NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
16562 | 2adl | 6743 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H MET 1 HT1 MET 1 30.253 -18.561 -0.838 2 2H MET 1 HT2 MET 1 29.582 -17.811 -2.228 3 3H MET 1 HT3 MET 1 30.625 -19.163 -2.399 4 HA MET 1 HA MET 1 28.526 -19.990 -2.726 5 1HB MET 1 HB2 MET 1 30.157 -20.820 -0.686 6 2HB MET 1 HB1 MET 1 28.615 -20.644 0.141 7 1HG MET 1 HG2 MET 1 28.331 -22.015 -2.391 8 2HG MET 1 HG1 MET 1 29.477 -22.824 -1.325 9 1HE MET 1 HE1 MET 1 29.129 -24.182 0.236 10 2HE MET 1 HE2 MET 1 27.596 -24.917 0.707 11 3HE MET 1 HE3 MET 1 28.240 -23.555 1.624 12 H LYS 2 HN LYS 2 28.635 -17.500 -0.337 13 HA LYS 2 HA LYS 2 25.701 -17.353 -0.399 14 1HB LYS 2 HB2 LYS 2 25.845 -16.492 1.988 15 2HB LYS 2 HB1 LYS 2 26.113 -18.214 1.760 16 1HG LYS 2 HG2 LYS 2 28.646 -17.112 1.568 17 2HG LYS 2 HG1 LYS 2 27.867 -16.191 2.856 18 1HD LYS 2 HD2 LYS 2 27.800 -19.196 2.759 19 2HD LYS 2 HD1 LYS 2 29.109 -18.305 3.540 20 1HE LYS 2 HE2 LYS 2 27.698 -18.660 5.318 21 2HE LYS 2 HE1 LYS 2 27.148 -17.080 4.760 22 1HZ LYS 2 HZ1 LYS 2 25.392 -18.831 5.240 23 2HZ LYS 2 HZ2 LYS 2 25.889 -19.579 3.808 24 3HZ LYS 2 HZ3 LYS 2 25.269 -18.006 3.768 25 H GLN 3 HN GLN 3 24.818 -15.211 -0.100 26 HA GLN 3 HA GLN 3 26.769 -13.058 -0.588 27 1HB GLN 3 HB2 GLN 3 25.632 -13.477 -2.676 28 2HB GLN 3 HB1 GLN 3 24.064 -13.519 -1.878 29 1HG GLN 3 HG2 GLN 3 23.814 -11.341 -2.100 30 2HG GLN 3 HG1 GLN 3 25.384 -11.023 -1.366 31 1HE2 GLN 3 HE21 GLN 3 25.420 -9.244 -2.914 32 2HE2 GLN 3 HE22 GLN 3 25.974 -9.546 -4.522 33 H ARG 4 HN ARG 4 26.722 -11.632 1.059 34 HA ARG 4 HA ARG 4 24.418 -11.627 2.818 35 1HB ARG 4 HB2 ARG 4 26.917 -11.509 3.539 36 2HB ARG 4 HB1 ARG 4 26.750 -9.792 3.185 37 1HG ARG 4 HG2 ARG 4 25.072 -9.509 4.836 38 2HG ARG 4 HG1 ARG 4 24.885 -11.261 5.031 39 1HD ARG 4 HD2 ARG 4 27.561 -10.861 5.540 40 2HD ARG 4 HD1 ARG 4 26.806 -9.434 6.249 41 HE ARG 4 HE ARG 4 25.275 -11.442 7.187 42 1HH1 ARG 4 HH11 ARG 4 28.727 -10.928 7.148 43 2HH1 ARG 4 HH12 ARG 4 29.001 -11.821 8.606 44 1HH2 ARG 4 HH21 ARG 4 25.635 -12.616 9.104 45 2HH2 ARG 4 HH22 ARG 4 27.246 -12.779 9.716 46 H ILE 5 HN ILE 5 22.749 -10.562 1.975 47 HA ILE 5 HA ILE 5 23.206 -7.902 0.840 48 HB ILE 5 HB ILE 5 21.233 -8.083 -0.291 49 1HG1 ILE 5 HG12 ILE 5 20.021 -9.980 1.714 50 2HG1 ILE 5 HG11 ILE 5 19.928 -8.232 1.907 51 1HG2 ILE 5 HG21 ILE 5 20.759 -10.454 -0.911 52 2HG2 ILE 5 HG22 ILE 5 21.889 -10.952 0.338 53 3HG2 ILE 5 HG23 ILE 5 22.452 -9.991 -1.028 54 1HD1 ILE 5 HD11 ILE 5 18.930 -8.276 -0.483 55 2HD1 ILE 5 HD12 ILE 5 17.926 -8.710 0.897 56 3HD1 ILE 5 HD13 ILE 5 18.611 -9.975 -0.122 57 H THR 6 HN THR 6 23.105 -6.225 2.201 58 HA THR 6 HA THR 6 21.349 -6.523 4.529 59 HB THR 6 HB THR 6 23.377 -6.908 5.499 60 HG1 THR 6 HG1 THR 6 22.316 -5.038 6.422 61 1HG2 THR 6 HG21 THR 6 24.485 -5.414 3.301 62 2HG2 THR 6 HG22 THR 6 25.239 -6.625 4.339 63 3HG2 THR 6 HG23 THR 6 25.198 -4.932 4.838 64 H VAL 7 HN VAL 7 19.845 -5.147 4.457 65 HA VAL 7 HA VAL 7 20.326 -2.444 3.407 66 HB VAL 7 HB VAL 7 18.402 -3.339 2.321 67 1HG1 VAL 7 HG11 VAL 7 16.480 -3.983 4.204 68 2HG1 VAL 7 HG12 VAL 7 17.968 -4.684 4.841 69 3HG1 VAL 7 HG13 VAL 7 17.421 -5.111 3.219 70 1HG2 VAL 7 HG21 VAL 7 18.092 -1.162 4.158 71 2HG2 VAL 7 HG22 VAL 7 16.568 -2.040 4.028 72 3HG2 VAL 7 HG23 VAL 7 17.345 -1.406 2.579 73 H THR 8 HN THR 8 21.396 -1.572 5.195 74 HA THR 8 HA THR 8 20.646 -1.902 7.853 75 HB THR 8 HB THR 8 21.833 0.416 8.046 76 HG1 THR 8 HG1 THR 8 22.540 1.243 6.266 77 1HG2 THR 8 HG21 THR 8 22.965 -1.585 8.703 78 2HG2 THR 8 HG22 THR 8 24.049 -0.599 7.722 79 3HG2 THR 8 HG23 THR 8 23.260 -2.010 7.016 80 H VAL 9 HN VAL 9 18.409 -1.761 7.979 81 HA VAL 9 HA VAL 9 17.034 0.599 7.122 82 HB VAL 9 HB VAL 9 16.038 -1.768 8.690 83 1HG1 VAL 9 HG11 VAL 9 14.817 0.736 8.256 84 2HG1 VAL 9 HG12 VAL 9 14.096 -0.716 8.934 85 3HG1 VAL 9 HG13 VAL 9 14.002 -0.417 7.204 86 1HG2 VAL 9 HG21 VAL 9 16.849 -1.615 6.040 87 2HG2 VAL 9 HG22 VAL 9 15.093 -1.502 5.966 88 3HG2 VAL 9 HG23 VAL 9 15.854 -2.880 6.760 89 H ASP 10 HN ASP 10 15.742 -0.492 10.110 90 HA ASP 10 HA ASP 10 15.600 0.428 12.187 91 1HB ASP 10 HB2 ASP 10 17.958 0.592 12.463 92 2HB ASP 10 HB1 ASP 10 18.079 1.922 11.320 93 H SER 11 HN SER 11 15.783 2.323 9.318 94 HA SER 11 HA SER 11 13.935 4.298 10.460 95 1HB SER 11 HB2 SER 11 16.393 4.820 9.343 96 2HB SER 11 HB1 SER 11 15.313 5.035 7.967 97 HG SER 11 HG SER 11 15.083 6.307 10.495 98 H ASP 12 HN ASP 12 14.871 2.457 7.572 99 HA ASP 12 HA ASP 12 12.570 3.069 6.058 100 1HB ASP 12 HB2 ASP 12 14.165 0.532 5.766 101 2HB ASP 12 HB1 ASP 12 13.316 1.444 4.525 102 H SER 13 HN SER 13 11.040 1.207 5.333 103 HA SER 13 HA SER 13 9.546 0.530 7.592 104 1HB SER 13 HB2 SER 13 9.075 0.634 4.838 105 2HB SER 13 HB1 SER 13 8.639 -0.997 5.354 106 HG SER 13 HG SER 13 7.744 1.392 6.599 107 H TYR 14 HN TYR 14 12.042 -1.304 6.191 108 HA TYR 14 HA TYR 14 11.463 -3.940 6.492 109 1HB TYR 14 HB2 TYR 14 13.674 -3.620 6.090 110 2HB TYR 14 HB1 TYR 14 13.754 -2.244 7.187 111 HD1 TYR 14 HD1 TYR 14 13.560 -5.948 7.126 112 HD2 TYR 14 HD2 TYR 14 14.564 -2.497 9.383 113 HE1 TYR 14 HE1 TYR 14 14.524 -7.384 8.875 114 HE2 TYR 14 HE2 TYR 14 15.545 -3.914 11.132 115 HH TYR 14 HH TYR 14 16.485 -6.172 11.366 116 H GLN 15 HN GLN 15 12.586 -1.826 9.110 117 HA GLN 15 HA GLN 15 12.388 -3.475 11.267 118 1HB GLN 15 HB2 GLN 15 11.819 -1.198 12.503 119 2HB GLN 15 HB1 GLN 15 13.415 -1.537 11.849 120 1HG GLN 15 HG2 GLN 15 13.284 0.123 10.385 121 2HG GLN 15 HG1 GLN 15 11.652 -0.327 9.896 122 1HE2 GLN 15 HE21 GLN 15 10.233 -0.032 12.180 123 2HE2 GLN 15 HE22 GLN 15 10.246 1.619 12.688 124 H LEU 16 HN LEU 16 9.784 -1.694 9.706 125 HA LEU 16 HA LEU 16 7.844 -1.910 11.711 126 1HB LEU 16 HB2 LEU 16 7.829 -1.482 8.790 127 2HB LEU 16 HB1 LEU 16 6.344 -2.120 9.461 128 HG LEU 16 HG LEU 16 7.485 0.213 10.868 129 1HD1 LEU 16 HD11 LEU 16 7.938 0.928 8.633 130 2HD1 LEU 16 HD12 LEU 16 6.485 1.759 9.188 131 3HD1 LEU 16 HD13 LEU 16 6.352 0.390 8.084 132 1HD2 LEU 16 HD21 LEU 16 5.348 0.518 11.505 133 2HD2 LEU 16 HD22 LEU 16 5.164 -1.162 10.999 134 3HD2 LEU 16 HD23 LEU 16 4.707 0.144 9.905 135 H LEU 17 HN LEU 17 8.647 -4.095 9.046 136 HA LEU 17 HA LEU 17 6.690 -6.031 9.576 137 1HB LEU 17 HB2 LEU 17 8.734 -5.687 7.726 138 2HB LEU 17 HB1 LEU 17 9.095 -7.196 8.545 139 HG LEU 17 HG LEU 17 7.790 -7.699 6.595 140 1HD1 LEU 17 HD11 LEU 17 6.810 -8.208 9.266 141 2HD1 LEU 17 HD12 LEU 17 6.899 -9.283 7.872 142 3HD1 LEU 17 HD13 LEU 17 5.505 -8.224 8.080 143 1HD2 LEU 17 HD21 LEU 17 6.797 -5.466 6.306 144 2HD2 LEU 17 HD22 LEU 17 5.716 -5.787 7.661 145 3HD2 LEU 17 HD23 LEU 17 5.597 -6.752 6.190 146 H LYS 18 HN LYS 18 10.103 -5.909 10.535 147 HA LYS 18 HA LYS 18 9.924 -8.290 12.040 148 1HB LYS 18 HB2 LYS 18 12.173 -7.552 12.962 149 2HB LYS 18 HB1 LYS 18 12.083 -7.800 11.225 150 1HG LYS 18 HG2 LYS 18 12.726 -5.721 10.844 151 2HG LYS 18 HG1 LYS 18 11.417 -5.090 11.843 152 1HD LYS 18 HD2 LYS 18 13.382 -6.163 13.586 153 2HD LYS 18 HD1 LYS 18 14.212 -5.156 12.400 154 1HE LYS 18 HE2 LYS 18 13.165 -3.240 13.089 155 2HE LYS 18 HE1 LYS 18 11.736 -4.099 13.663 156 1HZ LYS 18 HZ1 LYS 18 12.635 -4.423 15.682 157 2HZ LYS 18 HZ2 LYS 18 13.602 -3.097 15.273 158 3HZ LYS 18 HZ3 LYS 18 14.200 -4.668 15.086 159 H ALA 19 HN ALA 19 9.293 -5.043 12.635 160 HA ALA 19 HA ALA 19 9.500 -5.002 15.435 161 1HB ALA 19 HB1 ALA 19 7.809 -3.097 15.235 162 2HB ALA 19 HB2 ALA 19 7.900 -3.360 13.493 163 3HB ALA 19 HB3 ALA 19 9.346 -2.900 14.392 164 H TYR 20 HN TYR 20 7.199 -6.347 13.254 165 HA TYR 20 HA TYR 20 5.531 -7.148 15.496 166 1HB TYR 20 HB2 TYR 20 4.302 -6.910 12.798 167 2HB TYR 20 HB1 TYR 20 3.557 -6.735 14.382 168 HD1 TYR 20 HD1 TYR 20 3.588 -5.025 11.686 169 HD2 TYR 20 HD2 TYR 20 5.355 -4.605 15.532 170 HE1 TYR 20 HE1 TYR 20 3.628 -2.601 11.380 171 HE2 TYR 20 HE2 TYR 20 5.405 -2.162 15.244 172 HH TYR 20 HH TYR 20 3.647 -0.520 13.178 173 H ASP 21 HN ASP 21 7.760 -8.400 13.499 174 HA ASP 21 HA ASP 21 7.113 -11.033 13.799 175 1HB ASP 21 HB2 ASP 21 5.438 -9.811 11.737 176 2HB ASP 21 HB1 ASP 21 6.379 -11.163 11.115 177 H VAL 22 HN VAL 22 9.370 -10.185 13.980 178 HA VAL 22 HA VAL 22 10.961 -9.620 11.757 179 HB VAL 22 HB VAL 22 11.668 -9.087 13.952 180 1HG1 VAL 22 HG11 VAL 22 12.330 -10.887 15.559 181 2HG1 VAL 22 HG12 VAL 22 11.544 -12.043 14.482 182 3HG1 VAL 22 HG13 VAL 22 10.598 -10.757 15.237 183 1HG2 VAL 22 HG21 VAL 22 13.290 -10.564 12.116 184 2HG2 VAL 22 HG22 VAL 22 13.807 -10.950 13.759 185 3HG2 VAL 22 HG23 VAL 22 13.769 -9.272 13.219 186 H ASN 23 HN ASN 23 9.876 -11.196 10.415 187 HA ASN 23 HA ASN 23 11.555 -13.518 9.996 188 1HB ASN 23 HB2 ASN 23 9.317 -13.972 11.376 189 2HB ASN 23 HB1 ASN 23 8.618 -13.929 9.764 190 1HD2 ASN 23 HD21 ASN 23 10.166 -15.818 12.057 191 2HD2 ASN 23 HD22 ASN 23 10.536 -17.183 11.065 192 H ILE 24 HN ILE 24 11.945 -11.566 8.533 193 HA ILE 24 HA ILE 24 10.374 -11.836 6.170 194 HB ILE 24 HB ILE 24 10.588 -9.574 5.649 195 1HG1 ILE 24 HG12 ILE 24 12.580 -8.956 6.690 196 2HG1 ILE 24 HG11 ILE 24 11.296 -7.924 7.335 197 1HG2 ILE 24 HG21 ILE 24 8.551 -9.522 6.515 198 2HG2 ILE 24 HG22 ILE 24 9.292 -8.815 7.947 199 3HG2 ILE 24 HG23 ILE 24 9.039 -10.557 7.855 200 1HD1 ILE 24 HD11 ILE 24 12.183 -8.476 9.307 201 2HD1 ILE 24 HD12 ILE 24 12.981 -9.909 8.645 202 3HD1 ILE 24 HD13 ILE 24 11.255 -9.970 9.082 203 H SER 25 HN SER 25 13.450 -11.338 7.593 204 HA SER 25 HA SER 25 15.027 -10.558 5.549 205 1HB SER 25 HB2 SER 25 16.578 -12.584 6.501 206 2HB SER 25 HB1 SER 25 16.405 -11.024 7.303 207 HG SER 25 HG SER 25 15.984 -13.131 8.507 208 H GLY 26 HN GLY 26 13.679 -13.753 6.136 209 1HA GLY 26 HA2 GLY 26 14.710 -14.963 3.746 210 2HA GLY 26 HA1 GLY 26 13.409 -15.594 4.757 211 H LEU 27 HN LEU 27 11.818 -13.217 4.675 212 HA LEU 27 HA LEU 27 10.209 -13.662 2.453 213 1HB LEU 27 HB2 LEU 27 9.383 -12.651 4.486 214 2HB LEU 27 HB1 LEU 27 10.493 -11.302 4.301 215 HG LEU 27 HG LEU 27 8.651 -11.677 2.044 216 1HD1 LEU 27 HD11 LEU 27 6.963 -10.328 3.600 217 2HD1 LEU 27 HD12 LEU 27 7.696 -11.364 4.826 218 3HD1 LEU 27 HD13 LEU 27 6.901 -12.083 3.424 219 1HD2 LEU 27 HD21 LEU 27 10.373 -9.784 2.839 220 2HD2 LEU 27 HD22 LEU 27 8.890 -9.166 3.573 221 3HD2 LEU 27 HD23 LEU 27 8.961 -9.449 1.833 222 H VAL 28 HN VAL 28 12.708 -11.227 3.159 223 HA VAL 28 HA VAL 28 12.541 -9.502 1.073 224 HB VAL 28 HB VAL 28 14.932 -10.828 2.324 225 1HG1 VAL 28 HG11 VAL 28 16.138 -10.179 0.550 226 2HG1 VAL 28 HG12 VAL 28 15.982 -8.571 1.265 227 3HG1 VAL 28 HG13 VAL 28 14.882 -9.071 -0.020 228 1HG2 VAL 28 HG21 VAL 28 15.104 -8.832 3.595 229 2HG2 VAL 28 HG22 VAL 28 13.408 -9.340 3.634 230 3HG2 VAL 28 HG23 VAL 28 13.913 -8.016 2.580 231 H SER 29 HN SER 29 14.390 -12.534 0.974 232 HA SER 29 HA SER 29 14.783 -12.520 -1.820 233 1HB SER 29 HB2 SER 29 15.488 -14.887 -1.478 234 2HB SER 29 HB1 SER 29 16.293 -13.749 -0.398 235 HG SER 29 HG SER 29 14.341 -15.676 0.169 236 H THR 30 HN THR 30 12.073 -13.446 0.120 237 HA THR 30 HA THR 30 10.974 -15.334 -1.733 238 HB THR 30 HB THR 30 9.753 -13.832 0.592 239 HG1 THR 30 HG1 THR 30 10.253 -15.541 1.718 240 1HG2 THR 30 HG21 THR 30 8.238 -14.841 -1.428 241 2HG2 THR 30 HG22 THR 30 7.723 -14.693 0.254 242 3HG2 THR 30 HG23 THR 30 8.360 -16.226 -0.341 243 H THR 31 HN THR 31 10.407 -11.954 -0.883 244 HA THR 31 HA THR 31 8.353 -11.440 -2.666 245 HB THR 31 HB THR 31 10.540 -9.522 -1.854 246 HG1 THR 31 HG1 THR 31 9.751 -9.768 0.057 247 1HG2 THR 31 HG21 THR 31 9.203 -8.562 -3.586 248 2HG2 THR 31 HG22 THR 31 8.774 -7.811 -2.046 249 3HG2 THR 31 HG23 THR 31 7.717 -9.032 -2.759 250 H MET 32 HN MET 32 11.694 -11.904 -3.144 251 HA MET 32 HA MET 32 11.821 -10.717 -5.757 252 1HB MET 32 HB2 MET 32 13.936 -12.634 -5.025 253 2HB MET 32 HB1 MET 32 14.062 -11.015 -5.680 254 1HG MET 32 HG2 MET 32 13.403 -11.571 -2.805 255 2HG MET 32 HG1 MET 32 15.020 -11.360 -3.403 256 1HE MET 32 HE1 MET 32 16.114 -8.915 -3.909 257 2HE MET 32 HE2 MET 32 15.921 -9.671 -2.322 258 3HE MET 32 HE3 MET 32 15.556 -7.951 -2.530 259 H GLN 33 HN GLN 33 11.098 -13.823 -4.403 260 HA GLN 33 HA GLN 33 11.613 -15.378 -6.722 261 1HB GLN 33 HB2 GLN 33 11.220 -16.148 -4.282 262 2HB GLN 33 HB1 GLN 33 9.513 -16.069 -4.693 263 1HG GLN 33 HG2 GLN 33 10.996 -17.509 -6.700 264 2HG GLN 33 HG1 GLN 33 11.253 -18.200 -5.099 265 1HE2 GLN 33 HE21 GLN 33 9.915 -19.786 -4.672 266 2HE2 GLN 33 HE22 GLN 33 8.271 -19.910 -5.187 267 H ASN 34 HN ASN 34 8.744 -13.792 -5.408 268 HA ASN 34 HA ASN 34 6.961 -14.603 -7.460 269 1HB ASN 34 HB2 ASN 34 6.198 -13.747 -5.260 270 2HB ASN 34 HB1 ASN 34 6.867 -12.166 -5.652 271 1HD2 ASN 34 HD21 ASN 34 5.125 -10.917 -5.788 272 2HD2 ASN 34 HD22 ASN 34 3.780 -11.194 -6.837 273 H GLU 35 HN GLU 35 9.019 -11.780 -6.980 274 HA GLU 35 HA GLU 35 8.251 -10.495 -9.407 275 1HB GLU 35 HB2 GLU 35 10.317 -10.119 -7.324 276 2HB GLU 35 HB1 GLU 35 10.780 -9.575 -8.930 277 1HG GLU 35 HG2 GLU 35 9.859 -7.710 -7.824 278 2HG GLU 35 HG1 GLU 35 8.648 -8.252 -8.985 279 H ALA 36 HN ALA 36 10.739 -12.741 -8.388 280 HA ALA 36 HA ALA 36 12.321 -12.907 -10.660 281 1HB ALA 36 HB1 ALA 36 13.219 -14.164 -9.000 282 2HB ALA 36 HB2 ALA 36 12.362 -15.453 -9.846 283 3HB ALA 36 HB3 ALA 36 11.647 -14.709 -8.416 284 H ARG 37 HN ARG 37 9.453 -14.813 -9.787 285 HA ARG 37 HA ARG 37 9.219 -16.266 -12.172 286 1HB ARG 37 HB2 ARG 37 7.585 -15.708 -9.861 287 2HB ARG 37 HB1 ARG 37 6.629 -15.735 -11.338 288 1HG ARG 37 HG2 ARG 37 8.294 -17.933 -10.143 289 2HG ARG 37 HG1 ARG 37 6.561 -17.924 -10.473 290 1HD ARG 37 HD2 ARG 37 7.320 -17.582 -12.942 291 2HD ARG 37 HD1 ARG 37 8.856 -18.227 -12.364 292 HE ARG 37 HE ARG 37 6.473 -19.696 -12.873 293 1HH1 ARG 37 HH11 ARG 37 9.260 -19.568 -10.777 294 2HH1 ARG 37 HH12 ARG 37 9.233 -21.265 -10.431 295 1HH2 ARG 37 HH21 ARG 37 6.436 -21.928 -12.418 296 2HH2 ARG 37 HH22 ARG 37 7.632 -22.605 -11.363 297 H ARG 38 HN ARG 38 7.606 -13.372 -11.048 298 HA ARG 38 HA ARG 38 6.095 -12.830 -13.246 299 1HB ARG 38 HB2 ARG 38 6.304 -11.626 -10.925 300 2HB ARG 38 HB1 ARG 38 7.377 -10.543 -11.801 301 1HG ARG 38 HG2 ARG 38 5.428 -10.364 -13.490 302 2HG ARG 38 HG1 ARG 38 4.449 -11.005 -12.169 303 1HD ARG 38 HD2 ARG 38 6.273 -8.726 -11.600 304 2HD ARG 38 HD1 ARG 38 4.796 -8.406 -12.507 305 HE ARG 38 HE ARG 38 5.013 -9.081 -9.716 306 1HH1 ARG 38 HH11 ARG 38 2.916 -9.031 -12.505 307 2HH1 ARG 38 HH12 ARG 38 1.461 -9.009 -11.566 308 1HH2 ARG 38 HH21 ARG 38 3.101 -9.054 -8.480 309 2HH2 ARG 38 HH22 ARG 38 1.566 -9.022 -9.281 310 H LEU 39 HN LEU 39 9.379 -11.464 -12.620 311 HA LEU 39 HA LEU 39 9.700 -9.980 -14.890 312 1HB LEU 39 HB2 LEU 39 11.721 -11.671 -13.427 313 2HB LEU 39 HB1 LEU 39 12.140 -10.452 -14.616 314 HG LEU 39 HG LEU 39 11.994 -8.831 -13.139 315 1HD1 LEU 39 HD11 LEU 39 9.451 -9.067 -13.233 316 2HD1 LEU 39 HD12 LEU 39 10.182 -8.160 -11.915 317 3HD1 LEU 39 HD13 LEU 39 9.628 -9.804 -11.645 318 1HD2 LEU 39 HD21 LEU 39 13.284 -10.085 -11.702 319 2HD2 LEU 39 HD22 LEU 39 11.970 -11.208 -11.363 320 3HD2 LEU 39 HD23 LEU 39 11.945 -9.591 -10.665 321 H ARG 40 HN ARG 40 8.840 -10.820 -16.744 322 HA ARG 40 HA ARG 40 10.482 -12.456 -18.340 323 1HB ARG 40 HB2 ARG 40 9.063 -14.003 -16.619 324 2HB ARG 40 HB1 ARG 40 7.939 -13.915 -17.968 325 1HG ARG 40 HG2 ARG 40 10.644 -14.470 -18.845 326 2HG ARG 40 HG1 ARG 40 10.056 -15.668 -17.691 327 1HD ARG 40 HD2 ARG 40 7.893 -15.372 -19.316 328 2HD ARG 40 HD1 ARG 40 9.219 -15.130 -20.453 329 HE ARG 40 HE ARG 40 9.679 -17.358 -20.312 330 1HH1 ARG 40 HH11 ARG 40 7.772 -16.450 -17.534 331 2HH1 ARG 40 HH12 ARG 40 7.600 -18.076 -16.964 332 1HH2 ARG 40 HH21 ARG 40 9.453 -19.498 -19.563 333 2HH2 ARG 40 HH22 ARG 40 8.554 -19.807 -18.115 334 H ALA 41 HN ALA 41 9.987 -10.393 -19.426 335 HA ALA 41 HA ALA 41 9.045 -9.294 -21.186 336 1HB ALA 41 HB1 ALA 41 6.925 -11.276 -21.699 337 2HB ALA 41 HB2 ALA 41 8.581 -11.876 -21.796 338 3HB ALA 41 HB3 ALA 41 8.072 -10.523 -22.807 339 H GLU 42 HN GLU 42 7.986 -9.205 -18.377 340 HA GLU 42 HA GLU 42 5.779 -7.481 -18.903 341 1HB GLU 42 HB2 GLU 42 5.322 -10.241 -17.962 342 2HB GLU 42 HB1 GLU 42 4.453 -8.988 -17.087 343 1HG GLU 42 HG2 GLU 42 3.726 -8.166 -19.411 344 2HG GLU 42 HG1 GLU 42 4.251 -9.753 -19.971 345 H ARG 43 HN ARG 43 5.137 -6.261 -17.043 346 HA ARG 43 HA ARG 43 6.881 -6.588 -14.699 347 1HB ARG 43 HB2 ARG 43 7.756 -4.798 -16.183 348 2HB ARG 43 HB1 ARG 43 6.229 -3.944 -16.011 349 1HG ARG 43 HG2 ARG 43 6.793 -3.104 -14.025 350 2HG ARG 43 HG1 ARG 43 7.442 -4.643 -13.457 351 1HD ARG 43 HD2 ARG 43 8.868 -2.756 -15.328 352 2HD ARG 43 HD1 ARG 43 9.142 -2.843 -13.589 353 HE ARG 43 HE ARG 43 10.175 -4.607 -15.577 354 1HH1 ARG 43 HH11 ARG 43 9.109 -4.451 -12.257 355 2HH1 ARG 43 HH12 ARG 43 10.085 -5.787 -11.750 356 1HH2 ARG 43 HH21 ARG 43 11.460 -6.366 -14.911 357 2HH2 ARG 43 HH22 ARG 43 11.421 -6.874 -13.256 358 H TRP 44 HN TRP 44 4.317 -4.310 -15.684 359 HA TRP 44 HA TRP 44 2.681 -5.274 -13.450 360 1HB TRP 44 HB2 TRP 44 3.790 -2.543 -13.819 361 2HB TRP 44 HB1 TRP 44 2.121 -2.655 -13.270 362 HD1 TRP 44 HD1 TRP 44 5.393 -4.495 -12.233 363 HE1 TRP 44 HE1 TRP 44 5.511 -4.488 -9.662 364 HE3 TRP 44 HE3 TRP 44 1.074 -1.951 -11.229 365 HZ2 TRP 44 HZ2 TRP 44 3.976 -3.530 -7.495 366 HZ3 TRP 44 HZ3 TRP 44 0.471 -1.531 -8.880 367 HH2 TRP 44 HH2 TRP 44 1.893 -2.306 -7.053 368 H LYS 45 HN LYS 45 2.369 -2.513 -15.660 369 HA LYS 45 HA LYS 45 0.802 -1.958 -17.207 370 1HB LYS 45 HB2 LYS 45 0.507 -4.960 -17.356 371 2HB LYS 45 HB1 LYS 45 -0.330 -3.848 -18.430 372 1HG LYS 45 HG2 LYS 45 2.661 -4.064 -18.155 373 2HG LYS 45 HG1 LYS 45 1.696 -4.803 -19.434 374 1HD LYS 45 HD2 LYS 45 1.650 -2.899 -20.590 375 2HD LYS 45 HD1 LYS 45 1.084 -1.996 -19.185 376 1HE LYS 45 HE2 LYS 45 3.964 -2.776 -19.540 377 2HE LYS 45 HE1 LYS 45 3.305 -1.284 -20.210 378 1HZ LYS 45 HZ1 LYS 45 3.349 -2.055 -17.342 379 2HZ LYS 45 HZ2 LYS 45 2.617 -0.658 -17.953 380 3HZ LYS 45 HZ3 LYS 45 4.292 -0.857 -18.076 381 H VAL 46 HN VAL 46 -0.869 -4.822 -15.936 382 HA VAL 46 HA VAL 46 -3.087 -3.069 -15.139 383 HB VAL 46 HB VAL 46 -3.149 -6.072 -15.442 384 1HG1 VAL 46 HG11 VAL 46 -5.669 -5.253 -15.844 385 2HG1 VAL 46 HG12 VAL 46 -5.122 -3.986 -14.746 386 3HG1 VAL 46 HG13 VAL 46 -5.034 -5.677 -14.254 387 1HG2 VAL 46 HG21 VAL 46 -4.563 -5.185 -17.550 388 2HG2 VAL 46 HG22 VAL 46 -2.850 -5.596 -17.632 389 3HG2 VAL 46 HG23 VAL 46 -3.345 -3.914 -17.445 390 H GLU 47 HN GLU 47 -3.073 -2.519 -13.062 391 HA GLU 47 HA GLU 47 -3.122 -4.479 -11.003 392 1HB GLU 47 HB2 GLU 47 -0.565 -3.765 -11.748 393 2HB GLU 47 HB1 GLU 47 -0.882 -2.697 -10.388 394 1HG GLU 47 HG2 GLU 47 -1.444 -5.623 -10.176 395 2HG GLU 47 HG1 GLU 47 0.194 -5.005 -9.971 396 H ASN 48 HN ASN 48 -2.360 -1.060 -11.635 397 HA ASN 48 HA ASN 48 -3.441 -0.088 -9.212 398 1HB ASN 48 HB2 ASN 48 -1.931 1.011 -11.170 399 2HB ASN 48 HB1 ASN 48 -3.500 1.706 -11.566 400 1HD2 ASN 48 HD21 ASN 48 -4.694 2.511 -9.522 401 2HD2 ASN 48 HD22 ASN 48 -3.745 3.488 -8.459 402 H GLN 49 HN GLN 49 -5.486 0.096 -8.595 403 HA GLN 49 HA GLN 49 -7.563 0.466 -10.639 404 1HB GLN 49 HB2 GLN 49 -7.813 -1.408 -8.281 405 2HB GLN 49 HB1 GLN 49 -9.027 -1.116 -9.519 406 1HG GLN 49 HG2 GLN 49 -7.598 -2.112 -11.199 407 2HG GLN 49 HG1 GLN 49 -6.320 -2.338 -10.005 408 1HE2 GLN 49 HE21 GLN 49 -9.817 -2.927 -9.936 409 2HE2 GLN 49 HE22 GLN 49 -9.702 -4.595 -9.503 410 H GLU 50 HN GLU 50 -9.093 1.935 -10.143 411 HA GLU 50 HA GLU 50 -10.210 3.579 -9.040 412 1HB GLU 50 HB2 GLU 50 -9.916 1.455 -7.129 413 2HB GLU 50 HB1 GLU 50 -9.787 3.001 -6.302 414 1HG GLU 50 HG2 GLU 50 -11.921 3.678 -7.408 415 2HG GLU 50 HG1 GLU 50 -12.064 2.026 -8.006 416 H GLY 51 HN GLY 51 -7.799 2.975 -6.507 417 1HA GLY 51 HA2 GLY 51 -5.812 4.208 -6.135 418 2HA GLY 51 HA1 GLY 51 -6.385 5.424 -7.268 419 H MET 52 HN MET 52 -9.063 5.440 -5.943 420 HA MET 52 HA MET 52 -8.302 7.175 -3.700 421 1HB MET 52 HB2 MET 52 -10.601 8.115 -3.957 422 2HB MET 52 HB1 MET 52 -9.579 8.332 -5.371 423 1HG MET 52 HG2 MET 52 -10.699 6.598 -6.548 424 2HG MET 52 HG1 MET 52 -11.576 6.104 -5.101 425 1HE MET 52 HE1 MET 52 -13.455 6.352 -7.416 426 2HE MET 52 HE2 MET 52 -14.689 7.442 -6.783 427 3HE MET 52 HE3 MET 52 -13.969 6.221 -5.734 428 H VAL 53 HN VAL 53 -8.883 6.717 -1.664 429 HA VAL 53 HA VAL 53 -11.052 4.859 -1.122 430 HB VAL 53 HB VAL 53 -9.533 3.579 0.490 431 1HG1 VAL 53 HG11 VAL 53 -9.244 3.279 -2.494 432 2HG1 VAL 53 HG12 VAL 53 -10.440 2.510 -1.451 433 3HG1 VAL 53 HG13 VAL 53 -8.739 2.063 -1.322 434 1HG2 VAL 53 HG21 VAL 53 -7.244 3.663 0.298 435 2HG2 VAL 53 HG22 VAL 53 -7.663 5.352 0.011 436 3HG2 VAL 53 HG23 VAL 53 -7.297 4.292 -1.349 437 H GLU 54 HN GLU 54 -12.093 6.562 -0.092 438 HA GLU 54 HA GLU 54 -12.692 7.894 1.651 439 1HB GLU 54 HB2 GLU 54 -11.558 5.627 2.781 440 2HB GLU 54 HB1 GLU 54 -10.732 6.949 3.593 441 1HG GLU 54 HG2 GLU 54 -13.719 6.633 3.404 442 2HG GLU 54 HG1 GLU 54 -12.732 6.181 4.793 443 H VAL 55 HN VAL 55 -12.031 9.873 0.933 444 HA VAL 55 HA VAL 55 -9.275 10.698 1.365 445 HB VAL 55 HB VAL 55 -11.505 12.304 0.148 446 1HG1 VAL 55 HG11 VAL 55 -9.243 13.182 -1.024 447 2HG1 VAL 55 HG12 VAL 55 -8.615 12.721 0.558 448 3HG1 VAL 55 HG13 VAL 55 -9.926 13.894 0.438 449 1HG2 VAL 55 HG21 VAL 55 -10.887 11.544 -1.999 450 2HG2 VAL 55 HG22 VAL 55 -11.021 10.095 -1.002 451 3HG2 VAL 55 HG23 VAL 55 -9.432 10.757 -1.387 452 H ALA 56 HN ALA 56 -11.954 10.608 3.152 453 HA ALA 56 HA ALA 56 -12.705 11.633 5.045 454 1HB ALA 56 HB1 ALA 56 -10.049 11.322 5.350 455 2HB ALA 56 HB2 ALA 56 -11.101 12.009 6.587 456 3HB ALA 56 HB3 ALA 56 -10.177 13.072 5.526 457 H ARG 57 HN ARG 57 -14.214 13.051 4.248 458 HA ARG 57 HA ARG 57 -13.428 15.621 3.190 459 1HB ARG 57 HB2 ARG 57 -15.881 16.013 3.027 460 2HB ARG 57 HB1 ARG 57 -15.346 14.555 2.202 461 1HG ARG 57 HG2 ARG 57 -16.064 13.926 4.903 462 2HG ARG 57 HG1 ARG 57 -17.377 14.807 4.119 463 1HD ARG 57 HD2 ARG 57 -16.104 12.674 2.525 464 2HD ARG 57 HD1 ARG 57 -17.035 12.143 3.925 465 HE ARG 57 HE ARG 57 -18.710 13.871 2.698 466 1HH1 ARG 57 HH11 ARG 57 -16.899 11.110 1.569 467 2HH1 ARG 57 HH12 ARG 57 -18.052 10.697 0.345 468 1HH2 ARG 57 HH21 ARG 57 -20.228 13.330 1.089 469 2HH2 ARG 57 HH22 ARG 57 -19.942 11.957 0.072 470 H PHE 58 HN PHE 58 -15.046 17.475 4.103 471 HA PHE 58 HA PHE 58 -15.108 17.453 7.010 472 1HB PHE 58 HB2 PHE 58 -12.841 18.387 5.933 473 2HB PHE 58 HB1 PHE 58 -13.812 19.850 5.827 474 HD1 PHE 58 HD1 PHE 58 -11.288 18.957 7.583 475 HD2 PHE 58 HD2 PHE 58 -15.442 19.525 8.314 476 HE1 PHE 58 HE1 PHE 58 -10.802 19.445 9.945 477 HE2 PHE 58 HE2 PHE 58 -14.964 20.014 10.675 478 HZ PHE 58 HZ PHE 58 -12.642 19.976 11.494 479 H ILE 59 HN ILE 59 -17.168 17.479 5.080 480 HA ILE 59 HA ILE 59 -18.317 20.150 5.561 481 HB ILE 59 HB ILE 59 -18.901 18.412 3.162 482 1HG1 ILE 59 HG12 ILE 59 -17.562 21.009 2.774 483 2HG1 ILE 59 HG11 ILE 59 -16.574 19.786 3.568 484 1HG2 ILE 59 HG21 ILE 59 -20.465 19.905 2.546 485 2HG2 ILE 59 HG22 ILE 59 -19.528 21.281 3.128 486 3HG2 ILE 59 HG23 ILE 59 -20.479 20.320 4.260 487 1HD1 ILE 59 HD11 ILE 59 -17.824 18.523 1.392 488 2HD1 ILE 59 HD12 ILE 59 -16.119 18.930 1.587 489 3HD1 ILE 59 HD13 ILE 59 -17.215 20.072 0.809 490 H GLU 60 HN GLU 60 -19.422 16.931 4.481 491 HA GLU 60 HA GLU 60 -21.331 15.773 4.963 492 1HB GLU 60 HB2 GLU 60 -21.474 15.094 7.254 493 2HB GLU 60 HB1 GLU 60 -19.775 15.292 6.847 494 1HG GLU 60 HG2 GLU 60 -19.648 17.351 8.028 495 2HG GLU 60 HG1 GLU 60 -21.396 17.401 8.247 496 H MET 61 HN MET 61 -21.813 18.555 4.380 497 HA MET 61 HA MET 61 -23.514 20.063 4.403 498 1HB MET 61 HB2 MET 61 -24.849 17.609 5.488 499 2HB MET 61 HB1 MET 61 -25.726 19.132 5.444 500 1HG MET 61 HG2 MET 61 -25.370 19.274 3.035 501 2HG MET 61 HG1 MET 61 -24.481 17.752 3.076 502 1HE MET 61 HE1 MET 61 -27.399 19.478 2.302 503 2HE MET 61 HE2 MET 61 -28.738 18.331 2.262 504 3HE MET 61 HE3 MET 61 -27.387 18.147 1.144 505 H ASN 62 HN ASN 62 -22.834 21.680 5.704 506 HA ASN 62 HA ASN 62 -22.741 21.437 8.558 507 1HB ASN 62 HB2 ASN 62 -22.113 23.819 8.518 508 2HB ASN 62 HB1 ASN 62 -21.156 22.877 7.378 509 1HD2 ASN 62 HD21 ASN 62 -23.872 25.080 7.678 510 2HD2 ASN 62 HD22 ASN 62 -23.796 25.690 6.063 511 H GLY 63 HN GLY 63 -25.044 22.606 6.218 512 1HA GLY 63 HA2 GLY 63 -26.628 24.151 8.005 513 2HA GLY 63 HA1 GLY 63 -27.136 23.535 6.440 514 H SER 64 HN SER 64 -26.496 22.421 9.759 515 HA SER 64 HA SER 64 -29.021 20.979 9.730 516 1HB SER 64 HB2 SER 64 -27.983 18.878 10.515 517 2HB SER 64 HB1 SER 64 -27.439 19.310 8.894 518 HG SER 64 HG SER 64 -25.771 18.641 10.446 519 H PHE 65 HN PHE 65 -29.994 21.762 11.476 520 HA PHE 65 HA PHE 65 -28.513 21.777 14.011 521 1HB PHE 65 HB2 PHE 65 -30.252 24.014 12.954 522 2HB PHE 65 HB1 PHE 65 -29.681 23.909 14.616 523 HD1 PHE 65 HD1 PHE 65 -27.526 24.629 15.208 524 HD2 PHE 65 HD2 PHE 65 -28.577 24.234 11.103 525 HE1 PHE 65 HE1 PHE 65 -25.449 25.783 14.570 526 HE2 PHE 65 HE2 PHE 65 -26.501 25.386 10.457 527 HZ PHE 65 HZ PHE 65 -24.934 26.162 12.192 528 H ALA 66 HN ALA 66 -29.747 21.381 15.860 529 HA ALA 66 HA ALA 66 -32.601 20.894 15.564 530 1HB ALA 66 HB1 ALA 66 -31.101 18.667 16.822 531 2HB ALA 66 HB2 ALA 66 -31.066 18.784 15.063 532 3HB ALA 66 HB3 ALA 66 -32.608 18.646 15.906 533 H ASP 67 HN ASP 67 -30.945 22.780 17.044 534 HA ASP 67 HA ASP 67 -32.123 22.351 19.660 535 1HB ASP 67 HB2 ASP 67 -29.210 22.188 19.132 536 2HB ASP 67 HB1 ASP 67 -29.694 23.139 20.533 537 H GLU 68 HN GLU 68 -32.517 24.205 17.465 538 HA GLU 68 HA GLU 68 -32.912 26.418 17.122 539 1HB GLU 68 HB2 GLU 68 -32.412 26.635 20.097 540 2HB GLU 68 HB1 GLU 68 -33.183 27.855 19.093 541 1HG GLU 68 HG2 GLU 68 -34.242 25.079 19.576 542 2HG GLU 68 HG1 GLU 68 -34.793 26.542 20.392 543 H ASN 69 HN ASN 69 -30.828 26.284 15.940 544 HA ASN 69 HA ASN 69 -29.082 28.407 16.833 545 1HB ASN 69 HB2 ASN 69 -28.328 25.602 17.080 546 2HB ASN 69 HB1 ASN 69 -27.196 26.509 16.081 547 1HD2 ASN 69 HD21 ASN 69 -26.223 28.407 16.993 548 2HD2 ASN 69 HD22 ASN 69 -25.990 28.518 18.702 549 H LYS 70 HN LYS 70 -27.507 29.044 15.157 550 HA LYS 70 HA LYS 70 -27.452 28.001 12.570 551 1HB LYS 70 HB2 LYS 70 -29.762 29.713 13.160 552 2HB LYS 70 HB1 LYS 70 -28.802 30.298 11.808 553 1HG LYS 70 HG2 LYS 70 -29.362 28.559 10.474 554 2HG LYS 70 HG1 LYS 70 -29.471 27.420 11.817 555 1HD LYS 70 HD2 LYS 70 -31.683 27.640 11.812 556 2HD LYS 70 HD1 LYS 70 -31.508 29.358 12.176 557 1HE LYS 70 HE2 LYS 70 -31.803 29.989 10.005 558 2HE LYS 70 HE1 LYS 70 -31.104 28.502 9.364 559 1HZ LYS 70 HZ1 LYS 70 -33.208 27.408 10.286 560 2HZ LYS 70 HZ2 LYS 70 -33.347 28.323 8.870 561 3HZ LYS 70 HZ3 LYS 70 -33.846 28.975 10.349 562 H ASP 71 HN ASP 71 -25.680 28.907 14.399 563 HA ASP 71 HA ASP 71 -24.927 31.433 14.504 564 1HB ASP 71 HB2 ASP 71 -23.889 29.100 15.390 565 2HB ASP 71 HB1 ASP 71 -22.699 29.527 14.165 566 H TRP 72 HN TRP 72 -22.775 32.123 13.618 567 HA TRP 72 HA TRP 72 -21.960 31.549 10.994 568 1HB TRP 72 HB2 TRP 72 -24.348 33.015 11.062 569 2HB TRP 72 HB1 TRP 72 -23.099 34.193 10.675 570 HD1 TRP 72 HD1 TRP 72 -25.193 31.538 9.125 571 HE1 TRP 72 HE1 TRP 72 -24.482 31.162 6.680 572 HE3 TRP 72 HE3 TRP 72 -20.806 34.163 9.141 573 HZ2 TRP 72 HZ2 TRP 72 -22.345 31.882 4.983 574 HZ3 TRP 72 HZ3 TRP 72 -19.488 34.270 7.066 575 HH2 TRP 72 HH2 TRP 72 -20.243 33.153 5.031 576 1H MET 101 HT1 MET 101 21.258 6.241 14.048 577 2H MET 101 HT2 MET 101 22.789 5.471 14.141 578 3H MET 101 HT3 MET 101 22.136 6.258 15.519 579 HA MET 101 HA MET 101 22.003 3.801 15.498 580 1HB MET 101 HB2 MET 101 20.667 5.311 16.933 581 2HB MET 101 HB1 MET 101 19.443 5.406 15.675 582 1HG MET 101 HG2 MET 101 19.224 2.900 15.877 583 2HG MET 101 HG1 MET 101 20.216 3.024 17.328 584 1HE MET 101 HE1 MET 101 18.437 1.955 18.897 585 2HE MET 101 HE2 MET 101 17.412 1.663 17.491 586 3HE MET 101 HE3 MET 101 16.737 2.425 18.932 587 H LYS 102 HN LYS 102 22.193 2.536 13.700 588 HA LYS 102 HA LYS 102 19.838 2.401 11.933 589 1HB LYS 102 HB2 LYS 102 22.531 2.895 11.245 590 2HB LYS 102 HB1 LYS 102 22.177 1.260 10.707 591 1HG LYS 102 HG2 LYS 102 21.197 2.099 8.913 592 2HG LYS 102 HG1 LYS 102 19.974 2.832 9.953 593 1HD LYS 102 HD2 LYS 102 20.881 4.592 8.655 594 2HD LYS 102 HD1 LYS 102 21.580 4.760 10.267 595 1HE LYS 102 HE2 LYS 102 23.173 3.052 8.539 596 2HE LYS 102 HE1 LYS 102 22.963 4.670 7.872 597 1HZ LYS 102 HZ1 LYS 102 24.890 4.129 9.538 598 2HZ LYS 102 HZ2 LYS 102 23.693 4.421 10.697 599 3HZ LYS 102 HZ3 LYS 102 24.099 5.625 9.581 600 H GLN 103 HN GLN 103 19.347 0.266 11.051 601 HA GLN 103 HA GLN 103 20.268 -1.902 12.807 602 1HB GLN 103 HB2 GLN 103 17.951 -1.390 13.267 603 2HB GLN 103 HB1 GLN 103 17.556 -1.434 11.553 604 1HG GLN 103 HG2 GLN 103 16.789 -3.449 12.447 605 2HG GLN 103 HG1 GLN 103 18.268 -3.832 11.573 606 1HE2 GLN 103 HE21 GLN 103 18.564 -5.724 12.764 607 2HE2 GLN 103 HE22 GLN 103 19.103 -5.696 14.405 608 H ARG 104 HN ARG 104 21.438 -3.367 11.771 609 HA ARG 104 HA ARG 104 21.411 -3.434 8.874 610 1HB ARG 104 HB2 ARG 104 23.472 -3.547 10.492 611 2HB ARG 104 HB1 ARG 104 23.089 -5.262 10.540 612 1HG ARG 104 HG2 ARG 104 23.430 -5.490 8.188 613 2HG ARG 104 HG1 ARG 104 23.547 -3.730 7.989 614 1HD ARG 104 HD2 ARG 104 25.520 -3.904 9.644 615 2HD ARG 104 HD1 ARG 104 25.503 -5.621 9.257 616 HE ARG 104 HE ARG 104 26.199 -3.427 7.455 617 1HH1 ARG 104 HH11 ARG 104 25.768 -6.862 7.940 618 2HH1 ARG 104 HH12 ARG 104 26.709 -7.297 6.555 619 1HH2 ARG 104 HH21 ARG 104 27.436 -4.006 5.638 620 2HH2 ARG 104 HH22 ARG 104 27.654 -5.680 5.249 621 H ILE 105 HN ILE 105 19.704 -4.525 8.068 622 HA ILE 105 HA ILE 105 19.079 -7.168 9.191 623 HB ILE 105 HB ILE 105 16.960 -6.699 8.655 624 1HG1 ILE 105 HG12 ILE 105 17.878 -6.383 5.788 625 2HG1 ILE 105 HG11 ILE 105 17.459 -7.904 6.559 626 1HG2 ILE 105 HG21 ILE 105 17.701 -4.303 7.025 627 2HG2 ILE 105 HG22 ILE 105 17.825 -4.300 8.781 628 3HG2 ILE 105 HG23 ILE 105 16.273 -4.571 8.009 629 1HD1 ILE 105 HD11 ILE 105 15.548 -5.601 6.143 630 2HD1 ILE 105 HD12 ILE 105 15.158 -7.198 6.785 631 3HD1 ILE 105 HD13 ILE 105 15.668 -7.025 5.107 632 H THR 106 HN THR 106 20.363 -8.724 8.413 633 HA THR 106 HA THR 106 21.137 -8.491 5.592 634 HB THR 106 HB THR 106 23.106 -8.268 6.706 635 HG1 THR 106 HG1 THR 106 23.131 -10.124 5.278 636 1HG2 THR 106 HG21 THR 106 22.887 -8.540 8.939 637 2HG2 THR 106 HG22 THR 106 23.677 -10.072 8.565 638 3HG2 THR 106 HG23 THR 106 21.927 -10.011 8.778 639 H VAL 107 HN VAL 107 20.066 -9.738 4.399 640 HA VAL 107 HA VAL 107 19.442 -12.472 5.277 641 HB VAL 107 HB VAL 107 17.370 -11.750 4.540 642 1HG1 VAL 107 HG11 VAL 107 17.838 -10.536 1.967 643 2HG1 VAL 107 HG12 VAL 107 18.686 -9.680 3.251 644 3HG1 VAL 107 HG13 VAL 107 16.953 -9.930 3.366 645 1HG2 VAL 107 HG21 VAL 107 18.696 -13.539 2.813 646 2HG2 VAL 107 HG22 VAL 107 17.724 -12.477 1.789 647 3HG2 VAL 107 HG23 VAL 107 16.964 -13.380 3.096 648 H THR 108 HN THR 108 21.586 -13.176 4.991 649 HA THR 108 HA THR 108 23.053 -12.848 2.645 650 HB THR 108 HB THR 108 23.267 -14.425 5.070 651 HG1 THR 108 HG1 THR 108 25.003 -13.295 5.009 652 1HG2 THR 108 HG21 THR 108 24.994 -16.000 4.026 653 2HG2 THR 108 HG22 THR 108 24.110 -15.746 2.522 654 3HG2 THR 108 HG23 THR 108 23.291 -16.445 3.919 655 H VAL 109 HN VAL 109 21.971 -13.163 0.802 656 HA VAL 109 HA VAL 109 20.364 -15.520 0.422 657 HB VAL 109 HB VAL 109 20.938 -13.246 -1.471 658 1HG1 VAL 109 HG11 VAL 109 19.850 -14.375 -3.041 659 2HG1 VAL 109 HG12 VAL 109 18.474 -14.613 -1.970 660 3HG1 VAL 109 HG13 VAL 109 19.799 -15.772 -1.974 661 1HG2 VAL 109 HG21 VAL 109 19.412 -13.310 0.874 662 2HG2 VAL 109 HG22 VAL 109 18.249 -13.375 -0.444 663 3HG2 VAL 109 HG23 VAL 109 19.411 -12.052 -0.358 664 H ASP 110 HN ASP 110 21.767 -14.630 -2.543 665 HA ASP 110 HA ASP 110 23.296 -15.595 -3.933 666 1HB ASP 110 HB2 ASP 110 24.883 -15.676 -2.015 667 2HB ASP 110 HB1 ASP 110 24.209 -17.236 -1.557 668 H SER 111 HN SER 111 21.500 -17.543 -1.669 669 HA SER 111 HA SER 111 21.036 -19.593 -3.710 670 1HB SER 111 HB2 SER 111 21.536 -19.690 -0.882 671 2HB SER 111 HB1 SER 111 19.941 -20.368 -1.209 672 HG SER 111 HG SER 111 20.878 -21.829 -2.621 673 H ASP 112 HN ASP 112 19.489 -17.468 -1.331 674 HA ASP 112 HA ASP 112 16.827 -18.153 -2.029 675 1HB ASP 112 HB2 ASP 112 17.506 -15.475 -0.868 676 2HB ASP 112 HB1 ASP 112 16.137 -16.523 -0.530 677 H SER 113 HN SER 113 15.294 -16.364 -2.836 678 HA SER 113 HA SER 113 15.986 -15.857 -5.491 679 1HB SER 113 HB2 SER 113 13.722 -14.322 -4.446 680 2HB SER 113 HB1 SER 113 13.804 -15.412 -5.825 681 HG SER 113 HG SER 113 13.252 -15.956 -3.147 682 H TYR 114 HN TYR 114 16.603 -13.870 -2.790 683 HA TYR 114 HA TYR 114 16.420 -11.288 -3.544 684 1HB TYR 114 HB2 TYR 114 17.540 -11.588 -1.594 685 2HB TYR 114 HB1 TYR 114 18.522 -12.875 -2.272 686 HD1 TYR 114 HD1 TYR 114 20.633 -12.457 -3.222 687 HD2 TYR 114 HD2 TYR 114 18.105 -9.214 -2.170 688 HE1 TYR 114 HE1 TYR 114 22.500 -10.891 -3.601 689 HE2 TYR 114 HE2 TYR 114 19.953 -7.631 -2.534 690 HH TYR 114 HH TYR 114 23.170 -8.612 -2.870 691 H GLN 115 HN GLN 115 19.096 -13.450 -4.420 692 HA GLN 115 HA GLN 115 20.595 -11.851 -6.037 693 1HB GLN 115 HB2 GLN 115 21.076 -14.157 -7.258 694 2HB GLN 115 HB1 GLN 115 21.673 -13.811 -5.642 695 1HG GLN 115 HG2 GLN 115 20.369 -15.361 -4.684 696 2HG GLN 115 HG1 GLN 115 19.002 -15.020 -5.743 697 1HE2 GLN 115 HE21 GLN 115 22.311 -15.975 -6.537 698 2HE2 GLN 115 HE22 GLN 115 21.883 -17.438 -7.350 699 H LEU 116 HN LEU 116 17.759 -13.761 -7.020 700 HA LEU 116 HA LEU 116 18.013 -13.410 -9.777 701 1HB LEU 116 HB2 LEU 116 16.058 -14.432 -8.006 702 2HB LEU 116 HB1 LEU 116 15.244 -13.283 -9.056 703 HG LEU 116 HG LEU 116 17.018 -15.415 -10.206 704 1HD1 LEU 116 HD11 LEU 116 14.309 -16.196 -10.438 705 2HD1 LEU 116 HD12 LEU 116 14.635 -15.896 -8.731 706 3HD1 LEU 116 HD13 LEU 116 15.630 -17.039 -9.631 707 1HD2 LEU 116 HD21 LEU 116 14.542 -14.279 -11.428 708 2HD2 LEU 116 HD22 LEU 116 15.979 -14.941 -12.208 709 3HD2 LEU 116 HD23 LEU 116 16.042 -13.350 -11.449 710 H LEU 117 HN LEU 117 16.575 -11.311 -7.344 711 HA LEU 117 HA LEU 117 15.543 -9.410 -9.204 712 1HB LEU 117 HB2 LEU 117 15.486 -9.855 -6.393 713 2HB LEU 117 HB1 LEU 117 16.056 -8.224 -6.663 714 HG LEU 117 HG LEU 117 13.573 -8.506 -6.292 715 1HD1 LEU 117 HD11 LEU 117 14.970 -6.913 -8.285 716 2HD1 LEU 117 HD12 LEU 117 13.765 -6.439 -7.087 717 3HD1 LEU 117 HD13 LEU 117 13.249 -7.105 -8.631 718 1HD2 LEU 117 HD21 LEU 117 12.546 -10.072 -7.488 719 2HD2 LEU 117 HD22 LEU 117 13.905 -10.230 -8.598 720 3HD2 LEU 117 HD23 LEU 117 12.684 -8.987 -8.869 721 H LYS 118 HN LYS 118 18.454 -9.611 -7.229 722 HA LYS 118 HA LYS 118 19.408 -7.081 -8.139 723 1HB LYS 118 HB2 LYS 118 21.409 -7.522 -6.814 724 2HB LYS 118 HB1 LYS 118 19.949 -7.811 -5.877 725 1HG LYS 118 HG2 LYS 118 20.563 -9.892 -5.463 726 2HG LYS 118 HG1 LYS 118 20.745 -10.226 -7.186 727 1HD LYS 118 HD2 LYS 118 23.002 -9.111 -7.052 728 2HD LYS 118 HD1 LYS 118 22.808 -9.104 -5.299 729 1HE LYS 118 HE2 LYS 118 24.080 -11.029 -5.819 730 2HE LYS 118 HE1 LYS 118 22.453 -11.597 -5.448 731 1HZ LYS 118 HZ1 LYS 118 22.964 -12.745 -7.359 732 2HZ LYS 118 HZ2 LYS 118 23.817 -11.459 -8.052 733 3HZ LYS 118 HZ3 LYS 118 22.128 -11.416 -7.988 734 H ALA 119 HN ALA 119 19.712 -10.294 -9.090 735 HA ALA 119 HA ALA 119 22.068 -9.979 -10.678 736 1HB ALA 119 HB1 ALA 119 19.954 -12.129 -10.829 737 2HB ALA 119 HB2 ALA 119 21.390 -12.179 -9.806 738 3HB ALA 119 HB3 ALA 119 21.558 -12.188 -11.561 739 H TYR 120 HN TYR 120 18.880 -9.011 -10.972 740 HA TYR 120 HA TYR 120 19.214 -8.497 -13.807 741 1HB TYR 120 HB2 TYR 120 17.290 -9.556 -14.378 742 2HB TYR 120 HB1 TYR 120 17.431 -10.345 -12.807 743 HD1 TYR 120 HD1 TYR 120 15.272 -8.439 -14.854 744 HD2 TYR 120 HD2 TYR 120 16.453 -9.017 -10.820 745 HE1 TYR 120 HE1 TYR 120 13.183 -7.400 -14.103 746 HE2 TYR 120 HE2 TYR 120 14.365 -8.010 -10.058 747 HH TYR 120 HH TYR 120 12.671 -6.357 -10.974 748 H ASP 121 HN ASP 121 19.037 -7.067 -10.851 749 HA ASP 121 HA ASP 121 18.644 -4.501 -11.700 750 1HB ASP 121 HB2 ASP 121 16.098 -5.936 -11.519 751 2HB ASP 121 HB1 ASP 121 16.132 -4.492 -10.513 752 H VAL 122 HN VAL 122 20.316 -5.241 -10.031 753 HA VAL 122 HA VAL 122 19.689 -5.627 -7.341 754 HB VAL 122 HB VAL 122 21.852 -6.103 -8.188 755 1HG1 VAL 122 HG11 VAL 122 23.413 -4.275 -8.844 756 2HG1 VAL 122 HG12 VAL 122 22.048 -3.159 -8.784 757 3HG1 VAL 122 HG13 VAL 122 22.042 -4.499 -9.934 758 1HG2 VAL 122 HG21 VAL 122 22.971 -4.071 -6.545 759 2HG2 VAL 122 HG22 VAL 122 22.615 -5.744 -6.118 760 3HG2 VAL 122 HG23 VAL 122 21.398 -4.492 -5.864 761 H ASN 123 HN ASN 123 17.904 -4.199 -7.335 762 HA ASN 123 HA ASN 123 18.534 -1.714 -5.980 763 1HB ASN 123 HB2 ASN 123 18.035 -1.441 -8.557 764 2HB ASN 123 HB1 ASN 123 16.376 -1.708 -8.041 765 1HD2 ASN 123 HD21 ASN 123 18.281 0.646 -8.933 766 2HD2 ASN 123 HD22 ASN 123 17.765 1.930 -7.900 767 H ILE 124 HN ILE 124 17.914 -3.576 -4.528 768 HA ILE 124 HA ILE 124 15.091 -3.624 -4.175 769 HB ILE 124 HB ILE 124 15.136 -5.847 -3.417 770 1HG1 ILE 124 HG12 ILE 124 17.332 -5.935 -2.507 771 2HG1 ILE 124 HG11 ILE 124 17.109 -7.251 -3.651 772 1HG2 ILE 124 HG21 ILE 124 16.288 -6.675 -5.813 773 2HG2 ILE 124 HG22 ILE 124 15.608 -5.073 -6.107 774 3HG2 ILE 124 HG23 ILE 124 14.588 -6.367 -5.479 775 1HD1 ILE 124 HD11 ILE 124 18.986 -5.071 -3.705 776 2HD1 ILE 124 HD12 ILE 124 18.065 -5.227 -5.220 777 3HD1 ILE 124 HD13 ILE 124 18.995 -6.602 -4.595 778 H SER 125 HN SER 125 18.243 -3.702 -2.767 779 HA SER 125 HA SER 125 17.829 -4.276 -0.190 780 1HB SER 125 HB2 SER 125 19.433 -2.327 0.351 781 2HB SER 125 HB1 SER 125 20.005 -3.627 -0.693 782 HG SER 125 HG SER 125 19.650 -2.313 -2.473 783 H GLY 126 HN GLY 126 17.183 -1.137 -1.696 784 1HA GLY 126 HA2 GLY 126 15.936 0.030 0.602 785 2HA GLY 126 HA1 GLY 126 15.791 0.604 -1.060 786 H LEU 127 HN LEU 127 14.851 -1.748 -2.218 787 HA LEU 127 HA LEU 127 12.106 -1.582 -2.021 788 1HB LEU 127 HB2 LEU 127 13.409 -2.621 -3.845 789 2HB LEU 127 HB1 LEU 127 13.805 -3.945 -2.763 790 HG LEU 127 HG LEU 127 11.168 -4.147 -2.622 791 1HD1 LEU 127 HD11 LEU 127 11.289 -2.097 -4.348 792 2HD1 LEU 127 HD12 LEU 127 9.983 -3.284 -4.338 793 3HD1 LEU 127 HD13 LEU 127 11.315 -3.448 -5.483 794 1HD2 LEU 127 HD21 LEU 127 11.499 -6.073 -3.748 795 2HD2 LEU 127 HD22 LEU 127 13.200 -5.595 -3.705 796 3HD2 LEU 127 HD23 LEU 127 12.220 -5.258 -5.135 797 H VAL 128 HN VAL 128 14.383 -3.840 -0.435 798 HA VAL 128 HA VAL 128 12.631 -5.591 0.734 799 HB VAL 128 HB VAL 128 15.219 -4.403 1.679 800 1HG1 VAL 128 HG11 VAL 128 14.621 -4.863 3.805 801 2HG1 VAL 128 HG12 VAL 128 14.983 -6.526 3.329 802 3HG1 VAL 128 HG13 VAL 128 13.317 -5.949 3.311 803 1HG2 VAL 128 HG21 VAL 128 15.158 -5.995 -0.202 804 2HG2 VAL 128 HG22 VAL 128 14.439 -7.199 0.869 805 3HG2 VAL 128 HG23 VAL 128 16.073 -6.607 1.180 806 H SER 129 HN SER 129 13.762 -2.569 2.192 807 HA SER 129 HA SER 129 11.948 -2.611 4.351 808 1HB SER 129 HB2 SER 129 13.006 -0.025 3.343 809 2HB SER 129 HB1 SER 129 12.959 -0.662 4.984 810 HG SER 129 HG SER 129 14.606 -2.206 4.160 811 H THR 130 HN THR 130 11.545 -1.687 1.032 812 HA THR 130 HA THR 130 9.331 0.088 1.559 813 HB THR 130 HB THR 130 10.400 -1.044 -1.034 814 HG1 THR 130 HG1 THR 130 11.613 0.681 -1.107 815 1HG2 THR 130 HG21 THR 130 8.687 1.384 -0.924 816 2HG2 THR 130 HG22 THR 130 7.921 -0.206 -0.919 817 3HG2 THR 130 HG23 THR 130 8.977 0.262 -2.253 818 H THR 131 HN THR 131 9.764 -3.046 -0.052 819 HA THR 131 HA THR 131 7.134 -3.598 -0.550 820 HB THR 131 HB THR 131 9.353 -4.927 -1.093 821 HG1 THR 131 HG1 THR 131 6.697 -5.722 -0.988 822 1HG2 THR 131 HG21 THR 131 9.790 -6.842 0.118 823 2HG2 THR 131 HG22 THR 131 8.249 -6.777 0.973 824 3HG2 THR 131 HG23 THR 131 9.529 -5.632 1.374 825 H MET 132 HN MET 132 8.945 -3.948 2.410 826 HA MET 132 HA MET 132 6.874 -5.324 3.819 827 1HB MET 132 HB2 MET 132 9.515 -4.152 4.495 828 2HB MET 132 HB1 MET 132 8.363 -4.339 5.812 829 1HG MET 132 HG2 MET 132 9.073 -6.424 5.988 830 2HG MET 132 HG1 MET 132 8.234 -6.753 4.476 831 1HE MET 132 HE1 MET 132 12.256 -5.353 5.353 832 2HE MET 132 HE2 MET 132 12.350 -7.089 5.655 833 3HE MET 132 HE3 MET 132 11.093 -6.113 6.450 834 H GLN 133 HN GLN 133 7.611 -2.024 3.099 835 HA GLN 133 HA GLN 133 6.168 -0.773 5.187 836 1HB GLN 133 HB2 GLN 133 7.798 0.258 3.430 837 2HB GLN 133 HB1 GLN 133 6.371 0.366 2.411 838 1HG GLN 133 HG2 GLN 133 5.644 2.172 3.466 839 2HG GLN 133 HG1 GLN 133 5.856 1.421 5.047 840 1HE2 GLN 133 HE21 GLN 133 8.162 2.289 2.501 841 2HE2 GLN 133 HE22 GLN 133 9.144 3.305 3.495 842 H ASN 134 HN ASN 134 5.285 -1.569 1.836 843 HA ASN 134 HA ASN 134 2.618 -0.780 1.943 844 1HB ASN 134 HB2 ASN 134 3.632 -1.389 -0.170 845 2HB ASN 134 HB1 ASN 134 3.966 -3.019 0.403 846 1HD2 ASN 134 HD21 ASN 134 2.730 -4.423 -0.577 847 2HD2 ASN 134 HD22 ASN 134 1.057 -4.225 -0.962 848 H GLU 135 HN GLU 135 4.198 -3.719 3.012 849 HA GLU 135 HA GLU 135 1.758 -5.020 3.794 850 1HB GLU 135 HB2 GLU 135 4.637 -5.558 4.577 851 2HB GLU 135 HB1 GLU 135 3.277 -6.598 4.977 852 1HG GLU 135 HG2 GLU 135 2.930 -6.548 2.360 853 2HG GLU 135 HG1 GLU 135 4.654 -6.181 2.384 854 H ALA 136 HN ALA 136 4.207 -2.972 5.212 855 HA ALA 136 HA ALA 136 3.538 -3.136 7.914 856 1HB ALA 136 HB1 ALA 136 5.530 -1.961 6.823 857 2HB ALA 136 HB2 ALA 136 4.794 -1.176 8.219 858 3HB ALA 136 HB3 ALA 136 4.441 -0.594 6.593 859 H ARG 137 HN ARG 137 2.362 -0.932 5.367 860 HA ARG 137 HA ARG 137 0.521 0.452 7.024 861 1HB ARG 137 HB2 ARG 137 0.029 -0.051 4.117 862 2HB ARG 137 HB1 ARG 137 -0.407 1.357 5.079 863 1HG ARG 137 HG2 ARG 137 2.356 0.581 4.225 864 2HG ARG 137 HG1 ARG 137 1.406 1.931 3.614 865 1HD ARG 137 HD2 ARG 137 1.983 1.714 6.527 866 2HD ARG 137 HD1 ARG 137 3.236 2.309 5.439 867 HE ARG 137 HE ARG 137 0.786 3.668 4.999 868 1HH1 ARG 137 HH11 ARG 137 3.472 3.488 7.219 869 2HH1 ARG 137 HH12 ARG 137 3.305 5.128 7.749 870 1HH2 ARG 137 HH21 ARG 137 0.565 5.825 5.695 871 2HH2 ARG 137 HH22 ARG 137 1.655 6.455 6.885 872 H ARG 138 HN ARG 138 0.116 -1.994 4.572 873 HA ARG 138 HA ARG 138 -2.553 -2.443 4.853 874 1HB ARG 138 HB2 ARG 138 -0.295 -3.976 3.745 875 2HB ARG 138 HB1 ARG 138 -1.729 -4.920 4.119 876 1HG ARG 138 HG2 ARG 138 -1.832 -4.229 1.832 877 2HG ARG 138 HG1 ARG 138 -3.066 -3.356 2.743 878 1HD ARG 138 HD2 ARG 138 -0.922 -1.676 2.935 879 2HD ARG 138 HD1 ARG 138 -0.704 -2.358 1.326 880 HE ARG 138 HE ARG 138 -2.780 -0.556 2.188 881 1HH1 ARG 138 HH11 ARG 138 -1.835 -2.931 -0.191 882 2HH1 ARG 138 HH12 ARG 138 -2.917 -2.330 -1.402 883 1HH2 ARG 138 HH21 ARG 138 -4.203 0.234 0.596 884 2HH2 ARG 138 HH22 ARG 138 -4.261 -0.534 -0.956 885 H LEU 139 HN LEU 139 -0.022 -3.450 6.985 886 HA LEU 139 HA LEU 139 -0.922 -5.732 8.182 887 1HB LEU 139 HB2 LEU 139 0.348 -3.296 9.415 888 2HB LEU 139 HB1 LEU 139 -0.015 -4.719 10.365 889 HG LEU 139 HG LEU 139 2.149 -4.252 8.419 890 1HD1 LEU 139 HD11 LEU 139 3.425 -5.082 10.040 891 2HD1 LEU 139 HD12 LEU 139 2.254 -6.326 10.484 892 3HD1 LEU 139 HD13 LEU 139 2.029 -4.666 11.038 893 1HD2 LEU 139 HD21 LEU 139 0.793 -6.040 7.316 894 2HD2 LEU 139 HD22 LEU 139 1.022 -7.014 8.769 895 3HD2 LEU 139 HD23 LEU 139 2.415 -6.534 7.802 896 H ARG 140 HN ARG 140 -3.105 -6.010 8.321 897 HA ARG 140 HA ARG 140 -4.479 -4.352 10.327 898 1HB ARG 140 HB2 ARG 140 -5.120 -3.974 7.840 899 2HB ARG 140 HB1 ARG 140 -5.948 -5.518 7.984 900 1HG ARG 140 HG2 ARG 140 -7.687 -4.537 8.934 901 2HG ARG 140 HG1 ARG 140 -6.659 -3.881 10.209 902 1HD ARG 140 HD2 ARG 140 -7.058 -1.854 9.390 903 2HD ARG 140 HD1 ARG 140 -6.139 -2.309 7.956 904 HE ARG 140 HE ARG 140 -8.998 -2.063 8.185 905 1HH1 ARG 140 HH11 ARG 140 -6.373 -3.494 6.383 906 2HH1 ARG 140 HH12 ARG 140 -7.309 -3.694 4.940 907 1HH2 ARG 140 HH21 ARG 140 -10.228 -2.325 6.287 908 2HH2 ARG 140 HH22 ARG 140 -9.496 -3.030 4.885 909 H ALA 141 HN ALA 141 -3.287 -7.309 9.776 910 HA ALA 141 HA ALA 141 -3.651 -9.383 10.628 911 1HB ALA 141 HB1 ALA 141 -4.274 -9.431 12.795 912 2HB ALA 141 HB2 ALA 141 -5.752 -8.513 12.503 913 3HB ALA 141 HB3 ALA 141 -4.205 -7.676 12.633 914 H GLU 142 HN GLU 142 -4.614 -10.745 9.272 915 HA GLU 142 HA GLU 142 -6.192 -11.756 7.968 916 1HB GLU 142 HB2 GLU 142 -6.791 -12.111 10.571 917 2HB GLU 142 HB1 GLU 142 -8.281 -11.354 10.025 918 1HG GLU 142 HG2 GLU 142 -7.619 -13.321 8.121 919 2HG GLU 142 HG1 GLU 142 -7.407 -14.050 9.712 920 H ARG 143 HN ARG 143 -8.873 -11.558 7.638 921 HA ARG 143 HA ARG 143 -9.188 -8.813 6.626 922 1HB ARG 143 HB2 ARG 143 -10.426 -11.400 5.669 923 2HB ARG 143 HB1 ARG 143 -10.808 -9.812 5.017 924 1HG ARG 143 HG2 ARG 143 -8.172 -9.738 4.700 925 2HG ARG 143 HG1 ARG 143 -8.396 -11.488 4.652 926 1HD ARG 143 HD2 ARG 143 -10.409 -10.632 3.030 927 2HD ARG 143 HD1 ARG 143 -9.162 -9.427 2.708 928 HE ARG 143 HE ARG 143 -8.071 -12.038 2.620 929 1HH1 ARG 143 HH11 ARG 143 -10.070 -9.838 0.792 930 2HH1 ARG 143 HH12 ARG 143 -9.655 -10.534 -0.738 931 1HH2 ARG 143 HH21 ARG 143 -7.524 -12.956 0.608 932 2HH2 ARG 143 HH22 ARG 143 -8.210 -12.304 -0.843 933 H TRP 144 HN TRP 144 -9.820 -9.696 9.344 934 HA TRP 144 HA TRP 144 -12.679 -9.009 9.335 935 1HB TRP 144 HB2 TRP 144 -11.859 -11.499 9.972 936 2HB TRP 144 HB1 TRP 144 -11.717 -10.729 11.549 937 HD1 TRP 144 HD1 TRP 144 -14.361 -11.511 8.854 938 HE1 TRP 144 HE1 TRP 144 -16.674 -11.543 9.982 939 HE3 TRP 144 HE3 TRP 144 -13.006 -9.954 13.532 940 HZ2 TRP 144 HZ2 TRP 144 -17.778 -10.983 12.519 941 HZ3 TRP 144 HZ3 TRP 144 -14.751 -9.728 15.251 942 HH2 TRP 144 HH2 TRP 144 -17.088 -10.232 14.754 943 H LYS 145 HN LYS 145 -12.725 -6.996 10.108 944 HA LYS 145 HA LYS 145 -11.699 -6.490 12.763 945 1HB LYS 145 HB2 LYS 145 -10.064 -5.841 10.623 946 2HB LYS 145 HB1 LYS 145 -10.868 -4.322 10.993 947 1HG LYS 145 HG2 LYS 145 -8.819 -4.416 12.213 948 2HG LYS 145 HG1 LYS 145 -10.154 -4.582 13.356 949 1HD LYS 145 HD2 LYS 145 -9.647 -6.748 13.844 950 2HD LYS 145 HD1 LYS 145 -9.014 -7.077 12.229 951 1HE LYS 145 HE2 LYS 145 -7.043 -7.068 13.346 952 2HE LYS 145 HE1 LYS 145 -7.169 -5.334 13.054 953 1HZ LYS 145 HZ1 LYS 145 -6.757 -6.387 15.455 954 2HZ LYS 145 HZ2 LYS 145 -8.447 -6.311 15.473 955 3HZ LYS 145 HZ3 LYS 145 -7.540 -4.906 15.218 956 H VAL 146 HN VAL 146 -12.651 -4.448 9.999 957 HA VAL 146 HA VAL 146 -15.169 -3.802 11.294 958 HB VAL 146 HB VAL 146 -14.713 -1.319 11.005 959 1HG1 VAL 146 HG11 VAL 146 -14.476 -2.932 13.152 960 2HG1 VAL 146 HG12 VAL 146 -14.275 -1.181 13.213 961 3HG1 VAL 146 HG13 VAL 146 -12.859 -2.228 13.107 962 1HG2 VAL 146 HG21 VAL 146 -11.834 -1.791 11.398 963 2HG2 VAL 146 HG22 VAL 146 -12.666 -0.518 10.506 964 3HG2 VAL 146 HG23 VAL 146 -12.440 -2.105 9.772 965 H GLU 147 HN GLU 147 -16.660 -3.873 9.760 966 HA GLU 147 HA GLU 147 -17.714 -3.734 7.750 967 1HB GLU 147 HB2 GLU 147 -15.736 -1.494 7.595 968 2HB GLU 147 HB1 GLU 147 -16.672 -1.913 6.166 969 1HG GLU 147 HG2 GLU 147 -17.991 -0.297 7.092 970 2HG GLU 147 HG1 GLU 147 -18.699 -1.748 7.801 971 H ASN 148 HN ASN 148 -17.199 -3.712 5.234 972 HA ASN 148 HA ASN 148 -14.968 -5.591 4.809 973 1HB ASN 148 HB2 ASN 148 -17.595 -5.529 3.310 974 2HB ASN 148 HB1 ASN 148 -16.303 -6.710 3.118 975 1HD2 ASN 148 HD21 ASN 148 -18.607 -5.414 5.453 976 2HD2 ASN 148 HD22 ASN 148 -18.793 -6.879 6.351 977 H GLN 149 HN GLN 149 -14.899 -5.746 2.117 978 HA GLN 149 HA GLN 149 -13.477 -3.472 1.351 979 1HB GLN 149 HB2 GLN 149 -14.793 -5.552 -0.406 980 2HB GLN 149 HB1 GLN 149 -13.567 -4.408 -0.934 981 1HG GLN 149 HG2 GLN 149 -12.168 -5.464 1.000 982 2HG GLN 149 HG1 GLN 149 -13.300 -6.802 0.815 983 1HE2 GLN 149 HE21 GLN 149 -11.399 -8.019 0.210 984 2HE2 GLN 149 HE22 GLN 149 -10.825 -7.947 -1.417 985 H GLU 150 HN GLU 150 -14.111 -1.516 0.741 986 HA GLU 150 HA GLU 150 -16.902 -1.110 -0.007 987 1HB GLU 150 HB2 GLU 150 -16.466 1.280 0.468 988 2HB GLU 150 HB1 GLU 150 -16.159 0.243 1.854 989 1HG GLU 150 HG2 GLU 150 -13.869 0.518 1.722 990 2HG GLU 150 HG1 GLU 150 -13.923 1.003 0.028 991 H GLY 151 HN GLY 151 -17.197 0.815 -1.588 992 1HA GLY 151 HA2 GLY 151 -16.461 1.962 -3.534 993 2HA GLY 151 HA1 GLY 151 -15.132 0.821 -3.671 994 H MET 152 HN MET 152 -18.347 -0.339 -3.061 995 HA MET 152 HA MET 152 -18.307 -1.890 -5.471 996 1HB MET 152 HB2 MET 152 -20.501 -1.515 -3.424 997 2HB MET 152 HB1 MET 152 -20.493 -2.727 -4.698 998 1HG MET 152 HG2 MET 152 -19.042 -4.060 -3.612 999 2HG MET 152 HG1 MET 152 -18.143 -2.708 -2.925 1000 1HE MET 152 HE1 MET 152 -20.470 -1.637 0.037 1001 2HE MET 152 HE2 MET 152 -20.092 -0.972 -1.551 1002 3HE MET 152 HE3 MET 152 -18.795 -1.555 -0.508 1003 H VAL 153 HN VAL 153 -19.001 -1.276 -7.403 1004 HA VAL 153 HA VAL 153 -21.188 0.672 -7.588 1005 HB VAL 153 HB VAL 153 -19.982 1.719 -9.553 1006 1HG1 VAL 153 HG11 VAL 153 -19.341 2.040 -6.689 1007 2HG1 VAL 153 HG12 VAL 153 -19.990 3.202 -7.846 1008 3HG1 VAL 153 HG13 VAL 153 -18.263 2.848 -7.827 1009 1HG2 VAL 153 HG21 VAL 153 -17.368 0.984 -8.451 1010 2HG2 VAL 153 HG22 VAL 153 -17.887 1.154 -10.128 1011 3HG2 VAL 153 HG23 VAL 153 -18.220 -0.338 -9.248 1012 H GLU 154 HN GLU 154 -22.761 -0.153 -8.786 1013 HA GLU 154 HA GLU 154 -22.380 -2.484 -10.392 1014 1HB GLU 154 HB2 GLU 154 -24.648 -0.812 -9.524 1015 2HB GLU 154 HB1 GLU 154 -24.861 -1.596 -11.083 1016 1HG GLU 154 HG2 GLU 154 -23.886 -3.628 -9.530 1017 2HG GLU 154 HG1 GLU 154 -24.888 -2.722 -8.397 1018 H VAL 155 HN VAL 155 -22.700 0.957 -11.025 1019 HA VAL 155 HA VAL 155 -22.139 0.433 -13.857 1020 HB VAL 155 HB VAL 155 -23.738 2.799 -12.915 1021 1HG1 VAL 155 HG11 VAL 155 -22.668 1.926 -15.423 1022 2HG1 VAL 155 HG12 VAL 155 -23.555 3.403 -15.049 1023 3HG1 VAL 155 HG13 VAL 155 -24.429 1.944 -15.515 1024 1HG2 VAL 155 HG21 VAL 155 -25.771 1.629 -13.469 1025 2HG2 VAL 155 HG22 VAL 155 -24.888 0.710 -12.250 1026 3HG2 VAL 155 HG23 VAL 155 -24.859 0.192 -13.935 1027 H ALA 156 HN ALA 156 -22.279 3.639 -13.537 1028 HA ALA 156 HA ALA 156 -19.793 4.207 -12.255 1029 1HB ALA 156 HB1 ALA 156 -19.242 3.157 -14.558 1030 2HB ALA 156 HB2 ALA 156 -18.403 4.626 -14.060 1031 3HB ALA 156 HB3 ALA 156 -19.744 4.720 -15.202 1032 H ARG 157 HN ARG 157 -22.405 5.190 -11.971 1033 HA ARG 157 HA ARG 157 -22.943 7.562 -13.354 1034 1HB ARG 157 HB2 ARG 157 -23.675 6.809 -10.519 1035 2HB ARG 157 HB1 ARG 157 -24.393 8.130 -11.431 1036 1HG ARG 157 HG2 ARG 157 -24.563 5.198 -12.096 1037 2HG ARG 157 HG1 ARG 157 -25.854 6.209 -11.445 1038 1HD ARG 157 HD2 ARG 157 -24.936 7.537 -13.732 1039 2HD ARG 157 HD1 ARG 157 -25.018 5.833 -14.176 1040 HE ARG 157 HE ARG 157 -27.304 5.941 -14.054 1041 1HH1 ARG 157 HH11 ARG 157 -25.948 8.774 -12.531 1042 2HH1 ARG 157 HH12 ARG 157 -27.477 9.568 -12.361 1043 1HH2 ARG 157 HH21 ARG 157 -29.316 6.984 -13.830 1044 2HH2 ARG 157 HH22 ARG 157 -29.390 8.552 -13.097 1045 H PHE 158 HN PHE 158 -22.680 9.757 -12.740 1046 HA PHE 158 HA PHE 158 -20.668 10.325 -10.695 1047 1HB PHE 158 HB2 PHE 158 -19.814 10.104 -13.227 1048 2HB PHE 158 HB1 PHE 158 -20.352 11.780 -13.265 1049 HD1 PHE 158 HD1 PHE 158 -19.669 12.608 -10.495 1050 HD2 PHE 158 HD2 PHE 158 -17.497 10.296 -13.331 1051 HE1 PHE 158 HE1 PHE 158 -17.558 13.311 -9.445 1052 HE2 PHE 158 HE2 PHE 158 -15.381 10.994 -12.285 1053 HZ PHE 158 HZ PHE 158 -15.411 12.503 -10.339 1054 H ILE 159 HN ILE 159 -23.446 10.756 -10.646 1055 HA ILE 159 HA ILE 159 -23.520 13.699 -10.621 1056 HB ILE 159 HB ILE 159 -25.873 11.947 -11.326 1057 1HG1 ILE 159 HG12 ILE 159 -24.064 11.926 -13.056 1058 2HG1 ILE 159 HG11 ILE 159 -25.579 12.623 -13.621 1059 1HG2 ILE 159 HG21 ILE 159 -26.072 14.682 -12.161 1060 2HG2 ILE 159 HG22 ILE 159 -25.718 14.606 -10.435 1061 3HG2 ILE 159 HG23 ILE 159 -27.124 13.763 -11.085 1062 1HD1 ILE 159 HD11 ILE 159 -23.145 13.736 -13.976 1063 2HD1 ILE 159 HD12 ILE 159 -23.675 14.552 -12.505 1064 3HD1 ILE 159 HD13 ILE 159 -24.662 14.635 -13.964 1065 H GLU 160 HN GLU 160 -22.906 13.416 -8.371 1066 HA GLU 160 HA GLU 160 -24.660 12.069 -6.554 1067 1HB GLU 160 HB2 GLU 160 -23.275 13.146 -4.800 1068 2HB GLU 160 HB1 GLU 160 -22.318 12.283 -5.996 1069 1HG GLU 160 HG2 GLU 160 -22.771 15.141 -6.534 1070 2HG GLU 160 HG1 GLU 160 -21.766 14.765 -5.135 1071 H MET 161 HN MET 161 -24.342 15.323 -7.779 1072 HA MET 161 HA MET 161 -26.878 16.019 -6.526 1073 1HB MET 161 HB2 MET 161 -24.296 17.499 -6.064 1074 2HB MET 161 HB1 MET 161 -25.858 18.286 -5.888 1075 1HG MET 161 HG2 MET 161 -26.483 16.840 -4.114 1076 2HG MET 161 HG1 MET 161 -25.095 15.791 -4.400 1077 1HE MET 161 HE1 MET 161 -24.772 20.109 -2.872 1078 2HE MET 161 HE2 MET 161 -25.995 19.461 -3.965 1079 3HE MET 161 HE3 MET 161 -24.359 19.762 -4.551 1080 H ASN 162 HN ASN 162 -27.356 18.461 -7.251 1081 HA ASN 162 HA ASN 162 -27.338 18.360 -10.140 1082 1HB ASN 162 HB2 ASN 162 -29.166 19.250 -8.308 1083 2HB ASN 162 HB1 ASN 162 -28.450 20.763 -8.857 1084 1HD2 ASN 162 HD21 ASN 162 -30.777 18.476 -9.455 1085 2HD2 ASN 162 HD22 ASN 162 -31.148 18.885 -11.092 1086 H GLY 163 HN GLY 163 -25.743 20.129 -7.597 1087 1HA GLY 163 HA2 GLY 163 -23.545 20.953 -8.922 1088 2HA GLY 163 HA1 GLY 163 -24.726 22.171 -9.380 1089 H SER 164 HN SER 164 -26.130 22.203 -6.879 1090 HA SER 164 HA SER 164 -24.245 22.814 -4.798 1091 1HB SER 164 HB2 SER 164 -24.549 24.846 -6.555 1092 2HB SER 164 HB1 SER 164 -25.886 25.192 -5.458 1093 HG SER 164 HG SER 164 -23.877 26.181 -4.844 1094 H PHE 165 HN PHE 165 -27.544 23.669 -5.861 1095 HA PHE 165 HA PHE 165 -28.830 22.082 -3.929 1096 1HB PHE 165 HB2 PHE 165 -27.750 24.317 -2.758 1097 2HB PHE 165 HB1 PHE 165 -29.388 24.851 -3.120 1098 HD1 PHE 165 HD1 PHE 165 -31.194 24.170 -1.799 1099 HD2 PHE 165 HD2 PHE 165 -27.436 22.214 -1.405 1100 HE1 PHE 165 HE1 PHE 165 -32.018 22.998 0.201 1101 HE2 PHE 165 HE2 PHE 165 -28.253 21.037 0.595 1102 HZ PHE 165 HZ PHE 165 -30.547 21.428 1.400 1103 H ALA 166 HN ALA 166 -31.201 22.605 -3.778 1104 HA ALA 166 HA ALA 166 -32.139 23.364 -6.422 1105 1HB ALA 166 HB1 ALA 166 -33.504 22.090 -4.062 1106 2HB ALA 166 HB2 ALA 166 -33.053 21.337 -5.591 1107 3HB ALA 166 HB3 ALA 166 -34.346 22.535 -5.546 1108 H ASP 167 HN ASP 167 -31.794 25.629 -6.317 1109 HA ASP 167 HA ASP 167 -33.950 27.034 -4.933 1110 1HB ASP 167 HB2 ASP 167 -31.507 27.055 -3.786 1111 2HB ASP 167 HB1 ASP 167 -31.331 28.420 -4.885 1112 H GLU 168 HN GLU 168 -33.382 26.285 -7.716 1113 HA GLU 168 HA GLU 168 -34.186 28.636 -8.996 1114 1HB GLU 168 HB2 GLU 168 -31.492 28.753 -8.461 1115 2HB GLU 168 HB1 GLU 168 -31.517 28.118 -10.100 1116 1HG GLU 168 HG2 GLU 168 -33.084 30.045 -10.649 1117 2HG GLU 168 HG1 GLU 168 -32.611 30.720 -9.091 1118 H ASN 169 HN ASN 169 -34.922 28.218 -11.038 1119 HA ASN 169 HA ASN 169 -34.010 25.951 -12.550 1120 1HB ASN 169 HB2 ASN 169 -35.511 24.859 -10.919 1121 2HB ASN 169 HB1 ASN 169 -36.825 25.909 -11.440 1122 1HD2 ASN 169 HD21 ASN 169 -37.681 25.649 -13.533 1123 2HD2 ASN 169 HD22 ASN 169 -37.496 24.164 -14.395 1124 H LYS 170 HN LYS 170 -34.550 26.083 -14.701 1125 HA LYS 170 HA LYS 170 -36.696 27.498 -15.795 1126 1HB LYS 170 HB2 LYS 170 -35.296 29.414 -16.780 1127 2HB LYS 170 HB1 LYS 170 -35.795 29.571 -15.101 1128 1HG LYS 170 HG2 LYS 170 -33.554 28.710 -14.430 1129 2HG LYS 170 HG1 LYS 170 -33.080 28.779 -16.128 1130 1HD LYS 170 HD2 LYS 170 -32.320 30.816 -15.370 1131 2HD LYS 170 HD1 LYS 170 -33.927 31.249 -15.955 1132 1HE LYS 170 HE2 LYS 170 -33.623 30.391 -13.121 1133 2HE LYS 170 HE1 LYS 170 -33.079 32.005 -13.575 1134 1HZ LYS 170 HZ1 LYS 170 -35.474 31.955 -14.722 1135 2HZ LYS 170 HZ2 LYS 170 -35.214 32.512 -13.146 1136 3HZ LYS 170 HZ3 LYS 170 -35.773 30.937 -13.404 1137 H ASP 171 HN ASP 171 -35.487 25.092 -16.091 1138 HA ASP 171 HA ASP 171 -33.525 24.584 -17.780 1139 1HB ASP 171 HB2 ASP 171 -35.237 22.971 -16.752 1140 2HB ASP 171 HB1 ASP 171 -36.163 23.211 -18.231 1141 H TRP 172 HN TRP 172 -33.025 25.947 -19.439 1142 HA TRP 172 HA TRP 172 -34.976 26.118 -21.640 1143 1HB TRP 172 HB2 TRP 172 -33.899 28.246 -20.148 1144 2HB TRP 172 HB1 TRP 172 -33.070 28.286 -21.701 1145 HD1 TRP 172 HD1 TRP 172 -35.274 27.651 -23.735 1146 HE1 TRP 172 HE1 TRP 172 -37.306 29.197 -24.062 1147 HE3 TRP 172 HE3 TRP 172 -35.187 30.069 -19.231 1148 HZ2 TRP 172 HZ2 TRP 172 -38.688 31.180 -22.603 1149 HZ3 TRP 172 HZ3 TRP 172 -36.898 31.776 -18.776 1150 HH2 TRP 172 HH2 TRP 172 -38.612 32.320 -20.428
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