NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
1325 | 1ahk | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H ASP 1 2H ASP 1 -1.481 -1.054 -1.054 2 2H ASP 1 3H ASP 1 -1.134 -1.035 -1.035 3 3H ASP 1 1H ASP 1 -0.192 -0.118 -0.118 4 HA ASP 1 HA ASP 1 -1.549 1.609 1.609 5 1HB ASP 1 1HB ASP 1 -3.109 -0.195 -0.195 6 2HB ASP 1 2HB ASP 1 -3.244 1.561 1.561 7 H GLN 2 H GLN 2 -2.838 2.257 2.257 8 HA GLN 2 HA GLN 2 -4.490 0.546 0.546 9 1HB GLN 2 1HB GLN 2 -5.615 2.804 2.804 10 2HB GLN 2 2HB GLN 2 -3.913 2.562 2.562 11 1HG GLN 2 1HG GLN 2 -3.172 3.901 3.901 12 2HG GLN 2 2HG GLN 2 -4.711 3.776 3.776 13 1HE2 GLN 2 2HE2 GLN 2 -4.153 6.852 6.852 14 2HE2 GLN 2 1HE2 GLN 2 -2.896 5.860 5.860 15 H VAL 3 H VAL 3 -6.966 1.295 1.295 16 HA VAL 3 HA VAL 3 -8.228 1.618 1.618 17 HB VAL 3 HB VAL 3 -9.699 -0.452 -0.452 18 1HG1 VAL 3 3HG1 VAL 3 -9.240 -0.029 -0.029 19 2HG1 VAL 3 1HG1 VAL 3 -7.616 -0.671 -0.671 20 3HG1 VAL 3 2HG1 VAL 3 -9.019 -1.712 -1.712 21 1HG2 VAL 3 2HG2 VAL 3 -6.707 -0.883 -0.883 22 2HG2 VAL 3 3HG2 VAL 3 -7.888 -1.007 -1.007 23 3HG2 VAL 3 1HG2 VAL 3 -7.877 -2.203 -2.203 24 H ASP 4 H ASP 4 -10.861 0.950 0.950 25 HA ASP 4 HA ASP 4 -11.272 3.021 3.021 26 1HB ASP 4 1HB ASP 4 -12.285 2.874 2.874 27 2HB ASP 4 2HB ASP 4 -13.632 2.727 2.727 28 H VAL 5 H VAL 5 -11.039 0.823 0.823 29 HA VAL 5 HA VAL 5 -13.503 -0.804 -0.804 30 HB VAL 5 HB VAL 5 -12.346 -1.963 -1.963 31 1HG1 VAL 5 1HG1 VAL 5 -12.190 -2.480 -2.480 32 2HG1 VAL 5 2HG1 VAL 5 -10.528 -1.920 -1.920 33 3HG1 VAL 5 3HG1 VAL 5 -11.107 -3.298 -3.298 34 1HG2 VAL 5 2HG2 VAL 5 -10.899 0.195 0.195 35 2HG2 VAL 5 3HG2 VAL 5 -10.147 -1.383 -1.383 36 3HG2 VAL 5 1HG2 VAL 5 -9.884 -0.496 -0.496 37 H LYS 6 H LYS 6 -15.171 -0.571 -0.571 38 HA LYS 6 HA LYS 6 -15.302 1.863 1.863 39 1HB LYS 6 1HB LYS 6 -17.062 -0.471 -0.471 40 2HB LYS 6 2HB LYS 6 -17.330 0.385 0.385 41 1HG LYS 6 1HG LYS 6 -17.776 2.435 2.435 42 2HG LYS 6 2HG LYS 6 -17.077 1.869 1.869 43 1HD LYS 6 1HD LYS 6 -19.083 1.104 1.104 44 2HD LYS 6 2HD LYS 6 -19.184 0.077 0.077 45 1HE LYS 6 1HE LYS 6 -21.013 1.422 1.422 46 2HE LYS 6 2HE LYS 6 -19.771 2.417 2.417 47 1HZ LYS 6 1HZ LYS 6 -19.898 2.925 2.925 48 2HZ LYS 6 2HZ LYS 6 -21.431 3.129 3.129 49 3HZ LYS 6 3HZ LYS 6 -20.100 4.003 4.003 50 H ASP 7 H ASP 7 -13.477 1.739 1.739 51 HA ASP 7 HA ASP 7 -13.334 -0.477 -0.477 52 1HB ASP 7 1HB ASP 7 -11.398 0.817 0.817 53 2HB ASP 7 2HB ASP 7 -11.238 0.479 0.479 54 H CYS 8 H CYS 8 -13.267 0.069 0.069 55 HA CYS 8 HA CYS 8 -14.835 2.477 2.477 56 1HB CYS 8 1HB CYS 8 -15.743 -0.122 -0.122 57 2HB CYS 8 2HB CYS 8 -16.652 1.364 1.364 58 H ALA 9 H ALA 9 -12.155 2.120 2.120 59 HA ALA 9 HA ALA 9 -11.873 0.906 0.906 60 1HB ALA 9 1HB ALA 9 -10.087 1.792 1.792 61 2HB ALA 9 2HB ALA 9 -9.704 2.672 2.672 62 3HB ALA 9 3HB ALA 9 -9.688 0.908 0.908 63 H ASN 10 H ASN 10 -11.051 4.183 4.183 64 HA ASN 10 HA ASN 10 -12.739 5.695 5.695 65 1HB ASN 10 1HB ASN 10 -10.730 4.209 4.209 66 2HB ASN 10 2HB ASN 10 -10.495 5.947 5.947 67 1HD2 ASN 10 2HD2 ASN 10 -13.557 6.416 6.416 68 2HD2 ASN 10 1HD2 ASN 10 -12.346 7.202 7.202 69 H ASN 11 H ASN 11 -11.223 5.837 5.837 70 HA ASN 11 HA ASN 11 -9.837 7.316 7.316 71 1HB ASN 11 1HB ASN 11 -11.714 8.802 8.802 72 2HB ASN 11 2HB ASN 11 -10.451 9.345 9.345 73 1HD2 ASN 11 2HD2 ASN 11 -10.059 11.761 11.761 74 2HD2 ASN 11 1HD2 ASN 11 -10.952 11.487 11.487 75 H GLU 12 H GLU 12 -8.673 5.713 5.713 76 HA GLU 12 HA GLU 12 -6.364 7.501 7.501 77 1HB GLU 12 1HB GLU 12 -7.565 5.223 5.223 78 2HB GLU 12 2HB GLU 12 -6.030 5.995 5.995 79 1HG GLU 12 1HG GLU 12 -8.332 7.818 7.818 80 2HG GLU 12 2HG GLU 12 -8.391 6.828 6.828 81 H ILE 13 H ILE 13 -7.382 4.665 4.665 82 HA ILE 13 HA ILE 13 -5.285 2.859 2.859 83 HB ILE 13 HB ILE 13 -6.611 3.785 3.785 84 1HG1 ILE 13 1HG1 ILE 13 -7.223 1.612 1.612 85 2HG1 ILE 13 2HG1 ILE 13 -8.262 2.953 2.953 86 1HG2 ILE 13 1HG2 ILE 13 -4.464 1.902 1.902 87 2HG2 ILE 13 2HG2 ILE 13 -5.853 1.092 1.092 88 3HG2 ILE 13 3HG2 ILE 13 -5.106 2.456 2.456 89 1HD1 ILE 13 1HD1 ILE 13 -7.929 1.842 1.842 90 2HD1 ILE 13 2HD1 ILE 13 -7.679 0.397 0.397 91 3HD1 ILE 13 3HD1 ILE 13 -9.192 1.297 1.297 92 H LYS 14 H LYS 14 -3.223 2.674 2.674 93 HA LYS 14 HA LYS 14 -1.956 5.274 5.274 94 1HB LYS 14 1HB LYS 14 -0.207 2.936 2.936 95 2HB LYS 14 2HB LYS 14 -0.113 4.505 4.505 96 1HG LYS 14 1HG LYS 14 -2.277 3.528 3.528 97 2HG LYS 14 2HG LYS 14 -1.479 2.004 2.004 98 1HD LYS 14 1HD LYS 14 -0.637 2.670 2.670 99 2HD LYS 14 2HD LYS 14 0.645 3.015 3.015 100 1HE LYS 14 1HE LYS 14 -1.288 5.213 5.213 101 2HE LYS 14 2HE LYS 14 -0.312 4.833 4.833 102 1HZ LYS 14 2HZ LYS 14 1.282 4.815 4.815 103 2HZ LYS 14 3HZ LYS 14 0.457 6.295 6.295 104 3HZ LYS 14 1HZ LYS 14 1.448 5.763 5.763 105 H LYS 15 H LYS 15 -2.869 2.233 2.233 106 HA LYS 15 HA LYS 15 -2.086 3.063 3.063 107 1HB LYS 15 1HB LYS 15 -0.088 1.844 1.844 108 2HB LYS 15 2HB LYS 15 -0.566 0.680 0.680 109 1HG LYS 15 1HG LYS 15 -0.420 2.863 2.863 110 2HG LYS 15 2HG LYS 15 0.733 3.351 3.351 111 1HD LYS 15 1HD LYS 15 0.825 0.813 0.813 112 2HD LYS 15 2HD LYS 15 1.936 2.179 2.179 113 1HE LYS 15 1HE LYS 15 1.691 1.132 1.132 114 2HE LYS 15 2HE LYS 15 2.294 -0.072 -0.072 115 1HZ LYS 15 3HZ LYS 15 3.387 2.676 2.676 116 2HZ LYS 15 1HZ LYS 15 4.020 1.378 1.378 117 3HZ LYS 15 2HZ LYS 15 4.052 1.339 1.339 118 H VAL 16 H VAL 16 -3.919 2.280 2.280 119 HA VAL 16 HA VAL 16 -4.480 -0.633 -0.633 120 HB VAL 16 HB VAL 16 -6.132 0.644 0.644 121 1HG1 VAL 16 3HG1 VAL 16 -5.818 2.624 2.624 122 2HG1 VAL 16 1HG1 VAL 16 -7.266 1.878 1.878 123 3HG1 VAL 16 2HG1 VAL 16 -7.274 2.472 2.472 124 1HG2 VAL 16 2HG2 VAL 16 -6.676 -1.212 -1.212 125 2HG2 VAL 16 3HG2 VAL 16 -7.670 -0.870 -0.870 126 3HG2 VAL 16 1HG2 VAL 16 -7.948 0.007 0.007 127 H MET 17 H MET 17 -3.967 -1.443 -1.443 128 HA MET 17 HA MET 17 -5.269 -0.215 -0.215 129 1HB MET 17 1HB MET 17 -2.332 -0.964 -0.964 130 2HB MET 17 2HB MET 17 -3.226 -0.248 -0.248 131 1HG MET 17 1HG MET 17 -2.360 1.692 1.692 132 2HG MET 17 2HG MET 17 -3.774 1.577 1.577 133 1HE MET 17 1HE MET 17 -0.756 2.653 2.653 134 2HE MET 17 2HE MET 17 -1.235 3.301 3.301 135 3HE MET 17 3HE MET 17 0.219 2.315 2.315 136 H VAL 18 H VAL 18 -4.368 -1.814 -1.814 137 HA VAL 18 HA VAL 18 -4.324 -4.620 -4.620 138 HB VAL 18 HB VAL 18 -6.540 -4.169 -4.169 139 1HG1 VAL 18 3HG1 VAL 18 -5.817 -6.285 -6.285 140 2HG1 VAL 18 1HG1 VAL 18 -6.593 -5.534 -5.534 141 3HG1 VAL 18 2HG1 VAL 18 -7.541 -5.912 -5.912 142 1HG2 VAL 18 2HG2 VAL 18 -6.640 -2.177 -2.177 143 2HG2 VAL 18 3HG2 VAL 18 -8.091 -3.152 -3.152 144 3HG2 VAL 18 1HG2 VAL 18 -7.058 -3.401 -3.401 145 H ASP 19 H ASP 19 -2.949 -5.563 -5.563 146 HA ASP 19 HA ASP 19 -1.936 -4.216 -4.216 147 1HB ASP 19 1HB ASP 19 -1.456 -6.683 -6.683 148 2HB ASP 19 2HB ASP 19 -1.587 -7.013 -7.013 149 H GLY 20 H GLY 20 -3.803 -3.586 -3.586 150 1HA GLY 20 1HA GLY 20 -5.169 -3.861 -3.861 151 2HA GLY 20 2HA GLY 20 -4.434 -5.448 -5.448 152 H CYS 21 H CYS 21 -7.317 -4.318 -4.318 153 HA CYS 21 HA CYS 21 -8.832 -6.529 -6.529 154 1HB CYS 21 1HB CYS 21 -8.494 -7.006 -7.006 155 2HB CYS 21 2HB CYS 21 -7.791 -5.424 -5.424 156 H HIS 22 H HIS 22 -8.527 -3.095 -3.095 157 HA HIS 22 HA HIS 22 -9.902 -1.279 -1.279 158 1HB HIS 22 1HB HIS 22 -10.917 -3.340 -3.340 159 2HB HIS 22 2HB HIS 22 -12.260 -2.422 -2.422 160 HD1 HIS 22 HD1 HIS 22 -11.305 0.379 0.379 161 HD2 HIS 22 HD2 HIS 22 -10.257 -2.117 -2.117 162 HE1 HIS 22 HE1 HIS 22 -10.660 1.896 1.896 163 H GLY 23 H GLY 23 -11.038 -0.310 -0.310 164 1HA GLY 23 1HA GLY 23 -12.667 -2.030 -2.030 165 2HA GLY 23 2HA GLY 23 -11.937 -0.494 -0.494 166 H SER 24 H SER 24 -14.583 -0.794 -0.794 167 HA SER 24 HA SER 24 -16.592 0.410 0.410 168 1HB SER 24 1HB SER 24 -14.654 1.926 1.926 169 2HB SER 24 2HB SER 24 -16.218 1.958 1.958 170 HG SER 24 HG SER 24 -16.968 3.144 3.144 171 H ASP 25 H ASP 25 -15.756 0.517 0.517 172 HA ASP 25 HA ASP 25 -18.154 -0.594 -0.594 173 1HB ASP 25 1HB ASP 25 -17.100 -0.474 -0.474 174 2HB ASP 25 2HB ASP 25 -16.105 0.632 0.632 175 HA PRO 26 HA PRO 26 -17.545 -4.956 -4.956 176 1HB PRO 26 1HB PRO 26 -17.444 -6.019 -6.019 177 2HB PRO 26 2HB PRO 26 -18.934 -5.448 -5.448 178 1HG PRO 26 1HG PRO 26 -17.325 -4.163 -4.163 179 2HG PRO 26 2HG PRO 26 -19.049 -3.985 -3.985 180 1HD PRO 26 1HD PRO 26 -17.006 -2.153 -2.153 181 2HD PRO 26 2HD PRO 26 -18.656 -2.122 -2.122 182 H CYS 27 H CYS 27 -15.437 -4.570 -4.570 183 HA CYS 27 HA CYS 27 -12.986 -4.202 -4.202 184 1HB CYS 27 1HB CYS 27 -13.011 -4.845 -4.845 185 2HB CYS 27 2HB CYS 27 -13.918 -6.318 -6.318 186 H ILE 28 H ILE 28 -12.610 -4.669 -4.669 187 HA ILE 28 HA ILE 28 -12.608 -7.526 -7.526 188 HB ILE 28 HB ILE 28 -11.852 -5.071 -5.071 189 1HG1 ILE 28 1HG1 ILE 28 -14.308 -5.381 -5.381 190 2HG1 ILE 28 2HG1 ILE 28 -13.937 -5.389 -5.389 191 1HG2 ILE 28 3HG2 ILE 28 -11.240 -7.840 -7.840 192 2HG2 ILE 28 1HG2 ILE 28 -12.383 -7.405 -7.405 193 3HG2 ILE 28 2HG2 ILE 28 -10.861 -6.526 -6.526 194 1HD1 ILE 28 1HD1 ILE 28 -13.744 -7.994 -7.994 195 2HD1 ILE 28 2HD1 ILE 28 -15.373 -7.333 -7.333 196 3HD1 ILE 28 3HD1 ILE 28 -14.411 -7.597 -7.597 197 H ILE 29 H ILE 29 -10.684 -8.666 -8.666 198 HA ILE 29 HA ILE 29 -8.273 -7.099 -7.099 199 HB ILE 29 HB ILE 29 -8.326 -9.954 -9.954 200 1HG1 ILE 29 1HG1 ILE 29 -10.401 -8.033 -8.033 201 2HG1 ILE 29 2HG1 ILE 29 -10.650 -9.629 -9.629 202 1HG2 ILE 29 1HG2 ILE 29 -7.250 -7.480 -7.480 203 2HG2 ILE 29 2HG2 ILE 29 -7.999 -8.443 -8.443 204 3HG2 ILE 29 3HG2 ILE 29 -6.716 -9.134 -9.134 205 1HD1 ILE 29 3HD1 ILE 29 -9.139 -9.189 -9.189 206 2HD1 ILE 29 1HD1 ILE 29 -10.874 -9.497 -9.497 207 3HD1 ILE 29 2HD1 ILE 29 -9.747 -10.715 -10.715 208 H HIS 30 H HIS 30 -6.209 -8.267 -8.267 209 HA HIS 30 HA HIS 30 -6.449 -9.366 -9.366 210 1HB HIS 30 1HB HIS 30 -4.058 -7.971 -7.971 211 2HB HIS 30 2HB HIS 30 -4.275 -8.414 -8.414 212 HD1 HIS 30 HD1 HIS 30 -4.756 -6.342 -6.342 213 HD2 HIS 30 HD2 HIS 30 -6.687 -6.317 -6.317 214 HE1 HIS 30 HE1 HIS 30 -6.144 -4.224 -4.224 215 H ARG 31 H ARG 31 -4.776 -10.918 -10.918 216 HA ARG 31 HA ARG 31 -4.074 -12.766 -12.766 217 1HB ARG 31 1HB ARG 31 -3.505 -14.098 -14.098 218 2HB ARG 31 2HB ARG 31 -4.991 -14.268 -14.268 219 1HG ARG 31 1HG ARG 31 -6.071 -12.538 -12.538 220 2HG ARG 31 2HG ARG 31 -4.572 -12.193 -12.193 221 1HD ARG 31 1HD ARG 31 -5.135 -15.003 -15.003 222 2HD ARG 31 2HD ARG 31 -6.563 -14.092 -14.092 223 HE ARG 31 HE ARG 31 -4.354 -14.409 -14.409 224 1HH1 ARG 31 1HH2 ARG 31 -6.564 -12.041 -12.041 225 2HH1 ARG 31 2HH2 ARG 31 -5.967 -10.796 -10.796 226 1HH2 ARG 31 1HH1 ARG 31 -3.331 -12.703 -12.703 227 2HH2 ARG 31 2HH1 ARG 31 -4.135 -11.171 -11.171 228 H GLY 32 H GLY 32 -1.887 -13.884 -13.884 229 1HA GLY 32 1HA GLY 32 0.416 -13.854 -13.854 230 2HA GLY 32 2HA GLY 32 0.088 -12.582 -12.582 231 H LYS 33 H LYS 33 -1.244 -11.776 -11.776 232 HA LYS 33 HA LYS 33 1.236 -10.420 -10.420 233 1HB LYS 33 1HB LYS 33 -1.243 -9.136 -9.136 234 2HB LYS 33 2HB LYS 33 -0.599 -8.475 -8.475 235 1HG LYS 33 1HG LYS 33 1.698 -8.567 -8.567 236 2HG LYS 33 2HG LYS 33 0.656 -8.552 -8.552 237 1HD LYS 33 1HD LYS 33 -0.034 -6.587 -6.587 238 2HD LYS 33 2HD LYS 33 1.486 -6.295 -6.295 239 1HE LYS 33 1HE LYS 33 -0.493 -7.052 -7.052 240 2HE LYS 33 2HE LYS 33 -1.154 -5.762 -5.762 241 1HZ LYS 33 3HZ LYS 33 1.036 -4.598 -4.598 242 2HZ LYS 33 1HZ LYS 33 1.341 -5.739 -5.739 243 3HZ LYS 33 2HZ LYS 33 0.002 -4.700 -4.700 244 HA PRO 34 HA PRO 34 -0.255 -11.900 -11.900 245 1HB PRO 34 1HB PRO 34 1.251 -10.276 -10.276 246 2HB PRO 34 2HB PRO 34 1.891 -11.695 -11.695 247 1HG PRO 34 1HG PRO 34 2.238 -8.797 -8.797 248 2HG PRO 34 2HG PRO 34 3.332 -10.156 -10.156 249 1HD PRO 34 1HD PRO 34 1.678 -8.964 -8.964 250 2HD PRO 34 2HD PRO 34 2.403 -10.581 -10.581 251 H PHE 35 H PHE 35 -2.349 -11.338 -11.338 252 HA PHE 35 HA PHE 35 -3.155 -8.540 -8.540 253 1HB PHE 35 1HB PHE 35 -4.629 -10.095 -10.095 254 2HB PHE 35 2HB PHE 35 -4.697 -11.146 -11.146 255 HD1 PHE 35 HD2 PHE 35 -4.893 -7.423 -7.423 256 HD2 PHE 35 HD1 PHE 35 -6.847 -11.032 -11.032 257 HE1 PHE 35 HE2 PHE 35 -6.776 -6.093 -6.093 258 HE2 PHE 35 HE1 PHE 35 -8.737 -9.707 -9.707 259 HZ PHE 35 HZ PHE 35 -8.702 -7.233 -7.233 260 H THR 36 H THR 36 -1.338 -8.986 -8.986 261 HA THR 36 HA THR 36 -2.360 -10.141 -10.141 262 HB THR 36 HB THR 36 -0.099 -8.260 -8.260 263 HG1 THR 36 HG1 THR 36 1.023 -10.039 -10.039 264 1HG2 THR 36 3HG2 THR 36 -1.428 -8.663 -8.663 265 2HG2 THR 36 1HG2 THR 36 0.294 -9.042 -9.042 266 3HG2 THR 36 2HG2 THR 36 -0.245 -7.445 -7.445 267 H LEU 37 H LEU 37 -4.509 -9.137 -9.137 268 HA LEU 37 HA LEU 37 -4.954 -6.329 -6.329 269 1HB LEU 37 1HB LEU 37 -7.064 -6.833 -6.833 270 2HB LEU 37 2HB LEU 37 -6.664 -8.306 -8.306 271 HG LEU 37 HG LEU 37 -5.495 -8.787 -8.787 272 1HD1 LEU 37 2HD1 LEU 37 -8.002 -7.140 -7.140 273 2HD1 LEU 37 3HD1 LEU 37 -7.373 -8.237 -8.237 274 3HD1 LEU 37 1HD1 LEU 37 -6.406 -6.862 -6.862 275 1HD2 LEU 37 2HD2 LEU 37 -8.265 -9.429 -9.429 276 2HD2 LEU 37 3HD2 LEU 37 -6.816 -10.430 -10.430 277 3HD2 LEU 37 1HD2 LEU 37 -7.601 -10.170 -10.170 278 H GLU 38 H GLU 38 -5.346 -5.018 -5.018 279 HA GLU 38 HA GLU 38 -4.080 -6.014 -6.014 280 1HB GLU 38 1HB GLU 38 -2.856 -3.708 -3.708 281 2HB GLU 38 2HB GLU 38 -2.358 -4.250 -4.250 282 1HG GLU 38 1HG GLU 38 -1.915 -6.527 -6.527 283 2HG GLU 38 2HG GLU 38 -2.185 -5.803 -5.803 284 H ALA 39 H ALA 39 -3.681 -3.774 -3.774 285 HA ALA 39 HA ALA 39 -5.211 -1.520 -1.520 286 1HB ALA 39 3HB ALA 39 -6.921 -3.867 -3.867 287 2HB ALA 39 1HB ALA 39 -7.298 -2.199 -2.199 288 3HB ALA 39 2HB ALA 39 -7.274 -2.682 -2.682 289 H LEU 40 H LEU 40 -3.810 -0.706 -0.706 290 HA LEU 40 HA LEU 40 -3.336 -2.230 -2.230 291 1HB LEU 40 1HB LEU 40 -1.929 0.037 0.037 292 2HB LEU 40 2HB LEU 40 -1.579 -0.344 -0.344 293 HG LEU 40 HG LEU 40 -0.386 -2.160 -2.160 294 1HD1 LEU 40 2HD1 LEU 40 -2.458 -2.788 -2.788 295 2HD1 LEU 40 3HD1 LEU 40 -1.107 -3.837 -3.837 296 3HD1 LEU 40 1HD1 LEU 40 -2.365 -3.508 -3.508 297 1HD2 LEU 40 2HD2 LEU 40 -0.711 -0.893 -0.893 298 2HD2 LEU 40 3HD2 LEU 40 0.600 -0.640 -0.640 299 3HD2 LEU 40 1HD2 LEU 40 0.439 -2.190 -2.190 300 H PHE 41 H PHE 41 -2.977 -0.652 -0.652 301 HA PHE 41 HA PHE 41 -4.312 1.839 1.839 302 1HB PHE 41 1HB PHE 41 -6.360 1.041 1.041 303 2HB PHE 41 2HB PHE 41 -6.436 0.847 0.847 304 HD1 PHE 41 HD2 PHE 41 -6.161 -1.343 -1.343 305 HD2 PHE 41 HD1 PHE 41 -6.143 -0.891 -0.891 306 HE1 PHE 41 HE2 PHE 41 -6.476 -3.781 -3.781 307 HE2 PHE 41 HE1 PHE 41 -6.464 -3.324 -3.324 308 HZ PHE 41 HZ PHE 41 -6.630 -4.775 -4.775 309 H ASP 42 H ASP 42 -4.094 2.700 2.700 310 HA ASP 42 HA ASP 42 -2.526 1.020 1.020 311 1HB ASP 42 1HB ASP 42 -1.822 3.415 3.415 312 2HB ASP 42 2HB ASP 42 -3.077 3.959 3.959 313 H ALA 43 H ALA 43 -3.594 0.059 0.059 314 HA ALA 43 HA ALA 43 -6.259 0.198 0.198 315 1HB ALA 43 1HB ALA 43 -4.073 -1.077 -1.077 316 2HB ALA 43 2HB ALA 43 -4.416 0.018 0.018 317 3HB ALA 43 3HB ALA 43 -5.646 -1.118 -1.118 318 H ASN 44 H ASN 44 -7.517 1.911 1.911 319 HA ASN 44 HA ASN 44 -6.281 4.037 4.037 320 1HB ASN 44 1HB ASN 44 -8.482 5.135 5.135 321 2HB ASN 44 2HB ASN 44 -6.773 5.527 5.527 322 1HD2 ASN 44 2HD2 ASN 44 -8.424 2.745 2.745 323 2HD2 ASN 44 1HD2 ASN 44 -9.089 2.938 2.938 324 H GLN 45 H GLN 45 -8.443 1.578 1.578 325 HA GLN 45 HA GLN 45 -10.603 2.924 2.924 326 1HB GLN 45 1HB GLN 45 -11.628 0.704 0.704 327 2HB GLN 45 2HB GLN 45 -11.091 1.052 1.052 328 1HG GLN 45 1HG GLN 45 -8.941 -0.169 -0.169 329 2HG GLN 45 2HG GLN 45 -9.686 -0.680 -0.680 330 1HE2 GLN 45 2HE2 GLN 45 -12.166 -2.083 -2.083 331 2HE2 GLN 45 1HE2 GLN 45 -12.137 -0.457 -0.457 332 H ASN 46 H ASN 46 -10.749 0.359 0.359 333 HA ASN 46 HA ASN 46 -8.346 0.587 0.587 334 1HB ASN 46 1HB ASN 46 -10.659 0.870 0.870 335 2HB ASN 46 2HB ASN 46 -9.155 1.786 1.786 336 1HD2 ASN 46 2HD2 ASN 46 -12.468 3.469 3.469 337 2HD2 ASN 46 1HD2 ASN 46 -12.481 2.065 2.065 338 H THR 47 H THR 47 -8.673 -1.820 -1.820 339 HA THR 47 HA THR 47 -10.024 -3.389 -3.389 340 HB THR 47 HB THR 47 -11.714 -3.081 -3.081 341 HG1 THR 47 HG1 THR 47 -11.721 -5.425 -5.425 342 1HG2 THR 47 1HG2 THR 47 -9.401 -3.253 -3.253 343 2HG2 THR 47 2HG2 THR 47 -10.469 -4.588 -4.588 344 3HG2 THR 47 3HG2 THR 47 -11.066 -2.929 -2.929 345 H LYS 48 H LYS 48 -8.415 -4.762 -4.762 346 HA LYS 48 HA LYS 48 -6.159 -5.498 -5.498 347 1HB LYS 48 1HB LYS 48 -6.138 -7.515 -7.515 348 2HB LYS 48 2HB LYS 48 -5.703 -5.897 -5.897 349 1HG LYS 48 1HG LYS 48 -7.875 -5.542 -5.542 350 2HG LYS 48 2HG LYS 48 -8.515 -6.999 -6.999 351 1HD LYS 48 1HD LYS 48 -8.030 -7.422 -7.422 352 2HD LYS 48 2HD LYS 48 -6.947 -8.367 -8.367 353 1HE LYS 48 1HE LYS 48 -5.652 -5.897 -5.897 354 2HE LYS 48 2HE LYS 48 -6.290 -6.324 -6.324 355 1HZ LYS 48 3HZ LYS 48 -4.725 -8.174 -8.174 356 2HZ LYS 48 1HZ LYS 48 -4.052 -7.240 -7.240 357 3HZ LYS 48 2HZ LYS 48 -5.210 -8.430 -8.430 358 H THR 49 H THR 49 -9.417 -6.566 -6.566 359 HA THR 49 HA THR 49 -8.879 -9.177 -9.177 360 HB THR 49 HB THR 49 -11.337 -9.366 -9.366 361 HG1 THR 49 HG1 THR 49 -12.551 -7.610 -7.610 362 1HG2 THR 49 2HG2 THR 49 -10.173 -8.333 -8.333 363 2HG2 THR 49 3HG2 THR 49 -11.781 -9.048 -9.048 364 3HG2 THR 49 1HG2 THR 49 -10.357 -10.013 -10.013 365 H ALA 50 H ALA 50 -10.895 -9.242 -9.242 366 HA ALA 50 HA ALA 50 -10.933 -7.084 -7.084 367 1HB ALA 50 1HB ALA 50 -8.390 -7.804 -7.804 368 2HB ALA 50 2HB ALA 50 -8.928 -9.110 -9.110 369 3HB ALA 50 3HB ALA 50 -9.136 -7.428 -7.428 370 H LYS 51 H LYS 51 -11.970 -7.733 -7.733 371 HA LYS 51 HA LYS 51 -12.825 -10.598 -10.598 372 1HB LYS 51 1HB LYS 51 -14.491 -8.200 -8.200 373 2HB LYS 51 2HB LYS 51 -15.011 -9.885 -9.885 374 1HG LYS 51 1HG LYS 51 -14.287 -9.794 -9.794 375 2HG LYS 51 2HG LYS 51 -14.524 -8.058 -8.058 376 1HD LYS 51 1HD LYS 51 -16.681 -9.730 -9.730 377 2HD LYS 51 2HD LYS 51 -16.524 -9.824 -9.824 378 1HE LYS 51 1HE LYS 51 -16.520 -7.305 -7.305 379 2HE LYS 51 2HE LYS 51 -16.895 -7.320 -7.320 380 1HZ LYS 51 2HZ LYS 51 -18.736 -8.999 -8.999 381 2HZ LYS 51 3HZ LYS 51 -18.575 -7.998 -7.998 382 3HZ LYS 51 1HZ LYS 51 -18.995 -7.326 -7.326 383 H ILE 52 H ILE 52 -14.120 -10.519 -10.519 384 HA ILE 52 HA ILE 52 -12.571 -9.151 -9.151 385 HB ILE 52 HB ILE 52 -10.853 -10.756 -10.756 386 1HG1 ILE 52 1HG1 ILE 52 -11.610 -11.583 -11.583 387 2HG1 ILE 52 2HG1 ILE 52 -11.143 -9.913 -9.913 388 1HG2 ILE 52 3HG2 ILE 52 -12.811 -12.791 -12.791 389 2HG2 ILE 52 1HG2 ILE 52 -11.156 -13.153 -13.153 390 3HG2 ILE 52 2HG2 ILE 52 -12.333 -12.609 -12.609 391 1HD1 ILE 52 2HD1 ILE 52 -9.431 -12.173 -12.173 392 2HD1 ILE 52 3HD1 ILE 52 -9.291 -11.638 -11.638 393 3HD1 ILE 52 1HD1 ILE 52 -8.972 -10.508 -10.508 394 H GLU 53 H GLU 53 -13.297 -9.602 -9.602 395 HA GLU 53 HA GLU 53 -15.321 -11.699 -11.699 396 1HB GLU 53 1HB GLU 53 -16.052 -8.973 -8.973 397 2HB GLU 53 2HB GLU 53 -16.474 -9.343 -9.343 398 1HG GLU 53 1HG GLU 53 -18.070 -10.856 -10.856 399 2HG GLU 53 2HG GLU 53 -17.121 -11.466 -11.466 400 H ILE 54 H ILE 54 -12.823 -11.589 -11.589 401 HA ILE 54 HA ILE 54 -12.862 -10.203 -10.203 402 HB ILE 54 HB ILE 54 -11.003 -12.190 -12.190 403 1HG1 ILE 54 1HG1 ILE 54 -9.654 -10.430 -10.430 404 2HG1 ILE 54 2HG1 ILE 54 -10.077 -9.564 -9.564 405 1HG2 ILE 54 1HG2 ILE 54 -11.195 -11.249 -11.249 406 2HG2 ILE 54 2HG2 ILE 54 -9.592 -11.436 -11.436 407 3HG2 ILE 54 3HG2 ILE 54 -10.688 -12.815 -12.815 408 1HD1 ILE 54 2HD1 ILE 54 -12.267 -8.972 -8.972 409 2HD1 ILE 54 3HD1 ILE 54 -11.826 -9.821 -9.821 410 3HD1 ILE 54 1HD1 ILE 54 -10.940 -8.376 -8.376 411 H LYS 55 H LYS 55 -12.942 -11.288 -11.288 412 HA LYS 55 HA LYS 55 -13.492 -14.161 -14.161 413 1HB LYS 55 1HB LYS 55 -15.665 -12.134 -12.134 414 2HB LYS 55 2HB LYS 55 -15.679 -13.625 -13.625 415 1HG LYS 55 1HG LYS 55 -16.329 -14.858 -14.858 416 2HG LYS 55 2HG LYS 55 -15.133 -14.122 -14.122 417 1HD LYS 55 1HD LYS 55 -17.880 -13.058 -13.058 418 2HD LYS 55 2HD LYS 55 -17.295 -13.540 -13.540 419 1HE LYS 55 1HE LYS 55 -15.467 -11.662 -11.662 420 2HE LYS 55 2HE LYS 55 -16.712 -11.048 -11.048 421 1HZ LYS 55 2HZ LYS 55 -18.226 -11.471 -11.471 422 2HZ LYS 55 3HZ LYS 55 -16.765 -11.332 -11.332 423 3HZ LYS 55 1HZ LYS 55 -17.303 -10.049 -10.049 424 H ALA 56 H ALA 56 -11.830 -14.291 -14.291 425 HA ALA 56 HA ALA 56 -12.267 -12.864 -12.864 426 1HB ALA 56 3HB ALA 56 -9.923 -13.174 -13.174 427 2HB ALA 56 1HB ALA 56 -9.683 -14.110 -14.110 428 3HB ALA 56 2HB ALA 56 -10.061 -12.390 -12.390 429 H SER 57 H SER 57 -12.852 -14.181 -14.181 430 HA SER 57 HA SER 57 -12.436 -17.123 -17.123 431 1HB SER 57 1HB SER 57 -14.611 -17.458 -17.458 432 2HB SER 57 2HB SER 57 -14.835 -15.713 -15.713 433 HG SER 57 HG SER 57 -14.583 -17.377 -17.377 434 H LEU 58 H LEU 58 -11.053 -18.010 -18.010 435 HA LEU 58 HA LEU 58 -10.846 -16.713 -16.713 436 1HB LEU 58 1HB LEU 58 -8.842 -16.422 -16.422 437 2HB LEU 58 2HB LEU 58 -8.576 -18.148 -18.148 438 HG LEU 58 HG LEU 58 -7.297 -16.563 -16.563 439 1HD1 LEU 58 3HD1 LEU 58 -8.484 -19.100 -19.100 440 2HD1 LEU 58 1HD1 LEU 58 -8.693 -18.231 -18.231 441 3HD1 LEU 58 2HD1 LEU 58 -7.078 -18.444 -18.444 442 1HD2 LEU 58 2HD2 LEU 58 -9.397 -15.158 -15.158 443 2HD2 LEU 58 3HD2 LEU 58 -8.483 -15.622 -15.622 444 3HD2 LEU 58 1HD2 LEU 58 -9.961 -16.482 -16.482 445 H ASP 59 H ASP 59 -10.547 -18.211 -18.211 446 HA ASP 59 HA ASP 59 -11.993 -20.589 -20.589 447 1HB ASP 59 1HB ASP 59 -11.139 -19.510 -19.510 448 2HB ASP 59 2HB ASP 59 -9.524 -20.108 -20.108 449 H GLY 60 H GLY 60 -8.413 -20.527 -20.527 450 1HA GLY 60 1HA GLY 60 -8.435 -23.143 -23.143 451 2HA GLY 60 2HA GLY 60 -7.043 -22.421 -22.421 452 H LEU 61 H LEU 61 -8.881 -20.292 -20.292 453 HA LEU 61 HA LEU 61 -7.211 -20.844 -20.844 454 1HB LEU 61 1HB LEU 61 -6.445 -18.878 -18.878 455 2HB LEU 61 2HB LEU 61 -7.049 -18.026 -18.026 456 HG LEU 61 HG LEU 61 -4.634 -18.474 -18.474 457 1HD1 LEU 61 3HD1 LEU 61 -6.694 -19.462 -19.462 458 2HD1 LEU 61 1HD1 LEU 61 -5.153 -20.290 -20.290 459 3HD1 LEU 61 2HD1 LEU 61 -5.237 -18.534 -18.534 460 1HD2 LEU 61 1HD2 LEU 61 -4.812 -20.604 -20.604 461 2HD2 LEU 61 2HD2 LEU 61 -3.733 -20.678 -20.678 462 3HD2 LEU 61 3HD2 LEU 61 -5.333 -21.416 -21.416 463 H GLU 62 H GLU 62 -9.475 -21.301 -21.301 464 HA GLU 62 HA GLU 62 -11.391 -19.122 -19.122 465 1HB GLU 62 1HB GLU 62 -11.281 -21.924 -21.924 466 2HB GLU 62 2HB GLU 62 -12.530 -20.813 -20.813 467 1HG GLU 62 1HG GLU 62 -12.821 -20.350 -20.350 468 2HG GLU 62 2HG GLU 62 -12.105 -21.956 -21.956 469 H ILE 63 H ILE 63 -9.693 -17.623 -17.623 470 HA ILE 63 HA ILE 63 -8.911 -18.107 -18.107 471 HB ILE 63 HB ILE 63 -9.933 -15.403 -15.403 472 1HG1 ILE 63 1HG1 ILE 63 -7.301 -16.743 -16.743 473 2HG1 ILE 63 2HG1 ILE 63 -8.465 -16.011 -16.011 474 1HG2 ILE 63 3HG2 ILE 63 -8.552 -16.460 -16.460 475 2HG2 ILE 63 1HG2 ILE 63 -7.501 -15.306 -15.306 476 3HG2 ILE 63 2HG2 ILE 63 -9.106 -14.810 -14.810 477 1HD1 ILE 63 1HD1 ILE 63 -8.018 -13.829 -13.829 478 2HD1 ILE 63 2HD1 ILE 63 -6.514 -14.642 -14.642 479 3HD1 ILE 63 3HD1 ILE 63 -6.860 -14.299 -14.299 480 H ASP 64 H ASP 64 -10.074 -17.271 -17.271 481 HA ASP 64 HA ASP 64 -12.869 -16.608 -16.608 482 1HB ASP 64 1HB ASP 64 -12.242 -19.387 -19.387 483 2HB ASP 64 2HB ASP 64 -13.001 -19.161 -19.161 484 H VAL 65 H VAL 65 -13.705 -16.174 -16.174 485 HA VAL 65 HA VAL 65 -11.956 -16.759 -16.759 486 HB VAL 65 HB VAL 65 -12.966 -13.986 -13.986 487 1HG1 VAL 65 3HG1 VAL 65 -11.562 -15.277 -15.277 488 2HG1 VAL 65 1HG1 VAL 65 -10.991 -13.673 -13.673 489 3HG1 VAL 65 2HG1 VAL 65 -12.677 -13.907 -13.907 490 1HG2 VAL 65 2HG2 VAL 65 -10.449 -15.451 -15.451 491 2HG2 VAL 65 3HG2 VAL 65 -11.240 -14.142 -14.142 492 3HG2 VAL 65 1HG2 VAL 65 -10.270 -13.783 -13.783 493 HA PRO 66 HA PRO 66 -16.500 -17.164 -17.164 494 1HB PRO 66 1HB PRO 66 -16.398 -19.855 -19.855 495 2HB PRO 66 2HB PRO 66 -16.678 -19.190 -19.190 496 1HG PRO 66 1HG PRO 66 -14.221 -20.465 -20.465 497 2HG PRO 66 2HG PRO 66 -14.760 -20.344 -20.344 498 1HD PRO 66 1HD PRO 66 -12.767 -18.742 -18.742 499 2HD PRO 66 2HD PRO 66 -13.524 -18.444 -18.444 500 H GLY 67 H GLY 67 -13.644 -17.294 -17.294 501 1HA GLY 67 1HA GLY 67 -13.925 -16.547 -16.547 502 2HA GLY 67 2HA GLY 67 -14.938 -17.983 -17.983 503 H ILE 68 H ILE 68 -12.040 -17.937 -17.937 504 HA ILE 68 HA ILE 68 -10.936 -20.296 -20.296 505 HB ILE 68 HB ILE 68 -9.485 -17.875 -17.875 506 1HG1 ILE 68 1HG1 ILE 68 -11.337 -19.686 -19.686 507 2HG1 ILE 68 2HG1 ILE 68 -10.375 -18.443 -18.443 508 1HG2 ILE 68 2HG2 ILE 68 -8.014 -19.493 -19.493 509 2HG2 ILE 68 3HG2 ILE 68 -8.642 -20.780 -20.780 510 3HG2 ILE 68 1HG2 ILE 68 -7.710 -19.462 -19.462 511 1HD1 ILE 68 3HD1 ILE 68 -8.475 -20.043 -20.043 512 2HD1 ILE 68 1HD1 ILE 68 -9.487 -21.285 -21.285 513 3HD1 ILE 68 2HD1 ILE 68 -9.901 -20.638 -20.638 514 H ASP 69 H ASP 69 -9.917 -16.970 -16.970 515 HA ASP 69 HA ASP 69 -8.361 -17.942 -17.942 516 1HB ASP 69 1HB ASP 69 -7.968 -15.578 -15.578 517 2HB ASP 69 2HB ASP 69 -7.793 -15.854 -15.854 518 H THR 70 H THR 70 -9.030 -16.071 -16.071 519 HA THR 70 HA THR 70 -11.813 -16.897 -16.897 520 HB THR 70 HB THR 70 -10.948 -16.782 -16.782 521 HG1 THR 70 HG1 THR 70 -8.535 -17.267 -17.267 522 1HG2 THR 70 1HG2 THR 70 -10.180 -18.815 -18.815 523 2HG2 THR 70 2HG2 THR 70 -9.540 -18.995 -18.995 524 3HG2 THR 70 3HG2 THR 70 -11.283 -18.965 -18.965 525 H ASN 71 H ASN 71 -9.747 -14.343 -14.343 526 HA ASN 71 HA ASN 71 -11.640 -12.297 -12.297 527 1HB ASN 71 1HB ASN 71 -10.034 -13.031 -13.031 528 2HB ASN 71 2HB ASN 71 -10.076 -11.309 -11.309 529 1HD2 ASN 71 2HD2 ASN 71 -13.100 -12.463 -12.463 530 2HD2 ASN 71 1HD2 ASN 71 -11.456 -12.854 -12.854 531 H ALA 72 H ALA 72 -10.318 -12.448 -12.448 532 HA ALA 72 HA ALA 72 -8.596 -11.575 -11.575 533 1HB ALA 72 2HB ALA 72 -10.068 -9.635 -9.635 534 2HB ALA 72 3HB ALA 72 -8.405 -9.055 -9.055 535 3HB ALA 72 1HB ALA 72 -9.338 -9.458 -9.458 536 H CYS 73 H CYS 73 -7.683 -12.909 -12.909 537 HA CYS 73 HA CYS 73 -5.257 -11.338 -11.338 538 1HB CYS 73 1HB CYS 73 -6.604 -12.322 -12.322 539 2HB CYS 73 2HB CYS 73 -6.370 -13.919 -13.919 540 H HIS 74 H HIS 74 -6.171 -14.658 -14.658 541 HA HIS 74 HA HIS 74 -3.533 -15.573 -15.573 542 1HB HIS 74 1HB HIS 74 -5.854 -16.834 -16.834 543 2HB HIS 74 2HB HIS 74 -5.891 -16.529 -16.529 544 HD1 HIS 74 HD1 HIS 74 -5.424 -18.937 -18.937 545 HD2 HIS 74 HD2 HIS 74 -2.529 -17.445 -17.445 546 HE1 HIS 74 HE1 HIS 74 -3.516 -20.602 -20.602 547 H PHE 75 H PHE 75 -5.477 -13.279 -13.279 548 HA PHE 75 HA PHE 75 -3.952 -13.635 -13.635 549 1HB PHE 75 1HB PHE 75 -6.578 -12.295 -12.295 550 2HB PHE 75 2HB PHE 75 -5.724 -11.962 -11.962 551 HD1 PHE 75 HD1 PHE 75 -5.460 -13.692 -13.692 552 HD2 PHE 75 HD2 PHE 75 -7.571 -14.445 -14.445 553 HE1 PHE 75 HE1 PHE 75 -6.429 -15.748 -15.748 554 HE2 PHE 75 HE2 PHE 75 -8.532 -16.513 -16.513 555 HZ PHE 75 HZ PHE 75 -7.966 -17.163 -17.163 556 H VAL 76 H VAL 76 -4.473 -11.490 -11.490 557 HA VAL 76 HA VAL 76 -2.422 -9.672 -9.672 558 HB VAL 76 HB VAL 76 -3.944 -8.268 -8.268 559 1HG1 VAL 76 1HG1 VAL 76 -5.914 -10.085 -10.085 560 2HG1 VAL 76 2HG1 VAL 76 -6.424 -8.711 -8.711 561 3HG1 VAL 76 3HG1 VAL 76 -5.498 -10.025 -10.025 562 1HG2 VAL 76 1HG2 VAL 76 -4.798 -8.076 -8.076 563 2HG2 VAL 76 2HG2 VAL 76 -3.797 -6.932 -6.932 564 3HG2 VAL 76 3HG2 VAL 76 -5.519 -7.069 -7.069 565 H LYS 77 H LYS 77 -2.251 -7.699 -7.699 566 HA LYS 77 HA LYS 77 -1.535 -8.787 -8.787 567 1HB LYS 77 1HB LYS 77 -2.143 -5.877 -5.877 568 2HB LYS 77 2HB LYS 77 -1.014 -6.547 -6.547 569 1HG LYS 77 1HG LYS 77 -0.753 -6.594 -6.594 570 2HG LYS 77 2HG LYS 77 0.287 -5.748 -5.748 571 1HD LYS 77 1HD LYS 77 -0.065 -8.758 -8.758 572 2HD LYS 77 2HD LYS 77 1.293 -7.885 -7.885 573 1HE LYS 77 1HE LYS 77 1.185 -6.878 -6.878 574 2HE LYS 77 2HE LYS 77 0.787 -8.582 -8.582 575 1HZ LYS 77 1HZ LYS 77 2.877 -8.423 -8.423 576 2HZ LYS 77 2HZ LYS 77 3.291 -7.431 -7.431 577 3HZ LYS 77 3HZ LYS 77 2.913 -9.068 -9.068 578 H CYS 78 H CYS 78 -3.440 -9.861 -9.861 579 HA CYS 78 HA CYS 78 -6.030 -9.328 -9.328 580 1HB CYS 78 1HB CYS 78 -5.317 -9.756 -9.756 581 2HB CYS 78 2HB CYS 78 -6.121 -10.842 -10.842 582 HA PRO 79 HA PRO 79 -6.068 -6.046 -6.046 583 1HB PRO 79 1HB PRO 79 -3.697 -5.011 -5.011 584 2HB PRO 79 2HB PRO 79 -4.544 -6.359 -6.359 585 1HG PRO 79 1HG PRO 79 -2.103 -6.411 -6.411 586 2HG PRO 79 2HG PRO 79 -2.638 -7.542 -7.542 587 1HD PRO 79 1HD PRO 79 -2.840 -7.962 -7.962 588 2HD PRO 79 2HD PRO 79 -3.668 -8.906 -8.906 589 H LEU 80 H LEU 80 -6.841 -4.606 -4.606 590 HA LEU 80 HA LEU 80 -4.939 -3.203 -3.203 591 1HB LEU 80 1HB LEU 80 -7.955 -3.262 -3.262 592 2HB LEU 80 2HB LEU 80 -7.110 -2.164 -2.164 593 HG LEU 80 HG LEU 80 -7.908 -4.756 -4.756 594 1HD1 LEU 80 3HD1 LEU 80 -6.836 -2.525 -2.525 595 2HD1 LEU 80 1HD1 LEU 80 -5.702 -3.824 -3.824 596 3HD1 LEU 80 2HD1 LEU 80 -7.409 -4.003 -4.003 597 1HD2 LEU 80 1HD2 LEU 80 -4.901 -4.693 -4.693 598 2HD2 LEU 80 2HD2 LEU 80 -6.050 -5.710 -5.710 599 3HD2 LEU 80 3HD2 LEU 80 -5.782 -5.963 -5.963 600 H VAL 81 H VAL 81 -7.773 -2.184 -2.184 601 HA VAL 81 HA VAL 81 -8.152 -0.176 -0.176 602 HB VAL 81 HB VAL 81 -7.450 -0.807 -0.807 603 1HG1 VAL 81 3HG1 VAL 81 -6.978 -2.910 -2.910 604 2HG1 VAL 81 1HG1 VAL 81 -5.279 -2.419 -2.419 605 3HG1 VAL 81 2HG1 VAL 81 -6.035 -2.692 -2.692 606 1HG2 VAL 81 2HG2 VAL 81 -4.860 0.320 0.320 607 2HG2 VAL 81 3HG2 VAL 81 -5.888 0.883 0.883 608 3HG2 VAL 81 1HG2 VAL 81 -4.880 -0.549 -0.549 609 H LYS 82 H LYS 82 -6.519 1.859 1.859 610 HA LYS 82 HA LYS 82 -5.508 2.822 2.822 611 1HB LYS 82 1HB LYS 82 -5.650 5.072 5.072 612 2HB LYS 82 2HB LYS 82 -7.199 4.214 4.214 613 1HG LYS 82 1HG LYS 82 -5.748 3.318 3.318 614 2HG LYS 82 2HG LYS 82 -5.689 5.084 5.084 615 1HD LYS 82 1HD LYS 82 -8.340 4.330 4.330 616 2HD LYS 82 2HD LYS 82 -7.900 3.378 3.378 617 1HE LYS 82 1HE LYS 82 -8.515 5.231 5.231 618 2HE LYS 82 2HE LYS 82 -6.931 5.844 5.844 619 1HZ LYS 82 3HZ LYS 82 -8.346 6.438 6.438 620 2HZ LYS 82 1HZ LYS 82 -9.568 6.552 6.552 621 3HZ LYS 82 2HZ LYS 82 -8.167 7.502 7.502 622 H GLY 83 H GLY 83 -3.825 1.061 1.061 623 1HA GLY 83 1HA GLY 83 -1.591 2.913 2.913 624 2HA GLY 83 2HA GLY 83 -1.957 1.621 1.621 625 H GLN 84 H GLN 84 -2.315 1.136 1.136 626 HA GLN 84 HA GLN 84 0.327 -0.077 -0.077 627 1HB GLN 84 1HB GLN 84 -0.600 -1.896 -1.896 628 2HB GLN 84 2HB GLN 84 -2.139 -1.774 -1.774 629 1HG GLN 84 1HG GLN 84 -1.303 -3.502 -3.502 630 2HG GLN 84 2HG GLN 84 -0.459 -2.227 -2.227 631 1HE2 GLN 84 2HE2 GLN 84 1.640 -4.706 -4.706 632 2HE2 GLN 84 1HE2 GLN 84 -0.057 -4.737 -4.737 633 H GLN 85 H GLN 85 0.869 -0.388 -0.388 634 HA GLN 85 HA GLN 85 -1.171 0.304 0.304 635 1HB GLN 85 1HB GLN 85 1.047 1.689 1.689 636 2HB GLN 85 2HB GLN 85 1.803 0.315 0.315 637 1HG GLN 85 1HG GLN 85 0.255 0.572 0.572 638 2HG GLN 85 2HG GLN 85 -0.507 1.944 1.944 639 1HE2 GLN 85 2HE2 GLN 85 3.419 2.523 2.523 640 2HE2 GLN 85 1HE2 GLN 85 2.968 1.040 1.040 641 H TYR 86 H TYR 86 -1.387 -1.242 -1.242 642 HA TYR 86 HA TYR 86 0.497 -3.476 -3.476 643 1HB TYR 86 1HB TYR 86 -0.629 -4.958 -4.958 644 2HB TYR 86 2HB TYR 86 -1.549 -3.583 -3.583 645 HD1 TYR 86 HD1 TYR 86 -1.419 -5.995 -5.995 646 HD2 TYR 86 HD2 TYR 86 -3.876 -3.549 -3.549 647 HE1 TYR 86 HE1 TYR 86 -3.427 -7.049 -7.049 648 HE2 TYR 86 HE2 TYR 86 -5.891 -4.668 -4.668 649 HH TYR 86 HH TYR 86 -6.499 -6.748 -6.748 650 H ASP 87 H ASP 87 -0.055 -5.033 -5.033 651 HA ASP 87 HA ASP 87 -1.854 -3.701 -3.701 652 1HB ASP 87 1HB ASP 87 -0.161 -4.143 -4.143 653 2HB ASP 87 2HB ASP 87 0.510 -3.165 -3.165 654 H ILE 88 H ILE 88 -3.525 -5.325 -5.325 655 HA ILE 88 HA ILE 88 -3.131 -8.137 -8.137 656 HB ILE 88 HB ILE 88 -5.254 -6.655 -6.655 657 1HG1 ILE 88 1HG1 ILE 88 -6.480 -8.678 -8.678 658 2HG1 ILE 88 2HG1 ILE 88 -4.884 -9.348 -9.348 659 1HG2 ILE 88 2HG2 ILE 88 -4.870 -5.704 -5.704 660 2HG2 ILE 88 3HG2 ILE 88 -5.716 -7.171 -7.171 661 3HG2 ILE 88 1HG2 ILE 88 -6.510 -6.019 -6.019 662 1HD1 ILE 88 2HD1 ILE 88 -5.319 -8.289 -8.289 663 2HD1 ILE 88 3HD1 ILE 88 -7.014 -8.410 -8.410 664 3HD1 ILE 88 1HD1 ILE 88 -6.016 -9.864 -9.864 665 H LYS 89 H LYS 89 -4.433 -8.927 -8.927 666 HA LYS 89 HA LYS 89 -3.742 -7.753 -7.753 667 1HB LYS 89 1HB LYS 89 -1.354 -8.569 -8.569 668 2HB LYS 89 2HB LYS 89 -1.464 -9.370 -9.370 669 1HG LYS 89 1HG LYS 89 -2.153 -6.930 -6.930 670 2HG LYS 89 2HG LYS 89 -1.240 -6.446 -6.446 671 1HD LYS 89 1HD LYS 89 0.325 -8.427 -8.427 672 2HD LYS 89 2HD LYS 89 -0.257 -7.405 -7.405 673 1HE LYS 89 1HE LYS 89 0.555 -5.405 -5.405 674 2HE LYS 89 2HE LYS 89 1.082 -6.389 -6.389 675 1HZ LYS 89 3HZ LYS 89 2.054 -6.929 -6.929 676 2HZ LYS 89 1HZ LYS 89 2.800 -5.759 -5.759 677 3HZ LYS 89 2HZ LYS 89 2.747 -7.379 -7.379 678 H TYR 90 H TYR 90 -3.084 -9.426 -9.426 679 HA TYR 90 HA TYR 90 -3.844 -12.239 -12.239 680 1HB TYR 90 1HB TYR 90 -5.734 -10.278 -10.278 681 2HB TYR 90 2HB TYR 90 -5.806 -12.024 -12.024 682 HD1 TYR 90 HD1 TYR 90 -5.895 -13.542 -13.542 683 HD2 TYR 90 HD2 TYR 90 -6.751 -9.335 -9.335 684 HE1 TYR 90 HE1 TYR 90 -7.047 -13.826 -13.826 685 HE2 TYR 90 HE2 TYR 90 -7.910 -9.616 -9.616 686 HH TYR 90 HH TYR 90 -7.815 -12.657 -12.657 687 H THR 91 H THR 91 -1.611 -12.068 -12.068 688 HA THR 91 HA THR 91 -0.770 -10.942 -10.942 689 HB THR 91 HB THR 91 0.909 -12.717 -12.717 690 HG1 THR 91 HG1 THR 91 0.668 -14.496 -14.496 691 1HG2 THR 91 3HG2 THR 91 0.406 -11.076 -11.076 692 2HG2 THR 91 1HG2 THR 91 0.778 -12.655 -12.655 693 3HG2 THR 91 2HG2 THR 91 1.930 -11.872 -11.872 694 H TRP 92 H TRP 92 -0.060 -12.588 -12.588 695 HA TRP 92 HA TRP 92 -2.209 -14.381 -14.381 696 1HB TRP 92 1HB TRP 92 -3.045 -11.955 -11.955 697 2HB TRP 92 2HB TRP 92 -1.886 -11.874 -11.874 698 HD1 TRP 92 HD1 TRP 92 -2.110 -14.171 -14.171 699 HE1 TRP 92 HE1 TRP 92 -4.297 -15.058 -15.058 700 HE3 TRP 92 HE3 TRP 92 -5.493 -12.119 -12.119 701 HZ2 TRP 92 HZ2 TRP 92 -7.100 -14.907 -14.907 702 HZ3 TRP 92 HZ3 TRP 92 -7.917 -12.511 -12.511 703 HH2 TRP 92 HH2 TRP 92 -8.729 -13.906 -13.906 704 H ASN 93 H ASN 93 -0.528 -15.869 -15.869 705 HA ASN 93 HA ASN 93 1.672 -15.098 -15.098 706 1HB ASN 93 1HB ASN 93 1.644 -17.082 -17.082 707 2HB ASN 93 2HB ASN 93 0.649 -17.914 -17.914 708 1HD2 ASN 93 2HD2 ASN 93 4.102 -18.870 -18.870 709 2HD2 ASN 93 1HD2 ASN 93 2.974 -19.198 -19.198 710 H VAL 94 H VAL 94 0.973 -14.364 -14.364 711 HA VAL 94 HA VAL 94 -1.261 -15.824 -15.824 712 HB VAL 94 HB VAL 94 -0.059 -13.116 -13.116 713 1HG1 VAL 94 3HG1 VAL 94 -1.056 -14.836 -14.836 714 2HG1 VAL 94 1HG1 VAL 94 -1.799 -13.243 -13.243 715 3HG1 VAL 94 2HG1 VAL 94 -0.049 -13.398 -13.398 716 1HG2 VAL 94 1HG2 VAL 94 -2.654 -14.415 -14.415 717 2HG2 VAL 94 2HG2 VAL 94 -1.982 -12.900 -12.900 718 3HG2 VAL 94 3HG2 VAL 94 -2.750 -12.955 -12.955 719 HA PRO 95 HA PRO 95 1.764 -17.812 -17.812 720 1HB PRO 95 1HB PRO 95 -0.056 -19.687 -19.687 721 2HB PRO 95 2HB PRO 95 0.850 -19.851 -19.851 722 1HG PRO 95 1HG PRO 95 -2.012 -19.175 -19.175 723 2HG PRO 95 2HG PRO 95 -1.229 -19.897 -19.897 724 1HD PRO 95 1HD PRO 95 -2.035 -17.196 -17.196 725 2HD PRO 95 2HD PRO 95 -1.002 -17.863 -17.863 726 H LYS 96 H LYS 96 -1.316 -18.462 -18.462 727 HA LYS 96 HA LYS 96 -0.953 -16.270 -16.270 728 1HB LYS 96 1HB LYS 96 -0.905 -19.188 -19.188 729 2HB LYS 96 2HB LYS 96 -2.044 -18.312 -18.312 730 1HG LYS 96 1HG LYS 96 0.515 -16.923 -16.923 731 2HG LYS 96 2HG LYS 96 0.693 -18.539 -18.539 732 1HD LYS 96 1HD LYS 96 -1.220 -17.952 -17.952 733 2HD LYS 96 2HD LYS 96 -1.061 -16.288 -16.288 734 1HE LYS 96 1HE LYS 96 1.473 -17.587 -17.587 735 2HE LYS 96 2HE LYS 96 0.328 -17.302 -17.302 736 1HZ LYS 96 3HZ LYS 96 0.169 -14.986 -14.986 737 2HZ LYS 96 1HZ LYS 96 1.312 -15.273 -15.273 738 3HZ LYS 96 2HZ LYS 96 1.764 -15.400 -15.400 739 H ILE 97 H ILE 97 -2.983 -18.861 -18.861 740 HA ILE 97 HA ILE 97 -5.217 -18.937 -18.937 741 HB ILE 97 HB ILE 97 -5.008 -15.928 -15.928 742 1HG1 ILE 97 1HG1 ILE 97 -4.420 -17.142 -17.142 743 2HG1 ILE 97 2HG1 ILE 97 -3.337 -17.840 -17.840 744 1HG2 ILE 97 1HG2 ILE 97 -6.854 -17.981 -17.981 745 2HG2 ILE 97 2HG2 ILE 97 -6.358 -16.764 -16.764 746 3HG2 ILE 97 3HG2 ILE 97 -7.142 -16.271 -16.271 747 1HD1 ILE 97 3HD1 ILE 97 -3.791 -14.885 -14.885 748 2HD1 ILE 97 1HD1 ILE 97 -2.750 -15.540 -15.540 749 3HD1 ILE 97 2HD1 ILE 97 -2.358 -15.817 -15.817 750 H ALA 98 H ALA 98 -4.357 -17.759 -17.759 751 HA ALA 98 HA ALA 98 -5.602 -17.286 -17.286 752 1HB ALA 98 1HB ALA 98 -6.688 -19.509 -19.509 753 2HB ALA 98 2HB ALA 98 -8.078 -18.499 -18.499 754 3HB ALA 98 3HB ALA 98 -6.982 -19.034 -19.034 755 HA PRO 99 HA PRO 99 -8.362 -13.912 -13.912 756 1HB PRO 99 1HB PRO 99 -10.142 -14.203 -14.203 757 2HB PRO 99 2HB PRO 99 -8.452 -13.743 -13.743 758 1HG PRO 99 1HG PRO 99 -9.788 -16.386 -16.386 759 2HG PRO 99 2HG PRO 99 -8.488 -15.655 -15.655 760 1HD PRO 99 1HD PRO 99 -8.101 -17.631 -17.631 761 2HD PRO 99 2HD PRO 99 -6.827 -16.520 -16.520 762 H LYS 100 H LYS 100 -10.398 -13.422 -13.422 763 HA LYS 100 HA LYS 100 -12.367 -13.883 -13.883 764 1HB LYS 100 1HB LYS 100 -12.427 -15.898 -15.898 765 2HB LYS 100 2HB LYS 100 -13.833 -15.523 -15.523 766 1HG LYS 100 1HG LYS 100 -12.299 -13.588 -13.588 767 2HG LYS 100 2HG LYS 100 -13.909 -14.230 -14.230 768 1HD LYS 100 1HD LYS 100 -13.797 -13.037 -13.037 769 2HD LYS 100 2HD LYS 100 -13.279 -11.882 -11.882 770 1HE LYS 100 1HE LYS 100 -15.372 -11.695 -11.695 771 2HE LYS 100 2HE LYS 100 -15.623 -13.440 -13.440 772 1HZ LYS 100 1HZ LYS 100 -15.548 -12.484 -12.484 773 2HZ LYS 100 2HZ LYS 100 -16.650 -11.540 -11.540 774 3HZ LYS 100 3HZ LYS 100 -16.834 -13.227 -13.227 775 H SER 101 H SER 101 -12.795 -14.957 -14.957 776 HA SER 101 HA SER 101 -11.432 -17.584 -17.584 777 1HB SER 101 1HB SER 101 -10.687 -15.819 -15.819 778 2HB SER 101 2HB SER 101 -12.355 -15.514 -15.514 779 HG SER 101 HG SER 101 -11.765 -16.934 -16.934 780 H GLU 102 H GLU 102 -12.657 -19.295 -19.295 781 HA GLU 102 HA GLU 102 -15.267 -19.701 -19.701 782 1HB GLU 102 1HB GLU 102 -13.540 -20.843 -20.843 783 2HB GLU 102 2HB GLU 102 -15.260 -20.991 -20.991 784 1HG GLU 102 1HG GLU 102 -15.668 -22.354 -22.354 785 2HG GLU 102 2HG GLU 102 -14.375 -21.638 -21.638 786 H ASN 103 H ASN 103 -14.169 -17.804 -17.804 787 HA ASN 103 HA ASN 103 -16.545 -16.277 -16.277 788 1HB ASN 103 1HB ASN 103 -17.257 -18.687 -18.687 789 2HB ASN 103 2HB ASN 103 -16.471 -18.161 -18.161 790 1HD2 ASN 103 2HD2 ASN 103 -20.169 -16.892 -16.892 791 2HD2 ASN 103 1HD2 ASN 103 -19.462 -18.250 -18.250 792 H VAL 104 H VAL 104 -16.454 -14.766 -14.766 793 HA VAL 104 HA VAL 104 -14.142 -14.940 -14.940 794 HB VAL 104 HB VAL 104 -14.161 -12.362 -12.362 795 1HG1 VAL 104 1HG1 VAL 104 -12.510 -13.616 -13.616 796 2HG1 VAL 104 2HG1 VAL 104 -11.768 -14.117 -14.117 797 3HG1 VAL 104 3HG1 VAL 104 -11.942 -12.402 -12.402 798 1HG2 VAL 104 3HG2 VAL 104 -14.630 -14.045 -14.045 799 2HG2 VAL 104 1HG2 VAL 104 -13.112 -13.164 -13.164 800 3HG2 VAL 104 2HG2 VAL 104 -13.103 -14.823 -14.823 801 H VAL 105 H VAL 105 -14.154 -13.135 -13.135 802 HA VAL 105 HA VAL 105 -16.267 -11.218 -11.218 803 HB VAL 105 HB VAL 105 -16.897 -13.932 -13.932 804 1HG1 VAL 105 2HG1 VAL 105 -17.118 -11.594 -11.594 805 2HG1 VAL 105 3HG1 VAL 105 -18.073 -13.068 -13.068 806 3HG1 VAL 105 1HG1 VAL 105 -16.314 -13.139 -13.139 807 1HG2 VAL 105 3HG2 VAL 105 -18.368 -11.350 -11.350 808 2HG2 VAL 105 1HG2 VAL 105 -18.432 -12.858 -12.858 809 3HG2 VAL 105 2HG2 VAL 105 -19.198 -12.753 -12.753 810 H VAL 106 H VAL 106 -15.196 -9.687 -9.687 811 HA VAL 106 HA VAL 106 -13.372 -10.642 -10.642 812 HB VAL 106 HB VAL 106 -13.393 -8.022 -8.022 813 1HG1 VAL 106 1HG1 VAL 106 -12.229 -8.763 -8.763 814 2HG1 VAL 106 2HG1 VAL 106 -10.951 -8.446 -8.446 815 3HG1 VAL 106 3HG1 VAL 106 -12.163 -7.211 -7.211 816 1HG2 VAL 106 2HG2 VAL 106 -12.625 -10.094 -10.094 817 2HG2 VAL 106 3HG2 VAL 106 -11.388 -8.849 -8.849 818 3HG2 VAL 106 1HG2 VAL 106 -11.360 -10.270 -10.270 819 H THR 107 H THR 107 -13.477 -9.633 -9.633 820 HA THR 107 HA THR 107 -15.277 -7.448 -7.448 821 HB THR 107 HB THR 107 -16.102 -10.139 -10.139 822 HG1 THR 107 HG1 THR 107 -17.675 -10.184 -10.184 823 1HG2 THR 107 1HG2 THR 107 -17.293 -7.363 -7.363 824 2HG2 THR 107 2HG2 THR 107 -18.244 -8.789 -8.789 825 3HG2 THR 107 3HG2 THR 107 -16.863 -8.329 -8.329 826 H VAL 108 H VAL 108 -15.097 -6.888 -6.888 827 HA VAL 108 HA VAL 108 -13.454 -8.519 -8.519 828 HB VAL 108 HB VAL 108 -12.190 -6.386 -6.386 829 1HG1 VAL 108 1HG1 VAL 108 -11.388 -6.940 -6.940 830 2HG1 VAL 108 2HG1 VAL 108 -10.473 -5.966 -5.966 831 3HG1 VAL 108 3HG1 VAL 108 -12.061 -5.427 -5.427 832 1HG2 VAL 108 2HG2 VAL 108 -11.584 -9.121 -9.121 833 2HG2 VAL 108 3HG2 VAL 108 -11.291 -8.418 -8.418 834 3HG2 VAL 108 1HG2 VAL 108 -10.212 -8.045 -8.045 835 H LYS 109 H LYS 109 -12.948 -7.398 -7.398 836 HA LYS 109 HA LYS 109 -13.845 -4.813 -4.813 837 1HB LYS 109 1HB LYS 109 -16.105 -5.319 -5.319 838 2HB LYS 109 2HB LYS 109 -15.897 -6.993 -6.993 839 1HG LYS 109 1HG LYS 109 -16.077 -6.462 -6.462 840 2HG LYS 109 2HG LYS 109 -15.164 -4.966 -4.966 841 1HD LYS 109 1HD LYS 109 -17.456 -4.402 -4.402 842 2HD LYS 109 2HD LYS 109 -17.158 -3.934 -3.934 843 1HE LYS 109 1HE LYS 109 -18.075 -6.287 -6.287 844 2HE LYS 109 2HE LYS 109 -18.722 -6.291 -6.291 845 1HZ LYS 109 2HZ LYS 109 -19.187 -3.905 -3.905 846 2HZ LYS 109 3HZ LYS 109 -20.055 -5.301 -5.301 847 3HZ LYS 109 1HZ LYS 109 -20.196 -4.662 -4.662 848 H LEU 110 H LEU 110 -12.848 -4.381 -4.381 849 HA LEU 110 HA LEU 110 -12.151 -6.680 -6.680 850 1HB LEU 110 1HB LEU 110 -10.268 -5.325 -5.325 851 2HB LEU 110 2HB LEU 110 -10.731 -4.013 -4.013 852 HG LEU 110 HG LEU 110 -10.451 -5.604 -5.604 853 1HD1 LEU 110 3HD1 LEU 110 -9.293 -7.338 -7.338 854 2HD1 LEU 110 1HD1 LEU 110 -9.081 -7.646 -7.646 855 3HD1 LEU 110 2HD1 LEU 110 -10.691 -7.710 -7.710 856 1HD2 LEU 110 2HD2 LEU 110 -8.186 -4.845 -4.845 857 2HD2 LEU 110 3HD2 LEU 110 -8.645 -4.121 -4.121 858 3HD2 LEU 110 1HD2 LEU 110 -7.863 -5.702 -5.702 859 H ILE 111 H ILE 111 -13.221 -6.643 -6.643 860 HA ILE 111 HA ILE 111 -14.276 -4.014 -4.014 861 HB ILE 111 HB ILE 111 -15.529 -6.686 -6.686 862 1HG1 ILE 111 1HG1 ILE 111 -16.319 -4.840 -4.840 863 2HG1 ILE 111 2HG1 ILE 111 -15.290 -6.255 -6.255 864 1HG2 ILE 111 1HG2 ILE 111 -16.002 -4.253 -4.253 865 2HG2 ILE 111 2HG2 ILE 111 -17.064 -4.153 -4.153 866 3HG2 ILE 111 3HG2 ILE 111 -17.276 -5.451 -5.451 867 1HD1 ILE 111 1HD1 ILE 111 -17.382 -7.284 -7.284 868 2HD1 ILE 111 2HD1 ILE 111 -18.192 -6.105 -6.105 869 3HD1 ILE 111 3HD1 ILE 111 -17.229 -7.394 -7.394 870 H GLY 112 H GLY 112 -13.124 -3.467 -3.467 871 1HA GLY 112 1HA GLY 112 -11.926 -5.546 -5.546 872 2HA GLY 112 2HA GLY 112 -11.822 -3.806 -3.806 873 H ASP 113 H ASP 113 -13.165 -2.935 -2.935 874 HA ASP 113 HA ASP 113 -15.612 -4.423 -4.423 875 1HB ASP 113 1HB ASP 113 -13.339 -4.701 -4.701 876 2HB ASP 113 2HB ASP 113 -14.065 -3.281 -3.281 877 H ASN 114 H ASN 114 -14.305 -1.693 -1.693 878 HA ASN 114 HA ASN 114 -16.185 -0.003 -0.003 879 1HB ASN 114 1HB ASN 114 -13.698 1.045 1.045 880 2HB ASN 114 2HB ASN 114 -14.677 1.820 1.820 881 1HD2 ASN 114 2HD2 ASN 114 -12.070 -1.167 -1.167 882 2HD2 ASN 114 1HD2 ASN 114 -12.602 -1.083 -1.083 883 H GLY 115 H GLY 115 -15.134 -1.143 -1.143 884 1HA GLY 115 1HA GLY 115 -17.379 -0.223 -0.223 885 2HA GLY 115 2HA GLY 115 -16.106 0.976 0.976 886 H VAL 116 H VAL 116 -15.814 0.448 0.448 887 HA VAL 116 HA VAL 116 -14.797 -2.312 -2.312 888 HB VAL 116 HB VAL 116 -16.550 -1.980 -1.980 889 1HG1 VAL 116 3HG1 VAL 116 -15.671 0.882 0.882 890 2HG1 VAL 116 1HG1 VAL 116 -16.554 0.342 0.342 891 3HG1 VAL 116 2HG1 VAL 116 -17.289 0.200 0.200 892 1HG2 VAL 116 2HG2 VAL 116 -14.158 -2.313 -2.313 893 2HG2 VAL 116 3HG2 VAL 116 -15.527 -1.961 -1.961 894 3HG2 VAL 116 1HG2 VAL 116 -14.406 -0.677 -0.677 895 H LEU 117 H LEU 117 -12.616 -2.212 -2.212 896 HA LEU 117 HA LEU 117 -10.902 -0.015 -0.015 897 1HB LEU 117 1HB LEU 117 -10.275 -2.923 -2.923 898 2HB LEU 117 2HB LEU 117 -9.084 -1.666 -1.666 899 HG LEU 117 HG LEU 117 -11.220 -1.802 -1.802 900 1HD1 LEU 117 1HD1 LEU 117 -10.929 -4.235 -4.235 901 2HD1 LEU 117 2HD1 LEU 117 -9.255 -4.105 -4.105 902 3HD1 LEU 117 3HD1 LEU 117 -10.572 -3.893 -3.893 903 1HD2 LEU 117 3HD2 LEU 117 -8.299 -1.382 -1.382 904 2HD2 LEU 117 1HD2 LEU 117 -9.471 -0.575 -0.575 905 3HD2 LEU 117 2HD2 LEU 117 -8.821 -2.148 -2.148 906 H ALA 118 H ALA 118 -11.612 -2.479 -2.479 907 HA ALA 118 HA ALA 118 -10.907 -0.435 -0.435 908 1HB ALA 118 3HB ALA 118 -9.695 -3.186 -3.186 909 2HB ALA 118 1HB ALA 118 -9.676 -2.298 -2.298 910 3HB ALA 118 2HB ALA 118 -8.859 -1.637 -1.637 911 H CYS 119 H CYS 119 -11.264 -1.738 -1.738 912 HA CYS 119 HA CYS 119 -13.327 -3.686 -3.686 913 1HB CYS 119 1HB CYS 119 -15.104 -2.443 -2.443 914 2HB CYS 119 2HB CYS 119 -14.213 -0.929 -0.929 915 H ALA 120 H ALA 120 -14.048 -4.018 -4.018 916 HA ALA 120 HA ALA 120 -13.243 -2.315 -2.315 917 1HB ALA 120 2HB ALA 120 -10.991 -3.147 -3.147 918 2HB ALA 120 3HB ALA 120 -11.529 -4.787 -4.787 919 3HB ALA 120 1HB ALA 120 -11.389 -3.596 -3.596 920 H ILE 121 H ILE 121 -14.616 -2.859 -2.859 921 HA ILE 121 HA ILE 121 -15.391 -5.720 -5.720 922 HB ILE 121 HB ILE 121 -17.344 -3.400 -3.400 923 1HG1 ILE 121 1HG1 ILE 121 -17.935 -5.392 -5.392 924 2HG1 ILE 121 2HG1 ILE 121 -16.218 -5.019 -5.019 925 1HG2 ILE 121 3HG2 ILE 121 -17.478 -6.012 -6.012 926 2HG2 ILE 121 1HG2 ILE 121 -18.560 -5.975 -5.975 927 3HG2 ILE 121 2HG2 ILE 121 -18.751 -4.795 -4.795 928 1HD1 ILE 121 2HD1 ILE 121 -18.172 -2.763 -2.763 929 2HD1 ILE 121 3HD1 ILE 121 -18.012 -3.558 -3.558 930 3HD1 ILE 121 1HD1 ILE 121 -16.611 -2.788 -2.788 931 H ALA 122 H ALA 122 -15.362 -6.337 -6.337 932 HA ALA 122 HA ALA 122 -15.242 -4.161 -4.161 933 1HB ALA 122 2HB ALA 122 -13.334 -6.029 -6.029 934 2HB ALA 122 3HB ALA 122 -14.334 -6.903 -6.903 935 3HB ALA 122 1HB ALA 122 -13.637 -5.343 -5.343 936 H THR 123 H THR 123 -17.596 -4.146 -4.146 937 HA THR 123 HA THR 123 -19.369 -6.224 -6.224 938 HB THR 123 HB THR 123 -19.586 -3.987 -3.987 939 HG1 THR 123 HG1 THR 123 -20.138 -2.592 -2.592 940 1HG2 THR 123 1HG2 THR 123 -21.285 -5.930 -5.930 941 2HG2 THR 123 2HG2 THR 123 -21.760 -4.421 -4.421 942 3HG2 THR 123 3HG2 THR 123 -21.764 -4.543 -4.543 943 H HIS 124 H HIS 124 -19.125 -8.031 -8.031 944 HA HIS 124 HA HIS 124 -18.713 -9.415 -9.415 945 1HB HIS 124 1HB HIS 124 -19.476 -6.794 -6.794 946 2HB HIS 124 2HB HIS 124 -18.908 -8.113 -8.113 947 HD1 HIS 124 HD1 HIS 124 -21.888 -6.875 -6.875 948 HD2 HIS 124 HD2 HIS 124 -20.510 -10.601 -10.601 949 HE1 HIS 124 HE1 HIS 124 -23.902 -8.411 -8.411 950 H GLY 125 H GLY 125 -17.047 -9.969 -9.969 951 1HA GLY 125 1HA GLY 125 -14.838 -8.151 -8.151 952 2HA GLY 125 2HA GLY 125 -14.430 -9.377 -9.377 953 H LYS 126 H LYS 126 -14.563 -8.754 -8.754 954 HA LYS 126 HA LYS 126 -14.575 -11.686 -11.686 955 1HB LYS 126 1HB LYS 126 -15.628 -9.306 -9.306 956 2HB LYS 126 2HB LYS 126 -14.905 -10.574 -10.574 957 1HG LYS 126 1HG LYS 126 -16.479 -12.168 -12.168 958 2HG LYS 126 2HG LYS 126 -16.867 -11.318 -11.318 959 1HD LYS 126 1HD LYS 126 -18.025 -9.570 -9.570 960 2HD LYS 126 2HD LYS 126 -17.536 -10.284 -10.284 961 1HE LYS 126 1HE LYS 126 -18.973 -12.118 -12.118 962 2HE LYS 126 2HE LYS 126 -19.081 -11.922 -11.922 963 1HZ LYS 126 2HZ LYS 126 -20.221 -9.755 -9.755 964 2HZ LYS 126 3HZ LYS 126 -20.327 -10.240 -10.240 965 3HZ LYS 126 1HZ LYS 126 -21.103 -11.145 -11.145 966 H ILE 127 H ILE 127 -12.748 -12.552 -12.552 967 HA ILE 127 HA ILE 127 -10.372 -10.857 -10.857 968 HB ILE 127 HB ILE 127 -10.925 -13.815 -13.815 969 1HG1 ILE 127 1HG1 ILE 127 -8.984 -13.652 -13.652 970 2HG1 ILE 127 2HG1 ILE 127 -9.575 -11.995 -11.995 971 1HG2 ILE 127 1HG2 ILE 127 -8.560 -12.222 -12.222 972 2HG2 ILE 127 2HG2 ILE 127 -8.283 -13.809 -13.809 973 3HG2 ILE 127 3HG2 ILE 127 -9.299 -13.656 -13.656 974 1HD1 ILE 127 1HD1 ILE 127 -11.825 -13.771 -13.771 975 2HD1 ILE 127 2HD1 ILE 127 -10.710 -14.354 -14.354 976 3HD1 ILE 127 3HD1 ILE 127 -11.341 -12.709 -12.709 977 H ARG 128 H ARG 128 -9.199 -10.676 -10.676 978 HA ARG 128 HA ARG 128 -9.324 -11.572 -11.572 979 1HB ARG 128 1HB ARG 128 -11.585 -11.952 -11.952 980 2HB ARG 128 2HB ARG 128 -12.042 -10.416 -10.416 981 1HG ARG 128 1HG ARG 128 -10.394 -9.934 -9.934 982 2HG ARG 128 2HG ARG 128 -11.740 -10.985 -10.985 983 1HD ARG 128 1HD ARG 128 -12.699 -8.915 -8.915 984 2HD ARG 128 2HD ARG 128 -11.809 -8.178 -8.178 985 HE ARG 128 HE ARG 128 -14.253 -9.842 -9.842 986 1HH1 ARG 128 1HH2 ARG 128 -13.314 -10.675 -10.675 987 2HH1 ARG 128 2HH2 ARG 128 -13.361 -9.339 -9.339 988 1HH2 ARG 128 1HH1 ARG 128 -13.619 -6.948 -6.948 989 2HH2 ARG 128 2HH1 ARG 128 -13.534 -7.229 -7.229 990 H ASP 129 H ASP 129 -11.116 -8.566 -8.566 991 HA ASP 129 HA ASP 129 -8.897 -6.781 -6.781 992 1HB ASP 129 1HB ASP 129 -8.447 -7.800 -7.800 993 2HB ASP 129 2HB ASP 129 -9.972 -7.100 -7.100
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