NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
12659 | 1tbd | 4127 | cing | recoord | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H GLY 1 HT1 GLY 1 111.124 -5.809 25.046 2 2H GLY 1 HT3 GLY 1 110.160 -5.650 26.432 3 3H GLY 1 HT2 GLY 1 111.314 -4.459 26.061 4 1HA GLY 1 HA2 GLY 1 112.780 -5.732 26.102 5 2HA GLY 1 HA1 GLY 1 111.423 -7.026 26.616 6 H SER 2 HN SER 2 112.830 -7.314 24.636 7 HA SER 2 HA SER 2 115.273 -8.501 25.209 8 1HB SER 2 HB2 SER 2 114.599 -9.855 26.965 9 2HB SER 2 HB1 SER 2 112.962 -10.029 26.340 10 HG SER 2 HG SER 2 114.082 -11.949 26.031 11 H LYS 3 HN LYS 3 112.085 -9.152 23.790 12 HA LYS 3 HA LYS 3 113.304 -10.645 21.560 13 1HB LYS 3 HB2 LYS 3 110.429 -9.735 21.734 14 2HB LYS 3 HB1 LYS 3 111.086 -11.126 20.871 15 1HG LYS 3 HG2 LYS 3 111.550 -12.286 22.922 16 2HG LYS 3 HG1 LYS 3 111.209 -10.847 23.882 17 1HD LYS 3 HD2 LYS 3 108.867 -11.066 22.543 18 2HD LYS 3 HD1 LYS 3 109.329 -12.767 22.620 19 1HE LYS 3 HE2 LYS 3 109.874 -12.115 25.154 20 2HE LYS 3 HE1 LYS 3 108.652 -10.884 24.836 21 1HZ LYS 3 HZ1 LYS 3 107.713 -13.271 23.769 22 2HZ LYS 3 HZ3 LYS 3 108.294 -13.634 25.321 23 3HZ LYS 3 HZ2 LYS 3 107.114 -12.428 25.117 24 H VAL 4 HN VAL 4 113.240 -9.899 19.369 25 HA VAL 4 HA VAL 4 114.040 -7.329 18.806 26 HB VAL 4 HB VAL 4 113.984 -9.162 17.137 27 1HG1 VAL 4 HG11 VAL 4 111.413 -9.530 17.899 28 2HG1 VAL 4 HG13 VAL 4 111.158 -8.566 16.443 29 3HG1 VAL 4 HG12 VAL 4 112.044 -10.089 16.349 30 1HG2 VAL 4 HG22 VAL 4 113.565 -6.430 16.713 31 2HG2 VAL 4 HG21 VAL 4 114.103 -7.600 15.508 32 3HG2 VAL 4 HG23 VAL 4 112.388 -7.218 15.661 33 H GLU 5 HN GLU 5 113.003 -5.578 19.727 34 HA GLU 5 HA GLU 5 110.268 -5.255 20.238 35 1HB GLU 5 HB2 GLU 5 112.535 -3.637 20.389 36 2HB GLU 5 HB1 GLU 5 111.474 -2.779 19.271 37 1HG GLU 5 HG2 GLU 5 110.034 -2.217 20.919 38 2HG GLU 5 HG1 GLU 5 110.022 -3.858 21.566 39 H ASP 6 HN ASP 6 108.665 -5.590 18.763 40 HA ASP 6 HA ASP 6 108.946 -5.447 15.952 41 1HB ASP 6 HB2 ASP 6 106.784 -5.795 17.858 42 2HB ASP 6 HB1 ASP 6 106.266 -4.808 16.490 43 HA PRO 7 HA PRO 7 109.017 -1.028 15.473 44 1HB PRO 7 HB2 PRO 7 109.063 -1.046 12.727 45 2HB PRO 7 HB1 PRO 7 110.486 -1.373 13.730 46 1HG PRO 7 HG2 PRO 7 108.818 -3.282 12.163 47 2HG PRO 7 HG1 PRO 7 110.516 -3.413 12.649 48 1HD PRO 7 HD2 PRO 7 108.326 -4.722 13.883 49 2HD PRO 7 HD1 PRO 7 109.973 -4.592 14.537 50 H LYS 8 HN LYS 8 107.199 0.234 15.655 51 HA LYS 8 HA LYS 8 104.661 -0.678 14.475 52 1HB LYS 8 HB2 LYS 8 105.423 1.642 16.263 53 2HB LYS 8 HB1 LYS 8 103.797 1.447 15.609 54 1HG LYS 8 HG2 LYS 8 103.339 0.044 17.307 55 2HG LYS 8 HG1 LYS 8 104.524 -1.079 16.640 56 1HD LYS 8 HD2 LYS 8 105.959 -0.665 18.324 57 2HD LYS 8 HD1 LYS 8 105.854 1.074 18.047 58 1HE LYS 8 HE2 LYS 8 103.704 -0.468 19.512 59 2HE LYS 8 HE1 LYS 8 105.075 0.268 20.342 60 1HZ LYS 8 HZ1 LYS 8 103.994 2.151 18.577 61 2HZ LYS 8 HZ3 LYS 8 102.715 1.495 19.477 62 3HZ LYS 8 HZ2 LYS 8 104.037 2.203 20.275 63 H ASP 9 HN ASP 9 107.268 1.237 13.495 64 HA ASP 9 HA ASP 9 105.843 2.096 11.105 65 1HB ASP 9 HB2 ASP 9 106.593 4.079 13.252 66 2HB ASP 9 HB1 ASP 9 106.494 4.562 11.559 67 H PHE 10 HN PHE 10 107.569 3.992 10.138 68 HA PHE 10 HA PHE 10 109.933 2.408 9.566 69 1HB PHE 10 HB2 PHE 10 109.044 5.199 8.824 70 2HB PHE 10 HB1 PHE 10 110.626 4.575 8.357 71 HD1 PHE 10 HD1 PHE 10 107.145 3.165 8.507 72 HD2 PHE 10 HD2 PHE 10 110.684 3.815 6.161 73 HE1 PHE 10 HE1 PHE 10 106.109 1.951 6.608 74 HE2 PHE 10 HE2 PHE 10 109.648 2.602 4.263 75 HZ PHE 10 HZ PHE 10 107.361 1.670 4.487 76 HA PRO 11 HA PRO 11 112.667 4.013 12.599 77 1HB PRO 11 HB2 PRO 11 115.035 3.960 11.203 78 2HB PRO 11 HB1 PRO 11 114.231 2.507 11.822 79 1HG PRO 11 HG2 PRO 11 114.394 3.511 9.018 80 2HG PRO 11 HG1 PRO 11 114.188 1.853 9.606 81 1HD PRO 11 HD2 PRO 11 112.139 3.514 8.581 82 2HD PRO 11 HD1 PRO 11 111.904 1.996 9.473 83 H SER 12 HN SER 12 113.564 5.999 13.271 84 HA SER 12 HA SER 12 112.871 8.387 11.983 85 1HB SER 12 HB2 SER 12 114.557 9.478 13.424 86 2HB SER 12 HB1 SER 12 113.626 8.287 14.328 87 HG SER 12 HG SER 12 115.824 8.014 14.738 88 H GLU 13 HN GLU 13 115.576 6.266 11.367 89 HA GLU 13 HA GLU 13 117.274 8.088 9.976 90 1HB GLU 13 HB2 GLU 13 117.575 5.536 10.686 91 2HB GLU 13 HB1 GLU 13 117.038 5.261 9.028 92 1HG GLU 13 HG2 GLU 13 119.182 5.625 8.415 93 2HG GLU 13 HG1 GLU 13 118.885 7.325 8.779 94 H LEU 14 HN LEU 14 114.643 5.984 8.792 95 HA LEU 14 HA LEU 14 114.870 7.212 6.111 96 1HB LEU 14 HB2 LEU 14 113.519 4.827 7.270 97 2HB LEU 14 HB1 LEU 14 112.725 5.593 5.894 98 HG LEU 14 HG LEU 14 115.569 5.416 5.419 99 1HD1 LEU 14 HD13 LEU 14 114.863 3.369 7.036 100 2HD1 LEU 14 HD12 LEU 14 114.400 2.685 5.477 101 3HD1 LEU 14 HD11 LEU 14 116.063 3.204 5.753 102 1HD2 LEU 14 HD22 LEU 14 113.203 5.357 3.994 103 2HD2 LEU 14 HD21 LEU 14 114.795 5.001 3.325 104 3HD2 LEU 14 HD23 LEU 14 113.758 3.686 3.879 105 H LEU 15 HN LEU 15 113.455 8.084 8.958 106 HA LEU 15 HA LEU 15 110.863 8.949 7.885 107 1HB LEU 15 HB2 LEU 15 112.274 9.403 10.526 108 2HB LEU 15 HB1 LEU 15 110.703 10.108 10.144 109 HG LEU 15 HG LEU 15 111.263 7.141 9.941 110 1HD1 LEU 15 HD13 LEU 15 111.009 8.754 12.296 111 2HD1 LEU 15 HD12 LEU 15 109.556 7.768 12.137 112 3HD1 LEU 15 HD11 LEU 15 111.143 6.999 12.182 113 1HD2 LEU 15 HD22 LEU 15 108.736 8.819 10.033 114 2HD2 LEU 15 HD21 LEU 15 109.348 7.920 8.645 115 3HD2 LEU 15 HD23 LEU 15 108.761 7.056 10.066 116 H SER 16 HN SER 16 113.817 9.988 7.181 117 HA SER 16 HA SER 16 113.503 12.860 7.660 118 1HB SER 16 HB2 SER 16 115.554 11.085 6.434 119 2HB SER 16 HB1 SER 16 115.500 12.748 5.857 120 HG SER 16 HG SER 16 116.854 12.381 7.733 121 H PHE 17 HN PHE 17 112.431 10.616 5.306 122 HA PHE 17 HA PHE 17 111.287 12.820 3.731 123 1HB PHE 17 HB2 PHE 17 112.162 11.550 1.595 124 2HB PHE 17 HB1 PHE 17 113.198 12.721 2.407 125 HD1 PHE 17 HD2 PHE 17 112.405 9.416 3.871 126 HD2 PHE 17 HD1 PHE 17 115.287 11.722 1.673 127 HE1 PHE 17 HE2 PHE 17 114.098 7.655 4.244 128 HE2 PHE 17 HE1 PHE 17 116.981 9.957 2.043 129 HZ PHE 17 HZ PHE 17 116.390 7.920 3.331 130 H LEU 18 HN LEU 18 109.390 11.741 4.732 131 HA LEU 18 HA LEU 18 108.492 9.468 3.028 132 1HB LEU 18 HB2 LEU 18 108.844 9.489 5.965 133 2HB LEU 18 HB1 LEU 18 107.292 8.865 5.406 134 HG LEU 18 HG LEU 18 109.900 7.947 4.193 135 1HD1 LEU 18 HD12 LEU 18 108.751 7.323 6.823 136 2HD1 LEU 18 HD11 LEU 18 109.040 5.895 5.830 137 3HD1 LEU 18 HD13 LEU 18 110.367 6.997 6.197 138 1HD2 LEU 18 HD23 LEU 18 107.766 7.527 2.976 139 2HD2 LEU 18 HD22 LEU 18 108.532 6.030 3.510 140 3HD2 LEU 18 HD21 LEU 18 107.150 6.678 4.394 141 H SER 19 HN SER 19 105.970 9.126 3.753 142 HA SER 19 HA SER 19 104.756 11.789 3.292 143 1HB SER 19 HB2 SER 19 104.016 10.019 1.805 144 2HB SER 19 HB1 SER 19 103.622 8.980 3.172 145 HG SER 19 HG SER 19 102.068 10.731 1.978 146 H HIS 20 HN HIS 20 104.348 9.004 5.502 147 HA HIS 20 HA HIS 20 103.642 8.977 7.744 148 1HB HIS 20 HB2 HIS 20 103.679 12.000 7.631 149 2HB HIS 20 HB1 HIS 20 103.850 10.967 9.051 150 HD1 HIS 20 HD1 HIS 20 106.008 9.100 8.538 151 HD2 HIS 20 HD2 HIS 20 106.167 12.940 6.924 152 HE1 HIS 20 HE1 HIS 20 108.442 9.552 8.004 153 H ALA 21 HN ALA 21 101.745 8.869 5.622 154 HA ALA 21 HA ALA 21 99.348 9.664 7.096 155 1HB ALA 21 HB3 ALA 21 100.067 11.734 5.790 156 2HB ALA 21 HB2 ALA 21 99.729 10.816 4.323 157 3HB ALA 21 HB1 ALA 21 98.431 11.161 5.465 158 H VAL 22 HN VAL 22 97.489 8.541 6.321 159 HA VAL 22 HA VAL 22 98.096 6.503 4.215 160 HB VAL 22 HB VAL 22 95.851 5.877 5.997 161 1HG1 VAL 22 HG12 VAL 22 98.363 4.507 5.024 162 2HG1 VAL 22 HG11 VAL 22 97.258 3.739 6.164 163 3HG1 VAL 22 HG13 VAL 22 96.695 4.184 4.553 164 1HG2 VAL 22 HG23 VAL 22 98.555 6.519 7.125 165 2HG2 VAL 22 HG22 VAL 22 96.961 6.744 7.845 166 3HG2 VAL 22 HG21 VAL 22 97.679 5.135 7.780 167 H PHE 23 HN PHE 23 95.723 8.763 5.505 168 HA PHE 23 HA PHE 23 94.029 8.267 3.093 169 1HB PHE 23 HB2 PHE 23 93.221 9.746 5.609 170 2HB PHE 23 HB1 PHE 23 92.168 9.134 4.334 171 HD1 PHE 23 HD1 PHE 23 93.928 6.504 4.054 172 HD2 PHE 23 HD2 PHE 23 91.975 8.476 7.333 173 HE1 PHE 23 HE1 PHE 23 93.740 4.337 5.245 174 HE2 PHE 23 HE2 PHE 23 91.788 6.309 8.524 175 HZ PHE 23 HZ PHE 23 92.670 4.240 7.480 176 H SER 24 HN SER 24 96.196 9.725 2.471 177 HA SER 24 HA SER 24 95.820 12.576 2.928 178 1HB SER 24 HB2 SER 24 97.951 11.056 2.150 179 2HB SER 24 HB1 SER 24 97.439 11.724 0.603 180 HG SER 24 HG SER 24 98.873 12.917 2.395 181 H ASN 25 HN ASN 25 95.575 14.080 0.984 182 HA ASN 25 HA ASN 25 93.372 13.036 -0.726 183 1HB ASN 25 HB2 ASN 25 93.888 15.547 0.611 184 2HB ASN 25 HB1 ASN 25 93.670 15.815 -1.119 185 1HD2 ASN 25 HD22 ASN 25 90.303 15.740 0.590 186 2HD2 ASN 25 HD21 ASN 25 91.714 16.647 0.849 187 H ARG 26 HN ARG 26 96.421 12.767 -1.100 188 HA ARG 26 HA ARG 26 96.511 13.954 -3.847 189 1HB ARG 26 HB2 ARG 26 98.463 13.931 -1.655 190 2HB ARG 26 HB1 ARG 26 99.133 13.368 -3.187 191 1HG ARG 26 HG2 ARG 26 98.160 15.415 -4.282 192 2HG ARG 26 HG1 ARG 26 97.713 15.996 -2.678 193 1HD ARG 26 HD2 ARG 26 100.187 15.648 -2.053 194 2HD ARG 26 HD1 ARG 26 100.481 15.524 -3.787 195 HE ARG 26 HE ARG 26 99.296 17.850 -3.855 196 1HH1 ARG 26 HH11 ARG 26 98.887 19.233 -1.738 197 2HH1 ARG 26 HH12 ARG 26 100.376 19.630 -0.947 198 1HH2 ARG 26 HH21 ARG 26 102.219 17.222 -2.630 199 2HH2 ARG 26 HH22 ARG 26 102.262 18.492 -1.452 200 H THR 27 HN THR 27 97.339 12.599 -5.515 201 HA THR 27 HA THR 27 97.126 9.706 -4.896 202 HB THR 27 HB THR 27 97.148 9.475 -7.405 203 HG1 THR 27 HG1 THR 27 96.852 11.476 -8.533 204 1HG2 THR 27 HG21 THR 27 95.101 10.125 -5.756 205 2HG2 THR 27 HG23 THR 27 95.040 11.490 -6.871 206 3HG2 THR 27 HG22 THR 27 94.895 9.843 -7.485 207 H LEU 28 HN LEU 28 98.987 8.635 -4.462 208 HA LEU 28 HA LEU 28 101.537 9.725 -5.554 209 1HB LEU 28 HB2 LEU 28 100.909 7.886 -3.236 210 2HB LEU 28 HB1 LEU 28 102.549 8.110 -3.844 211 HG LEU 28 HG LEU 28 101.589 10.708 -3.605 212 1HD1 LEU 28 HD12 LEU 28 99.652 9.687 -2.324 213 2HD1 LEU 28 HD11 LEU 28 100.822 9.171 -1.109 214 3HD1 LEU 28 HD13 LEU 28 100.580 10.889 -1.427 215 1HD2 LEU 28 HD23 LEU 28 103.264 8.973 -1.770 216 2HD2 LEU 28 HD22 LEU 28 103.834 10.083 -3.018 217 3HD2 LEU 28 HD21 LEU 28 103.091 10.714 -1.548 218 H ALA 29 HN ALA 29 103.020 8.278 -6.599 219 HA ALA 29 HA ALA 29 101.751 5.748 -7.582 220 1HB ALA 29 HB3 ALA 29 102.210 7.772 -9.215 221 2HB ALA 29 HB2 ALA 29 103.874 7.191 -9.146 222 3HB ALA 29 HB1 ALA 29 102.591 6.127 -9.725 223 H CYS 30 HN CYS 30 103.755 6.565 -5.339 224 HA CYS 30 HA CYS 30 105.628 4.321 -5.883 225 1HB CYS 30 HB2 CYS 30 106.973 6.229 -6.465 226 2HB CYS 30 HB1 CYS 30 106.408 7.131 -5.059 227 HG CYS 30 HG CYS 30 108.100 5.987 -3.646 228 H PHE 31 HN PHE 31 105.802 3.020 -4.070 229 HA PHE 31 HA PHE 31 105.123 4.250 -1.444 230 1HB PHE 31 HB2 PHE 31 103.956 1.593 -2.257 231 2HB PHE 31 HB1 PHE 31 103.490 2.621 -0.906 232 HD1 PHE 31 HD2 PHE 31 103.763 2.752 -4.655 233 HD2 PHE 31 HD1 PHE 31 101.613 3.983 -1.145 234 HE1 PHE 31 HE2 PHE 31 102.078 3.867 -6.083 235 HE2 PHE 31 HE1 PHE 31 99.923 5.093 -2.570 236 HZ PHE 31 HZ PHE 31 100.145 5.035 -5.040 237 H ALA 32 HN ALA 32 106.062 3.199 0.338 238 HA ALA 32 HA ALA 32 108.048 1.068 -0.343 239 1HB ALA 32 HB3 ALA 32 108.312 3.606 1.151 240 2HB ALA 32 HB2 ALA 32 109.031 2.205 1.945 241 3HB ALA 32 HB1 ALA 32 109.544 2.657 0.320 242 H ILE 33 HN ILE 33 107.218 -0.802 0.481 243 HA ILE 33 HA ILE 33 105.488 -0.754 2.849 244 HB ILE 33 HB ILE 33 106.505 -2.978 1.065 245 1HG1 ILE 33 HG12 ILE 33 103.620 -2.481 1.503 246 2HG1 ILE 33 HG11 ILE 33 104.482 -1.180 0.680 247 1HG2 ILE 33 HG22 ILE 33 104.904 -3.078 3.624 248 2HG2 ILE 33 HG21 ILE 33 104.768 -4.343 2.403 249 3HG2 ILE 33 HG23 ILE 33 106.320 -4.031 3.182 250 1HD1 ILE 33 HD11 ILE 33 105.403 -2.862 -0.923 251 2HD1 ILE 33 HD13 ILE 33 104.414 -4.097 -0.144 252 3HD1 ILE 33 HD12 ILE 33 103.644 -2.751 -0.984 253 H TYR 34 HN TYR 34 106.087 -1.397 4.903 254 HA TYR 34 HA TYR 34 108.905 -2.335 5.255 255 1HB TYR 34 HB2 TYR 34 108.836 -0.023 5.973 256 2HB TYR 34 HB1 TYR 34 107.368 -0.310 6.909 257 HD1 TYR 34 HD2 TYR 34 110.260 -2.628 6.674 258 HD2 TYR 34 HD1 TYR 34 108.183 0.245 9.098 259 HE1 TYR 34 HE2 TYR 34 111.632 -3.284 8.625 260 HE2 TYR 34 HE1 TYR 34 109.553 -0.409 11.050 261 HH TYR 34 HH TYR 34 112.255 -1.737 11.039 262 H THR 35 HN THR 35 108.600 -4.463 5.817 263 HA THR 35 HA THR 35 107.172 -5.034 8.302 264 HB THR 35 HB THR 35 105.210 -5.766 7.471 265 HG1 THR 35 HG1 THR 35 106.788 -7.286 5.676 266 1HG2 THR 35 HG21 THR 35 106.394 -4.977 4.798 267 2HG2 THR 35 HG23 THR 35 104.701 -5.416 5.036 268 3HG2 THR 35 HG22 THR 35 105.365 -3.991 5.836 269 H THR 36 HN THR 36 107.147 -7.590 8.561 270 HA THR 36 HA THR 36 109.731 -8.547 8.764 271 HB THR 36 HB THR 36 108.737 -10.858 8.617 272 HG1 THR 36 HG1 THR 36 106.773 -11.103 7.869 273 1HG2 THR 36 HG21 THR 36 108.675 -9.402 10.686 274 2HG2 THR 36 HG23 THR 36 107.035 -8.940 10.228 275 3HG2 THR 36 HG22 THR 36 107.406 -10.623 10.606 276 H LYS 37 HN LYS 37 111.014 -10.014 7.436 277 HA LYS 37 HA LYS 37 111.201 -9.222 4.703 278 1HB LYS 37 HB2 LYS 37 112.926 -10.876 4.528 279 2HB LYS 37 HB1 LYS 37 113.038 -10.212 6.154 280 1HG LYS 37 HG2 LYS 37 111.604 -12.125 6.950 281 2HG LYS 37 HG1 LYS 37 111.744 -12.825 5.337 282 1HD LYS 37 HD2 LYS 37 114.027 -13.251 5.571 283 2HD LYS 37 HD1 LYS 37 114.230 -12.018 6.816 284 1HE LYS 37 HE2 LYS 37 112.865 -13.419 8.370 285 2HE LYS 37 HE1 LYS 37 112.805 -14.675 7.133 286 1HZ LYS 37 HZ1 LYS 37 115.417 -14.202 7.228 287 2HZ LYS 37 HZ3 LYS 37 115.007 -13.853 8.837 288 3HZ LYS 37 HZ2 LYS 37 114.647 -15.379 8.182 289 H GLU 38 HN GLU 38 109.897 -12.200 6.195 290 HA GLU 38 HA GLU 38 109.242 -13.598 3.863 291 1HB GLU 38 HB2 GLU 38 108.759 -13.918 6.582 292 2HB GLU 38 HB1 GLU 38 107.143 -13.791 5.884 293 1HG GLU 38 HG2 GLU 38 107.447 -15.665 4.509 294 2HG GLU 38 HG1 GLU 38 109.206 -15.562 4.596 295 H LYS 39 HN LYS 39 107.453 -11.006 5.487 296 HA LYS 39 HA LYS 39 105.087 -11.155 3.879 297 1HB LYS 39 HB2 LYS 39 106.113 -9.491 5.951 298 2HB LYS 39 HB1 LYS 39 105.644 -8.438 4.617 299 1HG LYS 39 HG2 LYS 39 103.417 -9.404 4.566 300 2HG LYS 39 HG1 LYS 39 103.870 -10.603 5.778 301 1HD LYS 39 HD2 LYS 39 104.448 -8.602 7.291 302 2HD LYS 39 HD1 LYS 39 103.553 -7.621 6.130 303 1HE LYS 39 HE2 LYS 39 101.791 -8.166 7.491 304 2HE LYS 39 HE1 LYS 39 101.770 -9.614 6.486 305 1HZ LYS 39 HZ2 LYS 39 103.221 -9.337 9.060 306 2HZ LYS 39 HZ1 LYS 39 101.743 -10.146 8.851 307 3HZ LYS 39 HZ3 LYS 39 103.144 -10.737 8.101 308 H ALA 40 HN ALA 40 107.861 -8.906 3.639 309 HA ALA 40 HA ALA 40 107.097 -7.674 1.215 310 1HB ALA 40 HB2 ALA 40 109.753 -8.162 2.546 311 2HB ALA 40 HB1 ALA 40 109.684 -7.403 0.955 312 3HB ALA 40 HB3 ALA 40 108.885 -6.642 2.331 313 H ALA 41 HN ALA 41 108.497 -10.827 1.783 314 HA ALA 41 HA ALA 41 109.494 -11.258 -0.886 315 1HB ALA 41 HB2 ALA 41 108.616 -13.208 1.264 316 2HB ALA 41 HB1 ALA 41 109.409 -13.685 -0.238 317 3HB ALA 41 HB3 ALA 41 110.263 -12.675 0.929 318 H LEU 42 HN LEU 42 106.353 -11.745 0.649 319 HA LEU 42 HA LEU 42 105.252 -13.115 -1.695 320 1HB LEU 42 HB2 LEU 42 104.029 -12.037 0.855 321 2HB LEU 42 HB1 LEU 42 103.062 -12.766 -0.428 322 HG LEU 42 HG LEU 42 105.421 -14.351 0.351 323 1HD1 LEU 42 HD11 LEU 42 104.715 -13.392 2.549 324 2HD1 LEU 42 HD13 LEU 42 103.099 -14.047 2.281 325 3HD1 LEU 42 HD12 LEU 42 104.474 -15.137 2.458 326 1HD2 LEU 42 HD23 LEU 42 103.595 -15.085 -1.193 327 2HD2 LEU 42 HD22 LEU 42 103.791 -16.164 0.188 328 3HD2 LEU 42 HD21 LEU 42 102.463 -15.004 0.156 329 H LEU 43 HN LEU 43 105.205 -9.854 -0.321 330 HA LEU 43 HA LEU 43 103.304 -8.849 -2.289 331 1HB LEU 43 HB2 LEU 43 105.215 -7.273 -0.542 332 2HB LEU 43 HB1 LEU 43 103.743 -6.678 -1.312 333 HG LEU 43 HG LEU 43 103.966 -8.709 0.918 334 1HD1 LEU 43 HD11 LEU 43 102.577 -6.026 0.649 335 2HD1 LEU 43 HD13 LEU 43 102.450 -7.087 2.052 336 3HD1 LEU 43 HD12 LEU 43 104.005 -6.372 1.626 337 1HD2 LEU 43 HD21 LEU 43 101.579 -7.939 -0.792 338 2HD2 LEU 43 HD23 LEU 43 102.314 -9.538 -0.665 339 3HD2 LEU 43 HD22 LEU 43 101.465 -8.846 0.716 340 H TYR 44 HN TYR 44 106.692 -9.450 -2.236 341 HA TYR 44 HA TYR 44 107.502 -7.434 -4.115 342 1HB TYR 44 HB2 TYR 44 109.063 -8.782 -2.666 343 2HB TYR 44 HB1 TYR 44 108.751 -10.165 -3.715 344 HD1 TYR 44 HD2 TYR 44 109.005 -9.631 -6.323 345 HD2 TYR 44 HD1 TYR 44 110.890 -7.416 -3.172 346 HE1 TYR 44 HE2 TYR 44 110.722 -8.836 -7.915 347 HE2 TYR 44 HE1 TYR 44 112.617 -6.621 -4.763 348 HH TYR 44 HH TYR 44 112.342 -6.577 -7.900 349 H LYS 45 HN LYS 45 106.983 -10.943 -4.627 350 HA LYS 45 HA LYS 45 106.930 -10.684 -7.499 351 1HB LYS 45 HB2 LYS 45 106.824 -12.802 -5.570 352 2HB LYS 45 HB1 LYS 45 105.486 -13.005 -6.701 353 1HG LYS 45 HG2 LYS 45 107.330 -12.472 -8.511 354 2HG LYS 45 HG1 LYS 45 108.436 -13.001 -7.242 355 1HD LYS 45 HD2 LYS 45 106.217 -14.827 -7.383 356 2HD LYS 45 HD1 LYS 45 106.912 -14.632 -8.992 357 1HE LYS 45 HE2 LYS 45 109.196 -14.974 -7.888 358 2HE LYS 45 HE1 LYS 45 108.310 -15.508 -6.460 359 1HZ LYS 45 HZ1 LYS 45 107.181 -16.826 -8.607 360 2HZ LYS 45 HZ3 LYS 45 108.856 -16.925 -8.848 361 3HZ LYS 45 HZ2 LYS 45 108.173 -17.492 -7.399 362 H LYS 46 HN LYS 46 104.478 -10.471 -4.988 363 HA LYS 46 HA LYS 46 102.197 -10.816 -6.705 364 1HB LYS 46 HB2 LYS 46 102.650 -9.629 -3.985 365 2HB LYS 46 HB1 LYS 46 101.106 -9.364 -4.796 366 1HG LYS 46 HG2 LYS 46 101.311 -11.994 -5.229 367 2HG LYS 46 HG1 LYS 46 102.291 -11.901 -3.765 368 1HD LYS 46 HD2 LYS 46 100.266 -10.425 -2.899 369 2HD LYS 46 HD1 LYS 46 99.378 -11.316 -4.135 370 1HE LYS 46 HE2 LYS 46 101.155 -12.813 -2.232 371 2HE LYS 46 HE1 LYS 46 99.553 -12.300 -1.702 372 1HZ LYS 46 HZ3 LYS 46 99.984 -13.769 -4.234 373 2HZ LYS 46 HZ2 LYS 46 99.718 -14.568 -2.758 374 3HZ LYS 46 HZ1 LYS 46 98.530 -13.533 -3.394 375 H ILE 47 HN ILE 47 103.299 -7.753 -5.197 376 HA ILE 47 HA ILE 47 101.836 -6.032 -6.887 377 HB ILE 47 HB ILE 47 104.580 -5.511 -5.719 378 1HG1 ILE 47 HG12 ILE 47 102.118 -6.115 -4.420 379 2HG1 ILE 47 HG11 ILE 47 103.619 -5.577 -3.681 380 1HG2 ILE 47 HG23 ILE 47 103.555 -3.955 -7.513 381 2HG2 ILE 47 HG22 ILE 47 102.409 -3.484 -6.262 382 3HG2 ILE 47 HG21 ILE 47 104.135 -3.221 -6.023 383 1HD1 ILE 47 HD11 ILE 47 102.863 -3.187 -4.284 384 2HD1 ILE 47 HD13 ILE 47 101.274 -3.896 -4.584 385 3HD1 ILE 47 HD12 ILE 47 101.996 -3.994 -2.977 386 H MET 48 HN MET 48 104.810 -7.774 -7.484 387 HA MET 48 HA MET 48 106.061 -6.406 -9.519 388 1HB MET 48 HB2 MET 48 106.471 -8.815 -8.582 389 2HB MET 48 HB1 MET 48 105.461 -9.322 -9.937 390 1HG MET 48 HG2 MET 48 106.976 -7.980 -11.452 391 2HG MET 48 HG1 MET 48 108.046 -7.748 -10.069 392 1HE MET 48 HE1 MET 48 109.663 -8.731 -9.606 393 2HE MET 48 HE3 MET 48 109.453 -10.338 -8.897 394 3HE MET 48 HE2 MET 48 110.401 -10.138 -10.368 395 H GLU 49 HN GLU 49 102.960 -8.102 -9.771 396 HA GLU 49 HA GLU 49 102.729 -6.986 -12.540 397 1HB GLU 49 HB2 GLU 49 102.564 -9.700 -11.681 398 2HB GLU 49 HB1 GLU 49 100.949 -9.197 -12.182 399 1HG GLU 49 HG2 GLU 49 101.794 -8.446 -14.334 400 2HG GLU 49 HG1 GLU 49 103.454 -8.775 -13.836 401 H LYS 50 HN LYS 50 101.611 -6.660 -9.454 402 HA LYS 50 HA LYS 50 98.770 -6.291 -10.169 403 1HB LYS 50 HB2 LYS 50 99.506 -7.275 -7.958 404 2HB LYS 50 HB1 LYS 50 100.123 -5.678 -7.533 405 1HG LYS 50 HG2 LYS 50 98.044 -4.828 -7.192 406 2HG LYS 50 HG1 LYS 50 97.366 -5.677 -8.578 407 1HD LYS 50 HD2 LYS 50 96.557 -6.367 -6.207 408 2HD LYS 50 HD1 LYS 50 96.986 -7.646 -7.342 409 1HE LYS 50 HE2 LYS 50 99.303 -6.715 -5.833 410 2HE LYS 50 HE1 LYS 50 98.024 -7.310 -4.774 411 1HZ LYS 50 HZ1 LYS 50 98.482 -8.941 -7.105 412 2HZ LYS 50 HZ3 LYS 50 99.812 -8.864 -6.055 413 3HZ LYS 50 HZ2 LYS 50 98.305 -9.395 -5.478 414 H TYR 51 HN TYR 51 101.661 -4.391 -9.776 415 HA TYR 51 HA TYR 51 100.064 -1.969 -10.450 416 1HB TYR 51 HB2 TYR 51 102.084 -2.222 -8.208 417 2HB TYR 51 HB1 TYR 51 101.572 -0.668 -8.867 418 HD1 TYR 51 HD2 TYR 51 100.539 -3.631 -6.941 419 HD2 TYR 51 HD1 TYR 51 99.292 0.162 -8.532 420 HE1 TYR 51 HE2 TYR 51 98.524 -3.687 -5.506 421 HE2 TYR 51 HE1 TYR 51 97.278 0.104 -7.103 422 HH TYR 51 HH TYR 51 95.950 -2.286 -5.889 423 H SER 52 HN SER 52 102.147 -3.917 -11.724 424 HA SER 52 HA SER 52 104.083 -3.720 -13.070 425 1HB SER 52 HB2 SER 52 102.404 -1.290 -13.575 426 2HB SER 52 HB1 SER 52 104.010 -1.361 -14.295 427 HG SER 52 HG SER 52 103.265 -2.756 -15.670 428 H VAL 53 HN VAL 53 104.740 -3.314 -10.479 429 HA VAL 53 HA VAL 53 105.743 -1.016 -9.436 430 HB VAL 53 HB VAL 53 107.559 -2.312 -8.420 431 1HG1 VAL 53 HG13 VAL 53 104.933 -2.697 -8.030 432 2HG1 VAL 53 HG12 VAL 53 105.352 -4.313 -8.600 433 3HG1 VAL 53 HG11 VAL 53 106.150 -3.646 -7.175 434 1HG2 VAL 53 HG23 VAL 53 106.970 -4.089 -10.757 435 2HG2 VAL 53 HG22 VAL 53 108.524 -3.654 -10.046 436 3HG2 VAL 53 HG21 VAL 53 107.493 -4.844 -9.251 437 H THR 54 HN THR 54 106.926 0.619 -10.253 438 HA THR 54 HA THR 54 108.463 0.398 -12.689 439 HB THR 54 HB THR 54 108.846 2.565 -10.626 440 HG1 THR 54 HG1 THR 54 106.847 2.756 -12.561 441 1HG2 THR 54 HG23 THR 54 110.045 2.258 -12.981 442 2HG2 THR 54 HG22 THR 54 108.550 2.984 -13.570 443 3HG2 THR 54 HG21 THR 54 109.554 3.852 -12.410 444 H PHE 55 HN PHE 55 109.045 -0.526 -9.507 445 HA PHE 55 HA PHE 55 111.629 -1.571 -9.961 446 1HB PHE 55 HB2 PHE 55 112.591 0.577 -10.049 447 2HB PHE 55 HB1 PHE 55 111.512 1.214 -8.816 448 HD1 PHE 55 HD2 PHE 55 114.005 -1.621 -9.095 449 HD2 PHE 55 HD1 PHE 55 112.488 1.650 -6.792 450 HE1 PHE 55 HE2 PHE 55 115.712 -2.051 -7.356 451 HE2 PHE 55 HE1 PHE 55 114.169 1.210 -5.026 452 HZ PHE 55 HZ PHE 55 115.792 -0.649 -5.316 453 H ILE 56 HN ILE 56 111.372 -3.259 -8.596 454 HA ILE 56 HA ILE 56 110.227 -2.685 -5.907 455 HB ILE 56 HB ILE 56 108.678 -3.974 -7.272 456 1HG1 ILE 56 HG12 ILE 56 110.052 -5.819 -5.293 457 2HG1 ILE 56 HG11 ILE 56 108.897 -4.559 -4.854 458 1HG2 ILE 56 HG22 ILE 56 111.119 -5.212 -8.163 459 2HG2 ILE 56 HG21 ILE 56 109.994 -6.447 -7.598 460 3HG2 ILE 56 HG23 ILE 56 109.504 -5.318 -8.860 461 1HD1 ILE 56 HD11 ILE 56 107.735 -6.048 -6.977 462 2HD1 ILE 56 HD13 ILE 56 108.354 -7.212 -5.808 463 3HD1 ILE 56 HD12 ILE 56 107.208 -5.975 -5.296 464 H SER 57 HN SER 57 111.945 -2.706 -4.507 465 HA SER 57 HA SER 57 113.905 -4.957 -4.811 466 1HB SER 57 HB2 SER 57 114.792 -2.658 -5.378 467 2HB SER 57 HB1 SER 57 114.515 -2.214 -3.698 468 HG SER 57 HG SER 57 116.664 -2.998 -4.157 469 H ARG 58 HN ARG 58 114.169 -6.216 -3.032 470 HA ARG 58 HA ARG 58 112.798 -5.403 -0.530 471 1HB ARG 58 HB2 ARG 58 113.087 -7.854 -1.830 472 2HB ARG 58 HB1 ARG 58 114.215 -7.962 -0.478 473 1HG ARG 58 HG2 ARG 58 112.482 -7.471 1.114 474 2HG ARG 58 HG1 ARG 58 111.344 -7.051 -0.167 475 1HD ARG 58 HD2 ARG 58 111.110 -9.395 0.876 476 2HD ARG 58 HD1 ARG 58 111.148 -9.303 -0.884 477 HE ARG 58 HE ARG 58 113.807 -9.667 0.176 478 1HH1 ARG 58 HH11 ARG 58 111.257 -11.060 -1.522 479 2HH1 ARG 58 HH12 ARG 58 111.760 -12.698 -1.274 480 1HH2 ARG 58 HH21 ARG 58 114.283 -11.868 0.954 481 2HH2 ARG 58 HH22 ARG 58 113.472 -13.156 0.127 482 H HIS 59 HN HIS 59 114.030 -4.245 0.893 483 HA HIS 59 HA HIS 59 116.967 -4.819 0.963 484 1HB HIS 59 HB2 HIS 59 115.470 -2.303 1.760 485 2HB HIS 59 HB1 HIS 59 117.217 -2.527 1.864 486 HD1 HIS 59 HD1 HIS 59 118.559 -2.142 -0.239 487 HD2 HIS 59 HD2 HIS 59 114.468 -2.372 -1.005 488 HE1 HIS 59 HE1 HIS 59 118.250 -1.517 -2.674 489 H ASN 60 HN ASN 60 117.929 -4.322 3.212 490 HA ASN 60 HA ASN 60 116.093 -5.451 5.287 491 1HB ASN 60 HB2 ASN 60 119.096 -5.552 5.472 492 2HB ASN 60 HB1 ASN 60 117.904 -6.612 6.225 493 1HD2 ASN 60 HD22 ASN 60 117.722 -8.807 3.463 494 2HD2 ASN 60 HD21 ASN 60 117.144 -8.422 5.012 495 H SER 61 HN SER 61 115.948 -4.368 7.253 496 HA SER 61 HA SER 61 117.416 -1.768 7.400 497 1HB SER 61 HB2 SER 61 115.467 -1.275 9.085 498 2HB SER 61 HB1 SER 61 115.153 -1.189 7.354 499 HG SER 61 HG SER 61 113.609 -2.450 8.564 500 H TYR 62 HN TYR 62 115.651 -3.224 10.064 501 HA TYR 62 HA TYR 62 118.258 -3.823 11.397 502 1HB TYR 62 HB2 TYR 62 115.866 -2.529 12.737 503 2HB TYR 62 HB1 TYR 62 117.445 -2.838 13.459 504 HD1 TYR 62 HD1 TYR 62 115.555 -0.742 11.091 505 HD2 TYR 62 HD2 TYR 62 119.399 -1.495 12.855 506 HE1 TYR 62 HE1 TYR 62 116.368 1.436 10.249 507 HE2 TYR 62 HE2 TYR 62 120.212 0.683 12.012 508 HH TYR 62 HH TYR 62 118.576 3.090 11.254 509 H ASN 63 HN ASN 63 114.718 -4.326 11.511 510 HA ASN 63 HA ASN 63 115.294 -7.073 12.549 511 1HB ASN 63 HB2 ASN 63 112.881 -5.369 13.231 512 2HB ASN 63 HB1 ASN 63 113.272 -6.957 13.893 513 1HD2 ASN 63 HD22 ASN 63 114.748 -3.760 15.736 514 2HD2 ASN 63 HD21 ASN 63 113.422 -3.733 14.676 515 H HIS 64 HN HIS 64 113.931 -5.219 10.067 516 HA HIS 64 HA HIS 64 112.650 -7.653 8.970 517 1HB HIS 64 HB2 HIS 64 111.226 -4.989 9.228 518 2HB HIS 64 HB1 HIS 64 110.608 -6.392 8.355 519 HD1 HIS 64 HD1 HIS 64 110.190 -4.841 11.485 520 HD2 HIS 64 HD2 HIS 64 110.792 -8.805 10.345 521 HE1 HIS 64 HE1 HIS 64 109.403 -6.272 13.420 522 H ASN 65 HN ASN 65 111.478 -6.264 6.723 523 HA ASN 65 HA ASN 65 113.906 -5.075 5.454 524 1HB ASN 65 HB2 ASN 65 112.090 -7.228 4.340 525 2HB ASN 65 HB1 ASN 65 113.260 -6.339 3.365 526 1HD2 ASN 65 HD22 ASN 65 114.725 -8.857 6.282 527 2HD2 ASN 65 HD21 ASN 65 113.223 -8.106 6.524 528 H ILE 66 HN ILE 66 113.424 -3.709 3.594 529 HA ILE 66 HA ILE 66 110.692 -2.511 3.766 530 HB ILE 66 HB ILE 66 113.381 -1.384 2.946 531 1HG1 ILE 66 HG12 ILE 66 112.781 0.299 4.687 532 2HG1 ILE 66 HG11 ILE 66 111.301 -0.605 5.012 533 1HG2 ILE 66 HG22 ILE 66 111.332 0.612 2.863 534 2HG2 ILE 66 HG21 ILE 66 112.382 0.078 1.550 535 3HG2 ILE 66 HG23 ILE 66 110.831 -0.718 1.823 536 1HD1 ILE 66 HD11 ILE 66 113.988 -1.965 5.113 537 2HD1 ILE 66 HD13 ILE 66 113.373 -1.078 6.508 538 3HD1 ILE 66 HD12 ILE 66 112.475 -2.456 5.873 539 H LEU 67 HN LEU 67 109.487 -3.553 2.194 540 HA LEU 67 HA LEU 67 110.696 -4.325 -0.358 541 1HB LEU 67 HB2 LEU 67 108.893 -5.703 0.555 542 2HB LEU 67 HB1 LEU 67 107.803 -4.318 0.565 543 HG LEU 67 HG LEU 67 108.479 -4.207 -2.005 544 1HD1 LEU 67 HD13 LEU 67 109.127 -7.009 -1.120 545 2HD1 LEU 67 HD12 LEU 67 108.539 -6.703 -2.753 546 3HD1 LEU 67 HD11 LEU 67 110.035 -5.952 -2.200 547 1HD2 LEU 67 HD22 LEU 67 106.424 -5.794 -0.540 548 2HD2 LEU 67 HD21 LEU 67 106.214 -4.467 -1.683 549 3HD2 LEU 67 HD23 LEU 67 106.583 -6.088 -2.272 550 H PHE 68 HN PHE 68 111.335 -2.500 -1.444 551 HA PHE 68 HA PHE 68 109.651 -0.145 -1.658 552 1HB PHE 68 HB2 PHE 68 112.355 -0.824 -2.205 553 2HB PHE 68 HB1 PHE 68 111.646 -0.340 -3.741 554 HD1 PHE 68 HD2 PHE 68 109.555 1.535 -2.071 555 HD2 PHE 68 HD1 PHE 68 113.824 1.162 -2.379 556 HE1 PHE 68 HE2 PHE 68 109.809 3.892 -1.395 557 HE2 PHE 68 HE1 PHE 68 114.072 3.525 -1.706 558 HZ PHE 68 HZ PHE 68 112.066 4.898 -1.217 559 H PHE 69 HN PHE 69 108.394 0.431 -3.504 560 HA PHE 69 HA PHE 69 108.527 -1.119 -5.930 561 1HB PHE 69 HB2 PHE 69 106.551 -2.388 -5.835 562 2HB PHE 69 HB1 PHE 69 107.298 -2.645 -4.263 563 HD1 PHE 69 HD2 PHE 69 106.473 -1.310 -2.272 564 HD2 PHE 69 HD1 PHE 69 104.419 -1.377 -6.042 565 HE1 PHE 69 HE2 PHE 69 104.406 -0.504 -1.163 566 HE2 PHE 69 HE1 PHE 69 102.354 -0.581 -4.937 567 HZ PHE 69 HZ PHE 69 102.345 -0.140 -2.495 568 H LEU 70 HN LEU 70 108.359 0.538 -7.268 569 HA LEU 70 HA LEU 70 106.677 2.864 -6.694 570 1HB LEU 70 HB2 LEU 70 108.795 2.142 -8.568 571 2HB LEU 70 HB1 LEU 70 107.471 2.978 -9.378 572 HG LEU 70 HG LEU 70 107.598 4.732 -7.547 573 1HD1 LEU 70 HD12 LEU 70 110.109 3.154 -6.926 574 2HD1 LEU 70 HD11 LEU 70 109.842 4.807 -6.369 575 3HD1 LEU 70 HD13 LEU 70 108.772 3.510 -5.831 576 1HD2 LEU 70 HD21 LEU 70 109.470 4.207 -9.745 577 2HD2 LEU 70 HD23 LEU 70 108.626 5.699 -9.322 578 3HD2 LEU 70 HD22 LEU 70 110.139 5.285 -8.514 579 H THR 71 HN THR 71 105.473 3.524 -9.030 580 HA THR 71 HA THR 71 104.039 1.248 -10.180 581 HB THR 71 HB THR 71 101.798 2.086 -9.434 582 HG1 THR 71 HG1 THR 71 102.153 4.121 -8.797 583 1HG2 THR 71 HG21 THR 71 103.196 0.252 -8.257 584 2HG2 THR 71 HG23 THR 71 103.489 1.471 -7.016 585 3HG2 THR 71 HG22 THR 71 101.842 0.950 -7.368 586 HA PRO 72 HA PRO 72 103.764 4.241 -13.395 587 1HB PRO 72 HB2 PRO 72 101.964 2.901 -14.988 588 2HB PRO 72 HB1 PRO 72 103.677 2.468 -14.860 589 1HG PRO 72 HG2 PRO 72 101.306 1.085 -13.708 590 2HG PRO 72 HG1 PRO 72 102.895 0.427 -14.126 591 1HD PRO 72 HD2 PRO 72 101.998 1.083 -11.515 592 2HD PRO 72 HD1 PRO 72 103.670 0.712 -11.988 593 H HIS 73 HN HIS 73 100.459 2.908 -13.461 594 HA HIS 73 HA HIS 73 99.154 5.356 -13.786 595 1HB HIS 73 HB2 HIS 73 97.130 4.258 -12.812 596 2HB HIS 73 HB1 HIS 73 97.935 3.258 -14.017 597 HD1 HIS 73 HD1 HIS 73 96.513 3.005 -10.760 598 HD2 HIS 73 HD2 HIS 73 99.909 1.389 -12.554 599 HE1 HIS 73 HE1 HIS 73 97.180 0.998 -9.360 600 H ARG 74 HN ARG 74 97.605 6.321 -11.984 601 HA ARG 74 HA ARG 74 99.364 6.873 -9.638 602 1HB ARG 74 HB2 ARG 74 97.248 8.436 -11.086 603 2HB ARG 74 HB1 ARG 74 97.571 8.798 -9.390 604 1HG ARG 74 HG2 ARG 74 100.029 8.966 -10.011 605 2HG ARG 74 HG1 ARG 74 99.524 8.898 -11.700 606 1HD ARG 74 HD2 ARG 74 97.840 10.811 -10.547 607 2HD ARG 74 HD1 ARG 74 99.424 11.136 -9.842 608 HE ARG 74 HE ARG 74 99.169 10.854 -12.799 609 1HH1 ARG 74 HH21 ARG 74 101.714 11.676 -11.355 610 2HH1 ARG 74 HH22 ARG 74 101.694 13.393 -11.583 611 1HH2 ARG 74 HH11 ARG 74 98.352 13.500 -12.498 612 2HH2 ARG 74 HH12 ARG 74 99.791 14.425 -12.230 613 H HIS 75 HN HIS 75 98.525 6.708 -7.523 614 HA HIS 75 HA HIS 75 95.740 5.790 -7.165 615 1HB HIS 75 HB2 HIS 75 97.337 4.043 -5.569 616 2HB HIS 75 HB1 HIS 75 96.225 3.609 -6.866 617 HD1 HIS 75 HD1 HIS 75 97.397 3.968 -9.392 618 HD2 HIS 75 HD2 HIS 75 99.926 3.340 -6.144 619 HE1 HIS 75 HE1 HIS 75 99.629 3.238 -10.343 620 H ARG 76 HN ARG 76 95.055 5.974 -4.944 621 HA ARG 76 HA ARG 76 96.625 7.963 -3.441 622 1HB ARG 76 HB2 ARG 76 93.842 7.070 -3.534 623 2HB ARG 76 HB1 ARG 76 94.433 7.234 -1.880 624 1HG ARG 76 HG2 ARG 76 95.375 9.514 -2.641 625 2HG ARG 76 HG1 ARG 76 94.319 9.335 -4.043 626 1HD ARG 76 HD2 ARG 76 93.380 9.176 -1.165 627 2HD ARG 76 HD1 ARG 76 93.249 10.614 -2.178 628 HE ARG 76 HE ARG 76 91.997 8.105 -3.156 629 1HH1 ARG 76 HH21 ARG 76 91.117 10.281 -4.684 630 2HH1 ARG 76 HH22 ARG 76 89.744 10.925 -3.849 631 1HH2 ARG 76 HH11 ARG 76 90.504 9.366 -0.846 632 2HH2 ARG 76 HH12 ARG 76 89.396 10.407 -1.676 633 H VAL 77 HN VAL 77 97.594 7.539 -1.421 634 HA VAL 77 HA VAL 77 98.609 4.946 -0.944 635 HB VAL 77 HB VAL 77 98.274 7.354 0.848 636 1HG1 VAL 77 HG13 VAL 77 99.387 4.619 1.504 637 2HG1 VAL 77 HG12 VAL 77 99.884 6.067 2.380 638 3HG1 VAL 77 HG11 VAL 77 98.197 5.554 2.410 639 1HG2 VAL 77 HG23 VAL 77 99.941 7.397 -1.005 640 2HG2 VAL 77 HG22 VAL 77 100.709 7.465 0.582 641 3HG2 VAL 77 HG21 VAL 77 100.697 5.954 -0.329 642 H SER 78 HN SER 78 95.483 6.222 -0.293 643 HA SER 78 HA SER 78 94.802 4.468 1.910 644 1HB SER 78 HB2 SER 78 92.707 5.423 1.786 645 2HB SER 78 HB1 SER 78 93.605 6.645 0.891 646 HG SER 78 HG SER 78 91.616 5.678 -0.089 647 H ALA 79 HN ALA 79 94.443 4.304 -1.624 648 HA ALA 79 HA ALA 79 93.030 1.780 -1.608 649 1HB ALA 79 HB2 ALA 79 93.067 3.436 -3.524 650 2HB ALA 79 HB1 ALA 79 94.723 2.922 -3.848 651 3HB ALA 79 HB3 ALA 79 93.396 1.769 -3.993 652 H ILE 80 HN ILE 80 96.434 2.630 -2.347 653 HA ILE 80 HA ILE 80 97.359 -0.056 -2.601 654 HB ILE 80 HB ILE 80 98.868 2.397 -1.635 655 1HG1 ILE 80 HG12 ILE 80 97.732 2.496 -3.927 656 2HG1 ILE 80 HG11 ILE 80 99.476 2.754 -3.923 657 1HG2 ILE 80 HG21 ILE 80 99.721 -0.359 -2.513 658 2HG2 ILE 80 HG23 ILE 80 100.808 1.021 -2.667 659 3HG2 ILE 80 HG22 ILE 80 100.213 0.539 -1.078 660 1HD1 ILE 80 HD13 ILE 80 99.783 0.326 -4.449 661 2HD1 ILE 80 HD12 ILE 80 98.032 0.177 -4.597 662 3HD1 ILE 80 HD11 ILE 80 98.927 1.208 -5.715 663 H ASN 81 HN ASN 81 96.694 1.971 0.168 664 HA ASN 81 HA ASN 81 98.108 0.375 2.117 665 1HB ASN 81 HB2 ASN 81 97.474 2.670 2.644 666 2HB ASN 81 HB1 ASN 81 95.768 2.285 2.410 667 1HD2 ASN 81 HD22 ASN 81 95.463 0.556 5.535 668 2HD2 ASN 81 HD21 ASN 81 94.801 0.685 3.978 669 H ASN 82 HN ASN 82 94.942 0.209 0.617 670 HA ASN 82 HA ASN 82 93.780 -1.643 2.502 671 1HB ASN 82 HB2 ASN 82 92.848 -0.224 0.321 672 2HB ASN 82 HB1 ASN 82 92.861 -1.883 -0.280 673 1HD2 ASN 82 HD22 ASN 82 89.611 -1.279 1.505 674 2HD2 ASN 82 HD21 ASN 82 90.388 -0.543 0.188 675 H TYR 83 HN TYR 83 95.875 -1.957 -0.294 676 HA TYR 83 HA TYR 83 95.533 -4.855 -0.496 677 1HB TYR 83 HB2 TYR 83 96.147 -3.674 -2.503 678 2HB TYR 83 HB1 TYR 83 97.514 -2.904 -1.702 679 HD1 TYR 83 HD1 TYR 83 96.968 -6.355 -0.756 680 HD2 TYR 83 HD2 TYR 83 98.848 -3.825 -3.675 681 HE1 TYR 83 HE1 TYR 83 98.440 -8.225 -1.434 682 HE2 TYR 83 HE2 TYR 83 100.314 -5.696 -4.355 683 HH TYR 83 HH TYR 83 101.095 -8.077 -2.791 684 H ALA 84 HN ALA 84 98.500 -2.956 0.183 685 HA ALA 84 HA ALA 84 99.973 -5.024 1.360 686 1HB ALA 84 HB2 ALA 84 99.950 -2.058 1.963 687 2HB ALA 84 HB1 ALA 84 101.132 -3.168 2.658 688 3HB ALA 84 HB3 ALA 84 101.062 -2.935 0.911 689 H GLN 85 HN GLN 85 97.470 -3.003 2.812 690 HA GLN 85 HA GLN 85 97.927 -3.878 5.524 691 1HB GLN 85 HB2 GLN 85 96.643 -1.823 4.938 692 2HB GLN 85 HB1 GLN 85 95.363 -2.842 4.277 693 1HG GLN 85 HG2 GLN 85 94.576 -2.503 6.439 694 2HG GLN 85 HG1 GLN 85 95.485 -4.001 6.646 695 1HE2 GLN 85 HE22 GLN 85 98.112 -2.455 8.527 696 2HE2 GLN 85 HE21 GLN 85 97.736 -3.785 7.542 697 H LYS 86 HN LYS 86 95.899 -5.066 2.872 698 HA LYS 86 HA LYS 86 94.395 -6.973 4.363 699 1HB LYS 86 HB2 LYS 86 94.604 -6.231 1.683 700 2HB LYS 86 HB1 LYS 86 95.152 -7.907 1.699 701 1HG LYS 86 HG2 LYS 86 93.111 -8.591 2.870 702 2HG LYS 86 HG1 LYS 86 92.566 -6.914 2.932 703 1HD LYS 86 HD2 LYS 86 92.043 -6.853 0.687 704 2HD LYS 86 HD1 LYS 86 93.283 -8.032 0.259 705 1HE LYS 86 HE2 LYS 86 91.929 -9.835 0.723 706 2HE LYS 86 HE1 LYS 86 91.047 -8.980 1.988 707 1HZ LYS 86 HZ2 LYS 86 90.486 -7.600 -0.307 708 2HZ LYS 86 HZ1 LYS 86 90.438 -9.229 -0.787 709 3HZ LYS 86 HZ3 LYS 86 89.456 -8.693 0.487 710 H LEU 87 HN LEU 87 97.720 -6.834 3.608 711 HA LEU 87 HA LEU 87 98.070 -9.760 4.009 712 1HB LEU 87 HB2 LEU 87 100.172 -7.690 3.315 713 2HB LEU 87 HB1 LEU 87 100.310 -9.444 3.174 714 HG LEU 87 HG LEU 87 97.982 -8.404 1.752 715 1HD1 LEU 87 HD11 LEU 87 100.582 -7.058 1.431 716 2HD1 LEU 87 HD13 LEU 87 99.896 -7.668 -0.075 717 3HD1 LEU 87 HD12 LEU 87 98.976 -6.541 0.918 718 1HD2 LEU 87 HD22 LEU 87 100.307 -10.235 1.301 719 2HD2 LEU 87 HD21 LEU 87 98.580 -10.560 1.147 720 3HD2 LEU 87 HD23 LEU 87 99.421 -9.649 -0.106 721 H CYS 88 HN CYS 88 97.230 -8.777 6.326 722 HA CYS 88 HA CYS 88 99.726 -8.554 7.951 723 1HB CYS 88 HB2 CYS 88 98.414 -6.351 7.679 724 2HB CYS 88 HB1 CYS 88 97.175 -7.110 8.679 725 HG CYS 88 HG CYS 88 98.571 -6.372 10.590 726 H THR 89 HN THR 89 98.205 -10.923 7.360 727 HA THR 89 HA THR 89 96.901 -11.455 9.998 728 HB THR 89 HB THR 89 95.722 -13.293 8.874 729 HG1 THR 89 HG1 THR 89 96.006 -13.274 6.492 730 1HG2 THR 89 HG21 THR 89 95.495 -10.493 8.163 731 2HG2 THR 89 HG23 THR 89 94.950 -11.520 6.837 732 3HG2 THR 89 HG22 THR 89 94.218 -11.679 8.434 733 H PHE 90 HN PHE 90 99.841 -11.647 8.892 734 HA PHE 90 HA PHE 90 100.359 -14.271 10.195 735 1HB PHE 90 HB2 PHE 90 102.296 -14.279 8.275 736 2HB PHE 90 HB1 PHE 90 100.761 -15.130 8.118 737 HD1 PHE 90 HD1 PHE 90 98.833 -14.002 6.940 738 HD2 PHE 90 HD2 PHE 90 102.822 -12.408 6.890 739 HE1 PHE 90 HE1 PHE 90 98.242 -12.585 4.993 740 HE2 PHE 90 HE2 PHE 90 102.229 -10.991 4.942 741 HZ PHE 90 HZ PHE 90 99.941 -11.080 3.994 742 H SER 91 HN SER 91 100.779 -11.138 10.467 743 HA SER 91 HA SER 91 102.850 -11.090 12.287 744 1HB SER 91 HB2 SER 91 103.885 -11.532 9.619 745 2HB SER 91 HB1 SER 91 104.482 -10.003 10.259 746 HG SER 91 HG SER 91 105.564 -12.172 10.784 747 H PHE 92 HN PHE 92 104.086 -8.748 12.097 748 HA PHE 92 HA PHE 92 101.920 -6.825 12.123 749 1HB PHE 92 HB2 PHE 92 103.503 -5.284 12.938 750 2HB PHE 92 HB1 PHE 92 104.113 -6.830 13.522 751 HD1 PHE 92 HD1 PHE 92 105.985 -7.979 12.280 752 HD2 PHE 92 HD2 PHE 92 104.732 -3.974 11.363 753 HE1 PHE 92 HE1 PHE 92 108.108 -7.589 11.076 754 HE2 PHE 92 HE2 PHE 92 106.856 -3.587 10.155 755 HZ PHE 92 HZ PHE 92 108.548 -5.394 10.007 756 H LEU 93 HN LEU 93 102.417 -4.615 10.883 757 HA LEU 93 HA LEU 93 103.615 -4.970 8.238 758 1HB LEU 93 HB2 LEU 93 101.357 -6.051 8.014 759 2HB LEU 93 HB1 LEU 93 100.626 -4.498 8.422 760 HG LEU 93 HG LEU 93 102.573 -4.031 6.390 761 1HD1 LEU 93 HD11 LEU 93 101.993 -6.599 6.100 762 2HD1 LEU 93 HD13 LEU 93 100.522 -5.962 5.368 763 3HD1 LEU 93 HD12 LEU 93 102.096 -5.543 4.692 764 1HD2 LEU 93 HD21 LEU 93 99.559 -3.938 6.588 765 2HD2 LEU 93 HD23 LEU 93 100.699 -2.591 6.599 766 3HD2 LEU 93 HD22 LEU 93 100.397 -3.480 5.106 767 H ILE 94 HN ILE 94 104.262 -2.997 7.470 768 HA ILE 94 HA ILE 94 102.938 -0.553 8.527 769 HB ILE 94 HB ILE 94 105.926 -1.081 8.591 770 1HG1 ILE 94 HG12 ILE 94 104.423 -0.217 10.997 771 2HG1 ILE 94 HG11 ILE 94 104.066 -1.849 10.429 772 1HG2 ILE 94 HG23 ILE 94 104.793 1.313 8.034 773 2HG2 ILE 94 HG22 ILE 94 104.733 1.359 9.796 774 3HG2 ILE 94 HG21 ILE 94 106.278 1.151 8.972 775 1HD1 ILE 94 HD11 ILE 94 106.826 -1.716 10.238 776 2HD1 ILE 94 HD13 ILE 94 106.487 -0.814 11.715 777 3HD1 ILE 94 HD12 ILE 94 105.928 -2.479 11.550 778 H CYS 95 HN CYS 95 102.235 -1.070 6.126 779 HA CYS 95 HA CYS 95 104.229 -0.265 4.121 780 1HB CYS 95 HB2 CYS 95 102.658 -1.971 3.450 781 2HB CYS 95 HB1 CYS 95 101.288 -0.972 3.934 782 HG CYS 95 HG CYS 95 101.642 0.532 1.902 783 H LYS 96 HN LYS 96 104.433 1.794 3.311 784 HA LYS 96 HA LYS 96 102.221 3.728 3.771 785 1HB LYS 96 HB2 LYS 96 104.665 3.675 5.272 786 2HB LYS 96 HB1 LYS 96 104.664 5.114 4.252 787 1HG LYS 96 HG2 LYS 96 102.822 6.026 5.297 788 2HG LYS 96 HG1 LYS 96 102.139 4.450 5.699 789 1HD LYS 96 HD2 LYS 96 103.607 4.155 7.536 790 2HD LYS 96 HD1 LYS 96 104.683 5.441 6.988 791 1HE LYS 96 HE2 LYS 96 103.374 7.093 7.869 792 2HE LYS 96 HE1 LYS 96 101.874 6.249 7.482 793 1HZ LYS 96 HZ1 LYS 96 103.343 4.800 9.414 794 2HZ LYS 96 HZ3 LYS 96 103.130 6.398 9.942 795 3HZ LYS 96 HZ2 LYS 96 101.779 5.454 9.530 796 H GLY 97 HN GLY 97 102.827 5.877 2.587 797 1HA GLY 97 HA2 GLY 97 103.791 5.109 -0.104 798 2HA GLY 97 HA1 GLY 97 102.938 6.600 0.299 799 H VAL 98 HN VAL 98 105.120 6.983 -1.218 800 HA VAL 98 HA VAL 98 107.075 8.125 0.723 801 HB VAL 98 HB VAL 98 107.798 6.645 -1.824 802 1HG1 VAL 98 HG12 VAL 98 109.269 8.580 -1.254 803 2HG1 VAL 98 HG11 VAL 98 109.559 7.858 0.328 804 3HG1 VAL 98 HG13 VAL 98 110.107 7.033 -1.131 805 1HG2 VAL 98 HG22 VAL 98 107.714 5.898 1.071 806 2HG2 VAL 98 HG21 VAL 98 107.387 4.907 -0.350 807 3HG2 VAL 98 HG23 VAL 98 109.050 5.282 0.100 808 H ASN 99 HN ASN 99 107.701 10.193 0.207 809 HA ASN 99 HA ASN 99 106.444 11.415 -2.178 810 1HB ASN 99 HB2 ASN 99 107.709 12.458 0.340 811 2HB ASN 99 HB1 ASN 99 107.560 13.521 -1.060 812 1HD2 ASN 99 HD22 ASN 99 104.427 13.632 1.105 813 2HD2 ASN 99 HD21 ASN 99 106.073 13.765 1.499 814 H LYS 100 HN LYS 100 109.675 10.982 -0.738 815 HA LYS 100 HA LYS 100 110.848 11.811 -3.358 816 1HB LYS 100 HB2 LYS 100 111.535 12.431 -0.639 817 2HB LYS 100 HB1 LYS 100 112.868 11.538 -1.372 818 1HG LYS 100 HG2 LYS 100 113.247 13.156 -2.991 819 2HG LYS 100 HG1 LYS 100 111.580 13.733 -2.952 820 1HD LYS 100 HD2 LYS 100 112.414 14.266 -0.389 821 2HD LYS 100 HD1 LYS 100 113.887 14.556 -1.316 822 1HE LYS 100 HE2 LYS 100 111.569 15.668 -2.668 823 2HE LYS 100 HE1 LYS 100 111.720 16.314 -1.034 824 1HZ LYS 100 HZ1 LYS 100 114.132 16.686 -1.592 825 2HZ LYS 100 HZ3 LYS 100 113.729 16.371 -3.209 826 3HZ LYS 100 HZ2 LYS 100 113.022 17.687 -2.400 827 H GLU 101 HN GLU 101 110.733 9.812 -4.430 828 HA GLU 101 HA GLU 101 111.380 7.288 -3.282 829 1HB GLU 101 HB2 GLU 101 111.697 8.123 -6.179 830 2HB GLU 101 HB1 GLU 101 111.478 6.489 -5.566 831 1HG GLU 101 HG2 GLU 101 109.288 6.894 -6.055 832 2HG GLU 101 HG1 GLU 101 109.305 7.686 -4.479 833 H TYR 102 HN TYR 102 113.343 8.853 -5.802 834 HA TYR 102 HA TYR 102 115.726 7.604 -5.644 835 1HB TYR 102 HB2 TYR 102 115.340 9.664 -6.984 836 2HB TYR 102 HB1 TYR 102 115.500 10.625 -5.516 837 HD1 TYR 102 HD1 TYR 102 117.670 10.611 -4.244 838 HD2 TYR 102 HD2 TYR 102 117.266 8.816 -8.126 839 HE1 TYR 102 HE1 TYR 102 120.137 10.605 -4.499 840 HE2 TYR 102 HE2 TYR 102 119.731 8.809 -8.380 841 HH TYR 102 HH TYR 102 121.669 9.709 -7.536 842 H LEU 103 HN LEU 103 115.023 10.308 -3.396 843 HA LEU 103 HA LEU 103 117.302 10.090 -1.789 844 1HB LEU 103 HB2 LEU 103 114.794 11.410 -1.653 845 2HB LEU 103 HB1 LEU 103 115.086 10.645 -0.089 846 HG LEU 103 HG LEU 103 116.074 12.953 -0.308 847 1HD1 LEU 103 HD12 LEU 103 117.590 10.478 0.355 848 2HD1 LEU 103 HD11 LEU 103 118.499 11.988 0.291 849 3HD1 LEU 103 HD13 LEU 103 117.135 11.826 1.397 850 1HD2 LEU 103 HD22 LEU 103 116.801 12.198 -2.790 851 2HD2 LEU 103 HD21 LEU 103 117.655 13.456 -1.896 852 3HD2 LEU 103 HD23 LEU 103 118.288 11.811 -1.924 853 H MET 104 HN MET 104 114.133 8.753 -0.795 854 HA MET 104 HA MET 104 114.905 7.231 1.356 855 1HB MET 104 HB2 MET 104 112.593 7.278 0.683 856 2HB MET 104 HB1 MET 104 112.967 6.470 -0.840 857 1HG MET 104 HG2 MET 104 113.430 4.413 0.230 858 2HG MET 104 HG1 MET 104 113.603 5.176 1.811 859 1HE MET 104 HE1 MET 104 112.160 2.833 2.054 860 2HE MET 104 HE3 MET 104 111.941 4.023 3.343 861 3HE MET 104 HE2 MET 104 110.549 3.169 2.684 862 H TYR 105 HN TYR 105 114.708 5.739 -1.906 863 HA TYR 105 HA TYR 105 115.994 3.345 -1.355 864 1HB TYR 105 HB2 TYR 105 115.113 3.729 -3.559 865 2HB TYR 105 HB1 TYR 105 116.213 5.082 -3.825 866 HD1 TYR 105 HD1 TYR 105 118.683 4.664 -4.007 867 HD2 TYR 105 HD2 TYR 105 115.819 1.461 -3.902 868 HE1 TYR 105 HE1 TYR 105 120.388 3.109 -4.897 869 HE2 TYR 105 HE2 TYR 105 117.526 -0.091 -4.792 870 HH TYR 105 HH TYR 105 120.310 -0.026 -4.682 871 H SER 106 HN SER 106 117.534 6.489 -1.941 872 HA SER 106 HA SER 106 120.229 5.561 -2.020 873 1HB SER 106 HB2 SER 106 119.245 7.929 -2.514 874 2HB SER 106 HB1 SER 106 119.470 8.202 -0.789 875 HG SER 106 HG SER 106 121.301 8.795 -2.084 876 H ALA 107 HN ALA 107 118.558 7.127 0.743 877 HA ALA 107 HA ALA 107 120.542 6.455 2.665 878 1HB ALA 107 HB1 ALA 107 118.220 7.913 2.705 879 2HB ALA 107 HB3 ALA 107 117.759 6.497 3.652 880 3HB ALA 107 HB2 ALA 107 119.142 7.474 4.144 881 H LEU 108 HN LEU 108 118.285 4.470 1.043 882 HA LEU 108 HA LEU 108 118.132 2.441 3.165 883 1HB LEU 108 HB2 LEU 108 117.044 2.729 0.381 884 2HB LEU 108 HB1 LEU 108 117.101 1.129 1.121 885 HG LEU 108 HG LEU 108 115.736 3.585 2.259 886 1HD1 LEU 108 HD13 LEU 108 114.808 1.070 0.893 887 2HD1 LEU 108 HD12 LEU 108 113.765 1.868 2.070 888 3HD1 LEU 108 HD11 LEU 108 114.288 2.734 0.626 889 1HD2 LEU 108 HD23 LEU 108 116.289 0.833 3.369 890 2HD2 LEU 108 HD22 LEU 108 116.536 2.399 4.140 891 3HD2 LEU 108 HD21 LEU 108 114.902 1.772 3.922 892 H THR 109 HN THR 109 119.947 3.032 0.200 893 HA THR 109 HA THR 109 121.134 0.360 0.183 894 HB THR 109 HB THR 109 122.577 1.298 -1.617 895 HG1 THR 109 HG1 THR 109 122.527 3.398 -2.066 896 1HG2 THR 109 HG23 THR 109 120.200 0.456 -1.993 897 2HG2 THR 109 HG22 THR 109 119.703 2.148 -2.017 898 3HG2 THR 109 HG21 THR 109 120.832 1.543 -3.230 899 H ARG 110 HN ARG 110 121.803 3.413 1.681 900 HA ARG 110 HA ARG 110 124.614 2.700 2.236 901 1HB ARG 110 HB2 ARG 110 122.912 5.112 2.526 902 2HB ARG 110 HB1 ARG 110 124.151 4.900 3.763 903 1HG ARG 110 HG2 ARG 110 125.849 4.597 1.961 904 2HG ARG 110 HG1 ARG 110 124.597 4.928 0.763 905 1HD ARG 110 HD2 ARG 110 124.757 7.153 1.095 906 2HD ARG 110 HD1 ARG 110 124.633 6.962 2.844 907 HE ARG 110 HE ARG 110 127.244 6.160 2.107 908 1HH1 ARG 110 HH21 ARG 110 127.202 8.379 0.195 909 2HH1 ARG 110 HH22 ARG 110 127.637 9.749 1.161 910 1HH2 ARG 110 HH11 ARG 110 126.956 8.176 4.175 911 2HH2 ARG 110 HH12 ARG 110 127.497 9.635 3.414 912 H ASP 111 HN ASP 111 125.287 1.785 4.140 913 HA ASP 111 HA ASP 111 123.654 0.365 5.859 914 1HB ASP 111 HB2 ASP 111 126.095 1.854 6.853 915 2HB ASP 111 HB1 ASP 111 125.477 0.299 7.410 916 HA PRO 112 HA PRO 112 123.788 -0.153 8.025 917 1HB PRO 112 HB2 PRO 112 121.696 -0.623 9.741 918 2HB PRO 112 HB1 PRO 112 123.227 0.114 10.246 919 1HG PRO 112 HG2 PRO 112 120.569 1.401 9.845 920 2HG PRO 112 HG1 PRO 112 121.911 1.901 10.886 921 1HD PRO 112 HD2 PRO 112 121.247 3.021 8.365 922 2HD PRO 112 HD1 PRO 112 122.747 3.301 9.277 923 H PHE 113 HN PHE 113 121.469 1.254 6.183 924 HA PHE 113 HA PHE 113 119.600 -0.987 5.955 925 1HB PHE 113 HB2 PHE 113 119.992 1.515 4.289 926 2HB PHE 113 HB1 PHE 113 118.708 0.337 4.015 927 HD1 PHE 113 HD1 PHE 113 117.346 -0.328 6.217 928 HD2 PHE 113 HD2 PHE 113 119.524 3.333 5.678 929 HE1 PHE 113 HE1 PHE 113 115.984 0.742 7.982 930 HE2 PHE 113 HE2 PHE 113 118.161 4.404 7.442 931 HZ PHE 113 HZ PHE 113 116.388 3.111 8.599 932 H SER 114 HN SER 114 120.345 -2.839 5.039 933 HA SER 114 HA SER 114 122.413 -2.711 2.931 934 1HB SER 114 HB2 SER 114 121.148 -4.943 4.516 935 2HB SER 114 HB1 SER 114 122.120 -5.283 3.087 936 HG SER 114 HG SER 114 123.495 -5.273 4.822 937 H VAL 115 HN VAL 115 121.919 -4.547 1.135 938 HA VAL 115 HA VAL 115 119.146 -4.035 0.133 939 HB VAL 115 HB VAL 115 121.663 -4.268 -1.544 940 1HG1 VAL 115 HG11 VAL 115 118.741 -3.948 -2.107 941 2HG1 VAL 115 HG13 VAL 115 119.887 -3.119 -3.160 942 3HG1 VAL 115 HG12 VAL 115 119.957 -4.873 -2.989 943 1HG2 VAL 115 HG23 VAL 115 120.424 -2.010 -0.138 944 2HG2 VAL 115 HG22 VAL 115 122.018 -2.128 -0.884 945 3HG2 VAL 115 HG21 VAL 115 120.612 -1.722 -1.868 946 H ILE 116 HN ILE 116 118.181 -5.795 -1.022 947 HA ILE 116 HA ILE 116 119.640 -8.390 -0.711 948 HB ILE 116 HB ILE 116 116.635 -8.162 -0.744 949 1HG1 ILE 116 HG12 ILE 116 118.278 -8.198 1.790 950 2HG1 ILE 116 HG11 ILE 116 117.760 -6.680 1.058 951 1HG2 ILE 116 HG21 ILE 116 118.248 -10.317 -0.871 952 2HG2 ILE 116 HG23 ILE 116 118.167 -10.131 0.881 953 3HG2 ILE 116 HG22 ILE 116 116.686 -10.352 -0.052 954 1HD1 ILE 116 HD11 ILE 116 115.416 -8.032 1.009 955 2HD1 ILE 116 HD13 ILE 116 116.152 -8.759 2.438 956 3HD1 ILE 116 HD12 ILE 116 115.909 -7.014 2.362 957 H GLU 117 HN GLU 117 116.691 -7.317 -2.443 958 HA GLU 117 HA GLU 117 117.998 -8.139 -4.991 959 1HB GLU 117 HB2 GLU 117 115.759 -9.484 -3.652 960 2HB GLU 117 HB1 GLU 117 115.400 -9.030 -5.318 961 1HG GLU 117 HG2 GLU 117 117.452 -10.151 -6.082 962 2HG GLU 117 HG1 GLU 117 117.843 -10.586 -4.418 963 H GLU 118 HN GLU 118 116.734 -7.338 -6.908 964 HA GLU 118 HA GLU 118 114.695 -5.300 -6.440 965 1HB GLU 118 HB2 GLU 118 116.414 -3.704 -7.844 966 2HB GLU 118 HB1 GLU 118 116.202 -3.623 -6.098 967 1HG GLU 118 HG2 GLU 118 118.224 -4.600 -5.672 968 2HG GLU 118 HG1 GLU 118 118.119 -5.669 -7.072 969 H SER 119 HN SER 119 113.695 -4.631 -8.406 970 HA SER 119 HA SER 119 114.076 -6.521 -10.619 971 1HB SER 119 HB2 SER 119 111.827 -6.119 -10.534 972 2HB SER 119 HB1 SER 119 112.039 -4.534 -9.795 973 HG SER 119 HG SER 119 111.308 -4.803 -12.147 974 H LEU 120 HN LEU 120 115.032 -3.296 -9.788 975 HA LEU 120 HA LEU 120 115.593 -2.466 -12.537 976 1HB LEU 120 HB2 LEU 120 116.175 -1.316 -9.805 977 2HB LEU 120 HB1 LEU 120 116.914 -0.627 -11.251 978 HG LEU 120 HG LEU 120 113.933 -0.975 -10.795 979 1HD1 LEU 120 HD11 LEU 120 115.730 1.465 -10.783 980 2HD1 LEU 120 HD13 LEU 120 113.972 1.543 -10.817 981 3HD1 LEU 120 HD12 LEU 120 114.794 0.845 -9.422 982 1HD2 LEU 120 HD23 LEU 120 115.592 0.026 -13.108 983 2HD2 LEU 120 HD22 LEU 120 114.290 -1.164 -13.124 984 3HD2 LEU 120 HD21 LEU 120 113.921 0.545 -12.887 985 HA PRO 121 HA PRO 121 119.584 -4.265 -12.841 986 1HB PRO 121 HB2 PRO 121 120.778 -2.458 -14.537 987 2HB PRO 121 HB1 PRO 121 119.572 -3.647 -15.060 988 1HG PRO 121 HG2 PRO 121 119.255 -0.708 -14.644 989 2HG PRO 121 HG1 PRO 121 118.365 -1.790 -15.728 990 1HD PRO 121 HD2 PRO 121 117.430 -0.815 -13.248 991 2HD PRO 121 HD1 PRO 121 116.731 -2.169 -14.162 992 H GLY 122 HN GLY 122 119.244 -0.980 -11.738 993 1HA GLY 122 HA2 GLY 122 121.572 -1.305 -9.975 994 2HA GLY 122 HA1 GLY 122 121.714 -0.002 -11.158 995 H GLY 123 HN GLY 123 119.047 -1.220 -9.107 996 1HA GLY 123 HA2 GLY 123 117.583 -0.063 -7.686 997 2HA GLY 123 HA1 GLY 123 118.924 1.057 -7.397 998 H LEU 124 HN LEU 124 116.893 2.556 -7.423 999 HA LEU 124 HA LEU 124 115.705 3.137 -10.002 1000 1HB LEU 124 HB2 LEU 124 115.772 4.823 -7.488 1001 2HB LEU 124 HB1 LEU 124 114.696 5.054 -8.868 1002 HG LEU 124 HG LEU 124 114.741 2.338 -7.685 1003 1HD1 LEU 124 HD13 LEU 124 114.764 4.063 -5.758 1004 2HD1 LEU 124 HD12 LEU 124 113.156 4.515 -6.323 1005 3HD1 LEU 124 HD11 LEU 124 113.464 2.871 -5.763 1006 1HD2 LEU 124 HD23 LEU 124 112.892 4.191 -9.096 1007 2HD2 LEU 124 HD22 LEU 124 113.111 2.453 -9.298 1008 3HD2 LEU 124 HD21 LEU 124 112.149 3.070 -7.955 1009 H LYS 125 HN LYS 125 115.753 5.668 -10.566 1010 HA LYS 125 HA LYS 125 118.110 7.193 -10.256 1011 1HB LYS 125 HB2 LYS 125 118.510 4.909 -11.916 1012 2HB LYS 125 HB1 LYS 125 118.506 6.324 -12.967 1013 1HG LYS 125 HG2 LYS 125 120.071 6.353 -10.395 1014 2HG LYS 125 HG1 LYS 125 120.751 5.607 -11.841 1015 1HD LYS 125 HD2 LYS 125 121.512 7.827 -11.985 1016 2HD LYS 125 HD1 LYS 125 120.087 7.829 -13.024 1017 1HE LYS 125 HE2 LYS 125 118.913 9.186 -11.619 1018 2HE LYS 125 HE1 LYS 125 119.532 8.383 -10.178 1019 1HZ LYS 125 HZ2 LYS 125 121.741 9.543 -10.997 1020 2HZ LYS 125 HZ1 LYS 125 120.628 10.641 -11.663 1021 3HZ LYS 125 HZ3 LYS 125 120.625 10.339 -9.994 1022 H GLU 126 HN GLU 126 118.262 8.150 -13.022 1023 HA GLU 126 HA GLU 126 115.869 9.807 -13.005 1024 1HB GLU 126 HB2 GLU 126 116.874 10.978 -14.836 1025 2HB GLU 126 HB1 GLU 126 118.194 10.550 -13.748 1026 1HG GLU 126 HG2 GLU 126 118.805 8.657 -15.128 1027 2HG GLU 126 HG1 GLU 126 117.382 8.885 -16.146 1028 H HIS 127 HN HIS 127 116.630 6.753 -14.287 1029 HA HIS 127 HA HIS 127 114.754 6.986 -16.555 1030 1HB HIS 127 HB2 HIS 127 115.493 4.826 -17.206 1031 2HB HIS 127 HB1 HIS 127 116.936 5.633 -16.596 1032 HD1 HIS 127 HD1 HIS 127 115.849 5.243 -13.517 1033 HD2 HIS 127 HD2 HIS 127 116.559 2.290 -16.369 1034 HE1 HIS 127 HE1 HIS 127 116.226 3.089 -12.238 1035 H ASP 128 HN ASP 128 114.398 6.593 -13.301 1036 HA ASP 128 HA ASP 128 111.968 4.891 -13.678 1037 1HB ASP 128 HB2 ASP 128 114.158 4.399 -12.003 1038 2HB ASP 128 HB1 ASP 128 112.905 5.022 -10.930 1039 H PHE 129 HN PHE 129 113.395 7.566 -11.824 1040 HA PHE 129 HA PHE 129 110.803 8.355 -10.728 1041 1HB PHE 129 HB2 PHE 129 113.420 9.888 -10.802 1042 2HB PHE 129 HB1 PHE 129 112.030 10.242 -9.774 1043 HD1 PHE 129 HD2 PHE 129 111.178 7.550 -8.939 1044 HD2 PHE 129 HD1 PHE 129 115.124 9.198 -9.322 1045 HE1 PHE 129 HE2 PHE 129 112.010 5.948 -7.251 1046 HE2 PHE 129 HE1 PHE 129 115.955 7.595 -7.632 1047 HZ PHE 129 HZ PHE 129 114.401 5.970 -6.591 1048 H ASN 130 HN ASN 130 111.101 11.218 -11.100 1049 HA ASN 130 HA ASN 130 110.738 11.466 -14.053 1050 1HB ASN 130 HB2 ASN 130 108.642 11.474 -12.232 1051 2HB ASN 130 HB1 ASN 130 108.958 13.189 -12.499 1052 1HD2 ASN 130 HD22 ASN 130 107.355 13.139 -15.622 1053 2HD2 ASN 130 HD21 ASN 130 107.822 14.020 -14.249 1054 HA PRO 131 HA PRO 131 113.273 14.916 -12.169 1055 1HB PRO 131 HB2 PRO 131 115.718 14.156 -13.159 1056 2HB PRO 131 HB1 PRO 131 115.108 13.642 -11.576 1057 1HG PRO 131 HG2 PRO 131 115.344 12.068 -14.095 1058 2HG PRO 131 HG1 PRO 131 115.337 11.504 -12.416 1059 1HD PRO 131 HD2 PRO 131 113.151 11.395 -14.228 1060 2HD PRO 131 HD1 PRO 131 113.090 11.102 -12.478 1061 H GLU 132 HN GLU 132 111.675 15.314 -14.317 1062 HA GLU 132 HA GLU 132 113.046 15.562 -16.842 1063 1HB GLU 132 HB2 GLU 132 110.606 17.111 -15.933 1064 2HB GLU 132 HB1 GLU 132 111.081 16.742 -17.591 1065 1HG GLU 132 HG2 GLU 132 110.375 14.657 -15.504 1066 2HG GLU 132 HG1 GLU 132 109.272 15.236 -16.754 1067 H SER 133 HN SER 133 115.012 16.696 -16.244 1068 HA SER 133 HA SER 133 116.319 18.601 -15.791 1069 1HB SER 133 HB2 SER 133 114.933 20.700 -16.872 1070 2HB SER 133 HB1 SER 133 115.917 19.577 -17.805 1071 HG SER 133 HG SER 133 114.000 18.301 -18.055 1072 H SER 134 HN SER 134 113.440 20.592 -15.749 1073 HA SER 134 HA SER 134 114.067 21.441 -13.016 1074 1HB SER 134 HB2 SER 134 111.669 22.626 -13.627 1075 2HB SER 134 HB1 SER 134 113.245 23.306 -14.021 1076 HG SER 134 HG SER 134 113.097 22.411 -16.052 No H/Q in entry = 1076
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