.731 -26.083 -14.999 443 HB2 LYS 57 1HB LYS 57 11.050 -23.549 -14.864 444 HB3 LYS 57 2HB LYS 57 12.802 -23.584 -14.712 445 HG2 LYS 57 1HG LYS 57 11.250 -24.520 -17.145 446 HG3 LYS 57 2HG LYS 57 12.043 -22.948 -16.971 447 HD2 LYS 57 1HD LYS 57 14.222 -24.146 -16.614 448 HD3 LYS 57 2HD LYS 57 13.391 -25.673 -16.947 449 HE2 LYS 57 1HE LYS 57 12.756 -24.834 -19.190 450 HE3 LYS 57 2HE LYS 57 13.597 -23.317 -18.859 451 HZ1 LYS 57 1HZ LYS 57 14.951 -24.819 -20.124 452 HZ2 LYS 57 2HZ LYS 57 15.637 -24.562 -18.646 453 HZ3 LYS 57 3HZ LYS 57 14.852 -25.979 -18.956 454 H GLY 58 H GLY 58 9.949 -25.784 -12.985 455 HA2 GLY 58 1HA GLY 58 10.010 -26.372 -10.653 456 HA3 GLY 58 2HA GLY 58 11.698 -25.902 -10.582 457 H TYR 59 H TYR 59 9.823 -23.694 -12.372 458 HA TYR 59 HA TYR 59 9.370 -21.974 -9.982 459 HB2 TYR 59 1HB TYR 59 10.668 -21.039 -12.574 460 HB3 TYR 59 2HB TYR 59 10.290 -20.034 -11.181 461 HD1 TYR 59 HD1 TYR 59 12.649 -22.333 -12.671 462 HD2 TYR 59 HD2 TYR 59 11.501 -20.402 -9.016 463 HE1 TYR 59 HE1 TYR 59 14.875 -22.819 -11.715 464 HE2 TYR 59 HE2 TYR 59 13.728 -20.888 -8.060 465 HH TYR 59 HH TYR 59 16.192 -22.641 -9.934 466 H GLY 60 H GLY 60 7.742 -20.438 -10.149 467 HA2 GLY 60 1HA GLY 60 6.310 -19.882 -12.571 468 HA3 GLY 60 2HA GLY 60 5.459 -21.130 -11.680 469 H PHE 61 H PHE 61 3.958 -19.061 -11.912 470 HA PHE 61 HA PHE 61 4.316 -17.441 -9.424 471 HB2 PHE 61 1HB PHE 61 3.126 -16.604 -12.097 472 HB3 PHE 61 2HB PHE 61 3.028 -15.642 -10.631 473 HD1 PHE 61 HD1 PHE 61 5.294 -16.976 -13.208 474 HD2 PHE 61 HD2 PHE 61 4.917 -14.418 -9.807 475 HE1 PHE 61 HE1 PHE 61 7.488 -15.961 -13.730 476 HE2 PHE 61 HE2 PHE 61 7.108 -13.399 -10.327 477 HZ PHE 61 HZ PHE 61 8.394 -14.172 -12.289 478 H CYS 62 H CYS 62 2.618 -17.206 -8.073 479 HA CYS 62 HA CYS 62 0.116 -18.646 -8.847 480 HB2 CYS 62 1HB CYS 62 1.351 -19.700 -6.969 481 HB3 CYS 62 2HB CYS 62 1.276 -18.191 -6.070 482 HG CYS 62 HG CYS 62 -1.273 -19.931 -7.189 483 H GLU 63 H GLU 63 -1.532 -17.360 -9.256 484 HA GLU 63 HA GLU 63 -1.484 -14.605 -8.146 485 HB2 GLU 63 1HB GLU 63 -1.707 -14.886 -10.609 486 HB3 GLU 63 2HB GLU 63 -3.184 -15.808 -10.368 487 HG2 GLU 63 1HG GLU 63 -4.291 -13.864 -9.412 488 HG3 GLU 63 2HG GLU 63 -2.800 -12.930 -9.520 489 H TYR 64 H TYR 64 -2.725 -14.031 -6.522 490 HA TYR 64 HA TYR 64 -5.022 -15.785 -5.811 491 HB2 TYR 64 1HB TYR 64 -3.447 -13.718 -4.235 492 HB3 TYR 64 2HB TYR 64 -4.955 -14.406 -3.651 493 HD1 TYR 64 HD1 TYR 64 -1.464 -15.191 -4.605 494 HD2 TYR 64 HD2 TYR 64 -5.055 -16.589 -2.719 495 HE1 TYR 64 HE1 TYR 64 -0.225 -17.116 -3.673 496 HE2 TYR 64 HE2 TYR 64 -3.816 -18.514 -1.787 497 HH TYR 64 HH TYR 64 -1.883 -19.616 -1.753 498 H GLN 65 H GLN 65 -6.996 -14.769 -5.021 499 HA GLN 65 HA GLN 65 -7.936 -12.799 -6.918 500 HB2 GLN 65 1HB GLN 65 -9.197 -14.035 -4.442 501 HB3 GLN 65 2HB GLN 65 -10.034 -12.885 -5.474 502 HG2 GLN 65 1HG GLN 65 -9.734 -14.427 -7.393 503 HG3 GLN 65 2HG GLN 65 -8.992 -15.607 -6.276 504 HE21 GLN 65 1HE2 GLN 65 -12.507 -16.600 -6.630 505 HE22 GLN 65 2HE2 GLN 65 -11.087 -16.524 -7.620 506 H ASP 66 H ASP 66 -6.535 -12.660 -3.751 507 HA ASP 66 HA ASP 66 -7.217 -9.753 -3.621 508 HB2 ASP 66 1HB ASP 66 -8.498 -11.065 -1.934 509 HB3 ASP 66 2HB ASP 66 -6.990 -11.688 -1.279 510 H GLN 67 H GLN 67 -5.646 -8.349 -2.953 511 HA GLN 67 HA GLN 67 -2.967 -9.186 -3.583 512 HB2 GLN 67 1HB GLN 67 -4.084 -6.609 -2.417 513 HB3 GLN 67 2HB GLN 67 -2.384 -6.829 -2.805 514 HG2 GLN 67 1HG GLN 67 -2.914 -7.175 -5.147 515 HG3 GLN 67 2HG GLN 67 -4.660 -7.068 -4.784 516 HE21 GLN 67 1HE2 GLN 67 -3.515 -3.792 -6.107 517 HE22 GLN 67 2HE2 GLN 67 -3.547 -5.423 -6.688 518 H GLU 68 H GLU 68 -4.625 -8.372 -0.543 519 HA GLU 68 HA GLU 68 -2.259 -8.636 1.083 520 HB2 GLU 68 1HB GLU 68 -4.244 -7.342 1.803 521 HB3 GLU 68 2HB GLU 68 -5.203 -8.815 1.843 522 HG2 GLU 68 1HG GLU 68 -4.545 -8.189 4.074 523 HG3 GLU 68 2HG GLU 68 -3.776 -9.710 3.627 524 H THR 69 H THR 69 -4.848 -10.850 0.103 525 HA THR 69 HA THR 69 -4.072 -13.083 1.673 526 HB THR 69 HB THR 69 -5.290 -12.999 -1.120 527 HG1 THR 69 HG1 THR 69 -6.483 -12.045 0.685 528 HG21 THR 69 1HG2 THR 69 -6.007 -15.308 -0.647 529 HG22 THR 69 2HG2 THR 69 -4.232 -15.181 -0.648 530 HG23 THR 69 3HG2 THR 69 -5.116 -15.274 0.892 531 H ALA 70 H ALA 70 -2.949 -11.986 -1.526 532 HA ALA 70 HA ALA 70 -1.085 -14.105 -1.932 533 HB1 ALA 70 1HB ALA 70 -0.015 -12.568 -3.548 534 HB2 ALA 70 2HB ALA 70 -1.784 -12.595 -3.736 535 HB3 ALA 70 3HB ALA 70 -0.998 -11.229 -2.912 536 H LEU 71 H LEU 71 -0.765 -10.933 -0.355 537 HA LEU 71 HA LEU 71 2.024 -11.160 0.222 538 HB2 LEU 71 1HB LEU 71 -0.218 -9.637 1.586 539 HB3 LEU 71 2HB LEU 71 1.479 -9.488 2.053 540 HG LEU 71 HG LEU 71 0.385 -8.818 -0.702 541 HD11 LEU 71 1HD1 LEU 71 0.669 -6.483 -0.002 542 HD12 LEU 71 2HD1 LEU 71 -0.522 -7.332 1.011 543 HD13 LEU 71 3HD1 LEU 71 1.118 -7.027 1.631 544 HD21 LEU 71 1HD2 LEU 71 2.598 -7.754 -0.984 545 HD22 LEU 71 2HD2 LEU 71 3.075 -8.315 0.636 546 HD23 LEU 71 3HD2 LEU 71 2.762 -9.496 -0.659 547 H SER 72 H SER 72 -0.884 -12.211 1.964 548 HA SER 72 HA SER 72 0.466 -13.197 4.286 549 HB2 SER 72 1HB SER 72 -2.117 -14.070 2.953 550 HB3 SER 72 2HB SER 72 -1.578 -14.635 4.527 551 HG SER 72 HG SER 72 -2.117 -11.989 3.738 552 H ALA 73 H ALA 73 -0.339 -14.684 1.155 553 HA ALA 73 HA ALA 73 0.627 -17.288 1.751 554 HB1 ALA 73 1HB ALA 73 0.831 -17.550 -0.700 555 HB2 ALA 73 2HB ALA 73 -0.713 -16.791 -0.244 556 HB3 ALA 73 3HB ALA 73 0.609 -15.796 -0.898 557 H MET 74 H MET 74 2.292 -14.411 0.475 558 HA MET 74 HA MET 74 4.869 -15.549 0.202 559 HB2 MET 74 1HB MET 74 4.340 -13.308 -0.617 560 HB3 MET 74 2HB MET 74 4.034 -12.739 1.018 561 HG2 MET 74 1HG MET 74 6.452 -13.248 1.552 562 HG3 MET 74 2HG MET 74 6.693 -13.567 -0.168 563 HE1 MET 74 1HE MET 74 5.568 -9.462 1.641 564 HE2 MET 74 2HE MET 74 4.455 -10.852 1.674 565 HE3 MET 74 3HE MET 74 5.979 -10.909 2.593 566 H ARG 75 H ARG 75 3.329 -14.044 3.048 567 HA ARG 75 HA ARG 75 5.657 -14.310 4.711 568 HB2 ARG 75 1HB ARG 75 2.721 -13.902 5.347 569 HB3 ARG 75 2HB ARG 75 3.966 -13.957 6.586 570 HG2 ARG 75 1HG ARG 75 5.105 -12.045 5.349 571 HG3 ARG 75 2HG ARG 75 3.606 -11.911 4.396 572 HD2 ARG 75 1HD ARG 75 3.738 -11.811 7.399 573 HD3 ARG 75 2HD ARG 75 3.721 -10.388 6.332 574 HE ARG 75 HE ARG 75 1.501 -12.218 6.904 575 HH11 ARG 75 1HH1 ARG 75 2.742 -9.539 5.000 576 HH12 ARG 75 2HH1 ARG 75 1.155 -8.992 4.506 577 HH21 ARG 75 1HH2 ARG 75 -0.553 -11.499 6.255 578 HH22 ARG 75 2HH2 ARG 75 -0.710 -10.101 5.216 579 H ASN 76 H ASN 76 2.970 -16.437 3.927 580 HA ASN 76 HA ASN 76 3.512 -18.097 6.321 581 HB2 ASN 76 1HB ASN 76 1.266 -18.063 4.287 582 HB3 ASN 76 2HB ASN 76 1.428 -19.319 5.507 583 HD21 ASN 76 1HD2 ASN 76 -0.843 -16.626 6.718 584 HD22 ASN 76 2HD2 ASN 76 -0.782 -17.627 5.305 585 H LEU 77 H LEU 77 3.412 -18.393 2.763 586 HA LEU 77 HA LEU 77 3.808 -21.292 3.017 587 HB2 LEU 77 1HB LEU 77 3.529 -19.537 0.552 588 HB3 LEU 77 2HB LEU 77 3.515 -21.303 0.569 589 HG LEU 77 HG LEU 77 1.425 -19.477 1.806 590 HD11 LEU 77 1HD1 LEU 77 -0.018 -20.413 0.055 591 HD12 LEU 77 2HD1 LEU 77 1.375 -19.547 -0.634 592 HD13 LEU 77 3HD1 LEU 77 1.363 -21.326 -0.596 593 HD21 LEU 77 1HD2 LEU 77 0.214 -21.583 2.264 594 HD22 LEU 77 2HD2 LEU 77 1.599 -22.514 1.644 595 HD23 LEU 77 3HD2 LEU 77 1.772 -21.540 3.124 596 H ASN 78 H ASN 78 5.784 -18.574 2.821 597 HA ASN 78 HA ASN 78 7.812 -19.590 1.030 598 HB2 ASN 78 1HB ASN 78 7.465 -17.169 1.573 599 HB3 ASN 78 2HB ASN 78 8.070 -17.478 3.195 600 HD21 ASN 78 1HD2 ASN 78 11.136 -16.421 1.870 601 HD22 ASN 78 2HD2 ASN 78 9.754 -15.992 2.822 602 H GLY 79 H GLY 79 8.845 -21.402 1.404 603 HA2 GLY 79 1HA GLY 79 10.522 -22.683 2.471 604 HA3 GLY 79 2HA GLY 79 10.403 -21.662 3.891 605 H ARG 80 H ARG 80 7.332 -22.571 2.777 606 HA ARG 80 HA ARG 80 6.952 -24.300 5.109 607 HB2 ARG 80 1HB ARG 80 5.252 -22.621 4.405 608 HB3 ARG 80 2HB ARG 80 5.003 -23.516 2.914 609 HG2 ARG 80 1HG ARG 80 4.032 -25.356 4.054 610 HG3 ARG 80 2HG ARG 80 4.571 -24.750 5.638 611 HD2 ARG 80 1HD ARG 80 3.123 -22.795 5.345 612 HD3 ARG 80 2HD ARG 80 2.541 -23.486 3.813 613 HE ARG 80 HE ARG 80 2.010 -24.506 6.533 614 HH11 ARG 80 1HH1 ARG 80 1.492 -24.699 3.064 615 HH12 ARG 80 2HH1 ARG 80 0.094 -25.741 3.205 616 HH21 ARG 80 1HH2 ARG 80 0.194 -25.859 6.703 617 HH22 ARG 80 2HH2 ARG 80 -0.642 -26.398 5.264 618 H GLU 81 H GLU 81 6.606 -26.453 5.158 619 HA GLU 81 HA GLU 81 7.436 -27.957 2.783 620 HB2 GLU 81 1HB GLU 81 8.240 -28.583 5.047 621 HB3 GLU 81 2HB GLU 81 6.587 -28.909 5.549 622 HG2 GLU 81 1HG GLU 81 6.428 -30.712 3.887 623 HG3 GLU 81 2HG GLU 81 8.078 -30.380 3.365 624 H PHE 82 H PHE 82 6.181 -28.916 1.352 625 HA PHE 82 HA PHE 82 3.281 -29.198 2.027 626 HB2 PHE 82 1HB PHE 82 4.589 -28.792 -0.693 627 HB3 PHE 82 2HB PHE 82 2.871 -29.043 -0.425 628 HD1 PHE 82 HD1 PHE 82 5.663 -26.694 -0.091 629 HD2 PHE 82 HD2 PHE 82 1.478 -27.299 0.520 630 HE1 PHE 82 HE1 PHE 82 5.355 -24.258 0.202 631 HE2 PHE 82 HE2 PHE 82 1.166 -24.864 0.811 632 HZ PHE 82 HZ PHE 82 3.106 -23.343 0.653 633 H SER 83 H SER 83 3.784 -31.258 2.998 634 HA SER 83 HA SER 83 3.779 -33.559 2.945 635 HB2 SER 83 1HB SER 83 3.146 -33.156 0.002 636 HB3 SER 83 2HB SER 83 2.987 -34.668 0.881 637 HG SER 83 HG SER 83 1.082 -33.944 1.193 638 H GLY 84 H GLY 84 6.255 -32.296 2.782 639 HA2 GLY 84 1HA GLY 84 8.397 -33.336 2.697 640 HA3 GLY 84 2HA GLY 84 7.795 -34.486 1.518 641 H ARG 85 H ARG 85 6.866 -31.248 0.890 642 HA ARG 85 HA ARG 85 9.177 -30.857 -0.954 643 HB2 ARG 85 1HB ARG 85 6.239 -30.493 -1.632 644 HB3 ARG 85 2HB ARG 85 7.571 -29.962 -2.648 645 HG2 ARG 85 1HG ARG 85 7.128 -32.844 -1.837 646 HG3 ARG 85 2HG ARG 85 6.520 -32.112 -3.342 647 HD2 ARG 85 1HD ARG 85 8.829 -31.525 -3.940 648 HD3 ARG 85 2HD ARG 85 9.391 -32.372 -2.480 649 HE ARG 85 HE ARG 85 8.343 -33.562 -4.942 650 HH11 ARG 85 1HH1 ARG 85 9.309 -34.028 -1.597 651 HH12 ARG 85 2HH1 ARG 85 9.529 -35.755 -1.770 652 HH21 ARG 85 1HH2 ARG 85 8.632 -35.804 -5.154 653 HH22 ARG 85 2HH2 ARG 85 9.147 -36.761 -3.783 654 H ALA 86 H ALA 86 10.065 -29.341 0.460 655 HA ALA 86 HA ALA 86 8.558 -27.020 1.313 656 HB1 ALA 86 1HB ALA 86 10.762 -26.145 2.014 657 HB2 ALA 86 2HB ALA 86 10.505 -27.813 2.579 658 HB3 ALA 86 3HB ALA 86 11.557 -27.499 1.179 659 H LEU 87 H LEU 87 8.089 -25.233 0.262 660 HA LEU 87 HA LEU 87 9.460 -24.797 -2.358 661 HB2 LEU 87 1HB LEU 87 6.622 -24.058 -1.562 662 HB3 LEU 87 2HB LEU 87 7.365 -23.781 -3.140 663 HG LEU 87 HG LEU 87 6.768 -26.498 -1.915 664 HD11 LEU 87 1HD1 LEU 87 5.060 -26.622 -3.673 665 HD12 LEU 87 2HD1 LEU 87 4.759 -25.268 -2.559 666 HD13 LEU 87 3HD1 LEU 87 5.450 -24.959 -4.170 667 HD21 LEU 87 1HD2 LEU 87 7.417 -27.345 -4.144 668 HD22 LEU 87 2HD2 LEU 87 7.841 -25.691 -4.649 669 HD23 LEU 87 3HD2 LEU 87 8.772 -26.495 -3.363 670 H ARG 88 H ARG 88 9.985 -22.718 -2.991 671 HA ARG 88 HA ARG 88 10.091 -20.736 -0.787 672 HB2 ARG 88 1HB ARG 88 12.184 -21.109 -1.945 673 HB3 ARG 88 2HB ARG 88 11.429 -20.847 -3.510 674 HG2 ARG 88 1HG ARG 88 10.985 -18.482 -2.853 675 HG3 ARG 88 2HG ARG 88 11.891 -18.779 -1.349 676 HD2 ARG 88 1HD ARG 88 13.884 -19.161 -2.509 677 HD3 ARG 88 2HD ARG 88 13.042 -19.297 -4.070 678 HE ARG 88 HE ARG 88 12.668 -16.730 -2.798 679 HH11 ARG 88 1HH1 ARG 88 14.812 -18.644 -4.817 680 HH12 ARG 88 2HH1 ARG 88 15.550 -17.250 -5.573 681 HH21 ARG 88 1HH2 ARG 88 13.633 -14.927 -3.786 682 HH22 ARG 88 2HH2 ARG 88 14.883 -15.146 -4.990 683 H VAL 89 H VAL 89 8.821 -19.015 -0.682 684 HA VAL 89 HA VAL 89 7.237 -18.306 -3.112 685 HB VAL 89 HB VAL 89 6.199 -18.460 -0.249 686 HG11 VAL 89 1HG1 VAL 89 4.018 -17.960 -1.240 687 HG12 VAL 89 2HG1 VAL 89 5.185 -16.641 -1.496 688 HG13 VAL 89 3HG1 VAL 89 4.789 -17.752 -2.830 689 HG21 VAL 89 1HG2 VAL 89 4.803 -20.311 -1.116 690 HG22 VAL 89 2HG2 VAL 89 5.606 -20.172 -2.699 691 HG23 VAL 89 3HG2 VAL 89 6.536 -20.685 -1.270 692 H ASP 90 H ASP 90 7.952 -16.369 -3.699 693 HA ASP 90 HA ASP 90 8.236 -14.303 -1.555 694 HB2 ASP 90 1HB ASP 90 9.771 -14.617 -4.163 695 HB3 ASP 90 2HB ASP 90 9.823 -13.162 -3.176 696 H ASN 91 H ASN 91 8.109 -12.015 -2.587 697 HA ASN 91 HA ASN 91 5.471 -11.800 -3.788 698 HB2 ASN 91 1HB ASN 91 6.430 -10.171 -2.128 699 HB3 ASN 91 2HB ASN 91 7.551 -9.630 -3.370 700 HD21 ASN 91 1HD2 ASN 91 4.522 -7.443 -3.257 701 HD22 ASN 91 2HD2 ASN 91 5.653 -8.000 -2.070 702 H ALA 92 H ALA 92 4.933 -11.846 -5.824 703 HA ALA 92 HA ALA 92 6.865 -12.303 -7.862 704 HB1 ALA 92 1HB ALA 92 4.960 -12.084 -9.425 705 HB2 ALA 92 2HB ALA 92 4.550 -13.103 -8.025 706 HB3 ALA 92 3HB ALA 92 3.964 -11.426 -8.106 707 H ALA 93 H ALA 93 5.479 -9.376 -6.580 708 HA ALA 93 HA ALA 93 6.329 -7.817 -8.937 709 HB1 ALA 93 1HB ALA 93 5.236 -5.922 -7.781 710 HB2 ALA 93 2HB ALA 93 4.143 -7.318 -7.938 711 HB3 ALA 93 3HB ALA 93 4.923 -6.969 -6.378 712 H SER 94 H SER 94 7.943 -9.091 -6.470 713 HA SER 94 HA SER 94 9.312 -6.925 -5.245 714 HB2 SER 94 1HB SER 94 9.453 -9.170 -4.351 715 HB3 SER 94 2HB SER 94 10.181 -9.771 -5.833 716 HG SER 94 HG SER 94 11.234 -8.068 -3.886 717 H GLU 95 H GLU 95 10.559 -5.426 -6.084 718 HA GLU 95 HA GLU 95 11.715 -5.711 -8.741 719 HB2 GLU 95 1HB GLU 95 11.995 -3.573 -6.594 720 HB3 GLU 95 2HB GLU 95 12.766 -3.472 -8.171 721 HG2 GLU 95 1HG GLU 95 9.782 -3.671 -7.705 722 HG3 GLU 95 2HG GLU 95 10.671 -2.180 -8.009 723 H LYS 96 H LYS 96 12.784 -6.175 -5.445 724 HA LYS 96 HA LYS 96 15.612 -6.125 -6.015 725 HB2 LYS 96 1HB LYS 96 13.995 -7.331 -3.740 726 HB3 LYS 96 2HB LYS 96 15.751 -7.382 -3.802 727 HG2 LYS 96 1HG LYS 96 15.835 -4.920 -3.806 728 HG3 LYS 96 2HG LYS 96 14.067 -4.861 -3.761 729 HD2 LYS 96 1HD LYS 96 14.082 -6.078 -1.605 730 HD3 LYS 96 2HD LYS 96 15.850 -6.132 -1.650 731 HE2 LYS 96 1HE LYS 96 15.941 -3.670 -1.612 732 HE3 LYS 96 2HE LYS 96 14.177 -3.593 -1.611 733 HZ1 LYS 96 1HZ LYS 96 15.072 -3.350 0.586 734 HZ2 LYS 96 2HZ LYS 96 14.186 -4.739 0.497 735 HZ3 LYS 96 3HZ LYS 96 15.834 -4.810 0.496 736 H ASN 97 H ASN 97 13.120 -8.621 -6.077 737 HA ASN 97 HA ASN 97 15.179 -10.634 -6.817 738 HB2 ASN 97 1HB ASN 97 12.242 -10.903 -6.101 739 HB3 ASN 97 2HB ASN 97 13.249 -12.242 -6.635 740 HD21 ASN 97 1HD2 ASN 97 13.416 -10.878 -2.831 741 HD22 ASN 97 2HD2 ASN 97 12.404 -10.154 -4.036 742 H LYS 98 H LYS 98 13.679 -8.314 -8.405 743 HA LYS 98 HA LYS 98 12.345 -9.723 -10.538 744 HB2 LYS 98 1HB LYS 98 11.952 -7.314 -9.947 745 HB3 LYS 98 2HB LYS 98 13.554 -6.929 -10.562 746 HG2 LYS 98 1HG LYS 98 12.923 -7.562 -12.805 747 HG3 LYS 98 2HG LYS 98 11.368 -8.189 -12.240 748 HD2 LYS 98 1HD LYS 98 10.756 -5.900 -11.463 749 HD3 LYS 98 2HD LYS 98 12.287 -5.293 -12.110 750 HE2 LYS 98 1HE LYS 98 11.635 -6.013 -14.373 751 HE3 LYS 98 2HE LYS 98 10.123 -6.671 -13.743 752 HZ1 LYS 98 1HZ LYS 98 9.817 -4.500 -14.683 753 HZ2 LYS 98 2HZ LYS 98 9.509 -4.453 -13.063 754 HZ3 LYS 98 3HZ LYS 98 10.921 -3.838 -13.653 755 H GLU 99 H GLU 99 15.643 -8.518 -10.058 756 HA GLU 99 HA GLU 99 16.550 -9.104 -12.719 757 HB2 GLU 99 1HB GLU 99 18.040 -8.833 -10.080 758 HB3 GLU 99 2HB GLU 99 18.843 -9.045 -11.629 759 HG2 GLU 99 1HG GLU 99 17.031 -6.740 -10.877 760 HG3 GLU 99 2HG GLU 99 18.793 -6.706 -10.920 761 H GLU 100 H GLU 100 16.368 -10.996 -9.731 762 HA GLU 100 HA GLU 100 17.690 -13.330 -10.683 763 HB2 GLU 100 1HB GLU 100 17.027 -12.961 -8.313 764 HB3 GLU 100 2HB GLU 100 15.334 -13.115 -8.764 765 HG2 GLU 100 1HG GLU 100 15.723 -15.435 -9.470 766 HG3 GLU 100 2HG GLU 100 17.426 -15.284 -9.044 767 H LEU 101 H LEU 101 14.268 -12.333 -10.872 768 HA LEU 101 HA LEU 101 13.298 -14.648 -12.184 769 HB2 LEU 101 1HB LEU 101 12.399 -11.752 -12.371 770 HB3 LEU 101 2HB LEU 101 11.493 -13.116 -13.033 771 HG LEU 101 HG LEU 101 12.146 -12.724 -10.091 772 HD11 LEU 101 1HD1 LEU 101 9.764 -12.169 -9.880 773 HD12 LEU 101 2HD1 LEU 101 10.617 -11.015 -10.931 774 HD13 LEU 101 3HD1 LEU 101 9.583 -12.274 -11.647 775 HD21 LEU 101 1HD2 LEU 101 10.520 -14.561 -9.789 776 HD22 LEU 101 2HD2 LEU 101 10.349 -14.701 -11.555 777 HD23 LEU 101 3HD2 LEU 101 11.903 -15.087 -10.779 778 H LYS 102 H LYS 102 14.874 -11.739 -13.449 779 HA LYS 102 HA LYS 102 14.496 -12.314 -16.220 780 HB2 LYS 102 1HB LYS 102 16.666 -10.773 -14.748 781 HB3 LYS 102 2HB LYS 102 16.572 -10.863 -16.502 782 HG2 LYS 102 1HG LYS 102 14.368 -9.787 -16.464 783 HG3 LYS 102 2HG LYS 102 14.411 -9.738 -14.696 784 HD2 LYS 102 1HD LYS 102 16.474 -8.341 -14.811 785 HD3 LYS 102 2HD LYS 102 16.354 -8.346 -16.577 786 HE2 LYS 102 1HE LYS 102 14.164 -7.236 -16.452 787 HE3 LYS 102 2HE LYS 102 14.223 -7.277 -14.688 788 HZ1 LYS 102 1HZ LYS 102 14.894 -5.155 -15.544 789 HZ2 LYS 102 2HZ LYS 102 16.167 -5.873 -14.779 790 HZ3 LYS 102 3HZ LYS 102 16.111 -5.834 -16.427 791 H SER 103 H SER 103 17.074 -13.220 -13.937 792 HA SER 103 HA SER 103 18.659 -14.553 -15.954 793 HB2 SER 103 1HB SER 103 20.021 -15.299 -14.124 794 HB3 SER 103 2HB SER 103 19.549 -13.638 -13.801 795 HG SER 103 HG SER 103 17.672 -14.861 -12.732 796 H LEU 104 H LEU 104 16.019 -15.492 -13.854 797 HA LEU 104 HA LEU 104 16.340 -18.344 -14.355 798 HB2 LEU 104 1HB LEU 104 14.046 -16.693 -13.245 799 HB3 LEU 104 2HB LEU 104 14.012 -18.453 -13.381 800 HG LEU 104 HG LEU 104 16.001 -16.879 -11.707 801 HD11 LEU 104 1HD1 LEU 104 14.696 -17.706 -9.800 802 HD12 LEU 104 2HD1 LEU 104 13.720 -16.664 -10.863 803 HD13 LEU 104 3HD1 LEU 104 13.519 -18.431 -10.921 804 HD21 LEU 104 1HD2 LEU 104 16.533 -19.108 -10.781 805 HD22 LEU 104 2HD2 LEU 104 15.382 -19.854 -11.915 806 HD23 LEU 104 3HD2 LEU 104 16.845 -19.052 -12.532 807 H GLY 105 H GLY 105 14.640 -15.651 -15.836 808 HA2 GLY 105 1HA GLY 105 13.837 -15.547 -18.040 809 HA3 GLY 105 2HA GLY 105 14.172 -17.257 -18.238 810 H THR 106 H THR 106 12.318 -16.004 -15.519 811 HA THR 106 HA THR 106 10.026 -17.646 -16.414 812 HB THR 106 HB THR 106 9.158 -17.316 -14.126 813 HG1 THR 106 HG1 THR 106 11.363 -15.533 -13.975 814 HG21 THR 106 1HG2 THR 106 10.953 -18.471 -12.896 815 HG22 THR 106 2HG2 THR 106 10.772 -19.142 -14.534 816 HG23 THR 106 3HG2 THR 106 12.114 -18.033 -14.170 817 H GLY 107 H GLY 107 7.818 -16.813 -16.073 818 HA2 GLY 107 1HA GLY 107 7.034 -14.187 -15.684 819 HA3 GLY 107 2HA GLY 107 7.511 -14.216 -17.371 Start of MODEL 7 1 H MET 1 1H MET 1 3.257 -3.060 -3.093 2 HA MET 1 HA MET 1 4.560 -1.084 -3.121 3 HB2 MET 1 1HB MET 1 1.759 -0.774 -1.972 4 HB3 MET 1 2HB MET 1 2.671 0.505 -2.762 5 HG2 MET 1 1HG MET 1 1.827 -2.087 -4.090 6 HG3 MET 1 2HG MET 1 0.973 -0.547 -4.224 7 HE1 MET 1 1HE MET 1 4.498 -1.969 -6.655 8 HE2 MET 1 2HE MET 1 4.359 -2.438 -4.942 9 HE3 MET 1 3HE MET 1 3.052 -2.837 -6.084 10 H ALA 2 H ALA 2 4.542 1.131 -1.917 11 HA ALA 2 HA ALA 2 4.967 0.672 0.989 12 HB1 ALA 2 1HB ALA 2 7.055 1.996 0.898 13 HB2 ALA 2 2HB ALA 2 7.173 0.511 -0.077 14 HB3 ALA 2 3HB ALA 2 6.915 2.081 -0.873 15 H GLY 3 H GLY 3 2.693 1.713 0.420 16 HA2 GLY 3 1HA GLY 3 1.392 3.601 0.895 17 HA3 GLY 3 2HA GLY 3 2.855 4.529 1.168 18 H LEU 4 H LEU 4 2.388 2.663 -1.774 19 HA LEU 4 HA LEU 4 2.633 5.193 -3.294 20 HB2 LEU 4 1HB LEU 4 2.873 2.305 -4.209 21 HB3 LEU 4 2HB LEU 4 3.204 3.732 -5.195 22 HG LEU 4 HG LEU 4 4.764 2.923 -2.715 23 HD11 LEU 4 1HD1 LEU 4 6.526 2.324 -4.315 24 HD12 LEU 4 2HD1 LEU 4 5.060 1.346 -4.556 25 HD13 LEU 4 3HD1 LEU 4 5.426 2.689 -5.664 26 HD21 LEU 4 1HD2 LEU 4 6.325 4.682 -3.478 27 HD22 LEU 4 2HD2 LEU 4 5.221 5.081 -4.816 28 HD23 LEU 4 3HD2 LEU 4 4.715 5.360 -3.133 29 H THR 5 H THR 5 1.257 5.816 -4.926 30 HA THR 5 HA THR 5 -1.454 4.647 -4.774 31 HB THR 5 HB THR 5 -0.424 7.136 -6.202 32 HG1 THR 5 HG1 THR 5 -1.706 6.639 -3.719 33 HG21 THR 5 1HG2 THR 5 -2.808 7.677 -6.503 34 HG22 THR 5 2HG2 THR 5 -2.392 6.158 -7.330 35 HG23 THR 5 3HG2 THR 5 -3.259 6.117 -5.778 36 H VAL 6 H VAL 6 -2.140 3.169 -6.125 37 HA VAL 6 HA VAL 6 -0.794 2.980 -8.788 38 HB VAL 6 HB VAL 6 -2.049 0.760 -7.118 39 HG11 VAL 6 1HG1 VAL 6 -1.172 -0.750 -8.832 40 HG12 VAL 6 2HG1 VAL 6 -2.372 0.385 -9.494 41 HG13 VAL 6 3HG1 VAL 6 -0.637 0.650 -9.791 42 HG21 VAL 6 1HG2 VAL 6 0.277 -0.065 -6.938 43 HG22 VAL 6 2HG2 VAL 6 0.850 1.361 -7.835 44 HG23 VAL 6 3HG2 VAL 6 0.113 1.558 -6.227 45 H ARG 7 H ARG 7 -2.029 3.494 -10.446 46 HA ARG 7 HA ARG 7 -4.977 3.086 -10.183 47 HB2 ARG 7 1HB ARG 7 -3.431 5.022 -11.939 48 HB3 ARG 7 2HB ARG 7 -5.172 4.795 -11.991 49 HG2 ARG 7 1HG ARG 7 -5.349 5.575 -9.662 50 HG3 ARG 7 2HG ARG 7 -3.585 5.816 -9.621 51 HD2 ARG 7 1HD ARG 7 -3.760 7.417 -11.434 52 HD3 ARG 7 2HD ARG 7 -5.522 7.173 -11.483 53 HE ARG 7 HE ARG 7 -4.777 7.875 -8.850 54 HH11 ARG 7 1HH1 ARG 7 -4.943 9.279 -12.066 55 HH12 ARG 7 2HH1 ARG 7 -5.198 10.906 -11.479 56 HH21 ARG 7 1HH2 ARG 7 -5.109 9.992 -8.100 57 HH22 ARG 7 2HH2 ARG 7 -5.292 11.312 -9.234 58 H ASP 8 H ASP 8 -2.401 1.533 -11.325 59 HA ASP 8 HA ASP 8 -3.625 0.837 -13.950 60 HB2 ASP 8 1HB ASP 8 -1.218 1.512 -13.926 61 HB3 ASP 8 2HB ASP 8 -0.864 0.163 -12.855 62 HA PRO 9 HA PRO 9 -5.362 -2.657 -11.837 63 HB2 PRO 9 1HB PRO 9 -5.778 -3.378 -14.769 64 HB3 PRO 9 2HB PRO 9 -6.912 -3.524 -13.420 65 HG2 PRO 9 1HG PRO 9 -7.202 -1.469 -15.078 66 HG3 PRO 9 2HG PRO 9 -7.341 -1.181 -13.341 67 HD2 PRO 9 1HD PRO 9 -4.989 -0.643 -15.193 68 HD3 PRO 9 2HD PRO 9 -5.638 0.375 -13.845 69 H ALA 10 H ALA 10 -3.169 -2.738 -14.640 70 HA ALA 10 HA ALA 10 -2.474 -5.494 -14.491 71 HB1 ALA 10 1HB ALA 10 -0.495 -4.851 -15.829 72 HB2 ALA 10 2HB ALA 10 -1.986 -4.108 -16.457 73 HB3 ALA 10 3HB ALA 10 -0.842 -3.137 -15.502 74 H VAL 11 H VAL 11 -1.062 -2.615 -12.958 75 HA VAL 11 HA VAL 11 1.073 -4.027 -11.653 76 HB VAL 11 HB VAL 11 -0.330 -1.409 -10.971 77 HG11 VAL 11 1HG1 VAL 11 1.604 -0.922 -9.553 78 HG12 VAL 11 2HG1 VAL 11 0.693 -2.337 -8.974 79 HG13 VAL 11 3HG1 VAL 11 2.230 -2.562 -9.844 80 HG21 VAL 11 1HG2 VAL 11 1.696 -0.408 -11.978 81 HG22 VAL 11 2HG2 VAL 11 2.317 -2.035 -12.345 82 HG23 VAL 11 3HG2 VAL 11 0.842 -1.443 -13.146 83 H ASP 12 H ASP 12 -2.241 -3.153 -10.688 84 HA ASP 12 HA ASP 12 -2.141 -4.105 -8.024 85 HB2 ASP 12 1HB ASP 12 -4.403 -3.954 -10.045 86 HB3 ASP 12 2HB ASP 12 -4.655 -4.519 -8.399 87 H ARG 13 H ARG 13 -2.722 -5.813 -11.081 88 HA ARG 13 HA ARG 13 -3.351 -8.343 -9.876 89 HB2 ARG 13 1HB ARG 13 -2.306 -7.586 -12.619 90 HB3 ARG 13 2HB ARG 13 -2.685 -9.241 -12.166 91 HG2 ARG 13 1HG ARG 13 -5.029 -8.486 -11.655 92 HG3 ARG 13 2HG ARG 13 -4.596 -6.905 -12.349 93 HD2 ARG 13 1HD ARG 13 -5.655 -8.179 -14.033 94 HD3 ARG 13 2HD ARG 13 -3.920 -8.104 -14.422 95 HE ARG 13 HE ARG 13 -4.585 -10.445 -12.890 96 HH11 ARG 13 1HH1 ARG 13 -4.647 -9.065 -16.120 97 HH12 ARG 13 2HH1 ARG 13 -4.594 -10.619 -16.921 98 HH21 ARG 13 1HH2 ARG 13 -4.516 -12.457 -13.941 99 HH22 ARG 13 2HH2 ARG 13 -4.520 -12.540 -15.688 100 H SER 14 H SER 14 -0.328 -6.849 -11.000 101 HA SER 14 HA SER 14 1.294 -9.178 -10.446 102 HB2 SER 14 1HB SER 14 3.165 -7.752 -10.880 103 HB3 SER 14 2HB SER 14 1.903 -7.321 -12.023 104 HG SER 14 HG SER 14 1.399 -5.850 -10.017 105 H LEU 15 H LEU 15 0.044 -6.539 -8.548 106 HA LEU 15 HA LEU 15 1.853 -6.877 -6.316 107 HB2 LEU 15 1HB LEU 15 0.556 -4.809 -6.690 108 HB3 LEU 15 2HB LEU 15 -0.948 -5.701 -6.436 109 HG LEU 15 HG LEU 15 -0.284 -6.138 -4.089 110 HD11 LEU 15 1HD1 LEU 15 1.665 -4.973 -3.156 111 HD12 LEU 15 2HD1 LEU 15 2.136 -6.142 -4.412 112 HD13 LEU 15 3HD1 LEU 15 2.103 -4.402 -4.783 113 HD21 LEU 15 1HD2 LEU 15 -0.551 -3.806 -3.313 114 HD22 LEU 15 2HD2 LEU 15 -0.145 -3.217 -4.943 115 HD23 LEU 15 3HD2 LEU 15 -1.636 -4.154 -4.682 116 H ARG 16 H ARG 16 -1.379 -8.122 -7.137 117 HA ARG 16 HA ARG 16 -1.490 -9.666 -4.638 118 HB2 ARG 16 1HB ARG 16 -3.691 -10.306 -5.324 119 HB3 ARG 16 2HB ARG 16 -3.516 -8.593 -5.670 120 HG2 ARG 16 1HG ARG 16 -3.021 -9.203 -8.061 121 HG3 ARG 16 2HG ARG 16 -3.445 -10.882 -7.644 122 HD2 ARG 16 1HD ARG 16 -5.638 -10.051 -6.846 123 HD3 ARG 16 2HD ARG 16 -5.201 -8.447 -7.479 124 HE ARG 16 HE ARG 16 -4.846 -10.373 -9.522 125 HH11 ARG 16 1HH1 ARG 16 -7.405 -8.819 -7.683 126 HH12 ARG 16 2HH1 ARG 16 -8.588 -8.972 -8.962 127 HH21 ARG 16 1HH2 ARG 16 -6.391 -10.565 -11.175 128 HH22 ARG 16 2HH2 ARG 16 -8.016 -9.960 -10.939 129 H SER 17 H SER 17 0.151 -10.053 -7.449 130 HA SER 17 HA SER 17 -0.123 -13.018 -7.393 131 HB2 SER 17 1HB SER 17 1.259 -11.156 -9.352 132 HB3 SER 17 2HB SER 17 1.310 -12.910 -9.451 133 HG SER 17 HG SER 17 -0.835 -11.157 -9.757 134 H VAL 18 H VAL 18 1.682 -14.363 -7.153 135 HA VAL 18 HA VAL 18 4.121 -13.012 -6.077 136 HB VAL 18 HB VAL 18 4.383 -14.846 -4.467 137 HG11 VAL 18 1HG1 VAL 18 2.508 -14.331 -2.981 138 HG12 VAL 18 2HG1 VAL 18 3.165 -12.870 -3.757 139 HG13 VAL 18 3HG1 VAL 18 1.639 -13.579 -4.340 140 HG21 VAL 18 1HG2 VAL 18 2.574 -16.508 -4.168 141 HG22 VAL 18 2HG2 VAL 18 1.714 -15.822 -5.567 142 HG23 VAL 18 3HG2 VAL 18 3.289 -16.620 -5.794 143 H PHE 19 H PHE 19 6.106 -14.206 -6.313 144 HA PHE 19 HA PHE 19 6.023 -16.161 -8.562 145 HB2 PHE 19 1HB PHE 19 7.480 -14.188 -8.893 146 HB3 PHE 19 2HB PHE 19 8.353 -14.569 -7.418 147 HD1 PHE 19 HD1 PHE 19 7.244 -16.552 -10.401 148 HD2 PHE 19 HD2 PHE 19 10.452 -15.383 -7.833 149 HE1 PHE 19 HE1 PHE 19 8.795 -17.982 -11.690 150 HE2 PHE 19 HE2 PHE 19 12.006 -16.809 -9.121 151 HZ PHE 19 HZ PHE 19 11.176 -18.111 -11.049 152 H VAL 20 H VAL 20 6.407 -18.235 -8.227 153 HA VAL 20 HA VAL 20 7.353 -19.003 -5.497 154 HB VAL 20 HB VAL 20 5.503 -20.536 -7.374 155 HG11 VAL 20 1HG1 VAL 20 5.139 -22.008 -5.454 156 HG12 VAL 20 2HG1 VAL 20 6.840 -22.005 -5.979 157 HG13 VAL 20 3HG1 VAL 20 6.354 -21.097 -4.527 158 HG21 VAL 20 1HG2 VAL 20 3.749 -19.970 -5.723 159 HG22 VAL 20 2HG2 VAL 20 4.925 -18.994 -4.811 160 HG23 VAL 20 3HG2 VAL 20 4.444 -18.503 -6.452 161 H GLY 21 H GLY 21 9.204 -20.059 -5.367 162 HA2 GLY 21 1HA GLY 21 10.180 -21.522 -7.794 163 HA3 GLY 21 2HA GLY 21 11.231 -20.784 -6.600 164 H ASN 22 H ASN 22 11.869 -23.266 -7.039 165 HA ASN 22 HA ASN 22 12.118 -25.366 -6.127 166 HB2 ASN 22 1HB ASN 22 11.035 -23.976 -3.654 167 HB3 ASN 22 2HB ASN 22 11.805 -25.557 -3.670 168 HD21 ASN 22 1HD2 ASN 22 14.263 -22.897 -2.761 169 HD22 ASN 22 2HD2 ASN 22 12.699 -23.353 -2.172 170 H ILE 23 H ILE 23 9.792 -24.971 -7.611 171 HA ILE 23 HA ILE 23 7.607 -26.270 -6.137 172 HB ILE 23 HB ILE 23 7.888 -25.422 -9.050 173 HG12 ILE 23 1HG1 ILE 23 6.189 -24.263 -6.832 174 HG13 ILE 23 2HG1 ILE 23 7.754 -23.625 -7.312 175 HG21 ILE 23 1HG2 ILE 23 5.481 -25.905 -9.228 176 HG22 ILE 23 2HG2 ILE 23 6.402 -27.379 -8.848 177 HG23 ILE 23 3HG2 ILE 23 5.484 -26.550 -7.570 178 HD11 ILE 23 1HD1 ILE 23 5.943 -22.362 -8.330 179 HD12 ILE 23 2HD1 ILE 23 6.901 -23.199 -9.576 180 HD13 ILE 23 3HD1 ILE 23 5.315 -23.843 -9.090 181 HA PRO 24 HA PRO 24 8.917 -30.415 -6.966 182 HB2 PRO 24 1HB PRO 24 5.910 -30.778 -6.686 183 HB3 PRO 24 2HB PRO 24 7.216 -31.727 -5.963 184 HG2 PRO 24 1HG PRO 24 5.956 -29.960 -4.429 185 HG3 PRO 24 2HG PRO 24 7.717 -30.060 -4.335 186 HD2 PRO 24 1HD PRO 24 5.988 -28.049 -5.833 187 HD3 PRO 24 2HD PRO 24 7.472 -27.759 -4.840 188 H TYR 25 H TYR 25 9.325 -31.052 -8.995 189 HA TYR 25 HA TYR 25 7.841 -30.013 -11.238 190 HB2 TYR 25 1HB TYR 25 9.475 -31.005 -12.584 191 HB3 TYR 25 2HB TYR 25 10.350 -30.702 -11.089 192 HD1 TYR 25 HD1 TYR 25 8.818 -33.277 -13.225 193 HD2 TYR 25 HD2 TYR 25 11.091 -32.506 -9.668 194 HE1 TYR 25 HE1 TYR 25 9.432 -35.668 -13.099 195 HE2 TYR 25 HE2 TYR 25 11.705 -34.897 -9.542 196 HH TYR 25 HH TYR 25 11.113 -36.992 -10.323 197 H GLU 26 H GLU 26 7.406 -32.726 -9.210 198 HA GLU 26 HA GLU 26 6.031 -34.349 -11.224 199 HB2 GLU 26 1HB GLU 26 6.280 -34.629 -8.203 200 HB3 GLU 26 2HB GLU 26 5.468 -35.794 -9.240 201 HG2 GLU 26 1HG GLU 26 7.566 -36.228 -10.427 202 HG3 GLU 26 2HG GLU 26 8.389 -35.027 -9.434 203 H ALA 27 H ALA 27 5.246 -31.690 -9.270 204 HA ALA 27 HA ALA 27 2.403 -32.432 -9.022 205 HB1 ALA 27 1HB ALA 27 2.194 -30.280 -7.821 206 HB2 ALA 27 2HB ALA 27 3.487 -31.293 -7.137 207 HB3 ALA 27 3HB ALA 27 3.896 -29.918 -8.188 208 H THR 28 H THR 28 0.751 -31.641 -10.174 209 HA THR 28 HA THR 28 1.428 -30.120 -12.604 210 HB THR 28 HB THR 28 -0.863 -30.577 -13.312 211 HG1 THR 28 HG1 THR 28 -1.897 -32.098 -11.496 212 HG21 THR 28 1HG2 THR 28 -0.844 -33.040 -13.258 213 HG22 THR 28 2HG2 THR 28 0.786 -32.398 -13.571 214 HG23 THR 28 3HG2 THR 28 0.365 -33.006 -11.953 215 H GLU 29 H GLU 29 -0.149 -28.383 -13.294 216 HA GLU 29 HA GLU 29 0.052 -26.207 -11.479 217 HB2 GLU 29 1HB GLU 29 -1.620 -26.624 -13.981 218 HB3 GLU 29 2HB GLU 29 -1.614 -25.107 -13.093 219 HG2 GLU 29 1HG GLU 29 0.779 -24.850 -13.481 220 HG3 GLU 29 2HG GLU 29 0.838 -26.413 -14.292 221 H GLU 30 H GLU 30 -2.614 -28.431 -12.197 222 HA GLU 30 HA GLU 30 -4.575 -26.999 -10.649 223 HB2 GLU 30 1HB GLU 30 -4.429 -29.896 -11.569 224 HB3 GLU 30 2HB GLU 30 -5.821 -29.207 -10.746 225 HG2 GLU 30 1HG GLU 30 -4.699 -28.280 -13.400 226 HG3 GLU 30 2HG GLU 30 -6.119 -29.298 -13.172 227 H GLN 31 H GLN 31 -2.348 -29.674 -9.934 228 HA GLN 31 HA GLN 31 -3.314 -30.144 -7.274 229 HB2 GLN 31 1HB GLN 31 -0.639 -30.701 -8.605 230 HB3 GLN 31 2HB GLN 31 -1.007 -31.191 -6.958 231 HG2 GLN 31 1HG GLN 31 -2.812 -32.609 -7.724 232 HG3 GLN 31 2HG GLN 31 -2.575 -32.042 -9.401 233 HE21 GLN 31 1HE2 GLN 31 -0.775 -35.337 -8.400 234 HE22 GLN 31 2HE2 GLN 31 -2.298 -34.723 -7.848 235 H LEU 32 H LEU 32 -0.855 -27.979 -8.619 236 HA LEU 32 HA LEU 32 0.199 -27.157 -6.070 237 HB2 LEU 32 1HB LEU 32 0.256 -25.878 -8.822 238 HB3 LEU 32 2HB LEU 32 1.099 -25.208 -7.422 239 HG LEU 32 HG LEU 32 1.625 -27.991 -8.513 240 HD11 LEU 32 1HD1 LEU 32 3.609 -27.004 -9.568 241 HD12 LEU 32 2HD1 LEU 32 2.105 -26.318 -10.225 242 HD13 LEU 32 3HD1 LEU 32 3.075 -25.385 -9.060 243 HD21 LEU 32 1HD2 LEU 32 3.690 -27.758 -7.175 244 HD22 LEU 32 2HD2 LEU 32 3.157 -26.149 -6.632 245 HD23 LEU 32 3HD2 LEU 32 2.243 -27.598 -6.151 246 H LYS 33 H LYS 33 -2.319 -25.873 -8.225 247 HA LYS 33 HA LYS 33 -2.914 -23.547 -6.672 248 HB2 LYS 33 1HB LYS 33 -4.543 -25.212 -8.617 249 HB3 LYS 33 2HB LYS 33 -5.219 -23.804 -7.809 250 HG2 LYS 33 1HG LYS 33 -3.316 -22.446 -8.777 251 HG3 LYS 33 2HG LYS 33 -2.882 -23.872 -9.730 252 HD2 LYS 33 1HD LYS 33 -5.653 -22.629 -9.768 253 HD3 LYS 33 2HD LYS 33 -4.370 -22.181 -10.902 254 HE2 LYS 33 1HE LYS 33 -4.207 -24.579 -11.600 255 HE3 LYS 33 2HE LYS 33 -5.568 -24.952 -10.539 256 HZ1 LYS 33 1HZ LYS 33 -6.273 -24.612 -12.792 257 HZ2 LYS 33 2HZ LYS 33 -6.912 -23.437 -11.826 258 HZ3 LYS 33 3HZ LYS 33 -5.641 -23.090 -12.818 259 H ASP 34 H ASP 34 -4.107 -26.890 -6.530 260 HA ASP 34 HA ASP 34 -6.021 -26.499 -4.464 261 HB2 ASP 34 1HB ASP 34 -4.316 -28.889 -5.243 262 HB3 ASP 34 2HB ASP 34 -5.496 -28.962 -3.941 263 H ILE 35 H ILE 35 -2.529 -27.209 -4.325 264 HA ILE 35 HA ILE 35 -2.300 -27.203 -1.487 265 HB ILE 35 HB ILE 35 -0.330 -26.478 -3.688 266 HG12 ILE 35 1HG1 ILE 35 -0.417 -28.882 -1.858 267 HG13 ILE 35 2HG1 ILE 35 -1.168 -28.844 -3.445 268 HG21 ILE 35 1HG2 ILE 35 1.420 -26.569 -1.958 269 HG22 ILE 35 2HG2 ILE 35 0.269 -25.251 -1.635 270 HG23 ILE 35 3HG2 ILE 35 0.174 -26.763 -0.702 271 HD11 ILE 35 1HD1 ILE 35 1.019 -29.901 -3.535 272 HD12 ILE 35 2HD1 ILE 35 1.013 -28.393 -4.481 273 HD13 ILE 35 3HD1 ILE 35 1.775 -28.433 -2.873 274 H PHE 36 H PHE 36 -2.205 -24.569 -3.876 275 HA PHE 36 HA PHE 36 -1.337 -22.603 -1.935 276 HB2 PHE 36 1HB PHE 36 -2.532 -22.290 -4.718 277 HB3 PHE 36 2HB PHE 36 -1.866 -20.971 -3.768 278 HD1 PHE 36 HD1 PHE 36 0.298 -23.193 -2.681 279 HD2 PHE 36 HD2 PHE 36 -0.864 -21.539 -6.445 280 HE1 PHE 36 HE1 PHE 36 2.548 -23.674 -3.586 281 HE2 PHE 36 HE2 PHE 36 1.384 -22.022 -7.354 282 HZ PHE 36 HZ PHE 36 3.091 -23.088 -5.923 283 H SER 37 H SER 37 -4.400 -23.897 -2.915 284 HA SER 37 HA SER 37 -6.066 -21.717 -2.098 285 HB2 SER 37 1HB SER 37 -7.863 -23.257 -2.219 286 HB3 SER 37 2HB SER 37 -6.731 -23.747 -3.471 287 HG SER 37 HG SER 37 -5.931 -25.299 -2.081 288 H GLU 38 H GLU 38 -4.228 -24.049 -0.324 289 HA GLU 38 HA GLU 38 -5.524 -24.037 2.169 290 HB2 GLU 38 1HB GLU 38 -3.497 -25.365 1.675 291 HB3 GLU 38 2HB GLU 38 -2.537 -23.895 1.589 292 HG2 GLU 38 1HG GLU 38 -2.971 -23.446 3.954 293 HG3 GLU 38 2HG GLU 38 -3.989 -24.881 4.054 294 H VAL 39 H VAL 39 -3.504 -21.554 0.653 295 HA VAL 39 HA VAL 39 -3.491 -19.873 3.034 296 HB VAL 39 HB VAL 39 -2.728 -19.303 0.139 297 HG11 VAL 39 1HG1 VAL 39 -1.609 -17.307 1.004 298 HG12 VAL 39 2HG1 VAL 39 -3.369 -17.248 1.261 299 HG13 VAL 39 3HG1 VAL 39 -2.282 -17.630 2.619 300 HG21 VAL 39 1HG2 VAL 39 -0.420 -19.485 1.014 301 HG22 VAL 39 2HG2 VAL 39 -1.064 -19.879 2.625 302 HG23 VAL 39 3HG2 VAL 39 -1.324 -20.996 1.265 303 H GLY 40 H GLY 40 -5.080 -19.741 -0.172 304 HA2 GLY 40 1HA GLY 40 -7.535 -18.682 0.796 305 HA3 GLY 40 2HA GLY 40 -6.531 -17.325 0.320 306 HA PRO 41 HA PRO 41 -8.994 -19.096 -3.242 307 HB2 PRO 41 1HB PRO 41 -9.335 -16.103 -3.654 308 HB3 PRO 41 2HB PRO 41 -10.515 -17.399 -3.888 309 HG2 PRO 41 1HG PRO 41 -10.695 -15.910 -1.689 310 HG3 PRO 41 2HG PRO 41 -10.907 -17.658 -1.555 311 HD2 PRO 41 1HD PRO 41 -8.452 -15.970 -0.926 312 HD3 PRO 41 2HD PRO 41 -9.157 -17.350 0.008 313 H VAL 42 H VAL 42 -7.951 -19.547 -5.098 314 HA VAL 42 HA VAL 42 -5.690 -17.781 -5.906 315 HB VAL 42 HB VAL 42 -6.302 -20.666 -6.680 316 HG11 VAL 42 1HG1 VAL 42 -4.058 -20.663 -7.655 317 HG12 VAL 42 2HG1 VAL 42 -5.130 -19.484 -8.447 318 HG13 VAL 42 3HG1 VAL 42 -3.901 -18.929 -7.285 319 HG21 VAL 42 1HG2 VAL 42 -4.354 -21.195 -5.250 320 HG22 VAL 42 2HG2 VAL 42 -4.214 -19.477 -4.807 321 HG23 VAL 42 3HG2 VAL 42 -5.646 -20.411 -4.312 322 H VAL 43 H VAL 43 -5.962 -16.483 -7.573 323 HA VAL 43 HA VAL 43 -8.340 -16.686 -9.239 324 HB VAL 43 HB VAL 43 -5.917 -14.841 -9.352 325 HG11 VAL 43 1HG1 VAL 43 -7.240 -13.457 -10.876 326 HG12 VAL 43 2HG1 VAL 43 -6.891 -15.060 -11.565 327 HG13 VAL 43 3HG1 VAL 43 -8.507 -14.705 -10.908 328 HG21 VAL 43 1HG2 VAL 43 -7.505 -13.186 -8.424 329 HG22 VAL 43 2HG2 VAL 43 -8.775 -14.432 -8.379 330 HG23 VAL 43 3HG2 VAL 43 -7.335 -14.591 -7.345 331 H SER 44 H SER 44 -4.817 -16.978 -9.793 332 HA SER 44 HA SER 44 -5.316 -18.847 -11.996 333 HB2 SER 44 1HB SER 44 -4.274 -17.571 -13.720 334 HB3 SER 44 2HB SER 44 -5.516 -16.550 -13.013 335 HG SER 44 HG SER 44 -4.073 -15.229 -12.430 336 H PHE 45 H PHE 45 -3.277 -19.692 -12.922 337 HA PHE 45 HA PHE 45 -0.807 -19.114 -11.466 338 HB2 PHE 45 1HB PHE 45 -1.795 -20.687 -9.896 339 HB3 PHE 45 2HB PHE 45 -2.188 -21.810 -11.188 340 HD1 PHE 45 HD1 PHE 45 0.735 -20.108 -9.606 341 HD2 PHE 45 HD2 PHE 45 -0.730 -23.534 -11.696 342 HE1 PHE 45 HE1 PHE 45 2.915 -21.230 -9.291 343 HE2 PHE 45 HE2 PHE 45 1.448 -24.661 -11.380 344 HZ PHE 45 HZ PHE 45 3.271 -23.507 -10.178 345 H ARG 46 H ARG 46 0.979 -19.583 -12.624 346 HA ARG 46 HA ARG 46 0.634 -21.311 -15.031 347 HB2 ARG 46 1HB ARG 46 0.574 -18.933 -15.719 348 HB3 ARG 46 2HB ARG 46 2.123 -18.664 -14.935 349 HG2 ARG 46 1HG ARG 46 3.246 -20.108 -16.504 350 HG3 ARG 46 2HG ARG 46 1.693 -20.596 -17.226 351 HD2 ARG 46 1HD ARG 46 2.703 -18.977 -18.630 352 HD3 ARG 46 2HD ARG 46 1.311 -18.220 -17.820 353 HE ARG 46 HE ARG 46 2.753 -16.861 -16.600 354 HH11 ARG 46 1HH1 ARG 46 4.551 -19.175 -18.537 355 HH12 ARG 46 2HH1 ARG 46 6.079 -18.347 -18.335 356 HH21 ARG 46 1HH2 ARG 46 4.741 -15.795 -16.345 357 HH22 ARG 46 2HH2 ARG 46 6.187 -16.433 -17.095 358 H LEU 47 H LEU 47 1.986 -22.952 -14.986 359 HA LEU 47 HA LEU 47 4.411 -22.746 -13.286 360 HB2 LEU 47 1HB LEU 47 2.898 -24.641 -12.881 361 HB3 LEU 47 2HB LEU 47 3.050 -25.144 -14.567 362 HG LEU 47 HG LEU 47 5.485 -25.574 -14.172 363 HD11 LEU 47 1HD1 LEU 47 6.289 -25.651 -11.854 364 HD12 LEU 47 2HD1 LEU 47 5.807 -24.005 -12.328 365 HD13 LEU 47 3HD1 LEU 47 4.738 -24.982 -11.294 366 HD21 LEU 47 1HD2 LEU 47 5.106 -27.628 -12.850 367 HD22 LEU 47 2HD2 LEU 47 3.538 -26.988 -12.303 368 HD23 LEU 47 3HD2 LEU 47 3.792 -27.370 -14.023 369 H VAL 48 H VAL 48 6.339 -22.434 -14.127 370 HA VAL 48 HA VAL 48 6.664 -22.479 -17.040 371 HB VAL 48 HB VAL 48 8.630 -21.818 -14.806 372 HG11 VAL 48 1HG1 VAL 48 9.992 -20.801 -16.565 373 HG12 VAL 48 2HG1 VAL 48 9.789 -22.552 -16.808 374 HG13 VAL 48 3HG1 VAL 48 8.853 -21.402 -17.793 375 HG21 VAL 48 1HG2 VAL 48 8.196 -19.478 -15.480 376 HG22 VAL 48 2HG2 VAL 48 6.999 -20.044 -16.670 377 HG23 VAL 48 3HG2 VAL 48 6.704 -20.276 -14.930 378 H TYR 49 H TYR 49 7.754 -23.924 -18.238 379 HA TYR 49 HA TYR 49 9.225 -26.095 -16.844 380 HB2 TYR 49 1HB TYR 49 8.023 -27.838 -18.029 381 HB3 TYR 49 2HB TYR 49 6.867 -26.859 -17.137 382 HD1 TYR 49 HD1 TYR 49 8.056 -27.872 -20.438 383 HD2 TYR 49 HD2 TYR 49 5.345 -25.324 -18.300 384 HE1 TYR 49 HE1 TYR 49 6.769 -27.498 -22.514 385 HE2 TYR 49 HE2 TYR 49 4.058 -24.951 -20.376 386 HH TYR 49 HH TYR 49 3.835 -25.472 -22.521 387 H ALA 50 H ALA 50 10.490 -27.449 -18.297 388 HA ALA 50 HA ALA 50 11.582 -25.792 -20.493 389 HB1 ALA 50 1HB ALA 50 13.475 -27.383 -20.445 390 HB2 ALA 50 2HB ALA 50 13.171 -26.671 -18.842 391 HB3 ALA 50 3HB ALA 50 12.637 -28.331 -19.195 392 H ARG 51 H ARG 51 11.499 -26.286 -22.590 393 HA ARG 51 HA ARG 51 9.633 -28.350 -23.431 394 HB2 ARG 51 1HB ARG 51 11.440 -26.461 -24.971 395 HB3 ARG 51 2HB ARG 51 10.351 -27.603 -25.745 396 HG2 ARG 51 1HG ARG 51 8.424 -26.504 -24.715 397 HG3 ARG 51 2HG ARG 51 9.511 -25.370 -23.879 398 HD2 ARG 51 1HD ARG 51 10.314 -24.562 -26.023 399 HD3 ARG 51 2HD ARG 51 9.224 -25.694 -26.857 400 HE ARG 51 HE ARG 51 7.642 -24.188 -25.118 401 HH11 ARG 51 1HH1 ARG 51 9.704 -23.627 -27.906 402 HH12 ARG 51 2HH1 ARG 51 8.796 -22.236 -28.455 403 HH21 ARG 51 1HH2 ARG 51 6.471 -22.381 -25.840 404 HH22 ARG 51 2HH2 ARG 51 6.966 -21.530 -27.286 405 H GLU 52 H GLU 52 13.073 -28.103 -23.011 406 HA GLU 52 HA GLU 52 13.824 -30.153 -24.891 407 HB2 GLU 52 1HB GLU 52 15.230 -29.009 -22.447 408 HB3 GLU 52 2HB GLU 52 15.966 -30.188 -23.522 409 HG2 GLU 52 1HG GLU 52 15.789 -28.629 -25.397 410 HG3 GLU 52 2HG GLU 52 14.984 -27.452 -24.361 411 H THR 53 H THR 53 12.901 -30.152 -21.479 412 HA THR 53 HA THR 53 13.309 -33.107 -21.426 413 HB THR 53 HB THR 53 13.272 -32.918 -18.970 414 HG1 THR 53 HG1 THR 53 13.372 -30.595 -18.219 415 HG21 THR 53 1HG2 THR 53 15.353 -31.634 -18.669 416 HG22 THR 53 2HG2 THR 53 15.427 -32.629 -20.143 417 HG23 THR 53 3HG2 THR 53 15.124 -30.881 -20.264 418 H GLY 54 H GLY 54 10.949 -30.551 -21.190 419 HA2 GLY 54 1HA GLY 54 8.611 -30.758 -21.354 420 HA3 GLY 54 2HA GLY 54 8.760 -32.502 -21.247 421 H LYS 55 H LYS 55 10.595 -30.960 -18.846 422 HA LYS 55 HA LYS 55 8.454 -31.547 -16.846 423 HB2 LYS 55 1HB LYS 55 11.483 -31.696 -16.585 424 HB3 LYS 55 2HB LYS 55 10.363 -31.900 -15.245 425 HG2 LYS 55 1HG LYS 55 9.376 -33.869 -16.373 426 HG3 LYS 55 2HG LYS 55 10.528 -33.670 -17.701 427 HD2 LYS 55 1HD LYS 55 12.408 -33.970 -16.125 428 HD3 LYS 55 2HD LYS 55 11.261 -34.155 -14.790 429 HE2 LYS 55 1HE LYS 55 10.301 -36.152 -15.887 430 HE3 LYS 55 2HE LYS 55 11.437 -35.967 -17.226 431 HZ1 LYS 55 1HZ LYS 55 12.199 -37.575 -15.638 432 HZ2 LYS 55 2HZ LYS 55 13.234 -36.290 -15.670 433 HZ3 LYS 55 3HZ LYS 55 12.173 -36.464 -14.419 434 HA PRO 56 HA PRO 56 8.299 -27.401 -15.549 435 HB2 PRO 56 1HB PRO 56 8.342 -28.608 -12.758 436 HB3 PRO 56 2HB PRO 56 7.233 -27.407 -13.432 437 HG2 PRO 56 1HG PRO 56 6.387 -29.920 -13.218 438 HG3 PRO 56 2HG PRO 56 6.025 -29.024 -14.696 439 HD2 PRO 56 1HD PRO 56 8.206 -31.088 -14.190 440 HD3 PRO 56 2HD PRO 56 7.125 -30.901 -15.629 441 H LYS 57 H LYS 57 9.740 -25.825 -14.913 442 HA LYS 57 HA LYS 57 12.467 -26.660 -14.272 443 HB2 LYS 57 1HB LYS 57 11.184 -23.925 -14.631 444 HB3 LYS 57 2HB LYS 57 12.890 -24.161 -14.277 445 HG2 LYS 57 1HG LYS 57 13.116 -25.476 -16.380 446 HG3 LYS 57 2HG LYS 57 11.419 -25.135 -16.742 447 HD2 LYS 57 1HD LYS 57 11.904 -22.704 -16.701 448 HD3 LYS 57 2HD LYS 57 13.604 -23.055 -16.357 449 HE2 LYS 57 1HE LYS 57 13.783 -24.284 -18.496 450 HE3 LYS 57 2HE LYS 57 12.087 -23.937 -18.841 451 HZ1 LYS 57 1HZ LYS 57 13.542 -22.402 -19.942 452 HZ2 LYS 57 2HZ LYS 57 12.623 -21.599 -18.832 453 HZ3 LYS 57 3HZ LYS 57 14.208 -21.923 -18.512 454 H GLY 58 H GLY 58 9.670 -25.911 -12.495 455 HA2 GLY 58 1HA GLY 58 9.581 -26.229 -10.115 456 HA3 GLY 58 2HA GLY 58 11.283 -25.826 -9.999 457 H TYR 59 H TYR 59 9.562 -23.769 -12.116 458 HA TYR 59 HA TYR 59 9.113 -21.767 -9.952 459 HB2 TYR 59 1HB TYR 59 10.478 -21.212 -12.619 460 HB3 TYR 59 2HB TYR 59 10.073 -20.009 -11.402 461 HD1 TYR 59 HD1 TYR 59 12.406 -22.601 -12.416 462 HD2 TYR 59 HD2 TYR 59 11.247 -19.992 -9.213 463 HE1 TYR 59 HE1 TYR 59 14.595 -22.965 -11.326 464 HE2 TYR 59 HE2 TYR 59 13.435 -20.355 -8.124 465 HH TYR 59 HH TYR 59 15.878 -22.498 -9.573 466 H GLY 60 H GLY 60 7.529 -20.217 -10.328 467 HA2 GLY 60 1HA GLY 60 6.147 -19.898 -12.812 468 HA3 GLY 60 2HA GLY 60 5.251 -21.031 -11.819 469 H PHE 61 H PHE 61 3.840 -18.918 -12.334 470 HA PHE 61 HA PHE 61 4.164 -17.089 -9.991 471 HB2 PHE 61 1HB PHE 61 3.079 -16.477 -12.768 472 HB3 PHE 61 2HB PHE 61 2.979 -15.375 -11.404 473 HD1 PHE 61 HD1 PHE 61 5.279 -17.058 -13.745 474 HD2 PHE 61 HD2 PHE 61 4.869 -14.111 -10.679 475 HE1 PHE 61 HE1 PHE 61 7.519 -16.172 -14.299 476 HE2 PHE 61 HE2 PHE 61 7.108 -13.221 -11.232 477 HZ PHE 61 HZ PHE 61 8.434 -14.254 -13.042 478 H CYS 62 H CYS 62 2.384 -16.553 -8.798 479 HA CYS 62 HA CYS 62 -0.132 -18.003 -9.496 480 HB2 CYS 62 1HB CYS 62 1.096 -19.250 -7.741 481 HB3 CYS 62 2HB CYS 62 1.146 -17.806 -6.740 482 HG CYS 62 HG CYS 62 -1.545 -19.312 -7.866 483 H GLU 63 H GLU 63 -1.873 -16.768 -9.516 484 HA GLU 63 HA GLU 63 -1.664 -14.062 -8.288 485 HB2 GLU 63 1HB GLU 63 -2.143 -14.190 -10.736 486 HB3 GLU 63 2HB GLU 63 -3.606 -15.102 -10.391 487 HG2 GLU 63 1HG GLU 63 -4.544 -13.199 -9.183 488 HG3 GLU 63 2HG GLU 63 -3.059 -12.283 -9.436 489 H TYR 64 H TYR 64 -2.766 -13.570 -6.538 490 HA TYR 64 HA TYR 64 -4.928 -15.444 -5.693 491 HB2 TYR 64 1HB TYR 64 -3.140 -13.576 -4.089 492 HB3 TYR 64 2HB TYR 64 -4.520 -14.423 -3.403 493 HD1 TYR 64 HD1 TYR 64 -1.086 -14.707 -4.577 494 HD2 TYR 64 HD2 TYR 64 -4.520 -16.886 -3.210 495 HE1 TYR 64 HE1 TYR 64 0.337 -16.682 -4.148 496 HE2 TYR 64 HE2 TYR 64 -3.097 -18.860 -2.781 497 HH TYR 64 HH TYR 64 0.374 -18.827 -3.540 498 H GLN 65 H GLN 65 -6.618 -14.386 -4.258 499 HA GLN 65 HA GLN 65 -8.120 -12.689 -5.954 500 HB2 GLN 65 1HB GLN 65 -9.091 -14.190 -4.212 501 HB3 GLN 65 2HB GLN 65 -8.462 -13.129 -2.960 502 HG2 GLN 65 1HG GLN 65 -10.791 -12.678 -3.282 503 HG3 GLN 65 2HG GLN 65 -9.850 -11.281 -3.874 504 HE21 GLN 65 1HE2 GLN 65 -11.543 -11.291 -6.890 505 HE22 GLN 65 2HE2 GLN 65 -10.850 -10.416 -5.565 506 H ASP 66 H ASP 66 -6.044 -11.952 -3.183 507 HA ASP 66 HA ASP 66 -5.974 -9.138 -4.053 508 HB2 ASP 66 1HB ASP 66 -6.485 -8.274 -1.791 509 HB3 ASP 66 2HB ASP 66 -7.858 -9.119 -2.492 510 H GLN 67 H GLN 67 -4.497 -7.880 -2.407 511 HA GLN 67 HA GLN 67 -1.957 -9.278 -2.658 512 HB2 GLN 67 1HB GLN 67 -0.945 -7.183 -2.042 513 HB3 GLN 67 2HB GLN 67 -2.272 -6.826 -3.138 514 HG2 GLN 67 1HG GLN 67 -2.744 -6.749 -0.179 515 HG3 GLN 67 2HG GLN 67 -1.915 -5.396 -0.999 516 HE21 GLN 67 1HE2 GLN 67 -5.112 -4.019 -1.394 517 HE22 GLN 67 2HE2 GLN 67 -3.589 -3.939 -0.572 518 H GLU 68 H GLU 68 -4.279 -8.795 -0.153 519 HA GLU 68 HA GLU 68 -2.508 -9.232 2.082 520 HB2 GLU 68 1HB GLU 68 -4.754 -8.233 2.342 521 HB3 GLU 68 2HB GLU 68 -5.499 -9.730 1.799 522 HG2 GLU 68 1HG GLU 68 -5.651 -9.575 4.189 523 HG3 GLU 68 2HG GLU 68 -4.574 -10.902 3.759 524 H THR 69 H THR 69 -4.554 -11.375 0.097 525 HA THR 69 HA THR 69 -3.749 -13.789 1.445 526 HB THR 69 HB THR 69 -4.769 -13.427 -1.406 527 HG1 THR 69 HG1 THR 69 -6.299 -12.663 0.034 528 HG21 THR 69 1HG2 THR 69 -5.454 -15.783 -1.186 529 HG22 THR 69 2HG2 THR 69 -3.691 -15.614 -1.007 530 HG23 THR 69 3HG2 THR 69 -4.713 -15.852 0.430 531 H ALA 70 H ALA 70 -2.497 -11.990 -1.341 532 HA ALA 70 HA ALA 70 -0.564 -13.914 -2.152 533 HB1 ALA 70 1HB ALA 70 0.563 -12.008 -3.254 534 HB2 ALA 70 2HB ALA 70 -1.192 -11.994 -3.547 535 HB3 ALA 70 3HB ALA 70 -0.480 -10.881 -2.356 536 H LEU 71 H LEU 71 -0.329 -11.174 0.121 537 HA LEU 71 HA LEU 71 2.424 -11.678 0.793 538 HB2 LEU 71 1HB LEU 71 0.200 -10.176 2.210 539 HB3 LEU 71 2HB LEU 71 1.856 -10.249 2.819 540 HG LEU 71 HG LEU 71 1.058 -9.090 0.126 541 HD11 LEU 71 1HD1 LEU 71 1.472 -6.918 1.191 542 HD12 LEU 71 2HD1 LEU 71 0.136 -7.791 1.977 543 HD13 LEU 71 3HD1 LEU 71 1.738 -7.733 2.750 544 HD21 LEU 71 1HD2 LEU 71 3.366 -8.206 0.165 545 HD22 LEU 71 2HD2 LEU 71 3.660 -9.040 1.710 546 HD23 LEU 71 3HD2 LEU 71 3.361 -9.985 0.232 547 H SER 72 H SER 72 -0.676 -12.766 2.117 548 HA SER 72 HA SER 72 0.362 -14.178 4.365 549 HB2 SER 72 1HB SER 72 -2.054 -14.727 2.611 550 HB3 SER 72 2HB SER 72 -1.722 -15.559 4.123 551 HG SER 72 HG SER 72 -2.368 -12.894 3.644 552 H ALA 73 H ALA 73 -0.111 -15.139 0.968 553 HA ALA 73 HA ALA 73 0.784 -17.825 1.265 554 HB1 ALA 73 1HB ALA 73 1.203 -17.733 -1.171 555 HB2 ALA 73 2HB ALA 73 -0.375 -17.029 -0.747 556 HB3 ALA 73 3HB ALA 73 0.998 -15.966 -1.131 557 H MET 74 H MET 74 2.559 -14.825 0.515 558 HA MET 74 HA MET 74 5.146 -15.903 0.300 559 HB2 MET 74 1HB MET 74 4.679 -13.550 -0.144 560 HB3 MET 74 2HB MET 74 4.219 -13.279 1.530 561 HG2 MET 74 1HG MET 74 6.577 -13.870 2.194 562 HG3 MET 74 2HG MET 74 6.986 -13.914 0.478 563 HE1 MET 74 1HE MET 74 5.703 -10.147 2.830 564 HE2 MET 74 2HE MET 74 4.596 -11.515 2.558 565 HE3 MET 74 3HE MET 74 6.053 -11.733 3.558 566 H ARG 75 H ARG 75 3.262 -15.129 3.206 567 HA ARG 75 HA ARG 75 5.550 -15.692 4.947 568 HB2 ARG 75 1HB ARG 75 2.642 -15.051 5.535 569 HB3 ARG 75 2HB ARG 75 3.859 -15.309 6.775 570 HG2 ARG 75 1HG ARG 75 5.118 -13.375 5.999 571 HG3 ARG 75 2HG ARG 75 3.960 -13.136 4.668 572 HD2 ARG 75 1HD ARG 75 3.240 -13.096 7.588 573 HD3 ARG 75 2HD ARG 75 3.600 -11.656 6.607 574 HE ARG 75 HE ARG 75 1.619 -13.127 5.267 575 HH11 ARG 75 1HH1 ARG 75 2.018 -11.348 8.270 576 HH12 ARG 75 2HH1 ARG 75 0.331 -10.895 8.372 577 HH21 ARG 75 1HH2 ARG 75 -0.568 -12.533 5.411 578 HH22 ARG 75 2HH2 ARG 75 -1.133 -11.566 6.754 579 H ASN 76 H ASN 76 2.831 -17.408 3.626 580 HA ASN 76 HA ASN 76 2.927 -19.435 5.789 581 HB2 ASN 76 1HB ASN 76 0.986 -18.903 3.525 582 HB3 ASN 76 2HB ASN 76 0.910 -20.355 4.513 583 HD21 ASN 76 1HD2 ASN 76 -1.357 -17.752 5.897 584 HD22 ASN 76 2HD2 ASN 76 -1.164 -18.512 4.353 585 H LEU 77 H LEU 77 3.136 -19.260 2.223 586 HA LEU 77 HA LEU 77 3.565 -22.129 2.040 587 HB2 LEU 77 1HB LEU 77 3.737 -19.886 0.001 588 HB3 LEU 77 2HB LEU 77 3.971 -21.591 -0.397 589 HG LEU 77 HG LEU 77 1.416 -20.405 0.745 590 HD11 LEU 77 1HD1 LEU 77 0.530 -20.738 -1.520 591 HD12 LEU 77 2HD1 LEU 77 1.886 -19.586 -1.508 592 HD13 LEU 77 3HD1 LEU 77 2.140 -21.254 -2.074 593 HD21 LEU 77 1HD2 LEU 77 0.475 -22.612 0.150 594 HD22 LEU 77 2HD2 LEU 77 2.085 -23.155 -0.381 595 HD23 LEU 77 3HD2 LEU 77 1.795 -22.776 1.333 596 H ASN 78 H ASN 78 5.578 -19.264 2.153 597 HA ASN 78 HA ASN 78 7.923 -20.444 0.985 598 HB2 ASN 78 1HB ASN 78 7.520 -17.990 1.204 599 HB3 ASN 78 2HB ASN 78 7.732 -18.133 2.944 600 HD21 ASN 78 1HD2 ASN 78 10.890 -17.314 0.864 601 HD22 ASN 78 2HD2 ASN 78 9.243 -16.877 0.554 602 H GLY 79 H GLY 79 8.932 -22.144 1.719 603 HA2 GLY 79 1HA GLY 79 10.541 -22.948 3.390 604 HA3 GLY 79 2HA GLY 79 9.533 -22.258 4.648 605 H ARG 80 H ARG 80 7.268 -23.392 2.663 606 HA ARG 80 HA ARG 80 6.805 -25.779 4.258 607 HB2 ARG 80 1HB ARG 80 5.356 -24.662 1.833 608 HB3 ARG 80 2HB ARG 80 4.811 -26.047 2.767 609 HG2 ARG 80 1HG ARG 80 5.210 -23.290 3.949 610 HG3 ARG 80 2HG ARG 80 3.665 -23.895 3.302 611 HD2 ARG 80 1HD ARG 80 5.242 -25.232 5.486 612 HD3 ARG 80 2HD ARG 80 3.896 -24.100 5.749 613 HE ARG 80 HE ARG 80 3.747 -26.861 4.816 614 HH11 ARG 80 1HH1 ARG 80 2.094 -23.781 5.170 615 HH12 ARG 80 2HH1 ARG 80 0.496 -24.485 5.070 616 HH21 ARG 80 1HH2 ARG 80 1.666 -27.763 4.688 617 HH22 ARG 80 2HH2 ARG 80 0.252 -26.738 4.798 618 H GLU 81 H GLU 81 7.589 -27.727 3.899 619 HA GLU 81 HA GLU 81 9.028 -28.203 1.371 620 HB2 GLU 81 1HB GLU 81 10.129 -28.727 3.525 621 HB3 GLU 81 2HB GLU 81 8.845 -29.861 3.920 622 HG2 GLU 81 1HG GLU 81 9.475 -31.238 1.968 623 HG3 GLU 81 2HG GLU 81 10.779 -30.110 1.606 624 H PHE 82 H PHE 82 8.154 -29.187 -0.293 625 HA PHE 82 HA PHE 82 6.104 -31.293 0.258 626 HB2 PHE 82 1HB PHE 82 6.317 -29.409 -2.123 627 HB3 PHE 82 2HB PHE 82 5.221 -30.779 -2.044 628 HD1 PHE 82 HD1 PHE 82 5.943 -27.418 -0.783 629 HD2 PHE 82 HD2 PHE 82 3.272 -30.747 -0.596 630 HE1 PHE 82 HE1 PHE 82 4.256 -26.000 0.337 631 HE2 PHE 82 HE2 PHE 82 1.582 -29.331 0.522 632 HZ PHE 82 HZ PHE 82 2.075 -26.956 0.990 633 H SER 83 H SER 83 7.283 -33.115 0.218 634 HA SER 83 HA SER 83 8.517 -34.851 -0.652 635 HB2 SER 83 1HB SER 83 7.987 -33.453 -3.296 636 HB3 SER 83 2HB SER 83 8.597 -35.091 -3.113 637 HG SER 83 HG SER 83 6.488 -35.310 -3.332 638 H GLY 84 H GLY 84 9.930 -32.676 0.399 639 HA2 GLY 84 1HA GLY 84 12.237 -32.308 0.635 640 HA3 GLY 84 2HA GLY 84 12.528 -33.215 -0.837 641 H ARG 85 H ARG 85 10.133 -30.680 -0.859 642 HA ARG 85 HA ARG 85 12.071 -28.839 -2.184 643 HB2 ARG 85 1HB ARG 85 9.294 -29.573 -3.171 644 HB3 ARG 85 2HB ARG 85 10.259 -28.251 -3.811 645 HG2 ARG 85 1HG ARG 85 11.154 -31.142 -3.835 646 HG3 ARG 85 2HG ARG 85 10.304 -30.336 -5.175 647 HD2 ARG 85 1HD ARG 85 12.099 -28.687 -5.296 648 HD3 ARG 85 2HD ARG 85 12.956 -29.544 -3.994 649 HE ARG 85 HE ARG 85 12.653 -30.378 -6.783 650 HH11 ARG 85 1HH1 ARG 85 13.608 -31.251 -3.517 651 HH12 ARG 85 2HH1 ARG 85 14.604 -32.593 -4.032 652 HH21 ARG 85 1HH2 ARG 85 13.950 -32.122 -7.440 653 HH22 ARG 85 2HH2 ARG 85 14.798 -33.087 -6.253 654 H ALA 86 H ALA 86 12.147 -27.622 -0.262 655 HA ALA 86 HA ALA 86 9.786 -26.417 0.865 656 HB1 ALA 86 1HB ALA 86 11.381 -24.898 1.989 657 HB2 ALA 86 2HB ALA 86 11.880 -26.600 2.133 658 HB3 ALA 86 3HB ALA 86 12.692 -25.530 0.967 659 H LEU 87 H LEU 87 8.523 -24.930 0.040 660 HA LEU 87 HA LEU 87 9.082 -23.825 -2.544 661 HB2 LEU 87 1HB LEU 87 6.952 -23.156 -0.484 662 HB3 LEU 87 2HB LEU 87 6.986 -22.494 -2.122 663 HG LEU 87 HG LEU 87 6.700 -25.437 -1.418 664 HD11 LEU 87 1HD1 LEU 87 4.392 -25.138 -2.197 665 HD12 LEU 87 2HD1 LEU 87 4.746 -24.116 -0.785 666 HD13 LEU 87 3HD1 LEU 87 4.690 -23.397 -2.412 667 HD21 LEU 87 1HD2 LEU 87 6.219 -25.680 -3.830 668 HD22 LEU 87 2HD2 LEU 87 6.543 -23.946 -4.070 669 HD23 LEU 87 3HD2 LEU 87 7.857 -25.035 -3.565 670 H ARG 88 H ARG 88 9.752 -21.855 -3.211 671 HA ARG 88 HA ARG 88 10.436 -19.880 -1.076 672 HB2 ARG 88 1HB ARG 88 12.362 -20.689 -2.418 673 HB3 ARG 88 2HB ARG 88 11.570 -20.131 -3.884 674 HG2 ARG 88 1HG ARG 88 11.705 -17.820 -3.123 675 HG3 ARG 88 2HG ARG 88 12.430 -18.353 -1.587 676 HD2 ARG 88 1HD ARG 88 14.309 -19.297 -2.815 677 HD3 ARG 88 2HD ARG 88 13.589 -18.728 -4.339 678 HE ARG 88 HE ARG 88 14.212 -16.561 -3.828 679 HH11 ARG 88 1HH1 ARG 88 14.778 -18.661 -1.070 680 HH12 ARG 88 2HH1 ARG 88 15.731 -17.477 -0.205 681 HH21 ARG 88 1HH2 ARG 88 15.451 -15.032 -2.695 682 HH22 ARG 88 2HH2 ARG 88 16.112 -15.422 -1.124 683 H VAL 89 H VAL 89 8.708 -18.579 -0.877 684 HA VAL 89 HA VAL 89 7.389 -17.666 -3.400 685 HB VAL 89 HB VAL 89 6.169 -17.996 -0.625 686 HG11 VAL 89 1HG1 VAL 89 4.038 -17.572 -1.752 687 HG12 VAL 89 2HG1 VAL 89 5.146 -16.185 -1.878 688 HG13 VAL 89 3HG1 VAL 89 4.906 -17.263 -3.274 689 HG21 VAL 89 1HG2 VAL 89 4.940 -19.882 -1.653 690 HG22 VAL 89 2HG2 VAL 89 5.842 -19.641 -3.169 691 HG23 VAL 89 3HG2 VAL 89 6.697 -20.159 -1.696 692 H ASP 90 H ASP 90 7.343 -15.563 -3.820 693 HA ASP 90 HA ASP 90 7.212 -13.629 -1.617 694 HB2 ASP 90 1HB ASP 90 9.713 -14.136 -2.195 695 HB3 ASP 90 2HB ASP 90 9.403 -13.222 -3.665 696 H ASN 91 H ASN 91 6.771 -11.439 -2.356 697 HA ASN 91 HA ASN 91 4.660 -11.546 -4.283 698 HB2 ASN 91 1HB ASN 91 4.891 -9.964 -2.294 699 HB3 ASN 91 2HB ASN 91 6.022 -9.037 -3.271 700 HD21 ASN 91 1HD2 ASN 91 2.175 -8.297 -3.601 701 HD22 ASN 91 2HD2 ASN 91 2.963 -9.071 -2.268 702 H ALA 92 H ALA 92 4.520 -11.127 -6.374 703 HA ALA 92 HA ALA 92 6.941 -11.233 -7.899 704 HB1 ALA 92 1HB ALA 92 5.454 -10.991 -9.861 705 HB2 ALA 92 2HB ALA 92 4.835 -12.198 -8.709 706 HB3 ALA 92 3HB ALA 92 4.105 -10.578 -8.777 707 H ALA 93 H ALA 93 5.114 -8.614 -6.600 708 HA ALA 93 HA ALA 93 6.068 -6.655 -8.543 709 HB1 ALA 93 1HB ALA 93 4.971 -5.010 -7.056 710 HB2 ALA 93 2HB ALA 93 3.886 -6.362 -7.457 711 HB3 ALA 93 3HB ALA 93 4.675 -6.297 -5.865 712 H SER 94 H SER 94 7.366 -8.181 -5.812 713 HA SER 94 HA SER 94 8.933 -6.053 -4.718 714 HB2 SER 94 1HB SER 94 8.631 -8.066 -3.452 715 HB3 SER 94 2HB SER 94 9.280 -9.061 -4.745 716 HG SER 94 HG SER 94 10.662 -8.445 -2.908 717 H GLU 95 H GLU 95 10.739 -5.092 -5.346 718 HA GLU 95 HA GLU 95 11.782 -5.500 -7.974 719 HB2 GLU 95 1HB GLU 95 12.889 -4.017 -5.560 720 HB3 GLU 95 2HB GLU 95 13.663 -3.997 -7.138 721 HG2 GLU 95 1HG GLU 95 11.686 -2.967 -8.130 722 HG3 GLU 95 2HG GLU 95 10.841 -3.055 -6.586 723 H LYS 96 H LYS 96 12.900 -6.550 -4.767 724 HA LYS 96 HA LYS 96 15.344 -7.733 -5.664 725 HB2 LYS 96 1HB LYS 96 13.572 -8.296 -3.259 726 HB3 LYS 96 2HB LYS 96 15.114 -9.099 -3.520 727 HG2 LYS 96 1HG LYS 96 16.272 -6.927 -3.459 728 HG3 LYS 96 2HG LYS 96 14.722 -6.107 -3.217 729 HD2 LYS 96 1HD LYS 96 14.384 -7.372 -1.113 730 HD3 LYS 96 2HD LYS 96 15.941 -8.179 -1.353 731 HE2 LYS 96 1HE LYS 96 17.099 -6.007 -1.252 732 HE3 LYS 96 2HE LYS 96 15.552 -5.178 -1.055 733 HZ1 LYS 96 1HZ LYS 96 16.648 -5.509 1.037 734 HZ2 LYS 96 2HZ LYS 96 15.241 -6.370 1.004 735 HZ3 LYS 96 3HZ LYS 96 16.686 -7.144 0.821 736 H ASN 97 H ASN 97 12.057 -9.043 -5.276 737 HA ASN 97 HA ASN 97 12.672 -11.708 -6.079 738 HB2 ASN 97 1HB ASN 97 10.528 -10.975 -5.031 739 HB3 ASN 97 2HB ASN 97 10.099 -10.161 -6.529 740 HD21 ASN 97 1HD2 ASN 97 10.053 -14.258 -6.312 741 HD22 ASN 97 2HD2 ASN 97 11.001 -13.327 -5.201 742 H LYS 98 H LYS 98 11.836 -8.817 -7.962 743 HA LYS 98 HA LYS 98 11.720 -10.123 -10.499 744 HB2 LYS 98 1HB LYS 98 12.353 -7.259 -9.704 745 HB3 LYS 98 2HB LYS 98 12.252 -7.779 -11.380 746 HG2 LYS 98 1HG LYS 98 9.913 -8.434 -11.069 747 HG3 LYS 98 2HG LYS 98 10.003 -7.993 -9.358 748 HD2 LYS 98 1HD LYS 98 10.522 -5.653 -9.994 749 HD3 LYS 98 2HD LYS 98 10.407 -6.099 -11.703 750 HE2 LYS 98 1HE LYS 98 8.049 -6.761 -11.376 751 HE3 LYS 98 2HE LYS 98 8.159 -6.330 -9.667 752 HZ1 LYS 98 1HZ LYS 98 7.177 -4.581 -10.956 753 HZ2 LYS 98 2HZ LYS 98 8.613 -4.068 -10.326 754 HZ3 LYS 98 3HZ LYS 98 8.508 -4.470 -11.923 755 H GLU 99 H GLU 99 14.404 -8.772 -8.631 756 HA GLU 99 HA GLU 99 16.364 -9.006 -10.715 757 HB2 GLU 99 1HB GLU 99 16.594 -8.913 -7.685 758 HB3 GLU 99 2HB GLU 99 17.993 -8.966 -8.747 759 HG2 GLU 99 1HG GLU 99 15.872 -6.807 -8.714 760 HG3 GLU 99 2HG GLU 99 17.484 -6.696 -8.008 761 H GLU 100 H GLU 100 15.246 -11.208 -8.164 762 HA GLU 100 HA GLU 100 17.070 -13.332 -8.752 763 HB2 GLU 100 1HB GLU 100 14.262 -13.331 -7.583 764 HB3 GLU 100 2HB GLU 100 15.249 -14.780 -7.715 765 HG2 GLU 100 1HG GLU 100 16.993 -13.648 -6.320 766 HG3 GLU 100 2HG GLU 100 15.876 -12.302 -6.100 767 H LEU 101 H LEU 101 13.829 -12.539 -10.008 768 HA LEU 101 HA LEU 101 13.551 -14.742 -11.762 769 HB2 LEU 101 1HB LEU 101 11.749 -13.133 -11.247 770 HB3 LEU 101 2HB LEU 101 12.614 -11.873 -12.132 771 HG LEU 101 HG LEU 101 12.346 -13.208 -14.225 772 HD11 LEU 101 1HD1 LEU 101 10.783 -15.101 -14.216 773 HD12 LEU 101 2HD1 LEU 101 12.208 -15.420 -13.199 774 HD13 LEU 101 3HD1 LEU 101 10.655 -14.987 -12.445 775 HD21 LEU 101 1HD2 LEU 101 9.928 -12.753 -14.455 776 HD22 LEU 101 2HD2 LEU 101 9.786 -12.606 -12.687 777 HD23 LEU 101 3HD2 LEU 101 10.751 -11.424 -13.604 778 H LYS 102 H LYS 102 15.156 -11.599 -12.227 779 HA LYS 102 HA LYS 102 15.789 -11.905 -14.972 780 HB2 LYS 102 1HB LYS 102 17.204 -10.423 -12.728 781 HB3 LYS 102 2HB LYS 102 17.732 -10.339 -14.403 782 HG2 LYS 102 1HG LYS 102 15.583 -9.375 -15.067 783 HG3 LYS 102 2HG LYS 102 14.987 -9.522 -13.408 784 HD2 LYS 102 1HD LYS 102 16.847 -8.029 -12.649 785 HD3 LYS 102 2HD LYS 102 17.329 -7.823 -14.339 786 HE2 LYS 102 1HE LYS 102 15.134 -6.851 -14.869 787 HE3 LYS 102 2HE LYS 102 14.601 -7.104 -13.205 788 HZ1 LYS 102 1HZ LYS 102 15.327 -4.861 -13.567 789 HZ2 LYS 102 2HZ LYS 102 16.328 -5.602 -12.485 790 HZ3 LYS 102 3HZ LYS 102 16.824 -5.364 -14.040 791 H SER 103 H SER 103 17.529 -12.975 -12.062 792 HA SER 103 HA SER 103 19.822 -13.951 -13.507 793 HB2 SER 103 1HB SER 103 20.487 -14.935 -11.425 794 HB3 SER 103 2HB SER 103 19.776 -13.368 -11.069 795 HG SER 103 HG SER 103 17.761 -14.790 -10.946 796 H LEU 104 H LEU 104 16.688 -15.285 -12.697 797 HA LEU 104 HA LEU 104 17.402 -18.013 -13.419 798 HB2 LEU 104 1HB LEU 104 14.733 -16.606 -13.074 799 HB3 LEU 104 2HB LEU 104 14.896 -18.326 -13.442 800 HG LEU 104 HG LEU 104 15.997 -16.992 -10.944 801 HD11 LEU 104 1HD1 LEU 104 14.111 -18.072 -9.802 802 HD12 LEU 104 2HD1 LEU 104 13.558 -16.889 -11.011 803 HD13 LEU 104 3HD1 LEU 104 13.482 -18.631 -11.370 804 HD21 LEU 104 1HD2 LEU 104 16.250 -19.330 -10.183 805 HD22 LEU 104 2HD2 LEU 104 15.650 -19.908 -11.757 806 HD23 LEU 104 3HD2 LEU 104 17.197 -19.032 -11.661 807 H GLY 105 H GLY 105 15.983 -15.210 -15.047 808 HA2 GLY 105 1HA GLY 105 16.385 -14.895 -17.428 809 HA3 GLY 105 2HA GLY 105 16.376 -16.636 -17.642 810 H THR 106 H THR 106 14.845 -15.650 -19.399 811 HA THR 106 HA THR 106 12.238 -14.761 -18.666 812 HB THR 106 HB THR 106 13.122 -16.217 -21.195 813 HG1 THR 106 HG1 THR 106 13.023 -13.879 -21.896 814 HG21 THR 106 1HG2 THR 106 11.150 -15.144 -22.210 815 HG22 THR 106 2HG2 THR 106 10.671 -16.225 -20.879 816 HG23 THR 106 3HG2 THR 106 10.701 -14.464 -20.629 817 H GLY 107 H GLY 107 10.499 -15.748 -17.935 818 HA2 GLY 107 1HA GLY 107 10.233 -18.693 -18.304 819 HA3 GLY 107 2HA GLY 107 10.210 -18.055 -16.670 Start of MODEL 8 1 H MET 1 1H MET 1 -14.586 -9.304 -29.636 2 HA MET 1 HA MET 1 -16.188 -8.125 -30.919 3 HB2 MET 1 1HB MET 1 -16.629 -10.458 -30.241 4 HB3 MET 1 2HB MET 1 -17.328 -9.904 -28.727 5 HG2 MET 1 1HG MET 1 -19.102 -8.720 -30.029 6 HG3 MET 1 2HG MET 1 -18.427 -9.408 -31.508 7 HE1 MET 1 1HE MET 1 -20.545 -11.762 -28.145 8 HE2 MET 1 2HE MET 1 -19.023 -10.882 -27.859 9 HE3 MET 1 3HE MET 1 -20.502 -9.988 -28.290 10 H ALA 2 H ALA 2 -17.764 -8.382 -27.752 11 HA ALA 2 HA ALA 2 -19.264 -5.980 -28.222 12 HB1 ALA 2 1HB ALA 2 -20.056 -6.290 -25.899 13 HB2 ALA 2 2HB ALA 2 -20.127 -7.807 -26.828 14 HB3 ALA 2 3HB ALA 2 -18.818 -7.543 -25.653 15 H GLY 3 H GLY 3 -16.338 -6.707 -26.374 16 HA2 GLY 3 1HA GLY 3 -14.642 -5.199 -25.768 17 HA3 GLY 3 2HA GLY 3 -15.610 -3.871 -26.380 18 H LEU 4 H LEU 4 -17.126 -6.130 -24.215 19 HA LEU 4 HA LEU 4 -17.366 -3.977 -22.201 20 HB2 LEU 4 1HB LEU 4 -18.732 -6.683 -22.424 21 HB3 LEU 4 2HB LEU 4 -19.076 -5.469 -21.188 22 HG LEU 4 HG LEU 4 -19.532 -5.116 -24.172 23 HD11 LEU 4 1HD1 LEU 4 -21.907 -5.271 -23.574 24 HD12 LEU 4 2HD1 LEU 4 -21.030 -6.768 -23.178 25 HD13 LEU 4 3HD1 LEU 4 -21.460 -5.620 -21.888 26 HD21 LEU 4 1HD2 LEU 4 -20.715 -3.065 -23.462 27 HD22 LEU 4 2HD2 LEU 4 -20.251 -3.382 -21.773 28 HD23 LEU 4 3HD2 LEU 4 -19.001 -3.013 -22.985 29 H THR 5 H THR 5 -15.448 -6.692 -22.806 30 HA THR 5 HA THR 5 -15.005 -7.327 -19.963 31 HB THR 5 HB THR 5 -13.681 -8.408 -22.488 32 HG1 THR 5 HG1 THR 5 -15.295 -9.968 -20.829 33 HG21 THR 5 1HG2 THR 5 -12.789 -10.159 -21.001 34 HG22 THR 5 2HG2 THR 5 -12.197 -8.551 -20.518 35 HG23 THR 5 3HG2 THR 5 -13.501 -9.334 -19.595 36 H VAL 6 H VAL 6 -13.573 -6.386 -18.714 37 HA VAL 6 HA VAL 6 -11.376 -4.846 -20.034 38 HB VAL 6 HB VAL 6 -12.722 -4.352 -17.342 39 HG11 VAL 6 1HG1 VAL 6 -11.376 -2.310 -17.272 40 HG12 VAL 6 2HG1 VAL 6 -10.365 -3.775 -17.285 41 HG13 VAL 6 3HG1 VAL 6 -10.548 -2.805 -18.767 42 HG21 VAL 6 1HG2 VAL 6 -13.568 -2.299 -18.435 43 HG22 VAL 6 2HG2 VAL 6 -12.809 -2.802 -19.964 44 HG23 VAL 6 3HG2 VAL 6 -14.142 -3.759 -19.275 45 H ARG 7 H ARG 7 -9.403 -5.596 -19.745 46 HA ARG 7 HA ARG 7 -8.891 -7.737 -17.834 47 HB2 ARG 7 1HB ARG 7 -7.065 -6.206 -19.714 48 HB3 ARG 7 2HB ARG 7 -6.538 -7.546 -18.707 49 HG2 ARG 7 1HG ARG 7 -8.069 -9.057 -19.874 50 HG3 ARG 7 2HG ARG 7 -8.648 -7.703 -20.875 51 HD2 ARG 7 1HD ARG 7 -5.793 -8.641 -20.737 52 HD3 ARG 7 2HD ARG 7 -6.970 -9.123 -21.981 53 HE ARG 7 HE ARG 7 -6.982 -6.344 -21.950 54 HH11 ARG 7 1HH1 ARG 7 -4.639 -8.895 -22.535 55 HH12 ARG 7 2HH1 ARG 7 -3.692 -7.941 -23.654 56 HH21 ARG 7 1HH2 ARG 7 -5.744 -5.115 -23.404 57 HH22 ARG 7 2HH2 ARG 7 -4.317 -5.801 -24.146 58 H ASP 8 H ASP 8 -7.693 -7.698 -15.990 59 HA ASP 8 HA ASP 8 -7.550 -5.182 -14.576 60 HB2 ASP 8 1HB ASP 8 -6.509 -7.965 -13.932 61 HB3 ASP 8 2HB ASP 8 -6.334 -6.599 -12.839 62 HA PRO 9 HA PRO 9 -3.677 -3.590 -15.713 63 HB2 PRO 9 1HB PRO 9 -3.344 -3.126 -12.723 64 HB3 PRO 9 2HB PRO 9 -3.087 -1.994 -14.057 65 HG2 PRO 9 1HG PRO 9 -5.333 -1.784 -12.651 66 HG3 PRO 9 2HG PRO 9 -5.420 -1.662 -14.411 67 HD2 PRO 9 1HD PRO 9 -6.061 -4.038 -12.619 68 HD3 PRO 9 2HD PRO 9 -6.961 -3.423 -14.064 69 H ALA 10 H ALA 10 -1.745 -4.543 -16.061 70 HA ALA 10 HA ALA 10 -1.151 -7.106 -15.015 71 HB1 ALA 10 1HB ALA 10 1.053 -6.821 -16.099 72 HB2 ALA 10 2HB ALA 10 -0.277 -6.307 -17.164 73 HB3 ALA 10 3HB ALA 10 0.711 -5.090 -16.323 74 H VAL 11 H VAL 11 -0.117 -3.885 -14.002 75 HA VAL 11 HA VAL 11 1.879 -4.669 -12.143 76 HB VAL 11 HB VAL 11 -0.045 -2.307 -12.126 77 HG11 VAL 11 1HG1 VAL 11 1.480 -1.263 -10.522 78 HG12 VAL 11 2HG1 VAL 11 0.726 -2.734 -9.864 79 HG13 VAL 11 3HG1 VAL 11 2.414 -2.774 -10.427 80 HG21 VAL 11 1HG2 VAL 11 1.938 -1.080 -12.954 81 HG22 VAL 11 2HG2 VAL 11 2.879 -2.591 -12.935 82 HG23 VAL 11 3HG2 VAL 11 1.502 -2.413 -14.049 83 H ASP 12 H ASP 12 -1.626 -4.112 -11.682 84 HA ASP 12 HA ASP 12 -1.654 -4.767 -8.905 85 HB2 ASP 12 1HB ASP 12 -3.807 -4.838 -11.047 86 HB3 ASP 12 2HB ASP 12 -4.137 -5.232 -9.365 87 H ARG 13 H ARG 13 -1.886 -6.738 -11.824 88 HA ARG 13 HA ARG 13 -2.694 -9.158 -10.509 89 HB2 ARG 13 1HB ARG 13 -1.227 -8.674 -13.121 90 HB3 ARG 13 2HB ARG 13 -1.769 -10.258 -12.587 91 HG2 ARG 13 1HG ARG 13 -4.116 -9.336 -12.513 92 HG3 ARG 13 2HG ARG 13 -3.478 -7.869 -13.294 93 HD2 ARG 13 1HD ARG 13 -4.323 -9.224 -15.005 94 HD3 ARG 13 2HD ARG 13 -2.553 -9.382 -15.075 95 HE ARG 13 HE ARG 13 -3.768 -11.423 -13.450 96 HH11 ARG 13 1HH1 ARG 13 -3.069 -10.474 -16.759 97 HH12 ARG 13 2HH1 ARG 13 -3.068 -12.116 -17.362 98 HH21 ARG 13 1HH2 ARG 13 -3.765 -13.550 -14.245 99 HH22 ARG 13 2HH2 ARG 13 -3.462 -13.858 -15.940 100 H SER 14 H SER 14 0.437 -7.655 -11.156 101 HA SER 14 HA SER 14 1.953 -9.953 -10.199 102 HB2 SER 14 1HB SER 14 3.882 -8.551 -10.460 103 HB3 SER 14 2HB SER 14 2.827 -8.271 -11.837 104 HG SER 14 HG SER 14 1.969 -6.573 -10.226 105 H LEU 15 H LEU 15 0.476 -7.119 -8.799 106 HA LEU 15 HA LEU 15 1.923 -7.295 -6.282 107 HB2 LEU 15 1HB LEU 15 -0.623 -5.868 -7.114 108 HB3 LEU 15 2HB LEU 15 0.059 -5.766 -5.487 109 HG LEU 15 HG LEU 15 1.493 -4.877 -8.015 110 HD11 LEU 15 1HD1 LEU 15 0.989 -2.605 -7.236 111 HD12 LEU 15 2HD1 LEU 15 -0.494 -3.524 -7.587 112 HD13 LEU 15 3HD1 LEU 15 0.023 -3.277 -5.901 113 HD21 LEU 15 1HD2 LEU 15 3.028 -3.807 -6.400 114 HD22 LEU 15 2HD2 LEU 15 2.091 -4.496 -5.052 115 HD23 LEU 15 3HD2 LEU 15 2.976 -5.570 -6.162 116 H ARG 16 H ARG 16 -1.014 -8.660 -7.637 117 HA ARG 16 HA ARG 16 -1.728 -9.797 -4.984 118 HB2 ARG 16 1HB ARG 16 -3.887 -10.214 -5.857 119 HB3 ARG 16 2HB ARG 16 -3.453 -8.613 -6.435 120 HG2 ARG 16 1HG ARG 16 -2.772 -9.676 -8.618 121 HG3 ARG 16 2HG ARG 16 -3.476 -11.194 -8.008 122 HD2 ARG 16 1HD ARG 16 -5.611 -10.038 -7.689 123 HD3 ARG 16 2HD ARG 16 -4.894 -8.568 -8.389 124 HE ARG 16 HE ARG 16 -4.600 -10.859 -10.109 125 HH11 ARG 16 1HH1 ARG 16 -6.834 -8.355 -9.071 126 HH12 ARG 16 2HH1 ARG 16 -7.764 -8.395 -10.552 127 HH21 ARG 16 1HH2 ARG 16 -5.815 -10.903 -12.027 128 HH22 ARG 16 2HH2 ARG 16 -7.188 -9.838 -12.226 129 H SER 17 H SER 17 0.586 -10.734 -6.499 130 HA SER 17 HA SER 17 -0.154 -13.587 -6.545 131 HB2 SER 17 1HB SER 17 0.831 -13.989 -8.735 132 HB3 SER 17 2HB SER 17 -0.502 -12.854 -8.872 133 HG SER 17 HG SER 17 0.799 -11.343 -9.408 134 H VAL 18 H VAL 18 1.725 -15.012 -6.634 135 HA VAL 18 HA VAL 18 4.194 -13.649 -5.648 136 HB VAL 18 HB VAL 18 4.514 -15.475 -4.035 137 HG11 VAL 18 1HG1 VAL 18 2.693 -14.946 -2.488 138 HG12 VAL 18 2HG1 VAL 18 3.324 -13.492 -3.297 139 HG13 VAL 18 3HG1 VAL 18 1.778 -14.202 -3.821 140 HG21 VAL 18 1HG2 VAL 18 2.714 -17.132 -3.662 141 HG22 VAL 18 2HG2 VAL 18 1.807 -16.454 -5.035 142 HG23 VAL 18 3HG2 VAL 18 3.372 -17.256 -5.311 143 H PHE 19 H PHE 19 6.164 -14.902 -5.881 144 HA PHE 19 HA PHE 19 6.022 -16.697 -8.262 145 HB2 PHE 19 1HB PHE 19 7.385 -14.543 -8.390 146 HB3 PHE 19 2HB PHE 19 8.465 -15.239 -7.192 147 HD1 PHE 19 HD1 PHE 19 6.842 -17.288 -9.785 148 HD2 PHE 19 HD2 PHE 19 10.389 -15.210 -8.621 149 HE1 PHE 19 HE1 PHE 19 8.099 -18.429 -11.583 150 HE2 PHE 19 HE2 PHE 19 11.648 -16.348 -10.419 151 HZ PHE 19 HZ PHE 19 10.502 -17.959 -11.899 152 H VAL 20 H VAL 20 6.035 -18.767 -7.737 153 HA VAL 20 HA VAL 20 7.290 -19.575 -5.180 154 HB VAL 20 HB VAL 20 5.529 -21.157 -7.102 155 HG11 VAL 20 1HG1 VAL 20 5.269 -22.716 -5.234 156 HG12 VAL 20 2HG1 VAL 20 6.962 -22.590 -5.766 157 HG13 VAL 20 3HG1 VAL 20 6.432 -21.766 -4.280 158 HG21 VAL 20 1HG2 VAL 20 3.756 -20.759 -5.423 159 HG22 VAL 20 2HG2 VAL 20 4.877 -19.746 -4.482 160 HG23 VAL 20 3HG2 VAL 20 4.354 -19.227 -6.102 161 H GLY 21 H GLY 21 9.170 -20.587 -5.060 162 HA2 GLY 21 1HA GLY 21 10.263 -21.841 -7.554 163 HA3 GLY 21 2HA GLY 21 11.255 -21.104 -6.310 164 H ASN 22 H ASN 22 11.924 -23.595 -7.004 165 HA ASN 22 HA ASN 22 12.318 -25.706 -6.179 166 HB2 ASN 22 1HB ASN 22 11.229 -24.498 -3.614 167 HB3 ASN 22 2HB ASN 22 12.057 -26.045 -3.729 168 HD21 ASN 22 1HD2 ASN 22 14.415 -23.312 -2.732 169 HD22 ASN 22 2HD2 ASN 22 12.871 -23.839 -2.149 170 H ILE 23 H ILE 23 9.923 -25.298 -7.579 171 HA ILE 23 HA ILE 23 7.837 -26.792 -6.164 172 HB ILE 23 HB ILE 23 8.055 -25.799 -9.036 173 HG12 ILE 23 1HG1 ILE 23 6.302 -24.844 -6.763 174 HG13 ILE 23 2HG1 ILE 23 7.827 -24.098 -7.211 175 HG21 ILE 23 1HG2 ILE 23 5.678 -26.406 -9.233 176 HG22 ILE 23 2HG2 ILE 23 6.681 -27.843 -8.927 177 HG23 ILE 23 3HG2 ILE 23 5.723 -27.129 -7.608 178 HD11 ILE 23 1HD1 ILE 23 5.946 -22.890 -8.166 179 HD12 ILE 23 2HD1 ILE 23 6.945 -23.611 -9.452 180 HD13 ILE 23 3HD1 ILE 23 5.399 -24.365 -8.997 181 HA PRO 24 HA PRO 24 9.358 -30.810 -7.196 182 HB2 PRO 24 1HB PRO 24 6.395 -31.397 -6.862 183 HB3 PRO 24 2HB PRO 24 7.784 -32.258 -6.185 184 HG2 PRO 24 1HG PRO 24 6.418 -30.627 -4.589 185 HG3 PRO 24 2HG PRO 24 8.182 -30.600 -4.522 186 HD2 PRO 24 1HD PRO 24 6.289 -28.690 -5.955 187 HD3 PRO 24 2HD PRO 24 7.754 -28.310 -4.962 188 H TYR 25 H TYR 25 9.568 -31.763 -9.153 189 HA TYR 25 HA TYR 25 8.301 -30.550 -11.432 190 HB2 TYR 25 1HB TYR 25 10.047 -33.025 -11.148 191 HB3 TYR 25 2HB TYR 25 9.490 -32.407 -12.697 192 HD1 TYR 25 HD1 TYR 25 9.919 -29.627 -10.622 193 HD2 TYR 25 HD2 TYR 25 12.154 -32.544 -12.838 194 HE1 TYR 25 HE1 TYR 25 11.851 -28.087 -10.703 195 HE2 TYR 25 HE2 TYR 25 14.085 -31.003 -12.918 196 HH TYR 25 HH TYR 25 13.920 -27.769 -11.448 197 H GLU 26 H GLU 26 7.605 -33.376 -9.502 198 HA GLU 26 HA GLU 26 5.864 -34.598 -11.487 199 HB2 GLU 26 1HB GLU 26 5.301 -36.181 -9.724 200 HB3 GLU 26 2HB GLU 26 7.041 -35.925 -9.742 201 HG2 GLU 26 1HG GLU 26 5.402 -34.246 -7.895 202 HG3 GLU 26 2HG GLU 26 5.620 -35.950 -7.503 203 H ALA 27 H ALA 27 5.568 -31.956 -9.404 204 HA ALA 27 HA ALA 27 2.714 -32.291 -8.866 205 HB1 ALA 27 1HB ALA 27 2.888 -30.036 -7.865 206 HB2 ALA 27 2HB ALA 27 4.144 -31.132 -7.242 207 HB3 ALA 27 3HB ALA 27 4.558 -29.908 -8.464 208 H THR 28 H THR 28 1.012 -31.261 -9.793 209 HA THR 28 HA THR 28 1.601 -29.912 -12.383 210 HB THR 28 HB THR 28 -0.684 -30.431 -13.033 211 HG1 THR 28 HG1 THR 28 -1.855 -31.808 -11.355 212 HG21 THR 28 1HG2 THR 28 -0.637 -32.892 -12.933 213 HG22 THR 28 2HG2 THR 28 0.980 -32.239 -13.289 214 HG23 THR 28 3HG2 THR 28 0.596 -32.821 -11.653 215 H GLU 29 H GLU 29 -0.096 -28.234 -13.009 216 HA GLU 29 HA GLU 29 0.174 -26.048 -11.196 217 HB2 GLU 29 1HB GLU 29 -1.594 -26.456 -13.637 218 HB3 GLU 29 2HB GLU 29 -1.513 -24.936 -12.757 219 HG2 GLU 29 1HG GLU 29 0.916 -24.817 -13.222 220 HG3 GLU 29 2HG GLU 29 0.797 -26.313 -14.145 221 H GLU 30 H GLU 30 -2.499 -28.284 -11.854 222 HA GLU 30 HA GLU 30 -4.422 -26.833 -10.266 223 HB2 GLU 30 1HB GLU 30 -4.332 -29.694 -11.290 224 HB3 GLU 30 2HB GLU 30 -5.687 -29.051 -10.374 225 HG2 GLU 30 1HG GLU 30 -4.684 -27.964 -13.015 226 HG3 GLU 30 2HG GLU 30 -6.070 -29.031 -12.800 227 H GLN 31 H GLN 31 -2.224 -29.549 -9.630 228 HA GLN 31 HA GLN 31 -3.113 -30.067 -6.964 229 HB2 GLN 31 1HB GLN 31 -0.437 -30.498 -8.340 230 HB3 GLN 31 2HB GLN 31 -0.756 -31.018 -6.691 231 HG2 GLN 31 1HG GLN 31 -2.518 -32.499 -7.444 232 HG3 GLN 31 2HG GLN 31 -2.325 -31.911 -9.119 233 HE21 GLN 31 1HE2 GLN 31 -0.430 -35.159 -8.279 234 HE22 GLN 31 2HE2 GLN 31 -1.998 -34.622 -7.774 235 H LEU 32 H LEU 32 -0.647 -27.864 -8.275 236 HA LEU 32 HA LEU 32 0.229 -26.867 -5.737 237 HB2 LEU 32 1HB LEU 32 0.237 -25.640 -8.514 238 HB3 LEU 32 2HB LEU 32 0.999 -24.884 -7.111 239 HG LEU 32 HG LEU 32 1.763 -27.632 -8.153 240 HD11 LEU 32 1HD1 LEU 32 3.684 -26.504 -9.182 241 HD12 LEU 32 2HD1 LEU 32 2.145 -25.945 -9.876 242 HD13 LEU 32 3HD1 LEU 32 3.015 -24.926 -8.705 243 HD21 LEU 32 1HD2 LEU 32 3.776 -27.223 -6.779 244 HD22 LEU 32 2HD2 LEU 32 3.109 -25.654 -6.266 245 HD23 LEU 32 3HD2 LEU 32 2.301 -27.165 -5.785 246 H LYS 33 H LYS 33 -2.279 -25.780 -8.023 247 HA LYS 33 HA LYS 33 -3.040 -23.432 -6.619 248 HB2 LYS 33 1HB LYS 33 -4.549 -25.299 -8.474 249 HB3 LYS 33 2HB LYS 33 -5.312 -23.879 -7.771 250 HG2 LYS 33 1HG LYS 33 -3.879 -22.392 -8.927 251 HG3 LYS 33 2HG LYS 33 -2.738 -23.679 -9.340 252 HD2 LYS 33 1HD LYS 33 -4.081 -23.096 -11.295 253 HD3 LYS 33 2HD LYS 33 -4.467 -24.741 -10.769 254 HE2 LYS 33 1HE LYS 33 -6.484 -23.936 -9.631 255 HE3 LYS 33 2HE LYS 33 -6.086 -22.268 -10.054 256 HZ1 LYS 33 1HZ LYS 33 -7.696 -23.197 -11.548 257 HZ2 LYS 33 2HZ LYS 33 -6.304 -22.864 -12.368 258 HZ3 LYS 33 3HZ LYS 33 -6.677 -24.422 -11.973 259 H ASP 34 H ASP 34 -4.015 -26.814 -6.222 260 HA ASP 34 HA ASP 34 -6.163 -26.359 -4.413 261 HB2 ASP 34 1HB ASP 34 -4.287 -28.711 -4.820 262 HB3 ASP 34 2HB ASP 34 -5.582 -28.745 -3.630 263 H ILE 35 H ILE 35 -2.703 -27.024 -3.805 264 HA ILE 35 HA ILE 35 -3.060 -26.891 -0.925 265 HB ILE 35 HB ILE 35 -0.605 -27.098 -0.824 266 HG12 ILE 35 1HG1 ILE 35 -0.606 -26.882 -3.841 267 HG13 ILE 35 2HG1 ILE 35 -0.194 -25.555 -2.766 268 HG21 ILE 35 1HG2 ILE 35 -0.370 -29.229 -2.035 269 HG22 ILE 35 2HG2 ILE 35 -1.945 -29.131 -1.213 270 HG23 ILE 35 3HG2 ILE 35 -1.840 -28.866 -2.969 271 HD11 ILE 35 1HD1 ILE 35 1.804 -26.672 -3.585 272 HD12 ILE 35 2HD1 ILE 35 1.652 -26.875 -1.823 273 HD13 ILE 35 3HD1 ILE 35 1.236 -28.218 -2.913 274 H PHE 36 H PHE 36 -2.543 -24.598 -3.437 275 HA PHE 36 HA PHE 36 -1.441 -22.569 -1.604 276 HB2 PHE 36 1HB PHE 36 -2.186 -22.513 -4.551 277 HB3 PHE 36 2HB PHE 36 -1.626 -21.098 -3.676 278 HD1 PHE 36 HD1 PHE 36 0.235 -23.156 -1.949 279 HD2 PHE 36 HD2 PHE 36 -0.237 -22.098 -6.061 280 HE1 PHE 36 HE1 PHE 36 2.579 -23.812 -2.385 281 HE2 PHE 36 HE2 PHE 36 2.105 -22.756 -6.501 282 HZ PHE 36 HZ PHE 36 3.513 -23.611 -4.661 283 H SER 37 H SER 37 -4.498 -23.581 -2.925 284 HA SER 37 HA SER 37 -5.961 -21.164 -2.441 285 HB2 SER 37 1HB SER 37 -7.914 -22.485 -2.728 286 HB3 SER 37 2HB SER 37 -6.707 -23.158 -3.813 287 HG SER 37 HG SER 37 -6.273 -24.729 -2.287 288 H GLU 38 H GLU 38 -4.649 -23.564 -0.344 289 HA GLU 38 HA GLU 38 -6.473 -23.316 1.844 290 HB2 GLU 38 1HB GLU 38 -3.521 -24.049 1.750 291 HB3 GLU 38 2HB GLU 38 -4.498 -24.140 3.209 292 HG2 GLU 38 1HG GLU 38 -5.930 -25.815 2.221 293 HG3 GLU 38 2HG GLU 38 -5.126 -25.643 0.662 294 H VAL 39 H VAL 39 -3.948 -21.256 0.640 295 HA VAL 39 HA VAL 39 -4.103 -19.630 3.144 296 HB VAL 39 HB VAL 39 -1.868 -18.729 2.469 297 HG11 VAL 39 1HG1 VAL 39 -0.578 -20.721 3.061 298 HG12 VAL 39 2HG1 VAL 39 -2.023 -20.536 4.083 299 HG13 VAL 39 3HG1 VAL 39 -2.010 -21.735 2.768 300 HG21 VAL 39 1HG2 VAL 39 -0.603 -19.926 0.711 301 HG22 VAL 39 2HG2 VAL 39 -2.041 -20.909 0.347 302 HG23 VAL 39 3HG2 VAL 39 -2.061 -19.155 0.043 303 H GLY 40 H GLY 40 -5.808 -19.640 0.622 304 HA2 GLY 40 1HA GLY 40 -6.876 -17.242 0.530 305 HA3 GLY 40 2HA GLY 40 -5.351 -16.814 -0.222 306 HA PRO 41 HA PRO 41 -8.666 -18.975 -3.058 307 HB2 PRO 41 1HB PRO 41 -9.295 -16.073 -3.719 308 HB3 PRO 41 2HB PRO 41 -10.376 -17.472 -3.722 309 HG2 PRO 41 1HG PRO 41 -10.497 -15.798 -1.660 310 HG3 PRO 41 2HG PRO 41 -10.529 -17.536 -1.345 311 HD2 PRO 41 1HD PRO 41 -8.200 -15.588 -1.118 312 HD3 PRO 41 2HD PRO 41 -8.686 -16.920 0.006 313 H VAL 42 H VAL 42 -7.663 -19.594 -4.878 314 HA VAL 42 HA VAL 42 -5.579 -17.811 -6.021 315 HB VAL 42 HB VAL 42 -6.121 -20.780 -6.454 316 HG11 VAL 42 1HG1 VAL 42 -3.954 -20.810 -7.589 317 HG12 VAL 42 2HG1 VAL 42 -5.128 -19.765 -8.422 318 HG13 VAL 42 3HG1 VAL 42 -3.843 -19.042 -7.424 319 HG21 VAL 42 1HG2 VAL 42 -4.055 -21.080 -5.125 320 HG22 VAL 42 2HG2 VAL 42 -3.956 -19.320 -4.884 321 HG23 VAL 42 3HG2 VAL 42 -5.309 -20.240 -4.183 322 H VAL 43 H VAL 43 -5.941 -16.723 -7.818 323 HA VAL 43 HA VAL 43 -8.330 -17.203 -9.412 324 HB VAL 43 HB VAL 43 -5.953 -15.335 -9.802 325 HG11 VAL 43 1HG1 VAL 43 -7.321 -14.203 -11.486 326 HG12 VAL 43 2HG1 VAL 43 -6.939 -15.877 -11.953 327 HG13 VAL 43 3HG1 VAL 43 -8.558 -15.473 -11.333 328 HG21 VAL 43 1HG2 VAL 43 -7.574 -13.606 -9.091 329 HG22 VAL 43 2HG2 VAL 43 -8.812 -14.863 -8.862 330 HG23 VAL 43 3HG2 VAL 43 -7.361 -14.846 -7.832 331 H SER 44 H SER 44 -4.806 -17.531 -9.925 332 HA SER 44 HA SER 44 -5.246 -19.603 -11.938 333 HB2 SER 44 1HB SER 44 -4.359 -18.458 -13.819 334 HB3 SER 44 2HB SER 44 -5.601 -17.408 -13.154 335 HG SER 44 HG SER 44 -4.174 -16.025 -12.586 336 H PHE 45 H PHE 45 -3.030 -20.101 -13.045 337 HA PHE 45 HA PHE 45 -0.711 -19.420 -11.371 338 HB2 PHE 45 1HB PHE 45 -1.773 -21.414 -10.253 339 HB3 PHE 45 2HB PHE 45 -1.535 -22.327 -11.735 340 HD1 PHE 45 HD1 PHE 45 0.074 -20.873 -8.801 341 HD2 PHE 45 HD2 PHE 45 0.709 -22.966 -12.471 342 HE1 PHE 45 HE1 PHE 45 2.352 -21.483 -8.057 343 HE2 PHE 45 HE2 PHE 45 2.986 -23.581 -11.729 344 HZ PHE 45 HZ PHE 45 3.807 -22.837 -9.522 345 H ARG 46 H ARG 46 1.146 -19.396 -12.485 346 HA ARG 46 HA ARG 46 1.069 -20.544 -15.245 347 HB2 ARG 46 1HB ARG 46 2.512 -18.068 -14.239 348 HB3 ARG 46 2HB ARG 46 2.706 -18.753 -15.845 349 HG2 ARG 46 1HG ARG 46 0.271 -18.373 -16.252 350 HG3 ARG 46 2HG ARG 46 0.188 -17.550 -14.676 351 HD2 ARG 46 1HD ARG 46 0.436 -15.903 -16.352 352 HD3 ARG 46 2HD ARG 46 1.982 -16.025 -15.481 353 HE ARG 46 HE ARG 46 1.651 -17.545 -17.986 354 HH11 ARG 46 1HH1 ARG 46 3.080 -14.845 -16.252 355 HH12 ARG 46 2HH1 ARG 46 4.294 -14.541 -17.474 356 HH21 ARG 46 1HH2 ARG 46 3.232 -17.141 -19.565 357 HH22 ARG 46 2HH2 ARG 46 4.382 -15.840 -19.349 358 H LEU 47 H LEU 47 2.063 -22.469 -14.943 359 HA LEU 47 HA LEU 47 4.438 -22.768 -13.316 360 HB2 LEU 47 1HB LEU 47 2.883 -24.631 -13.750 361 HB3 LEU 47 2HB LEU 47 3.266 -24.561 -15.473 362 HG LEU 47 HG LEU 47 5.649 -25.151 -14.889 363 HD11 LEU 47 1HD1 LEU 47 6.064 -26.093 -12.661 364 HD12 LEU 47 2HD1 LEU 47 5.621 -24.372 -12.575 365 HD13 LEU 47 3HD1 LEU 47 4.425 -25.621 -12.156 366 HD21 LEU 47 1HD2 LEU 47 5.117 -27.531 -14.487 367 HD22 LEU 47 2HD2 LEU 47 3.463 -27.081 -14.007 368 HD23 LEU 47 3HD2 LEU 47 4.006 -26.820 -15.682 369 H VAL 48 H VAL 48 6.479 -22.351 -13.794 370 HA VAL 48 HA VAL 48 7.237 -21.774 -16.587 371 HB VAL 48 HB VAL 48 8.872 -21.721 -14.013 372 HG11 VAL 48 1HG1 VAL 48 10.525 -20.481 -15.323 373 HG12 VAL 48 2HG1 VAL 48 10.275 -22.127 -15.952 374 HG13 VAL 48 3HG1 VAL 48 9.551 -20.733 -16.790 375 HG21 VAL 48 1HG2 VAL 48 8.654 -19.267 -14.235 376 HG22 VAL 48 2HG2 VAL 48 7.619 -19.489 -15.666 377 HG23 VAL 48 3HG2 VAL 48 7.061 -20.041 -14.069 378 H TYR 49 H TYR 49 7.964 -23.271 -17.920 379 HA TYR 49 HA TYR 49 9.542 -25.538 -16.882 380 HB2 TYR 49 1HB TYR 49 8.101 -27.236 -17.889 381 HB3 TYR 49 2HB TYR 49 7.196 -26.314 -16.696 382 HD1 TYR 49 HD1 TYR 49 7.582 -27.108 -20.243 383 HD2 TYR 49 HD2 TYR 49 5.451 -24.736 -17.373 384 HE1 TYR 49 HE1 TYR 49 5.850 -26.616 -21.936 385 HE2 TYR 49 HE2 TYR 49 3.718 -24.244 -19.066 386 HH TYR 49 HH TYR 49 3.944 -25.559 -22.364 387 H ALA 50 H ALA 50 10.445 -26.886 -18.606 388 HA ALA 50 HA ALA 50 11.629 -25.230 -20.609 389 HB1 ALA 50 1HB ALA 50 12.600 -27.337 -21.467 390 HB2 ALA 50 2HB ALA 50 12.757 -27.211 -19.699 391 HB3 ALA 50 3HB ALA 50 11.509 -28.261 -20.409 392 H ARG 51 H ARG 51 10.972 -24.610 -22.528 393 HA ARG 51 HA ARG 51 8.347 -25.055 -23.434 394 HB2 ARG 51 1HB ARG 51 9.740 -23.165 -24.169 395 HB3 ARG 51 2HB ARG 51 10.797 -24.261 -25.047 396 HG2 ARG 51 1HG ARG 51 8.799 -24.915 -26.449 397 HG3 ARG 51 2HG ARG 51 7.918 -23.581 -25.665 398 HD2 ARG 51 1HD ARG 51 8.788 -22.800 -27.725 399 HD3 ARG 51 2HD ARG 51 9.724 -22.055 -26.410 400 HE ARG 51 HE ARG 51 10.909 -24.491 -27.425 401 HH11 ARG 51 1HH1 ARG 51 10.613 -21.023 -27.898 402 HH12 ARG 51 2HH1 ARG 51 12.128 -20.885 -28.761 403 HH21 ARG 51 1HH2 ARG 51 12.874 -24.299 -28.546 404 HH22 ARG 51 2HH2 ARG 51 13.409 -22.739 -29.128 405 H GLU 52 H GLU 52 11.387 -26.640 -24.438 406 HA GLU 52 HA GLU 52 9.929 -28.172 -26.485 407 HB2 GLU 52 1HB GLU 52 12.871 -28.080 -25.709 408 HB3 GLU 52 2HB GLU 52 12.227 -29.068 -27.012 409 HG2 GLU 52 1HG GLU 52 11.484 -27.074 -28.203 410 HG3 GLU 52 2HG GLU 52 12.029 -26.052 -26.875 411 H THR 53 H THR 53 11.758 -28.780 -23.489 412 HA THR 53 HA THR 53 11.422 -31.656 -23.677 413 HB THR 53 HB THR 53 12.269 -29.907 -21.327 414 HG1 THR 53 HG1 THR 53 13.914 -31.545 -22.964 415 HG21 THR 53 1HG2 THR 53 13.175 -31.999 -20.392 416 HG22 THR 53 2HG2 THR 53 11.412 -32.109 -20.604 417 HG23 THR 53 3HG2 THR 53 12.499 -32.909 -21.762 418 H GLY 54 H GLY 54 9.878 -29.053 -21.800 419 HA2 GLY 54 1HA GLY 54 7.572 -29.076 -21.170 420 HA3 GLY 54 2HA GLY 54 7.522 -30.812 -21.410 421 H LYS 55 H LYS 55 10.359 -30.146 -19.806 422 HA LYS 55 HA LYS 55 9.247 -31.166 -17.287 423 HB2 LYS 55 1HB LYS 55 11.385 -32.047 -18.220 424 HB3 LYS 55 2HB LYS 55 12.112 -30.456 -18.037 425 HG2 LYS 55 1HG LYS 55 11.775 -30.593 -15.586 426 HG3 LYS 55 2HG LYS 55 11.085 -32.210 -15.787 427 HD2 LYS 55 1HD LYS 55 13.865 -31.453 -16.749 428 HD3 LYS 55 2HD LYS 55 13.540 -32.144 -15.152 429 HE2 LYS 55 1HE LYS 55 12.465 -34.110 -16.271 430 HE3 LYS 55 2HE LYS 55 12.927 -33.435 -17.835 431 HZ1 LYS 55 1HZ LYS 55 14.504 -35.054 -17.073 432 HZ2 LYS 55 2HZ LYS 55 15.223 -33.571 -17.151 433 HZ3 LYS 55 3HZ LYS 55 14.791 -34.204 -15.690 434 HA PRO 56 HA PRO 56 8.608 -27.220 -15.468 435 HB2 PRO 56 1HB PRO 56 9.005 -28.914 -12.973 436 HB3 PRO 56 2HB PRO 56 7.739 -27.729 -13.322 437 HG2 PRO 56 1HG PRO 56 7.138 -30.310 -13.545 438 HG3 PRO 56 2HG PRO 56 6.575 -29.196 -14.795 439 HD2 PRO 56 1HD PRO 56 8.962 -31.085 -14.843 440 HD3 PRO 56 2HD PRO 56 7.752 -30.744 -16.144 441 H LYS 57 H LYS 57 9.966 -25.640 -14.711 442 HA LYS 57 HA LYS 57 12.772 -26.410 -14.170 443 HB2 LYS 57 1HB LYS 57 11.452 -23.703 -14.611 444 HB3 LYS 57 2HB LYS 57 13.164 -23.922 -14.273 445 HG2 LYS 57 1HG LYS 57 13.350 -25.312 -16.346 446 HG3 LYS 57 2HG LYS 57 11.657 -24.938 -16.699 447 HD2 LYS 57 1HD LYS 57 12.188 -22.526 -16.735 448 HD3 LYS 57 2HD LYS 57 13.879 -22.888 -16.359 449 HE2 LYS 57 1HE LYS 57 14.066 -24.184 -18.461 450 HE3 LYS 57 2HE LYS 57 12.382 -23.813 -18.840 451 HZ1 LYS 57 1HZ LYS 57 13.885 -22.336 -19.958 452 HZ2 LYS 57 2HZ LYS 57 12.967 -21.486 -18.883 453 HZ3 LYS 57 3HZ LYS 57 14.540 -21.833 -18.531 454 H GLY 58 H GLY 58 10.015 -26.066 -12.398 455 HA2 GLY 58 1HA GLY 58 9.978 -26.391 -10.042 456 HA3 GLY 58 2HA GLY 58 11.625 -25.797 -9.931 457 H TYR 59 H TYR 59 9.688 -23.855 -11.950 458 HA TYR 59 HA TYR 59 9.120 -21.973 -9.702 459 HB2 TYR 59 1HB TYR 59 10.398 -21.359 -12.392 460 HB3 TYR 59 2HB TYR 59 9.701 -20.120 -11.358 461 HD1 TYR 59 HD1 TYR 59 12.484 -22.436 -11.842 462 HD2 TYR 59 HD2 TYR 59 10.722 -19.548 -9.202 463 HE1 TYR 59 HE1 TYR 59 14.614 -22.269 -10.601 464 HE2 TYR 59 HE2 TYR 59 12.853 -19.382 -7.961 465 HH TYR 59 HH TYR 59 15.692 -21.303 -8.916 466 H GLY 60 H GLY 60 7.405 -20.501 -10.012 467 HA2 GLY 60 1HA GLY 60 5.878 -20.273 -12.396 468 HA3 GLY 60 2HA GLY 60 5.124 -21.514 -11.412 469 H PHE 61 H PHE 61 3.884 -19.069 -12.083 470 HA PHE 61 HA PHE 61 4.037 -17.466 -9.577 471 HB2 PHE 61 1HB PHE 61 2.915 -16.845 -12.333 472 HB3 PHE 61 2HB PHE 61 2.660 -15.806 -10.940 473 HD1 PHE 61 HD1 PHE 61 5.066 -16.993 -13.414 474 HD2 PHE 61 HD2 PHE 61 4.517 -14.568 -9.940 475 HE1 PHE 61 HE1 PHE 61 7.224 -15.872 -13.858 476 HE2 PHE 61 HE2 PHE 61 6.674 -13.443 -10.381 477 HZ PHE 61 HZ PHE 61 8.028 -14.097 -12.341 478 H CYS 62 H CYS 62 2.368 -17.255 -8.211 479 HA CYS 62 HA CYS 62 -0.163 -18.661 -8.955 480 HB2 CYS 62 1HB CYS 62 1.076 -19.725 -7.076 481 HB3 CYS 62 2HB CYS 62 1.010 -18.213 -6.183 482 HG CYS 62 HG CYS 62 -1.514 -20.010 -7.268 483 H GLU 63 H GLU 63 -1.786 -17.341 -9.359 484 HA GLU 63 HA GLU 63 -1.654 -14.572 -8.307 485 HB2 GLU 63 1HB GLU 63 -1.980 -14.946 -10.757 486 HB3 GLU 63 2HB GLU 63 -3.486 -15.786 -10.415 487 HG2 GLU 63 1HG GLU 63 -4.454 -13.755 -9.485 488 HG3 GLU 63 2HG GLU 63 -2.929 -12.899 -9.702 489 H TYR 64 H TYR 64 -2.996 -13.760 -6.844 490 HA TYR 64 HA TYR 64 -5.179 -15.560 -5.881 491 HB2 TYR 64 1HB TYR 64 -3.488 -13.538 -4.358 492 HB3 TYR 64 2HB TYR 64 -4.891 -14.354 -3.683 493 HD1 TYR 64 HD1 TYR 64 -1.455 -14.830 -4.960 494 HD2 TYR 64 HD2 TYR 64 -4.792 -16.621 -2.944 495 HE1 TYR 64 HE1 TYR 64 -0.025 -16.727 -4.278 496 HE2 TYR 64 HE2 TYR 64 -3.362 -18.518 -2.262 497 HH TYR 64 HH TYR 64 0.052 -18.694 -3.244 498 H GLN 65 H GLN 65 -7.036 -14.490 -4.883 499 HA GLN 65 HA GLN 65 -8.058 -12.453 -6.671 500 HB2 GLN 65 1HB GLN 65 -9.178 -13.720 -4.143 501 HB3 GLN 65 2HB GLN 65 -10.054 -12.528 -5.092 502 HG2 GLN 65 1HG GLN 65 -9.968 -14.020 -7.049 503 HG3 GLN 65 2HG GLN 65 -9.112 -15.235 -6.059 504 HE21 GLN 65 1HE2 GLN 65 -12.637 -16.245 -6.081 505 HE22 GLN 65 2HE2 GLN 65 -11.325 -16.127 -7.206 506 H ASP 66 H ASP 66 -6.703 -12.490 -3.424 507 HA ASP 66 HA ASP 66 -7.126 -9.533 -3.303 508 HB2 ASP 66 1HB ASP 66 -8.552 -10.822 -1.678 509 HB3 ASP 66 2HB ASP 66 -7.086 -11.461 -0.946 510 H GLN 67 H GLN 67 -5.391 -8.312 -3.029 511 HA GLN 67 HA GLN 67 -2.775 -9.382 -3.208 512 HB2 GLN 67 1HB GLN 67 -3.757 -6.664 -2.259 513 HB3 GLN 67 2HB GLN 67 -2.057 -7.050 -2.488 514 HG2 GLN 67 1HG GLN 67 -2.402 -7.440 -4.847 515 HG3 GLN 67 2HG GLN 67 -4.163 -7.211 -4.654 516 HE21 GLN 67 1HE2 GLN 67 -2.905 -4.050 -5.998 517 HE22 GLN 67 2HE2 GLN 67 -3.120 -5.687 -6.523 518 H GLU 68 H GLU 68 -4.779 -8.619 -0.424 519 HA GLU 68 HA GLU 68 -2.666 -8.706 1.525 520 HB2 GLU 68 1HB GLU 68 -5.670 -9.128 1.760 521 HB3 GLU 68 2HB GLU 68 -4.586 -9.091 3.143 522 HG2 GLU 68 1HG GLU 68 -5.001 -6.828 1.176 523 HG3 GLU 68 2HG GLU 68 -5.735 -6.955 2.773 524 H THR 69 H THR 69 -4.777 -11.148 0.086 525 HA THR 69 HA THR 69 -3.814 -13.251 1.875 526 HB THR 69 HB THR 69 -5.130 -14.773 0.439 527 HG1 THR 69 HG1 THR 69 -4.988 -12.587 -1.270 528 HG21 THR 69 1HG2 THR 69 -7.347 -13.761 0.803 529 HG22 THR 69 2HG2 THR 69 -6.289 -13.499 2.210 530 HG23 THR 69 3HG2 THR 69 -6.585 -12.175 1.060 531 H ALA 70 H ALA 70 -2.957 -11.929 -1.247 532 HA ALA 70 HA ALA 70 -1.212 -14.054 -2.058 533 HB1 ALA 70 1HB ALA 70 -0.189 -12.350 -3.531 534 HB2 ALA 70 2HB ALA 70 -1.966 -12.312 -3.614 535 HB3 ALA 70 3HB ALA 70 -1.093 -11.079 -2.675 536 H LEU 71 H LEU 71 -0.655 -11.058 -0.204 537 HA LEU 71 HA LEU 71 2.148 -11.561 0.205 538 HB2 LEU 71 1HB LEU 71 0.140 -9.841 1.696 539 HB3 LEU 71 2HB LEU 71 1.866 -9.873 2.071 540 HG LEU 71 HG LEU 71 0.700 -9.043 -0.610 541 HD11 LEU 71 1HD1 LEU 71 1.259 -6.762 0.105 542 HD12 LEU 71 2HD1 LEU 71 0.044 -7.506 1.171 543 HD13 LEU 71 3HD1 LEU 71 1.737 -7.381 1.704 544 HD21 LEU 71 1HD2 LEU 71 2.992 -8.203 -1.000 545 HD22 LEU 71 2HD2 LEU 71 3.496 -8.842 0.583 546 HD23 LEU 71 3HD2 LEU 71 2.994 -9.959 -0.708 547 H SER 72 H SER 72 -0.781 -12.274 2.091 548 HA SER 72 HA SER 72 0.542 -13.453 4.328 549 HB2 SER 72 1HB SER 72 -2.180 -14.018 3.110 550 HB3 SER 72 2HB SER 72 -1.640 -14.635 4.664 551 HG SER 72 HG SER 72 -2.117 -12.004 3.855 552 H ALA 73 H ALA 73 -0.646 -14.838 1.264 553 HA ALA 73 HA ALA 73 0.106 -17.527 1.830 554 HB1 ALA 73 1HB ALA 73 0.007 -17.847 -0.621 555 HB2 ALA 73 2HB ALA 73 -1.396 -16.932 -0.018 556 HB3 ALA 73 3HB ALA 73 -0.067 -16.083 -0.840 557 H MET 74 H MET 74 1.883 -14.840 0.322 558 HA MET 74 HA MET 74 4.210 -16.180 -0.449 559 HB2 MET 74 1HB MET 74 3.814 -13.803 -0.912 560 HB3 MET 74 2HB MET 74 3.929 -13.419 0.799 561 HG2 MET 74 1HG MET 74 6.307 -14.222 0.757 562 HG3 MET 74 2HG MET 74 6.159 -14.418 -0.991 563 HE1 MET 74 1HE MET 74 5.970 -10.380 1.256 564 HE2 MET 74 2HE MET 74 4.711 -11.627 1.434 565 HE3 MET 74 3HE MET 74 6.365 -11.942 2.013 566 H ARG 75 H ARG 75 3.489 -14.786 2.763 567 HA ARG 75 HA ARG 75 5.995 -15.648 3.894 568 HB2 ARG 75 1HB ARG 75 3.382 -14.764 5.156 569 HB3 ARG 75 2HB ARG 75 4.820 -15.153 6.088 570 HG2 ARG 75 1HG ARG 75 6.052 -13.347 4.999 571 HG3 ARG 75 2HG ARG 75 4.632 -12.973 3.993 572 HD2 ARG 75 1HD ARG 75 3.351 -12.462 5.987 573 HD3 ARG 75 2HD ARG 75 4.763 -12.847 6.997 574 HE ARG 75 HE ARG 75 5.593 -10.924 5.149 575 HH11 ARG 75 1HH1 ARG 75 3.271 -11.189 7.773 576 HH12 ARG 75 2HH1 ARG 75 3.355 -9.491 8.185 577 HH21 ARG 75 1HH2 ARG 75 5.693 -8.722 5.694 578 HH22 ARG 75 2HH2 ARG 75 4.725 -8.094 7.009 579 H ASN 76 H ASN 76 2.741 -17.032 3.733 580 HA ASN 76 HA ASN 76 3.291 -19.076 5.720 581 HB2 ASN 76 1HB ASN 76 1.053 -18.655 3.723 582 HB3 ASN 76 2HB ASN 76 1.123 -20.060 4.779 583 HD21 ASN 76 1HD2 ASN 76 -0.928 -17.336 6.311 584 HD22 ASN 76 2HD2 ASN 76 -0.934 -18.132 4.773 585 H LEU 77 H LEU 77 3.512 -18.854 2.219 586 HA LEU 77 HA LEU 77 3.816 -21.765 1.949 587 HB2 LEU 77 1HB LEU 77 3.974 -19.502 -0.073 588 HB3 LEU 77 2HB LEU 77 4.106 -21.217 -0.477 589 HG LEU 77 HG LEU 77 1.659 -19.897 0.753 590 HD11 LEU 77 1HD1 LEU 77 0.674 -20.198 -1.475 591 HD12 LEU 77 2HD1 LEU 77 2.087 -19.118 -1.522 592 HD13 LEU 77 3HD1 LEU 77 2.234 -20.801 -2.084 593 HD21 LEU 77 1HD2 LEU 77 0.584 -22.056 0.211 594 HD22 LEU 77 2HD2 LEU 77 2.143 -22.686 -0.374 595 HD23 LEU 77 3HD2 LEU 77 1.936 -22.281 1.347 596 H ASN 78 H ASN 78 5.809 -18.875 2.012 597 HA ASN 78 HA ASN 78 8.188 -20.106 0.954 598 HB2 ASN 78 1HB ASN 78 7.813 -17.651 1.043 599 HB3 ASN 78 2HB ASN 78 7.916 -17.709 2.797 600 HD21 ASN 78 1HD2 ASN 78 11.205 -17.037 0.851 601 HD22 ASN 78 2HD2 ASN 78 9.584 -16.628 0.397 602 H GLY 79 H GLY 79 9.111 -21.811 1.798 603 HA2 GLY 79 1HA GLY 79 10.594 -22.669 3.527 604 HA3 GLY 79 2HA GLY 79 9.667 -21.796 4.732 605 H ARG 80 H ARG 80 7.349 -22.916 2.737 606 HA ARG 80 HA ARG 80 6.595 -25.057 4.551 607 HB2 ARG 80 1HB ARG 80 4.950 -23.536 3.454 608 HB3 ARG 80 2HB ARG 80 5.360 -24.242 1.898 609 HG2 ARG 80 1HG ARG 80 4.527 -26.420 2.637 610 HG3 ARG 80 2HG ARG 80 4.149 -25.737 4.237 611 HD2 ARG 80 1HD ARG 80 2.643 -24.129 3.137 612 HD3 ARG 80 2HD ARG 80 2.955 -24.951 1.591 613 HE ARG 80 HE ARG 80 2.101 -26.801 3.607 614 HH11 ARG 80 1HH1 ARG 80 0.941 -24.332 1.393 615 HH12 ARG 80 2HH1 ARG 80 -0.666 -25.013 1.278 616 HH21 ARG 80 1HH2 ARG 80 0.012 -27.675 3.449 617 HH22 ARG 80 2HH2 ARG 80 -1.193 -26.905 2.441 618 H GLU 81 H GLU 81 6.693 -27.213 4.297 619 HA GLU 81 HA GLU 81 8.411 -28.230 2.145 620 HB2 GLU 81 1HB GLU 81 8.652 -29.043 4.485 621 HB3 GLU 81 2HB GLU 81 7.017 -29.687 4.427 622 HG2 GLU 81 1HG GLU 81 7.674 -31.229 2.634 623 HG3 GLU 81 2HG GLU 81 9.309 -30.572 2.661 624 H PHE 82 H PHE 82 7.788 -29.159 0.329 625 HA PHE 82 HA PHE 82 5.106 -30.423 0.215 626 HB2 PHE 82 1HB PHE 82 4.816 -28.127 -0.671 627 HB3 PHE 82 2HB PHE 82 6.116 -28.397 -1.821 628 HD1 PHE 82 HD1 PHE 82 3.260 -30.585 -0.798 629 HD2 PHE 82 HD2 PHE 82 5.183 -28.404 -3.928 630 HE1 PHE 82 HE1 PHE 82 1.632 -31.488 -2.425 631 HE2 PHE 82 HE2 PHE 82 3.555 -29.303 -5.557 632 HZ PHE 82 HZ PHE 82 1.780 -30.847 -4.805 633 H SER 83 H SER 83 5.456 -32.447 -0.332 634 HA SER 83 HA SER 83 6.434 -34.318 -1.254 635 HB2 SER 83 1HB SER 83 5.520 -32.978 -3.293 636 HB3 SER 83 2HB SER 83 7.207 -32.618 -3.624 637 HG SER 83 HG SER 83 6.924 -34.426 -4.656 638 H GLY 84 H GLY 84 8.101 -32.636 0.417 639 HA2 GLY 84 1HA GLY 84 10.239 -33.320 1.215 640 HA3 GLY 84 2HA GLY 84 10.638 -33.939 -0.376 641 H ARG 85 H ARG 85 9.327 -31.125 -1.200 642 HA ARG 85 HA ARG 85 11.986 -29.823 -1.330 643 HB2 ARG 85 1HB ARG 85 9.417 -29.550 -2.881 644 HB3 ARG 85 2HB ARG 85 10.601 -28.253 -2.910 645 HG2 ARG 85 1HG ARG 85 11.033 -29.558 -4.813 646 HG3 ARG 85 2HG ARG 85 12.304 -30.002 -3.649 647 HD2 ARG 85 1HD ARG 85 11.376 -32.055 -3.222 648 HD3 ARG 85 2HD ARG 85 9.762 -31.559 -3.783 649 HE ARG 85 HE ARG 85 11.790 -31.527 -5.856 650 HH11 ARG 85 1HH1 ARG 85 9.434 -33.490 -4.142 651 HH12 ARG 85 2HH1 ARG 85 9.265 -34.647 -5.443 652 HH21 ARG 85 1HH2 ARG 85 11.563 -33.036 -7.538 653 HH22 ARG 85 2HH2 ARG 85 10.470 -34.391 -7.365 654 H ALA 86 H ALA 86 12.443 -27.832 -0.523 655 HA ALA 86 HA ALA 86 10.406 -26.610 1.241 656 HB1 ALA 86 1HB ALA 86 12.271 -25.184 2.021 657 HB2 ALA 86 2HB ALA 86 12.663 -26.915 2.154 658 HB3 ALA 86 3HB ALA 86 13.344 -25.948 0.826 659 H LEU 87 H LEU 87 9.025 -25.259 0.350 660 HA LEU 87 HA LEU 87 9.466 -24.180 -2.277 661 HB2 LEU 87 1HB LEU 87 7.360 -23.552 -0.178 662 HB3 LEU 87 2HB LEU 87 7.321 -22.959 -1.842 663 HG LEU 87 HG LEU 87 7.212 -25.886 -1.029 664 HD11 LEU 87 1HD1 LEU 87 4.854 -25.735 -1.694 665 HD12 LEU 87 2HD1 LEU 87 5.223 -24.656 -0.329 666 HD13 LEU 87 3HD1 LEU 87 5.044 -23.987 -1.968 667 HD21 LEU 87 1HD2 LEU 87 6.624 -26.222 -3.407 668 HD22 LEU 87 2HD2 LEU 87 6.838 -24.480 -3.706 669 HD23 LEU 87 3HD2 LEU 87 8.235 -25.482 -3.244 670 H ARG 88 H ARG 88 10.135 -22.244 -2.973 671 HA ARG 88 HA ARG 88 10.773 -20.203 -0.884 672 HB2 ARG 88 1HB ARG 88 12.764 -21.109 -2.043 673 HB3 ARG 88 2HB ARG 88 12.084 -20.631 -3.591 674 HG2 ARG 88 1HG ARG 88 12.312 -18.315 -3.087 675 HG3 ARG 88 2HG ARG 88 12.686 -18.658 -1.380 676 HD2 ARG 88 1HD ARG 88 14.718 -18.155 -2.437 677 HD3 ARG 88 2HD ARG 88 14.692 -19.918 -2.203 678 HE ARG 88 HE ARG 88 14.546 -20.226 -4.497 679 HH11 ARG 88 1HH1 ARG 88 14.289 -16.815 -3.695 680 HH12 ARG 88 2HH1 ARG 88 14.517 -16.281 -5.345 681 HH21 ARG 88 1HH2 ARG 88 14.840 -19.520 -6.636 682 HH22 ARG 88 2HH2 ARG 88 14.829 -17.812 -7.010 683 H VAL 89 H VAL 89 9.161 -18.763 -0.859 684 HA VAL 89 HA VAL 89 7.934 -18.037 -3.488 685 HB VAL 89 HB VAL 89 6.596 -18.157 -0.751 686 HG11 VAL 89 1HG1 VAL 89 4.520 -17.805 -1.998 687 HG12 VAL 89 2HG1 VAL 89 5.646 -16.439 -2.180 688 HG13 VAL 89 3HG1 VAL 89 5.455 -17.617 -3.500 689 HG21 VAL 89 1HG2 VAL 89 5.394 -20.107 -1.688 690 HG22 VAL 89 2HG2 VAL 89 6.363 -19.987 -3.176 691 HG23 VAL 89 3HG2 VAL 89 7.149 -20.398 -1.633 692 H ASP 90 H ASP 90 8.253 -16.015 -4.078 693 HA ASP 90 HA ASP 90 8.464 -13.946 -1.931 694 HB2 ASP 90 1HB ASP 90 9.994 -14.122 -4.556 695 HB3 ASP 90 2HB ASP 90 9.969 -12.694 -3.531 696 H ASN 91 H ASN 91 8.145 -11.677 -2.927 697 HA ASN 91 HA ASN 91 5.484 -11.642 -4.069 698 HB2 ASN 91 1HB ASN 91 6.372 -9.939 -2.456 699 HB3 ASN 91 2HB ASN 91 7.435 -9.344 -3.724 700 HD21 ASN 91 1HD2 ASN 91 4.158 -7.456 -3.497 701 HD22 ASN 91 2HD2 ASN 91 5.263 -8.009 -2.284 702 H ALA 92 H ALA 92 4.858 -11.671 -6.089 703 HA ALA 92 HA ALA 92 6.740 -12.260 -8.126 704 HB1 ALA 92 1HB ALA 92 4.816 -12.092 -9.672 705 HB2 ALA 92 2HB ALA 92 4.406 -13.017 -8.208 706 HB3 ALA 92 3HB ALA 92 3.855 -11.335 -8.381 707 H ALA 93 H ALA 93 5.513 -9.234 -6.955 708 HA ALA 93 HA ALA 93 6.050 -7.789 -9.431 709 HB1 ALA 93 1HB ALA 93 5.446 -5.789 -8.106 710 HB2 ALA 93 2HB ALA 93 4.230 -7.079 -7.944 711 HB3 ALA 93 3HB ALA 93 5.399 -6.788 -6.635 712 H SER 94 H SER 94 7.982 -8.991 -6.986 713 HA SER 94 HA SER 94 9.777 -6.812 -6.534 714 HB2 SER 94 1HB SER 94 9.709 -8.741 -5.055 715 HB3 SER 94 2HB SER 94 10.184 -9.814 -6.363 716 HG SER 94 HG SER 94 11.688 -8.386 -4.740 717 H GLU 95 H GLU 95 11.618 -6.151 -7.506 718 HA GLU 95 HA GLU 95 11.963 -6.735 -10.298 719 HB2 GLU 95 1HB GLU 95 13.765 -5.313 -8.299 720 HB3 GLU 95 2HB GLU 95 14.083 -5.388 -10.026 721 HG2 GLU 95 1HG GLU 95 11.641 -4.142 -8.744 722 HG3 GLU 95 2HG GLU 95 13.053 -3.271 -9.337 723 H LYS 96 H LYS 96 13.316 -8.066 -7.362 724 HA LYS 96 HA LYS 96 15.606 -9.327 -8.530 725 HB2 LYS 96 1HB LYS 96 13.954 -9.982 -6.064 726 HB3 LYS 96 2HB LYS 96 15.408 -10.866 -6.504 727 HG2 LYS 96 1HG LYS 96 16.731 -8.793 -6.338 728 HG3 LYS 96 2HG LYS 96 15.268 -7.896 -5.906 729 HD2 LYS 96 1HD LYS 96 14.983 -9.325 -3.905 730 HD3 LYS 96 2HD LYS 96 16.447 -10.221 -4.337 731 HE2 LYS 96 1HE LYS 96 17.783 -8.159 -4.132 732 HE3 LYS 96 2HE LYS 96 16.328 -7.242 -3.737 733 HZ1 LYS 96 1HZ LYS 96 17.542 -7.857 -1.778 734 HZ2 LYS 96 2HZ LYS 96 16.071 -8.604 -1.778 735 HZ3 LYS 96 3HZ LYS 96 17.431 -9.460 -2.147 736 H ASN 97 H ASN 97 12.231 -10.336 -8.154 737 HA ASN 97 HA ASN 97 12.641 -13.002 -9.170 738 HB2 ASN 97 1HB ASN 97 10.194 -11.228 -8.955 739 HB3 ASN 97 2HB ASN 97 10.131 -12.859 -9.609 740 HD21 ASN 97 1HD2 ASN 97 9.331 -12.869 -5.964 741 HD22 ASN 97 2HD2 ASN 97 8.730 -11.998 -7.335 742 H LYS 98 H LYS 98 11.936 -9.886 -10.680 743 HA LYS 98 HA LYS 98 11.510 -10.867 -13.324 744 HB2 LYS 98 1HB LYS 98 12.632 -8.227 -12.313 745 HB3 LYS 98 2HB LYS 98 12.286 -8.546 -14.007 746 HG2 LYS 98 1HG LYS 98 9.912 -8.896 -13.477 747 HG3 LYS 98 2HG LYS 98 10.248 -8.618 -11.762 748 HD2 LYS 98 1HD LYS 98 11.096 -6.335 -12.337 749 HD3 LYS 98 2HD LYS 98 10.637 -6.622 -14.022 750 HE2 LYS 98 1HE LYS 98 8.288 -6.904 -13.359 751 HE3 LYS 98 2HE LYS 98 8.723 -6.697 -11.661 752 HZ1 LYS 98 1HZ LYS 98 7.879 -4.677 -12.608 753 HZ2 LYS 98 2HZ LYS 98 9.459 -4.473 -12.181 754 HZ3 LYS 98 3HZ LYS 98 9.051 -4.666 -13.768 755 H GLU 99 H GLU 99 14.463 -10.066 -11.534 756 HA GLU 99 HA GLU 99 16.252 -10.472 -13.746 757 HB2 GLU 99 1HB GLU 99 16.663 -10.625 -10.736 758 HB3 GLU 99 2HB GLU 99 17.971 -10.793 -11.897 759 HG2 GLU 99 1HG GLU 99 16.190 -8.365 -11.593 760 HG3 GLU 99 2HG GLU 99 17.824 -8.535 -10.957 761 H GLU 100 H GLU 100 14.873 -12.621 -11.289 762 HA GLU 100 HA GLU 100 16.345 -14.959 -12.033 763 HB2 GLU 100 1HB GLU 100 13.602 -14.586 -10.775 764 HB3 GLU 100 2HB GLU 100 14.328 -16.167 -11.030 765 HG2 GLU 100 1HG GLU 100 16.238 -15.508 -9.609 766 HG3 GLU 100 2HG GLU 100 15.481 -13.940 -9.336 767 H LEU 101 H LEU 101 13.326 -13.529 -13.236 768 HA LEU 101 HA LEU 101 12.630 -15.640 -15.018 769 HB2 LEU 101 1HB LEU 101 12.091 -12.655 -15.098 770 HB3 LEU 101 2HB LEU 101 11.403 -13.793 -16.261 771 HG LEU 101 HG LEU 101 10.917 -13.830 -13.260 772 HD11 LEU 101 1HD1 LEU 101 8.664 -13.072 -13.872 773 HD12 LEU 101 2HD1 LEU 101 9.908 -11.898 -14.362 774 HD13 LEU 101 3HD1 LEU 101 9.163 -12.965 -15.577 775 HD21 LEU 101 1HD2 LEU 101 9.211 -15.522 -13.840 776 HD22 LEU 101 2HD2 LEU 101 9.717 -15.450 -15.545 777 HD23 LEU 101 3HD2 LEU 101 10.839 -16.068 -14.309 778 H LYS 102 H LYS 102 14.833 -12.894 -15.324 779 HA LYS 102 HA LYS 102 15.350 -13.160 -18.121 780 HB2 LYS 102 1HB LYS 102 17.042 -12.083 -15.836 781 HB3 LYS 102 2HB LYS 102 17.547 -12.013 -17.519 782 HG2 LYS 102 1HG LYS 102 15.603 -10.629 -18.075 783 HG3 LYS 102 2HG LYS 102 15.030 -10.741 -16.405 784 HD2 LYS 102 1HD LYS 102 17.115 -9.642 -15.625 785 HD3 LYS 102 2HD LYS 102 17.661 -9.507 -17.303 786 HE2 LYS 102 1HE LYS 102 15.730 -8.093 -17.846 787 HE3 LYS 102 2HE LYS 102 15.108 -8.274 -16.203 788 HZ1 LYS 102 1HZ LYS 102 16.282 -6.216 -16.480 789 HZ2 LYS 102 2HZ LYS 102 17.081 -7.171 -15.397 790 HZ3 LYS 102 3HZ LYS 102 17.661 -7.001 -16.932 791 H SER 103 H SER 103 16.792 -14.704 -15.270 792 HA SER 103 HA SER 103 18.782 -16.131 -16.841 793 HB2 SER 103 1HB SER 103 19.346 -17.226 -14.778 794 HB3 SER 103 2HB SER 103 19.061 -15.528 -14.430 795 HG SER 103 HG SER 103 16.771 -16.449 -14.139 796 H LEU 104 H LEU 104 15.502 -16.722 -15.749 797 HA LEU 104 HA LEU 104 15.536 -19.544 -16.467 798 HB2 LEU 104 1HB LEU 104 13.298 -17.580 -15.880 799 HB3 LEU 104 2HB LEU 104 13.020 -19.281 -16.268 800 HG LEU 104 HG LEU 104 14.645 -18.314 -13.890 801 HD11 LEU 104 1HD1 LEU 104 12.673 -18.928 -12.564 802 HD12 LEU 104 2HD1 LEU 104 12.313 -17.614 -13.708 803 HD13 LEU 104 3HD1 LEU 104 11.774 -19.273 -14.060 804 HD21 LEU 104 1HD2 LEU 104 14.386 -20.662 -13.161 805 HD22 LEU 104 2HD2 LEU 104 13.511 -21.033 -14.666 806 HD23 LEU 104 3HD2 LEU 104 15.228 -20.567 -14.727 807 H GLY 105 H GLY 105 14.798 -16.501 -18.060 808 HA2 GLY 105 1HA GLY 105 14.581 -16.090 -20.357 809 HA3 GLY 105 2HA GLY 105 14.748 -17.807 -20.672 810 H THR 106 H THR 106 12.416 -16.390 -18.413 811 HA THR 106 HA THR 106 10.221 -17.217 -20.258 812 HB THR 106 HB THR 106 10.395 -17.838 -17.278 813 HG1 THR 106 HG1 THR 106 10.652 -19.379 -19.650 814 HG21 THR 106 1HG2 THR 106 8.252 -19.002 -17.633 815 HG22 THR 106 2HG2 THR 106 8.102 -17.267 -17.999 816 HG23 THR 106 3HG2 THR 106 8.227 -18.448 -19.323 817 H GLY 107 H GLY 107 8.517 -15.900 -20.392 818 HA2 GLY 107 1HA GLY 107 8.463 -13.559 -18.516 819 HA3 GLY 107 2HA GLY 107 8.079 -13.431 -20.223 Start of MODEL 9 1 H MET 1 1H MET 1 5.806 -0.848 -2.276 2 HA MET 1 HA MET 1 3.844 -0.366 -1.042 3 HB2 MET 1 1HB MET 1 3.449 -1.473 -3.847 4 HB3 MET 1 2HB MET 1 2.253 -0.507 -2.995 5 HG2 MET 1 1HG MET 1 5.046 0.412 -3.737 6 HG3 MET 1 2HG MET 1 3.558 0.820 -4.596 7 HE1 MET 1 1HE MET 1 1.670 3.125 -2.121 8 HE2 MET 1 2HE MET 1 1.768 2.498 -3.785 9 HE3 MET 1 3HE MET 1 1.419 1.390 -2.435 10 H ALA 2 H ALA 2 4.616 -3.066 -0.216 11 HA ALA 2 HA ALA 2 2.478 -4.897 -0.715 12 HB1 ALA 2 1HB ALA 2 3.396 -6.152 1.209 13 HB2 ALA 2 2HB ALA 2 4.678 -5.629 0.091 14 HB3 ALA 2 3HB ALA 2 4.420 -4.757 1.620 15 H GLY 3 H GLY 3 0.439 -4.636 -0.205 16 HA2 GLY 3 1HA GLY 3 -1.386 -4.545 1.273 17 HA3 GLY 3 2HA GLY 3 -0.297 -4.140 2.586 18 H LEU 4 H LEU 4 0.242 -2.234 -0.188 19 HA LEU 4 HA LEU 4 -1.315 0.002 1.041 20 HB2 LEU 4 1HB LEU 4 1.259 0.132 -0.569 21 HB3 LEU 4 2HB LEU 4 0.390 1.515 0.102 22 HG LEU 4 HG LEU 4 1.719 -0.687 1.723 23 HD11 LEU 4 1HD1 LEU 4 3.339 1.064 2.299 24 HD12 LEU 4 2HD1 LEU 4 3.325 0.732 0.551 25 HD13 LEU 4 3HD1 LEU 4 2.521 2.187 1.187 26 HD21 LEU 4 1HD2 LEU 4 1.227 0.804 3.631 27 HD22 LEU 4 2HD2 LEU 4 0.379 1.924 2.539 28 HD23 LEU 4 3HD2 LEU 4 -0.270 0.291 2.818 29 H THR 5 H THR 5 -2.328 1.503 -0.310 30 HA THR 5 HA THR 5 -3.349 0.351 -2.778 31 HB THR 5 HB THR 5 -3.776 3.107 -1.546 32 HG1 THR 5 HG1 THR 5 -5.896 1.975 -1.144 33 HG21 THR 5 1HG2 THR 5 -5.724 3.226 -3.049 34 HG22 THR 5 2HG2 THR 5 -4.212 3.082 -3.977 35 HG23 THR 5 3HG2 THR 5 -5.268 1.665 -3.770 36 H VAL 6 H VAL 6 -2.790 0.717 -4.815 37 HA VAL 6 HA VAL 6 -0.912 2.963 -5.370 38 HB VAL 6 HB VAL 6 0.388 0.844 -5.136 39 HG11 VAL 6 1HG1 VAL 6 0.101 -0.945 -6.780 40 HG12 VAL 6 2HG1 VAL 6 -1.348 -0.730 -5.770 41 HG13 VAL 6 3HG1 VAL 6 -1.326 -0.111 -7.438 42 HG21 VAL 6 1HG2 VAL 6 1.544 1.000 -7.318 43 HG22 VAL 6 2HG2 VAL 6 0.160 1.898 -7.985 44 HG23 VAL 6 3HG2 VAL 6 1.143 2.614 -6.685 45 H ARG 7 H ARG 7 -1.120 3.937 -7.346 46 HA ARG 7 HA ARG 7 -3.760 3.703 -8.500 47 HB2 ARG 7 1HB ARG 7 -1.328 5.349 -9.256 48 HB3 ARG 7 2HB ARG 7 -2.859 5.448 -10.113 49 HG2 ARG 7 1HG ARG 7 -3.982 6.207 -8.080 50 HG3 ARG 7 2HG ARG 7 -2.457 6.058 -7.173 51 HD2 ARG 7 1HD ARG 7 -1.434 7.710 -8.628 52 HD3 ARG 7 2HD ARG 7 -2.957 7.858 -9.533 53 HE ARG 7 HE ARG 7 -3.580 8.316 -6.855 54 HH11 ARG 7 1HH1 ARG 7 -1.553 9.768 -9.329 55 HH12 ARG 7 2HH1 ARG 7 -1.691 11.383 -8.672 56 HH21 ARG 7 1HH2 ARG 7 -3.752 10.417 -6.011 57 HH22 ARG 7 2HH2 ARG 7 -2.935 11.752 -6.794 58 H ASP 8 H ASP 8 -0.485 2.796 -9.516 59 HA ASP 8 HA ASP 8 -1.207 2.153 -12.224 60 HB2 ASP 8 1HB ASP 8 1.128 2.634 -11.437 61 HB3 ASP 8 2HB ASP 8 1.128 1.101 -10.577 62 HA PRO 9 HA PRO 9 -3.520 -1.494 -11.242 63 HB2 PRO 9 1HB PRO 9 -3.193 -1.761 -14.255 64 HB3 PRO 9 2HB PRO 9 -4.648 -1.972 -13.273 65 HG2 PRO 9 1HG PRO 9 -4.375 0.296 -14.629 66 HG3 PRO 9 2HG PRO 9 -4.947 0.372 -12.960 67 HD2 PRO 9 1HD PRO 9 -2.153 0.892 -14.055 68 HD3 PRO 9 2HD PRO 9 -3.082 1.826 -12.815 69 H ALA 10 H ALA 10 -0.670 -1.305 -13.365 70 HA ALA 10 HA ALA 10 -0.177 -4.115 -13.526 71 HB1 ALA 10 1HB ALA 10 2.081 -3.454 -14.287 72 HB2 ALA 10 2HB ALA 10 0.809 -2.512 -15.100 73 HB3 ALA 10 3HB ALA 10 1.753 -1.781 -13.781 74 H VAL 11 H VAL 11 1.039 -1.599 -11.322 75 HA VAL 11 HA VAL 11 2.750 -3.354 -9.830 76 HB VAL 11 HB VAL 11 1.386 -0.741 -9.053 77 HG11 VAL 11 1HG1 VAL 11 3.021 -0.615 -7.237 78 HG12 VAL 11 2HG1 VAL 11 1.936 -2.015 -7.062 79 HG13 VAL 11 3HG1 VAL 11 3.601 -2.246 -7.648 80 HG21 VAL 11 1HG2 VAL 11 3.624 0.217 -9.496 81 HG22 VAL 11 2HG2 VAL 11 4.215 -1.390 -9.979 82 HG23 VAL 11 3HG2 VAL 11 2.965 -0.574 -10.947 83 H ASP 12 H ASP 12 -0.618 -2.267 -9.373 84 HA ASP 12 HA ASP 12 -1.102 -3.552 -6.901 85 HB2 ASP 12 1HB ASP 12 -2.634 -1.910 -8.024 86 HB3 ASP 12 2HB ASP 12 -3.072 -3.152 -9.189 87 H ARG 13 H ARG 13 -1.341 -4.779 -10.230 88 HA ARG 13 HA ARG 13 -2.409 -7.340 -9.537 89 HB2 ARG 13 1HB ARG 13 -2.382 -6.375 -11.840 90 HB3 ARG 13 2HB ARG 13 -0.641 -6.605 -11.897 91 HG2 ARG 13 1HG ARG 13 -0.885 -9.001 -11.803 92 HG3 ARG 13 2HG ARG 13 -2.638 -8.851 -11.531 93 HD2 ARG 13 1HD ARG 13 -2.857 -7.767 -13.712 94 HD3 ARG 13 2HD ARG 13 -1.114 -8.001 -13.982 95 HE ARG 13 HE ARG 13 -2.225 -10.499 -13.336 96 HH11 ARG 13 1HH1 ARG 13 -2.416 -8.093 -15.888 97 HH12 ARG 13 2HH1 ARG 13 -2.792 -9.262 -17.134 98 HH21 ARG 13 1HH2 ARG 13 -2.714 -12.007 -14.962 99 HH22 ARG 13 2HH2 ARG 13 -2.962 -11.477 -16.611 100 H SER 14 H SER 14 0.911 -6.111 -9.847 101 HA SER 14 HA SER 14 2.157 -8.671 -9.355 102 HB2 SER 14 1HB SER 14 4.201 -7.438 -9.180 103 HB3 SER 14 2HB SER 14 3.255 -6.705 -10.467 104 HG SER 14 HG SER 14 2.497 -5.512 -8.317 105 H LEU 15 H LEU 15 0.741 -6.218 -7.343 106 HA LEU 15 HA LEU 15 1.933 -7.269 -4.884 107 HB2 LEU 15 1HB LEU 15 -0.340 -5.327 -5.413 108 HB3 LEU 15 2HB LEU 15 0.205 -5.780 -3.795 109 HG LEU 15 HG LEU 15 1.975 -4.441 -5.869 110 HD11 LEU 15 1HD1 LEU 15 1.620 -2.397 -4.558 111 HD12 LEU 15 2HD1 LEU 15 0.102 -2.996 -5.267 112 HD13 LEU 15 3HD1 LEU 15 0.441 -3.255 -3.539 113 HD21 LEU 15 1HD2 LEU 15 3.413 -4.026 -3.901 114 HD22 LEU 15 2HD2 LEU 15 2.259 -4.908 -2.872 115 HD23 LEU 15 3HD2 LEU 15 3.152 -5.770 -4.147 116 H ARG 16 H ARG 16 -0.936 -7.789 -6.823 117 HA ARG 16 HA ARG 16 -2.252 -9.348 -4.703 118 HB2 ARG 16 1HB ARG 16 -2.988 -8.719 -7.577 119 HB3 ARG 16 2HB ARG 16 -3.943 -9.783 -6.555 120 HG2 ARG 16 1HG ARG 16 -4.372 -7.957 -4.996 121 HG3 ARG 16 2HG ARG 16 -3.345 -6.872 -5.965 122 HD2 ARG 16 1HD ARG 16 -4.847 -7.228 -7.876 123 HD3 ARG 16 2HD ARG 16 -5.899 -8.208 -6.829 124 HE ARG 16 HE ARG 16 -5.455 -5.294 -6.672 125 HH11 ARG 16 1HH1 ARG 16 -7.090 -8.178 -5.509 126 HH12 ARG 16 2HH1 ARG 16 -8.325 -7.284 -4.651 127 HH21 ARG 16 1HH2 ARG 16 -7.063 -4.145 -5.554 128 HH22 ARG 16 2HH2 ARG 16 -8.311 -5.001 -4.676 129 H SER 17 H SER 17 0.313 -9.964 -6.580 130 HA SER 17 HA SER 17 -0.383 -12.847 -6.842 131 HB2 SER 17 1HB SER 17 0.662 -12.943 -9.040 132 HB3 SER 17 2HB SER 17 -0.671 -11.800 -9.053 133 HG SER 17 HG SER 17 0.696 -10.153 -9.049 134 H VAL 18 H VAL 18 1.570 -14.209 -7.234 135 HA VAL 18 HA VAL 18 3.985 -13.025 -5.944 136 HB VAL 18 HB VAL 18 4.249 -15.047 -4.568 137 HG11 VAL 18 1HG1 VAL 18 2.403 -14.683 -3.003 138 HG12 VAL 18 2HG1 VAL 18 3.073 -13.150 -3.612 139 HG13 VAL 18 3HG1 VAL 18 1.529 -13.763 -4.251 140 HG21 VAL 18 1HG2 VAL 18 2.417 -16.705 -4.440 141 HG22 VAL 18 2HG2 VAL 18 1.551 -15.846 -5.735 142 HG23 VAL 18 3HG2 VAL 18 3.109 -16.635 -6.078 143 H PHE 19 H PHE 19 5.968 -14.162 -6.361 144 HA PHE 19 HA PHE 19 5.845 -15.962 -8.732 145 HB2 PHE 19 1HB PHE 19 8.157 -14.454 -7.453 146 HB3 PHE 19 2HB PHE 19 8.353 -15.610 -8.761 147 HD1 PHE 19 HD1 PHE 19 8.825 -12.460 -8.473 148 HD2 PHE 19 HD2 PHE 19 5.902 -14.929 -10.374 149 HE1 PHE 19 HE1 PHE 19 8.386 -10.670 -10.120 150 HE2 PHE 19 HE2 PHE 19 5.462 -13.142 -12.024 151 HZ PHE 19 HZ PHE 19 6.704 -11.010 -11.895 152 H VAL 20 H VAL 20 6.462 -18.046 -8.661 153 HA VAL 20 HA VAL 20 7.090 -19.090 -5.930 154 HB VAL 20 HB VAL 20 5.471 -20.434 -8.137 155 HG11 VAL 20 1HG1 VAL 20 4.938 -22.099 -6.424 156 HG12 VAL 20 2HG1 VAL 20 6.684 -22.028 -6.764 157 HG13 VAL 20 3HG1 VAL 20 6.033 -21.278 -5.287 158 HG21 VAL 20 1HG2 VAL 20 3.546 -20.056 -6.629 159 HG22 VAL 20 2HG2 VAL 20 4.602 -19.169 -5.505 160 HG23 VAL 20 3HG2 VAL 20 4.284 -18.516 -7.129 161 H GLY 21 H GLY 21 8.784 -20.403 -5.688 162 HA2 GLY 21 1HA GLY 21 10.014 -21.598 -8.140 163 HA3 GLY 21 2HA GLY 21 11.006 -20.718 -6.993 164 H ASN 22 H ASN 22 11.908 -23.112 -7.304 165 HA ASN 22 HA ASN 22 12.377 -25.137 -6.314 166 HB2 ASN 22 1HB ASN 22 11.030 -23.828 -3.928 167 HB3 ASN 22 2HB ASN 22 11.961 -25.319 -3.866 168 HD21 ASN 22 1HD2 ASN 22 14.042 -22.327 -2.953 169 HD22 ASN 22 2HD2 ASN 22 12.484 -22.889 -2.448 170 H ILE 23 H ILE 23 10.060 -25.009 -7.893 171 HA ILE 23 HA ILE 23 7.975 -26.508 -6.469 172 HB ILE 23 HB ILE 23 8.254 -25.663 -9.383 173 HG12 ILE 23 1HG1 ILE 23 6.382 -24.647 -7.236 174 HG13 ILE 23 2HG1 ILE 23 7.903 -23.876 -7.656 175 HG21 ILE 23 1HG2 ILE 23 5.908 -26.372 -9.616 176 HG22 ILE 23 2HG2 ILE 23 6.953 -27.748 -9.194 177 HG23 ILE 23 3HG2 ILE 23 5.927 -26.997 -7.950 178 HD11 ILE 23 1HD1 ILE 23 6.032 -22.783 -8.758 179 HD12 ILE 23 2HD1 ILE 23 7.111 -23.536 -9.957 180 HD13 ILE 23 3HD1 ILE 23 5.569 -24.316 -9.531 181 HA PRO 24 HA PRO 24 9.764 -30.412 -7.428 182 HB2 PRO 24 1HB PRO 24 7.643 -31.975 -6.625 183 HB3 PRO 24 2HB PRO 24 8.737 -31.193 -5.477 184 HG2 PRO 24 1HG PRO 24 6.016 -30.245 -6.471 185 HG3 PRO 24 2HG PRO 24 6.605 -30.327 -4.808 186 HD2 PRO 24 1HD PRO 24 6.673 -27.995 -6.197 187 HD3 PRO 24 2HD PRO 24 7.997 -28.433 -5.045 188 H TYR 25 H TYR 25 9.733 -31.698 -9.227 189 HA TYR 25 HA TYR 25 8.099 -30.771 -11.423 190 HB2 TYR 25 1HB TYR 25 9.375 -32.288 -12.785 191 HB3 TYR 25 2HB TYR 25 10.482 -31.563 -11.628 192 HD1 TYR 25 HD1 TYR 25 8.750 -34.637 -12.638 193 HD2 TYR 25 HD2 TYR 25 11.477 -32.866 -9.838 194 HE1 TYR 25 HE1 TYR 25 9.467 -36.888 -11.911 195 HE2 TYR 25 HE2 TYR 25 12.193 -35.117 -9.111 196 HH TYR 25 HH TYR 25 10.717 -38.047 -10.477 197 H GLU 26 H GLU 26 7.643 -33.129 -9.008 198 HA GLU 26 HA GLU 26 5.971 -34.896 -10.633 199 HB2 GLU 26 1HB GLU 26 6.472 -34.740 -7.634 200 HB3 GLU 26 2HB GLU 26 5.467 -35.962 -8.401 201 HG2 GLU 26 1HG GLU 26 7.420 -36.733 -9.706 202 HG3 GLU 26 2HG GLU 26 8.420 -35.529 -8.896 203 H ALA 27 H ALA 27 5.557 -31.918 -9.059 204 HA ALA 27 HA ALA 27 2.707 -32.387 -8.460 205 HB1 ALA 27 1HB ALA 27 2.769 -30.092 -7.538 206 HB2 ALA 27 2HB ALA 27 4.045 -31.117 -6.841 207 HB3 ALA 27 3HB ALA 27 4.450 -29.922 -8.095 208 H THR 28 H THR 28 1.031 -31.713 -9.624 209 HA THR 28 HA THR 28 1.583 -30.343 -12.182 210 HB THR 28 HB THR 28 -0.743 -30.830 -12.744 211 HG1 THR 28 HG1 THR 28 -1.879 -32.136 -11.000 212 HG21 THR 28 1HG2 THR 28 -0.715 -33.288 -12.577 213 HG22 THR 28 2HG2 THR 28 0.894 -32.661 -13.008 214 HG23 THR 28 3HG2 THR 28 0.563 -33.194 -11.343 215 H GLU 29 H GLU 29 -0.055 -28.648 -12.865 216 HA GLU 29 HA GLU 29 0.168 -26.396 -11.133 217 HB2 GLU 29 1HB GLU 29 -1.575 -26.929 -13.565 218 HB3 GLU 29 2HB GLU 29 -1.548 -25.380 -12.736 219 HG2 GLU 29 1HG GLU 29 0.821 -25.114 -13.225 220 HG3 GLU 29 2HG GLU 29 0.875 -26.713 -13.963 221 H GLU 30 H GLU 30 -2.429 -28.739 -11.664 222 HA GLU 30 HA GLU 30 -4.402 -27.310 -10.125 223 HB2 GLU 30 1HB GLU 30 -4.156 -30.234 -10.928 224 HB3 GLU 30 2HB GLU 30 -5.542 -29.585 -10.063 225 HG2 GLU 30 1HG GLU 30 -6.019 -28.066 -11.920 226 HG3 GLU 30 2HG GLU 30 -4.599 -28.654 -12.783 227 H GLN 31 H GLN 31 -2.074 -29.890 -9.360 228 HA GLN 31 HA GLN 31 -2.943 -30.271 -6.658 229 HB2 GLN 31 1HB GLN 31 -0.290 -30.795 -8.046 230 HB3 GLN 31 2HB GLN 31 -0.587 -31.221 -6.366 231 HG2 GLN 31 1HG GLN 31 -2.366 -32.731 -7.007 232 HG3 GLN 31 2HG GLN 31 -2.201 -32.236 -8.715 233 HE21 GLN 31 1HE2 GLN 31 -0.252 -35.416 -7.610 234 HE22 GLN 31 2HE2 GLN 31 -1.774 -34.826 -7.031 235 H LEU 32 H LEU 32 -0.468 -28.170 -8.116 236 HA LEU 32 HA LEU 32 0.451 -27.057 -5.641 237 HB2 LEU 32 1HB LEU 32 0.470 -26.009 -8.489 238 HB3 LEU 32 2HB LEU 32 1.229 -25.157 -7.141 239 HG LEU 32 HG LEU 32 1.987 -27.982 -7.948 240 HD11 LEU 32 1HD1 LEU 32 3.897 -26.959 -9.102 241 HD12 LEU 32 2HD1 LEU 32 2.349 -26.469 -9.831 242 HD13 LEU 32 3HD1 LEU 32 3.230 -25.342 -8.772 243 HD21 LEU 32 1HD2 LEU 32 4.015 -27.442 -6.642 244 HD22 LEU 32 2HD2 LEU 32 3.350 -25.831 -6.276 245 HD23 LEU 32 3HD2 LEU 32 2.549 -27.289 -5.642 246 H LYS 33 H LYS 33 -2.086 -26.085 -7.940 247 HA LYS 33 HA LYS 33 -2.836 -23.662 -6.677 248 HB2 LYS 33 1HB LYS 33 -3.657 -24.370 -8.904 249 HB3 LYS 33 2HB LYS 33 -4.584 -25.665 -8.161 250 HG2 LYS 33 1HG LYS 33 -5.972 -24.023 -6.975 251 HG3 LYS 33 2HG LYS 33 -5.020 -22.704 -7.672 252 HD2 LYS 33 1HD LYS 33 -5.694 -23.395 -9.939 253 HD3 LYS 33 2HD LYS 33 -6.614 -24.748 -9.264 254 HE2 LYS 33 1HE LYS 33 -8.040 -23.136 -8.020 255 HE3 LYS 33 2HE LYS 33 -7.143 -21.799 -8.744 256 HZ1 LYS 33 1HZ LYS 33 -9.165 -22.247 -9.927 257 HZ2 LYS 33 2HZ LYS 33 -7.870 -22.556 -10.902 258 HZ3 LYS 33 3HZ LYS 33 -8.710 -23.804 -10.225 259 H ASP 34 H ASP 34 -3.935 -27.002 -6.097 260 HA ASP 34 HA ASP 34 -5.862 -26.421 -4.111 261 HB2 ASP 34 1HB ASP 34 -4.059 -28.828 -4.538 262 HB3 ASP 34 2HB ASP 34 -5.270 -28.774 -3.264 263 H ILE 35 H ILE 35 -2.363 -27.067 -3.790 264 HA ILE 35 HA ILE 35 -2.235 -26.710 -0.967 265 HB ILE 35 HB ILE 35 -0.150 -26.253 -3.138 266 HG12 ILE 35 1HG1 ILE 35 -0.923 -28.549 -2.969 267 HG13 ILE 35 2HG1 ILE 35 0.732 -28.400 -2.398 268 HG21 ILE 35 1HG2 ILE 35 1.504 -26.293 -1.315 269 HG22 ILE 35 2HG2 ILE 35 0.391 -24.916 -1.139 270 HG23 ILE 35 3HG2 ILE 35 0.188 -26.359 -0.118 271 HD11 ILE 35 1HD1 ILE 35 -0.560 -29.883 -0.968 272 HD12 ILE 35 2HD1 ILE 35 -0.055 -28.431 -0.070 273 HD13 ILE 35 3HD1 ILE 35 -1.731 -28.583 -0.649 274 H PHE 36 H PHE 36 -2.110 -24.412 -3.661 275 HA PHE 36 HA PHE 36 -1.219 -22.207 -2.007 276 HB2 PHE 36 1HB PHE 36 -2.435 -22.286 -4.796 277 HB3 PHE 36 2HB PHE 36 -1.807 -20.832 -4.037 278 HD1 PHE 36 HD1 PHE 36 -0.720 -21.523 -6.565 279 HD2 PHE 36 HD2 PHE 36 0.349 -23.034 -2.714 280 HE1 PHE 36 HE1 PHE 36 1.542 -22.063 -7.406 281 HE2 PHE 36 HE2 PHE 36 2.612 -23.573 -3.551 282 HZ PHE 36 HZ PHE 36 3.207 -23.088 -5.898 283 H SER 37 H SER 37 -4.294 -23.615 -2.789 284 HA SER 37 HA SER 37 -5.919 -21.293 -2.307 285 HB2 SER 37 1HB SER 37 -7.764 -22.787 -2.338 286 HB3 SER 37 2HB SER 37 -6.608 -23.421 -3.499 287 HG SER 37 HG SER 37 -5.901 -24.859 -1.947 288 H GLU 38 H GLU 38 -4.124 -23.335 -0.234 289 HA GLU 38 HA GLU 38 -5.848 -23.320 2.058 290 HB2 GLU 38 1HB GLU 38 -2.836 -23.662 1.792 291 HB3 GLU 38 2HB GLU 38 -3.706 -23.862 3.306 292 HG2 GLU 38 1HG GLU 38 -5.041 -25.677 2.283 293 HG3 GLU 38 2HG GLU 38 -4.123 -25.490 0.790 294 H VAL 39 H VAL 39 -3.784 -20.930 0.653 295 HA VAL 39 HA VAL 39 -3.862 -19.356 3.193 296 HB VAL 39 HB VAL 39 -1.856 -18.172 2.323 297 HG11 VAL 39 1HG1 VAL 39 -0.257 -19.998 2.634 298 HG12 VAL 39 2HG1 VAL 39 -1.577 -20.058 3.826 299 HG13 VAL 39 3HG1 VAL 39 -1.573 -21.181 2.445 300 HG21 VAL 39 1HG2 VAL 39 -0.675 -19.102 0.358 301 HG22 VAL 39 2HG2 VAL 39 -2.009 -20.252 0.102 302 HG23 VAL 39 3HG2 VAL 39 -2.291 -18.504 -0.086 303 H GLY 40 H GLY 40 -5.783 -19.598 0.800 304 HA2 GLY 40 1HA GLY 40 -7.267 -17.472 0.823 305 HA3 GLY 40 2HA GLY 40 -5.868 -16.686 0.116 306 HA PRO 41 HA PRO 41 -8.795 -18.944 -2.968 307 HB2 PRO 41 1HB PRO 41 -9.374 -16.040 -3.664 308 HB3 PRO 41 2HB PRO 41 -10.458 -17.436 -3.726 309 HG2 PRO 41 1HG PRO 41 -10.690 -15.753 -1.679 310 HG3 PRO 41 2HG PRO 41 -10.757 -17.489 -1.364 311 HD2 PRO 41 1HD PRO 41 -8.427 -15.562 -1.001 312 HD3 PRO 41 2HD PRO 41 -8.992 -16.886 0.095 313 H VAL 42 H VAL 42 -7.814 -19.492 -4.837 314 HA VAL 42 HA VAL 42 -5.616 -17.756 -5.828 315 HB VAL 42 HB VAL 42 -6.329 -20.647 -6.481 316 HG11 VAL 42 1HG1 VAL 42 -4.161 -20.724 -7.613 317 HG12 VAL 42 2HG1 VAL 42 -5.267 -19.554 -8.370 318 HG13 VAL 42 3HG1 VAL 42 -3.948 -18.982 -7.321 319 HG21 VAL 42 1HG2 VAL 42 -4.292 -21.163 -5.174 320 HG22 VAL 42 2HG2 VAL 42 -4.091 -19.434 -4.807 321 HG23 VAL 42 3HG2 VAL 42 -5.500 -20.320 -4.177 322 H VAL 43 H VAL 43 -5.881 -16.524 -7.548 323 HA VAL 43 HA VAL 43 -8.292 -16.697 -9.163 324 HB VAL 43 HB VAL 43 -5.762 -15.020 -9.437 325 HG11 VAL 43 1HG1 VAL 43 -7.018 -13.667 -11.043 326 HG12 VAL 43 2HG1 VAL 43 -6.779 -15.334 -11.619 327 HG13 VAL 43 3HG1 VAL 43 -8.361 -14.833 -10.974 328 HG21 VAL 43 1HG2 VAL 43 -7.232 -13.208 -8.614 329 HG22 VAL 43 2HG2 VAL 43 -8.576 -14.367 -8.468 330 HG23 VAL 43 3HG2 VAL 43 -7.134 -14.541 -7.439 331 H SER 44 H SER 44 -4.807 -17.258 -9.745 332 HA SER 44 HA SER 44 -5.329 -19.379 -11.619 333 HB2 SER 44 1HB SER 44 -5.978 -17.512 -13.071 334 HB3 SER 44 2HB SER 44 -4.447 -16.708 -12.761 335 HG SER 44 HG SER 44 -3.473 -18.006 -14.039 336 H PHE 45 H PHE 45 -3.541 -20.586 -12.013 337 HA PHE 45 HA PHE 45 -0.914 -19.403 -11.226 338 HB2 PHE 45 1HB PHE 45 -1.486 -20.867 -9.415 339 HB3 PHE 45 2HB PHE 45 -2.058 -22.121 -10.505 340 HD1 PHE 45 HD1 PHE 45 1.028 -20.239 -9.578 341 HD2 PHE 45 HD2 PHE 45 -0.645 -23.848 -11.138 342 HE1 PHE 45 HE1 PHE 45 3.265 -21.291 -9.540 343 HE2 PHE 45 HE2 PHE 45 1.590 -24.904 -11.098 344 HZ PHE 45 HZ PHE 45 3.546 -23.623 -10.300 345 H ARG 46 H ARG 46 0.811 -19.869 -12.491 346 HA ARG 46 HA ARG 46 0.380 -21.828 -14.701 347 HB2 ARG 46 1HB ARG 46 1.681 -19.092 -14.919 348 HB3 ARG 46 2HB ARG 46 1.709 -20.315 -16.180 349 HG2 ARG 46 1HG ARG 46 -0.833 -19.111 -15.061 350 HG3 ARG 46 2HG ARG 46 0.016 -18.522 -16.511 351 HD2 ARG 46 1HD ARG 46 -0.240 -20.728 -17.529 352 HD3 ARG 46 2HD ARG 46 -1.142 -21.268 -16.095 353 HE ARG 46 HE ARG 46 -2.069 -19.494 -18.221 354 HH11 ARG 46 1HH1 ARG 46 -2.609 -20.746 -14.983 355 HH12 ARG 46 2HH1 ARG 46 -4.313 -20.353 -14.980 356 HH21 ARG 46 1HH2 ARG 46 -4.283 -18.989 -18.205 357 HH22 ARG 46 2HH2 ARG 46 -5.262 -19.358 -16.803 358 H LEU 47 H LEU 47 1.892 -23.331 -14.834 359 HA LEU 47 HA LEU 47 4.420 -22.910 -13.327 360 HB2 LEU 47 1HB LEU 47 3.173 -24.913 -12.732 361 HB3 LEU 47 2HB LEU 47 3.098 -25.416 -14.424 362 HG LEU 47 HG LEU 47 5.597 -25.668 -14.400 363 HD11 LEU 47 1HD1 LEU 47 6.727 -25.711 -12.221 364 HD12 LEU 47 2HD1 LEU 47 6.072 -24.098 -12.591 365 HD13 LEU 47 3HD1 LEU 47 5.230 -25.157 -11.434 366 HD21 LEU 47 1HD2 LEU 47 5.550 -27.756 -13.078 367 HD22 LEU 47 2HD2 LEU 47 4.036 -27.232 -12.302 368 HD23 LEU 47 3HD2 LEU 47 4.068 -27.579 -14.048 369 H VAL 48 H VAL 48 6.272 -22.548 -14.318 370 HA VAL 48 HA VAL 48 6.390 -22.562 -17.236 371 HB VAL 48 HB VAL 48 8.530 -22.012 -15.134 372 HG11 VAL 48 1HG1 VAL 48 9.800 -20.995 -16.962 373 HG12 VAL 48 2HG1 VAL 48 9.530 -22.734 -17.225 374 HG13 VAL 48 3HG1 VAL 48 8.564 -21.537 -18.121 375 HG21 VAL 48 1HG2 VAL 48 8.120 -19.646 -15.731 376 HG22 VAL 48 2HG2 VAL 48 6.830 -20.153 -16.848 377 HG23 VAL 48 3HG2 VAL 48 6.646 -20.414 -15.097 378 H TYR 49 H TYR 49 7.153 -24.096 -18.526 379 HA TYR 49 HA TYR 49 8.508 -26.427 -17.248 380 HB2 TYR 49 1HB TYR 49 6.934 -26.179 -19.840 381 HB3 TYR 49 2HB TYR 49 7.870 -27.604 -19.412 382 HD1 TYR 49 HD1 TYR 49 5.008 -25.480 -18.378 383 HD2 TYR 49 HD2 TYR 49 7.039 -29.231 -17.915 384 HE1 TYR 49 HE1 TYR 49 3.082 -26.367 -17.108 385 HE2 TYR 49 HE2 TYR 49 5.112 -30.118 -16.645 386 HH TYR 49 HH TYR 49 2.225 -28.126 -16.054 387 H ALA 50 H ALA 50 10.402 -27.251 -18.025 388 HA ALA 50 HA ALA 50 11.968 -25.410 -19.721 389 HB1 ALA 50 1HB ALA 50 13.884 -26.845 -19.099 390 HB2 ALA 50 2HB ALA 50 13.006 -26.259 -17.666 391 HB3 ALA 50 3HB ALA 50 12.778 -27.931 -18.228 392 H ARG 51 H ARG 51 11.698 -25.603 -21.829 393 HA ARG 51 HA ARG 51 10.593 -27.977 -23.012 394 HB2 ARG 51 1HB ARG 51 11.858 -25.502 -24.225 395 HB3 ARG 51 2HB ARG 51 11.134 -26.784 -25.183 396 HG2 ARG 51 1HG ARG 51 8.961 -26.374 -24.135 397 HG3 ARG 51 2HG ARG 51 9.685 -25.102 -23.122 398 HD2 ARG 51 1HD ARG 51 10.285 -23.858 -25.121 399 HD3 ARG 51 2HD ARG 51 9.549 -25.126 -26.128 400 HE ARG 51 HE ARG 51 7.595 -24.310 -24.310 401 HH11 ARG 51 1HH1 ARG 51 9.481 -22.892 -26.912 402 HH12 ARG 51 2HH1 ARG 51 8.245 -21.731 -27.343 403 HH21 ARG 51 1HH2 ARG 51 5.999 -22.798 -24.878 404 HH22 ARG 51 2HH2 ARG 51 6.274 -21.677 -26.193 405 H GLU 52 H GLU 52 13.817 -26.953 -22.309 406 HA GLU 52 HA GLU 52 15.214 -28.426 -24.324 407 HB2 GLU 52 1HB GLU 52 16.082 -27.664 -21.505 408 HB3 GLU 52 2HB GLU 52 17.155 -28.260 -22.764 409 HG2 GLU 52 1HG GLU 52 17.493 -25.997 -22.897 410 HG3 GLU 52 2HG GLU 52 16.273 -26.240 -24.146 411 H THR 53 H THR 53 13.566 -29.394 -21.434 412 HA THR 53 HA THR 53 14.721 -32.135 -21.742 413 HB THR 53 HB THR 53 14.373 -32.473 -19.321 414 HG1 THR 53 HG1 THR 53 13.349 -29.832 -19.506 415 HG21 THR 53 1HG2 THR 53 16.128 -30.954 -18.494 416 HG22 THR 53 2HG2 THR 53 16.550 -31.598 -20.098 417 HG23 THR 53 3HG2 THR 53 15.935 -29.937 -19.940 418 H GLY 54 H GLY 54 11.892 -30.137 -21.457 419 HA2 GLY 54 1HA GLY 54 9.682 -30.785 -22.035 420 HA3 GLY 54 2HA GLY 54 10.153 -32.472 -21.956 421 H LYS 55 H LYS 55 11.446 -31.004 -19.270 422 HA LYS 55 HA LYS 55 9.137 -31.905 -17.608 423 HB2 LYS 55 1HB LYS 55 12.064 -31.597 -16.830 424 HB3 LYS 55 2HB LYS 55 10.781 -32.211 -15.798 425 HG2 LYS 55 1HG LYS 55 11.723 -33.518 -18.368 426 HG3 LYS 55 2HG LYS 55 12.195 -34.000 -16.732 427 HD2 LYS 55 1HD LYS 55 9.787 -34.419 -16.200 428 HD3 LYS 55 2HD LYS 55 9.379 -34.033 -17.879 429 HE2 LYS 55 1HE LYS 55 10.861 -35.881 -18.642 430 HE3 LYS 55 2HE LYS 55 11.203 -36.285 -16.958 431 HZ1 LYS 55 1HZ LYS 55 9.480 -37.663 -17.863 432 HZ2 LYS 55 2HZ LYS 55 8.865 -36.729 -16.650 433 HZ3 LYS 55 3HZ LYS 55 8.546 -36.353 -18.224 434 HA PRO 56 HA PRO 56 8.247 -28.017 -15.923 435 HB2 PRO 56 1HB PRO 56 8.841 -29.242 -13.200 436 HB3 PRO 56 2HB PRO 56 7.434 -28.299 -13.710 437 HG2 PRO 56 1HG PRO 56 7.179 -30.940 -13.537 438 HG3 PRO 56 2HG PRO 56 6.486 -30.110 -14.933 439 HD2 PRO 56 1HD PRO 56 9.095 -31.664 -14.725 440 HD3 PRO 56 2HD PRO 56 7.868 -31.666 -16.055 441 H LYS 57 H LYS 57 9.383 -26.175 -15.498 442 HA LYS 57 HA LYS 57 12.259 -26.326 -15.221 443 HB2 LYS 57 1HB LYS 57 11.095 -24.530 -16.501 444 HB3 LYS 57 2HB LYS 57 10.403 -23.922 -15.004 445 HG2 LYS 57 1HG LYS 57 12.263 -22.540 -15.549 446 HG3 LYS 57 2HG LYS 57 12.742 -23.528 -14.162 447 HD2 LYS 57 1HD LYS 57 13.955 -25.066 -15.639 448 HD3 LYS 57 2HD LYS 57 13.420 -24.156 -17.059 449 HE2 LYS 57 1HE LYS 57 14.630 -22.166 -16.259 450 HE3 LYS 57 2HE LYS 57 15.137 -23.039 -14.811 451 HZ1 LYS 57 1HZ LYS 57 16.845 -23.025 -16.476 452 HZ2 LYS 57 2HZ LYS 57 16.327 -24.571 -16.223 453 HZ3 LYS 57 3HZ LYS 57 15.855 -23.754 -17.576 454 H GLY 58 H GLY 58 9.568 -25.730 -13.029 455 HA2 GLY 58 1HA GLY 58 9.835 -26.294 -10.671 456 HA3 GLY 58 2HA GLY 58 11.515 -25.800 -10.763 457 H TYR 59 H TYR 59 9.700 -23.648 -12.572 458 HA TYR 59 HA TYR 59 9.202 -21.860 -10.238 459 HB2 TYR 59 1HB TYR 59 10.599 -21.098 -12.835 460 HB3 TYR 59 2HB TYR 59 10.071 -19.952 -11.610 461 HD1 TYR 59 HD1 TYR 59 12.484 -22.600 -12.432 462 HD2 TYR 59 HD2 TYR 59 11.239 -19.719 -9.506 463 HE1 TYR 59 HE1 TYR 59 14.634 -22.876 -11.245 464 HE2 TYR 59 HE2 TYR 59 13.389 -19.995 -8.319 465 HH TYR 59 HH TYR 59 15.854 -22.280 -9.485 466 H GLY 60 H GLY 60 7.640 -20.223 -10.545 467 HA2 GLY 60 1HA GLY 60 6.174 -19.963 -13.026 468 HA3 GLY 60 2HA GLY 60 5.286 -20.952 -11.882 469 H PHE 61 H PHE 61 3.686 -19.209 -11.975 470 HA PHE 61 HA PHE 61 4.171 -17.358 -9.738 471 HB2 PHE 61 1HB PHE 61 3.418 -15.375 -10.944 472 HB3 PHE 61 2HB PHE 61 4.843 -16.039 -11.729 473 HD1 PHE 61 HD1 PHE 61 1.222 -15.516 -11.999 474 HD2 PHE 61 HD2 PHE 61 4.719 -17.029 -13.930 475 HE1 PHE 61 HE1 PHE 61 0.002 -15.589 -14.148 476 HE2 PHE 61 HE2 PHE 61 3.504 -17.101 -16.081 477 HZ PHE 61 HZ PHE 61 1.143 -16.382 -16.189 478 H CYS 62 H CYS 62 2.229 -16.426 -8.876 479 HA CYS 62 HA CYS 62 -0.250 -17.846 -9.701 480 HB2 CYS 62 1HB CYS 62 0.836 -19.202 -7.920 481 HB3 CYS 62 2HB CYS 62 0.841 -17.800 -6.860 482 HG CYS 62 HG CYS 62 -1.770 -17.476 -6.913 483 H GLU 63 H GLU 63 -1.974 -16.575 -9.707 484 HA GLU 63 HA GLU 63 -1.756 -13.919 -8.396 485 HB2 GLU 63 1HB GLU 63 -3.716 -15.004 -10.459 486 HB3 GLU 63 2HB GLU 63 -3.809 -13.394 -9.759 487 HG2 GLU 63 1HG GLU 63 -1.573 -12.879 -10.685 488 HG3 GLU 63 2HG GLU 63 -1.523 -14.481 -11.417 489 H TYR 64 H TYR 64 -2.963 -13.294 -6.726 490 HA TYR 64 HA TYR 64 -4.939 -15.286 -5.692 491 HB2 TYR 64 1HB TYR 64 -3.034 -13.414 -4.250 492 HB3 TYR 64 2HB TYR 64 -4.427 -14.122 -3.443 493 HD1 TYR 64 HD1 TYR 64 -1.172 -14.820 -5.020 494 HD2 TYR 64 HD2 TYR 64 -4.498 -16.456 -2.859 495 HE1 TYR 64 HE1 TYR 64 0.139 -16.861 -4.548 496 HE2 TYR 64 HE2 TYR 64 -3.187 -18.497 -2.387 497 HH TYR 64 HH TYR 64 -1.218 -19.505 -2.579 498 H GLN 65 H GLN 65 -6.625 -14.326 -4.250 499 HA GLN 65 HA GLN 65 -8.282 -12.640 -5.733 500 HB2 GLN 65 1HB GLN 65 -9.051 -14.031 -3.831 501 HB3 GLN 65 2HB GLN 65 -8.213 -12.972 -2.706 502 HG2 GLN 65 1HG GLN 65 -10.522 -12.411 -2.668 503 HG3 GLN 65 2HG GLN 65 -9.660 -11.088 -3.502 504 HE21 GLN 65 1HE2 GLN 65 -11.891 -11.207 -6.145 505 HE22 GLN 65 2HE2 GLN 65 -10.978 -10.281 -5.000 506 H ASP 66 H ASP 66 -6.132 -11.728 -3.025 507 HA ASP 66 HA ASP 66 -6.095 -8.958 -4.054 508 HB2 ASP 66 1HB ASP 66 -6.732 -7.978 -1.910 509 HB3 ASP 66 2HB ASP 66 -8.026 -9.012 -2.501 510 H GLN 67 H GLN 67 -4.818 -7.648 -2.106 511 HA GLN 67 HA GLN 67 -2.145 -8.641 -2.499 512 HB2 GLN 67 1HB GLN 67 -3.225 -6.376 -0.777 513 HB3 GLN 67 2HB GLN 67 -1.513 -6.699 -1.009 514 HG2 GLN 67 1HG GLN 67 -1.776 -6.338 -3.433 515 HG3 GLN 67 2HG GLN 67 -3.502 -5.965 -3.166 516 HE21 GLN 67 1HE2 GLN 67 -2.278 -2.636 -3.246 517 HE22 GLN 67 2HE2 GLN 67 -2.953 -3.909 -4.208 518 H GLU 68 H GLU 68 -4.411 -8.699 0.207 519 HA GLU 68 HA GLU 68 -2.456 -9.394 2.198 520 HB2 GLU 68 1HB GLU 68 -4.654 -8.391 2.751 521 HB3 GLU 68 2HB GLU 68 -5.470 -9.835 2.170 522 HG2 GLU 68 1HG GLU 68 -5.381 -9.868 4.569 523 HG3 GLU 68 2HG GLU 68 -4.373 -11.164 3.930 524 H THR 69 H THR 69 -4.624 -11.289 0.123 525 HA THR 69 HA THR 69 -3.895 -13.827 1.304 526 HB THR 69 HB THR 69 -4.946 -14.787 -0.786 527 HG1 THR 69 HG1 THR 69 -5.442 -12.037 -1.383 528 HG21 THR 69 1HG2 THR 69 -7.220 -13.998 -0.262 529 HG22 THR 69 2HG2 THR 69 -6.290 -14.293 1.227 530 HG23 THR 69 3HG2 THR 69 -6.540 -12.629 0.649 531 H ALA 70 H ALA 70 -2.647 -11.845 -1.329 532 HA ALA 70 HA ALA 70 -0.780 -13.815 -2.294 533 HB1 ALA 70 1HB ALA 70 0.336 -11.889 -3.373 534 HB2 ALA 70 2HB ALA 70 -1.423 -11.868 -3.643 535 HB3 ALA 70 3HB ALA 70 -0.694 -10.779 -2.440 536 H LEU 71 H LEU 71 -0.547 -11.163 0.073 537 HA LEU 71 HA LEU 71 2.214 -11.650 0.711 538 HB2 LEU 71 1HB LEU 71 -0.030 -10.289 2.236 539 HB3 LEU 71 2HB LEU 71 1.640 -10.344 2.808 540 HG LEU 71 HG LEU 71 0.760 -9.071 0.192 541 HD11 LEU 71 1HD1 LEU 71 1.107 -6.943 1.366 542 HD12 LEU 71 2HD1 LEU 71 -0.188 -7.905 2.118 543 HD13 LEU 71 3HD1 LEU 71 1.420 -7.828 2.878 544 HD21 LEU 71 1HD2 LEU 71 3.034 -8.105 0.255 545 HD22 LEU 71 2HD2 LEU 71 3.376 -9.006 1.752 546 HD23 LEU 71 3HD2 LEU 71 3.095 -9.884 0.230 547 H SER 72 H SER 72 -0.859 -12.852 2.005 548 HA SER 72 HA SER 72 0.190 -14.304 4.210 549 HB2 SER 72 1HB SER 72 -2.188 -14.873 2.412 550 HB3 SER 72 2HB SER 72 -1.853 -15.737 3.904 551 HG SER 72 HG SER 72 -2.569 -13.081 3.488 552 H ALA 73 H ALA 73 -0.279 -15.251 0.800 553 HA ALA 73 HA ALA 73 0.770 -17.871 1.005 554 HB1 ALA 73 1HB ALA 73 1.267 -17.650 -1.408 555 HB2 ALA 73 2HB ALA 73 -0.355 -17.036 -1.011 556 HB3 ALA 73 3HB ALA 73 0.981 -15.898 -1.299 557 H MET 74 H MET 74 2.443 -14.787 0.332 558 HA MET 74 HA MET 74 5.055 -15.834 0.098 559 HB2 MET 74 1HB MET 74 4.494 -13.512 -0.464 560 HB3 MET 74 2HB MET 74 4.123 -13.161 1.217 561 HG2 MET 74 1HG MET 74 6.509 -13.643 1.794 562 HG3 MET 74 2HG MET 74 6.844 -13.850 0.073 563 HE1 MET 74 1HE MET 74 5.678 -9.883 2.136 564 HE2 MET 74 2HE MET 74 4.565 -11.273 2.070 565 HE3 MET 74 3HE MET 74 6.090 -11.395 2.981 566 H ARG 75 H ARG 75 3.170 -15.007 2.980 567 HA ARG 75 HA ARG 75 5.520 -15.278 4.709 568 HB2 ARG 75 1HB ARG 75 2.585 -14.769 5.289 569 HB3 ARG 75 2HB ARG 75 3.815 -14.888 6.538 570 HG2 ARG 75 1HG ARG 75 4.961 -12.938 5.673 571 HG3 ARG 75 2HG ARG 75 3.837 -12.854 4.295 572 HD2 ARG 75 1HD ARG 75 3.023 -12.652 7.183 573 HD3 ARG 75 2HD ARG 75 3.334 -11.267 6.112 574 HE ARG 75 HE ARG 75 1.449 -13.056 4.928 575 HH11 ARG 75 1HH1 ARG 75 1.766 -10.617 7.436 576 HH12 ARG 75 2HH1 ARG 75 0.080 -10.154 7.375 577 HH21 ARG 75 1HH2 ARG 75 -0.738 -12.447 4.858 578 HH22 ARG 75 2HH2 ARG 75 -1.338 -11.190 5.916 579 H ASN 76 H ASN 76 2.830 -17.239 3.645 580 HA ASN 76 HA ASN 76 3.219 -19.106 5.926 581 HB2 ASN 76 1HB ASN 76 0.996 -18.780 3.892 582 HB3 ASN 76 2HB ASN 76 1.084 -20.140 5.003 583 HD21 ASN 76 1HD2 ASN 76 -1.055 -17.423 6.409 584 HD22 ASN 76 2HD2 ASN 76 -1.025 -18.289 4.909 585 H LEU 77 H LEU 77 2.972 -19.136 2.359 586 HA LEU 77 HA LEU 77 3.403 -21.994 2.246 587 HB2 LEU 77 1HB LEU 77 3.440 -19.825 0.122 588 HB3 LEU 77 2HB LEU 77 3.632 -21.545 -0.234 589 HG LEU 77 HG LEU 77 1.178 -20.270 1.027 590 HD11 LEU 77 1HD1 LEU 77 0.128 -20.754 -1.138 591 HD12 LEU 77 2HD1 LEU 77 1.491 -19.623 -1.307 592 HD13 LEU 77 3HD1 LEU 77 1.689 -21.332 -1.766 593 HD21 LEU 77 1HD2 LEU 77 0.177 -22.500 0.664 594 HD22 LEU 77 2HD2 LEU 77 1.739 -23.104 0.061 595 HD23 LEU 77 3HD2 LEU 77 1.576 -22.597 1.759 596 H ASN 78 H ASN 78 5.457 -19.161 2.112 597 HA ASN 78 HA ASN 78 7.673 -20.414 0.772 598 HB2 ASN 78 1HB ASN 78 7.303 -17.945 0.942 599 HB3 ASN 78 2HB ASN 78 7.700 -18.031 2.653 600 HD21 ASN 78 1HD2 ASN 78 10.633 -17.275 0.280 601 HD22 ASN 78 2HD2 ASN 78 8.972 -16.796 0.169 602 H GLY 79 H GLY 79 8.586 -22.183 1.513 603 HA2 GLY 79 1HA GLY 79 10.424 -22.854 3.059 604 HA3 GLY 79 2HA GLY 79 9.489 -22.164 4.372 605 H ARG 80 H ARG 80 7.049 -23.329 2.733 606 HA ARG 80 HA ARG 80 6.827 -25.699 4.395 607 HB2 ARG 80 1HB ARG 80 5.062 -24.467 2.265 608 HB3 ARG 80 2HB ARG 80 4.659 -25.987 3.049 609 HG2 ARG 80 1HG ARG 80 4.693 -24.820 5.249 610 HG3 ARG 80 2HG ARG 80 4.969 -23.289 4.384 611 HD2 ARG 80 1HD ARG 80 2.653 -23.495 4.864 612 HD3 ARG 80 2HD ARG 80 2.888 -23.712 3.115 613 HE ARG 80 HE ARG 80 2.925 -26.232 4.454 614 HH11 ARG 80 1HH1 ARG 80 0.751 -23.677 3.412 615 HH12 ARG 80 2HH1 ARG 80 -0.629 -24.741 3.259 616 HH21 ARG 80 1HH2 ARG 80 1.127 -27.604 4.252 617 HH22 ARG 80 2HH2 ARG 80 -0.417 -26.965 3.734 618 H GLU 81 H GLU 81 7.545 -27.653 3.956 619 HA GLU 81 HA GLU 81 8.624 -28.362 1.378 620 HB2 GLU 81 1HB GLU 81 9.433 -29.325 3.531 621 HB3 GLU 81 2HB GLU 81 7.892 -30.144 3.738 622 HG2 GLU 81 1HG GLU 81 8.296 -31.455 1.706 623 HG3 GLU 81 2HG GLU 81 9.825 -30.613 1.457 624 H PHE 82 H PHE 82 7.665 -29.116 -0.365 625 HA PHE 82 HA PHE 82 5.127 -30.641 -0.024 626 HB2 PHE 82 1HB PHE 82 4.572 -28.341 -0.777 627 HB3 PHE 82 2HB PHE 82 5.649 -28.526 -2.152 628 HD1 PHE 82 HD1 PHE 82 3.054 -30.765 -0.638 629 HD2 PHE 82 HD2 PHE 82 4.431 -28.659 -4.091 630 HE1 PHE 82 HE1 PHE 82 1.200 -31.725 -1.961 631 HE2 PHE 82 HE2 PHE 82 2.576 -29.616 -5.417 632 HZ PHE 82 HZ PHE 82 0.961 -31.151 -4.350 633 H SER 83 H SER 83 5.348 -32.607 -0.792 634 HA SER 83 HA SER 83 6.196 -34.405 -1.957 635 HB2 SER 83 1HB SER 83 6.382 -32.332 -4.169 636 HB3 SER 83 2HB SER 83 6.488 -34.071 -4.398 637 HG SER 83 HG SER 83 4.454 -34.106 -4.413 638 H GLY 84 H GLY 84 8.076 -32.785 -0.425 639 HA2 GLY 84 1HA GLY 84 10.292 -33.429 0.081 640 HA3 GLY 84 2HA GLY 84 10.450 -34.142 -1.513 641 H ARG 85 H ARG 85 9.080 -31.013 -1.577 642 HA ARG 85 HA ARG 85 11.739 -29.709 -1.881 643 HB2 ARG 85 1HB ARG 85 9.439 -29.559 -3.857 644 HB3 ARG 85 2HB ARG 85 10.814 -28.465 -3.867 645 HG2 ARG 85 1HG ARG 85 11.064 -31.468 -4.151 646 HG3 ARG 85 2HG ARG 85 10.944 -30.331 -5.516 647 HD2 ARG 85 1HD ARG 85 12.943 -29.181 -4.695 648 HD3 ARG 85 2HD ARG 85 13.077 -30.387 -3.394 649 HE ARG 85 HE ARG 85 13.684 -30.747 -6.228 650 HH11 ARG 85 1HH1 ARG 85 13.092 -32.280 -3.123 651 HH12 ARG 85 2HH1 ARG 85 13.901 -33.767 -3.562 652 HH21 ARG 85 1HH2 ARG 85 14.733 -32.682 -6.786 653 HH22 ARG 85 2HH2 ARG 85 14.830 -33.996 -5.635 654 H ALA 86 H ALA 86 11.822 -28.122 -0.461 655 HA ALA 86 HA ALA 86 9.517 -26.849 0.669 656 HB1 ALA 86 1HB ALA 86 11.143 -25.234 1.600 657 HB2 ALA 86 2HB ALA 86 11.679 -26.916 1.829 658 HB3 ALA 86 3HB ALA 86 12.408 -25.915 0.552 659 H LEU 87 H LEU 87 8.158 -25.518 -0.257 660 HA LEU 87 HA LEU 87 8.772 -24.364 -2.850 661 HB2 LEU 87 1HB LEU 87 6.380 -24.037 -1.005 662 HB3 LEU 87 2HB LEU 87 6.475 -23.392 -2.646 663 HG LEU 87 HG LEU 87 6.584 -26.343 -1.927 664 HD11 LEU 87 1HD1 LEU 87 4.312 -26.410 -2.854 665 HD12 LEU 87 2HD1 LEU 87 4.409 -25.353 -1.426 666 HD13 LEU 87 3HD1 LEU 87 4.343 -24.642 -3.057 667 HD21 LEU 87 1HD2 LEU 87 6.303 -26.644 -4.364 668 HD22 LEU 87 2HD2 LEU 87 6.362 -24.879 -4.590 669 HD23 LEU 87 3HD2 LEU 87 7.798 -25.749 -3.998 670 H ARG 88 H ARG 88 9.325 -22.343 -3.390 671 HA ARG 88 HA ARG 88 9.562 -20.359 -1.175 672 HB2 ARG 88 1HB ARG 88 11.663 -20.801 -2.328 673 HB3 ARG 88 2HB ARG 88 10.919 -20.490 -3.889 674 HG2 ARG 88 1HG ARG 88 10.551 -18.133 -3.231 675 HG3 ARG 88 2HG ARG 88 11.369 -18.463 -1.684 676 HD2 ARG 88 1HD ARG 88 13.400 -18.991 -2.803 677 HD3 ARG 88 2HD ARG 88 12.606 -18.888 -4.391 678 HE ARG 88 HE ARG 88 12.318 -16.442 -2.934 679 HH11 ARG 88 1HH1 ARG 88 14.625 -18.331 -4.792 680 HH12 ARG 88 2HH1 ARG 88 15.550 -16.935 -5.298 681 HH21 ARG 88 1HH2 ARG 88 13.527 -14.638 -3.597 682 HH22 ARG 88 2HH2 ARG 88 14.930 -14.844 -4.622 683 H VAL 89 H VAL 89 8.057 -18.862 -1.049 684 HA VAL 89 HA VAL 89 6.803 -17.923 -3.596 685 HB VAL 89 HB VAL 89 5.507 -18.145 -0.845 686 HG11 VAL 89 1HG1 VAL 89 3.454 -17.455 -1.983 687 HG12 VAL 89 2HG1 VAL 89 4.714 -16.200 -2.062 688 HG13 VAL 89 3HG1 VAL 89 4.371 -17.210 -3.488 689 HG21 VAL 89 1HG2 VAL 89 4.087 -19.854 -1.935 690 HG22 VAL 89 2HG2 VAL 89 5.031 -19.681 -3.433 691 HG23 VAL 89 3HG2 VAL 89 5.801 -20.328 -1.965 692 H ASP 90 H ASP 90 7.583 -15.978 -4.050 693 HA ASP 90 HA ASP 90 7.611 -13.984 -1.822 694 HB2 ASP 90 1HB ASP 90 9.334 -14.026 -4.333 695 HB3 ASP 90 2HB ASP 90 9.320 -12.738 -3.137 696 H ASN 91 H ASN 91 6.805 -11.929 -2.218 697 HA ASN 91 HA ASN 91 4.558 -11.793 -3.968 698 HB2 ASN 91 1HB ASN 91 4.969 -10.427 -1.865 699 HB3 ASN 91 2HB ASN 91 6.072 -9.436 -2.811 700 HD21 ASN 91 1HD2 ASN 91 2.091 -8.888 -3.019 701 HD22 ASN 91 2HD2 ASN 91 2.836 -10.043 -1.965 702 H ALA 92 H ALA 92 4.198 -10.941 -5.942 703 HA ALA 92 HA ALA 92 6.460 -11.265 -7.692 704 HB1 ALA 92 1HB ALA 92 4.841 -10.774 -9.496 705 HB2 ALA 92 2HB ALA 92 4.202 -11.971 -8.345 706 HB3 ALA 92 3HB ALA 92 3.643 -10.283 -8.277 707 H ALA 93 H ALA 93 5.229 -8.592 -5.992 708 HA ALA 93 HA ALA 93 5.997 -6.523 -7.845 709 HB1 ALA 93 1HB ALA 93 5.811 -5.023 -5.886 710 HB2 ALA 93 2HB ALA 93 4.404 -6.105 -6.025 711 HB3 ALA 93 3HB ALA 93 5.671 -6.443 -4.823 712 H SER 94 H SER 94 7.774 -8.653 -5.863 713 HA SER 94 HA SER 94 10.019 -7.012 -5.222 714 HB2 SER 94 1HB SER 94 9.743 -9.123 -4.120 715 HB3 SER 94 2HB SER 94 9.711 -9.995 -5.645 716 HG SER 94 HG SER 94 11.704 -10.218 -4.919 717 H GLU 95 H GLU 95 11.393 -6.028 -6.506 718 HA GLU 95 HA GLU 95 11.572 -6.634 -9.328 719 HB2 GLU 95 1HB GLU 95 13.272 -4.867 -7.524 720 HB3 GLU 95 2HB GLU 95 13.455 -4.957 -9.270 721 HG2 GLU 95 1HG GLU 95 10.969 -4.052 -7.800 722 HG3 GLU 95 2HG GLU 95 12.162 -3.004 -8.564 723 H LYS 96 H LYS 96 13.405 -7.526 -6.467 724 HA LYS 96 HA LYS 96 15.717 -8.544 -7.809 725 HB2 LYS 96 1HB LYS 96 14.441 -9.241 -5.139 726 HB3 LYS 96 2HB LYS 96 15.956 -9.943 -5.687 727 HG2 LYS 96 1HG LYS 96 16.973 -7.701 -5.788 728 HG3 LYS 96 2HG LYS 96 15.445 -6.985 -5.255 729 HD2 LYS 96 1HD LYS 96 15.569 -8.289 -3.153 730 HD3 LYS 96 2HD LYS 96 17.102 -8.995 -3.685 731 HE2 LYS 96 1HE LYS 96 18.128 -6.756 -3.746 732 HE3 LYS 96 2HE LYS 96 16.596 -6.027 -3.258 733 HZ1 LYS 96 1HZ LYS 96 18.068 -6.312 -1.403 734 HZ2 LYS 96 2HZ LYS 96 16.732 -7.258 -1.203 735 HZ3 LYS 96 3HZ LYS 96 18.164 -7.938 -1.658 736 H ASN 97 H ASN 97 12.590 -9.995 -6.980 737 HA ASN 97 HA ASN 97 13.317 -12.638 -7.906 738 HB2 ASN 97 1HB ASN 97 10.673 -11.276 -7.344 739 HB3 ASN 97 2HB ASN 97 10.765 -12.918 -7.966 740 HD21 ASN 97 1HD2 ASN 97 11.689 -14.384 -4.945 741 HD22 ASN 97 2HD2 ASN 97 11.451 -14.576 -6.650 742 H LYS 98 H LYS 98 11.929 -9.774 -9.423 743 HA LYS 98 HA LYS 98 11.338 -10.966 -11.950 744 HB2 LYS 98 1HB LYS 98 12.156 -8.140 -11.182 745 HB3 LYS 98 2HB LYS 98 11.705 -8.597 -12.819 746 HG2 LYS 98 1HG LYS 98 9.470 -9.264 -12.032 747 HG3 LYS 98 2HG LYS 98 9.922 -8.832 -10.377 748 HD2 LYS 98 1HD LYS 98 10.362 -6.491 -11.154 749 HD3 LYS 98 2HD LYS 98 9.780 -6.951 -12.761 750 HE2 LYS 98 1HE LYS 98 7.582 -7.531 -11.821 751 HE3 LYS 98 2HE LYS 98 8.154 -7.137 -10.198 752 HZ1 LYS 98 1HZ LYS 98 6.917 -5.338 -11.158 753 HZ2 LYS 98 2HZ LYS 98 8.483 -4.874 -10.926 754 HZ3 LYS 98 3HZ LYS 98 7.948 -5.242 -12.442 755 H GLU 99 H GLU 99 14.329 -9.643 -10.579 756 HA GLU 99 HA GLU 99 15.877 -9.891 -12.984 757 HB2 GLU 99 1HB GLU 99 16.673 -9.827 -10.048 758 HB3 GLU 99 2HB GLU 99 17.838 -9.845 -11.365 759 HG2 GLU 99 1HG GLU 99 15.741 -7.714 -10.895 760 HG3 GLU 99 2HG GLU 99 17.449 -7.594 -10.481 761 H GLU 100 H GLU 100 15.167 -12.097 -10.302 762 HA GLU 100 HA GLU 100 16.859 -14.234 -11.132 763 HB2 GLU 100 1HB GLU 100 14.203 -14.201 -9.654 764 HB3 GLU 100 2HB GLU 100 15.120 -15.675 -9.932 765 HG2 GLU 100 1HG GLU 100 17.005 -14.777 -8.666 766 HG3 GLU 100 2HG GLU 100 16.151 -13.253 -8.440 767 H LEU 101 H LEU 101 13.521 -13.375 -12.032 768 HA LEU 101 HA LEU 101 13.053 -15.616 -13.725 769 HB2 LEU 101 1HB LEU 101 11.949 -12.790 -13.752 770 HB3 LEU 101 2HB LEU 101 11.368 -14.066 -14.826 771 HG LEU 101 HG LEU 101 11.259 -14.191 -11.792 772 HD11 LEU 101 1HD1 LEU 101 8.862 -13.748 -12.079 773 HD12 LEU 101 2HD1 LEU 101 9.856 -12.393 -12.663 774 HD13 LEU 101 3HD1 LEU 101 9.114 -13.518 -13.825 775 HD21 LEU 101 1HD2 LEU 101 9.744 -16.093 -12.234 776 HD22 LEU 101 2HD2 LEU 101 10.007 -15.897 -13.983 777 HD23 LEU 101 3HD2 LEU 101 11.356 -16.385 -12.929 778 H LYS 102 H LYS 102 14.606 -12.487 -14.297 779 HA LYS 102 HA LYS 102 14.874 -12.734 -17.127 780 HB2 LYS 102 1HB LYS 102 16.540 -11.270 -15.048 781 HB3 LYS 102 2HB LYS 102 16.851 -11.156 -16.775 782 HG2 LYS 102 1HG LYS 102 14.611 -10.216 -17.139 783 HG3 LYS 102 2HG LYS 102 14.261 -10.364 -15.410 784 HD2 LYS 102 1HD LYS 102 16.187 -8.855 -14.920 785 HD3 LYS 102 2HD LYS 102 16.452 -8.665 -16.660 786 HE2 LYS 102 1HE LYS 102 14.205 -7.698 -16.916 787 HE3 LYS 102 2HE LYS 102 13.888 -7.936 -15.196 788 HZ1 LYS 102 1HZ LYS 102 14.559 -5.696 -15.668 789 HZ2 LYS 102 2HZ LYS 102 15.690 -6.427 -14.714 790 HZ3 LYS 102 3HZ LYS 102 15.986 -6.204 -16.321 791 H SER 103 H SER 103 16.932 -13.826 -14.443 792 HA SER 103 HA SER 103 18.991 -14.879 -16.184 793 HB2 SER 103 1HB SER 103 19.934 -15.821 -14.190 794 HB3 SER 103 2HB SER 103 19.330 -14.220 -13.791 795 HG SER 103 HG SER 103 17.314 -15.615 -13.344 796 H LEU 104 H LEU 104 15.988 -16.102 -14.850 797 HA LEU 104 HA LEU 104 16.483 -18.858 -15.617 798 HB2 LEU 104 1HB LEU 104 13.952 -17.323 -14.946 799 HB3 LEU 104 2HB LEU 104 13.972 -19.049 -15.324 800 HG LEU 104 HG LEU 104 15.483 -17.793 -13.006 801 HD11 LEU 104 1HD1 LEU 104 13.697 -18.730 -11.608 802 HD12 LEU 104 2HD1 LEU 104 13.072 -17.507 -12.739 803 HD13 LEU 104 3HD1 LEU 104 12.818 -19.238 -13.069 804 HD21 LEU 104 1HD2 LEU 104 15.664 -20.144 -12.266 805 HD22 LEU 104 2HD2 LEU 104 14.813 -20.673 -13.737 806 HD23 LEU 104 3HD2 LEU 104 16.418 -19.915 -13.862 807 H GLY 105 H GLY 105 15.173 -15.991 -17.165 808 HA2 GLY 105 1HA GLY 105 14.966 -15.631 -19.482 809 HA3 GLY 105 2HA GLY 105 15.317 -17.324 -19.775 810 H THR 106 H THR 106 12.832 -15.975 -17.609 811 HA THR 106 HA THR 106 10.696 -16.760 -19.490 812 HB THR 106 HB THR 106 11.183 -18.835 -18.181 813 HG1 THR 106 HG1 THR 106 8.705 -17.712 -17.349 814 HG21 THR 106 1HG2 THR 106 10.631 -18.875 -15.781 815 HG22 THR 106 2HG2 THR 106 11.973 -17.752 -16.106 816 HG23 THR 106 3HG2 THR 106 10.335 -17.121 -15.815 817 H GLY 107 H GLY 107 8.626 -15.946 -18.953 818 HA2 GLY 107 1HA GLY 107 7.947 -14.467 -16.656 819 HA3 GLY 107 2HA GLY 107 8.713 -13.328 -17.747 Start of MODEL 10 1 H MET 1 1H MET 1 5.191 -7.055 -1.498 2 HA MET 1 HA MET 1 3.348 -5.570 -1.573 3 HB2 MET 1 1HB MET 1 3.164 -7.712 -0.351 4 HB3 MET 1 2HB MET 1 3.793 -6.953 1.104 5 HG2 MET 1 1HG MET 1 1.400 -7.164 1.276 6 HG3 MET 1 2HG MET 1 1.816 -5.453 1.154 7 HE1 MET 1 1HE MET 1 -0.102 -7.989 -2.203 8 HE2 MET 1 2HE MET 1 1.548 -8.300 -1.606 9 HE3 MET 1 3HE MET 1 0.150 -8.539 -0.528 10 H ALA 2 H ALA 2 3.300 -3.435 -1.575 11 HA ALA 2 HA ALA 2 4.541 -1.837 0.481 12 HB1 ALA 2 1HB ALA 2 3.432 0.061 -0.654 13 HB2 ALA 2 2HB ALA 2 4.265 -1.004 -1.812 14 HB3 ALA 2 3HB ALA 2 2.497 -1.087 -1.641 15 H GLY 3 H GLY 3 1.207 -2.856 -0.195 16 HA2 GLY 3 1HA GLY 3 -0.587 -3.020 1.300 17 HA3 GLY 3 2HA GLY 3 0.452 -2.451 2.593 18 H LEU 4 H LEU 4 0.329 -0.614 -0.363 19 HA LEU 4 HA LEU 4 -1.109 1.535 1.124 20 HB2 LEU 4 1HB LEU 4 0.750 1.762 -1.269 21 HB3 LEU 4 2HB LEU 4 0.022 3.104 -0.383 22 HG LEU 4 HG LEU 4 2.047 1.144 0.755 23 HD11 LEU 4 1HD1 LEU 4 3.582 3.056 0.653 24 HD12 LEU 4 2HD1 LEU 4 3.002 2.592 -0.963 25 HD13 LEU 4 3HD1 LEU 4 2.324 4.024 -0.150 26 HD21 LEU 4 1HD2 LEU 4 2.095 2.731 2.649 27 HD22 LEU 4 2HD2 LEU 4 0.815 3.696 1.873 28 HD23 LEU 4 3HD2 LEU 4 0.467 2.041 2.433 29 H THR 5 H THR 5 -2.293 3.106 -0.322 30 HA THR 5 HA THR 5 -4.325 1.742 -1.794 31 HB THR 5 HB THR 5 -3.562 4.694 -1.851 32 HG1 THR 5 HG1 THR 5 -5.520 4.643 -0.393 33 HG21 THR 5 1HG2 THR 5 -5.880 5.031 -2.612 34 HG22 THR 5 2HG2 THR 5 -4.972 4.026 -3.767 35 HG23 THR 5 3HG2 THR 5 -6.130 3.271 -2.647 36 H VAL 6 H VAL 6 -4.502 1.113 -3.826 37 HA VAL 6 HA VAL 6 -2.285 1.892 -5.675 38 HB VAL 6 HB VAL 6 -3.945 -0.666 -5.619 39 HG11 VAL 6 1HG1 VAL 6 -2.418 -1.456 -7.358 40 HG12 VAL 6 2HG1 VAL 6 -3.349 -0.035 -7.886 41 HG13 VAL 6 3HG1 VAL 6 -1.644 0.145 -7.407 42 HG21 VAL 6 1HG2 VAL 6 -1.807 -1.730 -4.969 43 HG22 VAL 6 2HG2 VAL 6 -1.023 -0.132 -4.941 44 HG23 VAL 6 3HG2 VAL 6 -2.311 -0.513 -3.772 45 H ARG 7 H ARG 7 -2.873 3.201 -7.252 46 HA ARG 7 HA ARG 7 -5.690 3.151 -8.194 47 HB2 ARG 7 1HB ARG 7 -3.428 5.112 -8.701 48 HB3 ARG 7 2HB ARG 7 -5.024 5.235 -9.425 49 HG2 ARG 7 1HG ARG 7 -6.029 5.483 -7.196 50 HG3 ARG 7 2HG ARG 7 -4.411 5.359 -6.462 51 HD2 ARG 7 1HD ARG 7 -3.707 7.336 -7.677 52 HD3 ARG 7 2HD ARG 7 -5.321 7.459 -8.416 53 HE ARG 7 HE ARG 7 -5.642 7.379 -5.621 54 HH11 ARG 7 1HH1 ARG 7 -4.295 9.483 -8.091 55 HH12 ARG 7 2HH1 ARG 7 -4.588 10.947 -7.182 56 HH21 ARG 7 1HH2 ARG 7 -6.017 9.288 -4.449 57 HH22 ARG 7 2HH2 ARG 7 -5.563 10.839 -5.120 58 H ASP 8 H ASP 8 -2.649 1.895 -8.970 59 HA ASP 8 HA ASP 8 -3.286 1.782 -11.876 60 HB2 ASP 8 1HB ASP 8 -1.029 2.622 -11.209 61 HB3 ASP 8 2HB ASP 8 -0.702 1.083 -10.424 62 HA PRO 9 HA PRO 9 -4.919 -2.253 -11.032 63 HB2 PRO 9 1HB PRO 9 -4.680 -2.256 -14.071 64 HB3 PRO 9 2HB PRO 9 -6.017 -2.827 -13.064 65 HG2 PRO 9 1HG PRO 9 -6.258 -0.453 -14.235 66 HG3 PRO 9 2HG PRO 9 -6.756 -0.619 -12.548 67 HD2 PRO 9 1HD PRO 9 -4.193 0.556 -13.685 68 HD3 PRO 9 2HD PRO 9 -5.207 1.145 -12.306 69 H ALA 10 H ALA 10 -2.247 -1.468 -13.249 70 HA ALA 10 HA ALA 10 -1.246 -4.116 -13.569 71 HB1 ALA 10 1HB ALA 10 0.845 -3.011 -14.294 72 HB2 ALA 10 2HB ALA 10 -0.588 -2.265 -15.040 73 HB3 ALA 10 3HB ALA 10 0.228 -1.460 -13.681 74 H VAL 11 H VAL 11 -0.488 -1.570 -11.202 75 HA VAL 11 HA VAL 11 1.523 -3.060 -9.811 76 HB VAL 11 HB VAL 11 -0.339 -0.831 -8.889 77 HG11 VAL 11 1HG1 VAL 11 1.188 -0.539 -6.999 78 HG12 VAL 11 2HG1 VAL 11 0.385 -2.126 -6.968 79 HG13 VAL 11 3HG1 VAL 11 2.080 -1.996 -7.495 80 HG21 VAL 11 1HG2 VAL 11 1.688 0.561 -9.166 81 HG22 VAL 11 2HG2 VAL 11 2.589 -0.866 -9.733 82 HG23 VAL 11 3HG2 VAL 11 1.235 -0.227 -10.696 83 H ASP 12 H ASP 12 -1.995 -2.701 -9.319 84 HA ASP 12 HA ASP 12 -2.249 -4.253 -6.983 85 HB2 ASP 12 1HB ASP 12 -4.104 -2.953 -7.953 86 HB3 ASP 12 2HB ASP 12 -4.160 -4.027 -9.343 87 H ARG 13 H ARG 13 -2.184 -5.280 -10.394 88 HA ARG 13 HA ARG 13 -2.668 -8.045 -9.906 89 HB2 ARG 13 1HB ARG 13 -1.204 -6.606 -12.136 90 HB3 ARG 13 2HB ARG 13 -1.467 -8.344 -12.134 91 HG2 ARG 13 1HG ARG 13 -3.869 -8.037 -12.182 92 HG3 ARG 13 2HG ARG 13 -3.675 -6.274 -12.033 93 HD2 ARG 13 1HD ARG 13 -2.502 -6.219 -14.152 94 HD3 ARG 13 2HD ARG 13 -2.673 -7.983 -14.298 95 HE ARG 13 HE ARG 13 -5.244 -7.039 -13.940 96 HH11 ARG 13 1HH1 ARG 13 -2.646 -6.471 -16.235 97 HH12 ARG 13 2HH1 ARG 13 -3.727 -6.112 -17.562 98 HH21 ARG 13 1HH2 ARG 13 -6.638 -6.571 -15.670 99 HH22 ARG 13 2HH2 ARG 13 -5.988 -6.168 -17.243 100 H SER 14 H SER 14 0.338 -6.144 -10.053 101 HA SER 14 HA SER 14 2.072 -8.439 -9.864 102 HB2 SER 14 1HB SER 14 3.845 -6.849 -9.596 103 HB3 SER 14 2HB SER 14 2.719 -6.194 -10.776 104 HG SER 14 HG SER 14 1.759 -5.289 -8.669 105 H LEU 15 H LEU 15 0.395 -6.439 -7.538 106 HA LEU 15 HA LEU 15 1.957 -7.365 -5.261 107 HB2 LEU 15 1HB LEU 15 -0.694 -5.911 -5.509 108 HB3 LEU 15 2HB LEU 15 0.032 -6.339 -3.957 109 HG LEU 15 HG LEU 15 1.302 -4.515 -6.031 110 HD11 LEU 15 1HD1 LEU 15 0.738 -2.722 -4.451 111 HD12 LEU 15 2HD1 LEU 15 -0.718 -3.543 -5.061 112 HD13 LEU 15 3HD1 LEU 15 -0.115 -3.897 -3.424 113 HD21 LEU 15 1HD2 LEU 15 2.877 -4.011 -4.194 114 HD22 LEU 15 2HD2 LEU 15 2.054 -5.203 -3.160 115 HD23 LEU 15 3HD2 LEU 15 2.922 -5.739 -4.619 116 H ARG 16 H ARG 16 -1.153 -8.195 -6.764 117 HA ARG 16 HA ARG 16 -1.790 -10.200 -4.757 118 HB2 ARG 16 1HB ARG 16 -2.928 -9.548 -7.488 119 HB3 ARG 16 2HB ARG 16 -3.510 -10.897 -6.524 120 HG2 ARG 16 1HG ARG 16 -4.040 -9.264 -4.688 121 HG3 ARG 16 2HG ARG 16 -3.633 -7.957 -5.827 122 HD2 ARG 16 1HD ARG 16 -5.629 -10.090 -6.493 123 HD3 ARG 16 2HD ARG 16 -6.069 -8.614 -5.602 124 HE ARG 16 HE ARG 16 -5.468 -7.312 -7.521 125 HH11 ARG 16 1HH1 ARG 16 -5.491 -10.785 -8.053 126 HH12 ARG 16 2HH1 ARG 16 -5.631 -10.644 -9.791 127 HH21 ARG 16 1HH2 ARG 16 -5.649 -7.142 -9.778 128 HH22 ARG 16 2HH2 ARG 16 -5.720 -8.583 -10.768 129 H SER 17 H SER 17 0.045 -10.099 -7.712 130 HA SER 17 HA SER 17 0.155 -13.024 -7.950 131 HB2 SER 17 1HB SER 17 0.272 -11.688 -9.975 132 HB3 SER 17 2HB SER 17 1.645 -10.784 -9.353 133 HG SER 17 HG SER 17 2.917 -12.372 -9.750 134 H VAL 18 H VAL 18 1.732 -14.359 -7.274 135 HA VAL 18 HA VAL 18 4.105 -13.098 -5.962 136 HB VAL 18 HB VAL 18 4.167 -15.032 -4.422 137 HG11 VAL 18 1HG1 VAL 18 2.214 -14.454 -3.065 138 HG12 VAL 18 2HG1 VAL 18 3.020 -13.010 -3.723 139 HG13 VAL 18 3HG1 VAL 18 1.504 -13.596 -4.453 140 HG21 VAL 18 1HG2 VAL 18 2.240 -16.584 -4.338 141 HG22 VAL 18 2HG2 VAL 18 1.540 -15.789 -5.768 142 HG23 VAL 18 3HG2 VAL 18 3.075 -16.679 -5.906 143 H PHE 19 H PHE 19 6.102 -14.087 -6.237 144 HA PHE 19 HA PHE 19 6.344 -15.683 -8.684 145 HB2 PHE 19 1HB PHE 19 7.949 -13.862 -8.192 146 HB3 PHE 19 2HB PHE 19 8.454 -14.687 -6.726 147 HD1 PHE 19 HD1 PHE 19 8.129 -15.326 -10.398 148 HD2 PHE 19 HD2 PHE 19 10.326 -16.025 -6.802 149 HE1 PHE 19 HE1 PHE 19 9.840 -16.563 -11.685 150 HE2 PHE 19 HE2 PHE 19 12.040 -17.260 -8.086 151 HZ PHE 19 HZ PHE 19 11.795 -17.531 -10.528 152 H VAL 20 H VAL 20 6.529 -17.805 -8.831 153 HA VAL 20 HA VAL 20 6.780 -19.316 -6.267 154 HB VAL 20 HB VAL 20 5.474 -20.160 -8.890 155 HG11 VAL 20 1HG1 VAL 20 4.634 -22.068 -7.609 156 HG12 VAL 20 2HG1 VAL 20 6.413 -22.045 -7.683 157 HG13 VAL 20 3HG1 VAL 20 5.575 -21.534 -6.197 158 HG21 VAL 20 1HG2 VAL 20 3.360 -19.940 -7.623 159 HG22 VAL 20 2HG2 VAL 20 4.267 -19.336 -6.218 160 HG23 VAL 20 3HG2 VAL 20 4.217 -18.384 -7.720 161 H GLY 21 H GLY 21 8.573 -20.426 -5.958 162 HA2 GLY 21 1HA GLY 21 9.929 -21.641 -8.329 163 HA3 GLY 21 2HA GLY 21 10.865 -20.708 -7.177 164 H ASN 22 H ASN 22 11.822 -23.091 -7.374 165 HA ASN 22 HA ASN 22 12.209 -25.137 -6.380 166 HB2 ASN 22 1HB ASN 22 11.117 -23.584 -4.013 167 HB3 ASN 22 2HB ASN 22 11.864 -25.171 -3.881 168 HD21 ASN 22 1HD2 ASN 22 14.304 -22.335 -3.330 169 HD22 ASN 22 2HD2 ASN 22 12.700 -22.624 -2.745 170 H ILE 23 H ILE 23 9.922 -25.155 -7.866 171 HA ILE 23 HA ILE 23 7.705 -26.245 -6.342 172 HB ILE 23 HB ILE 23 8.293 -26.243 -9.333 173 HG12 ILE 23 1HG1 ILE 23 6.337 -24.562 -7.754 174 HG13 ILE 23 2HG1 ILE 23 7.956 -24.029 -8.180 175 HG21 ILE 23 1HG2 ILE 23 5.921 -26.845 -9.598 176 HG22 ILE 23 2HG2 ILE 23 6.807 -28.111 -8.716 177 HG23 ILE 23 3HG2 ILE 23 5.754 -26.982 -7.831 178 HD11 ILE 23 1HD1 ILE 23 6.307 -23.165 -9.745 179 HD12 ILE 23 2HD1 ILE 23 7.425 -24.281 -10.566 180 HD13 ILE 23 3HD1 ILE 23 5.784 -24.820 -10.135 181 HA PRO 24 HA PRO 24 9.373 -30.270 -5.767 182 HB2 PRO 24 1HB PRO 24 6.404 -30.871 -5.493 183 HB3 PRO 24 2HB PRO 24 7.738 -31.366 -4.445 184 HG2 PRO 24 1HG PRO 24 6.194 -29.348 -3.652 185 HG3 PRO 24 2HG PRO 24 7.943 -29.212 -3.450 186 HD2 PRO 24 1HD PRO 24 6.162 -28.010 -5.606 187 HD3 PRO 24 2HD PRO 24 7.541 -27.253 -4.712 188 H TYR 25 H TYR 25 9.699 -31.994 -7.113 189 HA TYR 25 HA TYR 25 8.734 -31.860 -9.808 190 HB2 TYR 25 1HB TYR 25 9.999 -33.867 -10.187 191 HB3 TYR 25 2HB TYR 25 10.925 -32.873 -9.072 192 HD1 TYR 25 HD1 TYR 25 9.036 -35.970 -9.504 193 HD2 TYR 25 HD2 TYR 25 11.147 -33.491 -6.710 194 HE1 TYR 25 HE1 TYR 25 9.153 -37.860 -7.915 195 HE2 TYR 25 HE2 TYR 25 11.263 -35.379 -5.121 196 HH TYR 25 HH TYR 25 9.479 -38.300 -5.602 197 H GLU 26 H GLU 26 7.454 -33.289 -6.942 198 HA GLU 26 HA GLU 26 5.700 -35.142 -8.379 199 HB2 GLU 26 1HB GLU 26 5.767 -34.226 -5.476 200 HB3 GLU 26 2HB GLU 26 4.650 -35.430 -6.103 201 HG2 GLU 26 1HG GLU 26 6.557 -36.861 -6.738 202 HG3 GLU 26 2HG GLU 26 7.667 -35.657 -6.088 203 H ALA 27 H ALA 27 5.698 -31.811 -7.577 204 HA ALA 27 HA ALA 27 2.778 -31.617 -7.360 205 HB1 ALA 27 1HB ALA 27 3.207 -29.200 -7.057 206 HB2 ALA 27 2HB ALA 27 4.194 -30.188 -5.954 207 HB3 ALA 27 3HB ALA 27 4.930 -29.470 -7.405 208 H THR 28 H THR 28 1.451 -31.452 -9.004 209 HA THR 28 HA THR 28 2.480 -30.450 -11.600 210 HB THR 28 HB THR 28 0.380 -31.248 -12.556 211 HG1 THR 28 HG1 THR 28 -0.839 -32.509 -10.647 212 HG21 THR 28 1HG2 THR 28 0.553 -33.646 -12.019 213 HG22 THR 28 2HG2 THR 28 2.165 -32.916 -12.192 214 HG23 THR 28 3HG2 THR 28 1.513 -33.259 -10.574 215 H GLU 29 H GLU 29 0.744 -29.123 -12.850 216 HA GLU 29 HA GLU 29 0.477 -26.590 -11.648 217 HB2 GLU 29 1HB GLU 29 0.327 -26.980 -14.085 218 HB3 GLU 29 2HB GLU 29 -1.200 -27.825 -13.870 219 HG2 GLU 29 1HG GLU 29 -2.234 -25.762 -13.028 220 HG3 GLU 29 2HG GLU 29 -0.703 -24.911 -13.220 221 H GLU 30 H GLU 30 -1.894 -29.242 -11.898 222 HA GLU 30 HA GLU 30 -4.007 -27.773 -10.605 223 HB2 GLU 30 1HB GLU 30 -3.564 -30.756 -11.022 224 HB3 GLU 30 2HB GLU 30 -5.029 -30.077 -10.327 225 HG2 GLU 30 1HG GLU 30 -3.962 -29.513 -13.102 226 HG3 GLU 30 2HG GLU 30 -5.285 -30.605 -12.699 227 H GLN 31 H GLN 31 -1.432 -29.906 -9.460 228 HA GLN 31 HA GLN 31 -2.333 -30.112 -6.754 229 HB2 GLN 31 1HB GLN 31 -0.543 -31.532 -7.783 230 HB3 GLN 31 2HB GLN 31 0.524 -30.135 -7.805 231 HG2 GLN 31 1HG GLN 31 1.065 -31.519 -5.926 232 HG3 GLN 31 2HG GLN 31 0.343 -29.997 -5.331 233 HE21 GLN 31 1HE2 GLN 31 -1.906 -31.716 -3.346 234 HE22 GLN 31 2HE2 GLN 31 -0.812 -30.391 -3.567 235 H LEU 32 H LEU 32 -0.287 -27.736 -8.428 236 HA LEU 32 HA LEU 32 0.337 -26.187 -6.106 237 HB2 LEU 32 1HB LEU 32 0.165 -25.460 -9.047 238 HB3 LEU 32 2HB LEU 32 0.739 -24.347 -7.802 239 HG LEU 32 HG LEU 32 2.032 -27.021 -8.441 240 HD11 LEU 32 1HD1 LEU 32 3.762 -25.673 -9.545 241 HD12 LEU 32 2HD1 LEU 32 2.179 -25.484 -10.334 242 HD13 LEU 32 3HD1 LEU 32 2.798 -24.205 -9.263 243 HD21 LEU 32 1HD2 LEU 32 3.876 -26.105 -7.074 244 HD22 LEU 32 2HD2 LEU 32 2.913 -24.641 -6.757 245 HD23 LEU 32 3HD2 LEU 32 2.371 -26.215 -6.129 246 H LYS 33 H LYS 33 -2.357 -26.101 -8.413 247 HA LYS 33 HA LYS 33 -3.643 -23.771 -7.431 248 HB2 LYS 33 1HB LYS 33 -4.747 -26.311 -8.682 249 HB3 LYS 33 2HB LYS 33 -5.759 -24.930 -8.282 250 HG2 LYS 33 1HG LYS 33 -4.464 -23.511 -9.810 251 HG3 LYS 33 2HG LYS 33 -3.401 -24.873 -10.188 252 HD2 LYS 33 1HD LYS 33 -5.366 -26.142 -11.042 253 HD3 LYS 33 2HD LYS 33 -6.392 -24.738 -10.716 254 HE2 LYS 33 1HE LYS 33 -5.083 -23.383 -12.290 255 HE3 LYS 33 2HE LYS 33 -3.990 -24.739 -12.580 256 HZ1 LYS 33 1HZ LYS 33 -5.639 -24.554 -14.294 257 HZ2 LYS 33 2HZ LYS 33 -5.847 -25.970 -13.472 258 HZ3 LYS 33 3HZ LYS 33 -6.867 -24.702 -13.203 259 H ASP 34 H ASP 34 -3.808 -27.152 -6.340 260 HA ASP 34 HA ASP 34 -5.766 -26.655 -4.291 261 HB2 ASP 34 1HB ASP 34 -3.716 -28.863 -4.691 262 HB3 ASP 34 2HB ASP 34 -4.842 -28.845 -3.341 263 H ILE 35 H ILE 35 -2.206 -26.748 -4.319 264 HA ILE 35 HA ILE 35 -1.844 -26.530 -1.510 265 HB ILE 35 HB ILE 35 -0.086 -25.721 -3.854 266 HG12 ILE 35 1HG1 ILE 35 0.230 -27.978 -1.871 267 HG13 ILE 35 2HG1 ILE 35 -0.623 -28.150 -3.398 268 HG21 ILE 35 1HG2 ILE 35 1.744 -25.480 -2.225 269 HG22 ILE 35 2HG2 ILE 35 0.458 -24.290 -1.922 270 HG23 ILE 35 3HG2 ILE 35 0.594 -25.733 -0.891 271 HD11 ILE 35 1HD1 ILE 35 1.669 -28.942 -3.579 272 HD12 ILE 35 2HD1 ILE 35 1.413 -27.520 -4.621 273 HD13 ILE 35 3HD1 ILE 35 2.278 -27.349 -3.074 274 H PHE 36 H PHE 36 -1.934 -23.996 -4.036 275 HA PHE 36 HA PHE 36 -1.293 -21.923 -2.109 276 HB2 PHE 36 1HB PHE 36 -2.089 -21.929 -5.032 277 HB3 PHE 36 2HB PHE 36 -1.952 -20.426 -4.135 278 HD1 PHE 36 HD1 PHE 36 0.047 -23.574 -4.532 279 HD2 PHE 36 HD2 PHE 36 0.027 -19.304 -4.389 280 HE1 PHE 36 HE1 PHE 36 2.484 -23.550 -4.948 281 HE2 PHE 36 HE2 PHE 36 2.463 -19.275 -4.807 282 HZ PHE 36 HZ PHE 36 3.691 -21.401 -5.084 283 H SER 37 H SER 37 -4.196 -23.422 -3.228 284 HA SER 37 HA SER 37 -6.008 -21.254 -2.713 285 HB2 SER 37 1HB SER 37 -7.740 -22.883 -2.903 286 HB3 SER 37 2HB SER 37 -6.497 -23.324 -4.064 287 HG SER 37 HG SER 37 -5.672 -24.729 -2.422 288 H GLU 38 H GLU 38 -4.237 -23.366 -0.658 289 HA GLU 38 HA GLU 38 -6.105 -23.522 1.521 290 HB2 GLU 38 1HB GLU 38 -3.081 -23.846 1.406 291 HB3 GLU 38 2HB GLU 38 -4.033 -24.137 2.856 292 HG2 GLU 38 1HG GLU 38 -5.313 -25.877 1.633 293 HG3 GLU 38 2HG GLU 38 -4.284 -25.612 0.227 294 H VAL 39 H VAL 39 -3.972 -21.043 0.404 295 HA VAL 39 HA VAL 39 -4.298 -19.599 3.001 296 HB VAL 39 HB VAL 39 -2.256 -18.325 2.351 297 HG11 VAL 39 1HG1 VAL 39 -0.645 -20.123 2.750 298 HG12 VAL 39 2HG1 VAL 39 -2.063 -20.252 3.817 299 HG13 VAL 39 3HG1 VAL 39 -1.906 -21.330 2.408 300 HG21 VAL 39 1HG2 VAL 39 -0.879 -19.164 0.474 301 HG22 VAL 39 2HG2 VAL 39 -2.156 -20.337 0.065 302 HG23 VAL 39 3HG2 VAL 39 -2.465 -18.591 -0.096 303 H GLY 40 H GLY 40 -5.992 -19.767 0.429 304 HA2 GLY 40 1HA GLY 40 -7.557 -17.696 0.532 305 HA3 GLY 40 2HA GLY 40 -6.151 -16.817 -0.042 306 HA PRO 41 HA PRO 41 -8.787 -18.966 -3.438 307 HB2 PRO 41 1HB PRO 41 -9.596 -16.082 -3.932 308 HB3 PRO 41 2HB PRO 41 -10.558 -17.554 -4.113 309 HG2 PRO 41 1HG PRO 41 -10.968 -16.033 -1.967 310 HG3 PRO 41 2HG PRO 41 -10.904 -17.787 -1.769 311 HD2 PRO 41 1HD PRO 41 -8.733 -15.717 -1.232 312 HD3 PRO 41 2HD PRO 41 -9.229 -17.134 -0.222 313 H VAL 42 H VAL 42 -7.925 -19.116 -5.477 314 HA VAL 42 HA VAL 42 -5.809 -17.121 -6.171 315 HB VAL 42 HB VAL 42 -5.927 -20.099 -6.811 316 HG11 VAL 42 1HG1 VAL 42 -3.694 -19.787 -7.762 317 HG12 VAL 42 2HG1 VAL 42 -4.928 -18.846 -8.634 318 HG13 VAL 42 3HG1 VAL 42 -3.827 -18.033 -7.495 319 HG21 VAL 42 1HG2 VAL 42 -3.947 -20.221 -5.333 320 HG22 VAL 42 2HG2 VAL 42 -4.096 -18.482 -4.991 321 HG23 VAL 42 3HG2 VAL 42 -5.367 -19.605 -4.456 322 H VAL 43 H VAL 43 -5.809 -16.216 -8.146 323 HA VAL 43 HA VAL 43 -8.195 -16.532 -9.783 324 HB VAL 43 HB VAL 43 -5.647 -14.906 -10.174 325 HG11 VAL 43 1HG1 VAL 43 -6.864 -13.716 -11.932 326 HG12 VAL 43 2HG1 VAL 43 -6.626 -15.434 -12.332 327 HG13 VAL 43 3HG1 VAL 43 -8.216 -14.861 -11.771 328 HG21 VAL 43 1HG2 VAL 43 -7.119 -13.012 -9.567 329 HG22 VAL 43 2HG2 VAL 43 -8.473 -14.141 -9.330 330 HG23 VAL 43 3HG2 VAL 43 -7.052 -14.219 -8.261 331 H SER 44 H SER 44 -4.687 -17.023 -10.353 332 HA SER 44 HA SER 44 -5.045 -19.370 -11.938 333 HB2 SER 44 1HB SER 44 -6.081 -17.811 -13.532 334 HB3 SER 44 2HB SER 44 -4.652 -16.791 -13.491 335 HG SER 44 HG SER 44 -3.537 -18.234 -14.553 336 H PHE 45 H PHE 45 -3.056 -20.089 -12.974 337 HA PHE 45 HA PHE 45 -0.658 -18.782 -11.774 338 HB2 PHE 45 1HB PHE 45 -1.145 -21.618 -12.754 339 HB3 PHE 45 2HB PHE 45 0.455 -21.005 -12.364 340 HD1 PHE 45 HD1 PHE 45 -2.935 -21.529 -10.919 341 HD2 PHE 45 HD2 PHE 45 1.240 -21.031 -10.167 342 HE1 PHE 45 HE1 PHE 45 -3.297 -22.104 -8.542 343 HE2 PHE 45 HE2 PHE 45 0.883 -21.608 -7.790 344 HZ PHE 45 HZ PHE 45 -1.387 -22.143 -6.977 345 H ARG 46 H ARG 46 1.231 -18.503 -13.022 346 HA ARG 46 HA ARG 46 0.819 -18.675 -15.973 347 HB2 ARG 46 1HB ARG 46 2.039 -16.371 -14.418 348 HB3 ARG 46 2HB ARG 46 2.155 -16.553 -16.162 349 HG2 ARG 46 1HG ARG 46 -0.294 -16.412 -16.347 350 HG3 ARG 46 2HG ARG 46 -0.407 -16.220 -14.582 351 HD2 ARG 46 1HD ARG 46 0.855 -14.182 -14.687 352 HD3 ARG 46 2HD ARG 46 1.096 -14.390 -16.437 353 HE ARG 46 HE ARG 46 -1.084 -13.715 -16.823 354 HH11 ARG 46 1HH1 ARG 46 -0.530 -14.120 -13.378 355 HH12 ARG 46 2HH1 ARG 46 -2.012 -13.314 -12.917 356 HH21 ARG 46 1HH2 ARG 46 -3.005 -12.670 -16.213 357 HH22 ARG 46 2HH2 ARG 46 -3.414 -12.493 -14.521 358 H LEU 47 H LEU 47 2.321 -19.822 -16.957 359 HA LEU 47 HA LEU 47 4.645 -20.779 -15.507 360 HB2 LEU 47 1HB LEU 47 3.487 -22.186 -17.147 361 HB3 LEU 47 2HB LEU 47 3.848 -21.027 -18.430 362 HG LEU 47 HG LEU 47 6.298 -21.500 -18.070 363 HD11 LEU 47 1HD1 LEU 47 6.889 -23.521 -16.810 364 HD12 LEU 47 2HD1 LEU 47 6.145 -22.289 -15.765 365 HD13 LEU 47 3HD1 LEU 47 5.194 -23.696 -16.296 366 HD21 LEU 47 1HD2 LEU 47 6.203 -23.687 -19.219 367 HD22 LEU 47 2HD2 LEU 47 4.498 -23.865 -18.739 368 HD23 LEU 47 3HD2 LEU 47 4.976 -22.571 -19.865 369 H VAL 48 H VAL 48 6.578 -19.891 -15.343 370 HA VAL 48 HA VAL 48 7.315 -17.637 -17.090 371 HB VAL 48 HB VAL 48 8.802 -18.998 -14.802 372 HG11 VAL 48 1HG1 VAL 48 10.304 -17.067 -14.870 373 HG12 VAL 48 2HG1 VAL 48 10.361 -18.009 -16.378 374 HG13 VAL 48 3HG1 VAL 48 9.469 -16.471 -16.324 375 HG21 VAL 48 1HG2 VAL 48 8.201 -16.944 -13.559 376 HG22 VAL 48 2HG2 VAL 48 7.300 -16.352 -14.975 377 HG23 VAL 48 3HG2 VAL 48 6.749 -17.809 -14.114 378 H TYR 49 H TYR 49 8.408 -17.837 -18.912 379 HA TYR 49 HA TYR 49 10.344 -20.023 -19.264 380 HB2 TYR 49 1HB TYR 49 9.284 -20.857 -21.333 381 HB3 TYR 49 2HB TYR 49 8.254 -21.116 -19.931 382 HD1 TYR 49 HD1 TYR 49 8.740 -19.104 -22.987 383 HD2 TYR 49 HD2 TYR 49 6.131 -20.029 -19.710 384 HE1 TYR 49 HE1 TYR 49 6.886 -17.939 -24.134 385 HE2 TYR 49 HE2 TYR 49 4.277 -18.865 -20.855 386 HH TYR 49 HH TYR 49 3.655 -17.705 -22.638 387 H ALA 50 H ALA 50 11.614 -19.829 -21.208 388 HA ALA 50 HA ALA 50 12.425 -17.142 -21.674 389 HB1 ALA 50 1HB ALA 50 13.844 -18.100 -23.459 390 HB2 ALA 50 2HB ALA 50 13.939 -19.054 -21.959 391 HB3 ALA 50 3HB ALA 50 12.960 -19.638 -23.325 392 H ARG 51 H ARG 51 11.634 -15.597 -22.887 393 HA ARG 51 HA ARG 51 9.273 -15.955 -24.446 394 HB2 ARG 51 1HB ARG 51 10.004 -13.807 -23.389 395 HB3 ARG 51 2HB ARG 51 11.281 -13.679 -24.589 396 HG2 ARG 51 1HG ARG 51 9.672 -13.458 -26.374 397 HG3 ARG 51 2HG ARG 51 8.328 -13.775 -25.250 398 HD2 ARG 51 1HD ARG 51 8.880 -11.764 -24.016 399 HD3 ARG 51 2HD ARG 51 10.234 -11.450 -25.126 400 HE ARG 51 HE ARG 51 7.851 -11.748 -26.627 401 HH11 ARG 51 1HH1 ARG 51 9.377 -9.526 -24.372 402 HH12 ARG 51 2HH1 ARG 51 8.565 -8.118 -25.017 403 HH21 ARG 51 1HH2 ARG 51 6.803 -9.910 -27.455 404 HH22 ARG 51 2HH2 ARG 51 7.108 -8.333 -26.762 405 H GLU 52 H GLU 52 12.689 -16.083 -25.239 406 HA GLU 52 HA GLU 52 12.281 -15.764 -28.101 407 HB2 GLU 52 1HB GLU 52 14.399 -15.107 -26.991 408 HB3 GLU 52 2HB GLU 52 14.690 -16.781 -26.538 409 HG2 GLU 52 1HG GLU 52 14.871 -17.419 -28.887 410 HG3 GLU 52 2HG GLU 52 14.493 -15.770 -29.384 411 H THR 53 H THR 53 13.074 -18.521 -25.959 412 HA THR 53 HA THR 53 12.870 -20.303 -28.330 413 HB THR 53 HB THR 53 14.037 -21.977 -26.953 414 HG1 THR 53 HG1 THR 53 14.843 -21.010 -24.841 415 HG21 THR 53 1HG2 THR 53 16.180 -20.796 -26.667 416 HG22 THR 53 2HG2 THR 53 15.391 -20.322 -28.190 417 HG23 THR 53 3HG2 THR 53 15.340 -19.232 -26.785 418 H GLY 54 H GLY 54 11.373 -19.574 -25.256 419 HA2 GLY 54 1HA GLY 54 9.119 -20.161 -24.731 420 HA3 GLY 54 2HA GLY 54 9.173 -21.446 -25.923 421 H LYS 55 H LYS 55 12.039 -21.556 -24.226 422 HA LYS 55 HA LYS 55 11.278 -24.045 -22.953 423 HB2 LYS 55 1HB LYS 55 13.534 -23.654 -23.929 424 HB3 LYS 55 2HB LYS 55 13.845 -22.426 -22.709 425 HG2 LYS 55 1HG LYS 55 13.704 -24.113 -20.937 426 HG3 LYS 55 2HG LYS 55 13.324 -25.357 -22.136 427 HD2 LYS 55 1HD LYS 55 15.503 -24.969 -23.236 428 HD3 LYS 55 2HD LYS 55 15.883 -23.716 -22.046 429 HE2 LYS 55 1HE LYS 55 15.742 -25.395 -20.234 430 HE3 LYS 55 2HE LYS 55 15.364 -26.647 -21.420 431 HZ1 LYS 55 1HZ LYS 55 17.678 -26.650 -20.843 432 HZ2 LYS 55 2HZ LYS 55 17.502 -26.251 -22.434 433 HZ3 LYS 55 3HZ LYS 55 17.857 -25.083 -21.325 434 HA PRO 56 HA PRO 56 9.709 -22.304 -19.213 435 HB2 PRO 56 1HB PRO 56 10.275 -25.165 -18.353 436 HB3 PRO 56 2HB PRO 56 8.827 -24.187 -18.079 437 HG2 PRO 56 1HG PRO 56 8.752 -26.033 -19.991 438 HG3 PRO 56 2HG PRO 56 8.059 -24.442 -20.319 439 HD2 PRO 56 1HD PRO 56 10.768 -25.561 -21.144 440 HD3 PRO 56 2HD PRO 56 9.592 -24.589 -22.118 441 H LYS 57 H LYS 57 10.715 -21.452 -17.442 442 HA LYS 57 HA LYS 57 13.597 -22.011 -17.129 443 HB2 LYS 57 1HB LYS 57 11.786 -19.909 -15.876 444 HB3 LYS 57 2HB LYS 57 13.509 -20.049 -15.556 445 HG2 LYS 57 1HG LYS 57 13.929 -19.698 -18.010 446 HG3 LYS 57 2HG LYS 57 12.198 -19.387 -18.205 447 HD2 LYS 57 1HD LYS 57 12.387 -17.556 -16.497 448 HD3 LYS 57 2HD LYS 57 14.137 -17.824 -16.461 449 HE2 LYS 57 1HE LYS 57 14.257 -17.319 -18.886 450 HE3 LYS 57 2HE LYS 57 12.514 -17.035 -18.910 451 HZ1 LYS 57 1HZ LYS 57 13.738 -14.996 -18.719 452 HZ2 LYS 57 2HZ LYS 57 12.844 -15.238 -17.354 453 HZ3 LYS 57 3HZ LYS 57 14.472 -15.503 -17.332 454 H GLY 58 H GLY 58 10.721 -23.152 -15.852 455 HA2 GLY 58 1HA GLY 58 10.575 -24.831 -14.173 456 HA3 GLY 58 2HA GLY 58 12.148 -24.357 -13.559 457 H TYR 59 H TYR 59 9.921 -21.802 -14.260 458 HA TYR 59 HA TYR 59 9.139 -21.627 -11.390 459 HB2 TYR 59 1HB TYR 59 10.234 -19.332 -13.067 460 HB3 TYR 59 2HB TYR 59 9.596 -19.189 -11.435 461 HD1 TYR 59 HD1 TYR 59 12.441 -20.133 -13.487 462 HD2 TYR 59 HD2 TYR 59 10.801 -20.220 -9.522 463 HE1 TYR 59 HE1 TYR 59 14.686 -20.601 -12.567 464 HE2 TYR 59 HE2 TYR 59 13.047 -20.688 -8.604 465 HH TYR 59 HH TYR 59 15.874 -21.019 -10.737 466 H GLY 60 H GLY 60 7.447 -19.895 -11.049 467 HA2 GLY 60 1HA GLY 60 5.760 -19.313 -13.392 468 HA3 GLY 60 2HA GLY 60 5.058 -20.439 -12.244 469 H PHE 61 H PHE 61 3.768 -18.077 -12.702 470 HA PHE 61 HA PHE 61 4.163 -16.743 -10.054 471 HB2 PHE 61 1HB PHE 61 2.973 -15.691 -12.643 472 HB3 PHE 61 2HB PHE 61 2.713 -14.900 -11.098 473 HD1 PHE 61 HD1 PHE 61 5.072 -15.550 -13.784 474 HD2 PHE 61 HD2 PHE 61 4.602 -13.878 -9.881 475 HE1 PHE 61 HE1 PHE 61 7.206 -14.332 -14.051 476 HE2 PHE 61 HE2 PHE 61 6.736 -12.658 -10.145 477 HZ PHE 61 HZ PHE 61 8.039 -12.886 -12.230 478 H CYS 62 H CYS 62 2.316 -16.273 -8.802 479 HA CYS 62 HA CYS 62 -0.148 -17.752 -9.612 480 HB2 CYS 62 1HB CYS 62 1.040 -19.066 -7.899 481 HB3 CYS 62 2HB CYS 62 1.105 -17.665 -6.840 482 HG CYS 62 HG CYS 62 -1.611 -17.408 -6.934 483 H GLU 63 H GLU 63 -1.599 -16.229 -10.030 484 HA GLU 63 HA GLU 63 -1.585 -13.710 -8.506 485 HB2 GLU 63 1HB GLU 63 -1.945 -13.681 -10.959 486 HB3 GLU 63 2HB GLU 63 -3.386 -14.670 -10.767 487 HG2 GLU 63 1HG GLU 63 -4.461 -12.879 -9.481 488 HG3 GLU 63 2HG GLU 63 -3.010 -11.890 -9.634 489 H TYR 64 H TYR 64 -2.680 -13.400 -6.718 490 HA TYR 64 HA TYR 64 -4.872 -15.268 -6.029 491 HB2 TYR 64 1HB TYR 64 -3.243 -13.246 -4.470 492 HB3 TYR 64 2HB TYR 64 -4.756 -13.866 -3.825 493 HD1 TYR 64 HD1 TYR 64 -1.379 -14.856 -5.010 494 HD2 TYR 64 HD2 TYR 64 -4.898 -16.006 -2.839 495 HE1 TYR 64 HE1 TYR 64 -0.198 -16.848 -4.148 496 HE2 TYR 64 HE2 TYR 64 -3.715 -17.998 -1.978 497 HH TYR 64 HH TYR 64 -1.872 -19.267 -2.162 498 H GLN 65 H GLN 65 -6.811 -14.346 -4.938 499 HA GLN 65 HA GLN 65 -7.925 -12.261 -6.686 500 HB2 GLN 65 1HB GLN 65 -9.163 -13.971 -4.495 501 HB3 GLN 65 2HB GLN 65 -10.055 -12.782 -5.433 502 HG2 GLN 65 1HG GLN 65 -9.535 -14.018 -7.498 503 HG3 GLN 65 2HG GLN 65 -8.666 -15.238 -6.525 504 HE21 GLN 65 1HE2 GLN 65 -11.849 -16.838 -6.957 505 HE22 GLN 65 2HE2 GLN 65 -10.334 -16.576 -7.757 506 H ASP 66 H ASP 66 -6.184 -12.273 -3.861 507 HA ASP 66 HA ASP 66 -7.029 -9.527 -3.251 508 HB2 ASP 66 1HB ASP 66 -8.521 -11.157 -1.904 509 HB3 ASP 66 2HB ASP 66 -7.068 -11.563 -1.001 510 H GLN 67 H GLN 67 -5.460 -8.312 -2.315 511 HA GLN 67 HA GLN 67 -2.772 -9.224 -2.600 512 HB2 GLN 67 1HB GLN 67 -3.946 -6.810 -1.171 513 HB3 GLN 67 2HB GLN 67 -2.218 -7.078 -1.346 514 HG2 GLN 67 1HG GLN 67 -2.440 -7.032 -3.785 515 HG3 GLN 67 2HG GLN 67 -4.198 -6.768 -3.612 516 HE21 GLN 67 1HE2 GLN 67 -3.291 -3.383 -4.083 517 HE22 GLN 67 2HE2 GLN 67 -3.867 -4.819 -4.865 518 H GLU 68 H GLU 68 -4.974 -9.144 0.140 519 HA GLU 68 HA GLU 68 -2.967 -9.509 2.167 520 HB2 GLU 68 1HB GLU 68 -5.954 -10.094 2.127 521 HB3 GLU 68 2HB GLU 68 -4.950 -10.279 3.559 522 HG2 GLU 68 1HG GLU 68 -5.377 -7.700 2.034 523 HG3 GLU 68 2HG GLU 68 -6.186 -8.161 3.529 524 H THR 69 H THR 69 -4.768 -11.702 0.087 525 HA THR 69 HA THR 69 -3.887 -14.082 1.539 526 HB THR 69 HB THR 69 -4.900 -15.325 -0.366 527 HG1 THR 69 HG1 THR 69 -4.763 -12.800 -1.502 528 HG21 THR 69 1HG2 THR 69 -7.218 -14.562 -0.023 529 HG22 THR 69 2HG2 THR 69 -6.322 -14.582 1.514 530 HG23 THR 69 3HG2 THR 69 -6.619 -13.041 0.678 531 H ALA 70 H ALA 70 -2.841 -12.212 -1.261 532 HA ALA 70 HA ALA 70 -0.776 -14.033 -2.077 533 HB1 ALA 70 1HB ALA 70 0.182 -12.067 -3.234 534 HB2 ALA 70 2HB ALA 70 -1.567 -12.218 -3.530 535 HB3 ALA 70 3HB ALA 70 -0.960 -11.012 -2.372 536 H LEU 71 H LEU 71 -0.821 -11.255 0.156 537 HA LEU 71 HA LEU 71 1.915 -11.414 0.926 538 HB2 LEU 71 1HB LEU 71 0.493 -9.496 1.468 539 HB3 LEU 71 2HB LEU 71 -0.525 -10.509 2.496 540 HG LEU 71 HG LEU 71 1.408 -10.853 4.027 541 HD11 LEU 71 1HD1 LEU 71 3.405 -9.453 3.744 542 HD12 LEU 71 2HD1 LEU 71 3.196 -10.582 2.385 543 HD13 LEU 71 3HD1 LEU 71 2.772 -8.865 2.188 544 HD21 LEU 71 1HD2 LEU 71 1.387 -8.554 4.935 545 HD22 LEU 71 2HD2 LEU 71 0.725 -7.951 3.397 546 HD23 LEU 71 3HD2 LEU 71 -0.240 -9.050 4.411 547 H SER 72 H SER 72 -1.011 -12.885 2.362 548 HA SER 72 HA SER 72 0.287 -14.273 4.460 549 HB2 SER 72 1HB SER 72 -2.184 -15.013 2.860 550 HB3 SER 72 2HB SER 72 -1.690 -15.808 4.346 551 HG SER 72 HG SER 72 -2.491 -13.160 3.926 552 H ALA 73 H ALA 73 -0.312 -15.213 1.080 553 HA ALA 73 HA ALA 73 0.649 -17.867 1.255 554 HB1 ALA 73 1HB ALA 73 1.032 -17.683 -1.181 555 HB2 ALA 73 2HB ALA 73 -0.544 -17.004 -0.708 556 HB3 ALA 73 3HB ALA 73 0.819 -15.921 -1.073 557 H MET 74 H MET 74 2.404 -14.855 0.477 558 HA MET 74 HA MET 74 4.962 -15.992 0.130 559 HB2 MET 74 1HB MET 74 4.412 -13.637 -0.383 560 HB3 MET 74 2HB MET 74 4.219 -13.295 1.329 561 HG2 MET 74 1HG MET 74 6.643 -13.956 1.639 562 HG3 MET 74 2HG MET 74 6.773 -14.024 -0.120 563 HE1 MET 74 1HE MET 74 6.180 -10.242 2.447 564 HE2 MET 74 2HE MET 74 5.006 -11.581 2.485 565 HE3 MET 74 3HE MET 74 6.677 -11.843 3.042 566 H ARG 75 H ARG 75 3.277 -15.030 3.101 567 HA ARG 75 HA ARG 75 5.635 -15.456 4.752 568 HB2 ARG 75 1HB ARG 75 2.713 -14.993 5.421 569 HB3 ARG 75 2HB ARG 75 3.964 -15.186 6.640 570 HG2 ARG 75 1HG ARG 75 5.112 -13.192 5.821 571 HG3 ARG 75 2HG ARG 75 3.897 -13.011 4.531 572 HD2 ARG 75 1HD ARG 75 2.162 -12.719 6.182 573 HD3 ARG 75 2HD ARG 75 3.345 -12.954 7.488 574 HE ARG 75 HE ARG 75 4.294 -10.875 5.868 575 HH11 ARG 75 1HH1 ARG 75 1.552 -11.537 7.961 576 HH12 ARG 75 2HH1 ARG 75 1.325 -9.860 8.405 577 HH21 ARG 75 1HH2 ARG 75 3.991 -8.701 6.451 578 HH22 ARG 75 2HH2 ARG 75 2.706 -8.255 7.551 579 H ASN 76 H ASN 76 2.878 -17.364 3.712 580 HA ASN 76 HA ASN 76 3.310 -19.298 5.917 581 HB2 ASN 76 1HB ASN 76 1.093 -18.939 3.882 582 HB3 ASN 76 2HB ASN 76 1.185 -20.327 4.958 583 HD21 ASN 76 1HD2 ASN 76 -0.975 -17.660 6.426 584 HD22 ASN 76 2HD2 ASN 76 -0.934 -18.486 4.904 585 H LEU 77 H LEU 77 3.099 -19.252 2.349 586 HA LEU 77 HA LEU 77 3.577 -22.114 2.211 587 HB2 LEU 77 1HB LEU 77 3.484 -19.947 0.085 588 HB3 LEU 77 2HB LEU 77 3.680 -21.666 -0.267 589 HG LEU 77 HG LEU 77 1.266 -20.427 1.100 590 HD11 LEU 77 1HD1 LEU 77 0.130 -20.887 -1.027 591 HD12 LEU 77 2HD1 LEU 77 1.473 -19.736 -1.232 592 HD13 LEU 77 3HD1 LEU 77 1.670 -21.433 -1.730 593 HD21 LEU 77 1HD2 LEU 77 0.276 -22.663 0.740 594 HD22 LEU 77 2HD2 LEU 77 1.819 -23.236 0.060 595 HD23 LEU 77 3HD2 LEU 77 1.722 -22.762 1.773 596 H ASN 78 H ASN 78 5.524 -19.215 2.054 597 HA ASN 78 HA ASN 78 7.758 -20.411 0.668 598 HB2 ASN 78 1HB ASN 78 7.296 -17.953 0.781 599 HB3 ASN 78 2HB ASN 78 7.725 -17.980 2.486 600 HD21 ASN 78 1HD2 ASN 78 10.584 -17.187 0.026 601 HD22 ASN 78 2HD2 ASN 78 8.903 -16.783 -0.074 602 H GLY 79 H GLY 79 8.888 -22.035 1.400 603 HA2 GLY 79 1HA GLY 79 10.631 -22.800 2.903 604 HA3 GLY 79 2HA GLY 79 9.877 -21.910 4.212 605 H ARG 80 H ARG 80 7.307 -23.166 2.662 606 HA ARG 80 HA ARG 80 6.907 -25.247 4.639 607 HB2 ARG 80 1HB ARG 80 5.063 -23.851 3.721 608 HB3 ARG 80 2HB ARG 80 5.292 -24.600 2.148 609 HG2 ARG 80 1HG ARG 80 4.581 -26.738 2.974 610 HG3 ARG 80 2HG ARG 80 4.560 -26.138 4.651 611 HD2 ARG 80 1HD ARG 80 2.764 -24.657 4.162 612 HD3 ARG 80 2HD ARG 80 2.857 -25.042 2.427 613 HE ARG 80 HE ARG 80 2.440 -27.410 3.971 614 HH11 ARG 80 1HH1 ARG 80 0.797 -24.545 2.773 615 HH12 ARG 80 2HH1 ARG 80 -0.778 -25.306 2.748 616 HH21 ARG 80 1HH2 ARG 80 0.390 -28.387 3.934 617 HH22 ARG 80 2HH2 ARG 80 -1.009 -27.481 3.404 618 H GLU 81 H GLU 81 7.135 -27.398 4.493 619 HA GLU 81 HA GLU 81 8.796 -28.318 2.252 620 HB2 GLU 81 1HB GLU 81 9.410 -28.864 4.593 621 HB3 GLU 81 2HB GLU 81 7.901 -29.741 4.793 622 HG2 GLU 81 1HG GLU 81 8.595 -31.337 3.050 623 HG3 GLU 81 2HG GLU 81 10.109 -30.457 2.853 624 H PHE 82 H PHE 82 8.073 -29.326 0.528 625 HA PHE 82 HA PHE 82 5.599 -30.979 0.822 626 HB2 PHE 82 1HB PHE 82 6.552 -29.401 -1.601 627 HB3 PHE 82 2HB PHE 82 5.219 -30.546 -1.627 628 HD1 PHE 82 HD1 PHE 82 6.318 -27.226 -0.609 629 HD2 PHE 82 HD2 PHE 82 3.124 -30.058 -0.438 630 HE1 PHE 82 HE1 PHE 82 4.766 -25.432 0.088 631 HE2 PHE 82 HE2 PHE 82 1.569 -28.267 0.256 632 HZ PHE 82 HZ PHE 82 2.392 -25.952 0.521 633 H SER 83 H SER 83 6.358 -32.985 1.072 634 HA SER 83 HA SER 83 7.488 -34.944 0.639 635 HB2 SER 83 1HB SER 83 7.480 -33.840 -2.190 636 HB3 SER 83 2HB SER 83 7.845 -35.502 -1.752 637 HG SER 83 HG SER 83 5.762 -35.478 -2.241 638 H GLY 84 H GLY 84 9.042 -32.640 1.462 639 HA2 GLY 84 1HA GLY 84 11.356 -32.938 2.119 640 HA3 GLY 84 2HA GLY 84 11.676 -33.735 0.590 641 H ARG 85 H ARG 85 9.935 -31.555 -0.731 642 HA ARG 85 HA ARG 85 12.242 -29.729 -1.132 643 HB2 ARG 85 1HB ARG 85 11.234 -30.920 -3.092 644 HB3 ARG 85 2HB ARG 85 9.727 -30.061 -2.803 645 HG2 ARG 85 1HG ARG 85 10.776 -28.882 -4.526 646 HG3 ARG 85 2HG ARG 85 11.091 -27.904 -3.073 647 HD2 ARG 85 1HD ARG 85 13.290 -29.006 -2.879 648 HD3 ARG 85 2HD ARG 85 12.967 -29.827 -4.424 649 HE ARG 85 HE ARG 85 12.616 -27.002 -4.679 650 HH11 ARG 85 1HH1 ARG 85 15.086 -29.487 -4.418 651 HH12 ARG 85 2HH1 ARG 85 16.287 -28.559 -5.287 652 HH21 ARG 85 1HH2 ARG 85 14.184 -25.808 -5.805 653 HH22 ARG 85 2HH2 ARG 85 15.779 -26.477 -6.073 654 H ALA 86 H ALA 86 12.252 -27.854 -0.124 655 HA ALA 86 HA ALA 86 9.847 -26.697 1.007 656 HB1 ALA 86 1HB ALA 86 11.335 -24.824 1.638 657 HB2 ALA 86 2HB ALA 86 12.032 -26.400 2.085 658 HB3 ALA 86 3HB ALA 86 12.633 -25.535 0.652 659 H LEU 87 H LEU 87 8.410 -25.428 0.102 660 HA LEU 87 HA LEU 87 8.794 -24.606 -2.678 661 HB2 LEU 87 1HB LEU 87 6.631 -25.490 -1.880 662 HB3 LEU 87 2HB LEU 87 6.490 -24.139 -0.750 663 HG LEU 87 HG LEU 87 6.460 -22.584 -2.744 664 HD11 LEU 87 1HD1 LEU 87 5.963 -23.580 -4.932 665 HD12 LEU 87 2HD1 LEU 87 7.563 -24.074 -4.334 666 HD13 LEU 87 3HD1 LEU 87 6.191 -25.205 -4.245 667 HD21 LEU 87 1HD2 LEU 87 4.112 -23.121 -3.300 668 HD22 LEU 87 2HD2 LEU 87 4.313 -24.741 -2.590 669 HD23 LEU 87 3HD2 LEU 87 4.413 -23.296 -1.554 670 H ARG 88 H ARG 88 9.259 -22.652 -3.453 671 HA ARG 88 HA ARG 88 9.661 -20.461 -1.484 672 HB2 ARG 88 1HB ARG 88 11.585 -20.962 -2.894 673 HB3 ARG 88 2HB ARG 88 10.614 -20.800 -4.348 674 HG2 ARG 88 1HG ARG 88 10.269 -18.400 -3.825 675 HG3 ARG 88 2HG ARG 88 11.333 -18.588 -2.411 676 HD2 ARG 88 1HD ARG 88 13.163 -19.218 -3.826 677 HD3 ARG 88 2HD ARG 88 12.111 -19.165 -5.259 678 HE ARG 88 HE ARG 88 12.039 -16.665 -3.900 679 HH11 ARG 88 1HH1 ARG 88 14.128 -18.643 -5.916 680 HH12 ARG 88 2HH1 ARG 88 14.985 -17.275 -6.590 681 HH21 ARG 88 1HH2 ARG 88 13.158 -14.897 -4.781 682 HH22 ARG 88 2HH2 ARG 88 14.437 -15.154 -5.949 683 H VAL 89 H VAL 89 8.103 -19.027 -1.245 684 HA VAL 89 HA VAL 89 6.685 -18.120 -3.714 685 HB VAL 89 HB VAL 89 5.500 -18.392 -0.917 686 HG11 VAL 89 1HG1 VAL 89 3.400 -17.695 -1.962 687 HG12 VAL 89 2HG1 VAL 89 4.649 -16.432 -2.070 688 HG13 VAL 89 3HG1 VAL 89 4.255 -17.420 -3.497 689 HG21 VAL 89 1HG2 VAL 89 4.046 -20.090 -1.978 690 HG22 VAL 89 2HG2 VAL 89 4.929 -19.887 -3.511 691 HG23 VAL 89 3HG2 VAL 89 5.761 -20.554 -2.085 692 H ASP 90 H ASP 90 7.521 -16.193 -4.163 693 HA ASP 90 HA ASP 90 7.830 -14.264 -1.901 694 HB2 ASP 90 1HB ASP 90 9.255 -14.354 -4.591 695 HB3 ASP 90 2HB ASP 90 9.417 -13.051 -3.421 696 H ASN 91 H ASN 91 6.987 -12.223 -2.058 697 HA ASN 91 HA ASN 91 4.761 -11.841 -3.866 698 HB2 ASN 91 1HB ASN 91 4.927 -10.883 -1.548 699 HB3 ASN 91 2HB ASN 91 6.166 -9.781 -2.135 700 HD21 ASN 91 1HD2 ASN 91 2.356 -9.340 -3.628 701 HD22 ASN 91 2HD2 ASN 91 2.989 -10.921 -3.315 702 H ALA 92 H ALA 92 4.651 -10.969 -5.804 703 HA ALA 92 HA ALA 92 7.230 -10.482 -7.102 704 HB1 ALA 92 1HB ALA 92 5.900 -10.467 -9.187 705 HB2 ALA 92 2HB ALA 92 5.557 -11.906 -8.197 706 HB3 ALA 92 3HB ALA 92 4.405 -10.551 -8.226 707 H ALA 93 H ALA 93 7.113 -8.495 -5.425 708 HA ALA 93 HA ALA 93 5.936 -6.170 -6.844 709 HB1 ALA 93 1HB ALA 93 6.468 -4.919 -4.777 710 HB2 ALA 93 2HB ALA 93 5.463 -6.349 -4.442 711 HB3 ALA 93 3HB ALA 93 7.207 -6.384 -4.090 712 H SER 94 H SER 94 8.828 -7.865 -6.642 713 HA SER 94 HA SER 94 10.652 -5.613 -6.811 714 HB2 SER 94 1HB SER 94 12.347 -7.260 -7.230 715 HB3 SER 94 2HB SER 94 11.280 -7.892 -5.985 716 HG SER 94 HG SER 94 11.451 -9.498 -7.350 717 H GLU 95 H GLU 95 11.947 -5.036 -8.628 718 HA GLU 95 HA GLU 95 10.350 -4.680 -10.999 719 HB2 GLU 95 1HB GLU 95 13.299 -4.148 -10.460 720 HB3 GLU 95 2HB GLU 95 12.459 -3.661 -11.927 721 HG2 GLU 95 1HG GLU 95 11.849 -2.723 -9.115 722 HG3 GLU 95 2HG GLU 95 12.674 -1.807 -10.375 723 H LYS 96 H LYS 96 12.882 -6.931 -10.055 724 HA LYS 96 HA LYS 96 13.441 -7.980 -12.654 725 HB2 LYS 96 1HB LYS 96 13.637 -9.208 -9.879 726 HB3 LYS 96 2HB LYS 96 14.172 -10.038 -11.335 727 HG2 LYS 96 1HG LYS 96 15.795 -8.242 -11.780 728 HG3 LYS 96 2HG LYS 96 15.248 -7.387 -10.330 729 HD2 LYS 96 1HD LYS 96 15.920 -9.325 -8.939 730 HD3 LYS 96 2HD LYS 96 16.480 -10.167 -10.392 731 HE2 LYS 96 1HE LYS 96 18.128 -8.384 -10.808 732 HE3 LYS 96 2HE LYS 96 17.555 -7.506 -9.387 733 HZ1 LYS 96 1HZ LYS 96 19.515 -8.778 -8.907 734 HZ2 LYS 96 2HZ LYS 96 18.244 -9.362 -8.034 735 HZ3 LYS 96 3HZ LYS 96 18.779 -10.182 -9.361 736 H ASN 97 H ASN 97 11.067 -8.920 -10.169 737 HA ASN 97 HA ASN 97 10.010 -11.124 -11.698 738 HB2 ASN 97 1HB ASN 97 8.971 -9.515 -9.356 739 HB3 ASN 97 2HB ASN 97 8.012 -10.785 -10.106 740 HD21 ASN 97 1HD2 ASN 97 10.124 -12.015 -7.213 741 HD22 ASN 97 2HD2 ASN 97 9.132 -10.609 -7.412 742 H LYS 98 H LYS 98 9.258 -7.683 -11.517 743 HA LYS 98 HA LYS 98 6.892 -7.744 -13.107 744 HB2 LYS 98 1HB LYS 98 9.035 -5.621 -12.733 745 HB3 LYS 98 2HB LYS 98 7.586 -5.353 -13.691 746 HG2 LYS 98 1HG LYS 98 6.178 -5.748 -11.719 747 HG3 LYS 98 2HG LYS 98 7.619 -6.075 -10.746 748 HD2 LYS 98 1HD LYS 98 8.446 -3.763 -11.310 749 HD3 LYS 98 2HD LYS 98 6.898 -3.457 -12.112 750 HE2 LYS 98 1HE LYS 98 5.701 -3.862 -10.003 751 HE3 LYS 98 2HE LYS 98 7.223 -4.239 -9.192 752 HZ1 LYS 98 1HZ LYS 98 6.537 -1.993 -8.780 753 HZ2 LYS 98 2HZ LYS 98 7.948 -1.995 -9.634 754 HZ3 LYS 98 3HZ LYS 98 6.526 -1.642 -10.391 755 H GLU 99 H GLU 99 10.331 -7.559 -13.989 756 HA GLU 99 HA GLU 99 9.861 -7.222 -16.803 757 HB2 GLU 99 1HB GLU 99 12.256 -8.261 -15.242 758 HB3 GLU 99 2HB GLU 99 12.267 -8.040 -16.986 759 HG2 GLU 99 1HG GLU 99 11.802 -5.867 -14.933 760 HG3 GLU 99 2HG GLU 99 13.304 -6.168 -15.802 761 H GLU 100 H GLU 100 10.211 -10.051 -14.709 762 HA GLU 100 HA GLU 100 10.258 -11.999 -16.815 763 HB2 GLU 100 1HB GLU 100 9.373 -12.159 -13.910 764 HB3 GLU 100 2HB GLU 100 9.426 -13.555 -14.978 765 HG2 GLU 100 1HG GLU 100 11.784 -11.821 -14.206 766 HG3 GLU 100 2HG GLU 100 11.401 -13.411 -13.550 767 H LEU 101 H LEU 101 7.623 -10.463 -14.987 768 HA LEU 101 HA LEU 101 5.488 -11.900 -16.225 769 HB2 LEU 101 1HB LEU 101 5.664 -9.128 -15.008 770 HB3 LEU 101 2HB LEU 101 4.154 -9.803 -15.629 771 HG LEU 101 HG LEU 101 5.797 -11.079 -13.415 772 HD11 LEU 101 1HD1 LEU 101 4.103 -10.154 -11.899 773 HD12 LEU 101 2HD1 LEU 101 5.005 -8.870 -12.740 774 HD13 LEU 101 3HD1 LEU 101 3.355 -9.288 -13.263 775 HD21 LEU 101 1HD2 LEU 101 3.712 -12.353 -13.045 776 HD22 LEU 101 2HD2 LEU 101 2.957 -11.518 -14.425 777 HD23 LEU 101 3HD2 LEU 101 4.336 -12.612 -14.691 778 H LYS 102 H LYS 102 7.224 -8.933 -17.133 779 HA LYS 102 HA LYS 102 5.587 -8.198 -19.328 780 HB2 LYS 102 1HB LYS 102 8.545 -7.777 -18.781 781 HB3 LYS 102 2HB LYS 102 7.734 -7.095 -20.184 782 HG2 LYS 102 1HG LYS 102 6.219 -5.833 -18.718 783 HG3 LYS 102 2HG LYS 102 6.996 -6.540 -17.296 784 HD2 LYS 102 1HD LYS 102 9.173 -5.547 -18.051 785 HD3 LYS 102 2HD LYS 102 8.308 -4.753 -19.375 786 HE2 LYS 102 1HE LYS 102 6.900 -3.548 -17.754 787 HE3 LYS 102 2HE LYS 102 7.718 -4.362 -16.418 788 HZ1 LYS 102 1HZ LYS 102 8.607 -2.182 -16.798 789 HZ2 LYS 102 2HZ LYS 102 9.764 -3.316 -17.108 790 HZ3 LYS 102 3HZ LYS 102 9.000 -2.553 -18.356 791 H SER 103 H SER 103 8.275 -10.491 -19.093 792 HA SER 103 HA SER 103 8.504 -10.939 -21.923 793 HB2 SER 103 1HB SER 103 9.945 -12.736 -21.352 794 HB3 SER 103 2HB SER 103 10.219 -11.493 -20.140 795 HG SER 103 HG SER 103 8.672 -12.619 -18.844 796 H LEU 104 H LEU 104 6.192 -11.914 -19.591 797 HA LEU 104 HA LEU 104 5.314 -14.216 -21.246 798 HB2 LEU 104 1HB LEU 104 4.323 -13.208 -18.555 799 HB3 LEU 104 2HB LEU 104 3.757 -14.667 -19.376 800 HG LEU 104 HG LEU 104 6.572 -14.206 -18.327 801 HD11 LEU 104 1HD1 LEU 104 5.948 -15.899 -16.662 802 HD12 LEU 104 2HD1 LEU 104 4.914 -14.456 -16.552 803 HD13 LEU 104 3HD1 LEU 104 4.295 -15.937 -17.320 804 HD21 LEU 104 1HD2 LEU 104 6.879 -16.594 -18.888 805 HD22 LEU 104 2HD2 LEU 104 5.239 -16.643 -19.578 806 HD23 LEU 104 3HD2 LEU 104 6.496 -15.638 -20.340 807 H GLY 105 H GLY 105 4.900 -10.973 -21.277 808 HA2 GLY 105 1HA GLY 105 3.359 -9.727 -22.544 809 HA3 GLY 105 2HA GLY 105 2.374 -11.163 -22.753 810 H THR 106 H THR 106 3.474 -10.215 -19.565 811 HA THR 106 HA THR 106 0.656 -9.488 -18.890 812 HB THR 106 HB THR 106 2.816 -10.712 -17.120 813 HG1 THR 106 HG1 THR 106 0.721 -11.715 -18.643 814 HG21 THR 106 1HG2 THR 106 1.039 -10.834 -15.419 815 HG22 THR 106 2HG2 THR 106 1.365 -9.146 -15.877 816 HG23 THR 106 3HG2 THR 106 -0.074 -9.979 -16.513 817 H GLY 107 H GLY 107 0.220 -7.539 -18.147 818 HA2 GLY 107 1HA GLY 107 1.549 -5.948 -16.361 819 HA3 GLY 107 2HA GLY 107 2.410 -5.603 -17.849
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