NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
635325 | 6mg9 | 30514 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 51.027 -11.201 19.915 2 H2 MET 1 HT2 MET 1 51.569 -12.760 19.514 3 H3 MET 1 HT3 MET 1 50.053 -12.219 18.972 4 HA MET 1 HA MET 1 51.821 -12.202 17.240 5 HB2 MET 1 HB2 MET 1 51.308 -9.753 16.607 6 HB3 MET 1 HB1 MET 1 49.932 -10.837 16.804 7 HG2 MET 1 HG2 MET 1 49.548 -10.022 19.063 8 HG3 MET 1 HG1 MET 1 50.992 -9.017 18.982 9 HE1 MET 1 HE1 MET 1 50.197 -6.055 16.916 10 HE2 MET 1 HE2 MET 1 51.145 -7.445 16.402 11 HE3 MET 1 HE3 MET 1 51.238 -6.894 18.072 12 H ALA 2 HN ALA 2 53.855 -11.574 16.673 13 HA ALA 2 HA ALA 2 55.269 -9.393 17.804 14 HB1 ALA 2 HB1 ALA 2 56.915 -10.639 19.141 15 HB2 ALA 2 HB2 ALA 2 56.003 -12.126 18.880 16 HB3 ALA 2 HB3 ALA 2 55.294 -10.807 19.811 17 HA PRO 3 HA PRO 3 56.918 -11.354 13.948 18 HB2 PRO 3 HB2 PRO 3 56.906 -8.698 12.743 19 HB3 PRO 3 HB1 PRO 3 55.973 -10.127 12.270 20 HG2 PRO 3 HG2 PRO 3 54.913 -7.842 13.432 21 HG3 PRO 3 HG1 PRO 3 54.127 -9.427 13.391 22 HD2 PRO 3 HD2 PRO 3 55.522 -8.078 15.656 23 HD3 PRO 3 HD1 PRO 3 54.198 -9.263 15.689 24 H GLU 4 HN GLU 4 59.038 -11.338 13.220 25 HA GLU 4 HA GLU 4 60.948 -10.038 14.954 26 HB2 GLU 4 HB2 GLU 4 62.620 -11.226 13.447 27 HB3 GLU 4 HB1 GLU 4 61.500 -12.264 14.324 28 HG2 GLU 4 HG2 GLU 4 60.827 -11.319 11.538 29 HG3 GLU 4 HG1 GLU 4 61.888 -12.702 11.774 30 H VAL 5 HN VAL 5 62.393 -10.225 11.985 31 HA VAL 5 HA VAL 5 62.468 -7.326 11.710 32 HB VAL 5 HB VAL 5 63.734 -9.304 9.796 33 HG11 VAL 5 HG11 VAL 5 64.772 -6.642 10.769 34 HG12 VAL 5 HG12 VAL 5 63.638 -6.764 9.424 35 HG13 VAL 5 HG13 VAL 5 65.224 -7.528 9.314 36 HG21 VAL 5 HG21 VAL 5 65.517 -9.781 11.193 37 HG22 VAL 5 HG22 VAL 5 64.273 -9.631 12.426 38 HG23 VAL 5 HG23 VAL 5 65.358 -8.285 12.103 39 H THR 6 HN THR 6 60.971 -6.266 10.453 40 HA THR 6 HA THR 6 59.358 -7.847 8.582 41 HB THR 6 HB THR 6 59.258 -4.878 9.149 42 HG1 THR 6 HG1 THR 6 57.488 -5.486 10.451 43 HG21 THR 6 HG21 THR 6 58.174 -5.216 7.086 44 HG22 THR 6 HG22 THR 6 56.863 -5.300 8.262 45 HG23 THR 6 HG23 THR 6 57.530 -6.782 7.580 46 H ILE 7 HN ILE 7 59.827 -8.069 6.482 47 HA ILE 7 HA ILE 7 61.926 -6.328 5.330 48 HB ILE 7 HB ILE 7 60.860 -8.947 4.301 49 HG12 ILE 7 HG12 ILE 7 61.890 -9.357 6.460 50 HG13 ILE 7 HG11 ILE 7 63.007 -9.892 5.208 51 HG21 ILE 7 HG21 ILE 7 63.158 -8.872 3.130 52 HG22 ILE 7 HG22 ILE 7 63.168 -7.159 3.548 53 HG23 ILE 7 HG23 ILE 7 61.896 -7.807 2.511 54 HD11 ILE 7 HD11 ILE 7 64.419 -8.672 6.616 55 HD12 ILE 7 HD12 ILE 7 63.179 -7.475 6.988 56 HD13 ILE 7 HD13 ILE 7 63.983 -7.453 5.420 57 H LEU 8 HN LEU 8 60.732 -4.591 4.695 58 HA LEU 8 HA LEU 8 58.807 -5.049 2.489 59 HB2 LEU 8 HB2 LEU 8 57.674 -4.224 4.547 60 HB3 LEU 8 HB1 LEU 8 58.740 -2.821 4.548 61 HG LEU 8 HG LEU 8 57.870 -2.158 2.330 62 HD11 LEU 8 HD11 LEU 8 57.163 -4.061 1.195 63 HD12 LEU 8 HD12 LEU 8 55.613 -3.439 1.748 64 HD13 LEU 8 HD13 LEU 8 56.390 -4.762 2.616 65 HD21 LEU 8 HD21 LEU 8 55.735 -1.360 3.111 66 HD22 LEU 8 HD22 LEU 8 56.798 -1.438 4.517 67 HD23 LEU 8 HD23 LEU 8 55.591 -2.696 4.254 68 H GLU 9 HN GLU 9 60.734 -4.941 1.156 69 HA GLU 9 HA GLU 9 61.741 -2.174 0.742 70 HB2 GLU 9 HB2 GLU 9 63.758 -3.529 -0.262 71 HB3 GLU 9 HB1 GLU 9 63.625 -3.313 1.484 72 HG2 GLU 9 HG2 GLU 9 62.787 -5.499 1.815 73 HG3 GLU 9 HG1 GLU 9 62.405 -5.707 0.106 74 HA PRO 10 HA PRO 10 59.643 -3.480 -3.151 75 HB2 PRO 10 HB2 PRO 10 59.031 -0.693 -3.675 76 HB3 PRO 10 HB1 PRO 10 57.910 -2.001 -3.275 77 HG2 PRO 10 HG2 PRO 10 58.595 0.162 -1.624 78 HG3 PRO 10 HG1 PRO 10 57.727 -1.300 -1.135 79 HD2 PRO 10 HD2 PRO 10 60.543 -0.547 -0.612 80 HD3 PRO 10 HD1 PRO 10 59.516 -1.723 0.233 81 H LEU 11 HN LEU 11 62.491 -2.414 -2.454 82 HA LEU 11 HA LEU 11 63.334 -0.875 -4.719 83 HB2 LEU 11 HB2 LEU 11 64.966 -2.587 -2.826 84 HB3 LEU 11 HB1 LEU 11 65.590 -1.328 -3.889 85 HG LEU 11 HG LEU 11 63.544 -0.850 -1.699 86 HD11 LEU 11 HD11 LEU 11 66.553 -0.668 -1.736 87 HD12 LEU 11 HD12 LEU 11 65.501 -1.374 -0.513 88 HD13 LEU 11 HD13 LEU 11 65.609 0.378 -0.676 89 HD21 LEU 11 HD21 LEU 11 64.479 1.569 -2.125 90 HD22 LEU 11 HD22 LEU 11 63.286 0.909 -3.238 91 HD23 LEU 11 HD23 LEU 11 64.993 0.912 -3.679 92 H GLN 12 HN GLN 12 62.014 -2.593 -6.079 93 HA GLN 12 HA GLN 12 63.297 -5.073 -6.662 94 HB2 GLN 12 HB2 GLN 12 61.268 -3.494 -8.260 95 HB3 GLN 12 HB1 GLN 12 61.717 -5.176 -8.547 96 HG2 GLN 12 HG2 GLN 12 60.563 -4.124 -5.949 97 HG3 GLN 12 HG1 GLN 12 59.631 -4.957 -7.191 98 HE21 GLN 12 HE21 GLN 12 61.118 -5.526 -4.288 99 HE22 GLN 12 HE22 GLN 12 61.509 -7.166 -4.486 100 H ASP 13 HN ASP 13 63.352 -1.876 -8.208 101 HA ASP 13 HA ASP 13 65.940 -2.307 -9.319 102 HB2 ASP 13 HB2 ASP 13 64.573 -3.748 -10.841 103 HB3 ASP 13 HB1 ASP 13 63.652 -2.315 -11.300 104 H VAL 14 HN VAL 14 66.856 -0.328 -9.658 105 HA VAL 14 HA VAL 14 65.026 1.995 -10.009 106 HB VAL 14 HB VAL 14 67.543 1.780 -8.347 107 HG11 VAL 14 HG11 VAL 14 66.874 4.174 -7.728 108 HG12 VAL 14 HG12 VAL 14 65.838 4.139 -9.154 109 HG13 VAL 14 HG13 VAL 14 67.582 3.948 -9.327 110 HG21 VAL 14 HG21 VAL 14 65.935 2.423 -6.518 111 HG22 VAL 14 HG22 VAL 14 65.623 0.834 -7.217 112 HG23 VAL 14 HG23 VAL 14 64.617 2.211 -7.673 113 H GLN 15 HN GLN 15 65.466 3.300 -11.663 114 HA GLN 15 HA GLN 15 68.129 3.159 -12.968 115 HB2 GLN 15 HB2 GLN 15 65.395 3.144 -14.264 116 HB3 GLN 15 HB1 GLN 15 66.883 3.506 -15.139 117 HG2 GLN 15 HG2 GLN 15 67.802 1.323 -14.563 118 HG3 GLN 15 HG1 GLN 15 66.389 0.957 -13.575 119 HE21 GLN 15 HE21 GLN 15 66.632 -0.925 -15.418 120 HE22 GLN 15 HE22 GLN 15 65.640 -0.672 -16.772 121 H LEU 16 HN LEU 16 68.995 5.097 -13.549 122 HA LEU 16 HA LEU 16 67.357 7.487 -13.700 123 HB2 LEU 16 HB2 LEU 16 68.506 8.683 -11.903 124 HB3 LEU 16 HB1 LEU 16 67.671 7.263 -11.282 125 HG LEU 16 HG LEU 16 70.151 6.188 -11.862 126 HD11 LEU 16 HD11 LEU 16 70.782 8.872 -10.621 127 HD12 LEU 16 HD12 LEU 16 70.893 8.613 -12.361 128 HD13 LEU 16 HD13 LEU 16 71.898 7.667 -11.264 129 HD21 LEU 16 HD21 LEU 16 69.172 7.493 -9.306 130 HD22 LEU 16 HD22 LEU 16 70.602 6.463 -9.388 131 HD23 LEU 16 HD23 LEU 16 69.013 5.799 -9.771 132 H SER 17 HN SER 17 68.224 8.954 -15.018 133 HA SER 17 HA SER 17 70.491 8.321 -16.581 134 HB2 SER 17 HB2 SER 17 68.650 9.729 -17.407 135 HB3 SER 17 HB1 SER 17 69.074 10.976 -16.238 136 HG SER 17 HG SER 17 70.361 10.176 -18.578 137 H GLU 18 HN GLU 18 72.547 9.202 -16.639 138 HA GLU 18 HA GLU 18 73.804 9.766 -14.186 139 HB2 GLU 18 HB2 GLU 18 74.883 8.870 -16.300 140 HB3 GLU 18 HB1 GLU 18 74.839 10.515 -16.928 141 HG2 GLU 18 HG2 GLU 18 76.128 9.831 -14.278 142 HG3 GLU 18 HG1 GLU 18 77.017 9.800 -15.798 143 H GLY 19 HN GLY 19 74.495 11.652 -13.236 144 HA2 GLY 19 HA2 GLY 19 74.922 13.992 -13.149 145 HA3 GLY 19 HA1 GLY 19 73.833 14.227 -14.513 146 H GLN 20 HN GLN 20 72.039 12.198 -12.913 147 HA GLN 20 HA GLN 20 70.625 14.300 -11.400 148 HB2 GLN 20 HB2 GLN 20 69.801 11.648 -12.581 149 HB3 GLN 20 HB1 GLN 20 68.793 12.478 -11.395 150 HG2 GLN 20 HG2 GLN 20 68.120 13.071 -13.694 151 HG3 GLN 20 HG1 GLN 20 68.735 14.480 -12.830 152 HE21 GLN 20 HE21 GLN 20 69.660 15.659 -14.562 153 HE22 GLN 20 HE22 GLN 20 70.894 15.050 -15.556 154 H ASP 21 HN ASP 21 69.985 14.018 -9.269 155 HA ASP 21 HA ASP 21 71.741 12.476 -7.611 156 HB2 ASP 21 HB2 ASP 21 69.282 14.142 -7.043 157 HB3 ASP 21 HB1 ASP 21 70.150 13.277 -5.777 158 H ALA 22 HN ALA 22 71.129 10.763 -6.176 159 HA ALA 22 HA ALA 22 68.671 9.289 -6.961 160 HB1 ALA 22 HB1 ALA 22 70.858 8.383 -7.942 161 HB2 ALA 22 HB2 ALA 22 69.846 7.244 -7.054 162 HB3 ALA 22 HB3 ALA 22 71.278 7.933 -6.290 163 H SER 23 HN SER 23 67.641 8.149 -5.356 164 HA SER 23 HA SER 23 68.755 8.146 -2.638 165 HB2 SER 23 HB2 SER 23 66.200 9.535 -3.451 166 HB3 SER 23 HB1 SER 23 66.517 9.025 -1.796 167 HG SER 23 HG SER 23 67.568 10.836 -1.659 168 H PHE 24 HN PHE 24 67.955 6.530 -1.350 169 HA PHE 24 HA PHE 24 66.063 4.600 -2.598 170 HB2 PHE 24 HB2 PHE 24 68.688 4.241 -1.226 171 HB3 PHE 24 HB1 PHE 24 67.459 3.050 -0.851 172 HD1 PHE 24 HD1 PHE 24 68.031 1.096 -1.988 173 HD2 PHE 24 HD2 PHE 24 68.262 4.834 -4.085 174 HE1 PHE 24 HE1 PHE 24 68.562 -0.109 -4.088 175 HE2 PHE 24 HE2 PHE 24 68.786 3.626 -6.181 176 HZ PHE 24 HZ PHE 24 68.940 1.159 -6.182 177 H GLN 25 HN GLN 25 64.591 3.572 -1.194 178 HA GLN 25 HA GLN 25 64.466 4.449 1.604 179 HB2 GLN 25 HB2 GLN 25 62.010 4.982 1.300 180 HB3 GLN 25 HB1 GLN 25 63.127 6.146 0.585 181 HG2 GLN 25 HG2 GLN 25 62.853 5.060 -1.615 182 HG3 GLN 25 HG1 GLN 25 61.732 3.903 -0.906 183 HE21 GLN 25 HE21 GLN 25 60.272 4.960 -2.668 184 HE22 GLN 25 HE22 GLN 25 59.402 6.341 -2.200 185 H CYS 26 HN CYS 26 63.836 2.842 2.905 186 HA CYS 26 HA CYS 26 62.061 0.743 1.936 187 HB2 CYS 26 HB2 CYS 26 63.521 -1.079 2.224 188 HB3 CYS 26 HB1 CYS 26 64.488 0.108 1.354 189 HG CYS 26 HG CYS 26 66.035 -0.458 3.274 190 H ARG 27 HN ARG 27 60.896 -0.204 3.540 191 HA ARG 27 HA ARG 27 61.260 0.902 6.257 192 HB2 ARG 27 HB2 ARG 27 58.916 -0.468 4.915 193 HB3 ARG 27 HB1 ARG 27 58.936 0.040 6.603 194 HG2 ARG 27 HG2 ARG 27 59.371 2.374 5.884 195 HG3 ARG 27 HG1 ARG 27 59.306 1.855 4.203 196 HD2 ARG 27 HD2 ARG 27 56.978 1.108 4.514 197 HD3 ARG 27 HD1 ARG 27 57.038 1.608 6.202 198 HE ARG 27 HE ARG 27 57.716 3.765 4.442 199 HH11 ARG 27 HH11 ARG 27 55.780 3.367 6.955 200 HH12 ARG 27 HH12 ARG 27 54.320 3.996 6.272 201 HH21 ARG 27 HH21 ARG 27 55.514 3.959 3.016 202 HH22 ARG 27 HH22 ARG 27 54.170 4.336 4.043 203 H LEU 28 HN LEU 28 62.289 -0.352 7.695 204 HA LEU 28 HA LEU 28 61.869 -3.287 7.573 205 HB2 LEU 28 HB2 LEU 28 64.460 -1.859 8.219 206 HB3 LEU 28 HB1 LEU 28 64.207 -3.600 8.275 207 HG LEU 28 HG LEU 28 63.850 -1.907 5.782 208 HD11 LEU 28 HD11 LEU 28 66.013 -2.775 5.072 209 HD12 LEU 28 HD12 LEU 28 66.145 -3.742 6.541 210 HD13 LEU 28 HD13 LEU 28 66.207 -1.982 6.635 211 HD21 LEU 28 HD21 LEU 28 62.580 -3.881 5.473 212 HD22 LEU 28 HD22 LEU 28 63.724 -4.869 6.380 213 HD23 LEU 28 HD23 LEU 28 64.137 -4.298 4.764 214 H SER 29 HN SER 29 60.557 -3.640 9.298 215 HA SER 29 HA SER 29 60.545 -2.074 11.654 216 HB2 SER 29 HB2 SER 29 58.668 -3.584 10.954 217 HB3 SER 29 HB1 SER 29 59.671 -4.957 11.429 218 HG SER 29 HG SER 29 59.676 -3.136 13.378 219 H ARG 30 HN ARG 30 61.043 -2.902 13.825 220 HA ARG 30 HA ARG 30 63.757 -3.370 14.148 221 HB2 ARG 30 HB2 ARG 30 63.275 -3.700 16.476 222 HB3 ARG 30 HB1 ARG 30 62.150 -2.485 15.872 223 HG2 ARG 30 HG2 ARG 30 60.474 -4.353 15.519 224 HG3 ARG 30 HG1 ARG 30 61.581 -5.418 16.385 225 HD2 ARG 30 HD2 ARG 30 60.417 -2.851 17.498 226 HD3 ARG 30 HD1 ARG 30 59.845 -4.470 17.886 227 HE ARG 30 HE ARG 30 62.242 -3.196 18.896 228 HH11 ARG 30 HH11 ARG 30 63.440 -5.674 17.996 229 HH12 ARG 30 HH12 ARG 30 63.082 -6.810 19.255 230 HH21 ARG 30 HH21 ARG 30 60.534 -4.893 20.622 231 HH22 ARG 30 HH22 ARG 30 61.440 -6.365 20.743 232 H ALA 31 HN ALA 31 64.810 -5.189 15.177 233 HA ALA 31 HA ALA 31 64.043 -7.700 13.886 234 HB1 ALA 31 HB1 ALA 31 66.311 -8.417 14.404 235 HB2 ALA 31 HB2 ALA 31 66.574 -6.965 15.370 236 HB3 ALA 31 HB3 ALA 31 66.351 -6.834 13.625 237 H SER 32 HN SER 32 65.073 -9.604 15.341 238 HA SER 32 HA SER 32 64.184 -9.436 18.119 239 HB2 SER 32 HB2 SER 32 62.795 -11.058 16.000 240 HB3 SER 32 HB1 SER 32 62.860 -11.654 17.658 241 HG SER 32 HG SER 32 61.876 -9.134 16.783 242 H GLY 33 HN GLY 33 65.205 -11.586 15.480 243 HA2 GLY 33 HA2 GLY 33 66.847 -13.178 17.313 244 HA3 GLY 33 HA1 GLY 33 66.570 -13.499 15.598 245 H GLN 34 HN GLN 34 67.551 -11.954 14.047 246 HA GLN 34 HA GLN 34 70.061 -10.755 15.071 247 HB2 GLN 34 HB2 GLN 34 70.427 -12.902 13.815 248 HB3 GLN 34 HB1 GLN 34 69.720 -12.125 12.401 249 HG2 GLN 34 HG2 GLN 34 71.452 -10.445 12.371 250 HG3 GLN 34 HG1 GLN 34 72.103 -11.024 13.904 251 HE21 GLN 34 HE21 GLN 34 74.069 -11.101 12.192 252 HE22 GLN 34 HE22 GLN 34 74.294 -12.616 11.460 253 H GLU 35 HN GLU 35 70.846 -8.937 13.905 254 HA GLU 35 HA GLU 35 68.703 -7.301 12.758 255 HB2 GLU 35 HB2 GLU 35 70.260 -6.414 14.514 256 HB3 GLU 35 HB1 GLU 35 71.583 -6.576 13.362 257 HG2 GLU 35 HG2 GLU 35 70.849 -4.299 13.234 258 HG3 GLU 35 HG1 GLU 35 70.240 -5.093 11.786 259 H ALA 36 HN ALA 36 68.797 -6.391 10.671 260 HA ALA 36 HA ALA 36 70.070 -7.994 8.675 261 HB1 ALA 36 HB1 ALA 36 69.164 -6.322 7.091 262 HB2 ALA 36 HB2 ALA 36 68.692 -5.305 8.451 263 HB3 ALA 36 HB3 ALA 36 67.934 -6.881 8.224 264 H ARG 37 HN ARG 37 71.748 -7.452 7.277 265 HA ARG 37 HA ARG 37 73.599 -5.366 8.273 266 HB2 ARG 37 HB2 ARG 37 74.076 -7.923 6.735 267 HB3 ARG 37 HB1 ARG 37 75.319 -6.700 7.003 268 HG2 ARG 37 HG2 ARG 37 75.034 -6.927 9.435 269 HG3 ARG 37 HG1 ARG 37 73.772 -8.135 9.182 270 HD2 ARG 37 HD2 ARG 37 75.384 -9.586 8.021 271 HD3 ARG 37 HD1 ARG 37 76.646 -8.379 8.255 272 HE ARG 37 HE ARG 37 75.402 -9.207 10.723 273 HH11 ARG 37 HH11 ARG 37 77.606 -9.099 11.887 274 HH12 ARG 37 HH12 ARG 37 78.698 -10.358 11.415 275 HH21 ARG 37 HH21 ARG 37 76.911 -11.202 8.560 276 HH22 ARG 37 HH22 ARG 37 78.304 -11.550 9.529 277 H TRP 38 HN TRP 38 74.360 -3.832 6.950 278 HA TRP 38 HA TRP 38 73.146 -3.596 4.266 279 HB2 TRP 38 HB2 TRP 38 73.055 -1.814 6.247 280 HB3 TRP 38 HB1 TRP 38 74.643 -1.369 5.635 281 HD1 TRP 38 HD1 TRP 38 74.772 -0.189 3.299 282 HE1 TRP 38 HE1 TRP 38 72.990 0.862 1.760 283 HE3 TRP 38 HE3 TRP 38 70.540 -2.074 5.443 284 HZ2 TRP 38 HZ2 TRP 38 70.142 0.897 1.480 285 HZ3 TRP 38 HZ3 TRP 38 68.308 -1.514 4.524 286 HH2 TRP 38 HH2 TRP 38 68.104 -0.033 2.546 287 H ALA 39 HN ALA 39 74.456 -3.636 2.450 288 HA ALA 39 HA ALA 39 77.285 -3.084 2.639 289 HB1 ALA 39 HB1 ALA 39 77.042 -5.435 3.546 290 HB2 ALA 39 HB2 ALA 39 78.130 -5.263 2.169 291 HB3 ALA 39 HB3 ALA 39 76.506 -5.913 1.936 292 H LEU 40 HN LEU 40 78.347 -3.055 0.625 293 HA LEU 40 HA LEU 40 76.602 -3.248 -1.764 294 HB2 LEU 40 HB2 LEU 40 76.936 -0.880 -1.055 295 HB3 LEU 40 HB1 LEU 40 78.671 -1.098 -1.225 296 HG LEU 40 HG LEU 40 76.935 -1.829 -3.579 297 HD11 LEU 40 HD11 LEU 40 77.699 1.039 -2.949 298 HD12 LEU 40 HD12 LEU 40 76.067 0.382 -2.801 299 HD13 LEU 40 HD13 LEU 40 76.844 0.462 -4.380 300 HD21 LEU 40 HD21 LEU 40 79.246 -2.201 -3.977 301 HD22 LEU 40 HD22 LEU 40 79.724 -0.711 -3.170 302 HD23 LEU 40 HD23 LEU 40 78.939 -0.648 -4.742 303 H GLY 41 HN GLY 41 77.428 -4.511 -3.317 304 HA2 GLY 41 HA2 GLY 41 79.024 -5.492 -4.701 305 HA3 GLY 41 HA1 GLY 41 80.285 -4.682 -3.778 306 H GLY 42 HN GLY 42 78.086 -6.258 -1.768 307 HA2 GLY 42 HA2 GLY 42 78.023 -8.435 -0.866 308 HA3 GLY 42 HA1 GLY 42 79.484 -8.839 -1.765 309 H VAL 43 HN VAL 43 80.493 -6.086 -0.726 310 HA VAL 43 HA VAL 43 81.497 -7.108 1.864 311 HB VAL 43 HB VAL 43 83.359 -5.447 1.446 312 HG11 VAL 43 HG11 VAL 43 83.579 -7.866 0.937 313 HG12 VAL 43 HG12 VAL 43 84.456 -6.884 -0.237 314 HG13 VAL 43 HG13 VAL 43 82.894 -7.582 -0.663 315 HG21 VAL 43 HG21 VAL 43 83.583 -4.560 -0.821 316 HG22 VAL 43 HG22 VAL 43 82.027 -4.054 -0.161 317 HG23 VAL 43 HG23 VAL 43 82.104 -5.382 -1.319 318 HA PRO 44 HA PRO 44 79.308 -3.853 3.949 319 HB2 PRO 44 HB2 PRO 44 81.492 -3.098 5.710 320 HB3 PRO 44 HB1 PRO 44 80.052 -4.050 6.098 321 HG2 PRO 44 HG2 PRO 44 82.751 -4.969 5.752 322 HG3 PRO 44 HG1 PRO 44 81.321 -5.906 6.201 323 HD2 PRO 44 HD2 PRO 44 82.724 -5.997 3.705 324 HD3 PRO 44 HD1 PRO 44 81.211 -6.828 4.122 325 H LEU 45 HN LEU 45 79.075 -1.647 3.742 326 HA LEU 45 HA LEU 45 81.122 -0.268 2.131 327 HB2 LEU 45 HB2 LEU 45 79.413 1.032 1.220 328 HB3 LEU 45 HB1 LEU 45 78.638 -0.532 1.424 329 HG LEU 45 HG LEU 45 78.353 1.888 3.241 330 HD11 LEU 45 HD11 LEU 45 77.059 1.876 1.102 331 HD12 LEU 45 HD12 LEU 45 76.031 1.825 2.533 332 HD13 LEU 45 HD13 LEU 45 76.316 0.355 1.602 333 HD21 LEU 45 HD21 LEU 45 76.698 0.451 4.465 334 HD22 LEU 45 HD22 LEU 45 78.354 -0.119 4.639 335 HD23 LEU 45 HD23 LEU 45 77.255 -0.930 3.525 336 H GLN 46 HN GLN 46 80.800 2.276 2.501 337 HA GLN 46 HA GLN 46 80.820 2.896 5.382 338 HB2 GLN 46 HB2 GLN 46 83.092 3.440 3.460 339 HB3 GLN 46 HB1 GLN 46 82.915 4.251 5.015 340 HG2 GLN 46 HG2 GLN 46 82.942 2.061 6.160 341 HG3 GLN 46 HG1 GLN 46 83.142 1.256 4.604 342 HE21 GLN 46 HE21 GLN 46 84.813 4.078 4.236 343 HE22 GLN 46 HE22 GLN 46 86.352 3.574 4.747 344 H ALA 47 HN ALA 47 79.609 4.642 5.721 345 HA ALA 47 HA ALA 47 78.500 6.155 3.592 346 HB1 ALA 47 HB1 ALA 47 77.187 6.005 5.548 347 HB2 ALA 47 HB2 ALA 47 77.753 7.675 5.523 348 HB3 ALA 47 HB3 ALA 47 78.524 6.498 6.587 349 H ASN 48 HN ASN 48 80.424 6.819 2.460 350 HA ASN 48 HA ASN 48 82.390 8.538 3.586 351 HB2 ASN 48 HB2 ASN 48 81.487 7.991 0.757 352 HB3 ASN 48 HB1 ASN 48 82.776 9.134 1.121 353 HD21 ASN 48 HD21 ASN 48 82.875 6.426 -0.265 354 HD22 ASN 48 HD22 ASN 48 84.044 5.549 0.601 355 H GLU 49 HN GLU 49 82.552 10.747 1.977 356 HA GLU 49 HA GLU 49 80.710 12.537 3.186 357 HB2 GLU 49 HB2 GLU 49 82.618 12.840 0.862 358 HB3 GLU 49 HB1 GLU 49 81.646 14.174 1.484 359 HG2 GLU 49 HG2 GLU 49 82.648 13.915 3.696 360 HG3 GLU 49 HG1 GLU 49 83.564 12.514 3.142 361 H MET 50 HN MET 50 81.021 11.376 -0.164 362 HA MET 50 HA MET 50 78.623 12.591 -1.105 363 HB2 MET 50 HB2 MET 50 80.465 11.874 -2.590 364 HB3 MET 50 HB1 MET 50 80.130 10.194 -2.179 365 HG2 MET 50 HG2 MET 50 77.839 10.437 -3.104 366 HG3 MET 50 HG1 MET 50 78.202 12.109 -3.528 367 HE1 MET 50 HE1 MET 50 79.145 8.582 -3.603 368 HE2 MET 50 HE2 MET 50 80.826 8.888 -4.030 369 HE3 MET 50 HE3 MET 50 79.728 8.215 -5.231 370 H ASN 51 HN ASN 51 79.449 9.419 0.190 371 HA ASN 51 HA ASN 51 76.669 8.490 -0.003 372 HB2 ASN 51 HB2 ASN 51 78.367 6.902 -0.683 373 HB3 ASN 51 HB1 ASN 51 79.235 7.119 0.835 374 HD21 ASN 51 HD21 ASN 51 75.761 7.109 1.086 375 HD22 ASN 51 HD22 ASN 51 75.611 5.536 1.707 376 H ASP 52 HN ASP 52 75.487 9.429 1.572 377 HA ASP 52 HA ASP 52 76.463 9.254 4.366 378 HB2 ASP 52 HB2 ASP 52 74.590 11.236 3.047 379 HB3 ASP 52 HB1 ASP 52 74.866 11.139 4.786 380 H ILE 53 HN ILE 53 75.138 8.282 5.841 381 HA ILE 53 HA ILE 53 72.553 7.209 4.837 382 HB ILE 53 HB ILE 53 74.533 5.866 6.692 383 HG12 ILE 53 HG12 ILE 53 73.652 5.117 3.890 384 HG13 ILE 53 HG11 ILE 53 75.150 5.981 4.237 385 HG21 ILE 53 HG21 ILE 53 72.926 3.930 6.314 386 HG22 ILE 53 HG22 ILE 53 71.816 5.102 5.605 387 HG23 ILE 53 HG23 ILE 53 72.291 5.248 7.298 388 HD11 ILE 53 HD11 ILE 53 75.729 3.662 4.092 389 HD12 ILE 53 HD12 ILE 53 74.374 3.194 5.120 390 HD13 ILE 53 HD13 ILE 53 75.744 4.068 5.808 391 H THR 54 HN THR 54 70.814 7.591 6.058 392 HA THR 54 HA THR 54 71.208 8.526 8.847 393 HB THR 54 HB THR 54 70.781 10.524 7.608 394 HG1 THR 54 HG1 THR 54 68.971 9.466 9.279 395 HG21 THR 54 HG21 THR 54 68.976 10.751 6.004 396 HG22 THR 54 HG22 THR 54 68.401 9.122 6.358 397 HG23 THR 54 HG23 THR 54 69.948 9.355 5.545 398 H VAL 55 HN VAL 55 69.763 7.831 10.317 399 HA VAL 55 HA VAL 55 67.575 6.050 9.384 400 HB VAL 55 HB VAL 55 69.397 5.776 11.787 401 HG11 VAL 55 HG11 VAL 55 66.771 4.460 11.089 402 HG12 VAL 55 HG12 VAL 55 67.301 5.113 12.639 403 HG13 VAL 55 HG13 VAL 55 67.977 3.599 12.044 404 HG21 VAL 55 HG21 VAL 55 68.843 3.943 9.431 405 HG22 VAL 55 HG22 VAL 55 70.009 3.656 10.723 406 HG23 VAL 55 HG23 VAL 55 70.259 4.980 9.587 407 H GLU 56 HN GLU 56 65.602 6.525 10.100 408 HA GLU 56 HA GLU 56 65.318 8.574 12.241 409 HB2 GLU 56 HB2 GLU 56 63.647 8.075 9.770 410 HB3 GLU 56 HB1 GLU 56 63.182 9.163 11.077 411 HG2 GLU 56 HG2 GLU 56 65.147 10.535 10.710 412 HG3 GLU 56 HG1 GLU 56 65.766 9.396 9.514 413 H GLN 57 HN GLN 57 62.894 8.508 12.991 414 HA GLN 57 HA GLN 57 62.538 6.145 14.469 415 HB2 GLN 57 HB2 GLN 57 60.629 8.376 13.761 416 HB3 GLN 57 HB1 GLN 57 60.224 7.071 14.877 417 HG2 GLN 57 HG2 GLN 57 62.154 7.672 16.287 418 HG3 GLN 57 HG1 GLN 57 62.569 8.970 15.170 419 HE21 GLN 57 HE21 GLN 57 62.202 10.109 17.474 420 HE22 GLN 57 HE22 GLN 57 60.636 10.718 17.721 421 H GLY 58 HN GLY 58 60.501 4.794 14.350 422 HA2 GLY 58 HA2 GLY 58 59.093 3.365 13.198 423 HA3 GLY 58 HA1 GLY 58 59.197 4.464 11.823 424 H THR 59 HN THR 59 62.196 3.524 13.093 425 HA THR 59 HA THR 59 63.921 2.311 12.222 426 HB THR 59 HB THR 59 61.993 0.226 11.253 427 HG1 THR 59 HG1 THR 59 61.049 0.167 13.101 428 HG21 THR 59 HG21 THR 59 63.649 -1.254 12.362 429 HG22 THR 59 HG22 THR 59 64.543 0.167 12.901 430 HG23 THR 59 HG23 THR 59 64.419 -0.195 11.178 431 H LEU 60 HN LEU 60 62.733 4.282 10.549 432 HA LEU 60 HA LEU 60 62.534 3.250 7.856 433 HB2 LEU 60 HB2 LEU 60 62.771 6.082 8.909 434 HB3 LEU 60 HB1 LEU 60 62.413 5.653 7.239 435 HG LEU 60 HG LEU 60 60.721 4.784 9.602 436 HD11 LEU 60 HD11 LEU 60 59.146 6.552 8.861 437 HD12 LEU 60 HD12 LEU 60 60.328 7.090 7.668 438 HD13 LEU 60 HD13 LEU 60 60.686 7.229 9.388 439 HD21 LEU 60 HD21 LEU 60 60.467 4.569 6.596 440 HD22 LEU 60 HD22 LEU 60 59.030 4.566 7.618 441 HD23 LEU 60 HD23 LEU 60 60.250 3.314 7.817 442 H HIS 61 HN HIS 61 64.083 3.249 6.276 443 HA HIS 61 HA HIS 61 66.817 4.161 7.022 444 HB2 HIS 61 HB2 HIS 61 65.965 1.804 5.324 445 HB3 HIS 61 HB1 HIS 61 67.632 2.344 5.527 446 HD1 HIS 61 HD1 HIS 61 68.719 2.027 7.876 447 HD2 HIS 61 HD2 HIS 61 64.855 0.487 7.590 448 HE1 HIS 61 HE1 HIS 61 68.372 0.579 9.924 449 H LEU 62 HN LEU 62 68.044 5.210 5.385 450 HA LEU 62 HA LEU 62 66.823 5.643 2.763 451 HB2 LEU 62 HB2 LEU 62 65.796 7.292 4.425 452 HB3 LEU 62 HB1 LEU 62 67.387 8.037 4.515 453 HG LEU 62 HG LEU 62 65.863 7.610 1.926 454 HD11 LEU 62 HD11 LEU 62 66.111 10.087 3.662 455 HD12 LEU 62 HD12 LEU 62 64.643 9.144 3.404 456 HD13 LEU 62 HD13 LEU 62 65.364 10.036 2.065 457 HD21 LEU 62 HD21 LEU 62 67.553 9.603 1.358 458 HD22 LEU 62 HD22 LEU 62 68.070 7.925 1.249 459 HD23 LEU 62 HD23 LEU 62 68.490 8.883 2.667 460 H LEU 63 HN LEU 63 68.484 5.347 1.416 461 HA LEU 63 HA LEU 63 71.211 6.014 2.220 462 HB2 LEU 63 HB2 LEU 63 70.191 3.983 0.664 463 HB3 LEU 63 HB1 LEU 63 70.685 5.127 -0.573 464 HG LEU 63 HG LEU 63 72.563 3.751 -0.276 465 HD11 LEU 63 HD11 LEU 63 73.441 5.830 1.689 466 HD12 LEU 63 HD12 LEU 63 72.887 6.367 0.108 467 HD13 LEU 63 HD13 LEU 63 74.233 5.245 0.231 468 HD21 LEU 63 HD21 LEU 63 72.036 2.489 1.649 469 HD22 LEU 63 HD22 LEU 63 71.950 3.913 2.680 470 HD23 LEU 63 HD23 LEU 63 73.509 3.351 2.084 471 H THR 64 HN THR 64 71.639 8.149 2.108 472 HA THR 64 HA THR 64 70.444 9.779 -0.008 473 HB THR 64 HB THR 64 72.265 10.510 2.301 474 HG1 THR 64 HG1 THR 64 70.286 11.423 3.072 475 HG21 THR 64 HG21 THR 64 72.571 12.127 0.558 476 HG22 THR 64 HG22 THR 64 71.457 12.841 1.723 477 HG23 THR 64 HG23 THR 64 70.842 12.169 0.213 478 H LEU 65 HN LEU 65 71.414 9.519 -1.914 479 HA LEU 65 HA LEU 65 74.383 9.573 -2.056 480 HB2 LEU 65 HB2 LEU 65 72.357 8.601 -4.092 481 HB3 LEU 65 HB1 LEU 65 74.110 8.524 -4.258 482 HG LEU 65 HG LEU 65 72.529 7.187 -2.044 483 HD11 LEU 65 HD11 LEU 65 72.983 5.092 -3.230 484 HD12 LEU 65 HD12 LEU 65 73.818 5.975 -4.507 485 HD13 LEU 65 HD13 LEU 65 72.085 6.195 -4.270 486 HD21 LEU 65 HD21 LEU 65 74.677 7.462 -1.161 487 HD22 LEU 65 HD22 LEU 65 75.457 7.370 -2.740 488 HD23 LEU 65 HD23 LEU 65 74.849 5.906 -1.968 489 H HIS 66 HN HIS 66 75.196 11.502 -2.609 490 HA HIS 66 HA HIS 66 73.511 13.534 -3.771 491 HB2 HIS 66 HB2 HIS 66 75.506 13.820 -2.104 492 HB3 HIS 66 HB1 HIS 66 76.506 13.788 -3.554 493 HD1 HIS 66 HD1 HIS 66 75.365 15.510 -5.544 494 HD2 HIS 66 HD2 HIS 66 74.727 16.390 -1.520 495 HE1 HIS 66 HE1 HIS 66 74.716 17.950 -5.443 496 H LYS 67 HN LYS 67 76.105 14.445 -5.259 497 HA LYS 67 HA LYS 67 75.237 13.925 -7.840 498 HB2 LYS 67 HB2 LYS 67 77.658 14.465 -8.510 499 HB3 LYS 67 HB1 LYS 67 76.763 15.700 -7.633 500 HG2 LYS 67 HG2 LYS 67 77.825 14.819 -5.502 501 HG3 LYS 67 HG1 LYS 67 78.848 13.806 -6.515 502 HD2 LYS 67 HD2 LYS 67 78.655 16.815 -6.825 503 HD3 LYS 67 HD1 LYS 67 79.879 16.026 -5.832 504 HE2 LYS 67 HE2 LYS 67 80.473 14.669 -7.938 505 HE3 LYS 67 HE1 LYS 67 79.502 15.842 -8.827 506 HZ1 LYS 67 HZ1 LYS 67 81.291 17.121 -7.022 507 HZ2 LYS 67 HZ2 LYS 67 81.115 17.333 -8.698 508 HZ3 LYS 67 HZ3 LYS 67 82.131 16.112 -8.096 509 H VAL 68 HN VAL 68 74.739 11.850 -8.296 510 HA VAL 68 HA VAL 68 76.423 9.626 -7.723 511 HB VAL 68 HB VAL 68 73.881 9.640 -8.151 512 HG11 VAL 68 HG11 VAL 68 73.110 9.475 -10.397 513 HG12 VAL 68 HG12 VAL 68 74.748 9.286 -11.029 514 HG13 VAL 68 HG13 VAL 68 74.218 10.847 -10.398 515 HG21 VAL 68 HG21 VAL 68 75.265 7.587 -7.878 516 HG22 VAL 68 HG22 VAL 68 75.588 7.599 -9.612 517 HG23 VAL 68 HG23 VAL 68 73.944 7.348 -9.024 518 H THR 69 HN THR 69 77.407 8.226 -9.303 519 HA THR 69 HA THR 69 78.294 9.523 -11.807 520 HB THR 69 HB THR 69 80.591 8.830 -11.379 521 HG1 THR 69 HG1 THR 69 81.125 7.748 -9.556 522 HG21 THR 69 HG21 THR 69 81.151 10.467 -9.758 523 HG22 THR 69 HG22 THR 69 79.647 10.218 -8.870 524 HG23 THR 69 HG23 THR 69 79.622 11.029 -10.436 525 H LEU 70 HN LEU 70 79.181 7.911 -13.351 526 HA LEU 70 HA LEU 70 77.527 5.640 -13.554 527 HB2 LEU 70 HB2 LEU 70 79.285 4.855 -15.242 528 HB3 LEU 70 HB1 LEU 70 78.482 6.382 -15.585 529 HG LEU 70 HG LEU 70 80.951 6.663 -13.939 530 HD11 LEU 70 HD11 LEU 70 82.509 6.299 -15.771 531 HD12 LEU 70 HD12 LEU 70 81.191 5.842 -16.849 532 HD13 LEU 70 HD13 LEU 70 81.608 4.811 -15.481 533 HD21 LEU 70 HD21 LEU 70 81.302 8.580 -15.344 534 HD22 LEU 70 HD22 LEU 70 79.569 8.520 -15.021 535 HD23 LEU 70 HD23 LEU 70 80.197 7.963 -16.572 536 H GLU 71 HN GLU 71 80.526 6.242 -11.959 537 HA GLU 71 HA GLU 71 81.350 3.529 -11.593 538 HB2 GLU 71 HB2 GLU 71 82.071 6.083 -10.147 539 HB3 GLU 71 HB1 GLU 71 82.833 4.525 -9.826 540 HG2 GLU 71 HG2 GLU 71 83.587 4.377 -12.145 541 HG3 GLU 71 HG1 GLU 71 82.754 5.880 -12.535 542 H ASP 72 HN ASP 72 79.305 5.751 -9.808 543 HA ASP 72 HA ASP 72 79.214 4.377 -7.354 544 HB2 ASP 72 HB2 ASP 72 77.242 6.209 -8.718 545 HB3 ASP 72 HB1 ASP 72 76.985 5.568 -7.098 546 H ALA 73 HN ALA 73 77.365 3.967 -10.338 547 HA ALA 73 HA ALA 73 75.277 2.377 -9.521 548 HB1 ALA 73 HB1 ALA 73 75.894 3.148 -11.891 549 HB2 ALA 73 HB2 ALA 73 75.165 1.549 -11.733 550 HB3 ALA 73 HB3 ALA 73 76.907 1.705 -11.968 551 H GLY 74 HN GLY 74 74.962 0.223 -9.054 552 HA2 GLY 74 HA2 GLY 74 76.747 -1.885 -9.363 553 HA3 GLY 74 HA1 GLY 74 77.100 -1.165 -7.794 554 H THR 75 HN THR 75 76.389 -3.529 -7.342 555 HA THR 75 HA THR 75 73.447 -3.720 -7.041 556 HB THR 75 HB THR 75 75.597 -5.847 -6.908 557 HG1 THR 75 HG1 THR 75 73.820 -4.916 -8.868 558 HG21 THR 75 HG21 THR 75 73.600 -7.387 -6.984 559 HG22 THR 75 HG22 THR 75 72.582 -5.980 -6.683 560 HG23 THR 75 HG23 THR 75 73.764 -6.486 -5.479 561 H VAL 76 HN VAL 76 72.579 -3.487 -5.076 562 HA VAL 76 HA VAL 76 74.339 -3.536 -2.700 563 HB VAL 76 HB VAL 76 71.444 -2.671 -2.729 564 HG11 VAL 76 HG11 VAL 76 73.768 -1.705 -1.056 565 HG12 VAL 76 HG12 VAL 76 72.769 -3.083 -0.591 566 HG13 VAL 76 HG13 VAL 76 72.045 -1.482 -0.750 567 HG21 VAL 76 HG21 VAL 76 73.905 -1.061 -3.463 568 HG22 VAL 76 HG22 VAL 76 72.364 -0.334 -3.010 569 HG23 VAL 76 HG23 VAL 76 72.475 -1.333 -4.458 570 H SER 77 HN SER 77 74.166 -5.117 -1.202 571 HA SER 77 HA SER 77 71.963 -7.094 -1.492 572 HB2 SER 77 HB2 SER 77 74.899 -7.501 -0.937 573 HB3 SER 77 HB1 SER 77 73.692 -8.743 -0.618 574 HG SER 77 HG SER 77 73.177 -7.850 -3.014 575 H PHE 78 HN PHE 78 71.271 -8.152 0.394 576 HA PHE 78 HA PHE 78 72.042 -6.919 2.974 577 HB2 PHE 78 HB2 PHE 78 69.190 -7.535 2.175 578 HB3 PHE 78 HB1 PHE 78 69.747 -6.693 3.621 579 HD1 PHE 78 HD1 PHE 78 68.368 -6.178 0.451 580 HD2 PHE 78 HD2 PHE 78 71.429 -4.646 3.049 581 HE1 PHE 78 HE1 PHE 78 68.322 -4.018 -0.769 582 HE2 PHE 78 HE2 PHE 78 71.380 -2.487 1.832 583 HZ PHE 78 HZ PHE 78 69.827 -2.172 -0.078 584 H HIS 79 HN HIS 79 71.974 -8.294 4.734 585 HA HIS 79 HA HIS 79 71.141 -11.102 4.264 586 HB2 HIS 79 HB2 HIS 79 73.684 -10.239 5.663 587 HB3 HIS 79 HB1 HIS 79 73.136 -11.894 5.404 588 HD1 HIS 79 HD1 HIS 79 74.546 -8.918 3.567 589 HD2 HIS 79 HD2 HIS 79 73.538 -12.889 2.787 590 HE1 HIS 79 HE1 HIS 79 75.503 -9.467 1.286 591 H VAL 80 HN VAL 80 69.545 -11.490 5.667 592 HA VAL 80 HA VAL 80 69.798 -10.470 8.449 593 HB VAL 80 HB VAL 80 67.120 -11.065 7.211 594 HG11 VAL 80 HG11 VAL 80 67.490 -10.619 9.682 595 HG12 VAL 80 HG12 VAL 80 66.326 -9.555 8.892 596 HG13 VAL 80 HG13 VAL 80 67.957 -8.981 9.233 597 HG21 VAL 80 HG21 VAL 80 67.926 -9.558 5.581 598 HG22 VAL 80 HG22 VAL 80 68.838 -8.623 6.764 599 HG23 VAL 80 HG23 VAL 80 67.079 -8.521 6.726 600 H GLY 81 HN GLY 81 69.656 -11.965 10.036 601 HA2 GLY 81 HA2 GLY 81 69.977 -14.677 9.554 602 HA3 GLY 81 HA1 GLY 81 69.421 -14.007 11.080 603 H THR 82 HN THR 82 67.188 -12.917 8.983 604 HA THR 82 HA THR 82 65.417 -15.262 9.419 605 HB THR 82 HB THR 82 63.600 -13.803 9.620 606 HG1 THR 82 HG1 THR 82 63.735 -12.459 7.955 607 HG21 THR 82 HG21 THR 82 65.212 -13.622 11.519 608 HG22 THR 82 HG22 THR 82 64.257 -12.157 11.286 609 HG23 THR 82 HG23 THR 82 65.930 -12.216 10.731 610 H CYS 83 HN CYS 83 66.254 -12.727 7.034 611 HA CYS 83 HA CYS 83 65.642 -14.598 4.873 612 HB2 CYS 83 HB2 CYS 83 63.463 -13.592 5.251 613 HB3 CYS 83 HB1 CYS 83 64.167 -11.976 5.187 614 HG CYS 83 HG CYS 83 63.303 -12.431 2.794 615 H SER 84 HN SER 84 66.195 -13.653 2.711 616 HA SER 84 HA SER 84 68.311 -11.573 2.893 617 HB2 SER 84 HB2 SER 84 68.395 -14.207 1.409 618 HB3 SER 84 HB1 SER 84 69.532 -12.891 1.132 619 HG SER 84 HG SER 84 70.249 -13.089 3.211 620 H SER 85 HN SER 85 68.611 -10.291 1.028 621 HA SER 85 HA SER 85 66.905 -10.652 -1.290 622 HB2 SER 85 HB2 SER 85 65.816 -8.410 -1.023 623 HB3 SER 85 HB1 SER 85 65.280 -9.610 0.148 624 HG SER 85 HG SER 85 65.801 -8.028 1.473 625 H GLU 86 HN GLU 86 67.223 -8.844 -2.884 626 HA GLU 86 HA GLU 86 69.588 -7.191 -2.517 627 HB2 GLU 86 HB2 GLU 86 70.684 -8.100 -4.584 628 HB3 GLU 86 HB1 GLU 86 70.685 -9.213 -3.219 629 HG2 GLU 86 HG2 GLU 86 68.523 -9.274 -5.327 630 HG3 GLU 86 HG1 GLU 86 70.020 -10.188 -5.496 631 H ALA 87 HN ALA 87 70.037 -5.922 -4.569 632 HA ALA 87 HA ALA 87 67.781 -5.573 -6.376 633 HB1 ALA 87 HB1 ALA 87 68.628 -3.390 -4.452 634 HB2 ALA 87 HB2 ALA 87 67.070 -4.218 -4.471 635 HB3 ALA 87 HB3 ALA 87 67.527 -3.167 -5.812 636 H GLN 88 HN GLN 88 68.327 -4.302 -8.219 637 HA GLN 88 HA GLN 88 71.243 -3.811 -8.530 638 HB2 GLN 88 HB2 GLN 88 69.173 -4.663 -10.566 639 HB3 GLN 88 HB1 GLN 88 70.835 -4.217 -10.958 640 HG2 GLN 88 HG2 GLN 88 71.670 -6.002 -9.478 641 HG3 GLN 88 HG1 GLN 88 70.013 -6.445 -9.070 642 HE21 GLN 88 HE21 GLN 88 72.224 -7.961 -10.582 643 HE22 GLN 88 HE22 GLN 88 71.476 -8.438 -12.030 644 H LEU 89 HN LEU 89 71.835 -1.779 -8.796 645 HA LEU 89 HA LEU 89 69.842 0.237 -9.672 646 HB2 LEU 89 HB2 LEU 89 71.032 0.447 -7.405 647 HB3 LEU 89 HB1 LEU 89 72.499 0.767 -8.321 648 HG LEU 89 HG LEU 89 69.929 2.348 -8.678 649 HD11 LEU 89 HD11 LEU 89 70.842 4.043 -7.236 650 HD12 LEU 89 HD12 LEU 89 72.381 3.190 -7.109 651 HD13 LEU 89 HD13 LEU 89 70.935 2.518 -6.355 652 HD21 LEU 89 HD21 LEU 89 72.739 2.561 -9.750 653 HD22 LEU 89 HD22 LEU 89 71.797 4.032 -9.521 654 HD23 LEU 89 HD23 LEU 89 71.204 2.769 -10.592 655 H LYS 90 HN LYS 90 70.024 0.718 -11.767 656 HA LYS 90 HA LYS 90 72.699 0.622 -13.044 657 HB2 LYS 90 HB2 LYS 90 69.936 0.228 -14.187 658 HB3 LYS 90 HB1 LYS 90 71.380 0.429 -15.180 659 HG2 LYS 90 HG2 LYS 90 72.418 -1.512 -14.078 660 HG3 LYS 90 HG1 LYS 90 70.979 -1.718 -13.076 661 HD2 LYS 90 HD2 LYS 90 69.619 -2.022 -15.133 662 HD3 LYS 90 HD1 LYS 90 71.089 -1.892 -16.101 663 HE2 LYS 90 HE2 LYS 90 70.623 -3.959 -13.942 664 HE3 LYS 90 HE1 LYS 90 70.458 -4.256 -15.672 665 HZ1 LYS 90 HZ1 LYS 90 72.902 -3.058 -15.379 666 HZ2 LYS 90 HZ2 LYS 90 72.613 -4.707 -15.671 667 HZ3 LYS 90 HZ3 LYS 90 72.814 -4.145 -14.080 668 H VAL 91 HN VAL 91 73.255 2.171 -14.546 669 HA VAL 91 HA VAL 91 71.815 4.762 -14.323 670 HB VAL 91 HB VAL 91 74.784 4.173 -14.359 671 HG11 VAL 91 HG11 VAL 91 73.287 6.734 -14.952 672 HG12 VAL 91 HG12 VAL 91 74.589 5.990 -15.880 673 HG13 VAL 91 HG13 VAL 91 74.937 6.749 -14.326 674 HG21 VAL 91 HG21 VAL 91 73.530 4.166 -12.183 675 HG22 VAL 91 HG22 VAL 91 73.052 5.832 -12.503 676 HG23 VAL 91 HG23 VAL 91 74.754 5.432 -12.277 677 H THR 92 HN THR 92 71.184 5.623 -16.176 678 HA THR 92 HA THR 92 72.033 4.352 -18.700 679 HB THR 92 HB THR 92 69.733 6.262 -18.193 680 HG1 THR 92 HG1 THR 92 69.785 3.432 -18.337 681 HG21 THR 92 HG21 THR 92 70.666 4.631 -20.545 682 HG22 THR 92 HG22 THR 92 70.091 6.297 -20.501 683 HG23 THR 92 HG23 THR 92 68.949 4.965 -20.337 684 H ALA 93 HN ALA 93 73.357 5.425 -20.068 685 HA ALA 93 HA ALA 93 74.569 7.862 -19.366 686 HB1 ALA 93 HB1 ALA 93 74.363 6.568 -22.098 687 HB2 ALA 93 HB2 ALA 93 75.633 6.285 -20.908 688 HB3 ALA 93 HB3 ALA 93 75.473 7.870 -21.665 689 H GLY 94 HN GLY 94 74.213 9.958 -19.929 690 HA2 GLY 94 HA2 GLY 94 72.480 10.881 -21.951 691 HA3 GLY 94 HA1 GLY 94 71.587 10.816 -20.434 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 56.973 -6.351 20.469 2 H2 MET 1 HT2 MET 1 57.081 -7.762 19.525 3 H3 MET 1 HT3 MET 1 58.201 -7.482 20.771 4 HA MET 1 HA MET 1 56.726 -7.996 22.434 5 HB2 MET 1 HB2 MET 1 54.564 -7.421 20.390 6 HB3 MET 1 HB1 MET 1 54.250 -8.020 22.018 7 HG2 MET 1 HG2 MET 1 55.430 -6.021 22.940 8 HG3 MET 1 HG1 MET 1 55.610 -5.405 21.296 9 HE1 MET 1 HE1 MET 1 52.966 -5.868 19.732 10 HE2 MET 1 HE2 MET 1 54.002 -4.453 19.894 11 HE3 MET 1 HE3 MET 1 52.265 -4.297 20.136 12 H ALA 2 HN ALA 2 57.026 -9.158 19.256 13 HA ALA 2 HA ALA 2 57.214 -11.851 20.002 14 HB1 ALA 2 HB1 ALA 2 54.502 -10.981 19.747 15 HB2 ALA 2 HB2 ALA 2 55.079 -12.622 20.013 16 HB3 ALA 2 HB3 ALA 2 54.833 -12.028 18.371 17 HA PRO 3 HA PRO 3 57.211 -11.389 15.230 18 HB2 PRO 3 HB2 PRO 3 56.987 -8.561 14.549 19 HB3 PRO 3 HB1 PRO 3 55.909 -9.892 14.093 20 HG2 PRO 3 HG2 PRO 3 55.244 -7.862 15.844 21 HG3 PRO 3 HG1 PRO 3 54.452 -9.448 15.785 22 HD2 PRO 3 HD2 PRO 3 56.500 -8.435 17.719 23 HD3 PRO 3 HD1 PRO 3 55.152 -9.560 17.987 24 H GLU 4 HN GLU 4 59.106 -11.253 14.040 25 HA GLU 4 HA GLU 4 61.372 -9.983 15.406 26 HB2 GLU 4 HB2 GLU 4 62.769 -11.371 14.010 27 HB3 GLU 4 HB1 GLU 4 61.483 -12.373 14.679 28 HG2 GLU 4 HG2 GLU 4 60.198 -11.885 12.504 29 HG3 GLU 4 HG1 GLU 4 61.731 -11.283 11.869 30 H VAL 5 HN VAL 5 63.031 -9.773 13.080 31 HA VAL 5 HA VAL 5 62.534 -7.113 12.335 32 HB VAL 5 HB VAL 5 64.730 -8.390 12.179 33 HG11 VAL 5 HG11 VAL 5 65.185 -9.745 10.294 34 HG12 VAL 5 HG12 VAL 5 63.697 -9.256 9.490 35 HG13 VAL 5 HG13 VAL 5 63.629 -10.301 10.906 36 HG21 VAL 5 HG21 VAL 5 64.762 -6.222 11.265 37 HG22 VAL 5 HG22 VAL 5 63.657 -6.656 9.961 38 HG23 VAL 5 HG23 VAL 5 65.326 -7.230 9.933 39 H THR 6 HN THR 6 61.177 -6.215 10.845 40 HA THR 6 HA THR 6 59.556 -8.062 9.229 41 HB THR 6 HB THR 6 58.304 -6.027 8.546 42 HG1 THR 6 HG1 THR 6 58.945 -4.103 9.154 43 HG21 THR 6 HG21 THR 6 57.724 -5.411 11.095 44 HG22 THR 6 HG22 THR 6 58.665 -6.869 11.397 45 HG23 THR 6 HG23 THR 6 57.229 -6.940 10.374 46 H ILE 7 HN ILE 7 59.803 -8.456 7.142 47 HA ILE 7 HA ILE 7 61.987 -7.096 5.705 48 HB ILE 7 HB ILE 7 60.456 -9.549 4.889 49 HG12 ILE 7 HG12 ILE 7 61.407 -9.976 7.088 50 HG13 ILE 7 HG11 ILE 7 62.359 -10.829 5.880 51 HG21 ILE 7 HG21 ILE 7 63.106 -8.334 4.084 52 HG22 ILE 7 HG22 ILE 7 61.696 -8.619 3.066 53 HG23 ILE 7 HG23 ILE 7 62.640 -9.983 3.667 54 HD11 ILE 7 HD11 ILE 7 63.872 -8.718 5.879 55 HD12 ILE 7 HD12 ILE 7 63.982 -9.811 7.251 56 HD13 ILE 7 HD13 ILE 7 63.059 -8.315 7.387 57 H LEU 8 HN LEU 8 60.470 -5.229 5.502 58 HA LEU 8 HA LEU 8 58.624 -5.543 3.199 59 HB2 LEU 8 HB2 LEU 8 58.672 -3.383 5.327 60 HB3 LEU 8 HB1 LEU 8 57.507 -3.520 4.011 61 HG LEU 8 HG LEU 8 57.935 -5.622 6.157 62 HD11 LEU 8 HD11 LEU 8 55.539 -3.804 5.855 63 HD12 LEU 8 HD12 LEU 8 56.914 -3.371 6.873 64 HD13 LEU 8 HD13 LEU 8 55.977 -4.819 7.230 65 HD21 LEU 8 HD21 LEU 8 55.579 -6.290 5.182 66 HD22 LEU 8 HD22 LEU 8 57.034 -6.774 4.316 67 HD23 LEU 8 HD23 LEU 8 56.106 -5.378 3.767 68 H GLU 9 HN GLU 9 60.475 -5.485 1.833 69 HA GLU 9 HA GLU 9 61.757 -2.819 1.568 70 HB2 GLU 9 HB2 GLU 9 63.176 -4.835 2.188 71 HB3 GLU 9 HB1 GLU 9 62.846 -5.443 0.565 72 HG2 GLU 9 HG2 GLU 9 63.732 -3.284 -0.357 73 HG3 GLU 9 HG1 GLU 9 64.191 -2.823 1.280 74 HA PRO 10 HA PRO 10 59.428 -3.419 -2.365 75 HB2 PRO 10 HB2 PRO 10 58.934 -0.561 -2.435 76 HB3 PRO 10 HB1 PRO 10 57.758 -1.861 -2.190 77 HG2 PRO 10 HG2 PRO 10 58.560 -0.012 -0.260 78 HG3 PRO 10 HG1 PRO 10 57.718 -1.538 0.052 79 HD2 PRO 10 HD2 PRO 10 60.601 -0.874 0.425 80 HD3 PRO 10 HD1 PRO 10 59.594 -2.069 1.271 81 H LEU 11 HN LEU 11 62.157 -1.895 -1.291 82 HA LEU 11 HA LEU 11 63.036 -0.370 -3.494 83 HB2 LEU 11 HB2 LEU 11 63.922 -0.670 -0.993 84 HB3 LEU 11 HB1 LEU 11 64.980 -1.852 -1.744 85 HG LEU 11 HG LEU 11 66.117 0.283 -1.690 86 HD11 LEU 11 HD11 LEU 11 66.813 0.383 -3.928 87 HD12 LEU 11 HD12 LEU 11 65.202 0.022 -4.548 88 HD13 LEU 11 HD13 LEU 11 66.162 -1.248 -3.789 89 HD21 LEU 11 HD21 LEU 11 65.164 2.311 -2.190 90 HD22 LEU 11 HD22 LEU 11 63.663 1.467 -1.843 91 HD23 LEU 11 HD23 LEU 11 64.195 1.664 -3.512 92 H GLN 12 HN GLN 12 62.647 -1.536 -5.414 93 HA GLN 12 HA GLN 12 64.080 -4.087 -5.787 94 HB2 GLN 12 HB2 GLN 12 62.031 -2.649 -7.497 95 HB3 GLN 12 HB1 GLN 12 62.817 -4.167 -7.941 96 HG2 GLN 12 HG2 GLN 12 61.911 -5.259 -5.952 97 HG3 GLN 12 HG1 GLN 12 61.177 -3.744 -5.429 98 HE21 GLN 12 HE21 GLN 12 59.195 -5.398 -5.623 99 HE22 GLN 12 HE22 GLN 12 58.390 -5.372 -7.117 100 H ASP 13 HN ASP 13 63.725 -2.844 -8.777 101 HA ASP 13 HA ASP 13 66.489 -1.777 -8.825 102 HB2 ASP 13 HB2 ASP 13 66.471 -2.440 -11.207 103 HB3 ASP 13 HB1 ASP 13 66.192 -3.812 -10.134 104 H VAL 14 HN VAL 14 66.895 0.199 -9.652 105 HA VAL 14 HA VAL 14 64.691 1.690 -10.963 106 HB VAL 14 HB VAL 14 65.420 3.728 -9.761 107 HG11 VAL 14 HG11 VAL 14 64.338 3.219 -7.688 108 HG12 VAL 14 HG12 VAL 14 64.802 1.521 -7.785 109 HG13 VAL 14 HG13 VAL 14 63.597 2.172 -8.899 110 HG21 VAL 14 HG21 VAL 14 67.177 1.780 -8.230 111 HG22 VAL 14 HG22 VAL 14 66.916 3.468 -7.792 112 HG23 VAL 14 HG23 VAL 14 67.741 3.067 -9.298 113 H GLN 15 HN GLN 15 65.445 3.396 -12.375 114 HA GLN 15 HA GLN 15 68.228 2.986 -13.336 115 HB2 GLN 15 HB2 GLN 15 65.697 3.503 -14.907 116 HB3 GLN 15 HB1 GLN 15 67.321 3.564 -15.598 117 HG2 GLN 15 HG2 GLN 15 67.699 1.224 -14.911 118 HG3 GLN 15 HG1 GLN 15 66.078 1.162 -14.222 119 HE21 GLN 15 HE21 GLN 15 66.125 -0.723 -15.992 120 HE22 GLN 15 HE22 GLN 15 65.554 -0.276 -17.527 121 H LEU 16 HN LEU 16 69.462 4.740 -13.600 122 HA LEU 16 HA LEU 16 68.263 7.407 -13.776 123 HB2 LEU 16 HB2 LEU 16 69.610 8.284 -11.926 124 HB3 LEU 16 HB1 LEU 16 68.497 7.042 -11.370 125 HG LEU 16 HG LEU 16 70.707 5.501 -11.948 126 HD11 LEU 16 HD11 LEU 16 71.872 7.986 -10.676 127 HD12 LEU 16 HD12 LEU 16 71.955 7.715 -12.414 128 HD13 LEU 16 HD13 LEU 16 72.725 6.580 -11.312 129 HD21 LEU 16 HD21 LEU 16 69.851 6.897 -9.408 130 HD22 LEU 16 HD22 LEU 16 71.226 5.793 -9.413 131 HD23 LEU 16 HD23 LEU 16 69.626 5.209 -9.865 132 H SER 17 HN SER 17 69.426 8.765 -15.017 133 HA SER 17 HA SER 17 71.702 7.727 -16.440 134 HB2 SER 17 HB2 SER 17 71.501 9.613 -17.812 135 HB3 SER 17 HB1 SER 17 69.844 9.351 -17.273 136 HG SER 17 HG SER 17 70.033 11.358 -16.642 137 H GLU 18 HN GLU 18 73.790 8.809 -16.565 138 HA GLU 18 HA GLU 18 74.906 9.319 -14.004 139 HB2 GLU 18 HB2 GLU 18 76.175 8.398 -15.959 140 HB3 GLU 18 HB1 GLU 18 76.103 9.993 -16.704 141 HG2 GLU 18 HG2 GLU 18 77.222 9.587 -13.926 142 HG3 GLU 18 HG1 GLU 18 78.226 9.420 -15.362 143 H GLY 19 HN GLY 19 75.500 11.208 -13.012 144 HA2 GLY 19 HA2 GLY 19 75.820 13.538 -12.805 145 HA3 GLY 19 HA1 GLY 19 74.998 13.777 -14.344 146 H GLN 20 HN GLN 20 73.073 11.635 -12.892 147 HA GLN 20 HA GLN 20 71.290 13.723 -11.814 148 HB2 GLN 20 HB2 GLN 20 70.756 10.851 -12.620 149 HB3 GLN 20 HB1 GLN 20 69.550 11.940 -11.940 150 HG2 GLN 20 HG2 GLN 20 69.922 13.511 -13.816 151 HG3 GLN 20 HG1 GLN 20 71.096 12.394 -14.506 152 HE21 GLN 20 HE21 GLN 20 68.141 13.354 -15.218 153 HE22 GLN 20 HE22 GLN 20 67.395 11.893 -15.652 154 H ASP 21 HN ASP 21 70.167 13.331 -9.805 155 HA ASP 21 HA ASP 21 71.932 12.270 -7.787 156 HB2 ASP 21 HB2 ASP 21 70.212 13.058 -6.211 157 HB3 ASP 21 HB1 ASP 21 70.640 14.309 -7.376 158 H ALA 22 HN ALA 22 71.178 10.766 -6.102 159 HA ALA 22 HA ALA 22 69.099 8.856 -6.900 160 HB1 ALA 22 HB1 ALA 22 71.928 7.966 -6.289 161 HB2 ALA 22 HB2 ALA 22 71.251 8.063 -7.917 162 HB3 ALA 22 HB3 ALA 22 70.566 6.941 -6.743 163 H SER 23 HN SER 23 68.337 7.581 -5.192 164 HA SER 23 HA SER 23 69.482 7.781 -2.542 165 HB2 SER 23 HB2 SER 23 67.389 8.794 -1.575 166 HB3 SER 23 HB1 SER 23 68.353 9.903 -2.548 167 HG SER 23 HG SER 23 65.848 9.385 -2.866 168 H PHE 24 HN PHE 24 68.304 6.431 -0.980 169 HA PHE 24 HA PHE 24 66.406 4.511 -2.213 170 HB2 PHE 24 HB2 PHE 24 68.766 3.830 -0.440 171 HB3 PHE 24 HB1 PHE 24 67.490 2.705 -0.883 172 HD1 PHE 24 HD1 PHE 24 70.726 3.730 -1.712 173 HD2 PHE 24 HD2 PHE 24 66.991 2.681 -3.555 174 HE1 PHE 24 HE1 PHE 24 71.922 3.125 -3.797 175 HE2 PHE 24 HE2 PHE 24 68.186 2.081 -5.637 176 HZ PHE 24 HZ PHE 24 70.650 2.290 -5.757 177 H GLN 25 HN GLN 25 64.949 3.522 -0.771 178 HA GLN 25 HA GLN 25 64.855 4.500 2.003 179 HB2 GLN 25 HB2 GLN 25 63.469 6.071 0.666 180 HB3 GLN 25 HB1 GLN 25 62.515 4.708 0.083 181 HG2 GLN 25 HG2 GLN 25 61.888 4.162 2.424 182 HG3 GLN 25 HG1 GLN 25 62.811 5.557 2.982 183 HE21 GLN 25 HE21 GLN 25 61.497 7.340 3.349 184 HE22 GLN 25 HE22 GLN 25 60.082 7.703 2.485 185 H CYS 26 HN CYS 26 64.384 2.848 3.348 186 HA CYS 26 HA CYS 26 62.925 0.498 2.265 187 HB2 CYS 26 HB2 CYS 26 65.316 0.366 4.113 188 HB3 CYS 26 HB1 CYS 26 64.438 -0.995 3.415 189 HG CYS 26 HG CYS 26 66.544 -0.509 1.913 190 H ARG 27 HN ARG 27 61.827 -0.780 3.797 191 HA ARG 27 HA ARG 27 61.238 0.557 6.386 192 HB2 ARG 27 HB2 ARG 27 59.387 -0.882 4.471 193 HB3 ARG 27 HB1 ARG 27 58.957 -0.514 6.140 194 HG2 ARG 27 HG2 ARG 27 59.278 1.871 5.736 195 HG3 ARG 27 HG1 ARG 27 59.808 1.548 4.086 196 HD2 ARG 27 HD2 ARG 27 57.602 0.576 3.576 197 HD3 ARG 27 HD1 ARG 27 57.079 0.888 5.226 198 HE ARG 27 HE ARG 27 57.953 3.325 4.171 199 HH11 ARG 27 HH11 ARG 27 56.150 4.776 3.993 200 HH12 ARG 27 HH12 ARG 27 54.729 4.222 3.168 201 HH21 ARG 27 HH21 ARG 27 55.835 0.943 2.922 202 HH22 ARG 27 HH22 ARG 27 54.553 2.050 2.560 203 H LEU 28 HN LEU 28 62.649 -0.717 7.606 204 HA LEU 28 HA LEU 28 61.963 -3.607 7.752 205 HB2 LEU 28 HB2 LEU 28 64.684 -2.309 8.030 206 HB3 LEU 28 HB1 LEU 28 64.344 -4.006 8.347 207 HG LEU 28 HG LEU 28 63.806 -2.653 5.686 208 HD11 LEU 28 HD11 LEU 28 66.141 -4.425 6.480 209 HD12 LEU 28 HD12 LEU 28 66.232 -2.671 6.292 210 HD13 LEU 28 HD13 LEU 28 65.870 -3.690 4.899 211 HD21 LEU 28 HD21 LEU 28 62.485 -4.609 5.757 212 HD22 LEU 28 HD22 LEU 28 63.675 -5.497 6.706 213 HD23 LEU 28 HD23 LEU 28 63.968 -5.178 4.999 214 H SER 29 HN SER 29 60.917 -3.914 9.623 215 HA SER 29 HA SER 29 61.106 -2.180 11.852 216 HB2 SER 29 HB2 SER 29 59.159 -3.626 11.567 217 HB3 SER 29 HB1 SER 29 60.168 -5.059 11.761 218 HG SER 29 HG SER 29 60.136 -3.017 13.704 219 H ARG 30 HN ARG 30 61.974 -2.682 13.948 220 HA ARG 30 HA ARG 30 64.692 -3.191 13.925 221 HB2 ARG 30 HB2 ARG 30 64.538 -3.218 16.339 222 HB3 ARG 30 HB1 ARG 30 63.460 -1.987 15.684 223 HG2 ARG 30 HG2 ARG 30 61.562 -3.587 15.867 224 HG3 ARG 30 HG1 ARG 30 62.648 -4.761 16.610 225 HD2 ARG 30 HD2 ARG 30 63.135 -3.154 18.424 226 HD3 ARG 30 HD1 ARG 30 62.014 -2.006 17.696 227 HE ARG 30 HE ARG 30 60.212 -3.350 18.408 228 HH11 ARG 30 HH11 ARG 30 62.745 -3.859 20.404 229 HH12 ARG 30 HH12 ARG 30 62.359 -5.482 20.870 230 HH21 ARG 30 HH21 ARG 30 59.929 -5.886 18.423 231 HH22 ARG 30 HH22 ARG 30 60.759 -6.630 19.750 232 H ALA 31 HN ALA 31 65.948 -4.826 14.935 233 HA ALA 31 HA ALA 31 65.070 -7.496 14.220 234 HB1 ALA 31 HB1 ALA 31 67.262 -7.081 13.514 235 HB2 ALA 31 HB2 ALA 31 67.496 -8.020 14.988 236 HB3 ALA 31 HB3 ALA 31 67.690 -6.266 15.018 237 H SER 32 HN SER 32 66.106 -9.232 15.767 238 HA SER 32 HA SER 32 65.731 -8.691 18.588 239 HB2 SER 32 HB2 SER 32 63.401 -9.005 17.965 240 HB3 SER 32 HB1 SER 32 63.797 -10.476 17.082 241 HG SER 32 HG SER 32 62.986 -10.737 19.298 242 H GLY 33 HN GLY 33 65.842 -11.199 16.085 243 HA2 GLY 33 HA2 GLY 33 67.420 -12.977 17.775 244 HA3 GLY 33 HA1 GLY 33 66.853 -13.305 16.138 245 H GLN 34 HN GLN 34 67.894 -12.052 14.373 246 HA GLN 34 HA GLN 34 70.722 -11.417 14.991 247 HB2 GLN 34 HB2 GLN 34 69.581 -12.913 12.627 248 HB3 GLN 34 HB1 GLN 34 71.223 -12.271 12.670 249 HG2 GLN 34 HG2 GLN 34 71.750 -13.617 14.629 250 HG3 GLN 34 HG1 GLN 34 70.082 -14.186 14.725 251 HE21 GLN 34 HE21 GLN 34 72.575 -15.808 14.285 252 HE22 GLN 34 HE22 GLN 34 72.328 -16.618 12.815 253 H GLU 35 HN GLU 35 71.632 -9.682 14.011 254 HA GLU 35 HA GLU 35 69.847 -7.635 13.077 255 HB2 GLU 35 HB2 GLU 35 71.884 -7.212 14.465 256 HB3 GLU 35 HB1 GLU 35 72.872 -7.657 13.073 257 HG2 GLU 35 HG2 GLU 35 71.868 -5.850 11.753 258 HG3 GLU 35 HG1 GLU 35 70.826 -5.422 13.109 259 H ALA 36 HN ALA 36 69.659 -6.763 11.027 260 HA ALA 36 HA ALA 36 70.297 -8.538 8.823 261 HB1 ALA 36 HB1 ALA 36 69.020 -6.958 7.473 262 HB2 ALA 36 HB2 ALA 36 68.995 -5.808 8.809 263 HB3 ALA 36 HB3 ALA 36 68.133 -7.339 8.950 264 H ARG 37 HN ARG 37 71.179 -7.491 6.746 265 HA ARG 37 HA ARG 37 73.357 -5.574 7.369 266 HB2 ARG 37 HB2 ARG 37 73.599 -8.152 5.806 267 HB3 ARG 37 HB1 ARG 37 74.845 -6.903 5.879 268 HG2 ARG 37 HG2 ARG 37 74.964 -7.140 8.323 269 HG3 ARG 37 HG1 ARG 37 73.695 -8.364 8.275 270 HD2 ARG 37 HD2 ARG 37 76.320 -8.624 6.790 271 HD3 ARG 37 HD1 ARG 37 76.042 -9.294 8.396 272 HE ARG 37 HE ARG 37 73.980 -10.184 6.695 273 HH11 ARG 37 HH11 ARG 37 75.020 -11.309 4.645 274 HH12 ARG 37 HH12 ARG 37 76.146 -12.547 5.090 275 HH21 ARG 37 HH21 ARG 37 76.473 -11.449 8.362 276 HH22 ARG 37 HH22 ARG 37 76.969 -12.626 7.193 277 H TRP 38 HN TRP 38 73.740 -4.054 5.934 278 HA TRP 38 HA TRP 38 72.275 -4.046 3.346 279 HB2 TRP 38 HB2 TRP 38 71.452 -2.387 5.019 280 HB3 TRP 38 HB1 TRP 38 73.070 -1.710 5.117 281 HD1 TRP 38 HD1 TRP 38 73.731 0.040 3.381 282 HE1 TRP 38 HE1 TRP 38 72.587 1.083 1.323 283 HE3 TRP 38 HE3 TRP 38 69.697 -3.055 2.957 284 HZ2 TRP 38 HZ2 TRP 38 70.263 0.661 -0.297 285 HZ3 TRP 38 HZ3 TRP 38 68.037 -2.714 1.149 286 HH2 TRP 38 HH2 TRP 38 68.314 -0.864 -0.476 287 H ALA 39 HN ALA 39 73.581 -3.639 1.499 288 HA ALA 39 HA ALA 39 76.179 -2.442 1.738 289 HB1 ALA 39 HB1 ALA 39 77.483 -4.474 1.164 290 HB2 ALA 39 HB2 ALA 39 76.026 -5.435 1.404 291 HB3 ALA 39 HB3 ALA 39 76.739 -4.563 2.759 292 H LEU 40 HN LEU 40 77.456 -2.581 -0.265 293 HA LEU 40 HA LEU 40 75.899 -3.207 -2.695 294 HB2 LEU 40 HB2 LEU 40 75.732 -0.740 -2.150 295 HB3 LEU 40 HB1 LEU 40 77.479 -0.643 -2.347 296 HG LEU 40 HG LEU 40 75.673 -1.766 -4.508 297 HD11 LEU 40 HD11 LEU 40 75.834 0.491 -5.576 298 HD12 LEU 40 HD12 LEU 40 76.563 1.101 -4.092 299 HD13 LEU 40 HD13 LEU 40 74.906 0.500 -4.076 300 HD21 LEU 40 HD21 LEU 40 78.575 -1.015 -4.292 301 HD22 LEU 40 HD22 LEU 40 77.772 -0.705 -5.828 302 HD23 LEU 40 HD23 LEU 40 77.815 -2.336 -5.178 303 H GLY 41 HN GLY 41 77.087 -4.505 -3.955 304 HA2 GLY 41 HA2 GLY 41 78.928 -5.302 -5.119 305 HA3 GLY 41 HA1 GLY 41 79.895 -4.012 -4.410 306 H GLY 42 HN GLY 42 78.094 -5.800 -2.138 307 HA2 GLY 42 HA2 GLY 42 78.615 -7.621 -0.771 308 HA3 GLY 42 HA1 GLY 42 80.106 -7.848 -1.674 309 H VAL 43 HN VAL 43 79.871 -4.624 -0.877 310 HA VAL 43 HA VAL 43 81.591 -4.988 1.509 311 HB VAL 43 HB VAL 43 81.507 -2.591 -0.325 312 HG11 VAL 43 HG11 VAL 43 82.422 -2.266 1.966 313 HG12 VAL 43 HG12 VAL 43 83.661 -2.084 0.727 314 HG13 VAL 43 HG13 VAL 43 83.572 -3.570 1.672 315 HG21 VAL 43 HG21 VAL 43 82.186 -4.624 -1.576 316 HG22 VAL 43 HG22 VAL 43 83.417 -4.951 -0.357 317 HG23 VAL 43 HG23 VAL 43 83.538 -3.509 -1.366 318 HA PRO 44 HA PRO 44 78.189 -2.974 3.681 319 HB2 PRO 44 HB2 PRO 44 79.928 -2.008 5.797 320 HB3 PRO 44 HB1 PRO 44 78.771 -3.343 5.857 321 HG2 PRO 44 HG2 PRO 44 81.631 -3.483 5.755 322 HG3 PRO 44 HG1 PRO 44 80.473 -4.815 5.852 323 HD2 PRO 44 HD2 PRO 44 82.081 -4.066 3.590 324 HD3 PRO 44 HD1 PRO 44 80.861 -5.353 3.673 325 H LEU 45 HN LEU 45 77.416 -0.844 3.789 326 HA LEU 45 HA LEU 45 78.968 1.115 2.349 327 HB2 LEU 45 HB2 LEU 45 76.346 1.592 3.768 328 HB3 LEU 45 HB1 LEU 45 77.021 2.486 2.406 329 HG LEU 45 HG LEU 45 75.840 -0.287 2.437 330 HD11 LEU 45 HD11 LEU 45 74.453 1.772 1.992 331 HD12 LEU 45 HD12 LEU 45 74.429 0.572 0.699 332 HD13 LEU 45 HD13 LEU 45 75.417 2.024 0.538 333 HD21 LEU 45 HD21 LEU 45 77.866 -0.646 1.204 334 HD22 LEU 45 HD22 LEU 45 77.719 0.910 0.383 335 HD23 LEU 45 HD23 LEU 45 76.602 -0.401 0.000 336 H GLN 46 HN GLN 46 79.641 3.149 3.094 337 HA GLN 46 HA GLN 46 79.873 3.443 6.039 338 HB2 GLN 46 HB2 GLN 46 82.155 4.324 5.680 339 HB3 GLN 46 HB1 GLN 46 82.011 2.648 5.148 340 HG2 GLN 46 HG2 GLN 46 81.595 3.496 2.818 341 HG3 GLN 46 HG1 GLN 46 81.956 5.121 3.399 342 HE21 GLN 46 HE21 GLN 46 83.946 5.380 2.211 343 HE22 GLN 46 HE22 GLN 46 85.322 4.442 2.539 344 H ALA 47 HN ALA 47 80.035 5.604 6.793 345 HA ALA 47 HA ALA 47 78.383 7.444 5.392 346 HB1 ALA 47 HB1 ALA 47 78.597 7.281 7.884 347 HB2 ALA 47 HB2 ALA 47 78.756 8.919 7.251 348 HB3 ALA 47 HB3 ALA 47 80.193 8.023 7.742 349 H ASN 48 HN ASN 48 79.540 7.616 3.362 350 HA ASN 48 HA ASN 48 82.125 8.901 3.286 351 HB2 ASN 48 HB2 ASN 48 81.149 7.301 1.525 352 HB3 ASN 48 HB1 ASN 48 80.189 8.674 0.984 353 HD21 ASN 48 HD21 ASN 48 81.354 8.823 -1.061 354 HD22 ASN 48 HD22 ASN 48 82.956 9.381 -1.124 355 H GLU 49 HN GLU 49 82.349 10.967 1.942 356 HA GLU 49 HA GLU 49 80.906 13.040 3.235 357 HB2 GLU 49 HB2 GLU 49 82.120 14.551 1.724 358 HB3 GLU 49 HB1 GLU 49 83.202 13.351 2.430 359 HG2 GLU 49 HG2 GLU 49 82.932 11.966 0.366 360 HG3 GLU 49 HG1 GLU 49 81.978 13.268 -0.340 361 H MET 50 HN MET 50 80.587 11.515 0.055 362 HA MET 50 HA MET 50 78.493 13.378 -0.754 363 HB2 MET 50 HB2 MET 50 78.507 12.210 -2.853 364 HB3 MET 50 HB1 MET 50 80.182 12.448 -2.360 365 HG2 MET 50 HG2 MET 50 80.156 10.128 -1.387 366 HG3 MET 50 HG1 MET 50 78.554 9.901 -2.090 367 HE1 MET 50 HE1 MET 50 80.346 7.970 -2.494 368 HE2 MET 50 HE2 MET 50 81.080 7.765 -4.082 369 HE3 MET 50 HE3 MET 50 79.325 7.787 -3.928 370 H ASN 51 HN ASN 51 78.745 10.304 0.792 371 HA ASN 51 HA ASN 51 75.888 9.697 0.312 372 HB2 ASN 51 HB2 ASN 51 77.631 7.925 -0.111 373 HB3 ASN 51 HB1 ASN 51 77.986 7.950 1.615 374 HD21 ASN 51 HD21 ASN 51 77.113 5.535 0.813 375 HD22 ASN 51 HD22 ASN 51 75.480 5.283 1.205 376 H ASP 52 HN ASP 52 74.447 9.421 2.024 377 HA ASP 52 HA ASP 52 75.418 10.023 4.749 378 HB2 ASP 52 HB2 ASP 52 73.201 11.464 3.282 379 HB3 ASP 52 HB1 ASP 52 73.382 11.498 5.036 380 H ILE 53 HN ILE 53 74.830 8.341 5.931 381 HA ILE 53 HA ILE 53 72.286 6.946 5.308 382 HB ILE 53 HB ILE 53 74.671 5.963 6.905 383 HG12 ILE 53 HG12 ILE 53 73.805 5.394 4.059 384 HG13 ILE 53 HG11 ILE 53 75.229 6.317 4.533 385 HG21 ILE 53 HG21 ILE 53 72.355 4.959 7.366 386 HG22 ILE 53 HG22 ILE 53 73.600 3.823 6.853 387 HG23 ILE 53 HG23 ILE 53 72.387 4.379 5.701 388 HD11 ILE 53 HD11 ILE 53 75.952 4.072 4.032 389 HD12 ILE 53 HD12 ILE 53 74.688 3.388 5.057 390 HD13 ILE 53 HD13 ILE 53 76.026 4.279 5.781 391 H THR 54 HN THR 54 70.653 7.188 6.684 392 HA THR 54 HA THR 54 71.201 7.712 9.526 393 HB THR 54 HB THR 54 70.968 9.928 8.413 394 HG1 THR 54 HG1 THR 54 68.998 9.004 10.207 395 HG21 THR 54 HG21 THR 54 69.381 9.037 6.642 396 HG22 THR 54 HG22 THR 54 68.908 10.571 7.376 397 HG23 THR 54 HG23 THR 54 68.118 9.073 7.873 398 H VAL 55 HN VAL 55 69.461 7.250 10.909 399 HA VAL 55 HA VAL 55 67.459 5.405 9.748 400 HB VAL 55 HB VAL 55 68.981 4.503 11.499 401 HG11 VAL 55 HG11 VAL 55 68.948 5.347 13.728 402 HG12 VAL 55 HG12 VAL 55 67.551 6.371 13.399 403 HG13 VAL 55 HG13 VAL 55 69.119 6.764 12.694 404 HG21 VAL 55 HG21 VAL 55 66.114 4.794 12.447 405 HG22 VAL 55 HG22 VAL 55 67.226 3.483 12.839 406 HG23 VAL 55 HG23 VAL 55 66.632 3.674 11.189 407 H GLU 56 HN GLU 56 65.362 5.932 9.787 408 HA GLU 56 HA GLU 56 64.558 8.380 11.264 409 HB2 GLU 56 HB2 GLU 56 63.418 7.120 8.757 410 HB3 GLU 56 HB1 GLU 56 62.759 8.542 9.568 411 HG2 GLU 56 HG2 GLU 56 64.868 9.744 9.241 412 HG3 GLU 56 HG1 GLU 56 65.584 8.318 8.494 413 H GLN 57 HN GLN 57 61.992 8.288 11.494 414 HA GLN 57 HA GLN 57 61.461 6.360 13.486 415 HB2 GLN 57 HB2 GLN 57 59.600 8.156 11.919 416 HB3 GLN 57 HB1 GLN 57 59.115 7.206 13.325 417 HG2 GLN 57 HG2 GLN 57 60.800 8.356 14.700 418 HG3 GLN 57 HG1 GLN 57 61.316 9.291 13.300 419 HE21 GLN 57 HE21 GLN 57 59.275 9.390 15.987 420 HE22 GLN 57 HE22 GLN 57 58.226 10.615 15.460 421 H GLY 58 HN GLY 58 59.987 4.617 13.490 422 HA2 GLY 58 HA2 GLY 58 58.807 2.828 12.600 423 HA3 GLY 58 HA1 GLY 58 58.833 3.638 11.032 424 H THR 59 HN THR 59 61.888 3.567 12.399 425 HA THR 59 HA THR 59 63.796 2.374 12.003 426 HB THR 59 HB THR 59 62.177 0.004 11.111 427 HG1 THR 59 HG1 THR 59 62.540 0.769 13.807 428 HG21 THR 59 HG21 THR 59 64.663 -0.097 11.195 429 HG22 THR 59 HG22 THR 59 63.914 -1.215 12.332 430 HG23 THR 59 HG23 THR 59 64.600 0.305 12.910 431 H LEU 60 HN LEU 60 62.713 4.026 9.988 432 HA LEU 60 HA LEU 60 63.107 2.588 7.454 433 HB2 LEU 60 HB2 LEU 60 61.939 5.225 8.264 434 HB3 LEU 60 HB1 LEU 60 62.575 5.073 6.628 435 HG LEU 60 HG LEU 60 61.152 3.103 6.253 436 HD11 LEU 60 HD11 LEU 60 59.321 2.710 7.997 437 HD12 LEU 60 HD12 LEU 60 60.313 3.659 9.103 438 HD13 LEU 60 HD13 LEU 60 60.937 2.153 8.428 439 HD21 LEU 60 HD21 LEU 60 59.792 5.617 7.252 440 HD22 LEU 60 HD22 LEU 60 58.920 4.325 6.428 441 HD23 LEU 60 HD23 LEU 60 60.197 5.202 5.587 442 H HIS 61 HN HIS 61 64.896 2.683 6.272 443 HA HIS 61 HA HIS 61 67.154 4.336 7.177 444 HB2 HIS 61 HB2 HIS 61 66.993 2.210 5.018 445 HB3 HIS 61 HB1 HIS 61 68.466 3.003 5.572 446 HD1 HIS 61 HD1 HIS 61 66.159 0.240 6.363 447 HD2 HIS 61 HD2 HIS 61 69.135 2.368 8.363 448 HE1 HIS 61 HE1 HIS 61 66.756 -1.119 8.415 449 H LEU 62 HN LEU 62 68.344 5.657 5.568 450 HA LEU 62 HA LEU 62 66.980 6.263 3.077 451 HB2 LEU 62 HB2 LEU 62 65.659 7.613 4.610 452 HB3 LEU 62 HB1 LEU 62 67.118 8.329 5.288 453 HG LEU 62 HG LEU 62 67.641 9.384 3.139 454 HD11 LEU 62 HD11 LEU 62 65.295 7.735 2.202 455 HD12 LEU 62 HD12 LEU 62 66.882 7.935 1.455 456 HD13 LEU 62 HD13 LEU 62 65.701 9.239 1.374 457 HD21 LEU 62 HD21 LEU 62 65.685 10.913 3.000 458 HD22 LEU 62 HD22 LEU 62 66.166 10.605 4.667 459 HD23 LEU 62 HD23 LEU 62 64.756 9.787 3.989 460 H LEU 63 HN LEU 63 68.605 6.222 1.729 461 HA LEU 63 HA LEU 63 71.225 7.344 2.451 462 HB2 LEU 63 HB2 LEU 63 70.220 5.453 0.335 463 HB3 LEU 63 HB1 LEU 63 71.755 6.289 0.108 464 HG LEU 63 HG LEU 63 72.695 5.302 2.056 465 HD11 LEU 63 HD11 LEU 63 69.854 4.478 2.680 466 HD12 LEU 63 HD12 LEU 63 70.957 5.425 3.680 467 HD13 LEU 63 HD13 LEU 63 71.235 3.701 3.451 468 HD21 LEU 63 HD21 LEU 63 72.570 3.822 0.090 469 HD22 LEU 63 HD22 LEU 63 71.007 3.219 0.645 470 HD23 LEU 63 HD23 LEU 63 72.462 2.895 1.586 471 H THR 64 HN THR 64 71.538 9.415 1.961 472 HA THR 64 HA THR 64 70.179 10.548 -0.422 473 HB THR 64 HB THR 64 71.332 12.001 1.977 474 HG1 THR 64 HG1 THR 64 69.512 10.957 2.627 475 HG21 THR 64 HG21 THR 64 71.345 13.329 -0.087 476 HG22 THR 64 HG22 THR 64 70.102 13.924 1.011 477 HG23 THR 64 HG23 THR 64 69.653 12.926 -0.370 478 H LEU 65 HN LEU 65 71.649 9.999 -1.969 479 HA LEU 65 HA LEU 65 74.443 10.947 -1.632 480 HB2 LEU 65 HB2 LEU 65 73.873 8.495 -2.230 481 HB3 LEU 65 HB1 LEU 65 73.431 9.120 -3.814 482 HG LEU 65 HG LEU 65 76.124 9.633 -2.514 483 HD11 LEU 65 HD11 LEU 65 75.816 7.226 -2.842 484 HD12 LEU 65 HD12 LEU 65 76.982 7.858 -4.005 485 HD13 LEU 65 HD13 LEU 65 75.334 7.500 -4.516 486 HD21 LEU 65 HD21 LEU 65 76.660 9.923 -5.072 487 HD22 LEU 65 HD22 LEU 65 75.867 11.235 -4.211 488 HD23 LEU 65 HD23 LEU 65 74.919 10.156 -5.233 489 H HIS 66 HN HIS 66 74.927 12.804 -2.618 490 HA HIS 66 HA HIS 66 73.060 14.009 -4.458 491 HB2 HIS 66 HB2 HIS 66 74.260 15.326 -2.746 492 HB3 HIS 66 HB1 HIS 66 75.780 14.990 -3.576 493 HD1 HIS 66 HD1 HIS 66 72.332 16.258 -4.640 494 HD2 HIS 66 HD2 HIS 66 76.370 17.056 -5.311 495 HE1 HIS 66 HE1 HIS 66 72.419 18.206 -6.255 496 H LYS 67 HN LYS 67 76.541 14.162 -4.958 497 HA LYS 67 HA LYS 67 76.213 13.883 -7.786 498 HB2 LYS 67 HB2 LYS 67 77.996 15.204 -6.284 499 HB3 LYS 67 HB1 LYS 67 78.911 13.715 -6.484 500 HG2 LYS 67 HG2 LYS 67 77.750 15.338 -8.771 501 HG3 LYS 67 HG1 LYS 67 79.423 15.425 -8.231 502 HD2 LYS 67 HD2 LYS 67 79.659 12.982 -8.701 503 HD3 LYS 67 HD1 LYS 67 78.019 12.985 -9.350 504 HE2 LYS 67 HE2 LYS 67 78.629 14.565 -11.073 505 HE3 LYS 67 HE1 LYS 67 80.230 14.785 -10.369 506 HZ1 LYS 67 HZ1 LYS 67 79.752 13.100 -12.342 507 HZ2 LYS 67 HZ2 LYS 67 79.455 12.058 -11.031 508 HZ3 LYS 67 HZ3 LYS 67 80.961 12.830 -11.183 509 H VAL 68 HN VAL 68 75.716 11.936 -8.566 510 HA VAL 68 HA VAL 68 76.858 9.501 -7.417 511 HB VAL 68 HB VAL 68 74.407 9.797 -8.232 512 HG11 VAL 68 HG11 VAL 68 75.649 9.044 -10.887 513 HG12 VAL 68 HG12 VAL 68 75.202 10.708 -10.495 514 HG13 VAL 68 HG13 VAL 68 73.965 9.452 -10.550 515 HG21 VAL 68 HG21 VAL 68 74.371 7.413 -9.023 516 HG22 VAL 68 HG22 VAL 68 75.291 7.644 -7.536 517 HG23 VAL 68 HG23 VAL 68 76.135 7.449 -9.073 518 H THR 69 HN THR 69 78.007 7.959 -8.704 519 HA THR 69 HA THR 69 79.343 9.073 -11.108 520 HB THR 69 HB THR 69 81.461 8.137 -10.332 521 HG1 THR 69 HG1 THR 69 80.872 7.650 -7.792 522 HG21 THR 69 HG21 THR 69 81.752 9.564 -8.253 523 HG22 THR 69 HG22 THR 69 80.025 9.910 -8.344 524 HG23 THR 69 HG23 THR 69 81.097 10.405 -9.656 525 H LEU 70 HN LEU 70 80.160 7.449 -12.572 526 HA LEU 70 HA LEU 70 78.388 5.314 -13.035 527 HB2 LEU 70 HB2 LEU 70 81.218 5.770 -14.015 528 HB3 LEU 70 HB1 LEU 70 80.167 4.494 -14.620 529 HG LEU 70 HG LEU 70 79.446 7.439 -14.676 530 HD11 LEU 70 HD11 LEU 70 79.946 7.199 -17.151 531 HD12 LEU 70 HD12 LEU 70 80.719 5.659 -16.771 532 HD13 LEU 70 HD13 LEU 70 81.360 7.158 -16.099 533 HD21 LEU 70 HD21 LEU 70 78.162 4.902 -15.695 534 HD22 LEU 70 HD22 LEU 70 77.912 6.406 -16.578 535 HD23 LEU 70 HD23 LEU 70 77.417 6.285 -14.893 536 H GLU 71 HN GLU 71 81.310 5.584 -11.177 537 HA GLU 71 HA GLU 71 81.852 2.802 -10.861 538 HB2 GLU 71 HB2 GLU 71 83.529 4.575 -10.420 539 HB3 GLU 71 HB1 GLU 71 82.572 5.122 -9.046 540 HG2 GLU 71 HG2 GLU 71 84.323 3.706 -8.187 541 HG3 GLU 71 HG1 GLU 71 82.820 2.803 -8.059 542 H ASP 72 HN ASP 72 79.851 5.126 -9.149 543 HA ASP 72 HA ASP 72 79.289 3.583 -6.859 544 HB2 ASP 72 HB2 ASP 72 78.773 6.040 -7.213 545 HB3 ASP 72 HB1 ASP 72 77.383 5.526 -8.169 546 H ALA 73 HN ALA 73 77.947 3.541 -10.110 547 HA ALA 73 HA ALA 73 75.588 2.117 -9.660 548 HB1 ALA 73 HB1 ALA 73 77.483 1.849 -12.007 549 HB2 ALA 73 HB2 ALA 73 76.219 3.069 -11.851 550 HB3 ALA 73 HB3 ALA 73 75.787 1.364 -11.984 551 H GLY 74 HN GLY 74 75.106 -0.028 -9.365 552 HA2 GLY 74 HA2 GLY 74 76.734 -2.231 -9.837 553 HA3 GLY 74 HA1 GLY 74 77.094 -1.696 -8.200 554 H THR 75 HN THR 75 76.209 -3.979 -7.887 555 HA THR 75 HA THR 75 73.257 -4.063 -7.833 556 HB THR 75 HB THR 75 75.307 -6.245 -7.394 557 HG1 THR 75 HG1 THR 75 74.416 -6.901 -9.472 558 HG21 THR 75 HG21 THR 75 72.295 -6.178 -7.383 559 HG22 THR 75 HG22 THR 75 73.395 -6.987 -6.265 560 HG23 THR 75 HG23 THR 75 73.149 -7.637 -7.884 561 H VAL 76 HN VAL 76 72.248 -3.585 -5.981 562 HA VAL 76 HA VAL 76 73.726 -3.555 -3.458 563 HB VAL 76 HB VAL 76 70.792 -2.977 -3.866 564 HG11 VAL 76 HG11 VAL 76 72.792 -1.954 -1.837 565 HG12 VAL 76 HG12 VAL 76 71.669 -3.282 -1.546 566 HG13 VAL 76 HG13 VAL 76 71.053 -1.656 -1.847 567 HG21 VAL 76 HG21 VAL 76 71.421 -0.621 -4.172 568 HG22 VAL 76 HG22 VAL 76 72.154 -1.608 -5.437 569 HG23 VAL 76 HG23 VAL 76 73.128 -1.052 -4.077 570 H SER 77 HN SER 77 73.625 -5.144 -1.954 571 HA SER 77 HA SER 77 71.645 -7.327 -2.352 572 HB2 SER 77 HB2 SER 77 74.404 -7.527 -1.129 573 HB3 SER 77 HB1 SER 77 73.295 -8.854 -1.461 574 HG SER 77 HG SER 77 73.698 -8.679 -3.563 575 H PHE 78 HN PHE 78 70.705 -8.237 -0.561 576 HA PHE 78 HA PHE 78 71.155 -6.978 2.075 577 HB2 PHE 78 HB2 PHE 78 69.238 -5.826 1.083 578 HB3 PHE 78 HB1 PHE 78 68.471 -7.371 0.716 579 HD1 PHE 78 HD1 PHE 78 67.099 -8.429 2.316 580 HD2 PHE 78 HD2 PHE 78 69.791 -5.320 3.554 581 HE1 PHE 78 HE1 PHE 78 66.083 -8.451 4.579 582 HE2 PHE 78 HE2 PHE 78 68.776 -5.340 5.815 583 HZ PHE 78 HZ PHE 78 66.923 -6.906 6.329 584 H HIS 79 HN HIS 79 71.451 -8.519 3.577 585 HA HIS 79 HA HIS 79 70.093 -11.128 3.241 586 HB2 HIS 79 HB2 HIS 79 72.441 -11.274 2.386 587 HB3 HIS 79 HB1 HIS 79 73.004 -10.828 3.998 588 HD1 HIS 79 HD1 HIS 79 72.530 -12.532 5.944 589 HD2 HIS 79 HD2 HIS 79 71.537 -13.932 2.146 590 HE1 HIS 79 HE1 HIS 79 72.178 -15.032 6.171 591 H VAL 80 HN VAL 80 69.058 -11.715 5.015 592 HA VAL 80 HA VAL 80 70.164 -11.040 7.655 593 HB VAL 80 HB VAL 80 68.600 -9.242 7.238 594 HG11 VAL 80 HG11 VAL 80 66.559 -11.412 6.690 595 HG12 VAL 80 HG12 VAL 80 67.283 -10.362 5.472 596 HG13 VAL 80 HG13 VAL 80 66.246 -9.677 6.722 597 HG21 VAL 80 HG21 VAL 80 67.195 -11.255 9.002 598 HG22 VAL 80 HG22 VAL 80 67.215 -9.495 9.161 599 HG23 VAL 80 HG23 VAL 80 68.675 -10.429 9.488 600 H GLY 81 HN GLY 81 69.970 -12.645 9.063 601 HA2 GLY 81 HA2 GLY 81 69.760 -15.219 8.677 602 HA3 GLY 81 HA1 GLY 81 69.037 -14.525 10.118 603 H THR 82 HN THR 82 66.763 -13.361 9.265 604 HA THR 82 HA THR 82 65.005 -15.531 8.947 605 HB THR 82 HB THR 82 63.266 -13.813 8.631 606 HG1 THR 82 HG1 THR 82 64.647 -11.624 8.984 607 HG21 THR 82 HG21 THR 82 64.078 -14.332 10.888 608 HG22 THR 82 HG22 THR 82 63.676 -12.621 10.755 609 HG23 THR 82 HG23 THR 82 65.362 -13.138 10.710 610 H CYS 83 HN CYS 83 65.069 -12.834 6.633 611 HA CYS 83 HA CYS 83 64.955 -14.821 4.417 612 HB2 CYS 83 HB2 CYS 83 63.534 -12.165 4.373 613 HB3 CYS 83 HB1 CYS 83 63.290 -13.558 3.323 614 HG CYS 83 HG CYS 83 61.393 -13.644 5.098 615 H SER 84 HN SER 84 64.966 -13.116 2.302 616 HA SER 84 HA SER 84 67.237 -11.289 2.555 617 HB2 SER 84 HB2 SER 84 67.288 -13.834 0.931 618 HB3 SER 84 HB1 SER 84 68.332 -12.463 0.561 619 HG SER 84 HG SER 84 69.255 -14.053 2.008 620 H SER 85 HN SER 85 67.339 -9.776 0.901 621 HA SER 85 HA SER 85 65.179 -9.860 -1.138 622 HB2 SER 85 HB2 SER 85 66.128 -7.435 0.417 623 HB3 SER 85 HB1 SER 85 64.922 -7.432 -0.868 624 HG SER 85 HG SER 85 63.610 -8.722 0.414 625 H GLU 86 HN GLU 86 65.666 -8.712 -3.105 626 HA GLU 86 HA GLU 86 68.560 -8.204 -3.548 627 HB2 GLU 86 HB2 GLU 86 67.831 -10.422 -4.450 628 HB3 GLU 86 HB1 GLU 86 66.684 -9.573 -5.487 629 HG2 GLU 86 HG2 GLU 86 68.535 -8.315 -6.522 630 HG3 GLU 86 HG1 GLU 86 69.687 -9.149 -5.479 631 H ALA 87 HN ALA 87 69.084 -6.613 -5.003 632 HA ALA 87 HA ALA 87 67.025 -5.175 -6.467 633 HB1 ALA 87 HB1 ALA 87 67.796 -2.977 -5.424 634 HB2 ALA 87 HB2 ALA 87 68.514 -3.950 -4.142 635 HB3 ALA 87 HB3 ALA 87 66.773 -3.996 -4.411 636 H GLN 88 HN GLN 88 67.903 -3.777 -8.059 637 HA GLN 88 HA GLN 88 70.836 -3.982 -8.460 638 HB2 GLN 88 HB2 GLN 88 68.636 -4.456 -10.481 639 HB3 GLN 88 HB1 GLN 88 70.330 -4.219 -10.911 640 HG2 GLN 88 HG2 GLN 88 70.983 -6.157 -9.585 641 HG3 GLN 88 HG1 GLN 88 69.327 -6.366 -9.021 642 HE21 GLN 88 HE21 GLN 88 69.977 -8.613 -10.157 643 HE22 GLN 88 HE22 GLN 88 69.513 -8.737 -11.785 644 H LEU 89 HN LEU 89 71.838 -2.196 -9.173 645 HA LEU 89 HA LEU 89 70.191 0.219 -9.713 646 HB2 LEU 89 HB2 LEU 89 71.790 0.098 -7.655 647 HB3 LEU 89 HB1 LEU 89 73.082 0.261 -8.842 648 HG LEU 89 HG LEU 89 70.786 2.197 -8.406 649 HD11 LEU 89 HD11 LEU 89 73.754 2.677 -8.084 650 HD12 LEU 89 HD12 LEU 89 72.750 2.107 -6.750 651 HD13 LEU 89 HD13 LEU 89 72.423 3.671 -7.494 652 HD21 LEU 89 HD21 LEU 89 72.234 3.606 -10.034 653 HD22 LEU 89 HD22 LEU 89 71.250 2.325 -10.732 654 HD23 LEU 89 HD23 LEU 89 72.982 2.078 -10.486 655 H LYS 90 HN LYS 90 70.113 0.528 -11.862 656 HA LYS 90 HA LYS 90 72.553 0.039 -13.479 657 HB2 LYS 90 HB2 LYS 90 69.626 -0.214 -14.184 658 HB3 LYS 90 HB1 LYS 90 70.937 -0.294 -15.364 659 HG2 LYS 90 HG2 LYS 90 71.911 -2.213 -14.225 660 HG3 LYS 90 HG1 LYS 90 70.735 -2.083 -12.923 661 HD2 LYS 90 HD2 LYS 90 69.910 -3.817 -14.324 662 HD3 LYS 90 HD1 LYS 90 68.931 -2.405 -14.716 663 HE2 LYS 90 HE2 LYS 90 70.171 -1.996 -16.726 664 HE3 LYS 90 HE1 LYS 90 71.413 -3.162 -16.277 665 HZ1 LYS 90 HZ1 LYS 90 69.089 -4.583 -16.187 666 HZ2 LYS 90 HZ2 LYS 90 70.237 -4.622 -17.438 667 HZ3 LYS 90 HZ3 LYS 90 68.891 -3.589 -17.547 668 H VAL 91 HN VAL 91 72.961 1.456 -15.230 669 HA VAL 91 HA VAL 91 71.848 4.183 -14.869 670 HB VAL 91 HB VAL 91 73.990 4.977 -15.800 671 HG11 VAL 91 HG11 VAL 91 75.376 4.444 -13.857 672 HG12 VAL 91 HG12 VAL 91 74.371 3.040 -13.496 673 HG13 VAL 91 HG13 VAL 91 73.704 4.666 -13.342 674 HG21 VAL 91 HG21 VAL 91 75.856 3.243 -15.925 675 HG22 VAL 91 HG22 VAL 91 74.652 3.148 -17.207 676 HG23 VAL 91 HG23 VAL 91 74.597 2.010 -15.863 677 H THR 92 HN THR 92 70.885 5.144 -16.565 678 HA THR 92 HA THR 92 70.833 3.700 -19.154 679 HB THR 92 HB THR 92 68.928 5.745 -17.989 680 HG1 THR 92 HG1 THR 92 67.565 3.772 -18.211 681 HG21 THR 92 HG21 THR 92 67.531 4.976 -19.985 682 HG22 THR 92 HG22 THR 92 69.020 4.285 -20.632 683 HG23 THR 92 HG23 THR 92 68.902 6.023 -20.353 684 H ALA 93 HN ALA 93 71.704 4.586 -20.909 685 HA ALA 93 HA ALA 93 73.290 6.930 -20.763 686 HB1 ALA 93 HB1 ALA 93 73.709 6.580 -23.115 687 HB2 ALA 93 HB2 ALA 93 72.292 5.540 -23.257 688 HB3 ALA 93 HB3 ALA 93 73.686 5.006 -22.319 689 H GLY 94 HN GLY 94 73.071 8.721 -22.419 690 HA2 GLY 94 HA2 GLY 94 71.765 10.278 -23.621 691 HA3 GLY 94 HA1 GLY 94 70.304 9.504 -23.017 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 62.326 -7.658 23.950 2 H2 MET 1 HT2 MET 1 61.075 -8.714 24.406 3 H3 MET 1 HT3 MET 1 60.877 -7.683 23.070 4 HA MET 1 HA MET 1 62.467 -8.862 21.792 5 HB2 MET 1 HB2 MET 1 62.975 -10.308 24.403 6 HB3 MET 1 HB1 MET 1 63.597 -10.865 22.849 7 HG2 MET 1 HG2 MET 1 64.760 -8.696 22.551 8 HG3 MET 1 HG1 MET 1 64.156 -8.169 24.122 9 HE1 MET 1 HE1 MET 1 66.788 -9.834 22.145 10 HE2 MET 1 HE2 MET 1 65.862 -11.304 22.438 11 HE3 MET 1 HE3 MET 1 67.470 -11.130 23.136 12 H ALA 2 HN ALA 2 60.814 -9.593 20.538 13 HA ALA 2 HA ALA 2 59.822 -12.212 20.898 14 HB1 ALA 2 HB1 ALA 2 57.818 -11.976 21.956 15 HB2 ALA 2 HB2 ALA 2 57.421 -10.497 21.082 16 HB3 ALA 2 HB3 ALA 2 58.453 -10.428 22.507 17 HA PRO 3 HA PRO 3 57.690 -10.144 17.136 18 HB2 PRO 3 HB2 PRO 3 58.824 -7.487 16.736 19 HB3 PRO 3 HB1 PRO 3 57.135 -7.935 17.025 20 HG2 PRO 3 HG2 PRO 3 58.727 -6.585 18.831 21 HG3 PRO 3 HG1 PRO 3 57.283 -7.519 19.258 22 HD2 PRO 3 HD2 PRO 3 60.166 -8.274 19.535 23 HD3 PRO 3 HD1 PRO 3 58.786 -8.692 20.573 24 H GLU 4 HN GLU 4 58.337 -10.457 15.047 25 HA GLU 4 HA GLU 4 61.125 -11.126 14.624 26 HB2 GLU 4 HB2 GLU 4 59.260 -12.527 13.746 27 HB3 GLU 4 HB1 GLU 4 58.790 -11.194 12.692 28 HG2 GLU 4 HG2 GLU 4 61.011 -11.271 11.609 29 HG3 GLU 4 HG1 GLU 4 61.475 -12.606 12.660 30 H VAL 5 HN VAL 5 62.430 -10.243 12.925 31 HA VAL 5 HA VAL 5 62.304 -7.401 12.692 32 HB VAL 5 HB VAL 5 63.875 -9.154 10.802 33 HG11 VAL 5 HG11 VAL 5 65.564 -7.384 11.130 34 HG12 VAL 5 HG12 VAL 5 64.491 -6.573 12.269 35 HG13 VAL 5 HG13 VAL 5 64.030 -6.716 10.574 36 HG21 VAL 5 HG21 VAL 5 64.429 -10.347 12.715 37 HG22 VAL 5 HG22 VAL 5 64.159 -8.981 13.790 38 HG23 VAL 5 HG23 VAL 5 65.625 -9.056 12.807 39 H THR 6 HN THR 6 61.314 -6.129 11.089 40 HA THR 6 HA THR 6 59.751 -7.670 9.096 41 HB THR 6 HB THR 6 58.686 -5.515 8.524 42 HG1 THR 6 HG1 THR 6 60.081 -3.977 8.956 43 HG21 THR 6 HG21 THR 6 57.409 -6.586 10.136 44 HG22 THR 6 HG22 THR 6 57.829 -5.116 11.013 45 HG23 THR 6 HG23 THR 6 58.714 -6.608 11.321 46 H ILE 7 HN ILE 7 60.314 -7.949 7.077 47 HA ILE 7 HA ILE 7 62.653 -6.475 6.029 48 HB ILE 7 HB ILE 7 61.411 -9.001 4.945 49 HG12 ILE 7 HG12 ILE 7 62.006 -9.446 7.250 50 HG13 ILE 7 HG11 ILE 7 63.232 -10.178 6.218 51 HG21 ILE 7 HG21 ILE 7 63.881 -9.270 4.191 52 HG22 ILE 7 HG22 ILE 7 64.028 -7.548 4.535 53 HG23 ILE 7 HG23 ILE 7 62.880 -8.112 3.323 54 HD11 ILE 7 HD11 ILE 7 63.433 -7.681 7.895 55 HD12 ILE 7 HD12 ILE 7 64.523 -7.939 6.534 56 HD13 ILE 7 HD13 ILE 7 64.500 -9.083 7.874 57 H LEU 8 HN LEU 8 60.390 -4.975 5.948 58 HA LEU 8 HA LEU 8 59.109 -5.295 3.335 59 HB2 LEU 8 HB2 LEU 8 58.781 -3.161 5.465 60 HB3 LEU 8 HB1 LEU 8 57.809 -3.298 4.002 61 HG LEU 8 HG LEU 8 58.023 -5.468 6.116 62 HD11 LEU 8 HD11 LEU 8 55.871 -4.749 6.916 63 HD12 LEU 8 HD12 LEU 8 55.711 -3.578 5.608 64 HD13 LEU 8 HD13 LEU 8 56.908 -3.324 6.877 65 HD21 LEU 8 HD21 LEU 8 55.798 -6.118 4.869 66 HD22 LEU 8 HD22 LEU 8 57.342 -6.546 4.137 67 HD23 LEU 8 HD23 LEU 8 56.453 -5.139 3.557 68 H GLU 9 HN GLU 9 61.083 -5.057 2.119 69 HA GLU 9 HA GLU 9 62.150 -2.293 1.983 70 HB2 GLU 9 HB2 GLU 9 63.417 -4.790 0.871 71 HB3 GLU 9 HB1 GLU 9 64.164 -3.214 1.139 72 HG2 GLU 9 HG2 GLU 9 63.756 -3.486 3.590 73 HG3 GLU 9 HG1 GLU 9 63.146 -5.111 3.273 74 HA PRO 10 HA PRO 10 59.813 -2.730 -1.957 75 HB2 PRO 10 HB2 PRO 10 59.742 0.165 -2.177 76 HB3 PRO 10 HB1 PRO 10 58.395 -0.942 -1.869 77 HG2 PRO 10 HG2 PRO 10 59.504 0.860 -0.033 78 HG3 PRO 10 HG1 PRO 10 58.406 -0.477 0.342 79 HD2 PRO 10 HD2 PRO 10 61.329 -0.287 0.790 80 HD3 PRO 10 HD1 PRO 10 60.129 -1.327 1.579 81 H LEU 11 HN LEU 11 62.776 -2.586 -1.438 82 HA LEU 11 HA LEU 11 63.935 -0.883 -3.429 83 HB2 LEU 11 HB2 LEU 11 64.884 -3.103 -1.647 84 HB3 LEU 11 HB1 LEU 11 65.910 -2.612 -2.990 85 HG LEU 11 HG LEU 11 66.370 -1.450 -0.783 86 HD11 LEU 11 HD11 LEU 11 66.724 -0.499 -3.257 87 HD12 LEU 11 HD12 LEU 11 67.054 0.478 -1.837 88 HD13 LEU 11 HD13 LEU 11 65.539 0.688 -2.713 89 HD21 LEU 11 HD21 LEU 11 63.844 0.113 -1.366 90 HD22 LEU 11 HD22 LEU 11 64.849 0.166 0.076 91 HD23 LEU 11 HD23 LEU 11 63.866 -1.259 -0.258 92 H GLN 12 HN GLN 12 64.045 -1.204 -5.541 93 HA GLN 12 HA GLN 12 63.906 -3.955 -6.628 94 HB2 GLN 12 HB2 GLN 12 62.413 -3.155 -8.416 95 HB3 GLN 12 HB1 GLN 12 61.675 -2.946 -6.830 96 HG2 GLN 12 HG2 GLN 12 62.359 -0.581 -6.808 97 HG3 GLN 12 HG1 GLN 12 63.108 -0.776 -8.390 98 HE21 GLN 12 HE21 GLN 12 61.246 1.126 -8.488 99 HE22 GLN 12 HE22 GLN 12 59.769 0.576 -9.127 100 H ASP 13 HN ASP 13 63.898 -2.893 -9.366 101 HA ASP 13 HA ASP 13 66.738 -2.061 -9.507 102 HB2 ASP 13 HB2 ASP 13 66.636 -2.919 -11.836 103 HB3 ASP 13 HB1 ASP 13 66.298 -4.165 -10.638 104 H VAL 14 HN VAL 14 67.260 -0.128 -10.336 105 HA VAL 14 HA VAL 14 65.225 1.372 -11.890 106 HB VAL 14 HB VAL 14 65.951 3.425 -10.684 107 HG11 VAL 14 HG11 VAL 14 64.887 1.157 -8.975 108 HG12 VAL 14 HG12 VAL 14 63.930 2.299 -9.922 109 HG13 VAL 14 HG13 VAL 14 64.835 2.858 -8.513 110 HG21 VAL 14 HG21 VAL 14 67.222 3.105 -8.558 111 HG22 VAL 14 HG22 VAL 14 68.169 2.670 -9.981 112 HG23 VAL 14 HG23 VAL 14 67.448 1.407 -8.983 113 H GLN 15 HN GLN 15 66.069 2.949 -13.300 114 HA GLN 15 HA GLN 15 68.968 2.762 -13.900 115 HB2 GLN 15 HB2 GLN 15 66.631 2.774 -15.828 116 HB3 GLN 15 HB1 GLN 15 68.286 3.120 -16.317 117 HG2 GLN 15 HG2 GLN 15 69.007 0.913 -15.562 118 HG3 GLN 15 HG1 GLN 15 67.381 0.559 -14.970 119 HE21 GLN 15 HE21 GLN 15 67.851 -1.311 -16.680 120 HE22 GLN 15 HE22 GLN 15 67.331 -0.992 -18.263 121 H LEU 16 HN LEU 16 69.784 4.706 -13.408 122 HA LEU 16 HA LEU 16 68.142 7.134 -13.897 123 HB2 LEU 16 HB2 LEU 16 70.507 6.721 -12.058 124 HB3 LEU 16 HB1 LEU 16 69.598 8.215 -12.241 125 HG LEU 16 HG LEU 16 68.333 5.594 -11.398 126 HD11 LEU 16 HD11 LEU 16 70.047 6.282 -9.771 127 HD12 LEU 16 HD12 LEU 16 68.427 6.490 -9.101 128 HD13 LEU 16 HD13 LEU 16 69.327 7.890 -9.686 129 HD21 LEU 16 HD21 LEU 16 66.622 7.042 -12.161 130 HD22 LEU 16 HD22 LEU 16 67.425 8.480 -11.534 131 HD23 LEU 16 HD23 LEU 16 66.657 7.345 -10.427 132 H SER 17 HN SER 17 68.834 8.603 -15.334 133 HA SER 17 HA SER 17 71.102 8.013 -16.990 134 HB2 SER 17 HB2 SER 17 70.473 9.946 -18.242 135 HB3 SER 17 HB1 SER 17 68.968 9.196 -17.722 136 HG SER 17 HG SER 17 69.545 11.633 -17.361 137 H GLU 18 HN GLU 18 72.889 9.584 -17.338 138 HA GLU 18 HA GLU 18 74.195 10.174 -14.903 139 HB2 GLU 18 HB2 GLU 18 75.405 9.735 -16.999 140 HB3 GLU 18 HB1 GLU 18 74.773 11.240 -17.675 141 HG2 GLU 18 HG2 GLU 18 75.907 12.544 -15.973 142 HG3 GLU 18 HG1 GLU 18 76.428 11.082 -15.142 143 H GLY 19 HN GLY 19 74.500 12.078 -13.797 144 HA2 GLY 19 HA2 GLY 19 74.316 14.390 -13.371 145 HA3 GLY 19 HA1 GLY 19 73.244 14.549 -14.761 146 H GLN 20 HN GLN 20 72.128 11.900 -13.218 147 HA GLN 20 HA GLN 20 70.104 13.454 -11.716 148 HB2 GLN 20 HB2 GLN 20 70.038 10.685 -12.919 149 HB3 GLN 20 HB1 GLN 20 68.796 11.292 -11.825 150 HG2 GLN 20 HG2 GLN 20 68.337 13.160 -13.335 151 HG3 GLN 20 HG1 GLN 20 69.621 12.624 -14.417 152 HE21 GLN 20 HE21 GLN 20 67.284 12.730 -15.717 153 HE22 GLN 20 HE22 GLN 20 66.555 11.204 -15.867 154 H ASP 21 HN ASP 21 69.683 13.089 -9.617 155 HA ASP 21 HA ASP 21 71.724 11.790 -8.046 156 HB2 ASP 21 HB2 ASP 21 69.171 13.250 -7.376 157 HB3 ASP 21 HB1 ASP 21 70.156 12.473 -6.139 158 H ALA 22 HN ALA 22 70.899 10.396 -6.132 159 HA ALA 22 HA ALA 22 68.745 8.551 -6.911 160 HB1 ALA 22 HB1 ALA 22 70.099 6.603 -6.776 161 HB2 ALA 22 HB2 ALA 22 71.470 7.510 -6.139 162 HB3 ALA 22 HB3 ALA 22 70.976 7.723 -7.820 163 H SER 23 HN SER 23 67.878 7.370 -5.198 164 HA SER 23 HA SER 23 68.960 7.523 -2.524 165 HB2 SER 23 HB2 SER 23 67.983 9.761 -2.657 166 HB3 SER 23 HB1 SER 23 66.454 9.084 -3.209 167 HG SER 23 HG SER 23 66.962 9.548 -0.798 168 H PHE 24 HN PHE 24 67.740 6.261 -1.036 169 HA PHE 24 HA PHE 24 65.575 4.613 -2.192 170 HB2 PHE 24 HB2 PHE 24 67.950 3.551 -0.646 171 HB3 PHE 24 HB1 PHE 24 66.551 2.617 -1.150 172 HD1 PHE 24 HD1 PHE 24 69.842 3.569 -2.033 173 HD2 PHE 24 HD2 PHE 24 65.986 2.755 -3.746 174 HE1 PHE 24 HE1 PHE 24 70.913 3.098 -4.218 175 HE2 PHE 24 HE2 PHE 24 67.062 2.284 -5.933 176 HZ PHE 24 HZ PHE 24 69.531 2.442 -6.164 177 H GLN 25 HN GLN 25 64.197 3.670 -0.602 178 HA GLN 25 HA GLN 25 64.501 4.645 2.165 179 HB2 GLN 25 HB2 GLN 25 63.039 6.268 0.997 180 HB3 GLN 25 HB1 GLN 25 61.958 4.946 0.544 181 HG2 GLN 25 HG2 GLN 25 61.513 4.444 2.883 182 HG3 GLN 25 HG1 GLN 25 62.700 5.638 3.401 183 HE21 GLN 25 HE21 GLN 25 60.057 5.906 4.323 184 HE22 GLN 25 HE22 GLN 25 59.330 7.241 3.566 185 H CYS 26 HN CYS 26 64.517 2.865 3.348 186 HA CYS 26 HA CYS 26 62.818 0.571 2.542 187 HB2 CYS 26 HB2 CYS 26 65.033 0.257 4.533 188 HB3 CYS 26 HB1 CYS 26 64.474 -0.855 3.282 189 HG CYS 26 HG CYS 26 66.114 1.708 2.556 190 H ARG 27 HN ARG 27 61.640 -0.541 4.094 191 HA ARG 27 HA ARG 27 61.099 0.928 6.625 192 HB2 ARG 27 HB2 ARG 27 59.280 -0.837 4.954 193 HB3 ARG 27 HB1 ARG 27 58.857 -0.149 6.519 194 HG2 ARG 27 HG2 ARG 27 59.151 2.123 5.617 195 HG3 ARG 27 HG1 ARG 27 59.606 1.447 4.052 196 HD2 ARG 27 HD2 ARG 27 57.401 0.339 3.896 197 HD3 ARG 27 HD1 ARG 27 56.939 1.044 5.440 198 HE ARG 27 HE ARG 27 57.148 2.428 2.879 199 HH11 ARG 27 HH11 ARG 27 56.810 2.605 6.328 200 HH12 ARG 27 HH12 ARG 27 56.194 4.224 6.315 201 HH21 ARG 27 HH21 ARG 27 56.353 4.544 2.869 202 HH22 ARG 27 HH22 ARG 27 55.915 5.310 4.360 203 H LEU 28 HN LEU 28 62.640 -0.195 7.875 204 HA LEU 28 HA LEU 28 62.216 -3.132 8.118 205 HB2 LEU 28 HB2 LEU 28 64.722 -1.491 8.545 206 HB3 LEU 28 HB1 LEU 28 64.582 -3.216 8.871 207 HG LEU 28 HG LEU 28 64.030 -1.966 6.163 208 HD11 LEU 28 HD11 LEU 28 66.407 -1.676 6.888 209 HD12 LEU 28 HD12 LEU 28 66.240 -2.739 5.490 210 HD13 LEU 28 HD13 LEU 28 66.524 -3.426 7.090 211 HD21 LEU 28 HD21 LEU 28 62.968 -4.051 6.127 212 HD22 LEU 28 HD22 LEU 28 64.120 -4.781 7.242 213 HD23 LEU 28 HD23 LEU 28 64.577 -4.492 5.564 214 H SER 29 HN SER 29 61.265 -3.705 9.960 215 HA SER 29 HA SER 29 61.204 -1.936 12.249 216 HB2 SER 29 HB2 SER 29 59.911 -3.661 13.355 217 HB3 SER 29 HB1 SER 29 59.275 -3.424 11.734 218 HG SER 29 HG SER 29 60.316 -5.628 12.862 219 H ARG 30 HN ARG 30 61.940 -2.656 14.382 220 HA ARG 30 HA ARG 30 64.644 -3.046 14.497 221 HB2 ARG 30 HB2 ARG 30 64.346 -3.585 16.867 222 HB3 ARG 30 HB1 ARG 30 63.346 -2.225 16.372 223 HG2 ARG 30 HG2 ARG 30 61.383 -3.650 16.236 224 HG3 ARG 30 HG1 ARG 30 62.352 -5.085 16.562 225 HD2 ARG 30 HD2 ARG 30 61.274 -4.425 18.623 226 HD3 ARG 30 HD1 ARG 30 62.996 -4.097 18.762 227 HE ARG 30 HE ARG 30 62.534 -1.791 18.740 228 HH11 ARG 30 HH11 ARG 30 60.525 -1.399 16.658 229 HH12 ARG 30 HH12 ARG 30 59.063 -1.104 17.536 230 HH21 ARG 30 HH21 ARG 30 60.280 -2.404 20.513 231 HH22 ARG 30 HH22 ARG 30 58.925 -1.667 19.724 232 H ALA 31 HN ALA 31 65.899 -4.670 15.520 233 HA ALA 31 HA ALA 31 65.542 -7.239 14.262 234 HB1 ALA 31 HB1 ALA 31 67.739 -6.034 14.371 235 HB2 ALA 31 HB2 ALA 31 67.797 -7.684 14.996 236 HB3 ALA 31 HB3 ALA 31 67.747 -6.319 16.111 237 H SER 32 HN SER 32 66.034 -9.232 15.565 238 HA SER 32 HA SER 32 65.285 -9.160 18.380 239 HB2 SER 32 HB2 SER 32 63.525 -10.987 17.901 240 HB3 SER 32 HB1 SER 32 63.076 -9.320 17.564 241 HG SER 32 HG SER 32 63.864 -11.361 15.771 242 H GLY 33 HN GLY 33 65.527 -11.417 15.628 243 HA2 GLY 33 HA2 GLY 33 67.113 -13.275 17.255 244 HA3 GLY 33 HA1 GLY 33 66.467 -13.582 15.643 245 H GLN 34 HN GLN 34 67.404 -12.176 13.881 246 HA GLN 34 HA GLN 34 70.293 -11.682 14.327 247 HB2 GLN 34 HB2 GLN 34 69.702 -13.746 12.937 248 HB3 GLN 34 HB1 GLN 34 69.066 -12.631 11.733 249 HG2 GLN 34 HG2 GLN 34 71.358 -13.163 11.143 250 HG3 GLN 34 HG1 GLN 34 71.299 -11.488 11.694 251 HE21 GLN 34 HE21 GLN 34 71.389 -14.566 13.585 252 HE22 GLN 34 HE22 GLN 34 72.786 -14.151 14.457 253 H GLU 35 HN GLU 35 71.078 -9.770 13.621 254 HA GLU 35 HA GLU 35 69.167 -7.760 12.758 255 HB2 GLU 35 HB2 GLU 35 70.895 -7.279 14.465 256 HB3 GLU 35 HB1 GLU 35 72.145 -7.536 13.247 257 HG2 GLU 35 HG2 GLU 35 71.210 -5.704 11.889 258 HG3 GLU 35 HG1 GLU 35 69.945 -5.456 13.093 259 H ALA 36 HN ALA 36 69.275 -6.562 10.849 260 HA ALA 36 HA ALA 36 70.122 -8.012 8.533 261 HB1 ALA 36 HB1 ALA 36 69.248 -6.036 7.304 262 HB2 ALA 36 HB2 ALA 36 69.012 -5.218 8.849 263 HB3 ALA 36 HB3 ALA 36 68.093 -6.676 8.475 264 H ARG 37 HN ARG 37 71.577 -7.345 6.920 265 HA ARG 37 HA ARG 37 73.718 -5.489 7.812 266 HB2 ARG 37 HB2 ARG 37 74.383 -7.907 7.871 267 HB3 ARG 37 HB1 ARG 37 74.028 -8.007 6.153 268 HG2 ARG 37 HG2 ARG 37 76.327 -7.609 6.123 269 HG3 ARG 37 HG1 ARG 37 75.702 -5.972 5.966 270 HD2 ARG 37 HD2 ARG 37 75.937 -5.667 8.419 271 HD3 ARG 37 HD1 ARG 37 76.602 -7.294 8.543 272 HE ARG 37 HE ARG 37 78.037 -5.685 6.651 273 HH11 ARG 37 HH11 ARG 37 77.505 -4.777 9.778 274 HH12 ARG 37 HH12 ARG 37 79.129 -4.989 10.343 275 HH21 ARG 37 HH21 ARG 37 80.196 -6.614 7.467 276 HH22 ARG 37 HH22 ARG 37 80.654 -6.033 9.032 277 H TRP 38 HN TRP 38 73.950 -3.792 6.505 278 HA TRP 38 HA TRP 38 72.647 -3.737 3.902 279 HB2 TRP 38 HB2 TRP 38 73.211 -1.816 5.857 280 HB3 TRP 38 HB1 TRP 38 74.376 -1.434 4.593 281 HD1 TRP 38 HD1 TRP 38 73.428 0.343 3.056 282 HE1 TRP 38 HE1 TRP 38 71.121 0.854 2.019 283 HE3 TRP 38 HE3 TRP 38 70.665 -3.390 5.176 284 HZ2 TRP 38 HZ2 TRP 38 68.462 -0.194 2.081 285 HZ3 TRP 38 HZ3 TRP 38 68.251 -3.613 4.672 286 HH2 TRP 38 HH2 TRP 38 67.142 -2.018 3.129 287 H ALA 39 HN ALA 39 73.882 -3.141 1.907 288 HA ALA 39 HA ALA 39 76.747 -3.340 1.982 289 HB1 ALA 39 HB1 ALA 39 77.021 -5.475 0.861 290 HB2 ALA 39 HB2 ALA 39 75.272 -5.718 0.842 291 HB3 ALA 39 HB3 ALA 39 76.144 -5.708 2.376 292 H LEU 40 HN LEU 40 77.752 -2.847 0.119 293 HA LEU 40 HA LEU 40 76.198 -2.498 -2.346 294 HB2 LEU 40 HB2 LEU 40 76.154 -0.335 -1.069 295 HB3 LEU 40 HB1 LEU 40 77.910 -0.286 -1.170 296 HG LEU 40 HG LEU 40 76.219 -0.595 -3.666 297 HD11 LEU 40 HD11 LEU 40 75.311 1.375 -2.654 298 HD12 LEU 40 HD12 LEU 40 76.434 1.915 -3.901 299 HD13 LEU 40 HD13 LEU 40 76.913 1.960 -2.206 300 HD21 LEU 40 HD21 LEU 40 78.456 -0.896 -4.280 301 HD22 LEU 40 HD22 LEU 40 79.062 0.202 -3.044 302 HD23 LEU 40 HD23 LEU 40 78.297 0.841 -4.493 303 H GLY 41 HN GLY 41 77.354 -3.249 -4.028 304 HA2 GLY 41 HA2 GLY 41 79.216 -3.746 -5.340 305 HA3 GLY 41 HA1 GLY 41 80.246 -3.018 -4.105 306 H GLY 42 HN GLY 42 78.108 -5.034 -2.605 307 HA2 GLY 42 HA2 GLY 42 78.120 -7.388 -2.221 308 HA3 GLY 42 HA1 GLY 42 79.753 -7.469 -2.865 309 H VAL 43 HN VAL 43 80.473 -5.011 -1.210 310 HA VAL 43 HA VAL 43 80.890 -6.458 1.339 311 HB VAL 43 HB VAL 43 82.817 -4.848 1.607 312 HG11 VAL 43 HG11 VAL 43 82.891 -6.533 -0.913 313 HG12 VAL 43 HG12 VAL 43 83.011 -7.199 0.715 314 HG13 VAL 43 HG13 VAL 43 84.258 -6.106 0.117 315 HG21 VAL 43 HG21 VAL 43 82.241 -4.291 -1.323 316 HG22 VAL 43 HG22 VAL 43 83.556 -3.617 -0.358 317 HG23 VAL 43 HG23 VAL 43 81.888 -3.161 -0.015 318 HA PRO 44 HA PRO 44 78.435 -3.487 3.541 319 HB2 PRO 44 HB2 PRO 44 80.312 -3.163 5.734 320 HB3 PRO 44 HB1 PRO 44 78.792 -4.069 5.717 321 HG2 PRO 44 HG2 PRO 44 81.479 -5.090 5.650 322 HG3 PRO 44 HG1 PRO 44 79.961 -5.993 5.710 323 HD2 PRO 44 HD2 PRO 44 81.742 -5.795 3.489 324 HD3 PRO 44 HD1 PRO 44 80.136 -6.549 3.509 325 H LEU 45 HN LEU 45 78.265 -1.300 3.475 326 HA LEU 45 HA LEU 45 80.622 0.235 2.609 327 HB2 LEU 45 HB2 LEU 45 78.636 2.014 2.329 328 HB3 LEU 45 HB1 LEU 45 78.943 0.772 1.120 329 HG LEU 45 HG LEU 45 77.235 -0.678 2.139 330 HD11 LEU 45 HD11 LEU 45 77.311 -0.134 4.452 331 HD12 LEU 45 HD12 LEU 45 75.748 0.473 3.913 332 HD13 LEU 45 HD13 LEU 45 77.098 1.587 4.138 333 HD21 LEU 45 HD21 LEU 45 76.718 1.298 0.482 334 HD22 LEU 45 HD22 LEU 45 75.936 2.032 1.879 335 HD23 LEU 45 HD23 LEU 45 75.381 0.469 1.277 336 H GLN 46 HN GLN 46 80.250 2.709 3.341 337 HA GLN 46 HA GLN 46 79.752 2.847 6.246 338 HB2 GLN 46 HB2 GLN 46 82.310 3.653 4.847 339 HB3 GLN 46 HB1 GLN 46 81.878 4.193 6.468 340 HG2 GLN 46 HG2 GLN 46 82.065 1.286 5.638 341 HG3 GLN 46 HG1 GLN 46 83.359 2.167 6.446 342 HE21 GLN 46 HE21 GLN 46 81.201 -0.073 7.215 343 HE22 GLN 46 HE22 GLN 46 80.735 0.424 8.769 344 H ALA 47 HN ALA 47 79.605 5.072 7.034 345 HA ALA 47 HA ALA 47 78.033 6.693 5.277 346 HB1 ALA 47 HB1 ALA 47 77.484 6.713 7.604 347 HB2 ALA 47 HB2 ALA 47 78.113 8.315 7.219 348 HB3 ALA 47 HB3 ALA 47 79.134 7.143 8.054 349 H ASN 48 HN ASN 48 79.563 7.050 3.539 350 HA ASN 48 HA ASN 48 81.936 8.636 4.046 351 HB2 ASN 48 HB2 ASN 48 81.677 6.879 2.213 352 HB3 ASN 48 HB1 ASN 48 80.688 8.063 1.359 353 HD21 ASN 48 HD21 ASN 48 82.175 8.556 -0.329 354 HD22 ASN 48 HD22 ASN 48 83.684 9.277 -0.045 355 H GLU 49 HN GLU 49 82.260 10.639 2.579 356 HA GLU 49 HA GLU 49 80.395 12.617 3.376 357 HB2 GLU 49 HB2 GLU 49 81.683 14.129 1.894 358 HB3 GLU 49 HB1 GLU 49 82.733 13.177 2.944 359 HG2 GLU 49 HG2 GLU 49 83.083 11.560 1.087 360 HG3 GLU 49 HG1 GLU 49 82.092 12.578 0.042 361 H MET 50 HN MET 50 80.816 10.762 0.426 362 HA MET 50 HA MET 50 78.699 12.205 -0.969 363 HB2 MET 50 HB2 MET 50 79.263 10.870 -2.867 364 HB3 MET 50 HB1 MET 50 80.786 11.327 -2.105 365 HG2 MET 50 HG2 MET 50 81.136 9.048 -2.434 366 HG3 MET 50 HG1 MET 50 80.454 9.030 -0.807 367 HE1 MET 50 HE1 MET 50 79.537 9.144 -4.556 368 HE2 MET 50 HE2 MET 50 78.649 7.635 -4.745 369 HE3 MET 50 HE3 MET 50 80.335 7.596 -4.237 370 H ASN 51 HN ASN 51 78.811 9.874 1.367 371 HA ASN 51 HA ASN 51 76.130 8.851 0.654 372 HB2 ASN 51 HB2 ASN 51 77.837 7.148 0.029 373 HB3 ASN 51 HB1 ASN 51 78.392 7.133 1.700 374 HD21 ASN 51 HD21 ASN 51 77.698 4.990 2.223 375 HD22 ASN 51 HD22 ASN 51 76.064 4.536 2.244 376 H ASP 52 HN ASP 52 74.898 9.693 2.233 377 HA ASP 52 HA ASP 52 75.882 9.634 5.030 378 HB2 ASP 52 HB2 ASP 52 75.235 11.863 3.972 379 HB3 ASP 52 HB1 ASP 52 73.576 11.272 3.977 380 H ILE 53 HN ILE 53 74.988 8.190 6.338 381 HA ILE 53 HA ILE 53 72.394 6.963 5.573 382 HB ILE 53 HB ILE 53 74.441 5.807 7.471 383 HG12 ILE 53 HG12 ILE 53 74.176 5.469 4.466 384 HG13 ILE 53 HG11 ILE 53 75.574 6.088 5.345 385 HG21 ILE 53 HG21 ILE 53 72.386 4.387 5.773 386 HG22 ILE 53 HG22 ILE 53 71.964 5.051 7.350 387 HG23 ILE 53 HG23 ILE 53 73.202 3.804 7.222 388 HD11 ILE 53 HD11 ILE 53 75.595 3.820 6.564 389 HD12 ILE 53 HD12 ILE 53 76.120 3.829 4.880 390 HD13 ILE 53 HD13 ILE 53 74.499 3.268 5.296 391 H THR 54 HN THR 54 70.696 7.179 6.919 392 HA THR 54 HA THR 54 71.166 7.910 9.734 393 HB THR 54 HB THR 54 70.937 10.029 8.456 394 HG1 THR 54 HG1 THR 54 70.208 10.300 10.442 395 HG21 THR 54 HG21 THR 54 69.352 8.905 6.752 396 HG22 THR 54 HG22 THR 54 68.983 10.558 7.243 397 HG23 THR 54 HG23 THR 54 68.082 9.210 7.938 398 H VAL 55 HN VAL 55 69.466 7.457 11.117 399 HA VAL 55 HA VAL 55 67.516 5.503 10.073 400 HB VAL 55 HB VAL 55 68.360 6.099 12.920 401 HG11 VAL 55 HG11 VAL 55 66.698 3.892 11.672 402 HG12 VAL 55 HG12 VAL 55 66.133 5.122 12.802 403 HG13 VAL 55 HG13 VAL 55 67.269 3.884 13.341 404 HG21 VAL 55 HG21 VAL 55 69.599 3.939 12.686 405 HG22 VAL 55 HG22 VAL 55 70.221 5.199 11.620 406 HG23 VAL 55 HG23 VAL 55 69.188 3.927 10.970 407 H GLU 56 HN GLU 56 65.558 6.261 9.651 408 HA GLU 56 HA GLU 56 64.594 8.720 10.903 409 HB2 GLU 56 HB2 GLU 56 63.492 6.951 8.711 410 HB3 GLU 56 HB1 GLU 56 62.641 8.360 9.339 411 HG2 GLU 56 HG2 GLU 56 64.508 9.811 8.711 412 HG3 GLU 56 HG1 GLU 56 65.439 8.417 8.166 413 H GLN 57 HN GLN 57 62.181 8.673 11.498 414 HA GLN 57 HA GLN 57 61.838 6.995 13.742 415 HB2 GLN 57 HB2 GLN 57 59.525 7.883 13.755 416 HB3 GLN 57 HB1 GLN 57 60.737 9.154 13.588 417 HG2 GLN 57 HG2 GLN 57 60.405 9.117 11.128 418 HG3 GLN 57 HG1 GLN 57 59.145 7.902 11.331 419 HE21 GLN 57 HE21 GLN 57 57.753 9.656 10.270 420 HE22 GLN 57 HE22 GLN 57 57.081 10.844 11.279 421 H GLY 58 HN GLY 58 60.145 5.425 14.101 422 HA2 GLY 58 HA2 GLY 58 58.873 3.575 13.572 423 HA3 GLY 58 HA1 GLY 58 58.740 4.199 11.930 424 H THR 59 HN THR 59 61.903 3.950 13.180 425 HA THR 59 HA THR 59 63.668 2.573 12.742 426 HB THR 59 HB THR 59 61.846 0.330 11.938 427 HG1 THR 59 HG1 THR 59 60.793 0.454 13.714 428 HG21 THR 59 HG21 THR 59 64.403 0.207 12.183 429 HG22 THR 59 HG22 THR 59 63.464 -1.016 13.044 430 HG23 THR 59 HG23 THR 59 64.128 0.365 13.918 431 H LEU 60 HN LEU 60 62.327 4.193 10.658 432 HA LEU 60 HA LEU 60 62.665 2.665 8.192 433 HB2 LEU 60 HB2 LEU 60 61.707 5.414 8.914 434 HB3 LEU 60 HB1 LEU 60 62.276 5.140 7.269 435 HG LEU 60 HG LEU 60 60.670 3.308 6.990 436 HD11 LEU 60 HD11 LEU 60 58.979 2.878 8.752 437 HD12 LEU 60 HD12 LEU 60 59.825 3.991 9.821 438 HD13 LEU 60 HD13 LEU 60 60.607 2.496 9.311 439 HD21 LEU 60 HD21 LEU 60 59.574 5.922 8.047 440 HD22 LEU 60 HD22 LEU 60 58.554 4.698 7.292 441 HD23 LEU 60 HD23 LEU 60 59.844 5.464 6.365 442 H HIS 61 HN HIS 61 64.435 2.617 6.954 443 HA HIS 61 HA HIS 61 66.796 4.172 7.777 444 HB2 HIS 61 HB2 HIS 61 66.431 1.798 5.936 445 HB3 HIS 61 HB1 HIS 61 67.961 2.658 6.114 446 HD1 HIS 61 HD1 HIS 61 65.469 0.648 8.140 447 HD2 HIS 61 HD2 HIS 61 69.385 2.044 8.450 448 HE1 HIS 61 HE1 HIS 61 66.450 -0.425 10.213 449 H LEU 62 HN LEU 62 68.148 5.122 6.008 450 HA LEU 62 HA LEU 62 66.754 5.791 3.544 451 HB2 LEU 62 HB2 LEU 62 66.059 7.384 5.526 452 HB3 LEU 62 HB1 LEU 62 67.631 8.113 5.243 453 HG LEU 62 HG LEU 62 66.069 9.361 3.937 454 HD11 LEU 62 HD11 LEU 62 67.291 7.414 1.974 455 HD12 LEU 62 HD12 LEU 62 68.227 8.648 2.818 456 HD13 LEU 62 HD13 LEU 62 66.929 9.120 1.725 457 HD21 LEU 62 HD21 LEU 62 65.116 6.939 2.417 458 HD22 LEU 62 HD22 LEU 62 64.333 8.498 2.643 459 HD23 LEU 62 HD23 LEU 62 64.373 7.337 3.966 460 H LEU 63 HN LEU 63 68.301 5.428 2.070 461 HA LEU 63 HA LEU 63 71.115 6.021 2.689 462 HB2 LEU 63 HB2 LEU 63 69.704 4.427 0.560 463 HB3 LEU 63 HB1 LEU 63 71.357 4.958 0.298 464 HG LEU 63 HG LEU 63 71.203 2.657 1.240 465 HD11 LEU 63 HD11 LEU 63 73.068 4.477 1.810 466 HD12 LEU 63 HD12 LEU 63 73.070 2.892 2.574 467 HD13 LEU 63 HD13 LEU 63 72.428 4.282 3.441 468 HD21 LEU 63 HD21 LEU 63 69.126 3.349 2.663 469 HD22 LEU 63 HD22 LEU 63 70.322 3.874 3.850 470 HD23 LEU 63 HD23 LEU 63 70.271 2.186 3.336 471 H THR 64 HN THR 64 71.765 8.045 2.220 472 HA THR 64 HA THR 64 70.415 9.515 0.032 473 HB THR 64 HB THR 64 72.260 10.532 2.213 474 HG1 THR 64 HG1 THR 64 70.184 11.411 2.947 475 HG21 THR 64 HG21 THR 64 72.189 11.920 0.144 476 HG22 THR 64 HG22 THR 64 71.467 12.742 1.524 477 HG23 THR 64 HG23 THR 64 70.435 12.011 0.297 478 H LEU 65 HN LEU 65 71.410 8.998 -1.827 479 HA LEU 65 HA LEU 65 74.376 9.101 -1.928 480 HB2 LEU 65 HB2 LEU 65 73.288 6.949 -2.601 481 HB3 LEU 65 HB1 LEU 65 72.477 7.814 -3.904 482 HG LEU 65 HG LEU 65 74.706 8.497 -4.795 483 HD11 LEU 65 HD11 LEU 65 76.616 6.905 -3.833 484 HD12 LEU 65 HD12 LEU 65 75.626 6.972 -2.373 485 HD13 LEU 65 HD13 LEU 65 76.269 8.457 -3.076 486 HD21 LEU 65 HD21 LEU 65 73.472 6.429 -5.550 487 HD22 LEU 65 HD22 LEU 65 74.465 5.495 -4.433 488 HD23 LEU 65 HD23 LEU 65 75.218 6.344 -5.780 489 H HIS 66 HN HIS 66 75.309 10.732 -2.968 490 HA HIS 66 HA HIS 66 73.744 12.256 -4.984 491 HB2 HIS 66 HB2 HIS 66 73.950 13.451 -2.778 492 HB3 HIS 66 HB1 HIS 66 75.700 13.451 -3.010 493 HD1 HIS 66 HD1 HIS 66 73.184 13.990 -5.786 494 HD2 HIS 66 HD2 HIS 66 75.988 16.178 -3.611 495 HE1 HIS 66 HE1 HIS 66 73.355 16.252 -6.911 496 H LYS 67 HN LYS 67 75.116 13.481 -6.499 497 HA LYS 67 HA LYS 67 76.732 13.486 -8.132 498 HB2 LYS 67 HB2 LYS 67 78.386 12.929 -5.670 499 HB3 LYS 67 HB1 LYS 67 79.099 13.212 -7.257 500 HG2 LYS 67 HG2 LYS 67 78.005 15.400 -7.389 501 HG3 LYS 67 HG1 LYS 67 77.207 15.112 -5.850 502 HD2 LYS 67 HD2 LYS 67 79.071 16.435 -5.255 503 HD3 LYS 67 HD1 LYS 67 79.588 14.793 -4.881 504 HE2 LYS 67 HE2 LYS 67 80.907 14.653 -6.872 505 HE3 LYS 67 HE1 LYS 67 80.182 16.113 -7.544 506 HZ1 LYS 67 HZ1 LYS 67 82.355 15.847 -5.702 507 HZ2 LYS 67 HZ2 LYS 67 81.163 16.919 -5.141 508 HZ3 LYS 67 HZ3 LYS 67 81.897 17.175 -6.652 509 H VAL 68 HN VAL 68 75.590 11.494 -8.909 510 HA VAL 68 HA VAL 68 77.066 8.992 -8.528 511 HB VAL 68 HB VAL 68 74.510 9.162 -8.588 512 HG11 VAL 68 HG11 VAL 68 74.521 10.681 -10.627 513 HG12 VAL 68 HG12 VAL 68 73.426 9.303 -10.723 514 HG13 VAL 68 HG13 VAL 68 74.963 9.266 -11.582 515 HG21 VAL 68 HG21 VAL 68 74.326 7.045 -9.905 516 HG22 VAL 68 HG22 VAL 68 75.668 7.026 -8.760 517 HG23 VAL 68 HG23 VAL 68 75.976 7.295 -10.476 518 H THR 69 HN THR 69 78.271 8.005 -10.098 519 HA THR 69 HA THR 69 78.629 9.446 -12.674 520 HB THR 69 HB THR 69 80.811 8.021 -11.126 521 HG1 THR 69 HG1 THR 69 80.039 9.946 -10.100 522 HG21 THR 69 HG21 THR 69 82.275 9.169 -12.736 523 HG22 THR 69 HG22 THR 69 80.865 9.902 -13.505 524 HG23 THR 69 HG23 THR 69 81.103 8.159 -13.582 525 H LEU 70 HN LEU 70 78.385 8.192 -14.434 526 HA LEU 70 HA LEU 70 77.257 5.705 -14.409 527 HB2 LEU 70 HB2 LEU 70 78.187 5.396 -16.729 528 HB3 LEU 70 HB1 LEU 70 77.319 6.904 -16.461 529 HG LEU 70 HG LEU 70 79.833 7.748 -15.834 530 HD11 LEU 70 HD11 LEU 70 81.415 6.768 -17.479 531 HD12 LEU 70 HD12 LEU 70 80.200 5.565 -17.911 532 HD13 LEU 70 HD13 LEU 70 80.891 5.582 -16.290 533 HD21 LEU 70 HD21 LEU 70 78.335 8.772 -17.509 534 HD22 LEU 70 HD22 LEU 70 78.734 7.490 -18.652 535 HD23 LEU 70 HD23 LEU 70 79.977 8.629 -18.135 536 H GLU 71 HN GLU 71 80.495 6.475 -13.651 537 HA GLU 71 HA GLU 71 81.678 3.944 -14.236 538 HB2 GLU 71 HB2 GLU 71 82.520 6.182 -12.386 539 HB3 GLU 71 HB1 GLU 71 83.492 4.745 -12.692 540 HG2 GLU 71 HG2 GLU 71 83.525 5.263 -15.097 541 HG3 GLU 71 HG1 GLU 71 82.528 6.688 -14.810 542 H ASP 72 HN ASP 72 79.980 5.285 -11.460 543 HA ASP 72 HA ASP 72 80.732 3.506 -9.471 544 HB2 ASP 72 HB2 ASP 72 79.300 5.504 -9.134 545 HB3 ASP 72 HB1 ASP 72 77.961 4.645 -9.894 546 H ALA 73 HN ALA 73 77.602 3.202 -11.190 547 HA ALA 73 HA ALA 73 76.260 1.300 -11.365 548 HB1 ALA 73 HB1 ALA 73 77.362 -0.337 -12.954 549 HB2 ALA 73 HB2 ALA 73 78.817 0.654 -12.837 550 HB3 ALA 73 HB3 ALA 73 77.331 1.341 -13.495 551 H GLY 74 HN GLY 74 75.965 0.445 -9.315 552 HA2 GLY 74 HA2 GLY 74 77.661 -1.899 -8.673 553 HA3 GLY 74 HA1 GLY 74 77.304 -0.698 -7.438 554 H THR 75 HN THR 75 76.630 -3.222 -6.911 555 HA THR 75 HA THR 75 73.688 -3.355 -7.310 556 HB THR 75 HB THR 75 75.590 -5.648 -6.748 557 HG1 THR 75 HG1 THR 75 74.526 -4.571 -9.128 558 HG21 THR 75 HG21 THR 75 73.723 -7.064 -7.201 559 HG22 THR 75 HG22 THR 75 72.763 -5.718 -7.817 560 HG23 THR 75 HG23 THR 75 73.122 -5.830 -6.094 561 H VAL 76 HN VAL 76 72.609 -2.812 -5.499 562 HA VAL 76 HA VAL 76 73.928 -3.097 -2.877 563 HB VAL 76 HB VAL 76 71.205 -1.926 -3.437 564 HG11 VAL 76 HG11 VAL 76 71.821 -2.519 -1.097 565 HG12 VAL 76 HG12 VAL 76 71.578 -0.788 -1.324 566 HG13 VAL 76 HG13 VAL 76 73.212 -1.445 -1.226 567 HG21 VAL 76 HG21 VAL 76 73.899 -0.539 -3.394 568 HG22 VAL 76 HG22 VAL 76 72.337 0.271 -3.498 569 HG23 VAL 76 HG23 VAL 76 72.885 -0.760 -4.821 570 H SER 77 HN SER 77 73.373 -4.636 -1.421 571 HA SER 77 HA SER 77 70.887 -6.185 -1.835 572 HB2 SER 77 HB2 SER 77 71.981 -8.249 -1.820 573 HB3 SER 77 HB1 SER 77 73.059 -7.262 -2.801 574 HG SER 77 HG SER 77 73.311 -7.631 0.005 575 H PHE 78 HN PHE 78 70.196 -7.382 0.032 576 HA PHE 78 HA PHE 78 71.359 -6.492 2.612 577 HB2 PHE 78 HB2 PHE 78 68.385 -6.852 2.316 578 HB3 PHE 78 HB1 PHE 78 69.283 -5.875 3.477 579 HD1 PHE 78 HD1 PHE 78 70.864 -4.015 2.284 580 HD2 PHE 78 HD2 PHE 78 67.266 -5.690 0.629 581 HE1 PHE 78 HE1 PHE 78 70.607 -2.033 0.815 582 HE2 PHE 78 HE2 PHE 78 67.015 -3.708 -0.834 583 HZ PHE 78 HZ PHE 78 68.685 -1.879 -0.741 584 H HIS 79 HN HIS 79 71.307 -8.039 4.253 585 HA HIS 79 HA HIS 79 70.106 -10.666 3.616 586 HB2 HIS 79 HB2 HIS 79 72.502 -10.683 2.940 587 HB3 HIS 79 HB1 HIS 79 72.941 -10.296 4.605 588 HD1 HIS 79 HD1 HIS 79 72.366 -12.115 6.439 589 HD2 HIS 79 HD2 HIS 79 71.799 -13.376 2.505 590 HE1 HIS 79 HE1 HIS 79 72.144 -14.635 6.521 591 H VAL 80 HN VAL 80 68.759 -11.119 5.215 592 HA VAL 80 HA VAL 80 69.595 -10.545 8.007 593 HB VAL 80 HB VAL 80 66.693 -10.664 7.213 594 HG11 VAL 80 HG11 VAL 80 67.245 -10.617 9.592 595 HG12 VAL 80 HG12 VAL 80 66.514 -9.082 9.128 596 HG13 VAL 80 HG13 VAL 80 68.259 -9.194 9.356 597 HG21 VAL 80 HG21 VAL 80 67.530 -9.056 5.647 598 HG22 VAL 80 HG22 VAL 80 68.571 -8.321 6.859 599 HG23 VAL 80 HG23 VAL 80 66.823 -8.141 6.975 600 H GLY 81 HN GLY 81 69.649 -12.272 9.312 601 HA2 GLY 81 HA2 GLY 81 69.665 -14.869 8.591 602 HA3 GLY 81 HA1 GLY 81 69.150 -14.366 10.193 603 H THR 82 HN THR 82 66.797 -12.929 8.804 604 HA THR 82 HA THR 82 64.988 -15.203 8.958 605 HB THR 82 HB THR 82 63.240 -13.413 8.488 606 HG1 THR 82 HG1 THR 82 63.879 -11.431 8.180 607 HG21 THR 82 HG21 THR 82 65.123 -13.182 10.844 608 HG22 THR 82 HG22 THR 82 63.612 -14.090 10.755 609 HG23 THR 82 HG23 THR 82 63.581 -12.330 10.749 610 H CYS 83 HN CYS 83 65.024 -12.538 6.628 611 HA CYS 83 HA CYS 83 64.805 -14.501 4.410 612 HB2 CYS 83 HB2 CYS 83 63.410 -11.822 4.561 613 HB3 CYS 83 HB1 CYS 83 63.217 -13.060 3.320 614 HG CYS 83 HG CYS 83 62.184 -13.341 6.256 615 H SER 84 HN SER 84 65.467 -13.611 2.311 616 HA SER 84 HA SER 84 67.498 -11.458 2.529 617 HB2 SER 84 HB2 SER 84 67.759 -14.145 1.172 618 HB3 SER 84 HB1 SER 84 68.868 -12.802 0.907 619 HG SER 84 HG SER 84 69.797 -13.772 2.571 620 H SER 85 HN SER 85 67.940 -10.330 0.564 621 HA SER 85 HA SER 85 66.268 -10.796 -1.766 622 HB2 SER 85 HB2 SER 85 65.145 -8.644 -1.700 623 HB3 SER 85 HB1 SER 85 64.778 -9.527 -0.218 624 HG SER 85 HG SER 85 67.063 -8.061 -0.029 625 H GLU 86 HN GLU 86 66.793 -9.248 -3.528 626 HA GLU 86 HA GLU 86 69.379 -7.855 -3.178 627 HB2 GLU 86 HB2 GLU 86 68.734 -9.885 -5.332 628 HB3 GLU 86 HB1 GLU 86 70.118 -8.796 -5.381 629 HG2 GLU 86 HG2 GLU 86 71.040 -10.739 -4.443 630 HG3 GLU 86 HG1 GLU 86 70.669 -9.777 -3.017 631 H ALA 87 HN ALA 87 69.800 -6.219 -4.679 632 HA ALA 87 HA ALA 87 67.615 -5.395 -6.482 633 HB1 ALA 87 HB1 ALA 87 68.086 -3.000 -5.621 634 HB2 ALA 87 HB2 ALA 87 68.799 -3.794 -4.216 635 HB3 ALA 87 HB3 ALA 87 67.100 -4.054 -4.608 636 H GLN 88 HN GLN 88 68.324 -4.111 -8.238 637 HA GLN 88 HA GLN 88 71.275 -4.035 -8.623 638 HB2 GLN 88 HB2 GLN 88 69.059 -4.570 -10.609 639 HB3 GLN 88 HB1 GLN 88 70.740 -4.287 -11.058 640 HG2 GLN 88 HG2 GLN 88 71.462 -6.224 -9.783 641 HG3 GLN 88 HG1 GLN 88 69.830 -6.468 -9.160 642 HE21 GLN 88 HE21 GLN 88 70.408 -8.698 -10.317 643 HE22 GLN 88 HE22 GLN 88 69.913 -8.815 -11.938 644 H LEU 89 HN LEU 89 72.140 -2.114 -8.940 645 HA LEU 89 HA LEU 89 70.429 0.152 -9.820 646 HB2 LEU 89 HB2 LEU 89 71.319 0.465 -7.546 647 HB3 LEU 89 HB1 LEU 89 72.952 0.160 -8.128 648 HG LEU 89 HG LEU 89 72.838 2.155 -9.560 649 HD11 LEU 89 HD11 LEU 89 70.804 3.719 -9.006 650 HD12 LEU 89 HD12 LEU 89 70.001 2.221 -8.535 651 HD13 LEU 89 HD13 LEU 89 70.590 2.428 -10.185 652 HD21 LEU 89 HD21 LEU 89 71.999 2.671 -6.689 653 HD22 LEU 89 HD22 LEU 89 72.809 3.833 -7.743 654 HD23 LEU 89 HD23 LEU 89 73.646 2.365 -7.241 655 H LYS 90 HN LYS 90 70.802 0.642 -11.877 656 HA LYS 90 HA LYS 90 73.573 0.452 -12.931 657 HB2 LYS 90 HB2 LYS 90 70.985 -0.305 -14.296 658 HB3 LYS 90 HB1 LYS 90 72.541 -0.186 -15.115 659 HG2 LYS 90 HG2 LYS 90 73.480 -1.867 -13.546 660 HG3 LYS 90 HG1 LYS 90 71.897 -2.025 -12.788 661 HD2 LYS 90 HD2 LYS 90 72.309 -2.490 -15.749 662 HD3 LYS 90 HD1 LYS 90 72.504 -3.780 -14.566 663 HE2 LYS 90 HE2 LYS 90 70.165 -3.261 -13.748 664 HE3 LYS 90 HE1 LYS 90 69.992 -2.180 -15.131 665 HZ1 LYS 90 HZ1 LYS 90 69.149 -4.456 -15.517 666 HZ2 LYS 90 HZ2 LYS 90 70.736 -5.038 -15.354 667 HZ3 LYS 90 HZ3 LYS 90 70.343 -3.974 -16.621 668 H VAL 91 HN VAL 91 74.193 2.060 -14.389 669 HA VAL 91 HA VAL 91 72.428 4.444 -14.425 670 HB VAL 91 HB VAL 91 75.375 4.450 -15.078 671 HG11 VAL 91 HG11 VAL 91 73.987 6.457 -15.565 672 HG12 VAL 91 HG12 VAL 91 75.183 6.777 -14.308 673 HG13 VAL 91 HG13 VAL 91 73.496 6.509 -13.871 674 HG21 VAL 91 HG21 VAL 91 74.030 4.377 -12.370 675 HG22 VAL 91 HG22 VAL 91 75.608 5.134 -12.597 676 HG23 VAL 91 HG23 VAL 91 75.396 3.417 -12.943 677 H THR 92 HN THR 92 71.532 5.023 -16.280 678 HA THR 92 HA THR 92 72.419 3.710 -18.764 679 HB THR 92 HB THR 92 70.021 3.611 -18.160 680 HG1 THR 92 HG1 THR 92 71.073 4.166 -20.432 681 HG21 THR 92 HG21 THR 92 68.672 5.577 -18.068 682 HG22 THR 92 HG22 THR 92 69.988 6.589 -18.670 683 HG23 THR 92 HG23 THR 92 70.073 5.904 -17.047 684 H ALA 93 HN ALA 93 72.381 5.023 -20.761 685 HA ALA 93 HA ALA 93 73.978 7.412 -20.396 686 HB1 ALA 93 HB1 ALA 93 74.255 7.353 -22.791 687 HB2 ALA 93 HB2 ALA 93 72.920 6.214 -22.965 688 HB3 ALA 93 HB3 ALA 93 74.418 5.705 -22.184 689 H GLY 94 HN GLY 94 70.722 6.754 -20.418 690 HA2 GLY 94 HA2 GLY 94 68.968 8.281 -20.222 691 HA3 GLY 94 HA1 GLY 94 70.047 9.562 -20.764 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 52.881 -16.556 18.153 2 H2 MET 1 HT2 MET 1 51.980 -16.355 16.727 3 H3 MET 1 HT3 MET 1 53.278 -15.313 17.069 4 HA MET 1 HA MET 1 53.625 -18.227 16.711 5 HB2 MET 1 HB2 MET 1 53.726 -15.992 14.673 6 HB3 MET 1 HB1 MET 1 54.441 -17.584 14.405 7 HG2 MET 1 HG2 MET 1 52.229 -18.630 14.811 8 HG3 MET 1 HG1 MET 1 51.525 -17.029 15.027 9 HE1 MET 1 HE1 MET 1 49.995 -17.982 11.670 10 HE2 MET 1 HE2 MET 1 49.744 -17.157 13.206 11 HE3 MET 1 HE3 MET 1 50.195 -18.860 13.193 12 H ALA 2 HN ALA 2 55.600 -15.941 15.089 13 HA ALA 2 HA ALA 2 57.494 -15.567 17.249 14 HB1 ALA 2 HB1 ALA 2 57.947 -17.907 16.492 15 HB2 ALA 2 HB2 ALA 2 59.314 -16.819 16.252 16 HB3 ALA 2 HB3 ALA 2 58.299 -17.275 14.884 17 HA PRO 3 HA PRO 3 57.477 -12.442 13.799 18 HB2 PRO 3 HB2 PRO 3 57.543 -10.377 15.851 19 HB3 PRO 3 HB1 PRO 3 56.290 -10.687 14.642 20 HG2 PRO 3 HG2 PRO 3 56.101 -11.158 17.407 21 HG3 PRO 3 HG1 PRO 3 54.978 -11.720 16.161 22 HD2 PRO 3 HD2 PRO 3 56.971 -13.269 17.678 23 HD3 PRO 3 HD1 PRO 3 55.607 -13.853 16.705 24 H GLU 4 HN GLU 4 59.238 -11.221 13.070 25 HA GLU 4 HA GLU 4 61.578 -10.907 14.811 26 HB2 GLU 4 HB2 GLU 4 63.082 -11.984 13.191 27 HB3 GLU 4 HB1 GLU 4 61.888 -13.125 13.794 28 HG2 GLU 4 HG2 GLU 4 61.575 -11.612 11.182 29 HG3 GLU 4 HG1 GLU 4 62.254 -13.233 11.302 30 H VAL 5 HN VAL 5 63.208 -10.461 12.334 31 HA VAL 5 HA VAL 5 62.673 -7.659 12.059 32 HB VAL 5 HB VAL 5 64.956 -8.693 12.016 33 HG11 VAL 5 HG11 VAL 5 64.120 -10.593 10.482 34 HG12 VAL 5 HG12 VAL 5 65.716 -9.919 10.159 35 HG13 VAL 5 HG13 VAL 5 64.339 -9.440 9.167 36 HG21 VAL 5 HG21 VAL 5 64.531 -6.418 11.159 37 HG22 VAL 5 HG22 VAL 5 64.152 -7.091 9.572 38 HG23 VAL 5 HG23 VAL 5 65.788 -7.221 10.218 39 H THR 6 HN THR 6 61.541 -6.611 10.513 40 HA THR 6 HA THR 6 60.627 -8.200 8.154 41 HB THR 6 HB THR 6 59.152 -5.996 9.604 42 HG1 THR 6 HG1 THR 6 59.250 -8.105 10.611 43 HG21 THR 6 HG21 THR 6 57.291 -6.823 8.044 44 HG22 THR 6 HG22 THR 6 58.576 -7.595 7.113 45 HG23 THR 6 HG23 THR 6 58.564 -5.844 7.316 46 H ILE 7 HN ILE 7 61.177 -7.435 6.212 47 HA ILE 7 HA ILE 7 62.038 -4.601 6.001 48 HB ILE 7 HB ILE 7 63.121 -6.800 4.245 49 HG12 ILE 7 HG12 ILE 7 65.174 -6.434 5.970 50 HG13 ILE 7 HG11 ILE 7 63.848 -6.138 7.090 51 HG21 ILE 7 HG21 ILE 7 63.393 -4.431 3.569 52 HG22 ILE 7 HG22 ILE 7 64.941 -5.193 3.927 53 HG23 ILE 7 HG23 ILE 7 64.207 -4.098 5.095 54 HD11 ILE 7 HD11 ILE 7 62.882 -8.329 6.575 55 HD12 ILE 7 HD12 ILE 7 64.568 -8.529 7.035 56 HD13 ILE 7 HD13 ILE 7 64.105 -8.606 5.338 57 H LEU 8 HN LEU 8 60.595 -3.511 4.918 58 HA LEU 8 HA LEU 8 59.189 -4.738 2.615 59 HB2 LEU 8 HB2 LEU 8 58.546 -2.327 4.331 60 HB3 LEU 8 HB1 LEU 8 57.691 -2.710 2.842 61 HG LEU 8 HG LEU 8 57.965 -4.668 5.139 62 HD11 LEU 8 HD11 LEU 8 55.493 -3.986 5.518 63 HD12 LEU 8 HD12 LEU 8 55.898 -2.531 4.607 64 HD13 LEU 8 HD13 LEU 8 56.747 -2.897 6.109 65 HD21 LEU 8 HD21 LEU 8 57.268 -5.986 3.372 66 HD22 LEU 8 HD22 LEU 8 56.532 -4.644 2.500 67 HD23 LEU 8 HD23 LEU 8 55.689 -5.380 3.860 68 H GLU 9 HN GLU 9 60.793 -4.487 1.083 69 HA GLU 9 HA GLU 9 61.702 -1.719 0.508 70 HB2 GLU 9 HB2 GLU 9 63.567 -3.070 -0.724 71 HB3 GLU 9 HB1 GLU 9 63.626 -2.898 1.033 72 HG2 GLU 9 HG2 GLU 9 62.713 -5.085 1.371 73 HG3 GLU 9 HG1 GLU 9 62.308 -5.254 -0.336 74 HA PRO 10 HA PRO 10 59.124 -2.911 -3.127 75 HB2 PRO 10 HB2 PRO 10 58.517 -0.100 -3.517 76 HB3 PRO 10 HB1 PRO 10 57.424 -1.393 -3.002 77 HG2 PRO 10 HG2 PRO 10 58.362 0.720 -1.412 78 HG3 PRO 10 HG1 PRO 10 57.535 -0.738 -0.843 79 HD2 PRO 10 HD2 PRO 10 60.413 -0.047 -0.688 80 HD3 PRO 10 HD1 PRO 10 59.473 -1.204 0.276 81 H LEU 11 HN LEU 11 61.855 -0.918 -2.640 82 HA LEU 11 HA LEU 11 62.228 -0.430 -5.521 83 HB2 LEU 11 HB2 LEU 11 64.423 0.704 -4.474 84 HB3 LEU 11 HB1 LEU 11 62.879 1.543 -4.523 85 HG LEU 11 HG LEU 11 62.423 0.703 -2.186 86 HD11 LEU 11 HD11 LEU 11 65.304 -0.213 -2.460 87 HD12 LEU 11 HD12 LEU 11 63.899 -1.230 -2.140 88 HD13 LEU 11 HD13 LEU 11 64.455 -0.082 -0.920 89 HD21 LEU 11 HD21 LEU 11 63.153 2.935 -2.294 90 HD22 LEU 11 HD22 LEU 11 64.765 2.486 -2.845 91 HD23 LEU 11 HD23 LEU 11 64.294 2.203 -1.169 92 H GLN 12 HN GLN 12 62.339 -2.853 -5.651 93 HA GLN 12 HA GLN 12 64.751 -4.139 -4.729 94 HB2 GLN 12 HB2 GLN 12 62.562 -4.997 -6.633 95 HB3 GLN 12 HB1 GLN 12 63.938 -6.014 -6.213 96 HG2 GLN 12 HG2 GLN 12 63.316 -5.933 -3.848 97 HG3 GLN 12 HG1 GLN 12 61.981 -4.839 -4.218 98 HE21 GLN 12 HE21 GLN 12 62.358 -7.934 -3.370 99 HE22 GLN 12 HE22 GLN 12 61.167 -8.680 -4.322 100 H ASP 13 HN ASP 13 64.168 -1.918 -7.078 101 HA ASP 13 HA ASP 13 66.696 -2.227 -8.337 102 HB2 ASP 13 HB2 ASP 13 65.854 -2.706 -10.629 103 HB3 ASP 13 HB1 ASP 13 65.652 -4.061 -9.522 104 H VAL 14 HN VAL 14 67.258 -0.373 -9.469 105 HA VAL 14 HA VAL 14 65.133 1.654 -9.896 106 HB VAL 14 HB VAL 14 66.735 3.370 -9.019 107 HG11 VAL 14 HG11 VAL 14 65.815 1.145 -7.173 108 HG12 VAL 14 HG12 VAL 14 64.939 2.620 -7.581 109 HG13 VAL 14 HG13 VAL 14 66.404 2.707 -6.603 110 HG21 VAL 14 HG21 VAL 14 68.204 0.959 -7.911 111 HG22 VAL 14 HG22 VAL 14 68.653 2.655 -7.732 112 HG23 VAL 14 HG23 VAL 14 68.762 1.877 -9.310 113 H GLN 15 HN GLN 15 65.648 3.295 -11.426 114 HA GLN 15 HA GLN 15 67.969 2.778 -13.185 115 HB2 GLN 15 HB2 GLN 15 65.084 3.069 -14.055 116 HB3 GLN 15 HB1 GLN 15 66.460 3.168 -15.153 117 HG2 GLN 15 HG2 GLN 15 67.143 0.909 -14.564 118 HG3 GLN 15 HG1 GLN 15 65.851 0.800 -13.368 119 HE21 GLN 15 HE21 GLN 15 63.977 -0.180 -14.120 120 HE22 GLN 15 HE22 GLN 15 63.510 -0.270 -15.748 121 H LEU 16 HN LEU 16 69.082 4.612 -13.372 122 HA LEU 16 HA LEU 16 67.700 7.140 -13.817 123 HB2 LEU 16 HB2 LEU 16 68.803 8.308 -11.990 124 HB3 LEU 16 HB1 LEU 16 67.832 6.981 -11.363 125 HG LEU 16 HG LEU 16 70.361 5.802 -11.837 126 HD11 LEU 16 HD11 LEU 16 71.309 8.092 -12.078 127 HD12 LEU 16 HD12 LEU 16 71.955 7.239 -10.677 128 HD13 LEU 16 HD13 LEU 16 70.723 8.480 -10.460 129 HD21 LEU 16 HD21 LEU 16 69.006 5.219 -9.938 130 HD22 LEU 16 HD22 LEU 16 69.071 6.866 -9.309 131 HD23 LEU 16 HD23 LEU 16 70.522 5.864 -9.309 132 H SER 17 HN SER 17 68.861 8.531 -15.059 133 HA SER 17 HA SER 17 71.242 7.517 -16.302 134 HB2 SER 17 HB2 SER 17 69.692 10.088 -16.589 135 HB3 SER 17 HB1 SER 17 71.198 9.801 -17.453 136 HG SER 17 HG SER 17 68.719 8.486 -17.649 137 H GLU 18 HN GLU 18 73.323 8.440 -16.264 138 HA GLU 18 HA GLU 18 74.344 9.124 -13.756 139 HB2 GLU 18 HB2 GLU 18 75.657 8.215 -15.677 140 HB3 GLU 18 HB1 GLU 18 75.575 9.804 -16.436 141 HG2 GLU 18 HG2 GLU 18 76.708 10.806 -14.498 142 HG3 GLU 18 HG1 GLU 18 76.756 9.234 -13.703 143 H GLY 19 HN GLY 19 75.064 11.050 -12.833 144 HA2 GLY 19 HA2 GLY 19 75.384 13.380 -12.665 145 HA3 GLY 19 HA1 GLY 19 74.507 13.596 -14.173 146 H GLN 20 HN GLN 20 72.552 11.565 -12.671 147 HA GLN 20 HA GLN 20 70.877 13.724 -11.568 148 HB2 GLN 20 HB2 GLN 20 70.259 10.879 -12.379 149 HB3 GLN 20 HB1 GLN 20 69.086 11.980 -11.654 150 HG2 GLN 20 HG2 GLN 20 69.411 13.574 -13.489 151 HG3 GLN 20 HG1 GLN 20 70.624 12.518 -14.211 152 HE21 GLN 20 HE21 GLN 20 67.487 13.384 -14.646 153 HE22 GLN 20 HE22 GLN 20 66.856 11.930 -15.253 154 H ASP 21 HN ASP 21 69.766 13.429 -9.558 155 HA ASP 21 HA ASP 21 71.466 12.353 -7.508 156 HB2 ASP 21 HB2 ASP 21 69.668 13.131 -5.973 157 HB3 ASP 21 HB1 ASP 21 70.213 14.391 -7.078 158 H ALA 22 HN ALA 22 71.010 10.668 -6.075 159 HA ALA 22 HA ALA 22 68.807 8.829 -6.806 160 HB1 ALA 22 HB1 ALA 22 70.368 6.924 -6.483 161 HB2 ALA 22 HB2 ALA 22 71.700 8.068 -6.330 162 HB3 ALA 22 HB3 ALA 22 70.823 7.938 -7.853 163 H SER 23 HN SER 23 68.018 7.583 -5.077 164 HA SER 23 HA SER 23 69.202 7.753 -2.455 165 HB2 SER 23 HB2 SER 23 68.161 9.980 -2.601 166 HB3 SER 23 HB1 SER 23 66.610 9.236 -2.975 167 HG SER 23 HG SER 23 67.920 9.511 -0.584 168 H PHE 24 HN PHE 24 67.960 6.551 -0.849 169 HA PHE 24 HA PHE 24 65.964 4.688 -2.018 170 HB2 PHE 24 HB2 PHE 24 68.354 4.041 -0.284 171 HB3 PHE 24 HB1 PHE 24 66.996 2.939 -0.489 172 HD1 PHE 24 HD1 PHE 24 69.583 4.859 -2.376 173 HD2 PHE 24 HD2 PHE 24 66.845 1.551 -2.393 174 HE1 PHE 24 HE1 PHE 24 70.570 4.050 -4.503 175 HE2 PHE 24 HE2 PHE 24 67.823 0.746 -4.523 176 HZ PHE 24 HZ PHE 24 69.691 1.992 -5.576 177 H GLN 25 HN GLN 25 64.287 4.115 -0.705 178 HA GLN 25 HA GLN 25 64.275 5.010 2.092 179 HB2 GLN 25 HB2 GLN 25 61.888 5.882 1.656 180 HB3 GLN 25 HB1 GLN 25 63.239 6.891 1.139 181 HG2 GLN 25 HG2 GLN 25 63.038 6.026 -1.150 182 HG3 GLN 25 HG1 GLN 25 61.709 4.981 -0.654 183 HE21 GLN 25 HE21 GLN 25 60.390 6.231 -2.293 184 HE22 GLN 25 HE22 GLN 25 59.753 7.739 -1.843 185 H CYS 26 HN CYS 26 63.690 3.322 3.293 186 HA CYS 26 HA CYS 26 61.466 1.619 2.424 187 HB2 CYS 26 HB2 CYS 26 63.020 -0.412 3.084 188 HB3 CYS 26 HB1 CYS 26 63.108 0.275 1.463 189 HG CYS 26 HG CYS 26 65.549 0.251 2.268 190 H ARG 27 HN ARG 27 60.655 0.242 4.099 191 HA ARG 27 HA ARG 27 61.109 1.346 6.807 192 HB2 ARG 27 HB2 ARG 27 58.849 -0.279 5.611 193 HB3 ARG 27 HB1 ARG 27 58.966 0.116 7.327 194 HG2 ARG 27 HG2 ARG 27 58.986 2.510 6.790 195 HG3 ARG 27 HG1 ARG 27 58.905 2.139 5.068 196 HD2 ARG 27 HD2 ARG 27 56.741 0.964 5.467 197 HD3 ARG 27 HD1 ARG 27 56.815 1.460 7.156 198 HE ARG 27 HE ARG 27 56.191 3.150 4.873 199 HH11 ARG 27 HH11 ARG 27 56.215 2.752 8.258 200 HH12 ARG 27 HH12 ARG 27 56.122 4.444 8.618 201 HH21 ARG 27 HH21 ARG 27 56.493 5.440 5.315 202 HH22 ARG 27 HH22 ARG 27 56.290 5.967 6.951 203 H LEU 28 HN LEU 28 61.697 0.010 8.532 204 HA LEU 28 HA LEU 28 62.067 -2.851 7.979 205 HB2 LEU 28 HB2 LEU 28 64.134 -1.294 7.444 206 HB3 LEU 28 HB1 LEU 28 64.371 -1.355 9.186 207 HG LEU 28 HG LEU 28 64.108 -3.779 7.383 208 HD11 LEU 28 HD11 LEU 28 66.227 -2.296 7.191 209 HD12 LEU 28 HD12 LEU 28 66.449 -4.019 7.480 210 HD13 LEU 28 HD13 LEU 28 66.605 -2.875 8.815 211 HD21 LEU 28 HD21 LEU 28 65.109 -4.836 9.544 212 HD22 LEU 28 HD22 LEU 28 63.387 -4.465 9.509 213 HD23 LEU 28 HD23 LEU 28 64.505 -3.387 10.346 214 H SER 29 HN SER 29 60.584 -3.433 9.555 215 HA SER 29 HA SER 29 60.376 -2.305 12.126 216 HB2 SER 29 HB2 SER 29 58.904 -4.040 12.616 217 HB3 SER 29 HB1 SER 29 58.840 -4.044 10.856 218 HG SER 29 HG SER 29 60.342 -5.722 12.582 219 H ARG 30 HN ARG 30 60.954 -3.287 14.164 220 HA ARG 30 HA ARG 30 63.688 -3.723 14.461 221 HB2 ARG 30 HB2 ARG 30 63.182 -4.276 16.763 222 HB3 ARG 30 HB1 ARG 30 62.140 -2.955 16.243 223 HG2 ARG 30 HG2 ARG 30 60.329 -4.607 15.775 224 HG3 ARG 30 HG1 ARG 30 61.363 -5.887 16.405 225 HD2 ARG 30 HD2 ARG 30 61.467 -4.752 18.583 226 HD3 ARG 30 HD1 ARG 30 60.446 -3.456 17.964 227 HE ARG 30 HE ARG 30 59.225 -6.038 17.657 228 HH11 ARG 30 HH11 ARG 30 57.417 -6.452 18.960 229 HH12 ARG 30 HH12 ARG 30 57.133 -5.491 20.372 230 HH21 ARG 30 HH21 ARG 30 59.925 -3.486 19.889 231 HH22 ARG 30 HH22 ARG 30 58.550 -3.805 20.894 232 H ALA 31 HN ALA 31 64.851 -5.542 15.194 233 HA ALA 31 HA ALA 31 63.951 -8.075 13.990 234 HB1 ALA 31 HB1 ALA 31 66.715 -7.389 14.993 235 HB2 ALA 31 HB2 ALA 31 66.176 -7.035 13.351 236 HB3 ALA 31 HB3 ALA 31 66.253 -8.704 13.917 237 H SER 32 HN SER 32 65.344 -9.929 15.269 238 HA SER 32 HA SER 32 64.818 -9.687 18.165 239 HB2 SER 32 HB2 SER 32 62.818 -10.729 16.910 240 HB3 SER 32 HB1 SER 32 63.879 -12.102 16.608 241 HG SER 32 HG SER 32 62.821 -12.493 18.518 242 H GLY 33 HN GLY 33 65.740 -12.003 15.656 243 HA2 GLY 33 HA2 GLY 33 67.796 -13.178 17.334 244 HA3 GLY 33 HA1 GLY 33 67.377 -13.652 15.687 245 H GLN 34 HN GLN 34 68.013 -12.179 13.942 246 HA GLN 34 HA GLN 34 70.453 -10.630 14.576 247 HB2 GLN 34 HB2 GLN 34 71.061 -12.745 13.505 248 HB3 GLN 34 HB1 GLN 34 69.945 -12.413 12.182 249 HG2 GLN 34 HG2 GLN 34 71.238 -10.469 11.511 250 HG3 GLN 34 HG1 GLN 34 72.293 -10.641 12.914 251 HE21 GLN 34 HE21 GLN 34 73.097 -10.764 10.052 252 HE22 GLN 34 HE22 GLN 34 73.782 -12.300 9.828 253 H GLU 35 HN GLU 35 70.759 -8.710 13.516 254 HA GLU 35 HA GLU 35 68.378 -7.586 12.224 255 HB2 GLU 35 HB2 GLU 35 69.446 -5.431 12.566 256 HB3 GLU 35 HB1 GLU 35 69.483 -6.353 14.066 257 HG2 GLU 35 HG2 GLU 35 71.815 -7.043 13.566 258 HG3 GLU 35 HG1 GLU 35 71.776 -6.065 12.099 259 H ALA 36 HN ALA 36 68.361 -6.668 10.179 260 HA ALA 36 HA ALA 36 70.061 -7.881 8.232 261 HB1 ALA 36 HB1 ALA 36 68.020 -5.661 8.009 262 HB2 ALA 36 HB2 ALA 36 67.759 -7.370 7.679 263 HB3 ALA 36 HB3 ALA 36 68.814 -6.422 6.632 264 H ARG 37 HN ARG 37 71.498 -6.878 6.786 265 HA ARG 37 HA ARG 37 72.572 -4.232 7.590 266 HB2 ARG 37 HB2 ARG 37 74.232 -6.629 6.765 267 HB3 ARG 37 HB1 ARG 37 74.836 -5.056 7.271 268 HG2 ARG 37 HG2 ARG 37 73.133 -6.814 9.056 269 HG3 ARG 37 HG1 ARG 37 74.894 -6.885 9.047 270 HD2 ARG 37 HD2 ARG 37 73.169 -4.502 9.759 271 HD3 ARG 37 HD1 ARG 37 74.221 -5.413 10.830 272 HE ARG 37 HE ARG 37 75.964 -4.544 8.962 273 HH11 ARG 37 HH11 ARG 37 76.374 -2.321 8.307 274 HH12 ARG 37 HH12 ARG 37 75.895 -1.068 9.404 275 HH21 ARG 37 HH21 ARG 37 74.078 -3.197 11.451 276 HH22 ARG 37 HH22 ARG 37 74.592 -1.564 11.183 277 H TRP 38 HN TRP 38 73.530 -3.024 5.907 278 HA TRP 38 HA TRP 38 72.339 -3.434 3.319 279 HB2 TRP 38 HB2 TRP 38 74.381 -1.469 4.357 280 HB3 TRP 38 HB1 TRP 38 73.790 -1.448 2.701 281 HD1 TRP 38 HD1 TRP 38 72.879 -0.541 6.232 282 HE1 TRP 38 HE1 TRP 38 70.646 0.732 6.245 283 HE3 TRP 38 HE3 TRP 38 71.421 -1.263 1.387 284 HZ2 TRP 38 HZ2 TRP 38 68.511 1.365 4.441 285 HZ3 TRP 38 HZ3 TRP 38 69.286 -0.306 0.560 286 HH2 TRP 38 HH2 TRP 38 67.832 1.005 2.081 287 H ALA 39 HN ALA 39 73.977 -3.066 1.364 288 HA ALA 39 HA ALA 39 76.537 -4.365 1.654 289 HB1 ALA 39 HB1 ALA 39 76.136 -6.370 0.514 290 HB2 ALA 39 HB2 ALA 39 74.616 -5.793 -0.173 291 HB3 ALA 39 HB3 ALA 39 74.704 -6.222 1.534 292 H LEU 40 HN LEU 40 77.869 -3.417 0.228 293 HA LEU 40 HA LEU 40 76.761 -2.466 -2.354 294 HB2 LEU 40 HB2 LEU 40 77.050 -0.523 -0.869 295 HB3 LEU 40 HB1 LEU 40 78.724 -0.984 -0.578 296 HG LEU 40 HG LEU 40 79.237 -0.680 -2.977 297 HD11 LEU 40 HD11 LEU 40 77.278 -1.151 -4.175 298 HD12 LEU 40 HD12 LEU 40 77.346 0.605 -4.278 299 HD13 LEU 40 HD13 LEU 40 76.269 -0.168 -3.113 300 HD21 LEU 40 HD21 LEU 40 78.879 1.801 -3.056 301 HD22 LEU 40 HD22 LEU 40 79.531 1.244 -1.515 302 HD23 LEU 40 HD23 LEU 40 77.821 1.654 -1.653 303 H GLY 41 HN GLY 41 77.729 -3.580 -3.920 304 HA2 GLY 41 HA2 GLY 41 79.409 -4.500 -5.214 305 HA3 GLY 41 HA1 GLY 41 80.572 -3.673 -4.180 306 H GLY 42 HN GLY 42 78.302 -5.613 -2.535 307 HA2 GLY 42 HA2 GLY 42 78.379 -7.866 -1.841 308 HA3 GLY 42 HA1 GLY 42 79.987 -8.017 -2.538 309 H VAL 43 HN VAL 43 80.748 -5.401 -1.176 310 HA VAL 43 HA VAL 43 81.338 -6.598 1.462 311 HB VAL 43 HB VAL 43 83.068 -4.681 1.523 312 HG11 VAL 43 HG11 VAL 43 83.885 -6.882 1.237 313 HG12 VAL 43 HG12 VAL 43 84.570 -5.984 -0.116 314 HG13 VAL 43 HG13 VAL 43 83.173 -7.030 -0.370 315 HG21 VAL 43 HG21 VAL 43 81.874 -3.536 -0.468 316 HG22 VAL 43 HG22 VAL 43 82.685 -4.737 -1.475 317 HG23 VAL 43 HG23 VAL 43 83.636 -3.606 -0.510 318 HA PRO 44 HA PRO 44 78.682 -3.780 3.578 319 HB2 PRO 44 HB2 PRO 44 80.630 -2.967 5.577 320 HB3 PRO 44 HB1 PRO 44 79.283 -4.097 5.761 321 HG2 PRO 44 HG2 PRO 44 82.106 -4.673 5.506 322 HG3 PRO 44 HG1 PRO 44 80.776 -5.782 5.868 323 HD2 PRO 44 HD2 PRO 44 82.243 -5.682 3.454 324 HD3 PRO 44 HD1 PRO 44 80.723 -6.556 3.719 325 H LEU 45 HN LEU 45 78.225 -1.598 3.505 326 HA LEU 45 HA LEU 45 80.158 0.097 2.118 327 HB2 LEU 45 HB2 LEU 45 78.366 1.468 1.520 328 HB3 LEU 45 HB1 LEU 45 77.634 -0.131 1.541 329 HG LEU 45 HG LEU 45 77.438 1.985 3.713 330 HD11 LEU 45 HD11 LEU 45 75.957 2.428 1.860 331 HD12 LEU 45 HD12 LEU 45 74.987 1.738 3.165 332 HD13 LEU 45 HD13 LEU 45 75.459 0.738 1.791 333 HD21 LEU 45 HD21 LEU 45 77.527 -0.141 4.848 334 HD22 LEU 45 HD22 LEU 45 76.512 -0.901 3.627 335 HD23 LEU 45 HD23 LEU 45 75.823 0.290 4.731 336 H GLN 46 HN GLN 46 80.036 2.516 2.868 337 HA GLN 46 HA GLN 46 80.014 2.767 5.791 338 HB2 GLN 46 HB2 GLN 46 82.332 2.085 5.181 339 HB3 GLN 46 HB1 GLN 46 82.444 3.486 4.119 340 HG2 GLN 46 HG2 GLN 46 83.482 4.001 6.268 341 HG3 GLN 46 HG1 GLN 46 82.024 4.967 6.080 342 HE21 GLN 46 HE21 GLN 46 80.718 4.958 7.913 343 HE22 GLN 46 HE22 GLN 46 80.643 3.699 9.047 344 H ALA 47 HN ALA 47 79.908 4.967 6.506 345 HA ALA 47 HA ALA 47 78.384 6.626 4.745 346 HB1 ALA 47 HB1 ALA 47 78.075 6.491 7.235 347 HB2 ALA 47 HB2 ALA 47 78.200 8.134 6.602 348 HB3 ALA 47 HB3 ALA 47 79.580 7.394 7.409 349 H ASN 48 HN ASN 48 80.132 6.721 3.062 350 HA ASN 48 HA ASN 48 82.500 8.232 3.473 351 HB2 ASN 48 HB2 ASN 48 80.920 7.873 0.916 352 HB3 ASN 48 HB1 ASN 48 82.616 8.338 1.045 353 HD21 ASN 48 HD21 ASN 48 81.066 5.782 0.011 354 HD22 ASN 48 HD22 ASN 48 81.960 4.514 0.699 355 H GLU 49 HN GLU 49 82.679 10.310 1.843 356 HA GLU 49 HA GLU 49 81.164 12.344 3.145 357 HB2 GLU 49 HB2 GLU 49 82.864 12.492 0.637 358 HB3 GLU 49 HB1 GLU 49 82.231 13.879 1.523 359 HG2 GLU 49 HG2 GLU 49 84.373 13.688 2.436 360 HG3 GLU 49 HG1 GLU 49 83.417 12.768 3.594 361 H MET 50 HN MET 50 81.034 10.956 -0.132 362 HA MET 50 HA MET 50 78.892 12.590 -1.046 363 HB2 MET 50 HB2 MET 50 79.827 9.872 -2.002 364 HB3 MET 50 HB1 MET 50 78.689 10.911 -2.859 365 HG2 MET 50 HG2 MET 50 80.412 12.693 -2.955 366 HG3 MET 50 HG1 MET 50 81.553 11.614 -2.156 367 HE1 MET 50 HE1 MET 50 81.214 8.701 -3.521 368 HE2 MET 50 HE2 MET 50 82.558 9.683 -2.948 369 HE3 MET 50 HE3 MET 50 82.587 9.037 -4.584 370 H ASN 51 HN ASN 51 79.034 9.402 0.474 371 HA ASN 51 HA ASN 51 76.114 9.112 0.364 372 HB2 ASN 51 HB2 ASN 51 78.270 7.268 1.432 373 HB3 ASN 51 HB1 ASN 51 76.557 6.877 1.311 374 HD21 ASN 51 HD21 ASN 51 79.132 8.187 -0.874 375 HD22 ASN 51 HD22 ASN 51 78.670 7.236 -2.203 376 H ASP 52 HN ASP 52 74.786 9.105 2.157 377 HA ASP 52 HA ASP 52 75.984 9.646 4.803 378 HB2 ASP 52 HB2 ASP 52 73.804 11.239 3.440 379 HB3 ASP 52 HB1 ASP 52 74.124 11.315 5.172 380 H ILE 53 HN ILE 53 74.982 8.603 6.449 381 HA ILE 53 HA ILE 53 72.632 6.937 5.765 382 HB ILE 53 HB ILE 53 74.643 6.605 8.007 383 HG12 ILE 53 HG12 ILE 53 75.461 6.293 5.546 384 HG13 ILE 53 HG11 ILE 53 75.796 5.017 6.704 385 HG21 ILE 53 HG21 ILE 53 72.661 5.527 8.673 386 HG22 ILE 53 HG22 ILE 53 73.600 4.235 7.926 387 HG23 ILE 53 HG23 ILE 53 72.287 4.998 7.031 388 HD11 ILE 53 HD11 ILE 53 73.255 4.851 5.116 389 HD12 ILE 53 HD12 ILE 53 74.264 3.558 5.751 390 HD13 ILE 53 HD13 ILE 53 74.775 4.451 4.322 391 H THR 54 HN THR 54 70.747 7.536 6.608 392 HA THR 54 HA THR 54 70.736 9.038 9.170 393 HB THR 54 HB THR 54 69.065 9.590 6.705 394 HG1 THR 54 HG1 THR 54 71.060 10.445 6.427 395 HG21 THR 54 HG21 THR 54 67.755 10.019 8.678 396 HG22 THR 54 HG22 THR 54 68.332 11.571 8.074 397 HG23 THR 54 HG23 THR 54 69.113 10.821 9.466 398 H VAL 55 HN VAL 55 69.450 8.246 10.674 399 HA VAL 55 HA VAL 55 67.310 6.324 9.931 400 HB VAL 55 HB VAL 55 67.769 5.312 12.207 401 HG11 VAL 55 HG11 VAL 55 69.698 4.024 11.418 402 HG12 VAL 55 HG12 VAL 55 70.052 5.260 10.211 403 HG13 VAL 55 HG13 VAL 55 68.576 4.302 10.086 404 HG21 VAL 55 HG21 VAL 55 70.303 6.964 11.952 405 HG22 VAL 55 HG22 VAL 55 69.952 5.788 13.219 406 HG23 VAL 55 HG23 VAL 55 69.012 7.272 13.111 407 H GLU 56 HN GLU 56 65.326 6.658 10.798 408 HA GLU 56 HA GLU 56 65.011 8.653 12.957 409 HB2 GLU 56 HB2 GLU 56 63.457 8.627 10.353 410 HB3 GLU 56 HB1 GLU 56 63.109 9.661 11.737 411 HG2 GLU 56 HG2 GLU 56 65.736 9.632 10.217 412 HG3 GLU 56 HG1 GLU 56 64.462 10.830 10.003 413 H GLN 57 HN GLN 57 62.439 8.694 13.414 414 HA GLN 57 HA GLN 57 61.812 6.353 14.749 415 HB2 GLN 57 HB2 GLN 57 60.673 8.524 15.106 416 HB3 GLN 57 HB1 GLN 57 59.861 8.334 13.552 417 HG2 GLN 57 HG2 GLN 57 58.717 6.347 14.319 418 HG3 GLN 57 HG1 GLN 57 59.642 6.334 15.818 419 HE21 GLN 57 HE21 GLN 57 56.804 6.413 15.875 420 HE22 GLN 57 HE22 GLN 57 56.311 7.933 16.451 421 H GLY 58 HN GLY 58 60.184 4.721 14.320 422 HA2 GLY 58 HA2 GLY 58 59.171 3.100 13.036 423 HA3 GLY 58 HA1 GLY 58 58.995 4.327 11.785 424 H THR 59 HN THR 59 62.102 3.434 13.113 425 HA THR 59 HA THR 59 64.019 2.788 11.991 426 HB THR 59 HB THR 59 63.862 0.507 11.127 427 HG1 THR 59 HG1 THR 59 61.887 0.804 10.007 428 HG21 THR 59 HG21 THR 59 63.879 0.759 13.547 429 HG22 THR 59 HG22 THR 59 62.764 -0.539 13.121 430 HG23 THR 59 HG23 THR 59 62.141 1.052 13.561 431 H LEU 60 HN LEU 60 62.603 4.770 10.608 432 HA LEU 60 HA LEU 60 62.264 4.098 7.848 433 HB2 LEU 60 HB2 LEU 60 62.576 6.729 9.305 434 HB3 LEU 60 HB1 LEU 60 62.305 6.625 7.570 435 HG LEU 60 HG LEU 60 60.453 5.276 9.554 436 HD11 LEU 60 HD11 LEU 60 60.600 7.738 10.022 437 HD12 LEU 60 HD12 LEU 60 59.010 7.230 9.457 438 HD13 LEU 60 HD13 LEU 60 60.120 8.041 8.353 439 HD21 LEU 60 HD21 LEU 60 60.262 6.105 6.641 440 HD22 LEU 60 HD22 LEU 60 58.842 5.685 7.596 441 HD23 LEU 60 HD23 LEU 60 60.097 4.487 7.318 442 H HIS 61 HN HIS 61 63.718 4.021 6.248 443 HA HIS 61 HA HIS 61 66.529 4.732 6.864 444 HB2 HIS 61 HB2 HIS 61 65.356 2.816 4.833 445 HB3 HIS 61 HB1 HIS 61 67.071 3.209 4.962 446 HD1 HIS 61 HD1 HIS 61 68.189 2.650 7.372 447 HD2 HIS 61 HD2 HIS 61 64.522 0.832 6.588 448 HE1 HIS 61 HE1 HIS 61 67.969 0.743 9.026 449 H LEU 62 HN LEU 62 67.570 6.216 5.665 450 HA LEU 62 HA LEU 62 66.445 7.131 3.123 451 HB2 LEU 62 HB2 LEU 62 65.534 8.488 5.173 452 HB3 LEU 62 HB1 LEU 62 67.144 9.190 5.213 453 HG LEU 62 HG LEU 62 65.743 10.645 3.898 454 HD11 LEU 62 HD11 LEU 62 68.093 10.070 3.071 455 HD12 LEU 62 HD12 LEU 62 66.999 10.790 1.892 456 HD13 LEU 62 HD13 LEU 62 67.305 9.056 1.860 457 HD21 LEU 62 HD21 LEU 62 64.146 8.600 3.322 458 HD22 LEU 62 HD22 LEU 62 65.130 8.513 1.863 459 HD23 LEU 62 HD23 LEU 62 64.249 9.988 2.244 460 H LEU 63 HN LEU 63 68.218 6.443 2.030 461 HA LEU 63 HA LEU 63 70.891 7.289 2.899 462 HB2 LEU 63 HB2 LEU 63 70.546 4.935 2.306 463 HB3 LEU 63 HB1 LEU 63 69.940 5.402 0.725 464 HG LEU 63 HG LEU 63 72.107 6.247 0.058 465 HD11 LEU 63 HD11 LEU 63 74.048 5.848 1.761 466 HD12 LEU 63 HD12 LEU 63 72.769 5.859 2.976 467 HD13 LEU 63 HD13 LEU 63 73.034 7.273 1.956 468 HD21 LEU 63 HD21 LEU 63 73.499 4.135 0.446 469 HD22 LEU 63 HD22 LEU 63 71.899 3.879 -0.253 470 HD23 LEU 63 HD23 LEU 63 72.175 3.561 1.459 471 H THR 64 HN THR 64 71.304 9.354 2.265 472 HA THR 64 HA THR 64 70.228 10.341 -0.274 473 HB THR 64 HB THR 64 72.003 11.788 1.709 474 HG1 THR 64 HG1 THR 64 69.203 12.014 1.502 475 HG21 THR 64 HG21 THR 64 71.832 12.750 -0.585 476 HG22 THR 64 HG22 THR 64 71.101 13.792 0.634 477 HG23 THR 64 HG23 THR 64 70.078 12.801 -0.405 478 H LEU 65 HN LEU 65 71.297 9.920 -2.054 479 HA LEU 65 HA LEU 65 74.261 9.692 -2.000 480 HB2 LEU 65 HB2 LEU 65 72.672 7.833 -2.927 481 HB3 LEU 65 HB1 LEU 65 72.489 8.900 -4.305 482 HG LEU 65 HG LEU 65 74.239 7.382 -4.866 483 HD11 LEU 65 HD11 LEU 65 76.075 8.815 -5.316 484 HD12 LEU 65 HD12 LEU 65 75.729 9.824 -3.917 485 HD13 LEU 65 HD13 LEU 65 74.651 9.850 -5.317 486 HD21 LEU 65 HD21 LEU 65 75.914 8.114 -2.476 487 HD22 LEU 65 HD22 LEU 65 75.957 6.663 -3.474 488 HD23 LEU 65 HD23 LEU 65 74.662 6.884 -2.304 489 H HIS 66 HN HIS 66 75.314 11.455 -2.633 490 HA HIS 66 HA HIS 66 74.027 13.338 -4.533 491 HB2 HIS 66 HB2 HIS 66 76.135 13.769 -2.406 492 HB3 HIS 66 HB1 HIS 66 75.716 14.974 -3.621 493 HD1 HIS 66 HD1 HIS 66 72.856 15.224 -3.731 494 HD2 HIS 66 HD2 HIS 66 74.688 14.254 -0.114 495 HE1 HIS 66 HE1 HIS 66 71.213 15.845 -1.908 496 H LYS 67 HN LYS 67 75.205 14.093 -6.293 497 HA LYS 67 HA LYS 67 76.682 13.931 -8.057 498 HB2 LYS 67 HB2 LYS 67 78.610 13.301 -5.808 499 HB3 LYS 67 HB1 LYS 67 79.056 13.804 -7.438 500 HG2 LYS 67 HG2 LYS 67 77.861 15.929 -7.127 501 HG3 LYS 67 HG1 LYS 67 77.380 15.428 -5.503 502 HD2 LYS 67 HD2 LYS 67 79.824 15.191 -4.936 503 HD3 LYS 67 HD1 LYS 67 80.200 15.910 -6.501 504 HE2 LYS 67 HE2 LYS 67 78.578 17.202 -4.291 505 HE3 LYS 67 HE1 LYS 67 80.220 17.634 -4.765 506 HZ1 LYS 67 HZ1 LYS 67 78.987 19.147 -5.930 507 HZ2 LYS 67 HZ2 LYS 67 77.696 18.075 -6.199 508 HZ3 LYS 67 HZ3 LYS 67 79.137 17.914 -7.085 509 H VAL 68 HN VAL 68 75.235 11.728 -8.139 510 HA VAL 68 HA VAL 68 76.452 9.277 -7.604 511 HB VAL 68 HB VAL 68 74.024 9.848 -8.444 512 HG11 VAL 68 HG11 VAL 68 74.942 10.683 -10.686 513 HG12 VAL 68 HG12 VAL 68 73.617 9.523 -10.777 514 HG13 VAL 68 HG13 VAL 68 75.273 8.992 -11.070 515 HG21 VAL 68 HG21 VAL 68 73.829 7.467 -9.292 516 HG22 VAL 68 HG22 VAL 68 74.628 7.629 -7.728 517 HG23 VAL 68 HG23 VAL 68 75.585 7.358 -9.183 518 H THR 69 HN THR 69 77.600 7.806 -8.848 519 HA THR 69 HA THR 69 78.907 8.813 -11.306 520 HB THR 69 HB THR 69 81.040 7.877 -10.533 521 HG1 THR 69 HG1 THR 69 80.058 6.305 -9.137 522 HG21 THR 69 HG21 THR 69 81.607 9.606 -9.017 523 HG22 THR 69 HG22 THR 69 79.987 9.638 -8.320 524 HG23 THR 69 HG23 THR 69 80.259 10.262 -9.947 525 H LEU 70 HN LEU 70 79.645 7.108 -12.717 526 HA LEU 70 HA LEU 70 77.848 4.951 -12.955 527 HB2 LEU 70 HB2 LEU 70 80.612 5.304 -14.148 528 HB3 LEU 70 HB1 LEU 70 79.440 4.093 -14.664 529 HG LEU 70 HG LEU 70 78.909 7.074 -14.661 530 HD11 LEU 70 HD11 LEU 70 80.724 6.338 -16.256 531 HD12 LEU 70 HD12 LEU 70 79.318 7.065 -17.033 532 HD13 LEU 70 HD13 LEU 70 79.525 5.314 -17.046 533 HD21 LEU 70 HD21 LEU 70 76.797 6.061 -14.652 534 HD22 LEU 70 HD22 LEU 70 77.362 4.643 -15.536 535 HD23 LEU 70 HD23 LEU 70 77.116 6.169 -16.379 536 H GLU 71 HN GLU 71 80.758 5.366 -11.174 537 HA GLU 71 HA GLU 71 81.430 2.620 -10.793 538 HB2 GLU 71 HB2 GLU 71 83.005 4.518 -10.419 539 HB3 GLU 71 HB1 GLU 71 82.048 4.998 -9.020 540 HG2 GLU 71 HG2 GLU 71 83.897 3.679 -8.216 541 HG3 GLU 71 HG1 GLU 71 82.447 2.697 -8.056 542 H ASP 72 HN ASP 72 79.353 4.917 -9.116 543 HA ASP 72 HA ASP 72 78.855 3.401 -6.788 544 HB2 ASP 72 HB2 ASP 72 78.267 5.784 -7.004 545 HB3 ASP 72 HB1 ASP 72 77.042 5.371 -8.200 546 H ALA 73 HN ALA 73 77.274 3.480 -9.954 547 HA ALA 73 HA ALA 73 75.114 1.779 -9.401 548 HB1 ALA 73 HB1 ALA 73 75.042 1.381 -11.810 549 HB2 ALA 73 HB2 ALA 73 76.688 1.993 -11.983 550 HB3 ALA 73 HB3 ALA 73 75.388 3.085 -11.507 551 H GLY 74 HN GLY 74 74.903 -0.441 -9.398 552 HA2 GLY 74 HA2 GLY 74 76.695 -2.315 -10.384 553 HA3 GLY 74 HA1 GLY 74 77.215 -1.963 -8.741 554 H THR 75 HN THR 75 76.088 -2.794 -7.027 555 HA THR 75 HA THR 75 73.463 -3.975 -7.402 556 HB THR 75 HB THR 75 75.813 -5.760 -6.739 557 HG1 THR 75 HG1 THR 75 74.396 -6.317 -8.981 558 HG21 THR 75 HG21 THR 75 74.104 -7.552 -7.042 559 HG22 THR 75 HG22 THR 75 72.869 -6.302 -7.212 560 HG23 THR 75 HG23 THR 75 73.740 -6.483 -5.688 561 H VAL 76 HN VAL 76 72.410 -3.403 -5.619 562 HA VAL 76 HA VAL 76 73.850 -3.348 -3.026 563 HB VAL 76 HB VAL 76 71.290 -1.982 -3.906 564 HG11 VAL 76 HG11 VAL 76 72.710 -2.034 -1.229 565 HG12 VAL 76 HG12 VAL 76 71.075 -2.601 -1.571 566 HG13 VAL 76 HG13 VAL 76 71.446 -0.880 -1.650 567 HG21 VAL 76 HG21 VAL 76 73.271 -0.890 -4.792 568 HG22 VAL 76 HG22 VAL 76 74.055 -0.948 -3.213 569 HG23 VAL 76 HG23 VAL 76 72.644 0.081 -3.461 570 H SER 77 HN SER 77 73.297 -4.865 -1.533 571 HA SER 77 HA SER 77 70.692 -6.245 -1.796 572 HB2 SER 77 HB2 SER 77 73.408 -7.560 -1.637 573 HB3 SER 77 HB1 SER 77 71.898 -8.411 -1.328 574 HG SER 77 HG SER 77 73.011 -7.545 -3.688 575 H PHE 78 HN PHE 78 70.531 -7.879 0.150 576 HA PHE 78 HA PHE 78 71.430 -6.511 2.634 577 HB2 PHE 78 HB2 PHE 78 68.719 -7.723 2.035 578 HB3 PHE 78 HB1 PHE 78 69.235 -7.128 3.611 579 HD1 PHE 78 HD1 PHE 78 67.971 -6.238 0.335 580 HD2 PHE 78 HD2 PHE 78 69.819 -4.691 3.888 581 HE1 PHE 78 HE1 PHE 78 67.269 -3.948 -0.297 582 HE2 PHE 78 HE2 PHE 78 69.121 -2.399 3.252 583 HZ PHE 78 HZ PHE 78 67.839 -2.033 1.161 584 H HIS 79 HN HIS 79 72.072 -7.811 4.289 585 HA HIS 79 HA HIS 79 71.971 -10.752 3.872 586 HB2 HIS 79 HB2 HIS 79 74.269 -9.845 3.730 587 HB3 HIS 79 HB1 HIS 79 74.076 -9.120 5.326 588 HD1 HIS 79 HD1 HIS 79 73.549 -10.896 7.320 589 HD2 HIS 79 HD2 HIS 79 75.096 -12.501 3.797 590 HE1 HIS 79 HE1 HIS 79 74.414 -13.203 7.903 591 H VAL 80 HN VAL 80 70.241 -11.322 5.082 592 HA VAL 80 HA VAL 80 70.153 -10.398 7.903 593 HB VAL 80 HB VAL 80 67.732 -11.415 6.438 594 HG11 VAL 80 HG11 VAL 80 67.549 -11.105 8.843 595 HG12 VAL 80 HG12 VAL 80 66.608 -9.859 8.021 596 HG13 VAL 80 HG13 VAL 80 68.180 -9.463 8.712 597 HG21 VAL 80 HG21 VAL 80 69.017 -8.697 6.201 598 HG22 VAL 80 HG22 VAL 80 67.277 -8.906 5.999 599 HG23 VAL 80 HG23 VAL 80 68.395 -9.736 4.919 600 H GLY 81 HN GLY 81 70.148 -11.913 9.456 601 HA2 GLY 81 HA2 GLY 81 70.920 -14.556 8.915 602 HA3 GLY 81 HA1 GLY 81 70.321 -13.969 10.461 603 H THR 82 HN THR 82 67.732 -13.123 9.073 604 HA THR 82 HA THR 82 66.446 -15.774 9.266 605 HB THR 82 HB THR 82 64.398 -14.561 9.658 606 HG1 THR 82 HG1 THR 82 65.497 -12.744 8.205 607 HG21 THR 82 HG21 THR 82 65.981 -14.818 11.546 608 HG22 THR 82 HG22 THR 82 65.030 -13.341 11.690 609 HG23 THR 82 HG23 THR 82 66.702 -13.262 11.136 610 H CYS 83 HN CYS 83 67.167 -13.305 6.931 611 HA CYS 83 HA CYS 83 65.985 -14.946 4.823 612 HB2 CYS 83 HB2 CYS 83 64.600 -13.179 3.908 613 HB3 CYS 83 HB1 CYS 83 64.131 -13.451 5.587 614 HG CYS 83 HG CYS 83 65.618 -10.947 4.520 615 H SER 84 HN SER 84 66.226 -13.542 2.652 616 HA SER 84 HA SER 84 68.690 -11.969 2.626 617 HB2 SER 84 HB2 SER 84 69.446 -14.329 2.394 618 HB3 SER 84 HB1 SER 84 68.415 -14.495 0.975 619 HG SER 84 HG SER 84 69.623 -12.546 0.219 620 H SER 85 HN SER 85 68.907 -10.712 0.720 621 HA SER 85 HA SER 85 66.849 -10.907 -1.341 622 HB2 SER 85 HB2 SER 85 67.055 -8.470 0.443 623 HB3 SER 85 HB1 SER 85 66.058 -8.601 -1.002 624 HG SER 85 HG SER 85 65.082 -10.462 0.071 625 H GLU 86 HN GLU 86 67.146 -9.158 -3.008 626 HA GLU 86 HA GLU 86 69.824 -7.989 -3.116 627 HB2 GLU 86 HB2 GLU 86 70.315 -9.050 -5.298 628 HB3 GLU 86 HB1 GLU 86 70.209 -10.224 -3.988 629 HG2 GLU 86 HG2 GLU 86 67.904 -10.769 -4.627 630 HG3 GLU 86 HG1 GLU 86 67.955 -9.559 -5.907 631 H ALA 87 HN ALA 87 70.117 -6.516 -4.863 632 HA ALA 87 HA ALA 87 67.818 -5.746 -6.483 633 HB1 ALA 87 HB1 ALA 87 69.079 -3.627 -4.744 634 HB2 ALA 87 HB2 ALA 87 67.703 -4.567 -4.170 635 HB3 ALA 87 HB3 ALA 87 67.546 -3.573 -5.618 636 H GLN 88 HN GLN 88 68.440 -4.540 -8.310 637 HA GLN 88 HA GLN 88 71.374 -4.249 -8.683 638 HB2 GLN 88 HB2 GLN 88 69.214 -4.995 -10.660 639 HB3 GLN 88 HB1 GLN 88 70.866 -4.578 -11.121 640 HG2 GLN 88 HG2 GLN 88 71.732 -6.394 -9.706 641 HG3 GLN 88 HG1 GLN 88 70.089 -6.806 -9.220 642 HE21 GLN 88 HE21 GLN 88 72.498 -7.682 -11.370 643 HE22 GLN 88 HE22 GLN 88 71.536 -8.418 -12.560 644 H LEU 89 HN LEU 89 72.157 -2.349 -9.200 645 HA LEU 89 HA LEU 89 70.301 -0.110 -9.757 646 HB2 LEU 89 HB2 LEU 89 73.103 -0.290 -8.643 647 HB3 LEU 89 HB1 LEU 89 72.466 1.227 -9.274 648 HG LEU 89 HG LEU 89 70.592 1.131 -7.699 649 HD11 LEU 89 HD11 LEU 89 70.086 -1.123 -7.340 650 HD12 LEU 89 HD12 LEU 89 70.895 -0.707 -5.832 651 HD13 LEU 89 HD13 LEU 89 71.772 -1.574 -7.091 652 HD21 LEU 89 HD21 LEU 89 72.530 2.278 -6.869 653 HD22 LEU 89 HD22 LEU 89 73.363 0.763 -6.526 654 HD23 LEU 89 HD23 LEU 89 71.974 1.245 -5.551 655 H LYS 90 HN LYS 90 70.071 0.344 -11.843 656 HA LYS 90 HA LYS 90 72.384 0.011 -13.677 657 HB2 LYS 90 HB2 LYS 90 70.354 -1.548 -13.974 658 HB3 LYS 90 HB1 LYS 90 69.487 -0.115 -14.526 659 HG2 LYS 90 HG2 LYS 90 71.126 0.240 -16.305 660 HG3 LYS 90 HG1 LYS 90 72.107 -1.095 -15.708 661 HD2 LYS 90 HD2 LYS 90 70.832 -1.934 -17.575 662 HD3 LYS 90 HD1 LYS 90 70.135 -2.622 -16.110 663 HE2 LYS 90 HE2 LYS 90 68.251 -1.217 -16.197 664 HE3 LYS 90 HE1 LYS 90 69.041 -0.060 -17.269 665 HZ1 LYS 90 HZ1 LYS 90 68.963 -2.643 -18.444 666 HZ2 LYS 90 HZ2 LYS 90 68.342 -1.176 -19.032 667 HZ3 LYS 90 HZ3 LYS 90 67.402 -2.147 -18.004 668 H VAL 91 HN VAL 91 72.605 1.552 -15.351 669 HA VAL 91 HA VAL 91 71.241 4.138 -14.832 670 HB VAL 91 HB VAL 91 73.258 5.150 -15.953 671 HG11 VAL 91 HG11 VAL 91 73.121 5.311 -13.574 672 HG12 VAL 91 HG12 VAL 91 74.754 4.750 -13.928 673 HG13 VAL 91 HG13 VAL 91 73.532 3.610 -13.364 674 HG21 VAL 91 HG21 VAL 91 75.294 3.741 -16.025 675 HG22 VAL 91 HG22 VAL 91 74.044 3.124 -17.102 676 HG23 VAL 91 HG23 VAL 91 74.336 2.343 -15.548 677 H THR 92 HN THR 92 70.186 5.092 -16.472 678 HA THR 92 HA THR 92 69.701 3.537 -18.839 679 HB THR 92 HB THR 92 68.807 6.351 -18.183 680 HG1 THR 92 HG1 THR 92 67.840 5.244 -16.663 681 HG21 THR 92 HG21 THR 92 66.865 5.506 -19.701 682 HG22 THR 92 HG22 THR 92 68.034 4.313 -20.265 683 HG23 THR 92 HG23 THR 92 68.363 6.034 -20.465 684 H ALA 93 HN ALA 93 70.554 3.734 -20.810 685 HA ALA 93 HA ALA 93 72.881 5.342 -21.237 686 HB1 ALA 93 HB1 ALA 93 71.214 3.925 -23.328 687 HB2 ALA 93 HB2 ALA 93 72.422 3.113 -22.331 688 HB3 ALA 93 HB3 ALA 93 72.912 4.387 -23.446 689 H GLY 94 HN GLY 94 73.128 7.179 -22.516 690 HA2 GLY 94 HA2 GLY 94 70.809 8.880 -22.706 691 HA3 GLY 94 HA1 GLY 94 72.450 9.296 -23.194 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 52.136 -12.455 18.772 2 H2 MET 1 HT2 MET 1 53.653 -12.171 18.061 3 H3 MET 1 HT3 MET 1 53.466 -12.062 19.747 4 HA MET 1 HA MET 1 53.999 -14.185 19.958 5 HB2 MET 1 HB2 MET 1 51.654 -14.581 18.076 6 HB3 MET 1 HB1 MET 1 52.459 -15.887 18.945 7 HG2 MET 1 HG2 MET 1 51.917 -14.792 21.089 8 HG3 MET 1 HG1 MET 1 51.097 -13.496 20.218 9 HE1 MET 1 HE1 MET 1 48.252 -13.893 20.822 10 HE2 MET 1 HE2 MET 1 49.549 -14.064 22.001 11 HE3 MET 1 HE3 MET 1 48.275 -15.279 21.922 12 H ALA 2 HN ALA 2 55.265 -12.613 17.843 13 HA ALA 2 HA ALA 2 56.730 -14.671 16.565 14 HB1 ALA 2 HB1 ALA 2 54.896 -15.069 15.133 15 HB2 ALA 2 HB2 ALA 2 55.966 -14.029 14.192 16 HB3 ALA 2 HB3 ALA 2 54.539 -13.351 14.976 17 HA PRO 3 HA PRO 3 58.246 -10.151 16.716 18 HB2 PRO 3 HB2 PRO 3 60.598 -11.160 18.103 19 HB3 PRO 3 HB1 PRO 3 59.398 -9.995 18.681 20 HG2 PRO 3 HG2 PRO 3 59.706 -12.761 19.422 21 HG3 PRO 3 HG1 PRO 3 58.573 -11.567 20.068 22 HD2 PRO 3 HD2 PRO 3 57.929 -13.795 18.416 23 HD3 PRO 3 HD1 PRO 3 56.842 -12.475 18.888 24 H GLU 4 HN GLU 4 59.504 -9.464 15.063 25 HA GLU 4 HA GLU 4 61.840 -10.726 14.098 26 HB2 GLU 4 HB2 GLU 4 60.260 -12.447 13.296 27 HB3 GLU 4 HB1 GLU 4 59.354 -11.208 12.430 28 HG2 GLU 4 HG2 GLU 4 61.277 -10.723 11.019 29 HG3 GLU 4 HG1 GLU 4 62.281 -11.836 11.949 30 H VAL 5 HN VAL 5 62.876 -9.465 12.545 31 HA VAL 5 HA VAL 5 62.141 -6.744 12.413 32 HB VAL 5 HB VAL 5 64.468 -7.783 12.081 33 HG11 VAL 5 HG11 VAL 5 65.113 -8.587 9.972 34 HG12 VAL 5 HG12 VAL 5 63.692 -7.914 9.172 35 HG13 VAL 5 HG13 VAL 5 63.531 -9.325 10.217 36 HG21 VAL 5 HG21 VAL 5 63.423 -5.688 10.157 37 HG22 VAL 5 HG22 VAL 5 65.132 -5.981 10.480 38 HG23 VAL 5 HG23 VAL 5 64.079 -5.404 11.768 39 H THR 6 HN THR 6 60.591 -5.786 11.211 40 HA THR 6 HA THR 6 59.127 -7.286 9.257 41 HB THR 6 HB THR 6 59.177 -4.324 9.833 42 HG1 THR 6 HG1 THR 6 57.821 -6.539 10.779 43 HG21 THR 6 HG21 THR 6 56.904 -4.478 8.604 44 HG22 THR 6 HG22 THR 6 57.550 -5.963 7.908 45 HG23 THR 6 HG23 THR 6 58.374 -4.428 7.634 46 H ILE 7 HN ILE 7 59.476 -7.515 7.096 47 HA ILE 7 HA ILE 7 61.734 -5.983 5.934 48 HB ILE 7 HB ILE 7 62.027 -8.411 6.154 49 HG12 ILE 7 HG12 ILE 7 62.658 -8.806 3.730 50 HG13 ILE 7 HG11 ILE 7 61.900 -7.262 3.357 51 HG21 ILE 7 HG21 ILE 7 60.677 -10.000 5.127 52 HG22 ILE 7 HG22 ILE 7 60.048 -8.862 3.941 53 HG23 ILE 7 HG23 ILE 7 59.479 -8.801 5.611 54 HD11 ILE 7 HD11 ILE 7 64.490 -7.386 3.872 55 HD12 ILE 7 HD12 ILE 7 63.959 -7.365 5.551 56 HD13 ILE 7 HD13 ILE 7 63.535 -6.035 4.473 57 H LEU 8 HN LEU 8 60.887 -4.296 5.022 58 HA LEU 8 HA LEU 8 58.961 -4.686 2.802 59 HB2 LEU 8 HB2 LEU 8 58.974 -2.445 4.840 60 HB3 LEU 8 HB1 LEU 8 58.054 -2.400 3.337 61 HG LEU 8 HG LEU 8 57.784 -4.602 5.404 62 HD11 LEU 8 HD11 LEU 8 55.884 -2.286 4.958 63 HD12 LEU 8 HD12 LEU 8 57.104 -2.301 6.232 64 HD13 LEU 8 HD13 LEU 8 55.816 -3.503 6.232 65 HD21 LEU 8 HD21 LEU 8 56.892 -5.523 3.474 66 HD22 LEU 8 HD22 LEU 8 56.453 -3.961 2.786 67 HD23 LEU 8 HD23 LEU 8 55.467 -4.674 4.061 68 H GLU 9 HN GLU 9 60.888 -4.807 1.486 69 HA GLU 9 HA GLU 9 62.189 -2.167 1.044 70 HB2 GLU 9 HB2 GLU 9 63.782 -3.812 1.882 71 HB3 GLU 9 HB1 GLU 9 63.337 -4.929 0.591 72 HG2 GLU 9 HG2 GLU 9 64.288 -3.579 -1.086 73 HG3 GLU 9 HG1 GLU 9 64.259 -2.134 -0.078 74 HA PRO 10 HA PRO 10 59.897 -3.238 -2.811 75 HB2 PRO 10 HB2 PRO 10 59.370 -0.409 -3.195 76 HB3 PRO 10 HB1 PRO 10 58.213 -1.697 -2.824 77 HG2 PRO 10 HG2 PRO 10 58.974 0.354 -1.092 78 HG3 PRO 10 HG1 PRO 10 58.148 -1.141 -0.631 79 HD2 PRO 10 HD2 PRO 10 61.012 -0.400 -0.287 80 HD3 PRO 10 HD1 PRO 10 60.014 -1.536 0.647 81 H LEU 11 HN LEU 11 62.645 -1.482 -2.007 82 HA LEU 11 HA LEU 11 63.394 -0.337 -4.487 83 HB2 LEU 11 HB2 LEU 11 65.095 -1.410 -2.218 84 HB3 LEU 11 HB1 LEU 11 65.697 -0.407 -3.534 85 HG LEU 11 HG LEU 11 63.398 0.533 -1.811 86 HD11 LEU 11 HD11 LEU 11 65.314 -0.058 -0.325 87 HD12 LEU 11 HD12 LEU 11 65.013 1.679 -0.369 88 HD13 LEU 11 HD13 LEU 11 66.351 0.994 -1.289 89 HD21 LEU 11 HD21 LEU 11 63.843 1.808 -3.865 90 HD22 LEU 11 HD22 LEU 11 65.548 1.937 -3.437 91 HD23 LEU 11 HD23 LEU 11 64.329 2.759 -2.469 92 H GLN 12 HN GLN 12 62.599 -2.160 -5.866 93 HA GLN 12 HA GLN 12 64.084 -4.625 -5.871 94 HB2 GLN 12 HB2 GLN 12 62.128 -3.417 -7.832 95 HB3 GLN 12 HB1 GLN 12 62.874 -5.000 -8.052 96 HG2 GLN 12 HG2 GLN 12 61.923 -5.778 -5.937 97 HG3 GLN 12 HG1 GLN 12 61.239 -4.183 -5.631 98 HE21 GLN 12 HE21 GLN 12 59.231 -5.837 -5.608 99 HE22 GLN 12 HE22 GLN 12 58.416 -5.972 -7.091 100 H ASP 13 HN ASP 13 63.722 -2.193 -8.455 101 HA ASP 13 HA ASP 13 66.593 -2.107 -8.908 102 HB2 ASP 13 HB2 ASP 13 64.718 -3.280 -10.979 103 HB3 ASP 13 HB1 ASP 13 66.420 -2.900 -11.241 104 H VAL 14 HN VAL 14 67.099 -0.083 -9.546 105 HA VAL 14 HA VAL 14 65.048 1.493 -11.018 106 HB VAL 14 HB VAL 14 65.886 3.496 -9.771 107 HG11 VAL 14 HG11 VAL 14 64.703 2.903 -7.636 108 HG12 VAL 14 HG12 VAL 14 64.644 1.229 -8.191 109 HG13 VAL 14 HG13 VAL 14 63.795 2.486 -9.090 110 HG21 VAL 14 HG21 VAL 14 67.117 3.070 -7.664 111 HG22 VAL 14 HG22 VAL 14 68.044 2.563 -9.073 112 HG23 VAL 14 HG23 VAL 14 67.223 1.359 -8.082 113 H GLN 15 HN GLN 15 65.846 3.190 -12.310 114 HA GLN 15 HA GLN 15 68.672 2.879 -13.170 115 HB2 GLN 15 HB2 GLN 15 66.226 3.504 -14.845 116 HB3 GLN 15 HB1 GLN 15 67.889 3.530 -15.432 117 HG2 GLN 15 HG2 GLN 15 68.146 1.153 -14.879 118 HG3 GLN 15 HG1 GLN 15 66.505 1.115 -14.233 119 HE21 GLN 15 HE21 GLN 15 68.027 0.001 -16.836 120 HE22 GLN 15 HE22 GLN 15 66.870 0.284 -18.044 121 H LEU 16 HN LEU 16 69.843 4.680 -13.066 122 HA LEU 16 HA LEU 16 68.461 7.282 -12.690 123 HB2 LEU 16 HB2 LEU 16 71.159 6.411 -11.641 124 HB3 LEU 16 HB1 LEU 16 70.349 7.941 -11.319 125 HG LEU 16 HG LEU 16 69.317 5.204 -10.522 126 HD11 LEU 16 HD11 LEU 16 69.810 6.042 -8.215 127 HD12 LEU 16 HD12 LEU 16 70.579 7.459 -8.932 128 HD13 LEU 16 HD13 LEU 16 71.258 5.853 -9.201 129 HD21 LEU 16 HD21 LEU 16 67.803 6.815 -9.080 130 HD22 LEU 16 HD22 LEU 16 67.382 6.505 -10.761 131 HD23 LEU 16 HD23 LEU 16 68.203 8.003 -10.323 132 H SER 17 HN SER 17 68.918 8.838 -14.164 133 HA SER 17 HA SER 17 70.879 8.303 -16.240 134 HB2 SER 17 HB2 SER 17 69.398 10.900 -15.799 135 HB3 SER 17 HB1 SER 17 70.087 10.280 -17.296 136 HG SER 17 HG SER 17 68.534 8.665 -17.298 137 H GLU 18 HN GLU 18 72.790 9.517 -16.581 138 HA GLU 18 HA GLU 18 74.199 10.218 -14.236 139 HB2 GLU 18 HB2 GLU 18 75.299 9.427 -16.291 140 HB3 GLU 18 HB1 GLU 18 74.838 10.920 -17.108 141 HG2 GLU 18 HG2 GLU 18 76.163 12.238 -15.553 142 HG3 GLU 18 HG1 GLU 18 76.538 10.803 -14.600 143 H GLY 19 HN GLY 19 74.490 12.094 -13.179 144 HA2 GLY 19 HA2 GLY 19 74.633 14.449 -12.949 145 HA3 GLY 19 HA1 GLY 19 73.674 14.640 -14.414 146 H GLN 20 HN GLN 20 72.172 12.262 -12.748 147 HA GLN 20 HA GLN 20 70.330 14.157 -11.393 148 HB2 GLN 20 HB2 GLN 20 69.826 11.490 -12.718 149 HB3 GLN 20 HB1 GLN 20 68.646 12.297 -11.683 150 HG2 GLN 20 HG2 GLN 20 68.685 14.268 -13.144 151 HG3 GLN 20 HG1 GLN 20 69.900 13.502 -14.165 152 HE21 GLN 20 HE21 GLN 20 68.098 10.926 -13.307 153 HE22 GLN 20 HE22 GLN 20 66.921 10.948 -14.530 154 H ASP 21 HN ASP 21 69.917 13.912 -9.296 155 HA ASP 21 HA ASP 21 71.455 11.966 -7.787 156 HB2 ASP 21 HB2 ASP 21 69.562 14.170 -6.942 157 HB3 ASP 21 HB1 ASP 21 70.455 13.140 -5.822 158 H ALA 22 HN ALA 22 70.335 10.803 -5.980 159 HA ALA 22 HA ALA 22 67.556 10.100 -6.366 160 HB1 ALA 22 HB1 ALA 22 69.640 7.952 -6.783 161 HB2 ALA 22 HB2 ALA 22 68.801 8.759 -8.107 162 HB3 ALA 22 HB3 ALA 22 67.892 7.794 -6.943 163 H SER 23 HN SER 23 67.048 8.150 -4.851 164 HA SER 23 HA SER 23 68.810 7.904 -2.555 165 HB2 SER 23 HB2 SER 23 67.625 10.042 -2.120 166 HB3 SER 23 HB1 SER 23 66.088 9.186 -2.225 167 HG SER 23 HG SER 23 68.201 8.789 -0.374 168 H PHE 24 HN PHE 24 68.274 6.208 -1.208 169 HA PHE 24 HA PHE 24 66.241 4.327 -2.262 170 HB2 PHE 24 HB2 PHE 24 68.846 4.032 -0.803 171 HB3 PHE 24 HB1 PHE 24 67.612 2.814 -0.514 172 HD1 PHE 24 HD1 PHE 24 68.010 4.563 -3.790 173 HD2 PHE 24 HD2 PHE 24 68.794 0.998 -1.517 174 HE1 PHE 24 HE1 PHE 24 68.657 3.368 -5.871 175 HE2 PHE 24 HE2 PHE 24 69.438 -0.188 -3.595 176 HZ PHE 24 HZ PHE 24 69.374 0.993 -5.770 177 H GLN 25 HN GLN 25 64.597 3.610 -0.913 178 HA GLN 25 HA GLN 25 64.524 4.689 1.849 179 HB2 GLN 25 HB2 GLN 25 61.960 4.834 1.399 180 HB3 GLN 25 HB1 GLN 25 63.006 6.115 0.790 181 HG2 GLN 25 HG2 GLN 25 63.062 5.055 -1.418 182 HG3 GLN 25 HG1 GLN 25 62.057 3.733 -0.824 183 HE21 GLN 25 HE21 GLN 25 61.580 6.076 -2.865 184 HE22 GLN 25 HE22 GLN 25 60.082 6.703 -2.372 185 H CYS 26 HN CYS 26 64.436 3.117 3.248 186 HA CYS 26 HA CYS 26 62.953 0.633 2.593 187 HB2 CYS 26 HB2 CYS 26 65.347 0.610 4.413 188 HB3 CYS 26 HB1 CYS 26 64.658 -0.699 3.449 189 HG CYS 26 HG CYS 26 66.508 -0.075 1.895 190 H ARG 27 HN ARG 27 62.272 -0.569 4.531 191 HA ARG 27 HA ARG 27 61.950 1.040 6.975 192 HB2 ARG 27 HB2 ARG 27 59.950 1.538 5.680 193 HB3 ARG 27 HB1 ARG 27 59.668 -0.177 5.390 194 HG2 ARG 27 HG2 ARG 27 59.352 -0.536 7.819 195 HG3 ARG 27 HG1 ARG 27 59.646 1.180 8.107 196 HD2 ARG 27 HD2 ARG 27 57.716 1.710 6.613 197 HD3 ARG 27 HD1 ARG 27 57.389 -0.013 6.476 198 HE ARG 27 HE ARG 27 56.901 1.675 8.806 199 HH11 ARG 27 HH11 ARG 27 57.049 0.195 10.769 200 HH12 ARG 27 HH12 ARG 27 56.191 -1.300 10.602 201 HH21 ARG 27 HH21 ARG 27 55.830 -1.009 7.161 202 HH22 ARG 27 HH22 ARG 27 55.494 -1.981 8.555 203 H LEU 28 HN LEU 28 62.732 -0.233 8.545 204 HA LEU 28 HA LEU 28 62.083 -3.129 8.469 205 HB2 LEU 28 HB2 LEU 28 64.675 -1.836 9.323 206 HB3 LEU 28 HB1 LEU 28 64.288 -3.541 9.543 207 HG LEU 28 HG LEU 28 64.351 -2.122 6.860 208 HD11 LEU 28 HD11 LEU 28 66.364 -4.094 7.974 209 HD12 LEU 28 HD12 LEU 28 66.577 -2.346 8.065 210 HD13 LEU 28 HD13 LEU 28 66.494 -3.143 6.495 211 HD21 LEU 28 HD21 LEU 28 63.007 -3.962 6.431 212 HD22 LEU 28 HD22 LEU 28 63.678 -4.911 7.756 213 HD23 LEU 28 HD23 LEU 28 64.577 -4.739 6.250 214 H SER 29 HN SER 29 60.463 -3.183 10.009 215 HA SER 29 HA SER 29 60.436 -1.611 12.356 216 HB2 SER 29 HB2 SER 29 58.443 -2.900 11.479 217 HB3 SER 29 HB1 SER 29 59.195 -4.363 12.122 218 HG SER 29 HG SER 29 58.021 -3.683 13.791 219 H ARG 30 HN ARG 30 60.366 -2.858 14.586 220 HA ARG 30 HA ARG 30 62.988 -3.367 15.304 221 HB2 ARG 30 HB2 ARG 30 61.282 -2.776 16.931 222 HB3 ARG 30 HB1 ARG 30 60.447 -4.304 16.652 223 HG2 ARG 30 HG2 ARG 30 62.317 -5.558 17.530 224 HG3 ARG 30 HG1 ARG 30 63.304 -4.101 17.642 225 HD2 ARG 30 HD2 ARG 30 60.727 -4.587 19.159 226 HD3 ARG 30 HD1 ARG 30 62.342 -4.765 19.836 227 HE ARG 30 HE ARG 30 62.363 -2.215 18.900 228 HH11 ARG 30 HH11 ARG 30 60.891 -4.010 21.399 229 HH12 ARG 30 HH12 ARG 30 60.029 -2.669 22.076 230 HH21 ARG 30 HH21 ARG 30 60.934 -0.468 19.555 231 HH22 ARG 30 HH22 ARG 30 60.058 -0.664 21.036 232 H ALA 31 HN ALA 31 64.273 -5.059 15.441 233 HA ALA 31 HA ALA 31 63.482 -7.555 14.146 234 HB1 ALA 31 HB1 ALA 31 66.212 -6.723 15.141 235 HB2 ALA 31 HB2 ALA 31 65.605 -6.357 13.528 236 HB3 ALA 31 HB3 ALA 31 65.836 -8.034 14.024 237 H SER 32 HN SER 32 65.031 -9.422 15.227 238 HA SER 32 HA SER 32 64.624 -9.471 18.138 239 HB2 SER 32 HB2 SER 32 62.541 -10.362 16.881 240 HB3 SER 32 HB1 SER 32 63.555 -11.736 16.453 241 HG SER 32 HG SER 32 63.904 -11.252 19.027 242 H GLY 33 HN GLY 33 65.249 -11.755 15.494 243 HA2 GLY 33 HA2 GLY 33 67.396 -13.029 16.914 244 HA3 GLY 33 HA1 GLY 33 66.907 -13.341 15.248 245 H GLN 34 HN GLN 34 67.736 -12.052 13.564 246 HA GLN 34 HA GLN 34 70.059 -10.368 14.294 247 HB2 GLN 34 HB2 GLN 34 69.812 -12.327 12.000 248 HB3 GLN 34 HB1 GLN 34 71.147 -11.194 12.207 249 HG2 GLN 34 HG2 GLN 34 70.344 -13.275 14.260 250 HG3 GLN 34 HG1 GLN 34 71.649 -13.486 13.093 251 HE21 GLN 34 HE21 GLN 34 71.254 -12.773 16.257 252 HE22 GLN 34 HE22 GLN 34 72.548 -11.702 16.492 253 H GLU 35 HN GLU 35 70.355 -8.499 13.234 254 HA GLU 35 HA GLU 35 68.094 -7.453 11.740 255 HB2 GLU 35 HB2 GLU 35 69.103 -6.014 13.404 256 HB3 GLU 35 HB1 GLU 35 70.696 -6.216 12.680 257 HG2 GLU 35 HG2 GLU 35 69.656 -4.051 12.060 258 HG3 GLU 35 HG1 GLU 35 69.954 -5.055 10.648 259 H ALA 36 HN ALA 36 68.258 -6.536 9.624 260 HA ALA 36 HA ALA 36 69.814 -8.086 7.798 261 HB1 ALA 36 HB1 ALA 36 67.585 -7.138 7.251 262 HB2 ALA 36 HB2 ALA 36 68.816 -6.659 6.082 263 HB3 ALA 36 HB3 ALA 36 68.279 -5.519 7.316 264 H ARG 37 HN ARG 37 71.677 -7.589 6.724 265 HA ARG 37 HA ARG 37 73.071 -5.079 7.503 266 HB2 ARG 37 HB2 ARG 37 74.236 -7.784 6.777 267 HB3 ARG 37 HB1 ARG 37 75.167 -6.338 7.170 268 HG2 ARG 37 HG2 ARG 37 74.116 -6.267 9.405 269 HG3 ARG 37 HG1 ARG 37 73.199 -7.721 9.017 270 HD2 ARG 37 HD2 ARG 37 76.226 -7.583 8.987 271 HD3 ARG 37 HD1 ARG 37 75.287 -8.147 10.364 272 HE ARG 37 HE ARG 37 75.760 -9.581 7.888 273 HH11 ARG 37 HH11 ARG 37 73.487 -10.702 7.485 274 HH12 ARG 37 HH12 ARG 37 72.992 -11.660 8.841 275 HH21 ARG 37 HH21 ARG 37 75.228 -10.185 11.045 276 HH22 ARG 37 HH22 ARG 37 73.972 -11.366 10.854 277 H TRP 38 HN TRP 38 73.925 -3.806 5.924 278 HA TRP 38 HA TRP 38 73.062 -4.250 3.207 279 HB2 TRP 38 HB2 TRP 38 74.727 -2.118 4.549 280 HB3 TRP 38 HB1 TRP 38 74.478 -2.147 2.804 281 HD1 TRP 38 HD1 TRP 38 72.963 -0.857 5.884 282 HE1 TRP 38 HE1 TRP 38 70.561 -0.026 5.432 283 HE3 TRP 38 HE3 TRP 38 72.169 -2.918 1.282 284 HZ2 TRP 38 HZ2 TRP 38 68.562 -0.227 3.391 285 HZ3 TRP 38 HZ3 TRP 38 70.013 -2.586 0.106 286 HH2 TRP 38 HH2 TRP 38 68.212 -1.243 1.156 287 H ALA 39 HN ALA 39 74.710 -3.965 1.395 288 HA ALA 39 HA ALA 39 77.410 -4.804 1.874 289 HB1 ALA 39 HB1 ALA 39 75.866 -6.919 2.057 290 HB2 ALA 39 HB2 ALA 39 77.364 -7.016 1.132 291 HB3 ALA 39 HB3 ALA 39 75.822 -6.815 0.298 292 H LEU 40 HN LEU 40 78.526 -3.715 0.376 293 HA LEU 40 HA LEU 40 77.344 -3.360 -2.331 294 HB2 LEU 40 HB2 LEU 40 77.542 -1.261 -0.946 295 HB3 LEU 40 HB1 LEU 40 79.286 -1.493 -0.942 296 HG LEU 40 HG LEU 40 77.653 -1.368 -3.495 297 HD11 LEU 40 HD11 LEU 40 79.069 0.879 -2.033 298 HD12 LEU 40 HD12 LEU 40 77.329 0.727 -2.281 299 HD13 LEU 40 HD13 LEU 40 78.397 0.999 -3.659 300 HD21 LEU 40 HD21 LEU 40 79.699 -2.184 -4.191 301 HD22 LEU 40 HD22 LEU 40 80.575 -1.508 -2.820 302 HD23 LEU 40 HD23 LEU 40 80.118 -0.476 -4.173 303 H GLY 41 HN GLY 41 78.362 -4.624 -3.722 304 HA2 GLY 41 HA2 GLY 41 80.101 -5.508 -4.968 305 HA3 GLY 41 HA1 GLY 41 81.224 -4.548 -4.006 306 H GLY 42 HN GLY 42 79.041 -6.390 -2.163 307 HA2 GLY 42 HA2 GLY 42 79.188 -8.605 -1.324 308 HA3 GLY 42 HA1 GLY 42 80.836 -8.714 -1.930 309 H VAL 43 HN VAL 43 81.342 -5.944 -0.779 310 HA VAL 43 HA VAL 43 81.885 -6.839 1.985 311 HB VAL 43 HB VAL 43 83.662 -5.173 1.990 312 HG11 VAL 43 HG11 VAL 43 84.146 -7.384 1.000 313 HG12 VAL 43 HG12 VAL 43 85.065 -6.117 0.189 314 HG13 VAL 43 HG13 VAL 43 83.627 -6.792 -0.579 315 HG21 VAL 43 HG21 VAL 43 82.551 -4.471 -0.746 316 HG22 VAL 43 HG22 VAL 43 84.115 -3.915 -0.150 317 HG23 VAL 43 HG23 VAL 43 82.635 -3.415 0.664 318 HA PRO 44 HA PRO 44 78.885 -3.986 3.593 319 HB2 PRO 44 HB2 PRO 44 80.574 -2.970 5.727 320 HB3 PRO 44 HB1 PRO 44 79.243 -4.131 5.840 321 HG2 PRO 44 HG2 PRO 44 82.082 -4.629 5.956 322 HG3 PRO 44 HG1 PRO 44 80.749 -5.761 6.217 323 HD2 PRO 44 HD2 PRO 44 82.508 -5.727 3.988 324 HD3 PRO 44 HD1 PRO 44 81.014 -6.671 4.139 325 H LEU 45 HN LEU 45 78.342 -1.863 3.310 326 HA LEU 45 HA LEU 45 80.267 -0.139 1.987 327 HB2 LEU 45 HB2 LEU 45 78.441 1.185 1.334 328 HB3 LEU 45 HB1 LEU 45 77.773 -0.443 1.356 329 HG LEU 45 HG LEU 45 77.450 1.662 3.530 330 HD11 LEU 45 HD11 LEU 45 75.022 1.355 2.903 331 HD12 LEU 45 HD12 LEU 45 75.570 0.422 1.510 332 HD13 LEU 45 HD13 LEU 45 76.013 2.124 1.663 333 HD21 LEU 45 HD21 LEU 45 75.875 -0.073 4.501 334 HD22 LEU 45 HD22 LEU 45 77.578 -0.506 4.599 335 HD23 LEU 45 HD23 LEU 45 76.556 -1.233 3.363 336 H GLN 46 HN GLN 46 80.206 2.267 2.656 337 HA GLN 46 HA GLN 46 80.015 2.645 5.566 338 HB2 GLN 46 HB2 GLN 46 82.354 1.906 5.095 339 HB3 GLN 46 HB1 GLN 46 82.537 3.284 4.009 340 HG2 GLN 46 HG2 GLN 46 83.455 3.879 6.181 341 HG3 GLN 46 HG1 GLN 46 81.980 4.805 5.926 342 HE21 GLN 46 HE21 GLN 46 81.120 4.979 8.032 343 HE22 GLN 46 HE22 GLN 46 80.816 3.651 9.045 344 H ALA 47 HN ALA 47 79.530 4.737 6.153 345 HA ALA 47 HA ALA 47 78.408 6.447 4.192 346 HB1 ALA 47 HB1 ALA 47 78.120 8.034 6.019 347 HB2 ALA 47 HB2 ALA 47 79.259 7.130 7.017 348 HB3 ALA 47 HB3 ALA 47 77.710 6.411 6.576 349 H ASN 48 HN ASN 48 79.175 8.280 3.217 350 HA ASN 48 HA ASN 48 81.779 9.386 3.885 351 HB2 ASN 48 HB2 ASN 48 82.052 7.330 2.281 352 HB3 ASN 48 HB1 ASN 48 81.427 8.422 1.049 353 HD21 ASN 48 HD21 ASN 48 83.367 8.818 -0.124 354 HD22 ASN 48 HD22 ASN 48 84.748 9.519 0.568 355 H GLU 49 HN GLU 49 82.174 10.880 1.520 356 HA GLU 49 HA GLU 49 80.240 12.942 1.880 357 HB2 GLU 49 HB2 GLU 49 82.280 12.521 -0.321 358 HB3 GLU 49 HB1 GLU 49 81.273 13.955 -0.176 359 HG2 GLU 49 HG2 GLU 49 83.167 14.681 0.953 360 HG3 GLU 49 HG1 GLU 49 82.251 14.012 2.297 361 H MET 50 HN MET 50 80.794 10.611 -0.752 362 HA MET 50 HA MET 50 78.572 11.446 -2.322 363 HB2 MET 50 HB2 MET 50 80.478 10.229 -3.274 364 HB3 MET 50 HB1 MET 50 80.053 8.808 -2.320 365 HG2 MET 50 HG2 MET 50 77.897 8.641 -3.478 366 HG3 MET 50 HG1 MET 50 78.241 10.119 -4.372 367 HE1 MET 50 HE1 MET 50 79.319 6.814 -3.274 368 HE2 MET 50 HE2 MET 50 80.959 6.796 -3.914 369 HE3 MET 50 HE3 MET 50 79.685 5.919 -4.753 370 H ASN 51 HN ASN 51 79.006 8.810 0.031 371 HA ASN 51 HA ASN 51 76.097 8.242 -0.107 372 HB2 ASN 51 HB2 ASN 51 78.447 6.588 0.828 373 HB3 ASN 51 HB1 ASN 51 76.770 6.132 1.120 374 HD21 ASN 51 HD21 ASN 51 78.588 4.594 -0.545 375 HD22 ASN 51 HD22 ASN 51 77.979 4.632 -2.129 376 H ASP 52 HN ASP 52 74.816 8.469 1.659 377 HA ASP 52 HA ASP 52 76.057 9.059 4.269 378 HB2 ASP 52 HB2 ASP 52 74.011 10.782 2.848 379 HB3 ASP 52 HB1 ASP 52 74.383 10.912 4.567 380 H ILE 53 HN ILE 53 74.787 8.459 6.016 381 HA ILE 53 HA ILE 53 72.276 7.010 5.379 382 HB ILE 53 HB ILE 53 74.447 6.236 7.348 383 HG12 ILE 53 HG12 ILE 53 73.403 4.793 4.890 384 HG13 ILE 53 HG11 ILE 53 74.860 5.782 4.895 385 HG21 ILE 53 HG21 ILE 53 72.989 4.210 7.654 386 HG22 ILE 53 HG22 ILE 53 71.731 5.040 6.738 387 HG23 ILE 53 HG23 ILE 53 72.277 5.696 8.283 388 HD11 ILE 53 HD11 ILE 53 75.967 4.326 6.421 389 HD12 ILE 53 HD12 ILE 53 75.192 3.266 5.243 390 HD13 ILE 53 HD13 ILE 53 74.468 3.495 6.834 391 H THR 54 HN THR 54 70.564 7.717 6.447 392 HA THR 54 HA THR 54 70.948 9.281 8.944 393 HB THR 54 HB THR 54 68.990 9.768 6.685 394 HG1 THR 54 HG1 THR 54 70.597 10.911 6.009 395 HG21 THR 54 HG21 THR 54 69.354 11.091 9.379 396 HG22 THR 54 HG22 THR 54 67.904 10.296 8.762 397 HG23 THR 54 HG23 THR 54 68.447 11.816 8.053 398 H VAL 55 HN VAL 55 69.781 8.630 10.654 399 HA VAL 55 HA VAL 55 67.964 6.360 10.339 400 HB VAL 55 HB VAL 55 68.970 7.811 12.801 401 HG11 VAL 55 HG11 VAL 55 67.212 5.371 12.451 402 HG12 VAL 55 HG12 VAL 55 66.845 6.844 13.350 403 HG13 VAL 55 HG13 VAL 55 68.069 5.726 13.950 404 HG21 VAL 55 HG21 VAL 55 70.402 5.884 13.094 405 HG22 VAL 55 HG22 VAL 55 70.642 6.483 11.453 406 HG23 VAL 55 HG23 VAL 55 69.647 5.054 11.732 407 H GLU 56 HN GLU 56 65.817 6.521 10.289 408 HA GLU 56 HA GLU 56 64.543 9.084 11.088 409 HB2 GLU 56 HB2 GLU 56 63.791 7.106 8.925 410 HB3 GLU 56 HB1 GLU 56 62.747 8.427 9.450 411 HG2 GLU 56 HG2 GLU 56 64.494 10.057 8.859 412 HG3 GLU 56 HG1 GLU 56 65.562 8.746 8.362 413 H GLN 57 HN GLN 57 62.457 8.957 12.081 414 HA GLN 57 HA GLN 57 62.206 7.050 14.110 415 HB2 GLN 57 HB2 GLN 57 60.133 8.850 12.843 416 HB3 GLN 57 HB1 GLN 57 59.826 7.871 14.277 417 HG2 GLN 57 HG2 GLN 57 61.658 8.998 15.463 418 HG3 GLN 57 HG1 GLN 57 62.015 9.955 14.027 419 HE21 GLN 57 HE21 GLN 57 61.479 11.612 16.023 420 HE22 GLN 57 HE22 GLN 57 59.875 12.171 16.025 421 H GLY 58 HN GLY 58 60.630 5.363 14.421 422 HA2 GLY 58 HA2 GLY 58 59.267 3.599 13.776 423 HA3 GLY 58 HA1 GLY 58 59.138 4.328 12.177 424 H THR 59 HN THR 59 62.324 4.082 13.248 425 HA THR 59 HA THR 59 64.093 2.745 12.739 426 HB THR 59 HB THR 59 62.307 0.473 11.958 427 HG1 THR 59 HG1 THR 59 61.208 0.964 13.698 428 HG21 THR 59 HG21 THR 59 64.734 0.658 13.766 429 HG22 THR 59 HG22 THR 59 64.806 0.275 12.046 430 HG23 THR 59 HG23 THR 59 63.985 -0.818 13.159 431 H LEU 60 HN LEU 60 62.515 4.287 10.663 432 HA LEU 60 HA LEU 60 62.906 2.789 8.208 433 HB2 LEU 60 HB2 LEU 60 61.958 5.557 8.897 434 HB3 LEU 60 HB1 LEU 60 62.478 5.225 7.246 435 HG LEU 60 HG LEU 60 60.877 3.290 7.192 436 HD11 LEU 60 HD11 LEU 60 59.066 3.381 8.976 437 HD12 LEU 60 HD12 LEU 60 60.143 4.430 9.895 438 HD13 LEU 60 HD13 LEU 60 60.632 2.779 9.521 439 HD21 LEU 60 HD21 LEU 60 58.846 4.724 7.028 440 HD22 LEU 60 HD22 LEU 60 60.243 5.458 6.242 441 HD23 LEU 60 HD23 LEU 60 59.727 6.026 7.830 442 H HIS 61 HN HIS 61 64.508 3.092 6.679 443 HA HIS 61 HA HIS 61 66.920 4.585 7.567 444 HB2 HIS 61 HB2 HIS 61 66.649 2.178 5.745 445 HB3 HIS 61 HB1 HIS 61 68.157 3.036 6.053 446 HD1 HIS 61 HD1 HIS 61 68.088 0.137 6.871 447 HD2 HIS 61 HD2 HIS 61 66.861 3.184 9.439 448 HE1 HIS 61 HE1 HIS 61 68.258 -0.792 9.219 449 H LEU 62 HN LEU 62 68.135 5.704 5.886 450 HA LEU 62 HA LEU 62 66.815 6.126 3.306 451 HB2 LEU 62 HB2 LEU 62 65.838 7.696 5.152 452 HB3 LEU 62 HB1 LEU 62 67.372 8.545 5.021 453 HG LEU 62 HG LEU 62 65.788 9.637 3.566 454 HD11 LEU 62 HD11 LEU 62 67.459 7.938 1.714 455 HD12 LEU 62 HD12 LEU 62 68.169 9.189 2.739 456 HD13 LEU 62 HD13 LEU 62 66.975 9.621 1.520 457 HD21 LEU 62 HD21 LEU 62 65.364 7.214 1.850 458 HD22 LEU 62 HD22 LEU 62 64.311 8.595 2.128 459 HD23 LEU 62 HD23 LEU 62 64.441 7.332 3.347 460 H LEU 63 HN LEU 63 68.544 5.750 1.991 461 HA LEU 63 HA LEU 63 71.184 6.851 2.750 462 HB2 LEU 63 HB2 LEU 63 70.248 4.633 0.977 463 HB3 LEU 63 HB1 LEU 63 71.699 5.491 0.468 464 HG LEU 63 HG LEU 63 72.809 4.988 2.553 465 HD11 LEU 63 HD11 LEU 63 70.060 4.075 3.389 466 HD12 LEU 63 HD12 LEU 63 71.187 5.128 4.244 467 HD13 LEU 63 HD13 LEU 63 71.489 3.396 4.167 468 HD21 LEU 63 HD21 LEU 63 72.898 2.544 2.400 469 HD22 LEU 63 HD22 LEU 63 72.764 3.233 0.782 470 HD23 LEU 63 HD23 LEU 63 71.349 2.521 1.557 471 H THR 64 HN THR 64 71.444 8.895 2.160 472 HA THR 64 HA THR 64 70.089 9.930 -0.207 473 HB THR 64 HB THR 64 71.941 11.282 1.773 474 HG1 THR 64 HG1 THR 64 69.577 12.220 2.014 475 HG21 THR 64 HG21 THR 64 70.912 13.358 0.779 476 HG22 THR 64 HG22 THR 64 70.213 12.339 -0.478 477 HG23 THR 64 HG23 THR 64 71.965 12.476 -0.326 478 H LEU 65 HN LEU 65 70.967 9.609 -2.120 479 HA LEU 65 HA LEU 65 73.908 9.428 -2.398 480 HB2 LEU 65 HB2 LEU 65 71.743 8.823 -4.432 481 HB3 LEU 65 HB1 LEU 65 73.462 8.473 -4.593 482 HG LEU 65 HG LEU 65 71.633 7.302 -2.473 483 HD11 LEU 65 HD11 LEU 65 71.111 6.410 -4.684 484 HD12 LEU 65 HD12 LEU 65 71.981 5.186 -3.757 485 HD13 LEU 65 HD13 LEU 65 72.820 6.113 -5.001 486 HD21 LEU 65 HD21 LEU 65 73.723 5.720 -2.313 487 HD22 LEU 65 HD22 LEU 65 73.787 7.289 -1.518 488 HD23 LEU 65 HD23 LEU 65 74.584 7.058 -3.073 489 H HIS 66 HN HIS 66 74.728 11.446 -2.560 490 HA HIS 66 HA HIS 66 73.361 13.452 -4.229 491 HB2 HIS 66 HB2 HIS 66 74.039 14.155 -1.987 492 HB3 HIS 66 HB1 HIS 66 75.711 13.720 -2.341 493 HD1 HIS 66 HD1 HIS 66 72.999 15.996 -3.770 494 HD2 HIS 66 HD2 HIS 66 77.150 15.803 -3.439 495 HE1 HIS 66 HE1 HIS 66 73.895 18.163 -4.732 496 H LYS 67 HN LYS 67 74.117 14.168 -6.112 497 HA LYS 67 HA LYS 67 75.306 14.202 -8.063 498 HB2 LYS 67 HB2 LYS 67 76.839 15.407 -6.310 499 HB3 LYS 67 HB1 LYS 67 77.837 13.963 -6.450 500 HG2 LYS 67 HG2 LYS 67 78.085 14.295 -8.850 501 HG3 LYS 67 HG1 LYS 67 76.941 15.636 -8.822 502 HD2 LYS 67 HD2 LYS 67 79.055 16.685 -8.843 503 HD3 LYS 67 HD1 LYS 67 78.558 16.751 -7.154 504 HE2 LYS 67 HE2 LYS 67 79.956 14.834 -6.615 505 HE3 LYS 67 HE1 LYS 67 80.345 14.596 -8.318 506 HZ1 LYS 67 HZ1 LYS 67 82.108 15.862 -7.835 507 HZ2 LYS 67 HZ2 LYS 67 81.405 16.500 -6.426 508 HZ3 LYS 67 HZ3 LYS 67 81.024 17.162 -7.944 509 H VAL 68 HN VAL 68 74.367 11.895 -8.164 510 HA VAL 68 HA VAL 68 76.026 9.657 -7.750 511 HB VAL 68 HB VAL 68 73.445 9.832 -8.282 512 HG11 VAL 68 HG11 VAL 68 72.817 9.459 -10.553 513 HG12 VAL 68 HG12 VAL 68 74.490 9.195 -11.051 514 HG13 VAL 68 HG13 VAL 68 73.948 10.813 -10.595 515 HG21 VAL 68 HG21 VAL 68 74.512 7.745 -7.697 516 HG22 VAL 68 HG22 VAL 68 75.259 7.623 -9.289 517 HG23 VAL 68 HG23 VAL 68 73.510 7.460 -9.120 518 H THR 69 HN THR 69 77.175 8.373 -9.266 519 HA THR 69 HA THR 69 77.974 9.704 -11.779 520 HB THR 69 HB THR 69 79.759 10.250 -10.238 521 HG1 THR 69 HG1 THR 69 80.115 9.112 -12.412 522 HG21 THR 69 HG21 THR 69 81.011 8.350 -9.115 523 HG22 THR 69 HG22 THR 69 79.657 7.304 -9.546 524 HG23 THR 69 HG23 THR 69 79.404 8.673 -8.463 525 H LEU 70 HN LEU 70 79.060 8.193 -13.259 526 HA LEU 70 HA LEU 70 77.563 5.841 -13.637 527 HB2 LEU 70 HB2 LEU 70 80.225 6.746 -14.743 528 HB3 LEU 70 HB1 LEU 70 79.406 5.287 -15.292 529 HG LEU 70 HG LEU 70 78.059 7.999 -15.280 530 HD11 LEU 70 HD11 LEU 70 78.585 7.835 -17.832 531 HD12 LEU 70 HD12 LEU 70 79.869 6.731 -17.336 532 HD13 LEU 70 HD13 LEU 70 79.855 8.392 -16.742 533 HD21 LEU 70 HD21 LEU 70 77.457 5.280 -16.468 534 HD22 LEU 70 HD22 LEU 70 76.792 6.735 -17.204 535 HD23 LEU 70 HD23 LEU 70 76.399 6.339 -15.537 536 H GLU 71 HN GLU 71 80.479 6.517 -11.922 537 HA GLU 71 HA GLU 71 81.455 3.862 -11.652 538 HB2 GLU 71 HB2 GLU 71 82.802 5.924 -11.264 539 HB3 GLU 71 HB1 GLU 71 81.845 6.241 -9.819 540 HG2 GLU 71 HG2 GLU 71 83.869 5.142 -9.119 541 HG3 GLU 71 HG1 GLU 71 82.557 3.982 -8.948 542 H ASP 72 HN ASP 72 78.934 5.675 -10.128 543 HA ASP 72 HA ASP 72 78.715 4.276 -7.689 544 HB2 ASP 72 HB2 ASP 72 77.534 6.413 -8.211 545 HB3 ASP 72 HB1 ASP 72 76.465 5.516 -9.291 546 H ALA 73 HN ALA 73 77.345 3.660 -10.904 547 HA ALA 73 HA ALA 73 75.527 1.693 -10.528 548 HB1 ALA 73 HB1 ALA 73 77.786 1.457 -12.528 549 HB2 ALA 73 HB2 ALA 73 76.382 2.500 -12.744 550 HB3 ALA 73 HB3 ALA 73 76.176 0.750 -12.656 551 H GLY 74 HN GLY 74 75.465 -0.124 -9.397 552 HA2 GLY 74 HA2 GLY 74 77.474 -2.126 -9.456 553 HA3 GLY 74 HA1 GLY 74 77.584 -1.213 -7.952 554 H THR 75 HN THR 75 77.021 -3.736 -7.518 555 HA THR 75 HA THR 75 74.079 -4.030 -7.384 556 HB THR 75 HB THR 75 76.310 -6.052 -7.089 557 HG1 THR 75 HG1 THR 75 75.366 -5.056 -9.191 558 HG21 THR 75 HG21 THR 75 74.579 -6.807 -5.647 559 HG22 THR 75 HG22 THR 75 74.307 -7.661 -7.166 560 HG23 THR 75 HG23 THR 75 73.317 -6.262 -6.750 561 H VAL 76 HN VAL 76 73.036 -3.817 -5.534 562 HA VAL 76 HA VAL 76 74.560 -3.916 -2.981 563 HB VAL 76 HB VAL 76 72.115 -2.285 -3.736 564 HG11 VAL 76 HG11 VAL 76 73.509 -2.743 -1.091 565 HG12 VAL 76 HG12 VAL 76 71.801 -2.965 -1.471 566 HG13 VAL 76 HG13 VAL 76 72.482 -1.341 -1.388 567 HG21 VAL 76 HG21 VAL 76 74.277 -1.391 -4.553 568 HG22 VAL 76 HG22 VAL 76 74.918 -1.463 -2.911 569 HG23 VAL 76 HG23 VAL 76 73.589 -0.368 -3.291 570 H SER 77 HN SER 77 73.916 -5.451 -1.573 571 HA SER 77 HA SER 77 71.177 -6.508 -1.672 572 HB2 SER 77 HB2 SER 77 72.411 -8.045 -3.104 573 HB3 SER 77 HB1 SER 77 73.667 -8.220 -1.882 574 HG SER 77 HG SER 77 72.449 -9.795 -1.198 575 H PHE 78 HN PHE 78 70.888 -8.100 0.208 576 HA PHE 78 HA PHE 78 72.641 -7.598 2.489 577 HB2 PHE 78 HB2 PHE 78 70.721 -6.834 3.889 578 HB3 PHE 78 HB1 PHE 78 71.160 -5.692 2.618 579 HD1 PHE 78 HD1 PHE 78 68.686 -8.193 3.715 580 HD2 PHE 78 HD2 PHE 78 69.731 -5.332 0.693 581 HE1 PHE 78 HE1 PHE 78 66.386 -8.325 2.796 582 HE2 PHE 78 HE2 PHE 78 67.435 -5.465 -0.230 583 HZ PHE 78 HZ PHE 78 65.759 -6.955 0.826 584 H HIS 79 HN HIS 79 72.365 -9.040 4.186 585 HA HIS 79 HA HIS 79 70.681 -11.412 3.587 586 HB2 HIS 79 HB2 HIS 79 73.384 -11.230 4.940 587 HB3 HIS 79 HB1 HIS 79 72.416 -12.701 4.827 588 HD1 HIS 79 HD1 HIS 79 74.374 -10.274 2.707 589 HD2 HIS 79 HD2 HIS 79 72.393 -13.916 2.273 590 HE1 HIS 79 HE1 HIS 79 74.984 -11.153 0.411 591 H VAL 80 HN VAL 80 69.198 -11.912 5.033 592 HA VAL 80 HA VAL 80 69.365 -10.777 7.770 593 HB VAL 80 HB VAL 80 66.773 -11.498 6.417 594 HG11 VAL 80 HG11 VAL 80 67.390 -9.361 8.460 595 HG12 VAL 80 HG12 VAL 80 66.991 -11.018 8.913 596 HG13 VAL 80 HG13 VAL 80 65.815 -10.036 8.038 597 HG21 VAL 80 HG21 VAL 80 66.669 -8.972 5.903 598 HG22 VAL 80 HG22 VAL 80 67.669 -9.966 4.844 599 HG23 VAL 80 HG23 VAL 80 68.422 -8.989 6.103 600 H GLY 81 HN GLY 81 69.343 -12.174 9.393 601 HA2 GLY 81 HA2 GLY 81 69.785 -14.862 9.179 602 HA3 GLY 81 HA1 GLY 81 69.102 -14.109 10.609 603 H THR 82 HN THR 82 66.699 -13.309 8.774 604 HA THR 82 HA THR 82 65.301 -15.911 9.089 605 HB THR 82 HB THR 82 64.086 -14.436 10.392 606 HG1 THR 82 HG1 THR 82 62.360 -14.750 9.264 607 HG21 THR 82 HG21 THR 82 65.323 -12.437 10.105 608 HG22 THR 82 HG22 THR 82 63.685 -12.031 9.592 609 HG23 THR 82 HG23 THR 82 64.935 -12.345 8.387 610 H CYS 83 HN CYS 83 65.929 -13.295 6.800 611 HA CYS 83 HA CYS 83 65.026 -15.043 4.612 612 HB2 CYS 83 HB2 CYS 83 64.110 -12.166 4.822 613 HB3 CYS 83 HB1 CYS 83 63.646 -13.354 3.605 614 HG CYS 83 HG CYS 83 61.918 -13.062 5.758 615 H SER 84 HN SER 84 65.414 -13.549 2.451 616 HA SER 84 HA SER 84 67.795 -11.908 2.645 617 HB2 SER 84 HB2 SER 84 69.226 -13.343 1.295 618 HB3 SER 84 HB1 SER 84 68.738 -14.201 2.754 619 HG SER 84 HG SER 84 67.613 -14.421 0.153 620 H SER 85 HN SER 85 68.411 -10.973 0.583 621 HA SER 85 HA SER 85 66.890 -11.491 -1.780 622 HB2 SER 85 HB2 SER 85 65.142 -10.325 -0.534 623 HB3 SER 85 HB1 SER 85 66.230 -8.974 -0.242 624 HG SER 85 HG SER 85 66.100 -9.671 -2.869 625 H GLU 86 HN GLU 86 67.316 -9.802 -3.478 626 HA GLU 86 HA GLU 86 69.893 -8.399 -3.075 627 HB2 GLU 86 HB2 GLU 86 69.155 -10.221 -5.382 628 HB3 GLU 86 HB1 GLU 86 70.549 -9.142 -5.374 629 HG2 GLU 86 HG2 GLU 86 71.435 -10.289 -3.382 630 HG3 GLU 86 HG1 GLU 86 70.036 -11.359 -3.369 631 H ALA 87 HN ALA 87 70.285 -6.770 -4.770 632 HA ALA 87 HA ALA 87 67.950 -5.844 -6.269 633 HB1 ALA 87 HB1 ALA 87 67.840 -3.693 -5.275 634 HB2 ALA 87 HB2 ALA 87 69.342 -3.940 -4.384 635 HB3 ALA 87 HB3 ALA 87 67.885 -4.820 -3.919 636 H GLN 88 HN GLN 88 68.509 -4.286 -7.897 637 HA GLN 88 HA GLN 88 71.427 -4.106 -8.448 638 HB2 GLN 88 HB2 GLN 88 69.168 -4.562 -10.403 639 HB3 GLN 88 HB1 GLN 88 70.840 -4.248 -10.846 640 HG2 GLN 88 HG2 GLN 88 71.567 -6.264 -9.666 641 HG3 GLN 88 HG1 GLN 88 69.911 -6.572 -9.139 642 HE21 GLN 88 HE21 GLN 88 70.255 -8.690 -10.414 643 HE22 GLN 88 HE22 GLN 88 69.958 -8.653 -12.084 644 H LEU 89 HN LEU 89 72.212 -2.176 -8.894 645 HA LEU 89 HA LEU 89 70.337 0.069 -9.393 646 HB2 LEU 89 HB2 LEU 89 71.463 0.254 -7.212 647 HB3 LEU 89 HB1 LEU 89 73.032 0.086 -7.997 648 HG LEU 89 HG LEU 89 72.629 2.169 -9.264 649 HD11 LEU 89 HD11 LEU 89 69.961 1.985 -7.879 650 HD12 LEU 89 HD12 LEU 89 70.318 2.367 -9.565 651 HD13 LEU 89 HD13 LEU 89 70.615 3.565 -8.311 652 HD21 LEU 89 HD21 LEU 89 72.070 2.617 -6.324 653 HD22 LEU 89 HD22 LEU 89 72.945 3.679 -7.426 654 HD23 LEU 89 HD23 LEU 89 73.652 2.139 -6.940 655 H LYS 90 HN LYS 90 70.418 0.311 -11.575 656 HA LYS 90 HA LYS 90 73.064 0.344 -12.909 657 HB2 LYS 90 HB2 LYS 90 70.277 -0.308 -13.791 658 HB3 LYS 90 HB1 LYS 90 71.319 0.470 -14.978 659 HG2 LYS 90 HG2 LYS 90 71.563 -1.909 -15.248 660 HG3 LYS 90 HG1 LYS 90 73.048 -1.317 -14.509 661 HD2 LYS 90 HD2 LYS 90 72.282 -2.035 -12.305 662 HD3 LYS 90 HD1 LYS 90 70.726 -2.524 -12.978 663 HE2 LYS 90 HE2 LYS 90 72.016 -4.533 -12.821 664 HE3 LYS 90 HE1 LYS 90 72.039 -4.083 -14.523 665 HZ1 LYS 90 HZ1 LYS 90 74.232 -3.997 -14.427 666 HZ2 LYS 90 HZ2 LYS 90 74.207 -4.403 -12.776 667 HZ3 LYS 90 HZ3 LYS 90 74.153 -2.773 -13.255 668 H VAL 91 HN VAL 91 73.673 2.117 -14.154 669 HA VAL 91 HA VAL 91 72.085 4.599 -13.742 670 HB VAL 91 HB VAL 91 75.094 4.449 -14.047 671 HG11 VAL 91 HG11 VAL 91 73.872 6.584 -14.596 672 HG12 VAL 91 HG12 VAL 91 75.025 6.738 -13.270 673 HG13 VAL 91 HG13 VAL 91 73.298 6.621 -12.930 674 HG21 VAL 91 HG21 VAL 91 75.281 4.681 -11.644 675 HG22 VAL 91 HG22 VAL 91 74.280 3.267 -11.962 676 HG23 VAL 91 HG23 VAL 91 73.530 4.785 -11.467 677 H THR 92 HN THR 92 71.032 4.693 -15.689 678 HA THR 92 HA THR 92 72.720 5.083 -18.084 679 HB THR 92 HB THR 92 71.942 2.791 -18.268 680 HG1 THR 92 HG1 THR 92 71.833 4.197 -20.119 681 HG21 THR 92 HG21 THR 92 69.190 3.968 -17.788 682 HG22 THR 92 HG22 THR 92 70.067 2.888 -16.705 683 HG23 THR 92 HG23 THR 92 69.501 2.299 -18.268 684 H ALA 93 HN ALA 93 71.897 6.556 -19.577 685 HA ALA 93 HA ALA 93 69.792 8.315 -18.540 686 HB1 ALA 93 HB1 ALA 93 71.928 9.298 -19.316 687 HB2 ALA 93 HB2 ALA 93 70.542 9.898 -20.227 688 HB3 ALA 93 HB3 ALA 93 71.604 8.681 -20.937 689 H GLY 94 HN GLY 94 69.987 5.692 -20.622 690 HA2 GLY 94 HA2 GLY 94 67.448 5.386 -21.362 691 HA3 GLY 94 HA1 GLY 94 67.944 6.636 -22.498 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 52.774 -8.776 22.649 2 H2 MET 1 HT2 MET 1 51.286 -9.586 22.509 3 H3 MET 1 HT3 MET 1 51.506 -8.073 21.769 4 HA MET 1 HA MET 1 52.315 -10.713 20.882 5 HB2 MET 1 HB2 MET 1 51.719 -8.051 19.542 6 HB3 MET 1 HB1 MET 1 52.071 -9.544 18.671 7 HG2 MET 1 HG2 MET 1 49.812 -9.240 20.671 8 HG3 MET 1 HG1 MET 1 49.611 -9.089 18.930 9 HE1 MET 1 HE1 MET 1 49.748 -10.695 17.288 10 HE2 MET 1 HE2 MET 1 49.841 -12.443 17.450 11 HE3 MET 1 HE3 MET 1 51.312 -11.480 17.542 12 H ALA 2 HN ALA 2 54.082 -10.592 19.062 13 HA ALA 2 HA ALA 2 56.191 -8.681 19.402 14 HB1 ALA 2 HB1 ALA 2 56.495 -11.405 20.678 15 HB2 ALA 2 HB2 ALA 2 56.638 -9.829 21.457 16 HB3 ALA 2 HB3 ALA 2 57.858 -10.354 20.297 17 HA PRO 3 HA PRO 3 56.138 -11.180 15.510 18 HB2 PRO 3 HB2 PRO 3 56.382 -8.672 14.048 19 HB3 PRO 3 HB1 PRO 3 55.052 -9.840 14.021 20 HG2 PRO 3 HG2 PRO 3 54.922 -7.312 15.143 21 HG3 PRO 3 HG1 PRO 3 53.833 -8.654 15.524 22 HD2 PRO 3 HD2 PRO 3 56.116 -7.578 17.114 23 HD3 PRO 3 HD1 PRO 3 54.630 -8.375 17.674 24 H GLU 4 HN GLU 4 57.846 -11.727 14.179 25 HA GLU 4 HA GLU 4 60.448 -11.145 15.139 26 HB2 GLU 4 HB2 GLU 4 61.229 -12.624 13.451 27 HB3 GLU 4 HB1 GLU 4 59.664 -13.256 13.947 28 HG2 GLU 4 HG2 GLU 4 60.211 -11.579 11.471 29 HG3 GLU 4 HG1 GLU 4 59.829 -13.295 11.514 30 H VAL 5 HN VAL 5 62.013 -10.789 12.893 31 HA VAL 5 HA VAL 5 61.973 -7.978 12.599 32 HB VAL 5 HB VAL 5 63.346 -9.837 10.659 33 HG11 VAL 5 HG11 VAL 5 63.657 -7.475 10.246 34 HG12 VAL 5 HG12 VAL 5 65.155 -8.105 10.925 35 HG13 VAL 5 HG13 VAL 5 64.050 -7.180 11.938 36 HG21 VAL 5 HG21 VAL 5 63.867 -10.938 12.670 37 HG22 VAL 5 HG22 VAL 5 63.913 -9.442 13.594 38 HG23 VAL 5 HG23 VAL 5 65.217 -9.822 12.470 39 H THR 6 HN THR 6 61.073 -6.660 11.049 40 HA THR 6 HA THR 6 59.348 -8.008 9.032 41 HB THR 6 HB THR 6 59.228 -5.123 9.903 42 HG1 THR 6 HG1 THR 6 57.348 -6.018 11.081 43 HG21 THR 6 HG21 THR 6 57.098 -5.107 8.835 44 HG22 THR 6 HG22 THR 6 57.091 -6.862 8.670 45 HG23 THR 6 HG23 THR 6 58.192 -5.888 7.697 46 H ILE 7 HN ILE 7 59.641 -7.727 6.890 47 HA ILE 7 HA ILE 7 61.776 -5.849 6.018 48 HB ILE 7 HB ILE 7 61.185 -8.674 5.192 49 HG12 ILE 7 HG12 ILE 7 63.671 -8.855 5.425 50 HG13 ILE 7 HG11 ILE 7 63.710 -7.171 5.932 51 HG21 ILE 7 HG21 ILE 7 62.653 -6.579 3.586 52 HG22 ILE 7 HG22 ILE 7 61.285 -7.564 3.062 53 HG23 ILE 7 HG23 ILE 7 62.859 -8.311 3.329 54 HD11 ILE 7 HD11 ILE 7 63.511 -9.295 7.642 55 HD12 ILE 7 HD12 ILE 7 61.814 -8.858 7.460 56 HD13 ILE 7 HD13 ILE 7 62.981 -7.661 8.023 57 H LEU 8 HN LEU 8 60.999 -4.264 4.914 58 HA LEU 8 HA LEU 8 58.873 -4.708 2.902 59 HB2 LEU 8 HB2 LEU 8 59.178 -2.316 4.745 60 HB3 LEU 8 HB1 LEU 8 58.047 -2.413 3.395 61 HG LEU 8 HG LEU 8 58.096 -4.315 5.757 62 HD11 LEU 8 HD11 LEU 8 57.401 -1.969 6.295 63 HD12 LEU 8 HD12 LEU 8 56.121 -3.157 6.544 64 HD13 LEU 8 HD13 LEU 8 56.104 -2.124 5.112 65 HD21 LEU 8 HD21 LEU 8 57.036 -5.597 4.156 66 HD22 LEU 8 HD22 LEU 8 56.545 -4.206 3.193 67 HD23 LEU 8 HD23 LEU 8 55.643 -4.638 4.646 68 H GLU 9 HN GLU 9 60.246 -4.778 1.148 69 HA GLU 9 HA GLU 9 61.993 -2.407 0.711 70 HB2 GLU 9 HB2 GLU 9 63.289 -4.111 -0.764 71 HB3 GLU 9 HB1 GLU 9 63.490 -4.172 0.986 72 HG2 GLU 9 HG2 GLU 9 62.039 -6.037 1.205 73 HG3 GLU 9 HG1 GLU 9 61.405 -5.840 -0.429 74 HA PRO 10 HA PRO 10 59.066 -2.468 -2.843 75 HB2 PRO 10 HB2 PRO 10 59.153 0.432 -2.894 76 HB3 PRO 10 HB1 PRO 10 57.788 -0.606 -2.451 77 HG2 PRO 10 HG2 PRO 10 59.222 1.024 -0.699 78 HG3 PRO 10 HG1 PRO 10 58.149 -0.307 -0.235 79 HD2 PRO 10 HD2 PRO 10 61.132 -0.237 -0.318 80 HD3 PRO 10 HD1 PRO 10 60.046 -1.206 0.706 81 H LEU 11 HN LEU 11 62.189 -1.537 -2.212 82 HA LEU 11 HA LEU 11 63.022 -0.213 -4.584 83 HB2 LEU 11 HB2 LEU 11 64.557 -2.009 -2.684 84 HB3 LEU 11 HB1 LEU 11 65.290 -0.945 -3.880 85 HG LEU 11 HG LEU 11 63.443 0.032 -1.679 86 HD11 LEU 11 HD11 LEU 11 66.426 -0.401 -1.733 87 HD12 LEU 11 HD12 LEU 11 65.272 -0.789 -0.460 88 HD13 LEU 11 HD13 LEU 11 65.734 0.887 -0.747 89 HD21 LEU 11 HD21 LEU 11 64.819 2.194 -2.240 90 HD22 LEU 11 HD22 LEU 11 63.522 1.711 -3.335 91 HD23 LEU 11 HD23 LEU 11 65.200 1.360 -3.748 92 H GLN 12 HN GLN 12 61.729 -1.647 -6.105 93 HA GLN 12 HA GLN 12 62.510 -4.360 -6.540 94 HB2 GLN 12 HB2 GLN 12 61.048 -2.370 -8.285 95 HB3 GLN 12 HB1 GLN 12 61.235 -4.081 -8.671 96 HG2 GLN 12 HG2 GLN 12 60.051 -4.727 -6.655 97 HG3 GLN 12 HG1 GLN 12 59.987 -3.051 -6.115 98 HE21 GLN 12 HE21 GLN 12 57.543 -3.584 -6.121 99 HE22 GLN 12 HE22 GLN 12 56.708 -3.346 -7.580 100 H ASP 13 HN ASP 13 63.196 -1.350 -8.303 101 HA ASP 13 HA ASP 13 65.846 -2.103 -9.032 102 HB2 ASP 13 HB2 ASP 13 64.631 -3.645 -10.527 103 HB3 ASP 13 HB1 ASP 13 63.728 -2.285 -11.191 104 H VAL 14 HN VAL 14 66.961 -0.271 -9.685 105 HA VAL 14 HA VAL 14 65.339 2.112 -10.426 106 HB VAL 14 HB VAL 14 67.720 1.950 -8.566 107 HG11 VAL 14 HG11 VAL 14 66.409 4.334 -9.898 108 HG12 VAL 14 HG12 VAL 14 68.113 3.885 -9.934 109 HG13 VAL 14 HG13 VAL 14 67.388 4.477 -8.440 110 HG21 VAL 14 HG21 VAL 14 65.547 1.502 -7.517 111 HG22 VAL 14 HG22 VAL 14 64.873 2.962 -8.244 112 HG23 VAL 14 HG23 VAL 14 66.132 3.088 -7.017 113 H GLN 15 HN GLN 15 65.957 3.181 -12.198 114 HA GLN 15 HA GLN 15 68.640 2.674 -13.345 115 HB2 GLN 15 HB2 GLN 15 65.996 2.620 -14.828 116 HB3 GLN 15 HB1 GLN 15 67.586 2.572 -15.590 117 HG2 GLN 15 HG2 GLN 15 68.120 0.499 -14.399 118 HG3 GLN 15 HG1 GLN 15 66.565 0.555 -13.577 119 HE21 GLN 15 HE21 GLN 15 66.631 -1.714 -14.816 120 HE22 GLN 15 HE22 GLN 15 65.901 -1.709 -16.348 121 H LEU 16 HN LEU 16 69.469 4.696 -12.910 122 HA LEU 16 HA LEU 16 68.039 7.008 -14.125 123 HB2 LEU 16 HB2 LEU 16 69.717 6.981 -11.610 124 HB3 LEU 16 HB1 LEU 16 68.973 8.403 -12.342 125 HG LEU 16 HG LEU 16 67.457 5.962 -11.369 126 HD11 LEU 16 HD11 LEU 16 66.697 7.481 -9.554 127 HD12 LEU 16 HD12 LEU 16 67.814 8.710 -10.149 128 HD13 LEU 16 HD13 LEU 16 68.436 7.191 -9.508 129 HD21 LEU 16 HD21 LEU 16 66.031 6.894 -12.964 130 HD22 LEU 16 HD22 LEU 16 66.672 8.523 -12.746 131 HD23 LEU 16 HD23 LEU 16 65.568 7.842 -11.553 132 H SER 17 HN SER 17 69.194 8.374 -15.351 133 HA SER 17 HA SER 17 71.672 7.497 -16.434 134 HB2 SER 17 HB2 SER 17 70.065 8.786 -17.758 135 HB3 SER 17 HB1 SER 17 70.257 10.164 -16.679 136 HG SER 17 HG SER 17 72.305 8.935 -18.220 137 H GLU 18 HN GLU 18 73.743 8.227 -16.103 138 HA GLU 18 HA GLU 18 74.543 9.034 -13.579 139 HB2 GLU 18 HB2 GLU 18 76.098 8.079 -15.207 140 HB3 GLU 18 HB1 GLU 18 75.966 9.519 -16.211 141 HG2 GLU 18 HG2 GLU 18 76.821 9.732 -13.323 142 HG3 GLU 18 HG1 GLU 18 77.990 9.320 -14.572 143 H GLY 19 HN GLY 19 75.221 10.997 -12.686 144 HA2 GLY 19 HA2 GLY 19 75.326 13.305 -12.424 145 HA3 GLY 19 HA1 GLY 19 74.855 13.488 -14.111 146 H GLN 20 HN GLN 20 72.896 11.389 -12.263 147 HA GLN 20 HA GLN 20 70.800 13.482 -12.014 148 HB2 GLN 20 HB2 GLN 20 70.361 11.622 -13.685 149 HB3 GLN 20 HB1 GLN 20 70.344 10.507 -12.319 150 HG2 GLN 20 HG2 GLN 20 68.057 11.159 -12.776 151 HG3 GLN 20 HG1 GLN 20 68.551 11.926 -11.268 152 HE21 GLN 20 HE21 GLN 20 67.878 12.545 -14.705 153 HE22 GLN 20 HE22 GLN 20 67.768 14.231 -14.552 154 H ASP 21 HN ASP 21 69.565 13.515 -10.111 155 HA ASP 21 HA ASP 21 70.933 12.634 -7.764 156 HB2 ASP 21 HB2 ASP 21 68.117 13.702 -8.101 157 HB3 ASP 21 HB1 ASP 21 68.953 13.500 -6.564 158 H ALA 22 HN ALA 22 70.614 10.870 -6.521 159 HA ALA 22 HA ALA 22 68.408 9.019 -7.229 160 HB1 ALA 22 HB1 ALA 22 70.307 8.074 -8.298 161 HB2 ALA 22 HB2 ALA 22 70.099 7.163 -6.804 162 HB3 ALA 22 HB3 ALA 22 71.346 8.405 -6.917 163 H SER 23 HN SER 23 67.765 7.604 -5.535 164 HA SER 23 HA SER 23 68.859 7.953 -2.877 165 HB2 SER 23 HB2 SER 23 66.220 9.168 -3.665 166 HB3 SER 23 HB1 SER 23 66.545 8.683 -2.003 167 HG SER 23 HG SER 23 68.668 9.973 -2.762 168 H PHE 24 HN PHE 24 67.818 6.571 -1.291 169 HA PHE 24 HA PHE 24 66.144 4.397 -2.395 170 HB2 PHE 24 HB2 PHE 24 68.803 4.166 -0.981 171 HB3 PHE 24 HB1 PHE 24 67.639 2.841 -0.966 172 HD1 PHE 24 HD1 PHE 24 69.533 5.114 -3.266 173 HD2 PHE 24 HD2 PHE 24 67.461 1.384 -2.805 174 HE1 PHE 24 HE1 PHE 24 70.299 4.404 -5.517 175 HE2 PHE 24 HE2 PHE 24 68.224 0.676 -5.050 176 HZ PHE 24 HZ PHE 24 69.641 2.186 -6.408 177 H GLN 25 HN GLN 25 64.793 3.369 -0.845 178 HA GLN 25 HA GLN 25 64.906 4.326 1.930 179 HB2 GLN 25 HB2 GLN 25 62.326 4.684 1.750 180 HB3 GLN 25 HB1 GLN 25 63.409 5.959 1.192 181 HG2 GLN 25 HG2 GLN 25 63.192 5.160 -1.119 182 HG3 GLN 25 HG1 GLN 25 62.151 3.845 -0.575 183 HE21 GLN 25 HE21 GLN 25 61.524 6.202 -2.400 184 HE22 GLN 25 HE22 GLN 25 60.184 6.953 -1.677 185 H CYS 26 HN CYS 26 64.710 2.670 3.237 186 HA CYS 26 HA CYS 26 62.945 0.405 2.520 187 HB2 CYS 26 HB2 CYS 26 65.474 -0.005 2.078 188 HB3 CYS 26 HB1 CYS 26 65.617 -0.068 3.835 189 HG CYS 26 HG CYS 26 64.937 -2.439 2.482 190 H ARG 27 HN ARG 27 61.816 -0.441 4.206 191 HA ARG 27 HA ARG 27 62.310 0.693 6.915 192 HB2 ARG 27 HB2 ARG 27 60.242 1.520 5.651 193 HB3 ARG 27 HB1 ARG 27 59.619 -0.124 5.821 194 HG2 ARG 27 HG2 ARG 27 59.791 0.022 8.254 195 HG3 ARG 27 HG1 ARG 27 60.525 1.621 8.136 196 HD2 ARG 27 HD2 ARG 27 58.185 1.930 8.635 197 HD3 ARG 27 HD1 ARG 27 58.447 2.409 6.962 198 HE ARG 27 HE ARG 27 57.221 0.530 6.259 199 HH11 ARG 27 HH11 ARG 27 55.005 0.602 7.723 200 HH12 ARG 27 HH12 ARG 27 55.046 -0.660 8.906 201 HH21 ARG 27 HH21 ARG 27 58.462 -1.159 8.649 202 HH22 ARG 27 HH22 ARG 27 56.999 -1.654 9.431 203 H LEU 28 HN LEU 28 62.663 -0.798 8.462 204 HA LEU 28 HA LEU 28 61.448 -3.451 8.157 205 HB2 LEU 28 HB2 LEU 28 63.562 -4.612 8.601 206 HB3 LEU 28 HB1 LEU 28 63.639 -3.681 7.112 207 HG LEU 28 HG LEU 28 64.563 -1.816 8.932 208 HD11 LEU 28 HD11 LEU 28 64.565 -3.495 10.763 209 HD12 LEU 28 HD12 LEU 28 66.195 -2.947 10.388 210 HD13 LEU 28 HD13 LEU 28 65.636 -4.518 9.811 211 HD21 LEU 28 HD21 LEU 28 66.838 -2.414 8.095 212 HD22 LEU 28 HD22 LEU 28 65.644 -2.356 6.799 213 HD23 LEU 28 HD23 LEU 28 66.178 -3.912 7.437 214 H SER 29 HN SER 29 60.738 -4.286 10.026 215 HA SER 29 HA SER 29 60.818 -2.707 12.389 216 HB2 SER 29 HB2 SER 29 58.935 -4.222 11.993 217 HB3 SER 29 HB1 SER 29 60.019 -5.610 12.057 218 HG SER 29 HG SER 29 60.541 -4.926 14.212 219 H ARG 30 HN ARG 30 61.731 -3.380 14.426 220 HA ARG 30 HA ARG 30 64.455 -3.692 14.342 221 HB2 ARG 30 HB2 ARG 30 64.323 -4.116 16.728 222 HB3 ARG 30 HB1 ARG 30 63.134 -2.897 16.273 223 HG2 ARG 30 HG2 ARG 30 61.403 -4.699 16.148 224 HG3 ARG 30 HG1 ARG 30 62.600 -5.840 16.759 225 HD2 ARG 30 HD2 ARG 30 62.889 -4.419 18.775 226 HD3 ARG 30 HD1 ARG 30 61.618 -3.354 18.181 227 HE ARG 30 HE ARG 30 61.267 -6.005 19.335 228 HH11 ARG 30 HH11 ARG 30 59.267 -6.969 18.261 229 HH12 ARG 30 HH12 ARG 30 57.917 -5.889 18.162 230 HH21 ARG 30 HH21 ARG 30 59.794 -3.055 18.857 231 HH22 ARG 30 HH22 ARG 30 58.214 -3.674 18.508 232 H ALA 31 HN ALA 31 65.785 -5.406 15.244 233 HA ALA 31 HA ALA 31 65.500 -7.814 13.803 234 HB1 ALA 31 HB1 ALA 31 67.529 -8.500 14.958 235 HB2 ALA 31 HB2 ALA 31 67.317 -7.205 16.140 236 HB3 ALA 31 HB3 ALA 31 67.662 -6.814 14.457 237 H SER 32 HN SER 32 65.866 -9.992 15.024 238 HA SER 32 HA SER 32 64.176 -10.192 17.445 239 HB2 SER 32 HB2 SER 32 62.783 -11.866 16.564 240 HB3 SER 32 HB1 SER 32 62.895 -10.721 15.233 241 HG SER 32 HG SER 32 64.796 -12.103 14.612 242 H GLY 33 HN GLY 33 66.031 -12.115 15.095 243 HA2 GLY 33 HA2 GLY 33 67.303 -13.596 17.323 244 HA3 GLY 33 HA1 GLY 33 67.185 -14.161 15.654 245 H GLN 34 HN GLN 34 68.210 -12.584 14.014 246 HA GLN 34 HA GLN 34 70.754 -11.516 15.097 247 HB2 GLN 34 HB2 GLN 34 71.885 -12.253 13.070 248 HB3 GLN 34 HB1 GLN 34 71.102 -13.635 13.837 249 HG2 GLN 34 HG2 GLN 34 69.162 -13.336 12.288 250 HG3 GLN 34 HG1 GLN 34 70.058 -12.057 11.468 251 HE21 GLN 34 HE21 GLN 34 70.346 -13.223 9.454 252 HE22 GLN 34 HE22 GLN 34 71.307 -14.618 9.353 253 H GLU 35 HN GLU 35 71.473 -9.583 14.280 254 HA GLU 35 HA GLU 35 69.501 -7.840 13.168 255 HB2 GLU 35 HB2 GLU 35 71.414 -6.211 13.038 256 HB3 GLU 35 HB1 GLU 35 71.144 -6.886 14.643 257 HG2 GLU 35 HG2 GLU 35 73.109 -8.188 12.755 258 HG3 GLU 35 HG1 GLU 35 73.585 -6.787 13.710 259 H ALA 36 HN ALA 36 69.406 -6.907 11.126 260 HA ALA 36 HA ALA 36 70.320 -8.550 8.955 261 HB1 ALA 36 HB1 ALA 36 69.137 -7.056 7.541 262 HB2 ALA 36 HB2 ALA 36 69.191 -5.759 8.731 263 HB3 ALA 36 HB3 ALA 36 68.169 -7.171 9.009 264 H ARG 37 HN ARG 37 71.717 -7.798 7.203 265 HA ARG 37 HA ARG 37 73.730 -5.805 8.109 266 HB2 ARG 37 HB2 ARG 37 74.166 -8.420 6.659 267 HB3 ARG 37 HB1 ARG 37 75.419 -7.203 6.934 268 HG2 ARG 37 HG2 ARG 37 75.032 -7.357 9.365 269 HG3 ARG 37 HG1 ARG 37 73.794 -8.580 9.092 270 HD2 ARG 37 HD2 ARG 37 75.502 -10.037 8.032 271 HD3 ARG 37 HD1 ARG 37 76.733 -8.826 8.389 272 HE ARG 37 HE ARG 37 75.257 -9.601 10.729 273 HH11 ARG 37 HH11 ARG 37 77.262 -9.671 12.141 274 HH12 ARG 37 HH12 ARG 37 78.347 -10.970 11.771 275 HH21 ARG 37 HH21 ARG 37 76.889 -11.649 8.698 276 HH22 ARG 37 HH22 ARG 37 78.132 -12.094 9.817 277 H TRP 38 HN TRP 38 74.281 -4.269 6.773 278 HA TRP 38 HA TRP 38 73.063 -4.177 4.083 279 HB2 TRP 38 HB2 TRP 38 72.885 -2.338 5.967 280 HB3 TRP 38 HB1 TRP 38 74.505 -1.899 5.437 281 HD1 TRP 38 HD1 TRP 38 74.593 -0.230 3.539 282 HE1 TRP 38 HE1 TRP 38 72.962 0.608 1.729 283 HE3 TRP 38 HE3 TRP 38 70.653 -3.350 4.402 284 HZ2 TRP 38 HZ2 TRP 38 70.331 0.021 0.762 285 HZ3 TRP 38 HZ3 TRP 38 68.598 -3.192 3.025 286 HH2 TRP 38 HH2 TRP 38 68.434 -1.513 1.208 287 H ALA 39 HN ALA 39 74.405 -3.762 2.207 288 HA ALA 39 HA ALA 39 77.224 -3.361 2.434 289 HB1 ALA 39 HB1 ALA 39 77.996 -5.568 1.693 290 HB2 ALA 39 HB2 ALA 39 76.344 -6.178 1.782 291 HB3 ALA 39 HB3 ALA 39 77.176 -5.677 3.252 292 H LEU 40 HN LEU 40 78.246 -3.045 0.493 293 HA LEU 40 HA LEU 40 76.629 -3.311 -1.979 294 HB2 LEU 40 HB2 LEU 40 76.663 -0.959 -1.475 295 HB3 LEU 40 HB1 LEU 40 78.376 -1.009 -1.066 296 HG LEU 40 HG LEU 40 78.984 -1.416 -3.382 297 HD11 LEU 40 HD11 LEU 40 77.077 -1.393 -5.114 298 HD12 LEU 40 HD12 LEU 40 76.000 -1.734 -3.758 299 HD13 LEU 40 HD13 LEU 40 77.277 -2.870 -4.181 300 HD21 LEU 40 HD21 LEU 40 78.637 0.918 -2.872 301 HD22 LEU 40 HD22 LEU 40 76.890 0.753 -3.062 302 HD23 LEU 40 HD23 LEU 40 77.950 0.614 -4.465 303 H GLY 41 HN GLY 41 77.604 -4.715 -3.311 304 HA2 GLY 41 HA2 GLY 41 79.301 -5.713 -4.543 305 HA3 GLY 41 HA1 GLY 41 80.433 -4.559 -3.838 306 H GLY 42 HN GLY 42 78.570 -5.979 -1.452 307 HA2 GLY 42 HA2 GLY 42 78.827 -7.990 -0.219 308 HA3 GLY 42 HA1 GLY 42 80.377 -8.262 -1.004 309 H VAL 43 HN VAL 43 80.395 -5.052 -0.195 310 HA VAL 43 HA VAL 43 81.718 -5.596 2.406 311 HB VAL 43 HB VAL 43 82.996 -3.468 1.869 312 HG11 VAL 43 HG11 VAL 43 83.296 -5.795 -0.051 313 HG12 VAL 43 HG12 VAL 43 83.927 -5.762 1.596 314 HG13 VAL 43 HG13 VAL 43 84.555 -4.640 0.388 315 HG21 VAL 43 HG21 VAL 43 82.976 -2.672 -0.390 316 HG22 VAL 43 HG22 VAL 43 81.289 -2.789 0.102 317 HG23 VAL 43 HG23 VAL 43 81.996 -4.035 -0.931 318 HA PRO 44 HA PRO 44 78.729 -2.914 4.408 319 HB2 PRO 44 HB2 PRO 44 80.685 -1.658 6.161 320 HB3 PRO 44 HB1 PRO 44 79.480 -2.889 6.561 321 HG2 PRO 44 HG2 PRO 44 82.309 -3.210 6.280 322 HG3 PRO 44 HG1 PRO 44 81.106 -4.442 6.679 323 HD2 PRO 44 HD2 PRO 44 82.569 -4.166 4.219 324 HD3 PRO 44 HD1 PRO 44 81.317 -5.361 4.614 325 H LEU 45 HN LEU 45 77.977 -0.792 4.268 326 HA LEU 45 HA LEU 45 79.526 1.040 2.574 327 HB2 LEU 45 HB2 LEU 45 76.650 1.026 3.521 328 HB3 LEU 45 HB1 LEU 45 77.367 2.412 2.707 329 HG LEU 45 HG LEU 45 77.984 0.940 0.796 330 HD11 LEU 45 HD11 LEU 45 76.687 -1.101 2.583 331 HD12 LEU 45 HD12 LEU 45 78.098 -1.260 1.534 332 HD13 LEU 45 HD13 LEU 45 76.482 -1.247 0.840 333 HD21 LEU 45 HD21 LEU 45 75.835 2.277 0.933 334 HD22 LEU 45 HD22 LEU 45 75.028 0.797 1.465 335 HD23 LEU 45 HD23 LEU 45 75.759 0.879 -0.138 336 H GLN 46 HN GLN 46 80.154 3.104 3.204 337 HA GLN 46 HA GLN 46 79.865 3.765 6.083 338 HB2 GLN 46 HB2 GLN 46 82.158 4.992 5.630 339 HB3 GLN 46 HB1 GLN 46 82.136 3.270 5.999 340 HG2 GLN 46 HG2 GLN 46 83.592 3.634 4.094 341 HG3 GLN 46 HG1 GLN 46 82.153 2.794 3.530 342 HE21 GLN 46 HE21 GLN 46 82.442 3.689 1.349 343 HE22 GLN 46 HE22 GLN 46 82.097 5.320 1.026 344 H ALA 47 HN ALA 47 79.766 5.993 6.598 345 HA ALA 47 HA ALA 47 78.134 7.515 4.889 346 HB1 ALA 47 HB1 ALA 47 78.137 7.842 7.304 347 HB2 ALA 47 HB2 ALA 47 78.519 9.358 6.488 348 HB3 ALA 47 HB3 ALA 47 79.803 8.416 7.243 349 H ASN 48 HN ASN 48 79.425 7.361 2.907 350 HA ASN 48 HA ASN 48 81.876 8.846 2.670 351 HB2 ASN 48 HB2 ASN 48 80.987 6.887 1.199 352 HB3 ASN 48 HB1 ASN 48 80.065 8.134 0.362 353 HD21 ASN 48 HD21 ASN 48 82.322 6.545 -0.727 354 HD22 ASN 48 HD22 ASN 48 83.519 7.666 -1.164 355 H GLU 49 HN GLU 49 82.027 10.728 1.111 356 HA GLU 49 HA GLU 49 80.382 12.839 1.992 357 HB2 GLU 49 HB2 GLU 49 82.213 12.620 -0.399 358 HB3 GLU 49 HB1 GLU 49 81.415 14.115 0.090 359 HG2 GLU 49 HG2 GLU 49 82.508 14.061 2.253 360 HG3 GLU 49 HG1 GLU 49 83.203 12.478 1.906 361 H MET 50 HN MET 50 80.272 10.854 -0.958 362 HA MET 50 HA MET 50 77.994 12.345 -1.998 363 HB2 MET 50 HB2 MET 50 78.063 10.527 -3.788 364 HB3 MET 50 HB1 MET 50 79.479 11.574 -3.680 365 HG2 MET 50 HG2 MET 50 80.701 9.888 -2.435 366 HG3 MET 50 HG1 MET 50 79.265 8.866 -2.332 367 HE1 MET 50 HE1 MET 50 81.719 7.610 -3.143 368 HE2 MET 50 HE2 MET 50 81.496 6.828 -4.706 369 HE3 MET 50 HE3 MET 50 80.244 6.692 -3.473 370 H ASN 51 HN ASN 51 78.502 9.697 0.093 371 HA ASN 51 HA ASN 51 75.650 8.898 -0.155 372 HB2 ASN 51 HB2 ASN 51 77.394 7.210 -0.983 373 HB3 ASN 51 HB1 ASN 51 77.869 7.043 0.705 374 HD21 ASN 51 HD21 ASN 51 76.465 5.084 -1.145 375 HD22 ASN 51 HD22 ASN 51 75.054 4.647 -0.309 376 H ASP 52 HN ASP 52 74.525 9.308 1.638 377 HA ASP 52 HA ASP 52 75.937 9.281 4.248 378 HB2 ASP 52 HB2 ASP 52 73.829 11.210 3.254 379 HB3 ASP 52 HB1 ASP 52 74.287 11.050 4.950 380 H ILE 53 HN ILE 53 75.118 7.935 5.666 381 HA ILE 53 HA ILE 53 72.479 6.706 5.120 382 HB ILE 53 HB ILE 53 74.769 5.701 6.828 383 HG12 ILE 53 HG12 ILE 53 73.832 4.754 4.110 384 HG13 ILE 53 HG11 ILE 53 75.226 5.806 4.342 385 HG21 ILE 53 HG21 ILE 53 72.171 4.465 5.884 386 HG22 ILE 53 HG22 ILE 53 72.602 4.859 7.550 387 HG23 ILE 53 HG23 ILE 53 73.457 3.576 6.696 388 HD11 ILE 53 HD11 ILE 53 74.854 2.985 5.373 389 HD12 ILE 53 HD12 ILE 53 76.164 4.044 5.897 390 HD13 ILE 53 HD13 ILE 53 76.050 3.552 4.211 391 H THR 54 HN THR 54 70.855 7.065 6.494 392 HA THR 54 HA THR 54 71.421 7.893 9.266 393 HB THR 54 HB THR 54 71.227 10.002 8.156 394 HG1 THR 54 HG1 THR 54 69.138 9.062 9.679 395 HG21 THR 54 HG21 THR 54 69.082 10.443 6.799 396 HG22 THR 54 HG22 THR 54 68.900 8.688 6.748 397 HG23 THR 54 HG23 THR 54 70.325 9.448 6.040 398 H VAL 55 HN VAL 55 69.778 7.442 10.720 399 HA VAL 55 HA VAL 55 67.623 5.675 9.704 400 HB VAL 55 HB VAL 55 67.632 4.832 12.114 401 HG11 VAL 55 HG11 VAL 55 68.597 3.519 10.304 402 HG12 VAL 55 HG12 VAL 55 69.667 3.430 11.701 403 HG13 VAL 55 HG13 VAL 55 70.075 4.482 10.347 404 HG21 VAL 55 HG21 VAL 55 70.371 6.123 12.150 405 HG22 VAL 55 HG22 VAL 55 69.565 5.276 13.468 406 HG23 VAL 55 HG23 VAL 55 68.972 6.848 12.938 407 H GLU 56 HN GLU 56 65.569 6.246 10.022 408 HA GLU 56 HA GLU 56 65.005 8.617 11.717 409 HB2 GLU 56 HB2 GLU 56 63.603 7.557 9.255 410 HB3 GLU 56 HB1 GLU 56 63.008 8.889 10.248 411 HG2 GLU 56 HG2 GLU 56 65.041 10.169 9.818 412 HG3 GLU 56 HG1 GLU 56 65.726 8.823 8.913 413 H GLN 57 HN GLN 57 62.389 8.511 12.052 414 HA GLN 57 HA GLN 57 61.698 7.212 14.214 415 HB2 GLN 57 HB2 GLN 57 60.115 8.535 12.836 416 HB3 GLN 57 HB1 GLN 57 59.910 7.142 11.777 417 HG2 GLN 57 HG2 GLN 57 58.082 7.218 13.397 418 HG3 GLN 57 HG1 GLN 57 59.091 5.815 13.724 419 HE21 GLN 57 HE21 GLN 57 58.205 5.962 15.994 420 HE22 GLN 57 HE22 GLN 57 58.898 7.075 17.072 421 H GLY 58 HN GLY 58 61.087 5.223 14.995 422 HA2 GLY 58 HA2 GLY 58 61.093 2.931 15.164 423 HA3 GLY 58 HA1 GLY 58 60.548 2.921 13.489 424 H THR 59 HN THR 59 62.002 2.502 11.852 425 HA THR 59 HA THR 59 64.848 2.495 12.308 426 HB THR 59 HB THR 59 63.516 -0.170 11.840 427 HG1 THR 59 HG1 THR 59 64.609 -0.270 14.128 428 HG21 THR 59 HG21 THR 59 65.752 -0.160 10.993 429 HG22 THR 59 HG22 THR 59 65.828 -0.954 12.565 430 HG23 THR 59 HG23 THR 59 66.351 0.722 12.397 431 H LEU 60 HN LEU 60 63.891 3.982 10.484 432 HA LEU 60 HA LEU 60 63.736 2.502 7.924 433 HB2 LEU 60 HB2 LEU 60 61.922 4.126 8.604 434 HB3 LEU 60 HB1 LEU 60 63.113 5.413 8.466 435 HG LEU 60 HG LEU 60 62.837 3.569 6.104 436 HD11 LEU 60 HD11 LEU 60 60.921 4.895 5.248 437 HD12 LEU 60 HD12 LEU 60 60.815 5.717 6.804 438 HD13 LEU 60 HD13 LEU 60 60.494 3.986 6.699 439 HD21 LEU 60 HD21 LEU 60 63.202 6.567 6.453 440 HD22 LEU 60 HD22 LEU 60 63.129 5.746 4.897 441 HD23 LEU 60 HD23 LEU 60 64.451 5.406 6.007 442 H HIS 61 HN HIS 61 65.515 2.397 6.733 443 HA HIS 61 HA HIS 61 67.750 4.235 7.212 444 HB2 HIS 61 HB2 HIS 61 67.467 1.716 5.552 445 HB3 HIS 61 HB1 HIS 61 68.924 2.708 5.572 446 HD1 HIS 61 HD1 HIS 61 66.774 0.596 7.866 447 HD2 HIS 61 HD2 HIS 61 70.540 2.387 7.846 448 HE1 HIS 61 HE1 HIS 61 67.977 -0.241 9.932 449 H LEU 62 HN LEU 62 68.653 5.553 5.567 450 HA LEU 62 HA LEU 62 67.299 5.714 2.980 451 HB2 LEU 62 HB2 LEU 62 65.976 7.150 4.589 452 HB3 LEU 62 HB1 LEU 62 67.403 8.158 4.771 453 HG LEU 62 HG LEU 62 66.309 7.553 2.013 454 HD11 LEU 62 HD11 LEU 62 64.423 8.419 3.406 455 HD12 LEU 62 HD12 LEU 62 64.884 9.528 2.117 456 HD13 LEU 62 HD13 LEU 62 65.390 9.846 3.775 457 HD21 LEU 62 HD21 LEU 62 68.093 9.656 3.251 458 HD22 LEU 62 HD22 LEU 62 67.214 10.023 1.769 459 HD23 LEU 62 HD23 LEU 62 68.354 8.687 1.806 460 H LEU 63 HN LEU 63 68.919 5.718 1.596 461 HA LEU 63 HA LEU 63 71.483 6.999 2.290 462 HB2 LEU 63 HB2 LEU 63 70.612 4.867 0.374 463 HB3 LEU 63 HB1 LEU 63 72.033 5.818 -0.046 464 HG LEU 63 HG LEU 63 73.163 5.159 1.965 465 HD11 LEU 63 HD11 LEU 63 71.955 3.487 3.524 466 HD12 LEU 63 HD12 LEU 63 70.466 4.036 2.757 467 HD13 LEU 63 HD13 LEU 63 71.476 5.176 3.644 468 HD21 LEU 63 HD21 LEU 63 71.731 2.779 0.744 469 HD22 LEU 63 HD22 LEU 63 73.209 2.687 1.703 470 HD23 LEU 63 HD23 LEU 63 73.220 3.513 0.145 471 H THR 64 HN THR 64 71.705 9.066 1.692 472 HA THR 64 HA THR 64 70.164 10.076 -0.610 473 HB THR 64 HB THR 64 71.917 11.564 1.367 474 HG1 THR 64 HG1 THR 64 69.094 11.475 1.170 475 HG21 THR 64 HG21 THR 64 70.167 12.394 -0.945 476 HG22 THR 64 HG22 THR 64 71.816 12.895 -0.571 477 HG23 THR 64 HG23 THR 64 70.470 13.495 0.398 478 H LEU 65 HN LEU 65 71.118 9.703 -2.496 479 HA LEU 65 HA LEU 65 74.061 9.863 -2.717 480 HB2 LEU 65 HB2 LEU 65 72.048 8.858 -4.742 481 HB3 LEU 65 HB1 LEU 65 73.801 8.690 -4.817 482 HG LEU 65 HG LEU 65 72.041 7.501 -2.647 483 HD11 LEU 65 HD11 LEU 65 71.791 6.521 -4.974 484 HD12 LEU 65 HD12 LEU 65 72.359 5.382 -3.751 485 HD13 LEU 65 HD13 LEU 65 73.498 6.089 -4.899 486 HD21 LEU 65 HD21 LEU 65 75.007 7.447 -3.225 487 HD22 LEU 65 HD22 LEU 65 74.241 6.148 -2.308 488 HD23 LEU 65 HD23 LEU 65 74.196 7.801 -1.700 489 H HIS 66 HN HIS 66 75.043 11.451 -3.757 490 HA HIS 66 HA HIS 66 73.665 13.095 -5.732 491 HB2 HIS 66 HB2 HIS 66 74.204 15.201 -4.541 492 HB3 HIS 66 HB1 HIS 66 73.061 14.209 -3.631 493 HD1 HIS 66 HD1 HIS 66 74.125 12.736 -1.648 494 HD2 HIS 66 HD2 HIS 66 76.601 15.713 -3.200 495 HE1 HIS 66 HE1 HIS 66 76.006 13.050 0.022 496 H LYS 67 HN LYS 67 75.165 14.433 -6.943 497 HA LYS 67 HA LYS 67 77.135 14.664 -8.119 498 HB2 LYS 67 HB2 LYS 67 78.288 14.510 -5.315 499 HB3 LYS 67 HB1 LYS 67 79.136 15.121 -6.733 500 HG2 LYS 67 HG2 LYS 67 76.493 16.307 -5.889 501 HG3 LYS 67 HG1 LYS 67 77.997 16.839 -5.143 502 HD2 LYS 67 HD2 LYS 67 78.896 17.407 -7.383 503 HD3 LYS 67 HD1 LYS 67 77.370 16.919 -8.115 504 HE2 LYS 67 HE2 LYS 67 76.172 18.627 -6.830 505 HE3 LYS 67 HE1 LYS 67 77.670 19.103 -6.033 506 HZ1 LYS 67 HZ1 LYS 67 77.693 19.076 -8.943 507 HZ2 LYS 67 HZ2 LYS 67 78.416 20.165 -7.857 508 HZ3 LYS 67 HZ3 LYS 67 76.758 20.288 -8.211 509 H VAL 68 HN VAL 68 76.316 12.209 -8.486 510 HA VAL 68 HA VAL 68 78.601 10.405 -7.897 511 HB VAL 68 HB VAL 68 76.956 8.583 -8.470 512 HG11 VAL 68 HG11 VAL 68 77.423 9.051 -6.154 513 HG12 VAL 68 HG12 VAL 68 75.676 8.857 -6.309 514 HG13 VAL 68 HG13 VAL 68 76.377 10.471 -6.175 515 HG21 VAL 68 HG21 VAL 68 74.544 9.217 -8.357 516 HG22 VAL 68 HG22 VAL 68 75.345 9.909 -9.765 517 HG23 VAL 68 HG23 VAL 68 75.015 10.916 -8.357 518 H THR 69 HN THR 69 79.841 9.718 -9.523 519 HA THR 69 HA THR 69 79.241 10.593 -12.243 520 HB THR 69 HB THR 69 81.497 9.797 -12.767 521 HG1 THR 69 HG1 THR 69 82.598 9.147 -10.607 522 HG21 THR 69 HG21 THR 69 81.406 12.014 -11.870 523 HG22 THR 69 HG22 THR 69 82.759 11.201 -11.084 524 HG23 THR 69 HG23 THR 69 81.235 11.406 -10.222 525 H LEU 70 HN LEU 70 80.621 8.462 -13.570 526 HA LEU 70 HA LEU 70 78.481 6.745 -14.126 527 HB2 LEU 70 HB2 LEU 70 80.259 7.127 -15.746 528 HB3 LEU 70 HB1 LEU 70 81.441 6.392 -14.669 529 HG LEU 70 HG LEU 70 80.344 4.220 -14.862 530 HD11 LEU 70 HD11 LEU 70 78.028 4.690 -15.034 531 HD12 LEU 70 HD12 LEU 70 78.444 4.086 -16.637 532 HD13 LEU 70 HD13 LEU 70 78.268 5.820 -16.365 533 HD21 LEU 70 HD21 LEU 70 81.969 4.855 -16.613 534 HD22 LEU 70 HD22 LEU 70 80.664 5.565 -17.565 535 HD23 LEU 70 HD23 LEU 70 80.699 3.826 -17.277 536 H GLU 71 HN GLU 71 80.691 6.743 -11.543 537 HA GLU 71 HA GLU 71 80.818 3.950 -10.984 538 HB2 GLU 71 HB2 GLU 71 81.128 6.384 -9.203 539 HB3 GLU 71 HB1 GLU 71 81.460 4.731 -8.684 540 HG2 GLU 71 HG2 GLU 71 83.180 4.485 -10.380 541 HG3 GLU 71 HG1 GLU 71 82.785 6.064 -11.061 542 H ASP 72 HN ASP 72 78.244 6.053 -11.004 543 HA ASP 72 HA ASP 72 76.797 5.540 -8.698 544 HB2 ASP 72 HB2 ASP 72 74.765 5.937 -10.131 545 HB3 ASP 72 HB1 ASP 72 75.999 7.190 -10.220 546 H ALA 73 HN ALA 73 77.321 3.433 -11.468 547 HA ALA 73 HA ALA 73 75.211 1.612 -10.946 548 HB1 ALA 73 HB1 ALA 73 77.919 1.175 -12.239 549 HB2 ALA 73 HB2 ALA 73 76.401 1.528 -13.063 550 HB3 ALA 73 HB3 ALA 73 76.613 -0.011 -12.234 551 H GLY 74 HN GLY 74 75.013 -0.032 -9.498 552 HA2 GLY 74 HA2 GLY 74 77.189 -1.315 -8.191 553 HA3 GLY 74 HA1 GLY 74 76.491 -0.088 -7.139 554 H THR 75 HN THR 75 76.416 -2.721 -6.355 555 HA THR 75 HA THR 75 73.550 -3.448 -6.662 556 HB THR 75 HB THR 75 74.569 -5.820 -6.019 557 HG1 THR 75 HG1 THR 75 76.704 -4.417 -7.236 558 HG21 THR 75 HG21 THR 75 74.759 -6.337 -8.422 559 HG22 THR 75 HG22 THR 75 74.811 -4.614 -8.791 560 HG23 THR 75 HG23 THR 75 73.351 -5.325 -8.103 561 H VAL 76 HN VAL 76 72.575 -2.808 -4.824 562 HA VAL 76 HA VAL 76 73.997 -3.191 -2.248 563 HB VAL 76 HB VAL 76 71.383 -1.736 -2.653 564 HG11 VAL 76 HG11 VAL 76 71.858 -2.315 -0.356 565 HG12 VAL 76 HG12 VAL 76 72.167 -0.591 -0.561 566 HG13 VAL 76 HG13 VAL 76 73.514 -1.726 -0.504 567 HG21 VAL 76 HG21 VAL 76 74.144 -0.497 -2.595 568 HG22 VAL 76 HG22 VAL 76 72.610 0.335 -2.847 569 HG23 VAL 76 HG23 VAL 76 73.234 -0.757 -4.082 570 H SER 77 HN SER 77 73.536 -4.952 -1.115 571 HA SER 77 HA SER 77 70.800 -6.065 -1.180 572 HB2 SER 77 HB2 SER 77 72.221 -7.403 -2.715 573 HB3 SER 77 HB1 SER 77 73.340 -7.706 -1.392 574 HG SER 77 HG SER 77 71.486 -9.257 -1.906 575 H PHE 78 HN PHE 78 70.216 -7.224 0.681 576 HA PHE 78 HA PHE 78 72.077 -7.101 2.965 577 HB2 PHE 78 HB2 PHE 78 70.572 -6.011 4.387 578 HB3 PHE 78 HB1 PHE 78 70.366 -5.135 2.878 579 HD1 PHE 78 HD1 PHE 78 68.628 -6.746 1.244 580 HD2 PHE 78 HD2 PHE 78 68.528 -6.188 5.499 581 HE1 PHE 78 HE1 PHE 78 66.222 -7.313 1.263 582 HE2 PHE 78 HE2 PHE 78 66.118 -6.760 5.516 583 HZ PHE 78 HZ PHE 78 64.964 -7.319 3.396 584 H HIS 79 HN HIS 79 71.773 -8.694 4.521 585 HA HIS 79 HA HIS 79 69.853 -10.849 3.812 586 HB2 HIS 79 HB2 HIS 79 72.727 -11.073 4.722 587 HB3 HIS 79 HB1 HIS 79 71.602 -12.432 4.662 588 HD1 HIS 79 HD1 HIS 79 70.773 -13.202 2.314 589 HD2 HIS 79 HD2 HIS 79 73.643 -10.182 2.189 590 HE1 HIS 79 HE1 HIS 79 71.532 -13.038 -0.096 591 H VAL 80 HN VAL 80 68.474 -11.305 5.353 592 HA VAL 80 HA VAL 80 69.267 -10.928 8.179 593 HB VAL 80 HB VAL 80 67.813 -9.083 7.689 594 HG11 VAL 80 HG11 VAL 80 65.848 -11.093 6.565 595 HG12 VAL 80 HG12 VAL 80 66.866 -10.032 5.590 596 HG13 VAL 80 HG13 VAL 80 65.632 -9.345 6.646 597 HG21 VAL 80 HG21 VAL 80 66.058 -9.470 9.259 598 HG22 VAL 80 HG22 VAL 80 67.402 -10.488 9.776 599 HG23 VAL 80 HG23 VAL 80 66.037 -11.201 8.917 600 H GLY 81 HN GLY 81 68.956 -12.646 9.393 601 HA2 GLY 81 HA2 GLY 81 68.683 -15.181 8.703 602 HA3 GLY 81 HA1 GLY 81 67.983 -14.608 10.206 603 H THR 82 HN THR 82 65.919 -12.993 8.811 604 HA THR 82 HA THR 82 63.996 -15.126 8.491 605 HB THR 82 HB THR 82 62.359 -13.314 8.200 606 HG1 THR 82 HG1 THR 82 64.627 -11.957 7.603 607 HG21 THR 82 HG21 THR 82 62.772 -12.166 10.392 608 HG22 THR 82 HG22 THR 82 64.365 -12.921 10.430 609 HG23 THR 82 HG23 THR 82 62.914 -13.923 10.471 610 H CYS 83 HN CYS 83 64.422 -12.291 6.385 611 HA CYS 83 HA CYS 83 64.083 -14.068 4.024 612 HB2 CYS 83 HB2 CYS 83 62.288 -12.390 4.399 613 HB3 CYS 83 HB1 CYS 83 63.493 -11.111 4.263 614 HG CYS 83 HG CYS 83 62.686 -13.003 1.910 615 H SER 84 HN SER 84 65.160 -13.321 2.020 616 HA SER 84 HA SER 84 67.613 -11.736 2.425 617 HB2 SER 84 HB2 SER 84 68.153 -14.170 2.717 618 HB3 SER 84 HB1 SER 84 67.579 -14.449 1.077 619 HG SER 84 HG SER 84 69.182 -12.473 0.817 620 H SER 85 HN SER 85 68.038 -10.415 0.700 621 HA SER 85 HA SER 85 67.106 -11.071 -1.960 622 HB2 SER 85 HB2 SER 85 65.921 -8.637 -0.632 623 HB3 SER 85 HB1 SER 85 65.583 -9.246 -2.247 624 HG SER 85 HG SER 85 64.156 -10.488 -1.366 625 H GLU 86 HN GLU 86 67.548 -9.298 -3.522 626 HA GLU 86 HA GLU 86 69.692 -7.454 -2.701 627 HB2 GLU 86 HB2 GLU 86 71.082 -8.113 -4.605 628 HB3 GLU 86 HB1 GLU 86 70.816 -9.495 -3.545 629 HG2 GLU 86 HG2 GLU 86 68.975 -10.246 -5.043 630 HG3 GLU 86 HG1 GLU 86 69.333 -8.898 -6.121 631 H ALA 87 HN ALA 87 70.157 -5.852 -4.418 632 HA ALA 87 HA ALA 87 67.880 -5.382 -6.252 633 HB1 ALA 87 HB1 ALA 87 67.805 -3.043 -5.634 634 HB2 ALA 87 HB2 ALA 87 69.145 -3.254 -4.505 635 HB3 ALA 87 HB3 ALA 87 67.584 -4.015 -4.180 636 H GLN 88 HN GLN 88 68.397 -4.265 -8.125 637 HA GLN 88 HA GLN 88 71.303 -4.060 -8.708 638 HB2 GLN 88 HB2 GLN 88 68.940 -4.693 -10.474 639 HB3 GLN 88 HB1 GLN 88 70.564 -4.374 -11.080 640 HG2 GLN 88 HG2 GLN 88 71.459 -6.266 -9.885 641 HG3 GLN 88 HG1 GLN 88 69.931 -6.518 -9.039 642 HE21 GLN 88 HE21 GLN 88 71.727 -7.622 -11.661 643 HE22 GLN 88 HE22 GLN 88 70.463 -8.289 -12.576 644 H LEU 89 HN LEU 89 72.097 -2.128 -9.168 645 HA LEU 89 HA LEU 89 70.231 0.066 -9.897 646 HB2 LEU 89 HB2 LEU 89 71.646 0.169 -7.712 647 HB3 LEU 89 HB1 LEU 89 73.011 0.466 -8.787 648 HG LEU 89 HG LEU 89 70.445 2.090 -8.767 649 HD11 LEU 89 HD11 LEU 89 71.613 3.771 -7.554 650 HD12 LEU 89 HD12 LEU 89 73.163 2.958 -7.771 651 HD13 LEU 89 HD13 LEU 89 71.949 2.261 -6.702 652 HD21 LEU 89 HD21 LEU 89 71.325 2.386 -10.906 653 HD22 LEU 89 HD22 LEU 89 72.994 2.186 -10.373 654 HD23 LEU 89 HD23 LEU 89 72.128 3.686 -10.032 655 H LYS 90 HN LYS 90 70.295 0.393 -12.030 656 HA LYS 90 HA LYS 90 72.892 0.160 -13.440 657 HB2 LYS 90 HB2 LYS 90 70.661 -1.284 -14.000 658 HB3 LYS 90 HB1 LYS 90 70.345 0.129 -15.001 659 HG2 LYS 90 HG2 LYS 90 72.451 -0.158 -16.177 660 HG3 LYS 90 HG1 LYS 90 72.943 -1.442 -15.077 661 HD2 LYS 90 HD2 LYS 90 72.154 -2.521 -17.064 662 HD3 LYS 90 HD1 LYS 90 70.903 -2.741 -15.843 663 HE2 LYS 90 HE2 LYS 90 69.530 -1.041 -16.808 664 HE3 LYS 90 HE1 LYS 90 70.841 -0.472 -17.844 665 HZ1 LYS 90 HZ1 LYS 90 70.521 -3.184 -18.342 666 HZ2 LYS 90 HZ2 LYS 90 70.150 -1.888 -19.374 667 HZ3 LYS 90 HZ3 LYS 90 68.962 -2.516 -18.334 668 H VAL 91 HN VAL 91 72.958 1.577 -15.448 669 HA VAL 91 HA VAL 91 72.028 4.294 -14.700 670 HB VAL 91 HB VAL 91 74.385 3.449 -16.401 671 HG11 VAL 91 HG11 VAL 91 73.733 5.621 -17.094 672 HG12 VAL 91 HG12 VAL 91 75.017 5.896 -15.918 673 HG13 VAL 91 HG13 VAL 91 73.330 6.115 -15.448 674 HG21 VAL 91 HG21 VAL 91 74.771 2.814 -14.109 675 HG22 VAL 91 HG22 VAL 91 74.146 4.352 -13.519 676 HG23 VAL 91 HG23 VAL 91 75.675 4.299 -14.398 677 H THR 92 HN THR 92 70.573 5.228 -15.964 678 HA THR 92 HA THR 92 69.713 3.947 -18.413 679 HB THR 92 HB THR 92 68.830 6.520 -17.091 680 HG1 THR 92 HG1 THR 92 67.159 4.361 -17.161 681 HG21 THR 92 HG21 THR 92 68.156 6.700 -19.344 682 HG22 THR 92 HG22 THR 92 66.746 6.024 -18.529 683 HG23 THR 92 HG23 THR 92 67.806 4.976 -19.471 684 H ALA 93 HN ALA 93 70.284 4.432 -20.428 685 HA ALA 93 HA ALA 93 72.224 6.571 -20.893 686 HB1 ALA 93 HB1 ALA 93 72.490 4.240 -21.831 687 HB2 ALA 93 HB2 ALA 93 72.588 5.533 -23.027 688 HB3 ALA 93 HB3 ALA 93 71.113 4.579 -22.881 689 H GLY 94 HN GLY 94 68.928 6.278 -20.875 690 HA2 GLY 94 HA2 GLY 94 68.154 8.737 -21.607 691 HA3 GLY 94 HA1 GLY 94 68.354 7.967 -23.178 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 49.975 -9.688 11.654 2 H2 MET 1 HT2 MET 1 50.747 -8.181 11.796 3 H3 MET 1 HT3 MET 1 49.452 -8.575 12.823 4 HA MET 1 HA MET 1 51.132 -9.029 14.251 5 HB2 MET 1 HB2 MET 1 50.912 -11.505 12.518 6 HB3 MET 1 HB1 MET 1 51.713 -11.474 14.090 7 HG2 MET 1 HG2 MET 1 49.607 -10.680 15.133 8 HG3 MET 1 HG1 MET 1 48.808 -10.772 13.562 9 HE1 MET 1 HE1 MET 1 47.278 -11.763 15.133 10 HE2 MET 1 HE2 MET 1 47.459 -13.280 16.008 11 HE3 MET 1 HE3 MET 1 46.885 -13.297 14.345 12 H ALA 2 HN ALA 2 52.392 -10.811 11.450 13 HA ALA 2 HA ALA 2 54.550 -10.999 10.659 14 HB1 ALA 2 HB1 ALA 2 53.649 -8.810 9.694 15 HB2 ALA 2 HB2 ALA 2 55.403 -8.996 9.716 16 HB3 ALA 2 HB3 ALA 2 54.607 -7.993 10.929 17 HA PRO 3 HA PRO 3 56.443 -10.337 14.853 18 HB2 PRO 3 HB2 PRO 3 56.986 -13.197 14.976 19 HB3 PRO 3 HB1 PRO 3 55.915 -12.241 16.011 20 HG2 PRO 3 HG2 PRO 3 55.063 -14.133 14.184 21 HG3 PRO 3 HG1 PRO 3 54.061 -12.822 14.826 22 HD2 PRO 3 HD2 PRO 3 55.429 -13.021 12.170 23 HD3 PRO 3 HD1 PRO 3 53.883 -12.252 12.591 24 H GLU 4 HN GLU 4 58.711 -10.593 15.454 25 HA GLU 4 HA GLU 4 60.975 -10.797 15.053 26 HB2 GLU 4 HB2 GLU 4 60.144 -13.054 14.023 27 HB3 GLU 4 HB1 GLU 4 60.406 -12.257 12.476 28 HG2 GLU 4 HG2 GLU 4 62.743 -11.894 12.987 29 HG3 GLU 4 HG1 GLU 4 62.524 -12.494 14.629 30 H VAL 5 HN VAL 5 62.613 -10.230 13.161 31 HA VAL 5 HA VAL 5 62.214 -7.602 12.389 32 HB VAL 5 HB VAL 5 64.400 -8.855 12.377 33 HG11 VAL 5 HG11 VAL 5 63.312 -10.790 11.028 34 HG12 VAL 5 HG12 VAL 5 64.960 -10.326 10.629 35 HG13 VAL 5 HG13 VAL 5 63.626 -9.785 9.619 36 HG21 VAL 5 HG21 VAL 5 63.648 -7.414 9.816 37 HG22 VAL 5 HG22 VAL 5 65.290 -7.646 10.419 38 HG23 VAL 5 HG23 VAL 5 64.155 -6.638 11.317 39 H THR 6 HN THR 6 61.258 -6.578 10.686 40 HA THR 6 HA THR 6 59.954 -8.321 8.633 41 HB THR 6 HB THR 6 59.030 -5.571 9.434 42 HG1 THR 6 HG1 THR 6 58.940 -6.890 11.251 43 HG21 THR 6 HG21 THR 6 57.178 -7.684 8.487 44 HG22 THR 6 HG22 THR 6 58.316 -7.085 7.281 45 HG23 THR 6 HG23 THR 6 57.212 -5.969 8.084 46 H ILE 7 HN ILE 7 60.651 -8.077 6.608 47 HA ILE 7 HA ILE 7 62.213 -5.652 5.919 48 HB ILE 7 HB ILE 7 62.194 -8.342 4.547 49 HG12 ILE 7 HG12 ILE 7 64.539 -8.454 5.585 50 HG13 ILE 7 HG11 ILE 7 64.040 -7.121 6.620 51 HG21 ILE 7 HG21 ILE 7 63.757 -5.789 4.181 52 HG22 ILE 7 HG22 ILE 7 62.873 -6.724 2.974 53 HG23 ILE 7 HG23 ILE 7 64.387 -7.343 3.631 54 HD11 ILE 7 HD11 ILE 7 63.725 -9.726 7.304 55 HD12 ILE 7 HD12 ILE 7 62.174 -9.450 6.532 56 HD13 ILE 7 HD13 ILE 7 62.673 -8.451 7.895 57 H LEU 8 HN LEU 8 61.041 -4.227 4.911 58 HA LEU 8 HA LEU 8 59.205 -5.057 2.732 59 HB2 LEU 8 HB2 LEU 8 58.860 -3.105 4.977 60 HB3 LEU 8 HB1 LEU 8 58.208 -2.631 3.413 61 HG LEU 8 HG LEU 8 56.972 -4.811 3.324 62 HD11 LEU 8 HD11 LEU 8 58.297 -5.119 6.012 63 HD12 LEU 8 HD12 LEU 8 58.094 -6.305 4.726 64 HD13 LEU 8 HD13 LEU 8 56.719 -5.854 5.726 65 HD21 LEU 8 HD21 LEU 8 56.409 -3.126 5.784 66 HD22 LEU 8 HD22 LEU 8 55.249 -4.138 4.925 67 HD23 LEU 8 HD23 LEU 8 55.922 -2.709 4.140 68 H GLU 9 HN GLU 9 61.011 -4.902 1.316 69 HA GLU 9 HA GLU 9 62.095 -2.178 0.897 70 HB2 GLU 9 HB2 GLU 9 63.941 -3.303 -0.243 71 HB3 GLU 9 HB1 GLU 9 63.745 -3.874 1.410 72 HG2 GLU 9 HG2 GLU 9 63.717 -5.990 0.551 73 HG3 GLU 9 HG1 GLU 9 62.106 -5.623 -0.053 74 HA PRO 10 HA PRO 10 59.539 -2.745 -2.882 75 HB2 PRO 10 HB2 PRO 10 59.400 0.136 -3.193 76 HB3 PRO 10 HB1 PRO 10 58.097 -0.971 -2.735 77 HG2 PRO 10 HG2 PRO 10 59.288 0.925 -1.067 78 HG3 PRO 10 HG1 PRO 10 58.276 -0.431 -0.543 79 HD2 PRO 10 HD2 PRO 10 61.240 -0.142 -0.423 80 HD3 PRO 10 HD1 PRO 10 60.147 -1.109 0.593 81 H LEU 11 HN LEU 11 62.514 -1.430 -2.145 82 HA LEU 11 HA LEU 11 63.418 -0.221 -4.518 83 HB2 LEU 11 HB2 LEU 11 65.003 -1.866 -2.531 84 HB3 LEU 11 HB1 LEU 11 65.655 -0.666 -3.642 85 HG LEU 11 HG LEU 11 63.602 -0.045 -1.495 86 HD11 LEU 11 HD11 LEU 11 65.531 -0.622 -0.269 87 HD12 LEU 11 HD12 LEU 11 65.675 1.125 -0.451 88 HD13 LEU 11 HD13 LEU 11 66.619 0.051 -1.482 89 HD21 LEU 11 HD21 LEU 11 64.647 2.321 -1.972 90 HD22 LEU 11 HD22 LEU 11 63.448 1.674 -3.089 91 HD23 LEU 11 HD23 LEU 11 65.160 1.594 -3.495 92 H GLN 12 HN GLN 12 62.466 -1.649 -6.203 93 HA GLN 12 HA GLN 12 63.530 -4.329 -6.477 94 HB2 GLN 12 HB2 GLN 12 61.857 -2.607 -8.323 95 HB3 GLN 12 HB1 GLN 12 62.341 -4.263 -8.687 96 HG2 GLN 12 HG2 GLN 12 61.196 -5.075 -6.684 97 HG3 GLN 12 HG1 GLN 12 60.764 -3.426 -6.237 98 HE21 GLN 12 HE21 GLN 12 58.525 -4.803 -6.458 99 HE22 GLN 12 HE22 GLN 12 57.766 -4.626 -7.967 100 H ASP 13 HN ASP 13 63.671 -1.526 -8.717 101 HA ASP 13 HA ASP 13 66.510 -1.563 -8.951 102 HB2 ASP 13 HB2 ASP 13 65.963 -3.699 -10.140 103 HB3 ASP 13 HB1 ASP 13 65.009 -2.763 -11.290 104 H VAL 14 HN VAL 14 67.084 0.443 -9.627 105 HA VAL 14 HA VAL 14 65.176 1.941 -11.353 106 HB VAL 14 HB VAL 14 65.805 3.997 -10.140 107 HG11 VAL 14 HG11 VAL 14 64.662 3.408 -7.970 108 HG12 VAL 14 HG12 VAL 14 64.714 1.719 -8.467 109 HG13 VAL 14 HG13 VAL 14 63.787 2.887 -9.410 110 HG21 VAL 14 HG21 VAL 14 67.053 3.856 -8.045 111 HG22 VAL 14 HG22 VAL 14 68.036 3.192 -9.349 112 HG23 VAL 14 HG23 VAL 14 67.213 2.109 -8.227 113 H GLN 15 HN GLN 15 66.156 3.711 -12.565 114 HA GLN 15 HA GLN 15 68.962 3.120 -13.358 115 HB2 GLN 15 HB2 GLN 15 66.603 4.085 -15.000 116 HB3 GLN 15 HB1 GLN 15 68.264 4.079 -15.587 117 HG2 GLN 15 HG2 GLN 15 68.401 1.660 -15.284 118 HG3 GLN 15 HG1 GLN 15 66.778 1.631 -14.593 119 HE21 GLN 15 HE21 GLN 15 66.715 3.989 -16.944 120 HE22 GLN 15 HE22 GLN 15 66.159 3.061 -18.252 121 H LEU 16 HN LEU 16 70.377 4.739 -13.130 122 HA LEU 16 HA LEU 16 69.373 7.515 -12.767 123 HB2 LEU 16 HB2 LEU 16 71.752 6.197 -11.443 124 HB3 LEU 16 HB1 LEU 16 71.196 7.848 -11.181 125 HG LEU 16 HG LEU 16 69.561 5.358 -10.607 126 HD11 LEU 16 HD11 LEU 16 69.977 6.032 -8.217 127 HD12 LEU 16 HD12 LEU 16 71.151 7.207 -8.815 128 HD13 LEU 16 HD13 LEU 16 71.419 5.483 -9.075 129 HD21 LEU 16 HD21 LEU 16 68.283 7.200 -9.223 130 HD22 LEU 16 HD22 LEU 16 67.989 7.073 -10.955 131 HD23 LEU 16 HD23 LEU 16 69.065 8.325 -10.334 132 H SER 17 HN SER 17 70.204 8.997 -14.133 133 HA SER 17 HA SER 17 72.165 8.217 -16.102 134 HB2 SER 17 HB2 SER 17 71.711 10.262 -17.151 135 HB3 SER 17 HB1 SER 17 70.175 9.865 -16.390 136 HG SER 17 HG SER 17 71.717 11.994 -16.028 137 H GLU 18 HN GLU 18 74.115 9.578 -16.515 138 HA GLU 18 HA GLU 18 75.830 9.598 -14.278 139 HB2 GLU 18 HB2 GLU 18 76.633 9.387 -16.599 140 HB3 GLU 18 HB1 GLU 18 76.124 11.044 -16.925 141 HG2 GLU 18 HG2 GLU 18 77.693 11.885 -15.231 142 HG3 GLU 18 HG1 GLU 18 78.172 10.237 -14.835 143 H GLY 19 HN GLY 19 76.174 11.082 -12.716 144 HA2 GLY 19 HA2 GLY 19 76.325 13.152 -11.679 145 HA3 GLY 19 HA1 GLY 19 75.888 13.904 -13.208 146 H GLN 20 HN GLN 20 73.780 11.429 -12.042 147 HA GLN 20 HA GLN 20 71.732 13.480 -11.431 148 HB2 GLN 20 HB2 GLN 20 71.246 11.838 -13.221 149 HB3 GLN 20 HB1 GLN 20 71.404 10.536 -12.051 150 HG2 GLN 20 HG2 GLN 20 69.053 11.062 -12.308 151 HG3 GLN 20 HG1 GLN 20 69.565 11.593 -10.714 152 HE21 GLN 20 HE21 GLN 20 68.163 13.372 -10.419 153 HE22 GLN 20 HE22 GLN 20 68.130 14.721 -11.451 154 H ASP 21 HN ASP 21 70.728 13.578 -9.498 155 HA ASP 21 HA ASP 21 71.901 12.126 -7.276 156 HB2 ASP 21 HB2 ASP 21 70.421 13.533 -5.899 157 HB3 ASP 21 HB1 ASP 21 71.352 14.505 -7.035 158 H ALA 22 HN ALA 22 70.437 11.096 -5.644 159 HA ALA 22 HA ALA 22 67.866 10.147 -6.514 160 HB1 ALA 22 HB1 ALA 22 70.045 8.072 -6.228 161 HB2 ALA 22 HB2 ALA 22 69.466 8.668 -7.784 162 HB3 ALA 22 HB3 ALA 22 68.369 7.812 -6.704 163 H SER 23 HN SER 23 67.000 8.516 -4.908 164 HA SER 23 HA SER 23 68.238 8.651 -2.251 165 HB2 SER 23 HB2 SER 23 65.493 9.761 -2.889 166 HB3 SER 23 HB1 SER 23 66.075 9.431 -1.260 167 HG SER 23 HG SER 23 66.575 11.536 -2.874 168 H PHE 24 HN PHE 24 67.729 6.922 -0.993 169 HA PHE 24 HA PHE 24 65.892 4.894 -2.159 170 HB2 PHE 24 HB2 PHE 24 68.545 4.716 -0.800 171 HB3 PHE 24 HB1 PHE 24 67.382 3.464 -0.389 172 HD1 PHE 24 HD1 PHE 24 68.497 1.635 -1.396 173 HD2 PHE 24 HD2 PHE 24 67.589 5.117 -3.740 174 HE1 PHE 24 HE1 PHE 24 69.044 0.388 -3.460 175 HE2 PHE 24 HE2 PHE 24 68.132 3.865 -5.808 176 HZ PHE 24 HZ PHE 24 68.860 1.498 -5.667 177 H GLN 25 HN GLN 25 64.149 4.366 -1.001 178 HA GLN 25 HA GLN 25 64.073 5.025 1.887 179 HB2 GLN 25 HB2 GLN 25 62.869 6.749 0.515 180 HB3 GLN 25 HB1 GLN 25 61.794 5.475 -0.058 181 HG2 GLN 25 HG2 GLN 25 62.209 5.953 2.898 182 HG3 GLN 25 HG1 GLN 25 61.025 6.878 1.981 183 HE21 GLN 25 HE21 GLN 25 60.391 4.947 4.109 184 HE22 GLN 25 HE22 GLN 25 59.462 3.720 3.388 185 H CYS 26 HN CYS 26 63.486 3.358 3.097 186 HA CYS 26 HA CYS 26 61.619 1.356 2.064 187 HB2 CYS 26 HB2 CYS 26 63.389 -0.403 3.014 188 HB3 CYS 26 HB1 CYS 26 63.474 0.169 1.347 189 HG CYS 26 HG CYS 26 65.223 2.031 2.335 190 H ARG 27 HN ARG 27 60.975 -0.190 3.770 191 HA ARG 27 HA ARG 27 61.130 1.016 6.485 192 HB2 ARG 27 HB2 ARG 27 58.903 1.251 5.402 193 HB3 ARG 27 HB1 ARG 27 58.826 -0.503 5.234 194 HG2 ARG 27 HG2 ARG 27 58.965 -0.757 7.676 195 HG3 ARG 27 HG1 ARG 27 59.070 0.995 7.861 196 HD2 ARG 27 HD2 ARG 27 56.869 1.179 6.660 197 HD3 ARG 27 HD1 ARG 27 56.754 -0.576 6.706 198 HE ARG 27 HE ARG 27 57.173 0.627 9.303 199 HH11 ARG 27 HH11 ARG 27 55.234 -1.359 7.416 200 HH12 ARG 27 HH12 ARG 27 53.756 -1.040 8.260 201 HH21 ARG 27 HH21 ARG 27 55.101 1.513 10.186 202 HH22 ARG 27 HH22 ARG 27 53.679 0.591 9.827 203 H LEU 28 HN LEU 28 62.152 -0.253 7.892 204 HA LEU 28 HA LEU 28 61.913 -3.199 7.629 205 HB2 LEU 28 HB2 LEU 28 64.161 -2.112 6.839 206 HB3 LEU 28 HB1 LEU 28 64.467 -1.886 8.557 207 HG LEU 28 HG LEU 28 63.795 -4.542 7.252 208 HD11 LEU 28 HD11 LEU 28 65.988 -3.797 6.520 209 HD12 LEU 28 HD12 LEU 28 66.202 -5.062 7.731 210 HD13 LEU 28 HD13 LEU 28 66.438 -3.370 8.170 211 HD21 LEU 28 HD21 LEU 28 64.855 -5.276 9.560 212 HD22 LEU 28 HD22 LEU 28 63.160 -4.812 9.477 213 HD23 LEU 28 HD23 LEU 28 64.358 -3.666 10.079 214 H SER 29 HN SER 29 60.611 -3.619 9.355 215 HA SER 29 HA SER 29 60.576 -2.095 11.735 216 HB2 SER 29 HB2 SER 29 59.039 -3.651 12.554 217 HB3 SER 29 HB1 SER 29 58.836 -3.805 10.816 218 HG SER 29 HG SER 29 60.653 -5.475 11.189 219 H ARG 30 HN ARG 30 61.303 -2.626 13.807 220 HA ARG 30 HA ARG 30 63.984 -3.199 14.036 221 HB2 ARG 30 HB2 ARG 30 63.604 -3.290 16.418 222 HB3 ARG 30 HB1 ARG 30 62.585 -2.040 15.708 223 HG2 ARG 30 HG2 ARG 30 60.686 -3.664 15.669 224 HG3 ARG 30 HG1 ARG 30 61.710 -4.835 16.503 225 HD2 ARG 30 HD2 ARG 30 61.129 -2.068 17.576 226 HD3 ARG 30 HD1 ARG 30 60.200 -3.495 18.023 227 HE ARG 30 HE ARG 30 62.885 -4.109 18.475 228 HH11 ARG 30 HH11 ARG 30 63.816 -3.825 20.536 229 HH12 ARG 30 HH12 ARG 30 63.038 -2.796 21.693 230 HH21 ARG 30 HH21 ARG 30 60.466 -1.888 19.547 231 HH22 ARG 30 HH22 ARG 30 61.141 -1.698 21.131 232 H ALA 31 HN ALA 31 65.168 -4.888 14.923 233 HA ALA 31 HA ALA 31 64.161 -7.552 14.246 234 HB1 ALA 31 HB1 ALA 31 66.528 -8.242 14.530 235 HB2 ALA 31 HB2 ALA 31 66.937 -6.580 14.952 236 HB3 ALA 31 HB3 ALA 31 66.339 -6.958 13.338 237 H SER 32 HN SER 32 65.456 -9.240 15.766 238 HA SER 32 HA SER 32 65.049 -8.538 18.603 239 HB2 SER 32 HB2 SER 32 62.911 -9.534 17.887 240 HB3 SER 32 HB1 SER 32 63.772 -10.922 17.227 241 HG SER 32 HG SER 32 64.076 -10.108 19.917 242 H GLY 33 HN GLY 33 65.871 -11.059 16.274 243 HA2 GLY 33 HA2 GLY 33 67.895 -12.187 18.066 244 HA3 GLY 33 HA1 GLY 33 67.357 -12.862 16.528 245 H GLN 34 HN GLN 34 67.971 -11.653 14.541 246 HA GLN 34 HA GLN 34 70.516 -10.185 14.881 247 HB2 GLN 34 HB2 GLN 34 70.870 -12.521 14.081 248 HB3 GLN 34 HB1 GLN 34 69.895 -12.142 12.661 249 HG2 GLN 34 HG2 GLN 34 71.463 -10.352 12.041 250 HG3 GLN 34 HG1 GLN 34 72.427 -10.688 13.480 251 HE21 GLN 34 HE21 GLN 34 74.332 -11.552 12.560 252 HE22 GLN 34 HE22 GLN 34 74.353 -12.910 11.541 253 H GLU 35 HN GLU 35 70.788 -8.359 13.783 254 HA GLU 35 HA GLU 35 68.527 -7.281 12.304 255 HB2 GLU 35 HB2 GLU 35 69.776 -5.190 12.329 256 HB3 GLU 35 HB1 GLU 35 69.821 -5.902 13.941 257 HG2 GLU 35 HG2 GLU 35 72.057 -6.861 13.438 258 HG3 GLU 35 HG1 GLU 35 72.025 -6.087 11.858 259 H ALA 36 HN ALA 36 68.719 -6.437 10.118 260 HA ALA 36 HA ALA 36 70.155 -8.195 8.364 261 HB1 ALA 36 HB1 ALA 36 69.164 -6.925 6.566 262 HB2 ALA 36 HB2 ALA 36 68.770 -5.599 7.661 263 HB3 ALA 36 HB3 ALA 36 67.941 -7.148 7.819 264 H ARG 37 HN ARG 37 71.810 -7.635 6.876 265 HA ARG 37 HA ARG 37 73.570 -5.439 7.782 266 HB2 ARG 37 HB2 ARG 37 74.218 -7.915 6.165 267 HB3 ARG 37 HB1 ARG 37 75.377 -6.698 6.686 268 HG2 ARG 37 HG2 ARG 37 73.657 -8.222 8.646 269 HG3 ARG 37 HG1 ARG 37 75.225 -8.817 8.110 270 HD2 ARG 37 HD2 ARG 37 76.236 -6.648 8.869 271 HD3 ARG 37 HD1 ARG 37 74.678 -6.208 9.557 272 HE ARG 37 HE ARG 37 76.466 -8.323 10.517 273 HH11 ARG 37 HH11 ARG 37 73.190 -8.306 10.465 274 HH12 ARG 37 HH12 ARG 37 72.941 -8.128 12.170 275 HH21 ARG 37 HH21 ARG 37 76.253 -7.330 12.836 276 HH22 ARG 37 HH22 ARG 37 74.678 -7.571 13.513 277 H TRP 38 HN TRP 38 74.525 -4.058 6.341 278 HA TRP 38 HA TRP 38 73.240 -3.853 3.676 279 HB2 TRP 38 HB2 TRP 38 73.341 -1.985 5.684 280 HB3 TRP 38 HB1 TRP 38 74.780 -1.545 4.779 281 HD1 TRP 38 HD1 TRP 38 74.421 -0.069 2.734 282 HE1 TRP 38 HE1 TRP 38 72.382 0.705 1.358 283 HE3 TRP 38 HE3 TRP 38 70.770 -2.948 4.858 284 HZ2 TRP 38 HZ2 TRP 38 69.580 0.181 1.183 285 HZ3 TRP 38 HZ3 TRP 38 68.427 -2.791 4.062 286 HH2 TRP 38 HH2 TRP 38 67.827 -1.231 2.228 287 H ALA 39 HN ALA 39 74.621 -3.486 1.835 288 HA ALA 39 HA ALA 39 77.447 -3.233 2.081 289 HB1 ALA 39 HB1 ALA 39 77.552 -5.439 2.880 290 HB2 ALA 39 HB2 ALA 39 77.921 -5.593 1.163 291 HB3 ALA 39 HB3 ALA 39 76.311 -5.997 1.760 292 H LEU 40 HN LEU 40 78.546 -3.233 0.080 293 HA LEU 40 HA LEU 40 76.877 -3.338 -2.359 294 HB2 LEU 40 HB2 LEU 40 76.975 -1.002 -1.806 295 HB3 LEU 40 HB1 LEU 40 78.700 -1.090 -1.464 296 HG LEU 40 HG LEU 40 79.168 -1.550 -3.836 297 HD11 LEU 40 HD11 LEU 40 76.161 -1.621 -3.995 298 HD12 LEU 40 HD12 LEU 40 77.326 -2.775 -4.633 299 HD13 LEU 40 HD13 LEU 40 77.121 -1.209 -5.414 300 HD21 LEU 40 HD21 LEU 40 78.261 0.634 -4.773 301 HD22 LEU 40 HD22 LEU 40 79.138 0.775 -3.250 302 HD23 LEU 40 HD23 LEU 40 77.377 0.821 -3.260 303 H GLY 41 HN GLY 41 77.791 -4.612 -3.838 304 HA2 GLY 41 HA2 GLY 41 79.439 -5.561 -5.168 305 HA3 GLY 41 HA1 GLY 41 80.636 -4.599 -4.311 306 H GLY 42 HN GLY 42 78.724 -6.207 -2.074 307 HA2 GLY 42 HA2 GLY 42 78.873 -8.428 -1.205 308 HA3 GLY 42 HA1 GLY 42 80.390 -8.644 -2.063 309 H VAL 43 HN VAL 43 81.030 -5.760 -0.971 310 HA VAL 43 HA VAL 43 82.029 -6.709 1.659 311 HB VAL 43 HB VAL 43 83.821 -5.025 1.386 312 HG11 VAL 43 HG11 VAL 43 84.230 -7.315 0.611 313 HG12 VAL 43 HG12 VAL 43 85.010 -6.163 -0.473 314 HG13 VAL 43 HG13 VAL 43 83.498 -6.935 -0.950 315 HG21 VAL 43 HG21 VAL 43 84.080 -3.961 -0.860 316 HG22 VAL 43 HG22 VAL 43 82.629 -3.418 -0.022 317 HG23 VAL 43 HG23 VAL 43 82.505 -4.606 -1.318 318 HA PRO 44 HA PRO 44 79.403 -3.628 3.541 319 HB2 PRO 44 HB2 PRO 44 81.302 -2.919 5.620 320 HB3 PRO 44 HB1 PRO 44 79.852 -3.922 5.761 321 HG2 PRO 44 HG2 PRO 44 82.609 -4.748 5.726 322 HG3 PRO 44 HG1 PRO 44 81.167 -5.738 5.983 323 HD2 PRO 44 HD2 PRO 44 82.848 -5.738 3.676 324 HD3 PRO 44 HD1 PRO 44 81.300 -6.581 3.863 325 H LEU 45 HN LEU 45 79.158 -1.421 3.378 326 HA LEU 45 HA LEU 45 81.414 0.105 2.228 327 HB2 LEU 45 HB2 LEU 45 79.339 1.756 1.819 328 HB3 LEU 45 HB1 LEU 45 79.666 0.407 0.735 329 HG LEU 45 HG LEU 45 78.060 -0.995 1.965 330 HD11 LEU 45 HD11 LEU 45 78.236 -0.104 4.196 331 HD12 LEU 45 HD12 LEU 45 76.580 0.169 3.662 332 HD13 LEU 45 HD13 LEU 45 77.740 1.499 3.653 333 HD21 LEU 45 HD21 LEU 45 76.122 -0.038 1.056 334 HD22 LEU 45 HD22 LEU 45 77.402 0.707 0.099 335 HD23 LEU 45 HD23 LEU 45 76.645 1.609 1.414 336 H GLN 46 HN GLN 46 80.577 2.674 2.802 337 HA GLN 46 HA GLN 46 80.162 2.918 5.675 338 HB2 GLN 46 HB2 GLN 46 82.255 4.345 5.886 339 HB3 GLN 46 HB1 GLN 46 82.524 2.608 5.743 340 HG2 GLN 46 HG2 GLN 46 82.532 4.447 3.347 341 HG3 GLN 46 HG1 GLN 46 83.991 4.107 4.274 342 HE21 GLN 46 HE21 GLN 46 82.905 3.261 1.434 343 HE22 GLN 46 HE22 GLN 46 83.225 1.594 1.404 344 H ALA 47 HN ALA 47 79.727 5.042 6.356 345 HA ALA 47 HA ALA 47 78.139 6.587 4.674 346 HB1 ALA 47 HB1 ALA 47 78.111 6.652 7.158 347 HB2 ALA 47 HB2 ALA 47 78.197 8.259 6.438 348 HB3 ALA 47 HB3 ALA 47 79.644 7.521 7.126 349 H ASN 48 HN ASN 48 79.574 6.683 2.757 350 HA ASN 48 HA ASN 48 81.896 8.373 2.810 351 HB2 ASN 48 HB2 ASN 48 81.344 6.457 1.172 352 HB3 ASN 48 HB1 ASN 48 80.322 7.634 0.348 353 HD21 ASN 48 HD21 ASN 48 83.547 6.493 0.666 354 HD22 ASN 48 HD22 ASN 48 84.310 7.727 -0.213 355 H GLU 49 HN GLU 49 81.959 10.270 1.207 356 HA GLU 49 HA GLU 49 80.233 12.287 2.145 357 HB2 GLU 49 HB2 GLU 49 82.061 12.172 -0.260 358 HB3 GLU 49 HB1 GLU 49 81.229 13.636 0.259 359 HG2 GLU 49 HG2 GLU 49 83.122 12.019 1.999 360 HG3 GLU 49 HG1 GLU 49 83.566 13.488 1.134 361 H MET 50 HN MET 50 80.083 10.215 -0.702 362 HA MET 50 HA MET 50 77.741 11.647 -1.749 363 HB2 MET 50 HB2 MET 50 77.949 10.008 -3.623 364 HB3 MET 50 HB1 MET 50 79.395 10.988 -3.384 365 HG2 MET 50 HG2 MET 50 80.473 9.178 -2.158 366 HG3 MET 50 HG1 MET 50 79.007 8.205 -2.240 367 HE1 MET 50 HE1 MET 50 82.348 8.982 -3.796 368 HE2 MET 50 HE2 MET 50 81.390 10.327 -4.409 369 HE3 MET 50 HE3 MET 50 82.036 9.133 -5.530 370 H ASN 51 HN ASN 51 78.540 8.889 0.145 371 HA ASN 51 HA ASN 51 75.757 7.853 -0.055 372 HB2 ASN 51 HB2 ASN 51 77.657 6.358 -0.903 373 HB3 ASN 51 HB1 ASN 51 78.176 6.248 0.778 374 HD21 ASN 51 HD21 ASN 51 77.214 3.962 -0.707 375 HD22 ASN 51 HD22 ASN 51 75.761 3.458 0.010 376 H ASP 52 HN ASP 52 74.621 8.255 1.760 377 HA ASP 52 HA ASP 52 76.066 8.334 4.355 378 HB2 ASP 52 HB2 ASP 52 73.743 10.002 3.377 379 HB3 ASP 52 HB1 ASP 52 74.252 9.927 5.064 380 H ILE 53 HN ILE 53 75.162 7.273 6.069 381 HA ILE 53 HA ILE 53 72.748 5.641 5.512 382 HB ILE 53 HB ILE 53 74.883 4.952 7.534 383 HG12 ILE 53 HG12 ILE 53 76.024 5.100 5.377 384 HG13 ILE 53 HG11 ILE 53 75.819 3.409 5.817 385 HG21 ILE 53 HG21 ILE 53 73.938 2.692 7.239 386 HG22 ILE 53 HG22 ILE 53 72.806 3.326 6.042 387 HG23 ILE 53 HG23 ILE 53 72.693 3.845 7.724 388 HD11 ILE 53 HD11 ILE 53 75.056 3.261 3.663 389 HD12 ILE 53 HD12 ILE 53 74.566 4.948 3.601 390 HD13 ILE 53 HD13 ILE 53 73.532 3.761 4.392 391 H THR 54 HN THR 54 71.031 6.324 6.644 392 HA THR 54 HA THR 54 71.453 7.239 9.420 393 HB THR 54 HB THR 54 70.284 9.242 9.135 394 HG1 THR 54 HG1 THR 54 69.161 9.647 7.121 395 HG21 THR 54 HG21 THR 54 71.695 8.924 6.479 396 HG22 THR 54 HG22 THR 54 72.537 9.188 8.005 397 HG23 THR 54 HG23 THR 54 71.438 10.418 7.380 398 H VAL 55 HN VAL 55 69.509 7.235 10.723 399 HA VAL 55 HA VAL 55 67.488 5.272 9.772 400 HB VAL 55 HB VAL 55 68.679 5.677 12.532 401 HG11 VAL 55 HG11 VAL 55 67.073 3.775 13.133 402 HG12 VAL 55 HG12 VAL 55 66.217 4.163 11.642 403 HG13 VAL 55 HG13 VAL 55 66.344 5.366 12.926 404 HG21 VAL 55 HG21 VAL 55 69.911 4.216 10.908 405 HG22 VAL 55 HG22 VAL 55 68.459 3.226 10.759 406 HG23 VAL 55 HG23 VAL 55 69.300 3.326 12.303 407 H GLU 56 HN GLU 56 65.442 5.956 9.738 408 HA GLU 56 HA GLU 56 64.769 8.543 11.027 409 HB2 GLU 56 HB2 GLU 56 63.434 7.078 8.731 410 HB3 GLU 56 HB1 GLU 56 62.909 8.624 9.398 411 HG2 GLU 56 HG2 GLU 56 65.644 8.106 8.190 412 HG3 GLU 56 HG1 GLU 56 64.307 8.891 7.350 413 H GLN 57 HN GLN 57 62.424 8.672 11.758 414 HA GLN 57 HA GLN 57 61.905 6.743 13.728 415 HB2 GLN 57 HB2 GLN 57 60.984 9.020 13.815 416 HB3 GLN 57 HB1 GLN 57 59.970 8.668 12.421 417 HG2 GLN 57 HG2 GLN 57 58.689 8.459 14.521 418 HG3 GLN 57 HG1 GLN 57 58.801 6.907 13.704 419 HE21 GLN 57 HE21 GLN 57 59.229 5.260 15.173 420 HE22 GLN 57 HE22 GLN 57 60.200 5.412 16.556 421 H GLY 58 HN GLY 58 60.256 5.157 13.896 422 HA2 GLY 58 HA2 GLY 58 58.768 3.544 13.138 423 HA3 GLY 58 HA1 GLY 58 58.758 4.337 11.564 424 H THR 59 HN THR 59 61.867 3.832 12.714 425 HA THR 59 HA THR 59 63.565 2.402 12.217 426 HB THR 59 HB THR 59 61.742 0.230 11.264 427 HG1 THR 59 HG1 THR 59 61.897 0.806 14.003 428 HG21 THR 59 HG21 THR 59 63.201 -1.107 12.763 429 HG22 THR 59 HG22 THR 59 64.018 0.371 13.269 430 HG23 THR 59 HG23 THR 59 64.143 -0.177 11.598 431 H LEU 60 HN LEU 60 62.278 4.183 10.202 432 HA LEU 60 HA LEU 60 62.609 2.713 7.687 433 HB2 LEU 60 HB2 LEU 60 61.737 5.498 8.427 434 HB3 LEU 60 HB1 LEU 60 62.214 5.136 6.767 435 HG LEU 60 HG LEU 60 60.548 3.330 6.668 436 HD11 LEU 60 HD11 LEU 60 58.869 3.268 8.611 437 HD12 LEU 60 HD12 LEU 60 60.075 4.165 9.537 438 HD13 LEU 60 HD13 LEU 60 60.454 2.557 8.921 439 HD21 LEU 60 HD21 LEU 60 59.838 5.590 6.012 440 HD22 LEU 60 HD22 LEU 60 59.444 5.966 7.690 441 HD23 LEU 60 HD23 LEU 60 58.509 4.752 6.816 442 H HIS 61 HN HIS 61 64.429 2.664 6.517 443 HA HIS 61 HA HIS 61 66.738 4.259 7.430 444 HB2 HIS 61 HB2 HIS 61 66.518 1.836 5.628 445 HB3 HIS 61 HB1 HIS 61 68.020 2.715 5.914 446 HD1 HIS 61 HD1 HIS 61 65.669 0.294 7.494 447 HD2 HIS 61 HD2 HIS 61 69.020 2.509 8.614 448 HE1 HIS 61 HE1 HIS 61 66.496 -0.707 9.673 449 H LEU 62 HN LEU 62 67.527 5.902 6.255 450 HA LEU 62 HA LEU 62 66.530 6.308 3.479 451 HB2 LEU 62 HB2 LEU 62 65.640 7.836 5.379 452 HB3 LEU 62 HB1 LEU 62 67.253 8.528 5.396 453 HG LEU 62 HG LEU 62 65.879 9.909 3.984 454 HD11 LEU 62 HD11 LEU 62 67.133 9.956 1.982 455 HD12 LEU 62 HD12 LEU 62 67.429 8.222 2.023 456 HD13 LEU 62 HD13 LEU 62 68.231 9.284 3.184 457 HD21 LEU 62 HD21 LEU 62 64.315 7.768 3.490 458 HD22 LEU 62 HD22 LEU 62 65.259 7.753 2.001 459 HD23 LEU 62 HD23 LEU 62 64.334 9.185 2.445 460 H LEU 63 HN LEU 63 68.193 6.052 2.090 461 HA LEU 63 HA LEU 63 70.927 6.816 2.938 462 HB2 LEU 63 HB2 LEU 63 69.811 4.736 1.135 463 HB3 LEU 63 HB1 LEU 63 71.274 5.522 0.551 464 HG LEU 63 HG LEU 63 72.454 4.923 2.598 465 HD11 LEU 63 HD11 LEU 63 70.852 5.013 4.327 466 HD12 LEU 63 HD12 LEU 63 71.175 3.291 4.176 467 HD13 LEU 63 HD13 LEU 63 69.719 3.982 3.459 468 HD21 LEU 63 HD21 LEU 63 70.910 2.530 1.558 469 HD22 LEU 63 HD22 LEU 63 72.521 2.518 2.277 470 HD23 LEU 63 HD23 LEU 63 72.261 3.283 0.708 471 H THR 64 HN THR 64 71.476 8.794 2.372 472 HA THR 64 HA THR 64 70.159 10.104 0.114 473 HB THR 64 HB THR 64 72.291 11.191 1.966 474 HG1 THR 64 HG1 THR 64 70.748 11.576 3.353 475 HG21 THR 64 HG21 THR 64 70.150 12.691 0.454 476 HG22 THR 64 HG22 THR 64 71.723 12.354 -0.266 477 HG23 THR 64 HG23 THR 64 71.615 13.330 1.195 478 H LEU 65 HN LEU 65 70.929 9.878 -1.832 479 HA LEU 65 HA LEU 65 73.824 9.391 -2.259 480 HB2 LEU 65 HB2 LEU 65 72.194 7.694 -3.099 481 HB3 LEU 65 HB1 LEU 65 71.510 8.931 -4.149 482 HG LEU 65 HG LEU 65 73.782 9.251 -5.164 483 HD11 LEU 65 HD11 LEU 65 75.249 7.053 -4.719 484 HD12 LEU 65 HD12 LEU 65 74.449 7.132 -3.153 485 HD13 LEU 65 HD13 LEU 65 75.413 8.493 -3.720 486 HD21 LEU 65 HD21 LEU 65 72.376 7.941 -6.489 487 HD22 LEU 65 HD22 LEU 65 72.287 6.639 -5.304 488 HD23 LEU 65 HD23 LEU 65 73.749 6.861 -6.263 489 H HIS 66 HN HIS 66 75.011 10.964 -3.147 490 HA HIS 66 HA HIS 66 73.722 13.421 -4.021 491 HB2 HIS 66 HB2 HIS 66 76.647 12.668 -3.805 492 HB3 HIS 66 HB1 HIS 66 76.029 14.284 -4.157 493 HD1 HIS 66 HD1 HIS 66 73.732 12.752 -1.880 494 HD2 HIS 66 HD2 HIS 66 77.426 14.635 -1.445 495 HE1 HIS 66 HE1 HIS 66 73.920 13.400 0.560 496 H LYS 67 HN LYS 67 75.342 14.401 -5.944 497 HA LYS 67 HA LYS 67 74.391 13.076 -8.298 498 HB2 LYS 67 HB2 LYS 67 76.303 15.387 -7.903 499 HB3 LYS 67 HB1 LYS 67 75.727 14.845 -9.477 500 HG2 LYS 67 HG2 LYS 67 73.393 15.247 -8.752 501 HG3 LYS 67 HG1 LYS 67 73.986 15.819 -7.191 502 HD2 LYS 67 HD2 LYS 67 75.247 17.615 -8.328 503 HD3 LYS 67 HD1 LYS 67 74.641 17.049 -9.884 504 HE2 LYS 67 HE2 LYS 67 72.947 18.070 -7.585 505 HE3 LYS 67 HE1 LYS 67 73.286 18.934 -9.086 506 HZ1 LYS 67 HZ1 LYS 67 71.749 16.428 -8.740 507 HZ2 LYS 67 HZ2 LYS 67 72.294 16.970 -10.257 508 HZ3 LYS 67 HZ3 LYS 67 71.199 17.910 -9.357 509 H VAL 68 HN VAL 68 75.486 10.982 -7.670 510 HA VAL 68 HA VAL 68 78.312 10.721 -7.852 511 HB VAL 68 HB VAL 68 77.802 8.282 -8.106 512 HG11 VAL 68 HG11 VAL 68 77.003 8.037 -5.873 513 HG12 VAL 68 HG12 VAL 68 76.161 9.587 -5.933 514 HG13 VAL 68 HG13 VAL 68 77.924 9.538 -5.902 515 HG21 VAL 68 HG21 VAL 68 75.505 7.537 -8.038 516 HG22 VAL 68 HG22 VAL 68 75.647 8.683 -9.370 517 HG23 VAL 68 HG23 VAL 68 74.920 9.190 -7.846 518 H THR 69 HN THR 69 78.924 8.751 -9.457 519 HA THR 69 HA THR 69 78.222 9.564 -12.215 520 HB THR 69 HB THR 69 80.565 9.347 -12.846 521 HG1 THR 69 HG1 THR 69 80.947 7.787 -11.081 522 HG21 THR 69 HG21 THR 69 81.392 11.341 -11.803 523 HG22 THR 69 HG22 THR 69 80.408 11.069 -10.364 524 HG23 THR 69 HG23 THR 69 79.639 11.513 -11.888 525 H LEU 70 HN LEU 70 79.805 7.719 -13.522 526 HA LEU 70 HA LEU 70 78.240 5.366 -13.351 527 HB2 LEU 70 HB2 LEU 70 80.965 5.654 -14.636 528 HB3 LEU 70 HB1 LEU 70 79.725 4.463 -15.029 529 HG LEU 70 HG LEU 70 79.454 7.466 -15.378 530 HD11 LEU 70 HD11 LEU 70 79.420 6.841 -17.819 531 HD12 LEU 70 HD12 LEU 70 79.904 5.210 -17.352 532 HD13 LEU 70 HD13 LEU 70 80.974 6.574 -17.030 533 HD21 LEU 70 HD21 LEU 70 77.407 6.721 -16.723 534 HD22 LEU 70 HD22 LEU 70 77.264 6.584 -14.977 535 HD23 LEU 70 HD23 LEU 70 77.590 5.148 -15.950 536 H GLU 71 HN GLU 71 80.924 6.409 -11.521 537 HA GLU 71 HA GLU 71 82.140 3.920 -10.933 538 HB2 GLU 71 HB2 GLU 71 82.045 6.523 -9.402 539 HB3 GLU 71 HB1 GLU 71 83.008 5.134 -8.895 540 HG2 GLU 71 HG2 GLU 71 84.212 5.164 -11.031 541 HG3 GLU 71 HG1 GLU 71 83.225 6.515 -11.584 542 H ASP 72 HN ASP 72 79.445 5.645 -9.421 543 HA ASP 72 HA ASP 72 79.236 3.956 -7.150 544 HB2 ASP 72 HB2 ASP 72 78.209 6.155 -7.174 545 HB3 ASP 72 HB1 ASP 72 77.151 5.677 -8.502 546 H ALA 73 HN ALA 73 77.845 3.798 -10.385 547 HA ALA 73 HA ALA 73 75.831 2.012 -10.208 548 HB1 ALA 73 HB1 ALA 73 76.764 2.966 -12.322 549 HB2 ALA 73 HB2 ALA 73 76.387 1.248 -12.430 550 HB3 ALA 73 HB3 ALA 73 78.061 1.773 -12.239 551 H GLY 74 HN GLY 74 75.634 0.268 -9.022 552 HA2 GLY 74 HA2 GLY 74 77.279 -2.041 -9.393 553 HA3 GLY 74 HA1 GLY 74 77.564 -1.284 -7.825 554 H THR 75 HN THR 75 76.620 -3.677 -7.473 555 HA THR 75 HA THR 75 73.664 -3.542 -7.327 556 HB THR 75 HB THR 75 75.554 -5.899 -7.116 557 HG1 THR 75 HG1 THR 75 75.452 -5.533 -9.200 558 HG21 THR 75 HG21 THR 75 73.390 -7.195 -7.339 559 HG22 THR 75 HG22 THR 75 72.539 -5.685 -7.027 560 HG23 THR 75 HG23 THR 75 73.601 -6.368 -5.796 561 H VAL 76 HN VAL 76 72.777 -3.048 -5.443 562 HA VAL 76 HA VAL 76 74.325 -3.321 -2.955 563 HB VAL 76 HB VAL 76 71.559 -2.140 -3.257 564 HG11 VAL 76 HG11 VAL 76 73.764 -1.711 -1.228 565 HG12 VAL 76 HG12 VAL 76 72.351 -2.738 -0.985 566 HG13 VAL 76 HG13 VAL 76 72.153 -0.997 -1.181 567 HG21 VAL 76 HG21 VAL 76 74.193 -0.646 -3.338 568 HG22 VAL 76 HG22 VAL 76 72.582 0.046 -3.486 569 HG23 VAL 76 HG23 VAL 76 73.220 -0.986 -4.768 570 H SER 77 HN SER 77 73.847 -4.838 -1.427 571 HA SER 77 HA SER 77 71.316 -6.333 -1.638 572 HB2 SER 77 HB2 SER 77 72.332 -8.439 -1.748 573 HB3 SER 77 HB1 SER 77 73.282 -7.477 -2.874 574 HG SER 77 HG SER 77 74.463 -7.081 -0.643 575 H PHE 78 HN PHE 78 70.582 -7.208 0.260 576 HA PHE 78 HA PHE 78 72.173 -7.021 2.697 577 HB2 PHE 78 HB2 PHE 78 70.441 -5.675 3.858 578 HB3 PHE 78 HB1 PHE 78 71.223 -4.776 2.559 579 HD1 PHE 78 HD1 PHE 78 68.113 -6.147 3.818 580 HD2 PHE 78 HD2 PHE 78 70.059 -4.570 0.327 581 HE1 PHE 78 HE1 PHE 78 65.905 -5.778 2.753 582 HE2 PHE 78 HE2 PHE 78 67.849 -4.202 -0.736 583 HZ PHE 78 HZ PHE 78 65.774 -4.803 0.480 584 H HIS 79 HN HIS 79 71.375 -8.360 4.354 585 HA HIS 79 HA HIS 79 68.833 -9.714 4.002 586 HB2 HIS 79 HB2 HIS 79 69.804 -11.961 3.798 587 HB3 HIS 79 HB1 HIS 79 70.250 -10.942 2.426 588 HD1 HIS 79 HD1 HIS 79 72.693 -9.849 2.527 589 HD2 HIS 79 HD2 HIS 79 71.987 -12.888 5.293 590 HE1 HIS 79 HE1 HIS 79 74.958 -10.547 3.416 591 H VAL 80 HN VAL 80 68.417 -11.297 5.664 592 HA VAL 80 HA VAL 80 70.007 -10.944 8.126 593 HB VAL 80 HB VAL 80 68.166 -9.463 8.389 594 HG11 VAL 80 HG11 VAL 80 66.747 -10.197 6.584 595 HG12 VAL 80 HG12 VAL 80 65.819 -10.277 8.080 596 HG13 VAL 80 HG13 VAL 80 66.472 -11.749 7.370 597 HG21 VAL 80 HG21 VAL 80 68.671 -11.309 10.208 598 HG22 VAL 80 HG22 VAL 80 67.081 -11.917 9.751 599 HG23 VAL 80 HG23 VAL 80 67.255 -10.276 10.374 600 H GLY 81 HN GLY 81 70.241 -12.719 9.363 601 HA2 GLY 81 HA2 GLY 81 70.389 -15.225 8.457 602 HA3 GLY 81 HA1 GLY 81 69.960 -14.897 10.129 603 H THR 82 HN THR 82 67.384 -13.631 9.172 604 HA THR 82 HA THR 82 65.815 -16.085 9.175 605 HB THR 82 HB THR 82 63.925 -14.618 9.523 606 HG1 THR 82 HG1 THR 82 64.298 -12.341 9.461 607 HG21 THR 82 HG21 THR 82 66.394 -13.729 11.040 608 HG22 THR 82 HG22 THR 82 65.290 -15.025 11.491 609 HG23 THR 82 HG23 THR 82 64.743 -13.349 11.523 610 H CYS 83 HN CYS 83 65.356 -13.091 7.339 611 HA CYS 83 HA CYS 83 64.636 -14.694 4.950 612 HB2 CYS 83 HB2 CYS 83 63.769 -11.996 5.962 613 HB3 CYS 83 HB1 CYS 83 63.552 -12.448 4.269 614 HG CYS 83 HG CYS 83 61.669 -13.910 4.922 615 H SER 84 HN SER 84 64.842 -12.909 2.961 616 HA SER 84 HA SER 84 67.406 -11.543 3.030 617 HB2 SER 84 HB2 SER 84 68.477 -12.879 1.336 618 HB3 SER 84 HB1 SER 84 67.980 -13.949 2.642 619 HG SER 84 HG SER 84 67.085 -14.984 1.023 620 H SER 85 HN SER 85 67.791 -10.243 1.183 621 HA SER 85 HA SER 85 65.766 -10.071 -0.908 622 HB2 SER 85 HB2 SER 85 64.780 -8.698 0.872 623 HB3 SER 85 HB1 SER 85 66.277 -7.778 1.005 624 HG SER 85 HG SER 85 64.353 -7.820 -1.039 625 H GLU 86 HN GLU 86 66.421 -8.749 -2.680 626 HA GLU 86 HA GLU 86 69.241 -7.840 -2.654 627 HB2 GLU 86 HB2 GLU 86 67.897 -9.603 -4.717 628 HB3 GLU 86 HB1 GLU 86 69.460 -8.818 -4.949 629 HG2 GLU 86 HG2 GLU 86 70.381 -10.000 -3.019 630 HG3 GLU 86 HG1 GLU 86 68.809 -10.722 -2.681 631 H ALA 87 HN ALA 87 69.716 -6.163 -4.120 632 HA ALA 87 HA ALA 87 67.465 -4.942 -5.596 633 HB1 ALA 87 HB1 ALA 87 67.906 -2.761 -4.684 634 HB2 ALA 87 HB2 ALA 87 69.304 -3.357 -3.790 635 HB3 ALA 87 HB3 ALA 87 67.678 -3.862 -3.325 636 H GLN 88 HN GLN 88 68.112 -3.701 -7.393 637 HA GLN 88 HA GLN 88 70.998 -3.867 -8.091 638 HB2 GLN 88 HB2 GLN 88 68.570 -4.372 -9.816 639 HB3 GLN 88 HB1 GLN 88 70.179 -4.085 -10.477 640 HG2 GLN 88 HG2 GLN 88 71.059 -5.996 -9.199 641 HG3 GLN 88 HG1 GLN 88 69.464 -6.279 -8.510 642 HE21 GLN 88 HE21 GLN 88 68.933 -8.279 -9.494 643 HE22 GLN 88 HE22 GLN 88 68.848 -8.505 -11.174 644 H LEU 89 HN LEU 89 71.939 -1.995 -8.505 645 HA LEU 89 HA LEU 89 70.273 0.349 -9.265 646 HB2 LEU 89 HB2 LEU 89 71.555 0.430 -7.033 647 HB3 LEU 89 HB1 LEU 89 73.027 0.452 -8.005 648 HG LEU 89 HG LEU 89 71.785 2.435 -9.278 649 HD11 LEU 89 HD11 LEU 89 70.292 3.720 -7.933 650 HD12 LEU 89 HD12 LEU 89 70.629 2.749 -6.501 651 HD13 LEU 89 HD13 LEU 89 69.697 2.062 -7.831 652 HD21 LEU 89 HD21 LEU 89 72.778 4.037 -7.585 653 HD22 LEU 89 HD22 LEU 89 73.885 2.787 -8.153 654 HD23 LEU 89 HD23 LEU 89 73.126 2.639 -6.568 655 H LYS 90 HN LYS 90 70.364 0.309 -11.416 656 HA LYS 90 HA LYS 90 73.009 0.160 -12.744 657 HB2 LYS 90 HB2 LYS 90 71.443 -0.122 -14.814 658 HB3 LYS 90 HB1 LYS 90 71.671 -1.486 -13.720 659 HG2 LYS 90 HG2 LYS 90 69.581 -1.131 -12.651 660 HG3 LYS 90 HG1 LYS 90 69.411 0.483 -13.338 661 HD2 LYS 90 HD2 LYS 90 67.949 -0.976 -14.573 662 HD3 LYS 90 HD1 LYS 90 69.316 -0.602 -15.621 663 HE2 LYS 90 HE2 LYS 90 70.355 -2.736 -15.136 664 HE3 LYS 90 HE1 LYS 90 69.145 -3.093 -13.902 665 HZ1 LYS 90 HZ1 LYS 90 69.020 -3.514 -16.693 666 HZ2 LYS 90 HZ2 LYS 90 67.759 -2.480 -16.211 667 HZ3 LYS 90 HZ3 LYS 90 67.931 -4.009 -15.489 668 H VAL 91 HN VAL 91 73.022 1.572 -14.810 669 HA VAL 91 HA VAL 91 71.741 4.191 -14.252 670 HB VAL 91 HB VAL 91 73.861 5.236 -15.092 671 HG11 VAL 91 HG11 VAL 91 74.990 5.065 -12.981 672 HG12 VAL 91 HG12 VAL 91 74.300 3.474 -12.666 673 HG13 VAL 91 HG13 VAL 91 73.271 4.903 -12.643 674 HG21 VAL 91 HG21 VAL 91 74.812 2.364 -14.858 675 HG22 VAL 91 HG22 VAL 91 75.901 3.746 -14.946 676 HG23 VAL 91 HG23 VAL 91 74.830 3.379 -16.299 677 H THR 92 HN THR 92 71.537 5.593 -16.047 678 HA THR 92 HA THR 92 71.245 4.167 -18.637 679 HB THR 92 HB THR 92 69.082 4.809 -17.861 680 HG1 THR 92 HG1 THR 92 68.517 6.270 -19.467 681 HG21 THR 92 HG21 THR 92 68.529 7.008 -17.041 682 HG22 THR 92 HG22 THR 92 70.124 7.627 -17.468 683 HG23 THR 92 HG23 THR 92 69.950 6.465 -16.154 684 H ALA 93 HN ALA 93 72.339 4.882 -20.318 685 HA ALA 93 HA ALA 93 74.386 6.793 -20.142 686 HB1 ALA 93 HB1 ALA 93 74.665 6.441 -22.501 687 HB2 ALA 93 HB2 ALA 93 73.003 5.872 -22.664 688 HB3 ALA 93 HB3 ALA 93 74.187 4.897 -21.794 689 H GLY 94 HN GLY 94 74.548 8.924 -20.717 690 HA2 GLY 94 HA2 GLY 94 73.789 11.102 -20.936 691 HA3 GLY 94 HA1 GLY 94 72.978 10.451 -22.357 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 54.347 -5.571 17.361 2 H2 MET 1 HT2 MET 1 54.102 -6.862 18.437 3 H3 MET 1 HT3 MET 1 52.867 -5.733 18.169 4 HA MET 1 HA MET 1 52.655 -7.970 17.011 5 HB2 MET 1 HB2 MET 1 52.076 -6.645 14.775 6 HB3 MET 1 HB1 MET 1 51.128 -6.389 16.238 7 HG2 MET 1 HG2 MET 1 53.569 -4.701 15.710 8 HG3 MET 1 HG1 MET 1 52.030 -4.303 14.949 9 HE1 MET 1 HE1 MET 1 49.938 -4.396 16.049 10 HE2 MET 1 HE2 MET 1 50.145 -2.692 16.443 11 HE3 MET 1 HE3 MET 1 49.576 -3.810 17.678 12 H ALA 2 HN ALA 2 53.891 -9.434 16.028 13 HA ALA 2 HA ALA 2 55.647 -10.386 14.886 14 HB1 ALA 2 HB1 ALA 2 55.985 -9.548 12.635 15 HB2 ALA 2 HB2 ALA 2 55.236 -8.009 13.059 16 HB3 ALA 2 HB3 ALA 2 54.266 -9.481 13.025 17 HA PRO 3 HA PRO 3 58.724 -7.438 16.686 18 HB2 PRO 3 HB2 PRO 3 59.879 -9.682 18.126 19 HB3 PRO 3 HB1 PRO 3 59.051 -8.264 18.790 20 HG2 PRO 3 HG2 PRO 3 58.065 -10.871 18.798 21 HG3 PRO 3 HG1 PRO 3 57.112 -9.403 19.065 22 HD2 PRO 3 HD2 PRO 3 57.278 -11.117 16.635 23 HD3 PRO 3 HD1 PRO 3 55.952 -10.072 17.192 24 H GLU 4 HN GLU 4 58.910 -10.465 15.020 25 HA GLU 4 HA GLU 4 61.671 -10.685 14.589 26 HB2 GLU 4 HB2 GLU 4 60.023 -12.427 13.953 27 HB3 GLU 4 HB1 GLU 4 59.435 -11.374 12.665 28 HG2 GLU 4 HG2 GLU 4 61.659 -11.384 11.614 29 HG3 GLU 4 HG1 GLU 4 62.280 -12.391 12.921 30 H VAL 5 HN VAL 5 62.994 -9.974 12.876 31 HA VAL 5 HA VAL 5 62.692 -7.293 12.080 32 HB VAL 5 HB VAL 5 64.507 -7.824 10.421 33 HG11 VAL 5 HG11 VAL 5 66.171 -8.524 12.181 34 HG12 VAL 5 HG12 VAL 5 64.815 -8.796 13.275 35 HG13 VAL 5 HG13 VAL 5 65.136 -7.177 12.651 36 HG21 VAL 5 HG21 VAL 5 65.497 -10.184 10.715 37 HG22 VAL 5 HG22 VAL 5 64.027 -10.067 9.756 38 HG23 VAL 5 HG23 VAL 5 63.948 -10.632 11.422 39 H THR 6 HN THR 6 61.327 -6.414 10.594 40 HA THR 6 HA THR 6 59.996 -8.292 8.733 41 HB THR 6 HB THR 6 58.637 -6.341 8.036 42 HG1 THR 6 HG1 THR 6 59.453 -4.491 8.492 43 HG21 THR 6 HG21 THR 6 57.718 -7.747 9.706 44 HG22 THR 6 HG22 THR 6 57.512 -6.106 10.314 45 HG23 THR 6 HG23 THR 6 58.808 -7.124 10.944 46 H ILE 7 HN ILE 7 60.238 -8.360 6.593 47 HA ILE 7 HA ILE 7 62.440 -6.745 5.442 48 HB ILE 7 HB ILE 7 61.321 -9.328 4.379 49 HG12 ILE 7 HG12 ILE 7 62.074 -9.810 6.641 50 HG13 ILE 7 HG11 ILE 7 63.266 -10.434 5.505 51 HG21 ILE 7 HG21 ILE 7 63.562 -9.439 3.311 52 HG22 ILE 7 HG22 ILE 7 63.957 -7.878 4.030 53 HG23 ILE 7 HG23 ILE 7 62.670 -7.995 2.832 54 HD11 ILE 7 HD11 ILE 7 64.624 -9.350 7.055 55 HD12 ILE 7 HD12 ILE 7 63.460 -8.062 7.339 56 HD13 ILE 7 HD13 ILE 7 64.411 -8.077 5.856 57 H LEU 8 HN LEU 8 60.377 -5.203 5.354 58 HA LEU 8 HA LEU 8 58.840 -5.700 2.882 59 HB2 LEU 8 HB2 LEU 8 57.870 -5.009 5.255 60 HB3 LEU 8 HB1 LEU 8 58.304 -3.392 4.729 61 HG LEU 8 HG LEU 8 55.993 -3.818 4.135 62 HD11 LEU 8 HD11 LEU 8 57.594 -4.087 1.584 63 HD12 LEU 8 HD12 LEU 8 57.489 -2.586 2.505 64 HD13 LEU 8 HD13 LEU 8 56.035 -3.295 1.804 65 HD21 LEU 8 HD21 LEU 8 56.558 -6.437 3.965 66 HD22 LEU 8 HD22 LEU 8 56.676 -6.049 2.249 67 HD23 LEU 8 HD23 LEU 8 55.184 -5.729 3.121 68 H GLU 9 HN GLU 9 60.870 -5.275 1.706 69 HA GLU 9 HA GLU 9 61.327 -2.368 1.294 70 HB2 GLU 9 HB2 GLU 9 63.638 -3.234 0.465 71 HB3 GLU 9 HB1 GLU 9 63.348 -3.110 2.200 72 HG2 GLU 9 HG2 GLU 9 62.818 -5.487 2.329 73 HG3 GLU 9 HG1 GLU 9 62.970 -5.644 0.578 74 HA PRO 10 HA PRO 10 59.774 -4.239 -2.621 75 HB2 PRO 10 HB2 PRO 10 58.334 -1.763 -3.141 76 HB3 PRO 10 HB1 PRO 10 57.671 -3.368 -2.799 77 HG2 PRO 10 HG2 PRO 10 57.550 -1.171 -1.098 78 HG3 PRO 10 HG1 PRO 10 57.296 -2.857 -0.624 79 HD2 PRO 10 HD2 PRO 10 59.685 -1.126 -0.194 80 HD3 PRO 10 HD1 PRO 10 59.098 -2.506 0.760 81 H LEU 11 HN LEU 11 62.339 -3.368 -2.463 82 HA LEU 11 HA LEU 11 62.790 -1.119 -4.234 83 HB2 LEU 11 HB2 LEU 11 64.688 -3.193 -3.110 84 HB3 LEU 11 HB1 LEU 11 65.179 -1.777 -4.039 85 HG LEU 11 HG LEU 11 63.631 -1.687 -1.431 86 HD11 LEU 11 HD11 LEU 11 65.782 -2.398 -0.837 87 HD12 LEU 11 HD12 LEU 11 65.881 -0.651 -0.659 88 HD13 LEU 11 HD13 LEU 11 66.565 -1.431 -2.085 89 HD21 LEU 11 HD21 LEU 11 64.584 0.390 -3.384 90 HD22 LEU 11 HD22 LEU 11 64.591 0.794 -1.668 91 HD23 LEU 11 HD23 LEU 11 63.087 0.331 -2.457 92 H GLN 12 HN GLN 12 62.902 -1.178 -6.369 93 HA GLN 12 HA GLN 12 63.190 -3.801 -7.735 94 HB2 GLN 12 HB2 GLN 12 61.776 -2.871 -9.527 95 HB3 GLN 12 HB1 GLN 12 60.930 -2.865 -7.986 96 HG2 GLN 12 HG2 GLN 12 61.637 -0.468 -7.678 97 HG3 GLN 12 HG1 GLN 12 62.280 -0.500 -9.318 98 HE21 GLN 12 HE21 GLN 12 60.128 1.260 -8.594 99 HE22 GLN 12 HE22 GLN 12 58.731 0.751 -9.412 100 H ASP 13 HN ASP 13 63.198 -2.213 -10.299 101 HA ASP 13 HA ASP 13 66.064 -1.499 -10.264 102 HB2 ASP 13 HB2 ASP 13 65.139 -3.322 -11.812 103 HB3 ASP 13 HB1 ASP 13 64.353 -2.016 -12.696 104 H VAL 14 HN VAL 14 66.693 0.524 -10.625 105 HA VAL 14 HA VAL 14 64.719 2.498 -11.645 106 HB VAL 14 HB VAL 14 65.975 4.150 -10.196 107 HG11 VAL 14 HG11 VAL 14 64.582 1.851 -8.792 108 HG12 VAL 14 HG12 VAL 14 63.768 3.189 -9.603 109 HG13 VAL 14 HG13 VAL 14 64.754 3.493 -8.173 110 HG21 VAL 14 HG21 VAL 14 67.037 1.576 -8.977 111 HG22 VAL 14 HG22 VAL 14 67.251 3.192 -8.304 112 HG23 VAL 14 HG23 VAL 14 68.002 2.773 -9.843 113 H GLN 15 HN GLN 15 65.382 3.880 -13.209 114 HA GLN 15 HA GLN 15 68.187 3.632 -14.161 115 HB2 GLN 15 HB2 GLN 15 65.631 4.203 -15.681 116 HB3 GLN 15 HB1 GLN 15 67.248 4.338 -16.376 117 HG2 GLN 15 HG2 GLN 15 67.693 1.984 -15.878 118 HG3 GLN 15 HG1 GLN 15 66.115 1.830 -15.108 119 HE21 GLN 15 HE21 GLN 15 64.975 0.491 -16.546 120 HE22 GLN 15 HE22 GLN 15 64.790 0.811 -18.204 121 H LEU 16 HN LEU 16 69.362 5.356 -13.656 122 HA LEU 16 HA LEU 16 68.100 8.050 -13.656 123 HB2 LEU 16 HB2 LEU 16 70.435 7.050 -12.007 124 HB3 LEU 16 HB1 LEU 16 69.756 8.675 -11.958 125 HG LEU 16 HG LEU 16 68.185 6.156 -11.349 126 HD11 LEU 16 HD11 LEU 16 68.369 6.909 -8.977 127 HD12 LEU 16 HD12 LEU 16 69.502 8.158 -9.496 128 HD13 LEU 16 HD13 LEU 16 69.924 6.457 -9.679 129 HD21 LEU 16 HD21 LEU 16 66.575 7.755 -11.903 130 HD22 LEU 16 HD22 LEU 16 67.566 9.109 -11.361 131 HD23 LEU 16 HD23 LEU 16 66.760 8.078 -10.181 132 H SER 17 HN SER 17 69.024 9.604 -14.906 133 HA SER 17 HA SER 17 70.939 8.925 -16.884 134 HB2 SER 17 HB2 SER 17 69.356 10.713 -17.282 135 HB3 SER 17 HB1 SER 17 69.967 11.620 -15.904 136 HG SER 17 HG SER 17 72.079 11.341 -17.165 137 H GLU 18 HN GLU 18 73.114 9.632 -17.116 138 HA GLU 18 HA GLU 18 74.758 9.296 -14.892 139 HB2 GLU 18 HB2 GLU 18 75.517 9.033 -17.213 140 HB3 GLU 18 HB1 GLU 18 75.386 10.775 -17.454 141 HG2 GLU 18 HG2 GLU 18 77.075 11.174 -15.730 142 HG3 GLU 18 HG1 GLU 18 77.155 9.447 -15.382 143 H GLY 19 HN GLY 19 75.870 10.650 -13.528 144 HA2 GLY 19 HA2 GLY 19 76.472 12.623 -12.455 145 HA3 GLY 19 HA1 GLY 19 75.722 13.524 -13.768 146 H GLN 20 HN GLN 20 73.789 11.081 -12.271 147 HA GLN 20 HA GLN 20 72.265 13.183 -10.827 148 HB2 GLN 20 HB2 GLN 20 71.255 10.644 -12.129 149 HB3 GLN 20 HB1 GLN 20 70.276 11.750 -11.168 150 HG2 GLN 20 HG2 GLN 20 71.817 12.586 -13.639 151 HG3 GLN 20 HG1 GLN 20 70.107 12.160 -13.641 152 HE21 GLN 20 HE21 GLN 20 71.985 14.837 -13.687 153 HE22 GLN 20 HE22 GLN 20 71.012 15.902 -12.792 154 H ASP 21 HN ASP 21 71.513 12.804 -8.817 155 HA ASP 21 HA ASP 21 72.986 10.932 -7.203 156 HB2 ASP 21 HB2 ASP 21 71.641 11.893 -5.355 157 HB3 ASP 21 HB1 ASP 21 72.395 13.144 -6.337 158 H ALA 22 HN ALA 22 71.760 9.510 -5.597 159 HA ALA 22 HA ALA 22 69.276 8.378 -6.732 160 HB1 ALA 22 HB1 ALA 22 71.549 6.593 -5.870 161 HB2 ALA 22 HB2 ALA 22 71.385 7.145 -7.537 162 HB3 ALA 22 HB3 ALA 22 70.112 6.173 -6.801 163 H SER 23 HN SER 23 67.881 7.516 -5.232 164 HA SER 23 HA SER 23 68.770 7.360 -2.416 165 HB2 SER 23 HB2 SER 23 66.277 8.777 -3.379 166 HB3 SER 23 HB1 SER 23 66.694 8.473 -1.694 167 HG SER 23 HG SER 23 68.768 9.573 -3.011 168 H PHE 24 HN PHE 24 67.541 5.981 -1.087 169 HA PHE 24 HA PHE 24 65.595 4.197 -2.430 170 HB2 PHE 24 HB2 PHE 24 67.971 3.348 -0.759 171 HB3 PHE 24 HB1 PHE 24 66.652 2.283 -1.229 172 HD1 PHE 24 HD1 PHE 24 69.805 3.693 -2.245 173 HD2 PHE 24 HD2 PHE 24 66.116 2.083 -3.715 174 HE1 PHE 24 HE1 PHE 24 70.873 3.259 -4.443 175 HE2 PHE 24 HE2 PHE 24 67.169 1.650 -5.911 176 HZ PHE 24 HZ PHE 24 69.550 2.234 -6.277 177 H GLN 25 HN GLN 25 64.078 3.204 -0.991 178 HA GLN 25 HA GLN 25 64.097 4.198 1.803 179 HB2 GLN 25 HB2 GLN 25 62.600 5.642 0.455 180 HB3 GLN 25 HB1 GLN 25 61.672 4.217 -0.014 181 HG2 GLN 25 HG2 GLN 25 61.080 3.778 2.301 182 HG3 GLN 25 HG1 GLN 25 62.131 5.080 2.855 183 HE21 GLN 25 HE21 GLN 25 59.322 5.078 3.464 184 HE22 GLN 25 HE22 GLN 25 58.598 6.367 2.630 185 H CYS 26 HN CYS 26 63.264 2.797 3.320 186 HA CYS 26 HA CYS 26 61.989 0.304 2.459 187 HB2 CYS 26 HB2 CYS 26 64.531 0.248 4.097 188 HB3 CYS 26 HB1 CYS 26 63.629 -1.132 3.467 189 HG CYS 26 HG CYS 26 65.775 0.157 1.957 190 H ARG 27 HN ARG 27 61.313 -1.026 4.293 191 HA ARG 27 HA ARG 27 60.921 0.447 6.831 192 HB2 ARG 27 HB2 ARG 27 58.823 -0.958 5.159 193 HB3 ARG 27 HB1 ARG 27 58.588 -0.529 6.855 194 HG2 ARG 27 HG2 ARG 27 58.938 1.828 6.357 195 HG3 ARG 27 HG1 ARG 27 59.306 1.450 4.673 196 HD2 ARG 27 HD2 ARG 27 57.048 0.581 4.345 197 HD3 ARG 27 HD1 ARG 27 56.672 0.847 6.045 198 HE ARG 27 HE ARG 27 57.531 3.259 4.760 199 HH11 ARG 27 HH11 ARG 27 55.282 3.092 6.762 200 HH12 ARG 27 HH12 ARG 27 53.893 3.399 5.775 201 HH21 ARG 27 HH21 ARG 27 55.533 2.758 2.796 202 HH22 ARG 27 HH22 ARG 27 54.036 3.214 3.537 203 H LEU 28 HN LEU 28 62.295 -0.825 8.014 204 HA LEU 28 HA LEU 28 61.781 -3.753 8.015 205 HB2 LEU 28 HB2 LEU 28 64.346 -2.317 8.741 206 HB3 LEU 28 HB1 LEU 28 64.111 -4.058 8.626 207 HG LEU 28 HG LEU 28 63.765 -2.148 6.288 208 HD11 LEU 28 HD11 LEU 28 66.131 -2.301 7.191 209 HD12 LEU 28 HD12 LEU 28 65.944 -2.852 5.527 210 HD13 LEU 28 HD13 LEU 28 66.080 -4.028 6.834 211 HD21 LEU 28 HD21 LEU 28 63.819 -5.159 6.579 212 HD22 LEU 28 HD22 LEU 28 64.030 -4.355 5.028 213 HD23 LEU 28 HD23 LEU 28 62.521 -4.169 5.912 214 H SER 29 HN SER 29 61.082 -4.629 9.874 215 HA SER 29 HA SER 29 60.732 -2.951 12.192 216 HB2 SER 29 HB2 SER 29 59.585 -4.736 13.190 217 HB3 SER 29 HB1 SER 29 59.204 -4.898 11.485 218 HG SER 29 HG SER 29 60.893 -6.411 13.120 219 H ARG 30 HN ARG 30 61.581 -3.465 14.288 220 HA ARG 30 HA ARG 30 64.344 -3.430 14.357 221 HB2 ARG 30 HB2 ARG 30 64.126 -3.414 16.723 222 HB3 ARG 30 HB1 ARG 30 62.763 -2.543 16.030 223 HG2 ARG 30 HG2 ARG 30 61.330 -4.529 16.301 224 HG3 ARG 30 HG1 ARG 30 62.685 -5.415 17.001 225 HD2 ARG 30 HD2 ARG 30 62.837 -3.842 18.842 226 HD3 ARG 30 HD1 ARG 30 61.574 -2.839 18.131 227 HE ARG 30 HE ARG 30 59.971 -4.435 18.796 228 HH11 ARG 30 HH11 ARG 30 62.277 -6.638 18.281 229 HH12 ARG 30 HH12 ARG 30 62.210 -7.431 19.819 230 HH21 ARG 30 HH21 ARG 30 60.308 -4.945 21.307 231 HH22 ARG 30 HH22 ARG 30 61.105 -6.465 21.539 232 H ALA 31 HN ALA 31 65.719 -4.723 15.779 233 HA ALA 31 HA ALA 31 66.013 -7.368 14.769 234 HB1 ALA 31 HB1 ALA 31 68.038 -7.421 15.977 235 HB2 ALA 31 HB2 ALA 31 67.462 -6.244 17.158 236 HB3 ALA 31 HB3 ALA 31 67.844 -5.730 15.515 237 H SER 32 HN SER 32 65.988 -9.320 15.869 238 HA SER 32 HA SER 32 64.665 -9.414 18.505 239 HB2 SER 32 HB2 SER 32 63.762 -10.918 16.033 240 HB3 SER 32 HB1 SER 32 63.224 -11.281 17.672 241 HG SER 32 HG SER 32 62.992 -8.672 17.294 242 H GLY 33 HN GLY 33 65.989 -11.406 15.868 243 HA2 GLY 33 HA2 GLY 33 67.321 -13.136 17.862 244 HA3 GLY 33 HA1 GLY 33 67.044 -13.538 16.166 245 H GLN 34 HN GLN 34 68.066 -11.878 14.608 246 HA GLN 34 HA GLN 34 70.762 -11.112 15.572 247 HB2 GLN 34 HB2 GLN 34 70.032 -12.250 12.856 248 HB3 GLN 34 HB1 GLN 34 71.619 -11.639 13.313 249 HG2 GLN 34 HG2 GLN 34 71.904 -13.918 13.702 250 HG3 GLN 34 HG1 GLN 34 71.400 -13.374 15.299 251 HE21 GLN 34 HE21 GLN 34 70.401 -15.203 12.449 252 HE22 GLN 34 HE22 GLN 34 68.991 -15.848 13.137 253 H GLU 35 HN GLU 35 71.579 -9.186 14.814 254 HA GLU 35 HA GLU 35 69.631 -7.232 14.004 255 HB2 GLU 35 HB2 GLU 35 71.572 -5.659 14.060 256 HB3 GLU 35 HB1 GLU 35 71.334 -6.549 15.561 257 HG2 GLU 35 HG2 GLU 35 73.220 -7.557 13.429 258 HG3 GLU 35 HG1 GLU 35 73.745 -6.381 14.631 259 H ALA 36 HN ALA 36 69.463 -6.126 12.079 260 HA ALA 36 HA ALA 36 70.298 -7.560 9.734 261 HB1 ALA 36 HB1 ALA 36 68.913 -4.883 10.013 262 HB2 ALA 36 HB2 ALA 36 68.128 -6.448 9.807 263 HB3 ALA 36 HB3 ALA 36 69.110 -5.778 8.505 264 H ARG 37 HN ARG 37 71.581 -6.775 8.002 265 HA ARG 37 HA ARG 37 73.508 -4.626 8.702 266 HB2 ARG 37 HB2 ARG 37 74.123 -7.289 7.390 267 HB3 ARG 37 HB1 ARG 37 75.269 -5.962 7.578 268 HG2 ARG 37 HG2 ARG 37 74.986 -6.072 10.035 269 HG3 ARG 37 HG1 ARG 37 73.865 -7.418 9.839 270 HD2 ARG 37 HD2 ARG 37 76.718 -7.458 8.821 271 HD3 ARG 37 HD1 ARG 37 76.239 -8.098 10.389 272 HE ARG 37 HE ARG 37 74.572 -9.375 8.639 273 HH11 ARG 37 HH11 ARG 37 76.611 -10.998 10.034 274 HH12 ARG 37 HH12 ARG 37 77.630 -11.561 8.750 275 HH21 ARG 37 HH21 ARG 37 76.482 -9.237 6.456 276 HH22 ARG 37 HH22 ARG 37 77.546 -10.576 6.725 277 H TRP 38 HN TRP 38 74.051 -3.236 7.117 278 HA TRP 38 HA TRP 38 72.665 -3.461 4.507 279 HB2 TRP 38 HB2 TRP 38 72.615 -1.387 6.218 280 HB3 TRP 38 HB1 TRP 38 74.109 -0.971 5.392 281 HD1 TRP 38 HD1 TRP 38 73.838 0.350 3.208 282 HE1 TRP 38 HE1 TRP 38 71.879 0.873 1.609 283 HE3 TRP 38 HE3 TRP 38 70.215 -2.581 5.280 284 HZ2 TRP 38 HZ2 TRP 38 69.131 0.139 1.266 285 HZ3 TRP 38 HZ3 TRP 38 67.941 -2.655 4.306 286 HH2 TRP 38 HH2 TRP 38 67.393 -1.298 2.304 287 H ALA 39 HN ALA 39 73.949 -3.138 2.531 288 HA ALA 39 HA ALA 39 76.775 -2.732 2.680 289 HB1 ALA 39 HB1 ALA 39 75.822 -5.576 2.302 290 HB2 ALA 39 HB2 ALA 39 76.800 -4.961 3.633 291 HB3 ALA 39 HB3 ALA 39 77.468 -5.022 2.003 292 H LEU 40 HN LEU 40 77.848 -2.862 0.633 293 HA LEU 40 HA LEU 40 76.028 -2.895 -1.715 294 HB2 LEU 40 HB2 LEU 40 76.776 -0.615 -0.980 295 HB3 LEU 40 HB1 LEU 40 78.432 -1.099 -1.303 296 HG LEU 40 HG LEU 40 76.261 -1.283 -3.414 297 HD11 LEU 40 HD11 LEU 40 77.104 0.912 -4.247 298 HD12 LEU 40 HD12 LEU 40 78.097 1.050 -2.798 299 HD13 LEU 40 HD13 LEU 40 76.339 1.042 -2.662 300 HD21 LEU 40 HD21 LEU 40 78.088 -2.449 -4.272 301 HD22 LEU 40 HD22 LEU 40 79.268 -1.501 -3.373 302 HD23 LEU 40 HD23 LEU 40 78.504 -0.827 -4.808 303 H GLY 41 HN GLY 41 76.585 -4.366 -3.221 304 HA2 GLY 41 HA2 GLY 41 77.858 -5.755 -4.549 305 HA3 GLY 41 HA1 GLY 41 79.277 -4.844 -4.039 306 H GLY 42 HN GLY 42 77.248 -6.193 -1.604 307 HA2 GLY 42 HA2 GLY 42 77.438 -8.070 -0.260 308 HA3 GLY 42 HA1 GLY 42 78.655 -8.701 -1.364 309 H VAL 43 HN VAL 43 79.385 -5.540 -0.531 310 HA VAL 43 HA VAL 43 81.313 -6.412 1.550 311 HB VAL 43 HB VAL 43 81.489 -4.110 -0.421 312 HG11 VAL 43 HG11 VAL 43 83.734 -3.756 0.449 313 HG12 VAL 43 HG12 VAL 43 83.566 -5.126 1.545 314 HG13 VAL 43 HG13 VAL 43 82.602 -3.673 1.794 315 HG21 VAL 43 HG21 VAL 43 81.818 -6.364 -1.422 316 HG22 VAL 43 HG22 VAL 43 83.080 -6.687 -0.235 317 HG23 VAL 43 HG23 VAL 43 83.303 -5.411 -1.433 318 HA PRO 44 HA PRO 44 78.765 -3.755 4.150 319 HB2 PRO 44 HB2 PRO 44 80.931 -3.303 6.035 320 HB3 PRO 44 HB1 PRO 44 79.489 -4.305 6.243 321 HG2 PRO 44 HG2 PRO 44 82.182 -5.163 5.808 322 HG3 PRO 44 HG1 PRO 44 80.738 -6.164 6.006 323 HD2 PRO 44 HD2 PRO 44 82.244 -5.724 3.591 324 HD3 PRO 44 HD1 PRO 44 80.771 -6.690 3.790 325 H LEU 45 HN LEU 45 78.484 -1.534 4.336 326 HA LEU 45 HA LEU 45 80.610 0.151 3.145 327 HB2 LEU 45 HB2 LEU 45 78.988 1.533 2.226 328 HB3 LEU 45 HB1 LEU 45 78.224 -0.044 2.104 329 HG LEU 45 HG LEU 45 77.671 2.103 4.188 330 HD11 LEU 45 HD11 LEU 45 76.684 2.361 1.898 331 HD12 LEU 45 HD12 LEU 45 75.469 2.148 3.160 332 HD13 LEU 45 HD13 LEU 45 75.890 0.800 2.109 333 HD21 LEU 45 HD21 LEU 45 77.548 -0.222 5.170 334 HD22 LEU 45 HD22 LEU 45 76.373 -0.633 3.923 335 HD23 LEU 45 HD23 LEU 45 75.990 0.600 5.123 336 H GLN 46 HN GLN 46 80.205 2.568 3.879 337 HA GLN 46 HA GLN 46 79.740 2.743 6.768 338 HB2 GLN 46 HB2 GLN 46 81.898 3.797 7.184 339 HB3 GLN 46 HB1 GLN 46 82.144 2.189 6.506 340 HG2 GLN 46 HG2 GLN 46 82.486 3.172 4.272 341 HG3 GLN 46 HG1 GLN 46 82.237 4.787 4.937 342 HE21 GLN 46 HE21 GLN 46 84.711 3.734 3.680 343 HE22 GLN 46 HE22 GLN 46 85.920 3.872 4.864 344 H ALA 47 HN ALA 47 79.327 4.860 7.477 345 HA ALA 47 HA ALA 47 78.123 6.541 5.508 346 HB1 ALA 47 HB1 ALA 47 78.725 7.222 8.391 347 HB2 ALA 47 HB2 ALA 47 77.338 6.258 7.884 348 HB3 ALA 47 HB3 ALA 47 77.487 7.934 7.356 349 H ASN 48 HN ASN 48 78.808 8.424 4.622 350 HA ASN 48 HA ASN 48 81.058 9.913 5.558 351 HB2 ASN 48 HB2 ASN 48 82.594 9.524 3.712 352 HB3 ASN 48 HB1 ASN 48 82.253 7.997 4.520 353 HD21 ASN 48 HD21 ASN 48 83.120 8.362 1.692 354 HD22 ASN 48 HD22 ASN 48 81.885 7.689 0.740 355 H GLU 49 HN GLU 49 81.760 11.395 3.457 356 HA GLU 49 HA GLU 49 79.483 13.018 3.005 357 HB2 GLU 49 HB2 GLU 49 81.785 13.888 3.115 358 HB3 GLU 49 HB1 GLU 49 82.164 13.061 1.603 359 HG2 GLU 49 HG2 GLU 49 80.468 14.369 0.425 360 HG3 GLU 49 HG1 GLU 49 79.984 15.143 1.932 361 H MET 50 HN MET 50 81.214 10.729 0.906 362 HA MET 50 HA MET 50 79.685 11.299 -1.428 363 HB2 MET 50 HB2 MET 50 81.897 10.186 -1.462 364 HB3 MET 50 HB1 MET 50 81.182 8.782 -0.678 365 HG2 MET 50 HG2 MET 50 79.643 8.494 -2.598 366 HG3 MET 50 HG1 MET 50 80.372 9.898 -3.381 367 HE1 MET 50 HE1 MET 50 80.449 6.140 -2.940 368 HE2 MET 50 HE2 MET 50 81.333 6.630 -1.498 369 HE3 MET 50 HE3 MET 50 82.158 5.725 -2.763 370 H ASN 51 HN ASN 51 79.424 8.877 1.157 371 HA ASN 51 HA ASN 51 76.595 8.458 0.395 372 HB2 ASN 51 HB2 ASN 51 78.584 6.269 1.056 373 HB3 ASN 51 HB1 ASN 51 76.841 6.044 0.921 374 HD21 ASN 51 HD21 ASN 51 78.654 4.677 -0.833 375 HD22 ASN 51 HD22 ASN 51 78.419 5.284 -2.400 376 H ASP 52 HN ASP 52 75.418 9.101 2.068 377 HA ASP 52 HA ASP 52 76.425 8.637 4.821 378 HB2 ASP 52 HB2 ASP 52 74.798 10.429 5.474 379 HB3 ASP 52 HB1 ASP 52 76.116 11.001 4.452 380 H ILE 53 HN ILE 53 75.022 7.751 6.326 381 HA ILE 53 HA ILE 53 72.611 6.433 5.207 382 HB ILE 53 HB ILE 53 74.057 5.492 7.686 383 HG12 ILE 53 HG12 ILE 53 75.790 5.693 5.886 384 HG13 ILE 53 HG11 ILE 53 75.474 4.025 6.345 385 HG21 ILE 53 HG21 ILE 53 73.187 3.295 6.851 386 HG22 ILE 53 HG22 ILE 53 72.396 4.155 5.529 387 HG23 ILE 53 HG23 ILE 53 71.915 4.466 7.197 388 HD11 ILE 53 HD11 ILE 53 74.233 5.407 3.946 389 HD12 ILE 53 HD12 ILE 53 74.055 3.707 4.381 390 HD13 ILE 53 HD13 ILE 53 75.624 4.333 3.881 391 H THR 54 HN THR 54 70.726 7.083 6.033 392 HA THR 54 HA THR 54 70.697 8.417 8.687 393 HB THR 54 HB THR 54 69.178 9.212 6.189 394 HG1 THR 54 HG1 THR 54 70.452 11.132 6.507 395 HG21 THR 54 HG21 THR 54 69.149 10.262 9.022 396 HG22 THR 54 HG22 THR 54 67.788 9.611 8.109 397 HG23 THR 54 HG23 THR 54 68.499 11.157 7.649 398 H VAL 55 HN VAL 55 69.175 7.747 10.075 399 HA VAL 55 HA VAL 55 67.149 5.785 9.140 400 HB VAL 55 HB VAL 55 68.729 4.823 10.744 401 HG11 VAL 55 HG11 VAL 55 67.796 6.941 12.695 402 HG12 VAL 55 HG12 VAL 55 69.298 7.077 11.779 403 HG13 VAL 55 HG13 VAL 55 69.081 5.755 12.926 404 HG21 VAL 55 HG21 VAL 55 66.149 5.423 12.215 405 HG22 VAL 55 HG22 VAL 55 67.132 3.962 12.310 406 HG23 VAL 55 HG23 VAL 55 66.220 4.317 10.844 407 H GLU 56 HN GLU 56 65.029 6.253 9.460 408 HA GLU 56 HA GLU 56 64.387 8.745 10.953 409 HB2 GLU 56 HB2 GLU 56 63.068 7.511 8.531 410 HB3 GLU 56 HB1 GLU 56 62.423 8.888 9.426 411 HG2 GLU 56 HG2 GLU 56 64.459 10.171 8.984 412 HG3 GLU 56 HG1 GLU 56 65.175 8.787 8.160 413 H GLN 57 HN GLN 57 61.858 8.719 11.309 414 HA GLN 57 HA GLN 57 61.064 7.564 13.505 415 HB2 GLN 57 HB2 GLN 57 59.413 7.593 10.980 416 HB3 GLN 57 HB1 GLN 57 58.757 7.323 12.594 417 HG2 GLN 57 HG2 GLN 57 59.623 9.492 13.325 418 HG3 GLN 57 HG1 GLN 57 60.314 9.763 11.725 419 HE21 GLN 57 HE21 GLN 57 59.006 11.375 10.815 420 HE22 GLN 57 HE22 GLN 57 57.313 11.289 10.723 421 H GLY 58 HN GLY 58 60.342 5.672 14.381 422 HA2 GLY 58 HA2 GLY 58 60.270 3.396 14.698 423 HA3 GLY 58 HA1 GLY 58 59.575 3.351 13.080 424 H THR 59 HN THR 59 60.928 2.982 11.282 425 HA THR 59 HA THR 59 63.765 2.505 11.666 426 HB THR 59 HB THR 59 63.529 0.090 10.899 427 HG1 THR 59 HG1 THR 59 60.940 0.901 11.049 428 HG21 THR 59 HG21 THR 59 63.397 -0.731 13.090 429 HG22 THR 59 HG22 THR 59 62.217 0.482 13.577 430 HG23 THR 59 HG23 THR 59 63.905 0.939 13.333 431 H LEU 60 HN LEU 60 62.392 4.230 9.919 432 HA LEU 60 HA LEU 60 62.329 2.956 7.298 433 HB2 LEU 60 HB2 LEU 60 61.639 5.666 8.399 434 HB3 LEU 60 HB1 LEU 60 61.955 5.509 6.669 435 HG LEU 60 HG LEU 60 60.240 3.758 6.497 436 HD11 LEU 60 HD11 LEU 60 60.046 4.194 9.483 437 HD12 LEU 60 HD12 LEU 60 60.362 2.684 8.627 438 HD13 LEU 60 HD13 LEU 60 58.760 3.418 8.557 439 HD21 LEU 60 HD21 LEU 60 58.247 5.148 7.046 440 HD22 LEU 60 HD22 LEU 60 59.500 6.077 6.222 441 HD23 LEU 60 HD23 LEU 60 59.287 6.237 7.965 442 H HIS 61 HN HIS 61 64.177 2.553 6.338 443 HA HIS 61 HA HIS 61 66.582 4.076 6.940 444 HB2 HIS 61 HB2 HIS 61 66.078 1.686 5.157 445 HB3 HIS 61 HB1 HIS 61 67.664 2.398 5.457 446 HD1 HIS 61 HD1 HIS 61 67.649 -0.344 6.405 447 HD2 HIS 61 HD2 HIS 61 66.009 2.670 8.779 448 HE1 HIS 61 HE1 HIS 61 67.647 -1.226 8.779 449 H LEU 62 HN LEU 62 67.846 5.176 5.388 450 HA LEU 62 HA LEU 62 66.667 5.702 2.757 451 HB2 LEU 62 HB2 LEU 62 65.714 7.352 4.448 452 HB3 LEU 62 HB1 LEU 62 67.357 7.963 4.634 453 HG LEU 62 HG LEU 62 67.281 8.134 1.988 454 HD11 LEU 62 HD11 LEU 62 64.981 7.007 1.955 455 HD12 LEU 62 HD12 LEU 62 65.112 8.516 1.058 456 HD13 LEU 62 HD13 LEU 62 64.352 8.499 2.647 457 HD21 LEU 62 HD21 LEU 62 66.154 10.441 2.281 458 HD22 LEU 62 HD22 LEU 62 67.585 10.123 3.260 459 HD23 LEU 62 HD23 LEU 62 65.980 10.003 3.979 460 H LEU 63 HN LEU 63 68.388 5.105 1.541 461 HA LEU 63 HA LEU 63 71.100 5.840 2.320 462 HB2 LEU 63 HB2 LEU 63 69.904 4.346 -0.010 463 HB3 LEU 63 HB1 LEU 63 71.595 4.817 -0.004 464 HG LEU 63 HG LEU 63 70.982 2.443 0.829 465 HD11 LEU 63 HD11 LEU 63 73.207 3.345 1.078 466 HD12 LEU 63 HD12 LEU 63 72.754 2.543 2.580 467 HD13 LEU 63 HD13 LEU 63 72.723 4.300 2.477 468 HD21 LEU 63 HD21 LEU 63 69.126 3.266 2.338 469 HD22 LEU 63 HD22 LEU 63 70.365 3.954 3.388 470 HD23 LEU 63 HD23 LEU 63 70.301 2.214 3.126 471 H THR 64 HN THR 64 71.694 7.901 2.036 472 HA THR 64 HA THR 64 70.553 9.421 -0.228 473 HB THR 64 HB THR 64 71.992 10.300 2.280 474 HG1 THR 64 HG1 THR 64 70.036 10.014 2.977 475 HG21 THR 64 HG21 THR 64 71.089 12.579 1.487 476 HG22 THR 64 HG22 THR 64 70.938 11.821 -0.099 477 HG23 THR 64 HG23 THR 64 72.519 11.949 0.672 478 H LEU 65 HN LEU 65 71.815 8.761 -1.947 479 HA LEU 65 HA LEU 65 74.750 9.018 -1.764 480 HB2 LEU 65 HB2 LEU 65 72.882 7.820 -3.808 481 HB3 LEU 65 HB1 LEU 65 74.563 8.165 -4.204 482 HG LEU 65 HG LEU 65 75.286 6.778 -2.285 483 HD11 LEU 65 HD11 LEU 65 73.476 5.229 -1.338 484 HD12 LEU 65 HD12 LEU 65 72.309 6.382 -1.987 485 HD13 LEU 65 HD13 LEU 65 73.471 6.896 -0.762 486 HD21 LEU 65 HD21 LEU 65 74.403 4.568 -3.280 487 HD22 LEU 65 HD22 LEU 65 75.268 5.652 -4.369 488 HD23 LEU 65 HD23 LEU 65 73.506 5.582 -4.411 489 H HIS 66 HN HIS 66 75.889 10.603 -2.747 490 HA HIS 66 HA HIS 66 74.541 12.964 -3.633 491 HB2 HIS 66 HB2 HIS 66 76.807 12.820 -2.469 492 HB3 HIS 66 HB1 HIS 66 77.466 12.319 -4.024 493 HD1 HIS 66 HD1 HIS 66 74.985 15.063 -3.061 494 HD2 HIS 66 HD2 HIS 66 78.547 14.584 -5.171 495 HE1 HIS 66 HE1 HIS 66 75.578 17.342 -3.987 496 H LYS 67 HN LYS 67 75.702 13.968 -5.783 497 HA LYS 67 HA LYS 67 74.494 12.638 -7.965 498 HB2 LYS 67 HB2 LYS 67 76.582 14.830 -7.882 499 HB3 LYS 67 HB1 LYS 67 75.750 14.302 -9.346 500 HG2 LYS 67 HG2 LYS 67 73.585 14.891 -8.358 501 HG3 LYS 67 HG1 LYS 67 74.387 15.373 -6.861 502 HD2 LYS 67 HD2 LYS 67 75.668 17.087 -8.112 503 HD3 LYS 67 HD1 LYS 67 74.818 16.626 -9.586 504 HE2 LYS 67 HE2 LYS 67 72.694 17.319 -8.657 505 HE3 LYS 67 HE1 LYS 67 73.427 17.601 -7.077 506 HZ1 LYS 67 HZ1 LYS 67 73.294 19.693 -8.086 507 HZ2 LYS 67 HZ2 LYS 67 73.843 19.113 -9.586 508 HZ3 LYS 67 HZ3 LYS 67 74.916 19.234 -8.275 509 H VAL 68 HN VAL 68 75.193 10.619 -8.350 510 HA VAL 68 HA VAL 68 78.083 10.095 -8.598 511 HB VAL 68 HB VAL 68 77.216 7.678 -8.777 512 HG11 VAL 68 HG11 VAL 68 76.815 7.583 -6.308 513 HG12 VAL 68 HG12 VAL 68 76.774 9.346 -6.289 514 HG13 VAL 68 HG13 VAL 68 78.255 8.502 -6.746 515 HG21 VAL 68 HG21 VAL 68 74.979 7.251 -8.061 516 HG22 VAL 68 HG22 VAL 68 74.845 8.511 -9.286 517 HG23 VAL 68 HG23 VAL 68 74.734 8.928 -7.576 518 H THR 69 HN THR 69 79.039 9.664 -10.451 519 HA THR 69 HA THR 69 77.621 10.062 -12.933 520 HB THR 69 HB THR 69 79.786 9.957 -13.967 521 HG1 THR 69 HG1 THR 69 80.511 8.764 -11.516 522 HG21 THR 69 HG21 THR 69 79.359 12.021 -12.763 523 HG22 THR 69 HG22 THR 69 81.056 11.589 -12.556 524 HG23 THR 69 HG23 THR 69 79.907 11.298 -11.251 525 H LEU 70 HN LEU 70 79.427 8.200 -14.364 526 HA LEU 70 HA LEU 70 77.724 6.025 -14.734 527 HB2 LEU 70 HB2 LEU 70 80.723 6.206 -15.153 528 HB3 LEU 70 HB1 LEU 70 79.705 4.915 -15.783 529 HG LEU 70 HG LEU 70 79.285 7.852 -16.419 530 HD11 LEU 70 HD11 LEU 70 80.837 5.695 -17.864 531 HD12 LEU 70 HD12 LEU 70 81.398 7.293 -17.372 532 HD13 LEU 70 HD13 LEU 70 80.235 7.132 -18.688 533 HD21 LEU 70 HD21 LEU 70 77.250 6.756 -16.871 534 HD22 LEU 70 HD22 LEU 70 78.047 5.263 -17.365 535 HD23 LEU 70 HD23 LEU 70 78.071 6.671 -18.426 536 H GLU 71 HN GLU 71 80.457 6.452 -12.521 537 HA GLU 71 HA GLU 71 80.833 3.860 -11.652 538 HB2 GLU 71 HB2 GLU 71 80.914 6.390 -9.980 539 HB3 GLU 71 HB1 GLU 71 81.598 4.837 -9.504 540 HG2 GLU 71 HG2 GLU 71 82.389 6.290 -12.045 541 HG3 GLU 71 HG1 GLU 71 83.265 6.451 -10.525 542 H ASP 72 HN ASP 72 77.934 5.586 -11.509 543 HA ASP 72 HA ASP 72 76.867 4.689 -9.033 544 HB2 ASP 72 HB2 ASP 72 74.660 5.220 -10.018 545 HB3 ASP 72 HB1 ASP 72 75.820 6.525 -10.234 546 H ALA 73 HN ALA 73 76.991 3.258 -12.248 547 HA ALA 73 HA ALA 73 75.168 1.204 -12.051 548 HB1 ALA 73 HB1 ALA 73 77.927 1.287 -13.271 549 HB2 ALA 73 HB2 ALA 73 76.370 1.444 -14.085 550 HB3 ALA 73 HB3 ALA 73 76.870 -0.117 -13.433 551 H GLY 74 HN GLY 74 74.847 -0.097 -10.328 552 HA2 GLY 74 HA2 GLY 74 76.846 -1.934 -9.469 553 HA3 GLY 74 HA1 GLY 74 76.664 -0.641 -8.290 554 H THR 75 HN THR 75 76.129 -3.207 -7.559 555 HA THR 75 HA THR 75 73.160 -3.323 -7.387 556 HB THR 75 HB THR 75 75.060 -5.646 -7.020 557 HG1 THR 75 HG1 THR 75 74.744 -6.123 -9.141 558 HG21 THR 75 HG21 THR 75 72.180 -5.714 -7.896 559 HG22 THR 75 HG22 THR 75 72.588 -5.586 -6.185 560 HG23 THR 75 HG23 THR 75 73.128 -6.980 -7.120 561 H VAL 76 HN VAL 76 72.346 -3.023 -5.376 562 HA VAL 76 HA VAL 76 74.197 -3.270 -3.076 563 HB VAL 76 HB VAL 76 71.477 -1.986 -2.913 564 HG11 VAL 76 HG11 VAL 76 72.906 -2.515 -0.892 565 HG12 VAL 76 HG12 VAL 76 72.453 -0.820 -1.059 566 HG13 VAL 76 HG13 VAL 76 74.075 -1.348 -1.504 567 HG21 VAL 76 HG21 VAL 76 72.855 0.203 -3.306 568 HG22 VAL 76 HG22 VAL 76 72.336 -0.725 -4.710 569 HG23 VAL 76 HG23 VAL 76 73.999 -0.856 -4.133 570 H SER 77 HN SER 77 73.905 -4.838 -1.610 571 HA SER 77 HA SER 77 71.389 -6.420 -1.707 572 HB2 SER 77 HB2 SER 77 72.705 -8.396 -1.151 573 HB3 SER 77 HB1 SER 77 73.321 -7.672 -2.633 574 HG SER 77 HG SER 77 75.141 -7.771 -1.550 575 H PHE 78 HN PHE 78 70.844 -7.500 0.284 576 HA PHE 78 HA PHE 78 71.943 -6.256 2.736 577 HB2 PHE 78 HB2 PHE 78 68.989 -6.726 2.341 578 HB3 PHE 78 HB1 PHE 78 69.795 -5.729 3.552 579 HD1 PHE 78 HD1 PHE 78 67.874 -5.500 0.704 580 HD2 PHE 78 HD2 PHE 78 71.549 -3.952 2.307 581 HE1 PHE 78 HE1 PHE 78 67.721 -3.561 -0.811 582 HE2 PHE 78 HE2 PHE 78 71.377 -1.998 0.790 583 HZ PHE 78 HZ PHE 78 69.455 -1.796 -0.762 584 H HIS 79 HN HIS 79 72.146 -7.669 4.416 585 HA HIS 79 HA HIS 79 71.015 -10.393 4.075 586 HB2 HIS 79 HB2 HIS 79 73.444 -10.311 3.539 587 HB3 HIS 79 HB1 HIS 79 73.752 -9.714 5.169 588 HD1 HIS 79 HD1 HIS 79 71.653 -12.592 3.773 589 HD2 HIS 79 HD2 HIS 79 74.492 -11.852 6.733 590 HE1 HIS 79 HE1 HIS 79 72.001 -14.784 4.998 591 H VAL 80 HN VAL 80 69.866 -11.081 5.710 592 HA VAL 80 HA VAL 80 70.469 -10.272 8.448 593 HB VAL 80 HB VAL 80 68.933 -8.523 7.884 594 HG11 VAL 80 HG11 VAL 80 66.862 -8.837 6.752 595 HG12 VAL 80 HG12 VAL 80 66.963 -10.591 6.896 596 HG13 VAL 80 HG13 VAL 80 68.055 -9.729 5.813 597 HG21 VAL 80 HG21 VAL 80 67.150 -8.942 9.443 598 HG22 VAL 80 HG22 VAL 80 68.549 -9.843 10.027 599 HG23 VAL 80 HG23 VAL 80 67.250 -10.683 9.182 600 H GLY 81 HN GLY 81 70.580 -12.098 9.497 601 HA2 GLY 81 HA2 GLY 81 70.413 -14.577 9.266 602 HA3 GLY 81 HA1 GLY 81 69.374 -13.947 10.528 603 H THR 82 HN THR 82 67.136 -13.267 9.692 604 HA THR 82 HA THR 82 65.699 -15.475 8.933 605 HB THR 82 HB THR 82 63.849 -13.949 8.437 606 HG1 THR 82 HG1 THR 82 64.496 -12.225 7.422 607 HG21 THR 82 HG21 THR 82 63.756 -12.853 10.570 608 HG22 THR 82 HG22 THR 82 65.513 -12.815 10.697 609 HG23 THR 82 HG23 THR 82 64.655 -14.352 10.806 610 H CYS 83 HN CYS 83 65.509 -12.788 6.669 611 HA CYS 83 HA CYS 83 66.172 -14.628 4.426 612 HB2 CYS 83 HB2 CYS 83 63.979 -12.542 4.575 613 HB3 CYS 83 HB1 CYS 83 64.470 -13.369 3.097 614 HG CYS 83 HG CYS 83 63.517 -15.562 3.980 615 H SER 84 HN SER 84 66.071 -12.882 2.355 616 HA SER 84 HA SER 84 67.619 -10.499 2.977 617 HB2 SER 84 HB2 SER 84 69.481 -11.163 1.453 618 HB3 SER 84 HB1 SER 84 69.401 -12.121 2.928 619 HG SER 84 HG SER 84 69.229 -13.782 1.669 620 H SER 85 HN SER 85 68.185 -9.307 0.914 621 HA SER 85 HA SER 85 66.477 -9.902 -1.383 622 HB2 SER 85 HB2 SER 85 64.989 -8.662 0.142 623 HB3 SER 85 HB1 SER 85 66.167 -7.356 0.228 624 HG SER 85 HG SER 85 65.883 -7.658 -2.277 625 H GLU 86 HN GLU 86 66.774 -8.157 -3.102 626 HA GLU 86 HA GLU 86 69.315 -6.712 -2.939 627 HB2 GLU 86 HB2 GLU 86 70.247 -7.787 -4.903 628 HB3 GLU 86 HB1 GLU 86 69.881 -9.018 -3.693 629 HG2 GLU 86 HG2 GLU 86 67.719 -9.466 -4.836 630 HG3 GLU 86 HG1 GLU 86 68.154 -8.302 -6.085 631 H ALA 87 HN ALA 87 69.689 -5.366 -4.873 632 HA ALA 87 HA ALA 87 67.343 -4.796 -6.538 633 HB1 ALA 87 HB1 ALA 87 66.980 -3.360 -4.613 634 HB2 ALA 87 HB2 ALA 87 67.489 -2.366 -5.977 635 HB3 ALA 87 HB3 ALA 87 68.637 -2.766 -4.699 636 H GLN 88 HN GLN 88 67.854 -3.599 -8.438 637 HA GLN 88 HA GLN 88 70.759 -3.448 -9.053 638 HB2 GLN 88 HB2 GLN 88 69.584 -5.263 -10.267 639 HB3 GLN 88 HB1 GLN 88 68.482 -4.068 -10.948 640 HG2 GLN 88 HG2 GLN 88 70.311 -2.937 -12.073 641 HG3 GLN 88 HG1 GLN 88 71.493 -3.980 -11.286 642 HE21 GLN 88 HE21 GLN 88 71.293 -3.809 -14.149 643 HE22 GLN 88 HE22 GLN 88 70.754 -5.310 -14.729 644 H LEU 89 HN LEU 89 71.525 -1.574 -9.681 645 HA LEU 89 HA LEU 89 69.649 0.574 -10.510 646 HB2 LEU 89 HB2 LEU 89 70.721 0.976 -8.306 647 HB3 LEU 89 HB1 LEU 89 72.305 0.848 -9.064 648 HG LEU 89 HG LEU 89 70.416 2.788 -10.351 649 HD11 LEU 89 HD11 LEU 89 71.234 4.528 -8.561 650 HD12 LEU 89 HD12 LEU 89 71.410 3.111 -7.526 651 HD13 LEU 89 HD13 LEU 89 69.834 3.518 -8.205 652 HD21 LEU 89 HD21 LEU 89 72.814 2.457 -11.053 653 HD22 LEU 89 HD22 LEU 89 73.318 3.049 -9.476 654 HD23 LEU 89 HD23 LEU 89 72.455 4.112 -10.582 655 H LYS 90 HN LYS 90 69.887 1.181 -12.554 656 HA LYS 90 HA LYS 90 72.520 0.816 -13.878 657 HB2 LYS 90 HB2 LYS 90 69.738 0.513 -14.999 658 HB3 LYS 90 HB1 LYS 90 71.185 0.613 -16.001 659 HG2 LYS 90 HG2 LYS 90 72.128 -1.341 -14.760 660 HG3 LYS 90 HG1 LYS 90 70.606 -1.479 -13.883 661 HD2 LYS 90 HD2 LYS 90 70.835 -1.592 -16.902 662 HD3 LYS 90 HD1 LYS 90 70.770 -3.015 -15.866 663 HE2 LYS 90 HE2 LYS 90 68.587 -1.995 -14.925 664 HE3 LYS 90 HE1 LYS 90 68.626 -0.944 -16.341 665 HZ1 LYS 90 HZ1 LYS 90 68.349 -2.690 -17.767 666 HZ2 LYS 90 HZ2 LYS 90 67.400 -3.192 -16.451 667 HZ3 LYS 90 HZ3 LYS 90 68.954 -3.839 -16.677 668 H VAL 91 HN VAL 91 72.978 2.367 -15.586 669 HA VAL 91 HA VAL 91 71.775 5.020 -15.012 670 HB VAL 91 HB VAL 91 74.240 4.700 -14.552 671 HG11 VAL 91 HG11 VAL 91 75.775 4.429 -16.344 672 HG12 VAL 91 HG12 VAL 91 74.528 4.689 -17.560 673 HG13 VAL 91 HG13 VAL 91 74.538 3.200 -16.610 674 HG21 VAL 91 HG21 VAL 91 73.305 6.696 -16.629 675 HG22 VAL 91 HG22 VAL 91 74.896 6.775 -15.874 676 HG23 VAL 91 HG23 VAL 91 73.444 6.937 -14.889 677 H THR 92 HN THR 92 70.609 5.948 -16.566 678 HA THR 92 HA THR 92 70.119 4.648 -19.043 679 HB THR 92 HB THR 92 69.483 7.443 -18.087 680 HG1 THR 92 HG1 THR 92 68.419 4.961 -17.797 681 HG21 THR 92 HG21 THR 92 67.792 7.338 -19.991 682 HG22 THR 92 HG22 THR 92 68.715 5.972 -20.614 683 HG23 THR 92 HG23 THR 92 69.472 7.559 -20.480 684 H ALA 93 HN ALA 93 71.097 4.796 -20.978 685 HA ALA 93 HA ALA 93 73.393 6.635 -21.259 686 HB1 ALA 93 HB1 ALA 93 73.715 4.157 -21.631 687 HB2 ALA 93 HB2 ALA 93 74.194 5.176 -22.989 688 HB3 ALA 93 HB3 ALA 93 72.665 4.297 -23.042 689 H GLY 94 HN GLY 94 70.164 6.403 -22.113 690 HA2 GLY 94 HA2 GLY 94 70.117 8.703 -23.710 691 HA3 GLY 94 HA1 GLY 94 70.136 7.311 -24.789 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 53.175 -18.565 16.906 2 H2 MET 1 HT2 MET 1 53.658 -17.424 18.069 3 H3 MET 1 HT3 MET 1 54.802 -18.470 17.374 4 HA MET 1 HA MET 1 54.909 -17.329 15.424 5 HB2 MET 1 HB2 MET 1 52.524 -17.544 14.917 6 HB3 MET 1 HB1 MET 1 52.141 -16.280 16.087 7 HG2 MET 1 HG2 MET 1 53.371 -14.638 14.787 8 HG3 MET 1 HG1 MET 1 53.928 -15.883 13.673 9 HE1 MET 1 HE1 MET 1 50.072 -15.300 15.154 10 HE2 MET 1 HE2 MET 1 49.844 -13.921 14.083 11 HE3 MET 1 HE3 MET 1 51.192 -13.934 15.215 12 H ALA 2 HN ALA 2 56.434 -15.862 15.671 13 HA ALA 2 HA ALA 2 55.934 -13.298 16.901 14 HB1 ALA 2 HB1 ALA 2 57.827 -15.262 18.217 15 HB2 ALA 2 HB2 ALA 2 56.378 -14.550 18.930 16 HB3 ALA 2 HB3 ALA 2 57.776 -13.535 18.576 17 HA PRO 3 HA PRO 3 59.136 -13.556 13.542 18 HB2 PRO 3 HB2 PRO 3 57.824 -11.258 12.319 19 HB3 PRO 3 HB1 PRO 3 58.011 -12.895 11.671 20 HG2 PRO 3 HG2 PRO 3 55.618 -11.761 12.547 21 HG3 PRO 3 HG1 PRO 3 55.913 -13.486 12.290 22 HD2 PRO 3 HD2 PRO 3 55.735 -11.981 14.843 23 HD3 PRO 3 HD1 PRO 3 55.477 -13.709 14.533 24 H GLU 4 HN GLU 4 60.988 -12.290 13.400 25 HA GLU 4 HA GLU 4 61.200 -10.173 15.414 26 HB2 GLU 4 HB2 GLU 4 63.684 -10.370 14.810 27 HB3 GLU 4 HB1 GLU 4 62.928 -11.740 15.617 28 HG2 GLU 4 HG2 GLU 4 62.647 -12.894 13.475 29 HG3 GLU 4 HG1 GLU 4 63.332 -11.512 12.621 30 H VAL 5 HN VAL 5 63.586 -9.773 13.104 31 HA VAL 5 HA VAL 5 62.631 -7.162 12.409 32 HB VAL 5 HB VAL 5 65.072 -7.838 12.610 33 HG11 VAL 5 HG11 VAL 5 64.841 -8.829 9.779 34 HG12 VAL 5 HG12 VAL 5 64.598 -9.944 11.124 35 HG13 VAL 5 HG13 VAL 5 66.130 -9.090 10.952 36 HG21 VAL 5 HG21 VAL 5 65.687 -6.504 10.491 37 HG22 VAL 5 HG22 VAL 5 64.624 -5.724 11.662 38 HG23 VAL 5 HG23 VAL 5 63.950 -6.425 10.191 39 H THR 6 HN THR 6 61.325 -6.601 10.738 40 HA THR 6 HA THR 6 60.685 -8.723 8.752 41 HB THR 6 HB THR 6 58.650 -7.568 8.289 42 HG1 THR 6 HG1 THR 6 59.893 -5.459 8.672 43 HG21 THR 6 HG21 THR 6 57.822 -7.142 10.781 44 HG22 THR 6 HG22 THR 6 59.355 -7.906 11.192 45 HG23 THR 6 HG23 THR 6 58.173 -8.772 10.215 46 H ILE 7 HN ILE 7 61.112 -8.519 6.609 47 HA ILE 7 HA ILE 7 62.517 -6.060 5.758 48 HB ILE 7 HB ILE 7 62.669 -8.856 4.650 49 HG12 ILE 7 HG12 ILE 7 65.064 -8.643 5.398 50 HG13 ILE 7 HG11 ILE 7 64.644 -7.120 6.171 51 HG21 ILE 7 HG21 ILE 7 64.583 -7.776 3.307 52 HG22 ILE 7 HG22 ILE 7 63.853 -6.230 3.740 53 HG23 ILE 7 HG23 ILE 7 62.939 -7.400 2.791 54 HD11 ILE 7 HD11 ILE 7 64.578 -9.536 7.438 55 HD12 ILE 7 HD12 ILE 7 62.905 -9.416 6.911 56 HD13 ILE 7 HD13 ILE 7 63.607 -8.150 7.922 57 H LEU 8 HN LEU 8 61.408 -4.729 4.662 58 HA LEU 8 HA LEU 8 59.521 -5.657 2.581 59 HB2 LEU 8 HB2 LEU 8 58.325 -4.702 4.563 60 HB3 LEU 8 HB1 LEU 8 59.219 -3.201 4.335 61 HG LEU 8 HG LEU 8 58.241 -2.959 2.075 62 HD11 LEU 8 HD11 LEU 8 57.744 -5.089 1.253 63 HD12 LEU 8 HD12 LEU 8 56.145 -4.512 1.703 64 HD13 LEU 8 HD13 LEU 8 57.013 -5.619 2.770 65 HD21 LEU 8 HD21 LEU 8 56.113 -3.443 4.184 66 HD22 LEU 8 HD22 LEU 8 55.998 -2.354 2.802 67 HD23 LEU 8 HD23 LEU 8 57.129 -2.002 4.108 68 H GLU 9 HN GLU 9 60.535 -5.209 0.689 69 HA GLU 9 HA GLU 9 61.900 -2.576 0.426 70 HB2 GLU 9 HB2 GLU 9 62.702 -5.058 -1.070 71 HB3 GLU 9 HB1 GLU 9 63.587 -3.547 -0.877 72 HG2 GLU 9 HG2 GLU 9 62.938 -5.486 1.350 73 HG3 GLU 9 HG1 GLU 9 64.516 -5.271 0.593 74 HA PRO 10 HA PRO 10 58.746 -2.691 -2.913 75 HB2 PRO 10 HB2 PRO 10 58.539 0.201 -2.743 76 HB3 PRO 10 HB1 PRO 10 57.319 -1.010 -2.318 77 HG2 PRO 10 HG2 PRO 10 58.691 0.619 -0.518 78 HG3 PRO 10 HG1 PRO 10 57.782 -0.843 -0.110 79 HD2 PRO 10 HD2 PRO 10 60.731 -0.467 -0.308 80 HD3 PRO 10 HD1 PRO 10 59.801 -1.644 0.645 81 H LEU 11 HN LEU 11 61.839 -1.319 -2.518 82 HA LEU 11 HA LEU 11 61.985 -0.007 -5.093 83 HB2 LEU 11 HB2 LEU 11 64.481 -0.047 -4.656 84 HB3 LEU 11 HB1 LEU 11 63.513 0.832 -3.478 85 HG LEU 11 HG LEU 11 63.842 -2.045 -2.813 86 HD11 LEU 11 HD11 LEU 11 66.041 -1.934 -3.635 87 HD12 LEU 11 HD12 LEU 11 66.227 -1.550 -1.925 88 HD13 LEU 11 HD13 LEU 11 66.252 -0.259 -3.128 89 HD21 LEU 11 HD21 LEU 11 62.881 -0.306 -1.305 90 HD22 LEU 11 HD22 LEU 11 64.455 0.492 -1.255 91 HD23 LEU 11 HD23 LEU 11 64.263 -1.130 -0.586 92 H GLN 12 HN GLN 12 61.279 -1.586 -6.553 93 HA GLN 12 HA GLN 12 62.451 -4.175 -6.797 94 HB2 GLN 12 HB2 GLN 12 60.810 -2.460 -8.671 95 HB3 GLN 12 HB1 GLN 12 61.325 -4.096 -9.078 96 HG2 GLN 12 HG2 GLN 12 59.719 -3.366 -6.610 97 HG3 GLN 12 HG1 GLN 12 59.019 -3.998 -8.100 98 HE21 GLN 12 HE21 GLN 12 59.617 -5.079 -5.153 99 HE22 GLN 12 HE22 GLN 12 60.194 -6.644 -5.465 100 H ASP 13 HN ASP 13 63.192 -1.017 -8.163 101 HA ASP 13 HA ASP 13 65.855 -1.708 -8.820 102 HB2 ASP 13 HB2 ASP 13 65.693 -1.589 -11.296 103 HB3 ASP 13 HB1 ASP 13 64.892 -3.014 -10.638 104 H VAL 14 HN VAL 14 67.052 0.092 -9.300 105 HA VAL 14 HA VAL 14 65.584 2.664 -9.565 106 HB VAL 14 HB VAL 14 68.079 1.916 -8.033 107 HG11 VAL 14 HG11 VAL 14 68.616 4.014 -9.046 108 HG12 VAL 14 HG12 VAL 14 68.097 4.372 -7.400 109 HG13 VAL 14 HG13 VAL 14 66.995 4.646 -8.750 110 HG21 VAL 14 HG21 VAL 14 65.411 3.123 -7.249 111 HG22 VAL 14 HG22 VAL 14 66.774 2.908 -6.151 112 HG23 VAL 14 HG23 VAL 14 65.987 1.500 -6.861 113 H GLN 15 HN GLN 15 66.143 3.951 -11.255 114 HA GLN 15 HA GLN 15 68.687 3.438 -12.694 115 HB2 GLN 15 HB2 GLN 15 65.925 3.703 -13.909 116 HB3 GLN 15 HB1 GLN 15 67.427 3.716 -14.833 117 HG2 GLN 15 HG2 GLN 15 67.979 1.470 -14.055 118 HG3 GLN 15 HG1 GLN 15 66.563 1.456 -13.005 119 HE21 GLN 15 HE21 GLN 15 67.253 -0.300 -15.417 120 HE22 GLN 15 HE22 GLN 15 65.896 -0.168 -16.426 121 H LEU 16 HN LEU 16 69.773 5.328 -12.369 122 HA LEU 16 HA LEU 16 68.307 7.894 -12.732 123 HB2 LEU 16 HB2 LEU 16 70.519 7.069 -10.884 124 HB3 LEU 16 HB1 LEU 16 70.463 8.744 -11.418 125 HG LEU 16 HG LEU 16 69.280 8.262 -9.236 126 HD11 LEU 16 HD11 LEU 16 67.209 9.231 -11.193 127 HD12 LEU 16 HD12 LEU 16 68.687 10.159 -10.969 128 HD13 LEU 16 HD13 LEU 16 67.624 9.857 -9.599 129 HD21 LEU 16 HD21 LEU 16 68.346 6.045 -10.180 130 HD22 LEU 16 HD22 LEU 16 67.095 7.051 -10.909 131 HD23 LEU 16 HD23 LEU 16 67.292 7.022 -9.161 132 H SER 17 HN SER 17 68.977 9.249 -14.308 133 HA SER 17 HA SER 17 70.869 8.351 -16.237 134 HB2 SER 17 HB2 SER 17 68.942 9.845 -16.770 135 HB3 SER 17 HB1 SER 17 69.764 11.143 -15.903 136 HG SER 17 HG SER 17 70.155 10.266 -18.407 137 H GLU 18 HN GLU 18 72.891 9.195 -16.781 138 HA GLU 18 HA GLU 18 74.664 9.650 -14.703 139 HB2 GLU 18 HB2 GLU 18 75.374 8.975 -16.960 140 HB3 GLU 18 HB1 GLU 18 74.954 10.575 -17.577 141 HG2 GLU 18 HG2 GLU 18 76.597 11.593 -16.019 142 HG3 GLU 18 HG1 GLU 18 77.012 9.990 -15.421 143 H GLY 19 HN GLY 19 75.274 11.344 -13.521 144 HA2 GLY 19 HA2 GLY 19 75.708 13.588 -13.000 145 HA3 GLY 19 HA1 GLY 19 74.770 14.086 -14.404 146 H GLN 20 HN GLN 20 73.258 11.733 -12.381 147 HA GLN 20 HA GLN 20 71.631 13.822 -11.024 148 HB2 GLN 20 HB2 GLN 20 70.683 11.238 -12.290 149 HB3 GLN 20 HB1 GLN 20 69.694 12.250 -11.240 150 HG2 GLN 20 HG2 GLN 20 69.987 14.149 -12.789 151 HG3 GLN 20 HG1 GLN 20 70.970 13.134 -13.841 152 HE21 GLN 20 HE21 GLN 20 68.690 11.045 -12.638 153 HE22 GLN 20 HE22 GLN 20 67.512 11.194 -13.852 154 H ASP 21 HN ASP 21 70.709 13.188 -9.010 155 HA ASP 21 HA ASP 21 72.461 11.422 -7.495 156 HB2 ASP 21 HB2 ASP 21 71.351 12.303 -5.542 157 HB3 ASP 21 HB1 ASP 21 71.716 13.651 -6.614 158 H ALA 22 HN ALA 22 71.364 9.961 -5.871 159 HA ALA 22 HA ALA 22 68.931 8.687 -6.975 160 HB1 ALA 22 HB1 ALA 22 71.407 7.214 -6.042 161 HB2 ALA 22 HB2 ALA 22 70.930 7.419 -7.728 162 HB3 ALA 22 HB3 ALA 22 69.913 6.486 -6.630 163 H SER 23 HN SER 23 67.608 7.712 -5.469 164 HA SER 23 HA SER 23 68.349 7.960 -2.614 165 HB2 SER 23 HB2 SER 23 66.969 9.910 -3.217 166 HB3 SER 23 HB1 SER 23 65.727 8.838 -3.857 167 HG SER 23 HG SER 23 66.389 8.053 -1.387 168 H PHE 24 HN PHE 24 67.602 6.343 -1.330 169 HA PHE 24 HA PHE 24 66.025 4.174 -2.624 170 HB2 PHE 24 HB2 PHE 24 68.497 4.153 -0.945 171 HB3 PHE 24 HB1 PHE 24 67.341 2.862 -0.657 172 HD1 PHE 24 HD1 PHE 24 67.821 0.896 -1.787 173 HD2 PHE 24 HD2 PHE 24 68.722 4.647 -3.679 174 HE1 PHE 24 HE1 PHE 24 68.663 -0.314 -3.774 175 HE2 PHE 24 HE2 PHE 24 69.565 3.433 -5.673 176 HZ PHE 24 HZ PHE 24 69.535 0.952 -5.717 177 H GLN 25 HN GLN 25 64.457 3.175 -1.411 178 HA GLN 25 HA GLN 25 63.828 4.306 1.261 179 HB2 GLN 25 HB2 GLN 25 61.899 3.655 -0.987 180 HB3 GLN 25 HB1 GLN 25 61.422 4.117 0.645 181 HG2 GLN 25 HG2 GLN 25 63.059 5.818 -1.262 182 HG3 GLN 25 HG1 GLN 25 61.352 6.049 -0.892 183 HE21 GLN 25 HE21 GLN 25 64.194 7.447 -0.190 184 HE22 GLN 25 HE22 GLN 25 63.934 7.910 1.421 185 H CYS 26 HN CYS 26 64.345 2.618 2.557 186 HA CYS 26 HA CYS 26 63.088 -0.014 1.979 187 HB2 CYS 26 HB2 CYS 26 65.438 -0.376 1.725 188 HB3 CYS 26 HB1 CYS 26 65.812 0.615 3.134 189 HG CYS 26 HG CYS 26 65.214 -1.281 4.665 190 H ARG 27 HN ARG 27 62.040 -0.964 3.679 191 HA ARG 27 HA ARG 27 62.005 0.565 6.239 192 HB2 ARG 27 HB2 ARG 27 59.946 0.924 4.886 193 HB3 ARG 27 HB1 ARG 27 59.650 -0.815 4.934 194 HG2 ARG 27 HG2 ARG 27 59.474 -0.783 7.348 195 HG3 ARG 27 HG1 ARG 27 59.974 0.907 7.405 196 HD2 ARG 27 HD2 ARG 27 57.560 0.807 7.637 197 HD3 ARG 27 HD1 ARG 27 57.950 1.503 6.067 198 HE ARG 27 HE ARG 27 57.616 -1.322 5.863 199 HH11 ARG 27 HH11 ARG 27 55.545 -2.178 5.397 200 HH12 ARG 27 HH12 ARG 27 54.248 -1.091 5.022 201 HH21 ARG 27 HH21 ARG 27 56.078 1.763 5.759 202 HH22 ARG 27 HH22 ARG 27 54.550 1.140 5.233 203 H LEU 28 HN LEU 28 62.748 -0.599 7.860 204 HA LEU 28 HA LEU 28 62.282 -3.530 7.861 205 HB2 LEU 28 HB2 LEU 28 64.674 -2.072 9.003 206 HB3 LEU 28 HB1 LEU 28 64.395 -3.811 9.041 207 HG LEU 28 HG LEU 28 64.738 -2.142 6.532 208 HD11 LEU 28 HD11 LEU 28 66.809 -2.380 7.821 209 HD12 LEU 28 HD12 LEU 28 66.887 -3.385 6.373 210 HD13 LEU 28 HD13 LEU 28 66.548 -4.121 7.940 211 HD21 LEU 28 HD21 LEU 28 64.083 -5.034 7.052 212 HD22 LEU 28 HD22 LEU 28 65.060 -4.623 5.641 213 HD23 LEU 28 HD23 LEU 28 63.440 -3.948 5.817 214 H SER 29 HN SER 29 60.992 -4.141 9.472 215 HA SER 29 HA SER 29 60.326 -2.367 11.630 216 HB2 SER 29 HB2 SER 29 58.906 -4.120 12.433 217 HB3 SER 29 HB1 SER 29 58.776 -4.126 10.680 218 HG SER 29 HG SER 29 60.480 -5.763 10.762 219 H ARG 30 HN ARG 30 60.638 -2.954 13.909 220 HA ARG 30 HA ARG 30 63.306 -3.176 14.596 221 HB2 ARG 30 HB2 ARG 30 62.510 -3.535 16.887 222 HB3 ARG 30 HB1 ARG 30 61.594 -2.269 16.072 223 HG2 ARG 30 HG2 ARG 30 59.791 -3.875 15.574 224 HG3 ARG 30 HG1 ARG 30 60.707 -5.156 16.370 225 HD2 ARG 30 HD2 ARG 30 59.061 -4.268 17.927 226 HD3 ARG 30 HD1 ARG 30 60.678 -3.835 18.473 227 HE ARG 30 HE ARG 30 59.567 -1.777 16.830 228 HH11 ARG 30 HH11 ARG 30 60.472 -0.109 18.524 229 HH12 ARG 30 HH12 ARG 30 59.502 -0.037 19.957 230 HH21 ARG 30 HH21 ARG 30 57.872 -3.028 19.317 231 HH22 ARG 30 HH22 ARG 30 58.044 -1.701 20.418 232 H ALA 31 HN ALA 31 64.596 -4.734 15.455 233 HA ALA 31 HA ALA 31 64.042 -7.470 14.596 234 HB1 ALA 31 HB1 ALA 31 66.196 -6.235 14.065 235 HB2 ALA 31 HB2 ALA 31 66.396 -7.823 14.805 236 HB3 ALA 31 HB3 ALA 31 66.588 -6.364 15.777 237 H SER 32 HN SER 32 65.457 -9.014 16.143 238 HA SER 32 HA SER 32 65.048 -8.579 18.959 239 HB2 SER 32 HB2 SER 32 62.817 -9.184 18.746 240 HB3 SER 32 HB1 SER 32 63.127 -10.205 17.348 241 HG SER 32 HG SER 32 64.477 -11.043 19.546 242 H GLY 33 HN GLY 33 65.483 -10.905 16.337 243 HA2 GLY 33 HA2 GLY 33 67.334 -12.503 17.983 244 HA3 GLY 33 HA1 GLY 33 66.627 -12.986 16.441 245 H GLN 34 HN GLN 34 67.271 -11.614 14.529 246 HA GLN 34 HA GLN 34 70.094 -10.740 14.757 247 HB2 GLN 34 HB2 GLN 34 68.797 -12.340 12.540 248 HB3 GLN 34 HB1 GLN 34 70.425 -11.665 12.473 249 HG2 GLN 34 HG2 GLN 34 69.483 -13.582 14.626 250 HG3 GLN 34 HG1 GLN 34 70.373 -14.078 13.186 251 HE21 GLN 34 HE21 GLN 34 71.157 -13.991 16.202 252 HE22 GLN 34 HE22 GLN 34 72.634 -13.154 16.195 253 H GLU 35 HN GLU 35 70.654 -8.873 13.839 254 HA GLU 35 HA GLU 35 68.553 -7.234 12.617 255 HB2 GLU 35 HB2 GLU 35 71.362 -6.613 13.550 256 HB3 GLU 35 HB1 GLU 35 70.326 -5.438 12.740 257 HG2 GLU 35 HG2 GLU 35 68.608 -5.810 14.523 258 HG3 GLU 35 HG1 GLU 35 69.760 -6.855 15.357 259 H ALA 36 HN ALA 36 68.822 -6.206 10.603 260 HA ALA 36 HA ALA 36 70.212 -7.813 8.621 261 HB1 ALA 36 HB1 ALA 36 68.450 -5.375 8.356 262 HB2 ALA 36 HB2 ALA 36 67.918 -7.049 8.234 263 HB3 ALA 36 HB3 ALA 36 69.008 -6.379 7.019 264 H ARG 37 HN ARG 37 71.390 -6.657 6.827 265 HA ARG 37 HA ARG 37 72.791 -4.208 7.606 266 HB2 ARG 37 HB2 ARG 37 75.007 -5.253 7.262 267 HB3 ARG 37 HB1 ARG 37 74.145 -5.992 8.613 268 HG2 ARG 37 HG2 ARG 37 73.379 -7.819 7.122 269 HG3 ARG 37 HG1 ARG 37 74.277 -7.100 5.787 270 HD2 ARG 37 HD2 ARG 37 75.551 -7.959 8.390 271 HD3 ARG 37 HD1 ARG 37 75.476 -8.977 6.954 272 HE ARG 37 HE ARG 37 76.575 -6.534 6.170 273 HH11 ARG 37 HH11 ARG 37 78.295 -6.022 8.147 274 HH12 ARG 37 HH12 ARG 37 79.561 -7.202 8.118 275 HH21 ARG 37 HH21 ARG 37 77.768 -9.450 6.176 276 HH22 ARG 37 HH22 ARG 37 79.266 -9.146 6.990 277 H TRP 38 HN TRP 38 74.054 -3.318 5.822 278 HA TRP 38 HA TRP 38 72.754 -3.785 3.259 279 HB2 TRP 38 HB2 TRP 38 74.802 -1.802 4.242 280 HB3 TRP 38 HB1 TRP 38 74.293 -1.873 2.555 281 HD1 TRP 38 HD1 TRP 38 73.127 -0.836 6.007 282 HE1 TRP 38 HE1 TRP 38 70.911 0.460 5.797 283 HE3 TRP 38 HE3 TRP 38 72.083 -1.641 1.066 284 HZ2 TRP 38 HZ2 TRP 38 68.954 1.062 3.819 285 HZ3 TRP 38 HZ3 TRP 38 70.031 -0.689 0.052 286 HH2 TRP 38 HH2 TRP 38 68.469 0.661 1.423 287 H ALA 39 HN ALA 39 74.355 -3.611 1.300 288 HA ALA 39 HA ALA 39 76.926 -4.834 1.631 289 HB1 ALA 39 HB1 ALA 39 76.380 -6.923 0.379 290 HB2 ALA 39 HB2 ALA 39 74.670 -6.518 0.524 291 HB3 ALA 39 HB3 ALA 39 75.624 -6.847 1.969 292 H LEU 40 HN LEU 40 77.907 -3.488 0.256 293 HA LEU 40 HA LEU 40 76.798 -3.192 -2.484 294 HB2 LEU 40 HB2 LEU 40 76.989 -1.128 -0.994 295 HB3 LEU 40 HB1 LEU 40 78.735 -1.329 -1.087 296 HG LEU 40 HG LEU 40 77.036 -1.188 -3.591 297 HD11 LEU 40 HD11 LEU 40 78.185 1.094 -1.969 298 HD12 LEU 40 HD12 LEU 40 76.494 0.830 -2.392 299 HD13 LEU 40 HD13 LEU 40 77.662 1.256 -3.645 300 HD21 LEU 40 HD21 LEU 40 79.258 -0.165 -4.428 301 HD22 LEU 40 HD22 LEU 40 79.258 -1.889 -4.102 302 HD23 LEU 40 HD23 LEU 40 79.968 -0.773 -2.936 303 H GLY 41 HN GLY 41 77.887 -4.360 -3.923 304 HA2 GLY 41 HA2 GLY 41 79.635 -5.351 -5.051 305 HA3 GLY 41 HA1 GLY 41 80.714 -4.254 -4.189 306 H GLY 42 HN GLY 42 78.588 -6.215 -2.307 307 HA2 GLY 42 HA2 GLY 42 78.920 -8.260 -1.203 308 HA3 GLY 42 HA1 GLY 42 80.531 -8.359 -1.909 309 H VAL 43 HN VAL 43 80.558 -5.331 -0.894 310 HA VAL 43 HA VAL 43 81.555 -6.006 1.814 311 HB VAL 43 HB VAL 43 82.432 -3.789 -0.048 312 HG11 VAL 43 HG11 VAL 43 84.194 -3.355 1.542 313 HG12 VAL 43 HG12 VAL 43 83.719 -4.733 2.532 314 HG13 VAL 43 HG13 VAL 43 82.675 -3.316 2.434 315 HG21 VAL 43 HG21 VAL 43 84.459 -5.158 -0.296 316 HG22 VAL 43 HG22 VAL 43 83.031 -6.061 -0.805 317 HG23 VAL 43 HG23 VAL 43 83.765 -6.384 0.766 318 HA PRO 44 HA PRO 44 78.236 -3.375 3.289 319 HB2 PRO 44 HB2 PRO 44 79.728 -2.547 5.647 320 HB3 PRO 44 HB1 PRO 44 78.369 -3.677 5.544 321 HG2 PRO 44 HG2 PRO 44 81.134 -4.282 5.962 322 HG3 PRO 44 HG1 PRO 44 79.774 -5.405 5.852 323 HD2 PRO 44 HD2 PRO 44 81.865 -5.010 3.921 324 HD3 PRO 44 HD1 PRO 44 80.464 -6.091 3.803 325 H LEU 45 HN LEU 45 77.709 -1.255 3.136 326 HA LEU 45 HA LEU 45 79.774 0.570 2.172 327 HB2 LEU 45 HB2 LEU 45 77.567 2.062 1.973 328 HB3 LEU 45 HB1 LEU 45 77.930 0.811 0.787 329 HG LEU 45 HG LEU 45 76.497 -0.785 2.013 330 HD11 LEU 45 HD11 LEU 45 76.323 1.521 3.936 331 HD12 LEU 45 HD12 LEU 45 76.521 -0.197 4.268 332 HD13 LEU 45 HD13 LEU 45 74.947 0.431 3.784 333 HD21 LEU 45 HD21 LEU 45 75.341 1.858 1.132 334 HD22 LEU 45 HD22 LEU 45 74.294 0.556 1.695 335 HD23 LEU 45 HD23 LEU 45 75.333 0.304 0.293 336 H GLN 46 HN GLN 46 79.880 2.763 3.021 337 HA GLN 46 HA GLN 46 78.992 3.080 5.818 338 HB2 GLN 46 HB2 GLN 46 81.839 3.314 4.827 339 HB3 GLN 46 HB1 GLN 46 81.282 4.004 6.350 340 HG2 GLN 46 HG2 GLN 46 80.634 1.827 7.173 341 HG3 GLN 46 HG1 GLN 46 80.993 1.082 5.613 342 HE21 GLN 46 HE21 GLN 46 82.425 -0.130 7.470 343 HE22 GLN 46 HE22 GLN 46 84.019 0.447 7.570 344 H ALA 47 HN ALA 47 79.204 5.303 6.575 345 HA ALA 47 HA ALA 47 78.132 7.129 4.707 346 HB1 ALA 47 HB1 ALA 47 78.417 8.789 6.542 347 HB2 ALA 47 HB2 ALA 47 79.331 7.584 7.449 348 HB3 ALA 47 HB3 ALA 47 77.629 7.305 7.075 349 H ASN 48 HN ASN 48 79.847 6.928 3.003 350 HA ASN 48 HA ASN 48 82.456 8.034 3.452 351 HB2 ASN 48 HB2 ASN 48 81.752 6.443 1.563 352 HB3 ASN 48 HB1 ASN 48 81.064 7.862 0.779 353 HD21 ASN 48 HD21 ASN 48 82.824 7.300 -0.913 354 HD22 ASN 48 HD22 ASN 48 84.371 7.953 -0.662 355 H GLU 49 HN GLU 49 82.988 9.871 1.616 356 HA GLU 49 HA GLU 49 81.935 12.264 2.687 357 HB2 GLU 49 HB2 GLU 49 84.150 12.083 1.566 358 HB3 GLU 49 HB1 GLU 49 83.322 11.867 0.024 359 HG2 GLU 49 HG2 GLU 49 82.245 14.072 0.284 360 HG3 GLU 49 HG1 GLU 49 83.056 14.284 1.835 361 H MET 50 HN MET 50 81.249 10.517 -0.331 362 HA MET 50 HA MET 50 79.118 12.404 -1.012 363 HB2 MET 50 HB2 MET 50 78.864 10.871 -3.022 364 HB3 MET 50 HB1 MET 50 80.400 11.722 -2.890 365 HG2 MET 50 HG2 MET 50 81.430 9.702 -1.898 366 HG3 MET 50 HG1 MET 50 79.887 8.857 -2.035 367 HE1 MET 50 HE1 MET 50 82.325 7.626 -3.058 368 HE2 MET 50 HE2 MET 50 82.044 7.166 -4.736 369 HE3 MET 50 HE3 MET 50 80.787 6.893 -3.533 370 H ASN 51 HN ASN 51 79.466 9.424 0.654 371 HA ASN 51 HA ASN 51 76.599 8.773 0.284 372 HB2 ASN 51 HB2 ASN 51 78.231 6.980 -0.193 373 HB3 ASN 51 HB1 ASN 51 78.804 7.078 1.472 374 HD21 ASN 51 HD21 ASN 51 78.016 5.002 2.175 375 HD22 ASN 51 HD22 ASN 51 76.363 4.620 2.217 376 H ASP 52 HN ASP 52 75.204 8.654 1.962 377 HA ASP 52 HA ASP 52 76.136 9.062 4.708 378 HB2 ASP 52 HB2 ASP 52 75.774 11.340 3.709 379 HB3 ASP 52 HB1 ASP 52 74.086 10.902 3.450 380 H ILE 53 HN ILE 53 74.650 8.303 6.245 381 HA ILE 53 HA ILE 53 72.219 6.994 5.158 382 HB ILE 53 HB ILE 53 74.158 5.937 7.222 383 HG12 ILE 53 HG12 ILE 53 73.300 4.846 4.524 384 HG13 ILE 53 HG11 ILE 53 74.785 5.757 4.795 385 HG21 ILE 53 HG21 ILE 53 71.403 5.048 6.349 386 HG22 ILE 53 HG22 ILE 53 72.002 5.308 7.986 387 HG23 ILE 53 HG23 ILE 53 72.556 3.918 7.057 388 HD11 ILE 53 HD11 ILE 53 74.038 3.124 6.090 389 HD12 ILE 53 HD12 ILE 53 75.480 4.060 6.481 390 HD13 ILE 53 HD13 ILE 53 75.281 3.376 4.868 391 H THR 54 HN THR 54 70.384 7.471 6.161 392 HA THR 54 HA THR 54 70.511 8.572 8.908 393 HB THR 54 HB THR 54 69.332 10.482 8.371 394 HG1 THR 54 HG1 THR 54 68.292 8.831 6.384 395 HG21 THR 54 HG21 THR 54 71.541 10.384 7.130 396 HG22 THR 54 HG22 THR 54 70.356 11.499 6.447 397 HG23 THR 54 HG23 THR 54 70.625 9.926 5.694 398 H VAL 55 HN VAL 55 68.516 8.460 10.071 399 HA VAL 55 HA VAL 55 66.701 6.301 9.130 400 HB VAL 55 HB VAL 55 67.728 6.987 11.891 401 HG11 VAL 55 HG11 VAL 55 65.389 5.282 11.029 402 HG12 VAL 55 HG12 VAL 55 65.439 6.524 12.279 403 HG13 VAL 55 HG13 VAL 55 66.242 4.976 12.543 404 HG21 VAL 55 HG21 VAL 55 67.828 4.471 10.196 405 HG22 VAL 55 HG22 VAL 55 68.482 4.628 11.825 406 HG23 VAL 55 HG23 VAL 55 69.178 5.563 10.502 407 H GLU 56 HN GLU 56 64.574 6.783 9.018 408 HA GLU 56 HA GLU 56 63.670 9.393 10.108 409 HB2 GLU 56 HB2 GLU 56 62.555 7.720 7.843 410 HB3 GLU 56 HB1 GLU 56 61.827 9.205 8.452 411 HG2 GLU 56 HG2 GLU 56 63.902 10.436 7.906 412 HG3 GLU 56 HG1 GLU 56 64.601 8.947 7.264 413 H GLN 57 HN GLN 57 61.164 9.298 10.435 414 HA GLN 57 HA GLN 57 60.407 8.260 12.725 415 HB2 GLN 57 HB2 GLN 57 58.909 9.494 11.135 416 HB3 GLN 57 HB1 GLN 57 58.609 7.958 10.320 417 HG2 GLN 57 HG2 GLN 57 57.702 6.998 12.369 418 HG3 GLN 57 HG1 GLN 57 58.087 8.470 13.262 419 HE21 GLN 57 HE21 GLN 57 55.967 9.270 13.706 420 HE22 GLN 57 HE22 GLN 57 54.835 9.624 12.492 421 H GLY 58 HN GLY 58 59.544 6.403 13.640 422 HA2 GLY 58 HA2 GLY 58 59.355 4.149 14.039 423 HA3 GLY 58 HA1 GLY 58 59.041 3.973 12.314 424 H THR 59 HN THR 59 60.637 3.301 10.966 425 HA THR 59 HA THR 59 63.395 3.258 11.761 426 HB THR 59 HB THR 59 62.072 0.568 11.461 427 HG1 THR 59 HG1 THR 59 61.294 1.087 13.357 428 HG21 THR 59 HG21 THR 59 64.693 1.293 12.776 429 HG22 THR 59 HG22 THR 59 64.590 0.966 11.052 430 HG23 THR 59 HG23 THR 59 64.160 -0.288 12.210 431 H LEU 60 HN LEU 60 62.247 4.415 9.604 432 HA LEU 60 HA LEU 60 62.541 2.582 7.337 433 HB2 LEU 60 HB2 LEU 60 60.668 4.251 7.529 434 HB3 LEU 60 HB1 LEU 60 61.860 5.530 7.322 435 HG LEU 60 HG LEU 60 61.883 3.319 5.280 436 HD11 LEU 60 HD11 LEU 60 59.474 3.797 5.565 437 HD12 LEU 60 HD12 LEU 60 60.069 4.369 4.005 438 HD13 LEU 60 HD13 LEU 60 59.793 5.513 5.317 439 HD21 LEU 60 HD21 LEU 60 62.130 6.345 5.132 440 HD22 LEU 60 HD22 LEU 60 62.355 5.239 3.779 441 HD23 LEU 60 HD23 LEU 60 63.476 5.208 5.133 442 H HIS 61 HN HIS 61 64.462 2.264 6.520 443 HA HIS 61 HA HIS 61 66.707 4.003 7.006 444 HB2 HIS 61 HB2 HIS 61 66.280 1.442 5.467 445 HB3 HIS 61 HB1 HIS 61 67.833 2.280 5.472 446 HD1 HIS 61 HD1 HIS 61 69.360 1.427 7.273 447 HD2 HIS 61 HD2 HIS 61 65.351 1.123 8.374 448 HE1 HIS 61 HE1 HIS 61 69.329 0.436 9.605 449 H LEU 62 HN LEU 62 67.834 5.226 5.468 450 HA LEU 62 HA LEU 62 66.686 5.452 2.764 451 HB2 LEU 62 HB2 LEU 62 65.599 7.145 4.318 452 HB3 LEU 62 HB1 LEU 62 67.182 7.890 4.496 453 HG LEU 62 HG LEU 62 65.869 7.409 1.801 454 HD11 LEU 62 HD11 LEU 62 65.156 9.720 1.823 455 HD12 LEU 62 HD12 LEU 62 65.905 9.980 3.398 456 HD13 LEU 62 HD13 LEU 62 64.501 8.921 3.252 457 HD21 LEU 62 HD21 LEU 62 68.358 8.803 2.751 458 HD22 LEU 62 HD22 LEU 62 67.502 9.481 1.367 459 HD23 LEU 62 HD23 LEU 62 68.099 7.829 1.305 460 H LEU 63 HN LEU 63 68.367 5.114 1.446 461 HA LEU 63 HA LEU 63 71.067 5.846 2.309 462 HB2 LEU 63 HB2 LEU 63 70.081 3.673 0.922 463 HB3 LEU 63 HB1 LEU 63 70.694 4.664 -0.391 464 HG LEU 63 HG LEU 63 72.513 3.295 0.199 465 HD11 LEU 63 HD11 LEU 63 72.856 5.944 0.350 466 HD12 LEU 63 HD12 LEU 63 74.165 4.808 0.656 467 HD13 LEU 63 HD13 LEU 63 73.309 5.537 2.010 468 HD21 LEU 63 HD21 LEU 63 71.598 3.743 3.035 469 HD22 LEU 63 HD22 LEU 63 73.240 3.193 2.701 470 HD23 LEU 63 HD23 LEU 63 71.858 2.230 2.176 471 H THR 64 HN THR 64 71.487 7.940 2.041 472 HA THR 64 HA THR 64 70.393 9.387 -0.258 473 HB THR 64 HB THR 64 72.055 10.349 2.084 474 HG1 THR 64 HG1 THR 64 70.044 9.577 2.719 475 HG21 THR 64 HG21 THR 64 70.636 11.734 -0.187 476 HG22 THR 64 HG22 THR 64 72.286 11.973 0.390 477 HG23 THR 64 HG23 THR 64 70.924 12.554 1.345 478 H LEU 65 HN LEU 65 71.497 9.093 -2.081 479 HA LEU 65 HA LEU 65 74.464 9.064 -2.015 480 HB2 LEU 65 HB2 LEU 65 72.497 8.261 -4.176 481 HB3 LEU 65 HB1 LEU 65 74.246 8.217 -4.351 482 HG LEU 65 HG LEU 65 72.747 6.719 -2.179 483 HD11 LEU 65 HD11 LEU 65 73.615 5.849 -4.944 484 HD12 LEU 65 HD12 LEU 65 72.007 5.750 -4.228 485 HD13 LEU 65 HD13 LEU 65 73.297 4.698 -3.646 486 HD21 LEU 65 HD21 LEU 65 74.967 6.853 -1.455 487 HD22 LEU 65 HD22 LEU 65 75.619 6.860 -3.093 488 HD23 LEU 65 HD23 LEU 65 75.014 5.361 -2.389 489 H HIS 66 HN HIS 66 75.534 10.856 -2.583 490 HA HIS 66 HA HIS 66 74.203 13.211 -3.561 491 HB2 HIS 66 HB2 HIS 66 76.261 13.143 -2.035 492 HB3 HIS 66 HB1 HIS 66 77.197 12.744 -3.473 493 HD1 HIS 66 HD1 HIS 66 74.318 15.225 -3.333 494 HD2 HIS 66 HD2 HIS 66 78.456 15.234 -3.873 495 HE1 HIS 66 HE1 HIS 66 74.957 17.594 -3.967 496 H LYS 67 HN LYS 67 74.713 14.308 -5.573 497 HA LYS 67 HA LYS 67 74.175 13.187 -7.889 498 HB2 LYS 67 HB2 LYS 67 75.839 14.781 -9.005 499 HB3 LYS 67 HB1 LYS 67 74.647 15.492 -7.917 500 HG2 LYS 67 HG2 LYS 67 76.240 15.668 -6.138 501 HG3 LYS 67 HG1 LYS 67 77.422 14.701 -7.004 502 HD2 LYS 67 HD2 LYS 67 78.128 16.960 -7.275 503 HD3 LYS 67 HD1 LYS 67 77.393 16.509 -8.810 504 HE2 LYS 67 HE2 LYS 67 75.372 17.693 -8.293 505 HE3 LYS 67 HE1 LYS 67 75.850 17.904 -6.609 506 HZ1 LYS 67 HZ1 LYS 67 76.365 19.604 -8.746 507 HZ2 LYS 67 HZ2 LYS 67 77.860 18.939 -8.287 508 HZ3 LYS 67 HZ3 LYS 67 76.903 19.757 -7.146 509 H VAL 68 HN VAL 68 74.730 11.016 -8.020 510 HA VAL 68 HA VAL 68 77.506 10.189 -8.155 511 HB VAL 68 HB VAL 68 76.522 7.957 -8.691 512 HG11 VAL 68 HG11 VAL 68 76.845 8.959 -6.320 513 HG12 VAL 68 HG12 VAL 68 75.806 7.546 -6.486 514 HG13 VAL 68 HG13 VAL 68 75.092 9.149 -6.321 515 HG21 VAL 68 HG21 VAL 68 74.147 7.637 -8.718 516 HG22 VAL 68 HG22 VAL 68 74.456 8.984 -9.811 517 HG23 VAL 68 HG23 VAL 68 73.848 9.289 -8.185 518 H THR 69 HN THR 69 78.217 8.827 -9.999 519 HA THR 69 HA THR 69 77.235 9.805 -12.616 520 HB THR 69 HB THR 69 79.275 11.055 -12.062 521 HG1 THR 69 HG1 THR 69 79.223 10.612 -14.180 522 HG21 THR 69 HG21 THR 69 80.132 9.266 -10.477 523 HG22 THR 69 HG22 THR 69 81.347 9.967 -11.547 524 HG23 THR 69 HG23 THR 69 80.670 8.382 -11.903 525 H LEU 70 HN LEU 70 79.438 8.261 -13.894 526 HA LEU 70 HA LEU 70 78.100 5.889 -14.407 527 HB2 LEU 70 HB2 LEU 70 80.965 6.730 -14.684 528 HB3 LEU 70 HB1 LEU 70 80.559 5.042 -14.957 529 HG LEU 70 HG LEU 70 80.579 6.553 -17.014 530 HD11 LEU 70 HD11 LEU 70 77.860 5.301 -16.606 531 HD12 LEU 70 HD12 LEU 70 79.313 4.313 -16.760 532 HD13 LEU 70 HD13 LEU 70 78.828 5.384 -18.072 533 HD21 LEU 70 HD21 LEU 70 79.355 8.414 -15.729 534 HD22 LEU 70 HD22 LEU 70 77.886 7.488 -16.030 535 HD23 LEU 70 HD23 LEU 70 78.838 8.089 -17.381 536 H GLU 71 HN GLU 71 80.409 6.631 -11.871 537 HA GLU 71 HA GLU 71 80.869 4.034 -10.903 538 HB2 GLU 71 HB2 GLU 71 80.838 6.698 -9.465 539 HB3 GLU 71 HB1 GLU 71 81.440 5.197 -8.765 540 HG2 GLU 71 HG2 GLU 71 83.093 5.016 -10.602 541 HG3 GLU 71 HG1 GLU 71 82.501 6.542 -11.262 542 H ASP 72 HN ASP 72 77.990 5.574 -11.185 543 HA ASP 72 HA ASP 72 76.717 5.172 -8.705 544 HB2 ASP 72 HB2 ASP 72 75.745 6.596 -10.423 545 HB3 ASP 72 HB1 ASP 72 75.578 5.218 -11.510 546 H ALA 73 HN ALA 73 77.194 3.068 -11.488 547 HA ALA 73 HA ALA 73 75.409 1.041 -10.841 548 HB1 ALA 73 HB1 ALA 73 78.120 0.812 -12.154 549 HB2 ALA 73 HB2 ALA 73 76.586 1.127 -12.966 550 HB3 ALA 73 HB3 ALA 73 76.864 -0.426 -12.180 551 H GLY 74 HN GLY 74 75.454 -0.737 -9.593 552 HA2 GLY 74 HA2 GLY 74 77.619 -1.904 -8.303 553 HA3 GLY 74 HA1 GLY 74 76.983 -0.676 -7.209 554 H THR 75 HN THR 75 76.968 -3.571 -6.829 555 HA THR 75 HA THR 75 74.119 -4.277 -7.085 556 HB THR 75 HB THR 75 74.981 -6.516 -6.215 557 HG1 THR 75 HG1 THR 75 77.179 -5.019 -5.974 558 HG21 THR 75 HG21 THR 75 74.501 -6.017 -8.604 559 HG22 THR 75 HG22 THR 75 75.848 -7.143 -8.416 560 HG23 THR 75 HG23 THR 75 76.159 -5.447 -8.794 561 H VAL 76 HN VAL 76 72.870 -3.595 -5.496 562 HA VAL 76 HA VAL 76 73.897 -3.582 -2.719 563 HB VAL 76 HB VAL 76 71.482 -2.154 -3.849 564 HG11 VAL 76 HG11 VAL 76 71.424 -2.613 -1.409 565 HG12 VAL 76 HG12 VAL 76 71.588 -0.891 -1.751 566 HG13 VAL 76 HG13 VAL 76 72.994 -1.824 -1.244 567 HG21 VAL 76 HG21 VAL 76 73.562 -1.294 -4.847 568 HG22 VAL 76 HG22 VAL 76 74.276 -1.143 -3.242 569 HG23 VAL 76 HG23 VAL 76 72.908 -0.129 -3.695 570 H SER 77 HN SER 77 73.126 -5.007 -1.326 571 HA SER 77 HA SER 77 70.484 -6.251 -1.724 572 HB2 SER 77 HB2 SER 77 71.938 -7.826 -2.803 573 HB3 SER 77 HB1 SER 77 73.128 -7.704 -1.514 574 HG SER 77 HG SER 77 70.543 -8.436 -0.785 575 H PHE 78 HN PHE 78 70.100 -7.797 0.231 576 HA PHE 78 HA PHE 78 71.184 -6.566 2.710 577 HB2 PHE 78 HB2 PHE 78 68.329 -7.488 2.263 578 HB3 PHE 78 HB1 PHE 78 68.983 -6.724 3.714 579 HD1 PHE 78 HD1 PHE 78 69.404 -4.356 3.813 580 HD2 PHE 78 HD2 PHE 78 68.106 -6.187 0.156 581 HE1 PHE 78 HE1 PHE 78 68.961 -2.116 2.852 582 HE2 PHE 78 HE2 PHE 78 67.655 -3.947 -0.811 583 HZ PHE 78 HZ PHE 78 68.082 -1.908 0.536 584 H HIS 79 HN HIS 79 71.592 -7.981 4.402 585 HA HIS 79 HA HIS 79 71.104 -10.867 3.921 586 HB2 HIS 79 HB2 HIS 79 73.682 -9.535 4.771 587 HB3 HIS 79 HB1 HIS 79 73.389 -11.268 4.913 588 HD1 HIS 79 HD1 HIS 79 73.274 -12.650 2.707 589 HD2 HIS 79 HD2 HIS 79 73.992 -8.587 2.099 590 HE1 HIS 79 HE1 HIS 79 73.901 -12.389 0.264 591 H VAL 80 HN VAL 80 69.848 -11.585 5.475 592 HA VAL 80 HA VAL 80 70.415 -10.892 8.279 593 HB VAL 80 HB VAL 80 68.695 -9.330 7.577 594 HG11 VAL 80 HG11 VAL 80 66.668 -9.953 6.525 595 HG12 VAL 80 HG12 VAL 80 66.959 -11.668 6.800 596 HG13 VAL 80 HG13 VAL 80 67.945 -10.775 5.642 597 HG21 VAL 80 HG21 VAL 80 66.741 -10.154 9.015 598 HG22 VAL 80 HG22 VAL 80 68.307 -10.012 9.808 599 HG23 VAL 80 HG23 VAL 80 67.706 -11.593 9.322 600 H GLY 81 HN GLY 81 70.538 -12.665 9.448 601 HA2 GLY 81 HA2 GLY 81 70.531 -15.237 8.654 602 HA3 GLY 81 HA1 GLY 81 70.081 -14.772 10.289 603 H THR 82 HN THR 82 67.667 -13.338 9.029 604 HA THR 82 HA THR 82 65.845 -15.569 9.294 605 HB THR 82 HB THR 82 64.101 -13.844 9.025 606 HG1 THR 82 HG1 THR 82 64.587 -11.921 8.282 607 HG21 THR 82 HG21 THR 82 65.069 -14.173 11.249 608 HG22 THR 82 HG22 THR 82 64.737 -12.460 10.996 609 HG23 THR 82 HG23 THR 82 66.388 -13.065 10.865 610 H CYS 83 HN CYS 83 65.785 -13.010 6.846 611 HA CYS 83 HA CYS 83 65.340 -15.056 4.731 612 HB2 CYS 83 HB2 CYS 83 64.179 -12.259 4.870 613 HB3 CYS 83 HB1 CYS 83 63.875 -13.458 3.612 614 HG CYS 83 HG CYS 83 62.281 -14.650 5.106 615 H SER 84 HN SER 84 65.638 -13.848 2.485 616 HA SER 84 HA SER 84 68.094 -12.188 2.553 617 HB2 SER 84 HB2 SER 84 67.587 -14.602 0.794 618 HB3 SER 84 HB1 SER 84 68.897 -13.451 0.549 619 HG SER 84 HG SER 84 69.325 -15.429 1.852 620 H SER 85 HN SER 85 68.331 -10.770 0.757 621 HA SER 85 HA SER 85 66.204 -10.643 -1.228 622 HB2 SER 85 HB2 SER 85 65.064 -9.379 0.412 623 HB3 SER 85 HB1 SER 85 66.532 -8.555 0.928 624 HG SER 85 HG SER 85 66.110 -7.116 -0.535 625 H GLU 86 HN GLU 86 66.620 -8.896 -2.824 626 HA GLU 86 HA GLU 86 69.390 -7.939 -2.921 627 HB2 GLU 86 HB2 GLU 86 69.851 -8.991 -5.042 628 HB3 GLU 86 HB1 GLU 86 69.344 -10.239 -3.903 629 HG2 GLU 86 HG2 GLU 86 67.001 -10.000 -4.802 630 HG3 GLU 86 HG1 GLU 86 67.650 -8.946 -6.056 631 H ALA 87 HN ALA 87 69.771 -6.478 -4.711 632 HA ALA 87 HA ALA 87 67.489 -5.353 -6.112 633 HB1 ALA 87 HB1 ALA 87 67.592 -3.175 -5.152 634 HB2 ALA 87 HB2 ALA 87 69.068 -3.556 -4.266 635 HB3 ALA 87 HB3 ALA 87 67.538 -4.292 -3.786 636 H GLN 88 HN GLN 88 68.129 -3.827 -7.733 637 HA GLN 88 HA GLN 88 71.019 -3.924 -8.423 638 HB2 GLN 88 HB2 GLN 88 68.561 -4.187 -10.156 639 HB3 GLN 88 HB1 GLN 88 70.176 -3.894 -10.808 640 HG2 GLN 88 HG2 GLN 88 71.006 -5.934 -9.750 641 HG3 GLN 88 HG1 GLN 88 69.435 -6.215 -9.001 642 HE21 GLN 88 HE21 GLN 88 71.309 -7.064 -11.652 643 HE22 GLN 88 HE22 GLN 88 70.073 -7.566 -12.700 644 H LEU 89 HN LEU 89 71.985 -2.016 -8.705 645 HA LEU 89 HA LEU 89 70.324 0.412 -9.179 646 HB2 LEU 89 HB2 LEU 89 71.571 0.028 -6.882 647 HB3 LEU 89 HB1 LEU 89 73.007 0.475 -7.796 648 HG LEU 89 HG LEU 89 70.491 2.145 -7.516 649 HD11 LEU 89 HD11 LEU 89 73.220 2.237 -6.227 650 HD12 LEU 89 HD12 LEU 89 71.636 2.331 -5.464 651 HD13 LEU 89 HD13 LEU 89 72.249 3.701 -6.384 652 HD21 LEU 89 HD21 LEU 89 72.056 3.889 -8.590 653 HD22 LEU 89 HD22 LEU 89 71.383 2.656 -9.647 654 HD23 LEU 89 HD23 LEU 89 73.049 2.517 -9.081 655 H LYS 90 HN LYS 90 70.724 1.197 -11.232 656 HA LYS 90 HA LYS 90 73.507 1.278 -12.185 657 HB2 LYS 90 HB2 LYS 90 72.963 0.322 -14.351 658 HB3 LYS 90 HB1 LYS 90 72.582 -0.826 -13.072 659 HG2 LYS 90 HG2 LYS 90 70.207 -0.147 -13.176 660 HG3 LYS 90 HG1 LYS 90 70.592 0.973 -14.486 661 HD2 LYS 90 HD2 LYS 90 71.400 -0.889 -15.865 662 HD3 LYS 90 HD1 LYS 90 71.058 -2.024 -14.560 663 HE2 LYS 90 HE2 LYS 90 69.148 -2.201 -15.914 664 HE3 LYS 90 HE1 LYS 90 68.639 -1.047 -14.681 665 HZ1 LYS 90 HZ1 LYS 90 69.923 -0.137 -17.173 666 HZ2 LYS 90 HZ2 LYS 90 68.925 0.734 -16.109 667 HZ3 LYS 90 HZ3 LYS 90 68.258 -0.452 -17.127 668 H VAL 91 HN VAL 91 73.733 2.574 -14.217 669 HA VAL 91 HA VAL 91 71.912 4.901 -14.080 670 HB VAL 91 HB VAL 91 74.121 5.629 -13.657 671 HG11 VAL 91 HG11 VAL 91 75.266 3.560 -14.338 672 HG12 VAL 91 HG12 VAL 91 76.043 4.977 -15.042 673 HG13 VAL 91 HG13 VAL 91 74.992 3.966 -16.032 674 HG21 VAL 91 HG21 VAL 91 73.945 6.009 -16.655 675 HG22 VAL 91 HG22 VAL 91 74.594 7.119 -15.451 676 HG23 VAL 91 HG23 VAL 91 72.858 6.847 -15.552 677 H THR 92 HN THR 92 70.709 5.485 -15.752 678 HA THR 92 HA THR 92 70.869 3.840 -18.194 679 HB THR 92 HB THR 92 68.733 3.883 -16.914 680 HG1 THR 92 HG1 THR 92 67.682 3.797 -18.744 681 HG21 THR 92 HG21 THR 92 67.440 5.839 -16.709 682 HG22 THR 92 HG22 THR 92 68.403 6.707 -17.903 683 HG23 THR 92 HG23 THR 92 69.069 6.375 -16.304 684 H ALA 93 HN ALA 93 71.080 4.744 -20.224 685 HA ALA 93 HA ALA 93 72.108 7.477 -20.307 686 HB1 ALA 93 HB1 ALA 93 73.422 5.957 -21.544 687 HB2 ALA 93 HB2 ALA 93 72.497 6.834 -22.764 688 HB3 ALA 93 HB3 ALA 93 72.009 5.208 -22.286 689 H GLY 94 HN GLY 94 69.106 5.986 -20.689 690 HA2 GLY 94 HA2 GLY 94 67.949 8.423 -21.758 691 HA3 GLY 94 HA1 GLY 94 67.821 7.033 -22.831 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 53.451 -17.537 15.825 2 H2 MET 1 HT2 MET 1 52.641 -17.318 17.300 3 H3 MET 1 HT3 MET 1 54.290 -17.722 17.287 4 HA MET 1 HA MET 1 54.198 -15.464 15.777 5 HB2 MET 1 HB2 MET 1 51.837 -15.171 16.545 6 HB3 MET 1 HB1 MET 1 52.418 -15.123 18.209 7 HG2 MET 1 HG2 MET 1 53.774 -13.158 17.728 8 HG3 MET 1 HG1 MET 1 53.331 -13.233 16.025 9 HE1 MET 1 HE1 MET 1 50.075 -11.616 15.646 10 HE2 MET 1 HE2 MET 1 51.042 -12.976 15.085 11 HE3 MET 1 HE3 MET 1 51.782 -11.387 15.248 12 H ALA 2 HN ALA 2 56.080 -14.528 16.305 13 HA ALA 2 HA ALA 2 56.923 -14.215 19.051 14 HB1 ALA 2 HB1 ALA 2 58.079 -16.322 17.265 15 HB2 ALA 2 HB2 ALA 2 57.802 -16.363 19.004 16 HB3 ALA 2 HB3 ALA 2 59.173 -15.470 18.350 17 HA PRO 3 HA PRO 3 58.937 -10.678 17.357 18 HB2 PRO 3 HB2 PRO 3 61.485 -11.005 18.710 19 HB3 PRO 3 HB1 PRO 3 60.164 -9.900 19.112 20 HG2 PRO 3 HG2 PRO 3 60.934 -12.345 20.437 21 HG3 PRO 3 HG1 PRO 3 59.710 -11.165 20.922 22 HD2 PRO 3 HD2 PRO 3 59.229 -13.783 19.929 23 HD3 PRO 3 HD1 PRO 3 58.021 -12.515 20.185 24 H GLU 4 HN GLU 4 60.235 -10.155 15.622 25 HA GLU 4 HA GLU 4 62.568 -11.539 14.836 26 HB2 GLU 4 HB2 GLU 4 60.939 -13.356 14.344 27 HB3 GLU 4 HB1 GLU 4 60.099 -12.268 13.244 28 HG2 GLU 4 HG2 GLU 4 62.102 -12.065 11.856 29 HG3 GLU 4 HG1 GLU 4 63.013 -13.064 12.990 30 H VAL 5 HN VAL 5 63.633 -10.398 13.302 31 HA VAL 5 HA VAL 5 62.916 -7.791 12.664 32 HB VAL 5 HB VAL 5 65.214 -8.862 12.483 33 HG11 VAL 5 HG11 VAL 5 64.207 -10.766 10.995 34 HG12 VAL 5 HG12 VAL 5 65.812 -10.149 10.617 35 HG13 VAL 5 HG13 VAL 5 64.422 -9.615 9.674 36 HG21 VAL 5 HG21 VAL 5 65.012 -6.638 11.686 37 HG22 VAL 5 HG22 VAL 5 64.034 -7.139 10.306 38 HG23 VAL 5 HG23 VAL 5 65.757 -7.518 10.346 39 H THR 6 HN THR 6 61.578 -6.890 11.186 40 HA THR 6 HA THR 6 60.312 -8.723 9.213 41 HB THR 6 HB THR 6 58.497 -7.214 9.084 42 HG1 THR 6 HG1 THR 6 60.325 -5.426 9.454 43 HG21 THR 6 HG21 THR 6 59.504 -7.397 11.937 44 HG22 THR 6 HG22 THR 6 58.357 -8.464 11.129 45 HG23 THR 6 HG23 THR 6 57.897 -6.804 11.513 46 H ILE 7 HN ILE 7 60.910 -8.600 7.140 47 HA ILE 7 HA ILE 7 62.568 -6.305 6.299 48 HB ILE 7 HB ILE 7 62.110 -8.901 4.841 49 HG12 ILE 7 HG12 ILE 7 63.017 -9.489 7.008 50 HG13 ILE 7 HG11 ILE 7 64.333 -9.560 5.840 51 HG21 ILE 7 HG21 ILE 7 63.036 -7.009 3.545 52 HG22 ILE 7 HG22 ILE 7 64.220 -8.304 3.742 53 HG23 ILE 7 HG23 ILE 7 64.333 -6.847 4.728 54 HD11 ILE 7 HD11 ILE 7 63.785 -7.441 7.917 55 HD12 ILE 7 HD12 ILE 7 64.825 -7.115 6.529 56 HD13 ILE 7 HD13 ILE 7 65.255 -8.384 7.670 57 H LEU 8 HN LEU 8 61.470 -4.720 5.421 58 HA LEU 8 HA LEU 8 59.341 -5.338 3.440 59 HB2 LEU 8 HB2 LEU 8 59.561 -3.023 5.374 60 HB3 LEU 8 HB1 LEU 8 58.431 -3.055 4.025 61 HG LEU 8 HG LEU 8 58.539 -5.164 6.206 62 HD11 LEU 8 HD11 LEU 8 56.707 -4.085 7.270 63 HD12 LEU 8 HD12 LEU 8 56.438 -3.014 5.896 64 HD13 LEU 8 HD13 LEU 8 57.851 -2.790 6.928 65 HD21 LEU 8 HD21 LEU 8 56.809 -4.690 3.786 66 HD22 LEU 8 HD22 LEU 8 56.089 -5.438 5.213 67 HD23 LEU 8 HD23 LEU 8 57.458 -6.202 4.414 68 H GLU 9 HN GLU 9 60.323 -5.148 1.537 69 HA GLU 9 HA GLU 9 61.919 -2.697 1.007 70 HB2 GLU 9 HB2 GLU 9 62.323 -5.432 -0.210 71 HB3 GLU 9 HB1 GLU 9 63.281 -3.990 -0.522 72 HG2 GLU 9 HG2 GLU 9 62.972 -5.042 2.289 73 HG3 GLU 9 HG1 GLU 9 64.186 -5.716 1.204 74 HA PRO 10 HA PRO 10 58.435 -2.773 -1.991 75 HB2 PRO 10 HB2 PRO 10 58.425 0.127 -1.970 76 HB3 PRO 10 HB1 PRO 10 57.192 -0.974 -1.335 77 HG2 PRO 10 HG2 PRO 10 58.880 0.666 0.187 78 HG3 PRO 10 HG1 PRO 10 57.899 -0.672 0.794 79 HD2 PRO 10 HD2 PRO 10 60.826 -0.578 0.304 80 HD3 PRO 10 HD1 PRO 10 59.896 -1.635 1.387 81 H LEU 11 HN LEU 11 61.599 -1.808 -1.932 82 HA LEU 11 HA LEU 11 61.899 -0.396 -4.389 83 HB2 LEU 11 HB2 LEU 11 63.838 -2.010 -2.721 84 HB3 LEU 11 HB1 LEU 11 64.314 -1.085 -4.142 85 HG LEU 11 HG LEU 11 62.831 0.162 -1.812 86 HD11 LEU 11 HD11 LEU 11 64.873 -0.717 -0.891 87 HD12 LEU 11 HD12 LEU 11 65.109 1.012 -1.130 88 HD13 LEU 11 HD13 LEU 11 65.810 -0.139 -2.270 89 HD21 LEU 11 HD21 LEU 11 64.158 2.207 -2.799 90 HD22 LEU 11 HD22 LEU 11 62.708 1.651 -3.637 91 HD23 LEU 11 HD23 LEU 11 64.301 1.202 -4.243 92 H GLN 12 HN GLN 12 62.374 -1.099 -6.416 93 HA GLN 12 HA GLN 12 62.365 -4.030 -6.907 94 HB2 GLN 12 HB2 GLN 12 61.020 -1.824 -8.485 95 HB3 GLN 12 HB1 GLN 12 61.205 -3.484 -9.060 96 HG2 GLN 12 HG2 GLN 12 59.955 -4.323 -7.137 97 HG3 GLN 12 HG1 GLN 12 59.822 -2.692 -6.483 98 HE21 GLN 12 HE21 GLN 12 57.382 -3.594 -6.766 99 HE22 GLN 12 HE22 GLN 12 56.637 -3.125 -8.217 100 H ASP 13 HN ASP 13 63.236 -0.846 -8.189 101 HA ASP 13 HA ASP 13 65.901 -1.517 -8.813 102 HB2 ASP 13 HB2 ASP 13 65.724 -1.476 -11.303 103 HB3 ASP 13 HB1 ASP 13 64.996 -2.906 -10.578 104 H VAL 14 HN VAL 14 67.070 0.283 -9.478 105 HA VAL 14 HA VAL 14 65.537 2.811 -9.792 106 HB VAL 14 HB VAL 14 68.041 2.249 -8.183 107 HG11 VAL 14 HG11 VAL 14 67.854 4.726 -7.627 108 HG12 VAL 14 HG12 VAL 14 66.762 4.862 -9.006 109 HG13 VAL 14 HG13 VAL 14 68.432 4.352 -9.251 110 HG21 VAL 14 HG21 VAL 14 65.788 1.740 -7.168 111 HG22 VAL 14 HG22 VAL 14 65.385 3.446 -7.351 112 HG23 VAL 14 HG23 VAL 14 66.712 2.964 -6.297 113 H GLN 15 HN GLN 15 66.043 3.954 -11.568 114 HA GLN 15 HA GLN 15 68.678 3.558 -12.844 115 HB2 GLN 15 HB2 GLN 15 65.997 3.409 -14.228 116 HB3 GLN 15 HB1 GLN 15 67.547 3.517 -15.063 117 HG2 GLN 15 HG2 GLN 15 68.289 1.427 -14.031 118 HG3 GLN 15 HG1 GLN 15 66.791 1.327 -13.107 119 HE21 GLN 15 HE21 GLN 15 68.259 0.289 -15.986 120 HE22 GLN 15 HE22 GLN 15 66.852 -0.149 -16.829 121 H LEU 16 HN LEU 16 69.600 5.399 -13.618 122 HA LEU 16 HA LEU 16 68.009 7.700 -14.331 123 HB2 LEU 16 HB2 LEU 16 69.051 9.213 -12.656 124 HB3 LEU 16 HB1 LEU 16 67.950 8.034 -11.949 125 HG LEU 16 HG LEU 16 70.752 7.056 -12.107 126 HD11 LEU 16 HD11 LEU 16 71.266 9.408 -11.653 127 HD12 LEU 16 HD12 LEU 16 71.543 8.439 -10.203 128 HD13 LEU 16 HD13 LEU 16 70.090 9.430 -10.338 129 HD21 LEU 16 HD21 LEU 16 68.699 6.115 -10.824 130 HD22 LEU 16 HD22 LEU 16 69.028 7.384 -9.643 131 HD23 LEU 16 HD23 LEU 16 70.246 6.150 -9.981 132 H SER 17 HN SER 17 69.340 9.495 -15.129 133 HA SER 17 HA SER 17 71.581 8.519 -16.636 134 HB2 SER 17 HB2 SER 17 71.508 10.572 -17.763 135 HB3 SER 17 HB1 SER 17 69.833 10.333 -17.279 136 HG SER 17 HG SER 17 70.324 12.356 -16.624 137 H GLU 18 HN GLU 18 73.728 9.418 -16.618 138 HA GLU 18 HA GLU 18 74.845 9.581 -14.007 139 HB2 GLU 18 HB2 GLU 18 76.046 8.699 -16.019 140 HB3 GLU 18 HB1 GLU 18 76.144 10.351 -16.630 141 HG2 GLU 18 HG2 GLU 18 77.407 11.048 -14.662 142 HG3 GLU 18 HG1 GLU 18 77.234 9.447 -13.952 143 H GLY 19 HN GLY 19 75.487 11.306 -12.811 144 HA2 GLY 19 HA2 GLY 19 76.079 13.567 -12.412 145 HA3 GLY 19 HA1 GLY 19 75.332 14.019 -13.943 146 H GLN 20 HN GLN 20 73.194 11.946 -12.616 147 HA GLN 20 HA GLN 20 71.602 14.136 -11.421 148 HB2 GLN 20 HB2 GLN 20 70.817 11.490 -12.651 149 HB3 GLN 20 HB1 GLN 20 69.687 12.521 -11.772 150 HG2 GLN 20 HG2 GLN 20 70.187 14.380 -13.326 151 HG3 GLN 20 HG1 GLN 20 71.299 13.335 -14.211 152 HE21 GLN 20 HE21 GLN 20 69.461 14.144 -15.910 153 HE22 GLN 20 HE22 GLN 20 68.190 13.039 -16.123 154 H ASP 21 HN ASP 21 70.472 13.811 -9.484 155 HA ASP 21 HA ASP 21 71.881 12.247 -7.523 156 HB2 ASP 21 HB2 ASP 21 70.955 14.442 -6.959 157 HB3 ASP 21 HB1 ASP 21 69.328 13.859 -7.305 158 H ALA 22 HN ALA 22 70.942 10.624 -6.153 159 HA ALA 22 HA ALA 22 68.567 9.227 -7.240 160 HB1 ALA 22 HB1 ALA 22 69.666 7.098 -7.107 161 HB2 ALA 22 HB2 ALA 22 71.098 7.819 -6.367 162 HB3 ALA 22 HB3 ALA 22 70.707 8.169 -8.049 163 H SER 23 HN SER 23 67.326 8.141 -5.724 164 HA SER 23 HA SER 23 68.144 8.348 -2.878 165 HB2 SER 23 HB2 SER 23 65.543 9.228 -4.135 166 HB3 SER 23 HB1 SER 23 65.706 8.907 -2.412 167 HG SER 23 HG SER 23 67.548 10.580 -3.722 168 H PHE 24 HN PHE 24 67.343 6.811 -1.518 169 HA PHE 24 HA PHE 24 65.893 4.522 -2.725 170 HB2 PHE 24 HB2 PHE 24 68.443 4.613 -1.163 171 HB3 PHE 24 HB1 PHE 24 67.377 3.237 -0.905 172 HD1 PHE 24 HD1 PHE 24 68.882 5.245 -3.705 173 HD2 PHE 24 HD2 PHE 24 67.597 1.387 -2.319 174 HE1 PHE 24 HE1 PHE 24 69.724 4.214 -5.796 175 HE2 PHE 24 HE2 PHE 24 68.442 0.355 -4.413 176 HZ PHE 24 HZ PHE 24 69.508 1.765 -6.149 177 H GLN 25 HN GLN 25 64.479 3.469 -1.389 178 HA GLN 25 HA GLN 25 64.023 4.551 1.322 179 HB2 GLN 25 HB2 GLN 25 61.984 4.241 -0.891 180 HB3 GLN 25 HB1 GLN 25 61.554 4.440 0.806 181 HG2 GLN 25 HG2 GLN 25 62.694 6.584 0.896 182 HG3 GLN 25 HG1 GLN 25 63.291 6.377 -0.750 183 HE21 GLN 25 HE21 GLN 25 61.947 8.630 -0.691 184 HE22 GLN 25 HE22 GLN 25 60.331 8.488 -1.191 185 H CYS 26 HN CYS 26 64.208 2.873 2.648 186 HA CYS 26 HA CYS 26 63.027 0.267 1.871 187 HB2 CYS 26 HB2 CYS 26 65.336 -0.130 1.600 188 HB3 CYS 26 HB1 CYS 26 65.759 0.850 3.000 189 HG CYS 26 HG CYS 26 64.858 -2.089 3.077 190 H ARG 27 HN ARG 27 61.652 -0.497 3.312 191 HA ARG 27 HA ARG 27 61.492 0.780 5.969 192 HB2 ARG 27 HB2 ARG 27 59.577 -0.943 4.383 193 HB3 ARG 27 HB1 ARG 27 59.281 -0.467 6.056 194 HG2 ARG 27 HG2 ARG 27 59.437 1.917 5.384 195 HG3 ARG 27 HG1 ARG 27 59.703 1.417 3.712 196 HD2 ARG 27 HD2 ARG 27 57.514 0.282 3.694 197 HD3 ARG 27 HD1 ARG 27 57.243 0.768 5.364 198 HE ARG 27 HE ARG 27 57.760 3.088 3.880 199 HH11 ARG 27 HH11 ARG 27 55.923 4.429 3.570 200 HH12 ARG 27 HH12 ARG 27 54.384 3.696 3.257 201 HH21 ARG 27 HH21 ARG 27 55.539 0.457 3.703 202 HH22 ARG 27 HH22 ARG 27 54.172 1.446 3.317 203 H LEU 28 HN LEU 28 62.265 -0.257 7.723 204 HA LEU 28 HA LEU 28 62.371 -3.201 7.738 205 HB2 LEU 28 HB2 LEU 28 64.514 -2.637 6.844 206 HB3 LEU 28 HB1 LEU 28 64.746 -1.358 8.028 207 HG LEU 28 HG LEU 28 64.949 -2.963 9.826 208 HD11 LEU 28 HD11 LEU 28 63.984 -4.897 7.724 209 HD12 LEU 28 HD12 LEU 28 63.432 -4.690 9.386 210 HD13 LEU 28 HD13 LEU 28 64.977 -5.472 9.063 211 HD21 LEU 28 HD21 LEU 28 67.011 -3.971 9.202 212 HD22 LEU 28 HD22 LEU 28 66.892 -2.529 8.197 213 HD23 LEU 28 HD23 LEU 28 66.521 -4.113 7.515 214 H SER 29 HN SER 29 61.264 -3.744 9.540 215 HA SER 29 HA SER 29 61.251 -2.007 11.864 216 HB2 SER 29 HB2 SER 29 59.587 -3.371 12.738 217 HB3 SER 29 HB1 SER 29 59.338 -3.592 11.010 218 HG SER 29 HG SER 29 59.432 -5.608 11.894 219 H ARG 30 HN ARG 30 61.974 -2.659 13.954 220 HA ARG 30 HA ARG 30 64.617 -3.443 14.064 221 HB2 ARG 30 HB2 ARG 30 64.335 -3.582 16.470 222 HB3 ARG 30 HB1 ARG 30 63.429 -2.210 15.840 223 HG2 ARG 30 HG2 ARG 30 61.356 -3.550 15.880 224 HG3 ARG 30 HG1 ARG 30 62.252 -4.937 16.499 225 HD2 ARG 30 HD2 ARG 30 61.163 -3.800 18.353 226 HD3 ARG 30 HD1 ARG 30 62.908 -3.597 18.489 227 HE ARG 30 HE ARG 30 61.836 -1.396 17.074 228 HH11 ARG 30 HH11 ARG 30 62.184 -2.804 20.206 229 HH12 ARG 30 HH12 ARG 30 61.822 -1.340 21.062 230 HH21 ARG 30 HH21 ARG 30 61.212 0.504 18.191 231 HH22 ARG 30 HH22 ARG 30 61.268 0.530 19.922 232 H ALA 31 HN ALA 31 65.665 -5.208 15.048 233 HA ALA 31 HA ALA 31 64.451 -7.812 14.397 234 HB1 ALA 31 HB1 ALA 31 66.696 -8.659 14.265 235 HB2 ALA 31 HB2 ALA 31 67.346 -7.183 14.969 236 HB3 ALA 31 HB3 ALA 31 66.641 -7.150 13.354 237 H SER 32 HN SER 32 65.802 -9.565 15.822 238 HA SER 32 HA SER 32 65.881 -8.852 18.639 239 HB2 SER 32 HB2 SER 32 63.430 -9.367 17.976 240 HB3 SER 32 HB1 SER 32 63.967 -11.038 17.826 241 HG SER 32 HG SER 32 64.946 -10.069 20.089 242 H GLY 33 HN GLY 33 65.801 -11.402 16.206 243 HA2 GLY 33 HA2 GLY 33 67.603 -13.116 17.736 244 HA3 GLY 33 HA1 GLY 33 66.885 -13.477 16.165 245 H GLN 34 HN GLN 34 67.650 -12.071 14.323 246 HA GLN 34 HA GLN 34 70.508 -11.353 14.632 247 HB2 GLN 34 HB2 GLN 34 69.173 -12.651 12.243 248 HB3 GLN 34 HB1 GLN 34 70.853 -12.116 12.306 249 HG2 GLN 34 HG2 GLN 34 69.610 -14.199 14.127 250 HG3 GLN 34 HG1 GLN 34 70.648 -14.548 12.745 251 HE21 GLN 34 HE21 GLN 34 70.867 -14.590 15.966 252 HE22 GLN 34 HE22 GLN 34 72.448 -14.017 16.194 253 H GLU 35 HN GLU 35 71.226 -9.527 13.630 254 HA GLU 35 HA GLU 35 69.166 -7.610 12.813 255 HB2 GLU 35 HB2 GLU 35 72.124 -7.337 13.394 256 HB3 GLU 35 HB1 GLU 35 71.103 -6.003 12.857 257 HG2 GLU 35 HG2 GLU 35 71.083 -5.776 15.192 258 HG3 GLU 35 HG1 GLU 35 69.589 -6.643 14.873 259 H ALA 36 HN ALA 36 68.803 -7.021 10.764 260 HA ALA 36 HA ALA 36 70.190 -8.247 8.577 261 HB1 ALA 36 HB1 ALA 36 68.774 -6.661 7.208 262 HB2 ALA 36 HB2 ALA 36 68.143 -6.024 8.724 263 HB3 ALA 36 HB3 ALA 36 67.858 -7.706 8.293 264 H ARG 37 HN ARG 37 71.606 -7.303 7.111 265 HA ARG 37 HA ARG 37 72.725 -4.648 7.838 266 HB2 ARG 37 HB2 ARG 37 74.246 -7.159 7.072 267 HB3 ARG 37 HB1 ARG 37 74.967 -5.563 7.284 268 HG2 ARG 37 HG2 ARG 37 74.317 -5.508 9.617 269 HG3 ARG 37 HG1 ARG 37 73.397 -7.001 9.441 270 HD2 ARG 37 HD2 ARG 37 75.550 -7.492 10.476 271 HD3 ARG 37 HD1 ARG 37 75.493 -8.202 8.866 272 HE ARG 37 HE ARG 37 76.640 -5.616 8.714 273 HH11 ARG 37 HH11 ARG 37 77.228 -8.878 9.710 274 HH12 ARG 37 HH12 ARG 37 78.953 -8.737 9.635 275 HH21 ARG 37 HH21 ARG 37 78.904 -5.405 8.685 276 HH22 ARG 37 HH22 ARG 37 79.899 -6.770 9.057 277 H TRP 38 HN TRP 38 73.613 -3.449 6.114 278 HA TRP 38 HA TRP 38 72.319 -3.829 3.569 279 HB2 TRP 38 HB2 TRP 38 74.301 -1.855 4.684 280 HB3 TRP 38 HB1 TRP 38 73.953 -1.874 2.961 281 HD1 TRP 38 HD1 TRP 38 72.400 -1.043 6.334 282 HE1 TRP 38 HE1 TRP 38 70.256 0.331 5.929 283 HE3 TRP 38 HE3 TRP 38 72.001 -1.479 1.268 284 HZ2 TRP 38 HZ2 TRP 38 68.586 1.129 3.760 285 HZ3 TRP 38 HZ3 TRP 38 70.129 -0.399 0.057 286 HH2 TRP 38 HH2 TRP 38 68.422 0.905 1.294 287 H ALA 39 HN ALA 39 73.865 -3.538 1.535 288 HA ALA 39 HA ALA 39 76.458 -4.762 1.758 289 HB1 ALA 39 HB1 ALA 39 74.188 -6.362 0.558 290 HB2 ALA 39 HB2 ALA 39 75.209 -6.816 1.921 291 HB3 ALA 39 HB3 ALA 39 75.894 -6.727 0.299 292 H LEU 40 HN LEU 40 77.573 -3.547 0.374 293 HA LEU 40 HA LEU 40 76.408 -2.996 -2.301 294 HB2 LEU 40 HB2 LEU 40 76.437 -0.925 -1.023 295 HB3 LEU 40 HB1 LEU 40 78.124 -1.180 -0.589 296 HG LEU 40 HG LEU 40 78.810 -0.961 -2.925 297 HD11 LEU 40 HD11 LEU 40 75.829 -0.897 -3.399 298 HD12 LEU 40 HD12 LEU 40 77.052 -1.883 -4.206 299 HD13 LEU 40 HD13 LEU 40 76.943 -0.160 -4.553 300 HD21 LEU 40 HD21 LEU 40 78.157 1.395 -3.290 301 HD22 LEU 40 HD22 LEU 40 78.573 1.100 -1.602 302 HD23 LEU 40 HD23 LEU 40 76.882 1.222 -2.083 303 H GLY 41 HN GLY 41 77.536 -3.941 -3.873 304 HA2 GLY 41 HA2 GLY 41 79.352 -4.652 -5.121 305 HA3 GLY 41 HA1 GLY 41 80.410 -3.854 -3.957 306 H GLY 42 HN GLY 42 78.307 -5.731 -2.255 307 HA2 GLY 42 HA2 GLY 42 78.323 -8.035 -1.650 308 HA3 GLY 42 HA1 GLY 42 79.905 -8.208 -2.405 309 H VAL 43 HN VAL 43 80.510 -5.494 -1.044 310 HA VAL 43 HA VAL 43 81.348 -6.632 1.552 311 HB VAL 43 HB VAL 43 83.001 -4.714 1.515 312 HG11 VAL 43 HG11 VAL 43 83.128 -6.638 -0.827 313 HG12 VAL 43 HG12 VAL 43 83.587 -7.035 0.828 314 HG13 VAL 43 HG13 VAL 43 84.497 -5.824 -0.074 315 HG21 VAL 43 HG21 VAL 43 82.145 -4.527 -1.388 316 HG22 VAL 43 HG22 VAL 43 83.359 -3.541 -0.573 317 HG23 VAL 43 HG23 VAL 43 81.653 -3.373 -0.150 318 HA PRO 44 HA PRO 44 78.533 -3.863 3.575 319 HB2 PRO 44 HB2 PRO 44 80.355 -3.044 5.687 320 HB3 PRO 44 HB1 PRO 44 78.998 -4.170 5.783 321 HG2 PRO 44 HG2 PRO 44 81.783 -4.783 5.815 322 HG3 PRO 44 HG1 PRO 44 80.421 -5.909 5.864 323 HD2 PRO 44 HD2 PRO 44 82.244 -5.437 3.670 324 HD3 PRO 44 HD1 PRO 44 80.888 -6.578 3.748 325 H LEU 45 HN LEU 45 78.020 -1.688 3.594 326 HA LEU 45 HA LEU 45 79.927 0.090 2.271 327 HB2 LEU 45 HB2 LEU 45 78.112 1.434 1.682 328 HB3 LEU 45 HB1 LEU 45 77.420 -0.182 1.653 329 HG LEU 45 HG LEU 45 77.141 1.863 3.885 330 HD11 LEU 45 HD11 LEU 45 75.208 0.651 1.897 331 HD12 LEU 45 HD12 LEU 45 75.691 2.346 2.019 332 HD13 LEU 45 HD13 LEU 45 74.712 1.614 3.289 333 HD21 LEU 45 HD21 LEU 45 77.267 -0.305 4.933 334 HD22 LEU 45 HD22 LEU 45 76.259 -1.029 3.679 335 HD23 LEU 45 HD23 LEU 45 75.557 0.111 4.829 336 H GLN 46 HN GLN 46 79.637 2.510 3.075 337 HA GLN 46 HA GLN 46 79.546 2.712 5.984 338 HB2 GLN 46 HB2 GLN 46 81.874 2.019 5.523 339 HB3 GLN 46 HB1 GLN 46 82.069 3.416 4.459 340 HG2 GLN 46 HG2 GLN 46 81.615 4.935 6.324 341 HG3 GLN 46 HG1 GLN 46 81.324 3.563 7.394 342 HE21 GLN 46 HE21 GLN 46 83.111 3.556 8.792 343 HE22 GLN 46 HE22 GLN 46 84.727 3.608 8.279 344 H ALA 47 HN ALA 47 79.012 4.716 6.691 345 HA ALA 47 HA ALA 47 77.877 6.561 4.878 346 HB1 ALA 47 HB1 ALA 47 78.625 6.762 7.794 347 HB2 ALA 47 HB2 ALA 47 77.027 6.479 7.107 348 HB3 ALA 47 HB3 ALA 47 77.801 8.055 6.925 349 H ASN 48 HN ASN 48 78.585 8.484 4.093 350 HA ASN 48 HA ASN 48 80.995 9.774 4.901 351 HB2 ASN 48 HB2 ASN 48 81.800 7.728 3.553 352 HB3 ASN 48 HB1 ASN 48 81.144 8.557 2.144 353 HD21 ASN 48 HD21 ASN 48 82.887 9.496 1.070 354 HD22 ASN 48 HD22 ASN 48 84.124 10.385 1.821 355 H GLU 49 HN GLU 49 81.624 11.302 2.781 356 HA GLU 49 HA GLU 49 79.429 13.074 2.591 357 HB2 GLU 49 HB2 GLU 49 81.838 13.724 2.383 358 HB3 GLU 49 HB1 GLU 49 81.850 12.984 0.782 359 HG2 GLU 49 HG2 GLU 49 80.086 14.505 0.030 360 HG3 GLU 49 HG1 GLU 49 79.978 15.206 1.647 361 H MET 50 HN MET 50 80.763 10.694 0.322 362 HA MET 50 HA MET 50 79.012 11.314 -1.831 363 HB2 MET 50 HB2 MET 50 80.476 8.746 -1.172 364 HB3 MET 50 HB1 MET 50 79.669 9.082 -2.701 365 HG2 MET 50 HG2 MET 50 81.915 10.753 -1.537 366 HG3 MET 50 HG1 MET 50 82.122 9.536 -2.794 367 HE1 MET 50 HE1 MET 50 80.602 10.735 -5.869 368 HE2 MET 50 HE2 MET 50 79.360 10.134 -4.773 369 HE3 MET 50 HE3 MET 50 80.952 9.381 -4.789 370 H ASN 51 HN ASN 51 78.830 9.022 0.859 371 HA ASN 51 HA ASN 51 75.989 8.498 0.159 372 HB2 ASN 51 HB2 ASN 51 77.394 6.496 -0.127 373 HB3 ASN 51 HB1 ASN 51 77.945 6.645 1.541 374 HD21 ASN 51 HD21 ASN 51 76.947 4.644 2.240 375 HD22 ASN 51 HD22 ASN 51 75.260 4.472 2.339 376 H ASP 52 HN ASP 52 74.628 9.356 1.566 377 HA ASP 52 HA ASP 52 75.459 9.744 4.386 378 HB2 ASP 52 HB2 ASP 52 73.517 11.303 2.663 379 HB3 ASP 52 HB1 ASP 52 73.662 11.509 4.407 380 H ILE 53 HN ILE 53 74.189 8.830 5.952 381 HA ILE 53 HA ILE 53 71.741 7.405 5.046 382 HB ILE 53 HB ILE 53 73.688 6.568 7.208 383 HG12 ILE 53 HG12 ILE 53 73.166 5.396 4.454 384 HG13 ILE 53 HG11 ILE 53 74.566 6.388 4.862 385 HG21 ILE 53 HG21 ILE 53 72.337 4.477 7.125 386 HG22 ILE 53 HG22 ILE 53 71.250 5.257 5.974 387 HG23 ILE 53 HG23 ILE 53 71.373 5.864 7.624 388 HD11 ILE 53 HD11 ILE 53 75.158 4.740 6.646 389 HD12 ILE 53 HD12 ILE 53 75.193 4.042 5.022 390 HD13 ILE 53 HD13 ILE 53 73.827 3.721 6.092 391 H THR 54 HN THR 54 69.917 7.912 6.054 392 HA THR 54 HA THR 54 70.053 9.281 8.682 393 HB THR 54 HB THR 54 68.307 10.072 6.339 394 HG1 THR 54 HG1 THR 54 70.051 11.123 5.851 395 HG21 THR 54 HG21 THR 54 68.595 11.119 9.162 396 HG22 THR 54 HG22 THR 54 67.139 10.475 8.403 397 HG23 THR 54 HG23 THR 54 67.800 12.022 7.870 398 H VAL 55 HN VAL 55 68.475 8.798 10.112 399 HA VAL 55 HA VAL 55 66.553 6.662 9.368 400 HB VAL 55 HB VAL 55 67.942 7.347 11.969 401 HG11 VAL 55 HG11 VAL 55 66.601 5.380 12.878 402 HG12 VAL 55 HG12 VAL 55 65.557 5.554 11.469 403 HG13 VAL 55 HG13 VAL 55 65.693 6.870 12.631 404 HG21 VAL 55 HG21 VAL 55 68.895 5.178 11.787 405 HG22 VAL 55 HG22 VAL 55 69.013 5.861 10.164 406 HG23 VAL 55 HG23 VAL 55 67.747 4.690 10.538 407 H GLU 56 HN GLU 56 64.409 7.073 9.584 408 HA GLU 56 HA GLU 56 63.595 9.547 11.017 409 HB2 GLU 56 HB2 GLU 56 62.497 8.466 8.415 410 HB3 GLU 56 HB1 GLU 56 61.773 9.780 9.338 411 HG2 GLU 56 HG2 GLU 56 64.613 9.791 8.272 412 HG3 GLU 56 HG1 GLU 56 63.250 10.588 7.497 413 H GLN 57 HN GLN 57 61.001 9.403 11.036 414 HA GLN 57 HA GLN 57 60.087 8.097 13.117 415 HB2 GLN 57 HB2 GLN 57 58.685 9.474 11.606 416 HB3 GLN 57 HB1 GLN 57 58.555 8.094 10.515 417 HG2 GLN 57 HG2 GLN 57 57.425 6.783 12.184 418 HG3 GLN 57 HG1 GLN 57 57.746 7.990 13.432 419 HE21 GLN 57 HE21 GLN 57 57.025 10.372 12.203 420 HE22 GLN 57 HE22 GLN 57 55.387 10.335 11.761 421 H GLY 58 HN GLY 58 59.562 6.141 13.863 422 HA2 GLY 58 HA2 GLY 58 59.299 3.860 13.979 423 HA3 GLY 58 HA1 GLY 58 59.072 3.861 12.230 424 H THR 59 HN THR 59 60.719 3.321 10.920 425 HA THR 59 HA THR 59 63.465 3.202 11.807 426 HB THR 59 HB THR 59 63.645 0.725 11.324 427 HG1 THR 59 HG1 THR 59 60.865 1.109 11.270 428 HG21 THR 59 HG21 THR 59 63.450 1.819 13.656 429 HG22 THR 59 HG22 THR 59 63.120 0.091 13.538 430 HG23 THR 59 HG23 THR 59 61.785 1.234 13.640 431 H LEU 60 HN LEU 60 62.474 4.699 9.852 432 HA LEU 60 HA LEU 60 62.605 3.285 7.311 433 HB2 LEU 60 HB2 LEU 60 60.978 5.113 7.657 434 HB3 LEU 60 HB1 LEU 60 62.308 6.232 7.918 435 HG LEU 60 HG LEU 60 63.132 5.815 5.635 436 HD11 LEU 60 HD11 LEU 60 62.560 3.647 5.009 437 HD12 LEU 60 HD12 LEU 60 61.323 4.554 4.145 438 HD13 LEU 60 HD13 LEU 60 60.929 3.766 5.672 439 HD21 LEU 60 HD21 LEU 60 61.270 6.916 4.439 440 HD22 LEU 60 HD22 LEU 60 61.482 7.615 6.043 441 HD23 LEU 60 HD23 LEU 60 60.169 6.478 5.745 442 H HIS 61 HN HIS 61 64.456 2.877 6.349 443 HA HIS 61 HA HIS 61 66.859 4.467 6.992 444 HB2 HIS 61 HB2 HIS 61 66.532 1.783 5.623 445 HB3 HIS 61 HB1 HIS 61 68.073 2.572 5.952 446 HD1 HIS 61 HD1 HIS 61 67.897 -0.024 7.316 447 HD2 HIS 61 HD2 HIS 61 66.179 3.372 9.015 448 HE1 HIS 61 HE1 HIS 61 67.650 -0.507 9.788 449 H LEU 62 HN LEU 62 67.567 5.924 5.559 450 HA LEU 62 HA LEU 62 66.675 5.687 2.732 451 HB2 LEU 62 HB2 LEU 62 67.257 8.210 4.294 452 HB3 LEU 62 HB1 LEU 62 66.700 8.116 2.622 453 HG LEU 62 HG LEU 62 65.187 7.118 5.057 454 HD11 LEU 62 HD11 LEU 62 63.610 8.967 4.400 455 HD12 LEU 62 HD12 LEU 62 64.823 9.516 3.245 456 HD13 LEU 62 HD13 LEU 62 65.181 9.531 4.968 457 HD21 LEU 62 HD21 LEU 62 64.430 5.715 3.340 458 HD22 LEU 62 HD22 LEU 62 64.691 6.928 2.087 459 HD23 LEU 62 HD23 LEU 62 63.316 7.069 3.183 460 H LEU 63 HN LEU 63 68.188 5.395 1.305 461 HA LEU 63 HA LEU 63 70.994 5.959 2.010 462 HB2 LEU 63 HB2 LEU 63 69.642 3.828 0.615 463 HB3 LEU 63 HB1 LEU 63 70.694 4.632 -0.544 464 HG LEU 63 HG LEU 63 71.911 2.819 0.491 465 HD11 LEU 63 HD11 LEU 63 73.108 5.087 2.021 466 HD12 LEU 63 HD12 LEU 63 72.915 5.303 0.281 467 HD13 LEU 63 HD13 LEU 63 73.855 3.949 0.899 468 HD21 LEU 63 HD21 LEU 63 72.015 2.366 2.772 469 HD22 LEU 63 HD22 LEU 63 70.374 2.984 2.633 470 HD23 LEU 63 HD23 LEU 63 71.657 4.033 3.233 471 H THR 64 HN THR 64 71.401 8.065 1.529 472 HA THR 64 HA THR 64 70.227 9.230 -0.918 473 HB THR 64 HB THR 64 71.539 10.587 1.446 474 HG1 THR 64 HG1 THR 64 69.420 11.030 2.050 475 HG21 THR 64 HG21 THR 64 70.250 12.560 0.452 476 HG22 THR 64 HG22 THR 64 70.070 11.577 -0.999 477 HG23 THR 64 HG23 THR 64 71.677 12.031 -0.437 478 H LEU 65 HN LEU 65 71.521 8.850 -2.582 479 HA LEU 65 HA LEU 65 74.447 9.166 -2.318 480 HB2 LEU 65 HB2 LEU 65 72.719 8.124 -4.583 481 HB3 LEU 65 HB1 LEU 65 74.472 8.259 -4.656 482 HG LEU 65 HG LEU 65 72.996 6.689 -2.524 483 HD11 LEU 65 HD11 LEU 65 74.346 5.634 -5.027 484 HD12 LEU 65 HD12 LEU 65 72.602 5.786 -4.817 485 HD13 LEU 65 HD13 LEU 65 73.518 4.681 -3.795 486 HD21 LEU 65 HD21 LEU 65 75.447 5.581 -2.609 487 HD22 LEU 65 HD22 LEU 65 75.107 6.999 -1.625 488 HD23 LEU 65 HD23 LEU 65 75.884 7.189 -3.194 489 H HIS 66 HN HIS 66 75.498 10.914 -3.069 490 HA HIS 66 HA HIS 66 73.960 12.923 -4.630 491 HB2 HIS 66 HB2 HIS 66 76.236 13.263 -2.671 492 HB3 HIS 66 HB1 HIS 66 75.602 14.559 -3.684 493 HD1 HIS 66 HD1 HIS 66 72.817 14.794 -3.438 494 HD2 HIS 66 HD2 HIS 66 74.917 13.127 -0.247 495 HE1 HIS 66 HE1 HIS 66 71.322 15.016 -1.402 496 H LYS 67 HN LYS 67 74.870 13.878 -6.406 497 HA LYS 67 HA LYS 67 76.086 13.917 -8.351 498 HB2 LYS 67 HB2 LYS 67 77.673 14.900 -6.525 499 HB3 LYS 67 HB1 LYS 67 78.546 13.379 -6.690 500 HG2 LYS 67 HG2 LYS 67 78.845 13.775 -9.094 501 HG3 LYS 67 HG1 LYS 67 77.896 15.260 -8.983 502 HD2 LYS 67 HD2 LYS 67 79.564 16.187 -7.398 503 HD3 LYS 67 HD1 LYS 67 80.529 14.721 -7.582 504 HE2 LYS 67 HE2 LYS 67 80.760 15.155 -9.990 505 HE3 LYS 67 HE1 LYS 67 79.767 16.601 -9.833 506 HZ1 LYS 67 HZ1 LYS 67 82.485 16.105 -8.813 507 HZ2 LYS 67 HZ2 LYS 67 81.493 17.271 -8.073 508 HZ3 LYS 67 HZ3 LYS 67 81.908 17.419 -9.717 509 H VAL 68 HN VAL 68 74.921 11.560 -8.309 510 HA VAL 68 HA VAL 68 76.304 9.214 -8.014 511 HB VAL 68 HB VAL 68 73.871 9.783 -9.029 512 HG11 VAL 68 HG11 VAL 68 74.961 10.512 -11.224 513 HG12 VAL 68 HG12 VAL 68 73.672 9.314 -11.365 514 HG13 VAL 68 HG13 VAL 68 75.361 8.816 -11.482 515 HG21 VAL 68 HG21 VAL 68 73.777 7.358 -9.770 516 HG22 VAL 68 HG22 VAL 68 74.413 7.612 -8.145 517 HG23 VAL 68 HG23 VAL 68 75.514 7.277 -9.480 518 H THR 69 HN THR 69 77.561 7.895 -9.379 519 HA THR 69 HA THR 69 78.916 9.240 -11.639 520 HB THR 69 HB THR 69 81.072 8.463 -10.871 521 HG1 THR 69 HG1 THR 69 80.496 6.567 -9.865 522 HG21 THR 69 HG21 THR 69 79.616 9.731 -8.535 523 HG22 THR 69 HG22 THR 69 80.195 10.614 -9.946 524 HG23 THR 69 HG23 THR 69 81.345 9.820 -8.871 525 H LEU 70 HN LEU 70 80.076 7.641 -13.008 526 HA LEU 70 HA LEU 70 78.384 5.500 -13.728 527 HB2 LEU 70 HB2 LEU 70 80.280 6.782 -15.057 528 HB3 LEU 70 HB1 LEU 70 81.314 5.511 -14.423 529 HG LEU 70 HG LEU 70 80.522 4.851 -16.617 530 HD11 LEU 70 HD11 LEU 70 80.541 3.183 -14.599 531 HD12 LEU 70 HD12 LEU 70 79.817 2.690 -16.125 532 HD13 LEU 70 HD13 LEU 70 78.791 3.209 -14.793 533 HD21 LEU 70 HD21 LEU 70 77.641 4.761 -15.782 534 HD22 LEU 70 HD22 LEU 70 78.347 5.006 -17.374 535 HD23 LEU 70 HD23 LEU 70 78.318 6.333 -16.217 536 H GLU 71 HN GLU 71 81.166 5.792 -11.630 537 HA GLU 71 HA GLU 71 81.699 3.037 -11.186 538 HB2 GLU 71 HB2 GLU 71 83.287 4.842 -10.626 539 HB3 GLU 71 HB1 GLU 71 82.183 5.420 -9.380 540 HG2 GLU 71 HG2 GLU 71 82.378 3.255 -8.203 541 HG3 GLU 71 HG1 GLU 71 83.481 2.677 -9.455 542 H ASP 72 HN ASP 72 79.226 5.172 -10.041 543 HA ASP 72 HA ASP 72 78.552 3.936 -7.599 544 HB2 ASP 72 HB2 ASP 72 77.650 6.132 -8.538 545 HB3 ASP 72 HB1 ASP 72 76.560 5.151 -9.521 546 H ALA 73 HN ALA 73 77.795 3.172 -10.934 547 HA ALA 73 HA ALA 73 75.721 1.402 -10.773 548 HB1 ALA 73 HB1 ALA 73 76.914 0.147 -12.640 549 HB2 ALA 73 HB2 ALA 73 78.252 1.272 -12.411 550 HB3 ALA 73 HB3 ALA 73 76.669 1.875 -12.907 551 H GLY 74 HN GLY 74 75.361 -0.287 -9.479 552 HA2 GLY 74 HA2 GLY 74 77.215 -2.442 -9.232 553 HA3 GLY 74 HA1 GLY 74 77.169 -1.481 -7.758 554 H THR 75 HN THR 75 76.437 -3.879 -7.238 555 HA THR 75 HA THR 75 73.487 -4.074 -7.477 556 HB THR 75 HB THR 75 75.583 -6.175 -6.885 557 HG1 THR 75 HG1 THR 75 75.526 -6.351 -8.961 558 HG21 THR 75 HG21 THR 75 73.641 -6.770 -5.625 559 HG22 THR 75 HG22 THR 75 73.557 -7.714 -7.112 560 HG23 THR 75 HG23 THR 75 72.560 -6.273 -6.928 561 H VAL 76 HN VAL 76 72.332 -3.593 -5.739 562 HA VAL 76 HA VAL 76 73.629 -3.631 -3.073 563 HB VAL 76 HB VAL 76 70.993 -2.311 -3.683 564 HG11 VAL 76 HG11 VAL 76 71.721 -2.511 -1.342 565 HG12 VAL 76 HG12 VAL 76 71.706 -0.826 -1.859 566 HG13 VAL 76 HG13 VAL 76 73.234 -1.699 -1.743 567 HG21 VAL 76 HG21 VAL 76 73.760 -1.325 -4.359 568 HG22 VAL 76 HG22 VAL 76 72.441 -0.201 -4.030 569 HG23 VAL 76 HG23 VAL 76 72.323 -1.333 -5.376 570 H SER 77 HN SER 77 72.923 -5.062 -1.580 571 HA SER 77 HA SER 77 70.300 -6.353 -1.885 572 HB2 SER 77 HB2 SER 77 71.802 -7.854 -3.058 573 HB3 SER 77 HB1 SER 77 72.951 -7.807 -1.722 574 HG SER 77 HG SER 77 71.850 -9.426 -0.968 575 H PHE 78 HN PHE 78 69.998 -7.918 0.052 576 HA PHE 78 HA PHE 78 71.136 -6.703 2.512 577 HB2 PHE 78 HB2 PHE 78 68.273 -7.577 2.037 578 HB3 PHE 78 HB1 PHE 78 68.931 -7.031 3.576 579 HD1 PHE 78 HD1 PHE 78 69.440 -4.688 3.977 580 HD2 PHE 78 HD2 PHE 78 68.010 -6.016 0.152 581 HE1 PHE 78 HE1 PHE 78 69.009 -2.336 3.319 582 HE2 PHE 78 HE2 PHE 78 67.573 -3.668 -0.504 583 HZ PHE 78 HZ PHE 78 68.075 -1.826 1.078 584 H HIS 79 HN HIS 79 71.774 -8.110 4.055 585 HA HIS 79 HA HIS 79 71.301 -11.011 3.600 586 HB2 HIS 79 HB2 HIS 79 73.656 -10.240 3.177 587 HB3 HIS 79 HB1 HIS 79 73.734 -9.725 4.861 588 HD1 HIS 79 HD1 HIS 79 73.535 -11.627 6.695 589 HD2 HIS 79 HD2 HIS 79 73.935 -13.008 2.783 590 HE1 HIS 79 HE1 HIS 79 74.165 -14.075 6.860 591 H VAL 80 HN VAL 80 69.893 -11.676 5.106 592 HA VAL 80 HA VAL 80 70.264 -10.743 7.899 593 HB VAL 80 HB VAL 80 67.575 -11.492 6.784 594 HG11 VAL 80 HG11 VAL 80 67.634 -11.299 9.166 595 HG12 VAL 80 HG12 VAL 80 66.866 -9.835 8.552 596 HG13 VAL 80 HG13 VAL 80 68.540 -9.794 9.088 597 HG21 VAL 80 HG21 VAL 80 68.251 -9.815 5.247 598 HG22 VAL 80 HG22 VAL 80 69.019 -8.862 6.515 599 HG23 VAL 80 HG23 VAL 80 67.260 -8.983 6.445 600 H GLY 81 HN GLY 81 70.528 -12.301 9.345 601 HA2 GLY 81 HA2 GLY 81 70.886 -14.988 8.668 602 HA3 GLY 81 HA1 GLY 81 70.641 -14.387 10.305 603 H THR 82 HN THR 82 68.009 -13.267 8.849 604 HA THR 82 HA THR 82 66.393 -15.673 9.487 605 HB THR 82 HB THR 82 64.617 -14.223 10.088 606 HG1 THR 82 HG1 THR 82 65.294 -12.783 8.204 607 HG21 THR 82 HG21 THR 82 65.619 -12.754 11.776 608 HG22 THR 82 HG22 THR 82 67.184 -12.887 10.982 609 HG23 THR 82 HG23 THR 82 66.457 -14.306 11.739 610 H CYS 83 HN CYS 83 66.778 -13.024 7.162 611 HA CYS 83 HA CYS 83 65.561 -14.691 5.075 612 HB2 CYS 83 HB2 CYS 83 64.596 -11.873 5.586 613 HB3 CYS 83 HB1 CYS 83 63.955 -13.035 4.421 614 HG CYS 83 HG CYS 83 63.298 -14.533 6.594 615 H SER 84 HN SER 84 65.380 -12.823 3.066 616 HA SER 84 HA SER 84 67.825 -11.292 2.860 617 HB2 SER 84 HB2 SER 84 68.764 -12.562 0.991 618 HB3 SER 84 HB1 SER 84 68.658 -13.569 2.432 619 HG SER 84 HG SER 84 67.834 -14.676 0.643 620 H SER 85 HN SER 85 68.060 -10.323 0.657 621 HA SER 85 HA SER 85 65.724 -10.254 -1.052 622 HB2 SER 85 HB2 SER 85 65.075 -8.726 0.797 623 HB3 SER 85 HB1 SER 85 66.514 -7.765 0.481 624 HG SER 85 HG SER 85 64.680 -6.935 -0.603 625 H GLU 86 HN GLU 86 66.077 -8.664 -2.889 626 HA GLU 86 HA GLU 86 68.953 -8.146 -3.394 627 HB2 GLU 86 HB2 GLU 86 67.003 -9.481 -5.287 628 HB3 GLU 86 HB1 GLU 86 68.608 -8.907 -5.740 629 HG2 GLU 86 HG2 GLU 86 69.632 -10.413 -4.099 630 HG3 GLU 86 HG1 GLU 86 68.039 -10.961 -3.585 631 H ALA 87 HN ALA 87 69.387 -6.508 -4.890 632 HA ALA 87 HA ALA 87 67.267 -4.946 -6.069 633 HB1 ALA 87 HB1 ALA 87 69.028 -3.471 -4.119 634 HB2 ALA 87 HB2 ALA 87 67.505 -4.186 -3.595 635 HB3 ALA 87 HB3 ALA 87 67.511 -2.949 -4.853 636 H GLN 88 HN GLN 88 68.100 -3.448 -7.628 637 HA GLN 88 HA GLN 88 71.022 -3.636 -8.124 638 HB2 GLN 88 HB2 GLN 88 68.788 -4.070 -10.114 639 HB3 GLN 88 HB1 GLN 88 70.483 -3.860 -10.553 640 HG2 GLN 88 HG2 GLN 88 71.088 -5.817 -9.178 641 HG3 GLN 88 HG1 GLN 88 69.393 -6.031 -8.735 642 HE21 GLN 88 HE21 GLN 88 68.692 -7.853 -9.882 643 HE22 GLN 88 HE22 GLN 88 68.943 -8.095 -11.543 644 H LEU 89 HN LEU 89 71.979 -1.782 -8.620 645 HA LEU 89 HA LEU 89 70.309 0.589 -9.274 646 HB2 LEU 89 HB2 LEU 89 71.626 0.545 -7.057 647 HB3 LEU 89 HB1 LEU 89 73.076 0.656 -8.052 648 HG LEU 89 HG LEU 89 70.768 2.618 -8.211 649 HD11 LEU 89 HD11 LEU 89 73.397 2.785 -6.714 650 HD12 LEU 89 HD12 LEU 89 71.780 2.766 -6.007 651 HD13 LEU 89 HD13 LEU 89 72.306 4.149 -6.969 652 HD21 LEU 89 HD21 LEU 89 71.919 2.887 -10.221 653 HD22 LEU 89 HD22 LEU 89 73.464 2.395 -9.532 654 HD23 LEU 89 HD23 LEU 89 72.818 3.996 -9.193 655 H LYS 90 HN LYS 90 70.537 1.190 -11.350 656 HA LYS 90 HA LYS 90 73.185 0.873 -12.649 657 HB2 LYS 90 HB2 LYS 90 71.329 -0.779 -13.398 658 HB3 LYS 90 HB1 LYS 90 70.598 0.617 -14.185 659 HG2 LYS 90 HG2 LYS 90 72.642 1.016 -15.465 660 HG3 LYS 90 HG1 LYS 90 73.459 -0.301 -14.634 661 HD2 LYS 90 HD2 LYS 90 70.923 -0.729 -16.228 662 HD3 LYS 90 HD1 LYS 90 72.520 -0.823 -16.965 663 HE2 LYS 90 HE2 LYS 90 73.096 -2.534 -15.134 664 HE3 LYS 90 HE1 LYS 90 71.368 -2.588 -14.794 665 HZ1 LYS 90 HZ1 LYS 90 72.739 -3.941 -16.785 666 HZ2 LYS 90 HZ2 LYS 90 71.786 -2.775 -17.571 667 HZ3 LYS 90 HZ3 LYS 90 71.064 -3.902 -16.522 668 H VAL 91 HN VAL 91 73.940 2.615 -13.694 669 HA VAL 91 HA VAL 91 72.140 4.963 -13.971 670 HB VAL 91 HB VAL 91 73.748 5.587 -12.375 671 HG11 VAL 91 HG11 VAL 91 75.249 3.750 -12.380 672 HG12 VAL 91 HG12 VAL 91 76.233 5.144 -12.814 673 HG13 VAL 91 HG13 VAL 91 75.703 4.020 -14.061 674 HG21 VAL 91 HG21 VAL 91 73.614 7.111 -14.421 675 HG22 VAL 91 HG22 VAL 91 75.129 6.383 -14.950 676 HG23 VAL 91 HG23 VAL 91 75.063 7.283 -13.433 677 H THR 92 HN THR 92 71.519 5.047 -16.032 678 HA THR 92 HA THR 92 73.548 4.601 -18.157 679 HB THR 92 HB THR 92 70.546 4.319 -18.383 680 HG1 THR 92 HG1 THR 92 70.873 2.487 -17.433 681 HG21 THR 92 HG21 THR 92 72.823 3.439 -20.177 682 HG22 THR 92 HG22 THR 92 71.758 4.816 -20.481 683 HG23 THR 92 HG23 THR 92 71.108 3.174 -20.480 684 H ALA 93 HN ALA 93 74.167 6.423 -19.107 685 HA ALA 93 HA ALA 93 72.793 8.901 -18.770 686 HB1 ALA 93 HB1 ALA 93 75.163 8.992 -19.037 687 HB2 ALA 93 HB2 ALA 93 74.467 9.717 -20.487 688 HB3 ALA 93 HB3 ALA 93 75.093 8.069 -20.538 689 H GLY 94 HN GLY 94 71.643 10.121 -20.253 690 HA2 GLY 94 HA2 GLY 94 70.310 8.581 -22.371 691 HA3 GLY 94 HA1 GLY 94 69.789 10.131 -21.717 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 55.705 -10.580 21.431 2 H2 MET 1 HT2 MET 1 55.046 -9.930 22.855 3 H3 MET 1 HT3 MET 1 54.408 -11.361 22.196 4 HA MET 1 HA MET 1 56.365 -11.146 24.126 5 HB2 MET 1 HB2 MET 1 54.636 -12.965 23.583 6 HB3 MET 1 HB1 MET 1 55.805 -13.574 22.413 7 HG2 MET 1 HG2 MET 1 57.497 -13.726 24.246 8 HG3 MET 1 HG1 MET 1 56.248 -13.235 25.393 9 HE1 MET 1 HE1 MET 1 54.210 -14.307 25.867 10 HE2 MET 1 HE2 MET 1 53.805 -16.007 25.658 11 HE3 MET 1 HE3 MET 1 53.555 -14.883 24.328 12 H ALA 2 HN ALA 2 56.660 -11.782 20.658 13 HA ALA 2 HA ALA 2 59.432 -11.034 20.670 14 HB1 ALA 2 HB1 ALA 2 60.270 -13.221 19.802 15 HB2 ALA 2 HB2 ALA 2 58.711 -13.937 20.210 16 HB3 ALA 2 HB3 ALA 2 59.747 -13.291 21.485 17 HA PRO 3 HA PRO 3 57.128 -10.505 16.689 18 HB2 PRO 3 HB2 PRO 3 58.281 -7.830 16.544 19 HB3 PRO 3 HB1 PRO 3 56.576 -8.289 16.681 20 HG2 PRO 3 HG2 PRO 3 58.089 -7.079 18.678 21 HG3 PRO 3 HG1 PRO 3 56.559 -7.933 18.922 22 HD2 PRO 3 HD2 PRO 3 59.325 -8.840 19.533 23 HD3 PRO 3 HD1 PRO 3 57.788 -9.338 20.268 24 H GLU 4 HN GLU 4 57.966 -10.631 14.620 25 HA GLU 4 HA GLU 4 60.814 -11.224 14.429 26 HB2 GLU 4 HB2 GLU 4 59.103 -12.728 13.442 27 HB3 GLU 4 HB1 GLU 4 58.619 -11.431 12.349 28 HG2 GLU 4 HG2 GLU 4 60.863 -11.385 11.368 29 HG3 GLU 4 HG1 GLU 4 61.407 -12.623 12.502 30 H VAL 5 HN VAL 5 62.158 -10.339 12.737 31 HA VAL 5 HA VAL 5 62.140 -7.525 12.555 32 HB VAL 5 HB VAL 5 63.453 -9.327 10.513 33 HG11 VAL 5 HG11 VAL 5 65.188 -7.632 10.552 34 HG12 VAL 5 HG12 VAL 5 64.409 -6.811 11.904 35 HG13 VAL 5 HG13 VAL 5 63.624 -6.847 10.330 36 HG21 VAL 5 HG21 VAL 5 64.297 -10.535 12.273 37 HG22 VAL 5 HG22 VAL 5 63.893 -9.303 13.461 38 HG23 VAL 5 HG23 VAL 5 65.358 -9.147 12.490 39 H THR 6 HN THR 6 61.097 -6.122 11.101 40 HA THR 6 HA THR 6 59.272 -7.413 9.189 41 HB THR 6 HB THR 6 59.650 -4.472 9.750 42 HG1 THR 6 HG1 THR 6 58.260 -6.494 11.004 43 HG21 THR 6 HG21 THR 6 57.276 -4.466 8.765 44 HG22 THR 6 HG22 THR 6 57.678 -6.062 8.130 45 HG23 THR 6 HG23 THR 6 58.622 -4.655 7.642 46 H ILE 7 HN ILE 7 59.809 -7.827 7.161 47 HA ILE 7 HA ILE 7 62.082 -6.368 5.950 48 HB ILE 7 HB ILE 7 60.797 -8.889 4.930 49 HG12 ILE 7 HG12 ILE 7 61.505 -9.390 7.197 50 HG13 ILE 7 HG11 ILE 7 62.687 -10.079 6.088 51 HG21 ILE 7 HG21 ILE 7 62.274 -7.577 3.413 52 HG22 ILE 7 HG22 ILE 7 62.927 -9.169 3.790 53 HG23 ILE 7 HG23 ILE 7 63.575 -7.741 4.592 54 HD11 ILE 7 HD11 ILE 7 64.033 -9.015 7.692 55 HD12 ILE 7 HD12 ILE 7 62.943 -7.635 7.831 56 HD13 ILE 7 HD13 ILE 7 63.958 -7.816 6.402 57 H LEU 8 HN LEU 8 61.199 -4.594 5.032 58 HA LEU 8 HA LEU 8 59.215 -5.016 2.879 59 HB2 LEU 8 HB2 LEU 8 59.313 -2.817 4.940 60 HB3 LEU 8 HB1 LEU 8 58.466 -2.618 3.410 61 HG LEU 8 HG LEU 8 57.933 -4.899 5.341 62 HD11 LEU 8 HD11 LEU 8 57.341 -2.900 6.520 63 HD12 LEU 8 HD12 LEU 8 55.837 -3.549 5.867 64 HD13 LEU 8 HD13 LEU 8 56.624 -2.182 5.077 65 HD21 LEU 8 HD21 LEU 8 55.664 -4.713 3.969 66 HD22 LEU 8 HD22 LEU 8 57.032 -5.582 3.287 67 HD23 LEU 8 HD23 LEU 8 56.690 -3.937 2.764 68 H GLU 9 HN GLU 9 60.857 -5.153 1.379 69 HA GLU 9 HA GLU 9 62.439 -2.677 0.947 70 HB2 GLU 9 HB2 GLU 9 64.047 -4.244 -0.244 71 HB3 GLU 9 HB1 GLU 9 63.975 -4.376 1.512 72 HG2 GLU 9 HG2 GLU 9 62.254 -6.270 1.127 73 HG3 GLU 9 HG1 GLU 9 62.791 -6.249 -0.551 74 HA PRO 10 HA PRO 10 59.726 -3.225 -2.733 75 HB2 PRO 10 HB2 PRO 10 59.485 -0.338 -2.890 76 HB3 PRO 10 HB1 PRO 10 58.226 -1.517 -2.499 77 HG2 PRO 10 HG2 PRO 10 59.362 0.317 -0.723 78 HG3 PRO 10 HG1 PRO 10 58.390 -1.096 -0.281 79 HD2 PRO 10 HD2 PRO 10 61.334 -0.722 -0.115 80 HD3 PRO 10 HD1 PRO 10 60.278 -1.810 0.801 81 H LEU 11 HN LEU 11 62.779 -2.477 -2.206 82 HA LEU 11 HA LEU 11 63.503 -0.882 -4.470 83 HB2 LEU 11 HB2 LEU 11 65.063 -2.737 -2.664 84 HB3 LEU 11 HB1 LEU 11 65.807 -1.897 -4.023 85 HG LEU 11 HG LEU 11 65.053 0.274 -3.069 86 HD11 LEU 11 HD11 LEU 11 63.962 -1.572 -0.939 87 HD12 LEU 11 HD12 LEU 11 63.144 -0.248 -1.770 88 HD13 LEU 11 HD13 LEU 11 64.376 0.100 -0.561 89 HD21 LEU 11 HD21 LEU 11 66.606 -1.453 -1.120 90 HD22 LEU 11 HD22 LEU 11 66.668 0.308 -1.223 91 HD23 LEU 11 HD23 LEU 11 67.298 -0.677 -2.546 92 H GLN 12 HN GLN 12 61.933 -2.242 -5.844 93 HA GLN 12 HA GLN 12 62.759 -4.846 -6.657 94 HB2 GLN 12 HB2 GLN 12 60.912 -2.823 -7.937 95 HB3 GLN 12 HB1 GLN 12 61.155 -4.453 -8.557 96 HG2 GLN 12 HG2 GLN 12 60.234 -3.815 -5.738 97 HG3 GLN 12 HG1 GLN 12 59.151 -4.254 -7.060 98 HE21 GLN 12 HE21 GLN 12 60.432 -5.631 -4.405 99 HE22 GLN 12 HE22 GLN 12 60.689 -7.216 -4.955 100 H ASP 13 HN ASP 13 63.212 -1.591 -8.003 101 HA ASP 13 HA ASP 13 65.720 -2.238 -9.139 102 HB2 ASP 13 HB2 ASP 13 64.190 -3.510 -10.707 103 HB3 ASP 13 HB1 ASP 13 63.528 -1.950 -11.197 104 H VAL 14 HN VAL 14 66.813 -0.414 -9.669 105 HA VAL 14 HA VAL 14 65.296 2.129 -9.922 106 HB VAL 14 HB VAL 14 67.797 1.549 -8.315 107 HG11 VAL 14 HG11 VAL 14 68.255 3.615 -9.446 108 HG12 VAL 14 HG12 VAL 14 67.705 4.045 -7.830 109 HG13 VAL 14 HG13 VAL 14 66.605 4.188 -9.201 110 HG21 VAL 14 HG21 VAL 14 65.535 1.160 -7.278 111 HG22 VAL 14 HG22 VAL 14 65.183 2.867 -7.539 112 HG23 VAL 14 HG23 VAL 14 66.490 2.393 -6.455 113 H GLN 15 HN GLN 15 65.863 3.324 -11.691 114 HA GLN 15 HA GLN 15 68.465 2.794 -12.994 115 HB2 GLN 15 HB2 GLN 15 65.958 3.130 -14.628 116 HB3 GLN 15 HB1 GLN 15 67.530 2.506 -15.126 117 HG2 GLN 15 HG2 GLN 15 66.221 0.559 -14.913 118 HG3 GLN 15 HG1 GLN 15 67.106 0.622 -13.391 119 HE21 GLN 15 HE21 GLN 15 65.581 -0.246 -11.928 120 HE22 GLN 15 HE22 GLN 15 64.026 0.387 -11.700 121 H LEU 16 HN LEU 16 69.425 4.693 -12.604 122 HA LEU 16 HA LEU 16 68.064 7.184 -13.483 123 HB2 LEU 16 HB2 LEU 16 69.832 6.600 -11.127 124 HB3 LEU 16 HB1 LEU 16 69.856 8.213 -11.827 125 HG LEU 16 HG LEU 16 68.246 7.985 -9.935 126 HD11 LEU 16 HD11 LEU 16 67.910 9.440 -12.174 127 HD12 LEU 16 HD12 LEU 16 66.723 9.419 -10.877 128 HD13 LEU 16 HD13 LEU 16 66.477 8.421 -12.307 129 HD21 LEU 16 HD21 LEU 16 66.483 6.488 -9.923 130 HD22 LEU 16 HD22 LEU 16 67.676 5.530 -10.793 131 HD23 LEU 16 HD23 LEU 16 66.410 6.380 -11.677 132 H SER 17 HN SER 17 69.260 8.650 -14.696 133 HA SER 17 HA SER 17 71.495 7.520 -16.167 134 HB2 SER 17 HB2 SER 17 69.784 8.822 -17.349 135 HB3 SER 17 HB1 SER 17 70.168 10.235 -16.373 136 HG SER 17 HG SER 17 72.426 9.256 -17.383 137 H GLU 18 HN GLU 18 73.493 8.797 -16.488 138 HA GLU 18 HA GLU 18 74.785 9.341 -14.048 139 HB2 GLU 18 HB2 GLU 18 75.939 8.650 -16.142 140 HB3 GLU 18 HB1 GLU 18 75.607 10.243 -16.821 141 HG2 GLU 18 HG2 GLU 18 76.929 11.320 -15.100 142 HG3 GLU 18 HG1 GLU 18 77.138 9.792 -14.244 143 H GLY 19 HN GLY 19 75.186 11.168 -12.919 144 HA2 GLY 19 HA2 GLY 19 75.317 13.461 -12.466 145 HA3 GLY 19 HA1 GLY 19 74.619 13.795 -14.045 146 H GLN 20 HN GLN 20 72.722 11.460 -12.630 147 HA GLN 20 HA GLN 20 70.714 13.473 -11.831 148 HB2 GLN 20 HB2 GLN 20 70.462 10.503 -12.374 149 HB3 GLN 20 HB1 GLN 20 69.129 11.560 -11.907 150 HG2 GLN 20 HG2 GLN 20 70.861 11.961 -14.360 151 HG3 GLN 20 HG1 GLN 20 69.266 11.215 -14.377 152 HE21 GLN 20 HE21 GLN 20 70.611 14.032 -15.212 153 HE22 GLN 20 HE22 GLN 20 69.389 15.121 -14.762 154 H ASP 21 HN ASP 21 69.305 12.880 -9.966 155 HA ASP 21 HA ASP 21 70.964 12.396 -7.652 156 HB2 ASP 21 HB2 ASP 21 68.868 12.841 -6.393 157 HB3 ASP 21 HB1 ASP 21 69.252 14.118 -7.547 158 H ALA 22 HN ALA 22 70.637 10.756 -6.090 159 HA ALA 22 HA ALA 22 68.928 8.483 -6.838 160 HB1 ALA 22 HB1 ALA 22 70.977 7.848 -7.883 161 HB2 ALA 22 HB2 ALA 22 70.879 6.938 -6.376 162 HB3 ALA 22 HB3 ALA 22 71.923 8.352 -6.487 163 H SER 23 HN SER 23 68.208 7.331 -5.129 164 HA SER 23 HA SER 23 69.379 7.524 -2.508 165 HB2 SER 23 HB2 SER 23 67.504 8.629 -1.417 166 HB3 SER 23 HB1 SER 23 68.174 9.688 -2.652 167 HG SER 23 HG SER 23 66.008 7.920 -3.117 168 H PHE 24 HN PHE 24 68.169 6.213 -0.935 169 HA PHE 24 HA PHE 24 66.320 4.255 -2.175 170 HB2 PHE 24 HB2 PHE 24 68.751 3.702 -0.466 171 HB3 PHE 24 HB1 PHE 24 67.492 2.509 -0.786 172 HD1 PHE 24 HD1 PHE 24 70.362 4.300 -2.138 173 HD2 PHE 24 HD2 PHE 24 67.053 1.744 -3.111 174 HE1 PHE 24 HE1 PHE 24 71.438 3.736 -4.304 175 HE2 PHE 24 HE2 PHE 24 68.125 1.180 -5.276 176 HZ PHE 24 HZ PHE 24 70.316 2.170 -5.869 177 H GLN 25 HN GLN 25 64.831 3.301 -0.758 178 HA GLN 25 HA GLN 25 64.706 4.375 1.992 179 HB2 GLN 25 HB2 GLN 25 62.439 4.359 -0.021 180 HB3 GLN 25 HB1 GLN 25 62.253 4.696 1.701 181 HG2 GLN 25 HG2 GLN 25 63.747 6.617 1.530 182 HG3 GLN 25 HG1 GLN 25 64.062 6.254 -0.163 183 HE21 GLN 25 HE21 GLN 25 63.154 8.683 -0.151 184 HE22 GLN 25 HE22 GLN 25 61.481 8.808 -0.415 185 H CYS 26 HN CYS 26 64.498 2.776 3.374 186 HA CYS 26 HA CYS 26 63.037 0.325 2.597 187 HB2 CYS 26 HB2 CYS 26 65.608 0.121 2.468 188 HB3 CYS 26 HB1 CYS 26 65.572 0.236 4.227 189 HG CYS 26 HG CYS 26 63.909 -1.985 2.787 190 H ARG 27 HN ARG 27 61.647 -0.370 4.084 191 HA ARG 27 HA ARG 27 61.563 0.994 6.714 192 HB2 ARG 27 HB2 ARG 27 59.466 -0.533 5.155 193 HB3 ARG 27 HB1 ARG 27 59.219 0.141 6.762 194 HG2 ARG 27 HG2 ARG 27 59.667 2.396 5.898 195 HG3 ARG 27 HG1 ARG 27 59.952 1.730 4.285 196 HD2 ARG 27 HD2 ARG 27 57.366 1.430 5.836 197 HD3 ARG 27 HD1 ARG 27 57.631 2.622 4.565 198 HE ARG 27 HE ARG 27 57.225 -0.239 4.218 199 HH11 ARG 27 HH11 ARG 27 59.439 -0.018 2.452 200 HH12 ARG 27 HH12 ARG 27 58.788 0.640 0.987 201 HH21 ARG 27 HH21 ARG 27 55.897 1.829 2.504 202 HH22 ARG 27 HH22 ARG 27 56.780 1.704 1.019 203 H LEU 28 HN LEU 28 62.777 -0.249 8.144 204 HA LEU 28 HA LEU 28 62.117 -3.150 8.260 205 HB2 LEU 28 HB2 LEU 28 64.775 -1.831 8.853 206 HB3 LEU 28 HB1 LEU 28 64.416 -3.549 9.027 207 HG LEU 28 HG LEU 28 64.196 -2.001 6.423 208 HD11 LEU 28 HD11 LEU 28 66.239 -3.327 5.810 209 HD12 LEU 28 HD12 LEU 28 66.342 -3.860 7.488 210 HD13 LEU 28 HD13 LEU 28 66.526 -2.151 7.094 211 HD21 LEU 28 HD21 LEU 28 63.703 -4.867 7.238 212 HD22 LEU 28 HD22 LEU 28 64.297 -4.527 5.615 213 HD23 LEU 28 HD23 LEU 28 62.768 -3.839 6.152 214 H SER 29 HN SER 29 61.122 -3.720 10.041 215 HA SER 29 HA SER 29 61.024 -1.998 12.349 216 HB2 SER 29 HB2 SER 29 59.605 -3.664 13.360 217 HB3 SER 29 HB1 SER 29 59.091 -3.472 11.690 218 HG SER 29 HG SER 29 59.660 -5.690 12.783 219 H ARG 30 HN ARG 30 61.594 -2.849 14.490 220 HA ARG 30 HA ARG 30 64.281 -3.283 14.760 221 HB2 ARG 30 HB2 ARG 30 63.816 -3.808 17.072 222 HB3 ARG 30 HB1 ARG 30 62.734 -2.527 16.529 223 HG2 ARG 30 HG2 ARG 30 60.962 -4.233 16.121 224 HG3 ARG 30 HG1 ARG 30 62.036 -5.473 16.767 225 HD2 ARG 30 HD2 ARG 30 62.162 -4.224 18.907 226 HD3 ARG 30 HD1 ARG 30 61.025 -3.042 18.264 227 HE ARG 30 HE ARG 30 60.409 -5.793 19.073 228 HH11 ARG 30 HH11 ARG 30 58.592 -4.261 20.384 229 HH12 ARG 30 HH12 ARG 30 57.258 -3.975 19.317 230 HH21 ARG 30 HH21 ARG 30 59.027 -4.794 16.454 231 HH22 ARG 30 HH22 ARG 30 57.506 -4.270 17.092 232 H ALA 31 HN ALA 31 65.600 -4.934 15.285 233 HA ALA 31 HA ALA 31 65.053 -7.438 14.032 234 HB1 ALA 31 HB1 ALA 31 67.277 -6.618 13.865 235 HB2 ALA 31 HB2 ALA 31 67.350 -8.015 14.937 236 HB3 ALA 31 HB3 ALA 31 67.389 -6.384 15.608 237 H SER 32 HN SER 32 65.855 -9.473 15.297 238 HA SER 32 HA SER 32 65.014 -9.522 18.090 239 HB2 SER 32 HB2 SER 32 63.600 -11.196 15.994 240 HB3 SER 32 HB1 SER 32 63.361 -11.307 17.737 241 HG SER 32 HG SER 32 62.910 -8.924 17.496 242 H GLY 33 HN GLY 33 65.513 -11.799 15.393 243 HA2 GLY 33 HA2 GLY 33 67.246 -13.457 17.070 244 HA3 GLY 33 HA1 GLY 33 66.680 -13.836 15.442 245 H GLN 34 HN GLN 34 67.572 -12.497 13.665 246 HA GLN 34 HA GLN 34 70.344 -11.602 14.222 247 HB2 GLN 34 HB2 GLN 34 70.324 -13.757 13.010 248 HB3 GLN 34 HB1 GLN 34 69.333 -13.019 11.753 249 HG2 GLN 34 HG2 GLN 34 71.075 -11.474 11.161 250 HG3 GLN 34 HG1 GLN 34 72.042 -11.940 12.561 251 HE21 GLN 34 HE21 GLN 34 73.045 -12.121 9.869 252 HE22 GLN 34 HE22 GLN 34 73.283 -13.762 9.511 253 H GLU 35 HN GLU 35 70.812 -9.598 13.590 254 HA GLU 35 HA GLU 35 68.787 -7.936 12.423 255 HB2 GLU 35 HB2 GLU 35 70.404 -6.150 12.634 256 HB3 GLU 35 HB1 GLU 35 70.466 -7.136 14.093 257 HG2 GLU 35 HG2 GLU 35 72.405 -8.383 13.102 258 HG3 GLU 35 HG1 GLU 35 72.390 -7.253 11.749 259 H ALA 36 HN ALA 36 68.727 -6.998 10.411 260 HA ALA 36 HA ALA 36 69.791 -8.513 8.237 261 HB1 ALA 36 HB1 ALA 36 68.452 -5.796 8.267 262 HB2 ALA 36 HB2 ALA 36 67.620 -7.342 8.117 263 HB3 ALA 36 HB3 ALA 36 68.710 -6.799 6.840 264 H ARG 37 HN ARG 37 71.355 -7.934 6.736 265 HA ARG 37 HA ARG 37 73.288 -5.880 7.626 266 HB2 ARG 37 HB2 ARG 37 73.662 -8.209 5.719 267 HB3 ARG 37 HB1 ARG 37 74.914 -7.077 6.215 268 HG2 ARG 37 HG2 ARG 37 73.377 -8.652 8.276 269 HG3 ARG 37 HG1 ARG 37 74.752 -9.374 7.442 270 HD2 ARG 37 HD2 ARG 37 76.210 -7.557 8.210 271 HD3 ARG 37 HD1 ARG 37 74.846 -6.763 8.990 272 HE ARG 37 HE ARG 37 74.856 -8.419 10.667 273 HH11 ARG 37 HH11 ARG 37 77.848 -7.974 10.392 274 HH12 ARG 37 HH12 ARG 37 78.444 -9.599 10.337 275 HH21 ARG 37 HH21 ARG 37 75.340 -10.996 9.651 276 HH22 ARG 37 HH22 ARG 37 77.025 -11.309 9.911 277 H TRP 38 HN TRP 38 73.678 -4.166 6.432 278 HA TRP 38 HA TRP 38 72.418 -3.930 3.753 279 HB2 TRP 38 HB2 TRP 38 71.553 -2.411 5.556 280 HB3 TRP 38 HB1 TRP 38 73.169 -1.724 5.694 281 HD1 TRP 38 HD1 TRP 38 73.844 0.087 4.011 282 HE1 TRP 38 HE1 TRP 38 72.702 1.184 1.970 283 HE3 TRP 38 HE3 TRP 38 69.810 -3.009 3.482 284 HZ2 TRP 38 HZ2 TRP 38 70.381 0.796 0.338 285 HZ3 TRP 38 HZ3 TRP 38 68.147 -2.617 1.679 286 HH2 TRP 38 HH2 TRP 38 68.438 -0.723 0.108 287 H ALA 39 HN ALA 39 73.759 -3.315 2.031 288 HA ALA 39 HA ALA 39 76.277 -2.079 2.376 289 HB1 ALA 39 HB1 ALA 39 77.619 -4.182 1.662 290 HB2 ALA 39 HB2 ALA 39 76.238 -5.078 2.294 291 HB3 ALA 39 HB3 ALA 39 77.157 -4.016 3.356 292 H LEU 40 HN LEU 40 77.444 -1.817 0.441 293 HA LEU 40 HA LEU 40 75.994 -2.586 -2.029 294 HB2 LEU 40 HB2 LEU 40 75.828 -0.114 -1.411 295 HB3 LEU 40 HB1 LEU 40 77.570 -0.018 -1.670 296 HG LEU 40 HG LEU 40 75.638 -1.097 -3.752 297 HD11 LEU 40 HD11 LEU 40 74.903 1.112 -3.536 298 HD12 LEU 40 HD12 LEU 40 76.101 1.222 -4.824 299 HD13 LEU 40 HD13 LEU 40 76.519 1.725 -3.187 300 HD21 LEU 40 HD21 LEU 40 78.582 -0.536 -3.661 301 HD22 LEU 40 HD22 LEU 40 77.743 -0.141 -5.159 302 HD23 LEU 40 HD23 LEU 40 77.695 -1.782 -4.533 303 H GLY 41 HN GLY 41 77.206 -3.865 -3.252 304 HA2 GLY 41 HA2 GLY 41 79.104 -4.564 -4.431 305 HA3 GLY 41 HA1 GLY 41 80.086 -3.429 -3.500 306 H GLY 42 HN GLY 42 78.041 -5.071 -1.443 307 HA2 GLY 42 HA2 GLY 42 78.207 -7.068 -0.233 308 HA3 GLY 42 HA1 GLY 42 79.711 -7.435 -1.069 309 H VAL 43 HN VAL 43 79.954 -4.289 -0.076 310 HA VAL 43 HA VAL 43 81.359 -5.071 2.415 311 HB VAL 43 HB VAL 43 82.708 -3.001 2.035 312 HG11 VAL 43 HG11 VAL 43 83.892 -3.980 -0.040 313 HG12 VAL 43 HG12 VAL 43 82.659 -5.238 0.007 314 HG13 VAL 43 HG13 VAL 43 83.749 -5.020 1.376 315 HG21 VAL 43 HG21 VAL 43 82.617 -2.011 -0.250 316 HG22 VAL 43 HG22 VAL 43 81.108 -1.780 0.632 317 HG23 VAL 43 HG23 VAL 43 81.220 -3.023 -0.613 318 HA PRO 44 HA PRO 44 78.452 -2.564 4.704 319 HB2 PRO 44 HB2 PRO 44 80.455 -1.508 6.526 320 HB3 PRO 44 HB1 PRO 44 79.252 -2.769 6.834 321 HG2 PRO 44 HG2 PRO 44 82.084 -3.068 6.415 322 HG3 PRO 44 HG1 PRO 44 80.889 -4.313 6.810 323 HD2 PRO 44 HD2 PRO 44 82.233 -3.956 4.314 324 HD3 PRO 44 HD1 PRO 44 80.913 -5.091 4.669 325 H LEU 45 HN LEU 45 77.778 -0.398 4.683 326 HA LEU 45 HA LEU 45 79.260 1.382 2.946 327 HB2 LEU 45 HB2 LEU 45 76.735 2.022 4.477 328 HB3 LEU 45 HB1 LEU 45 77.343 2.804 3.020 329 HG LEU 45 HG LEU 45 76.219 0.021 3.292 330 HD11 LEU 45 HD11 LEU 45 74.689 2.009 2.978 331 HD12 LEU 45 HD12 LEU 45 74.591 0.793 1.703 332 HD13 LEU 45 HD13 LEU 45 75.484 2.284 1.426 333 HD21 LEU 45 HD21 LEU 45 77.869 1.261 1.089 334 HD22 LEU 45 HD22 LEU 45 76.694 -0.001 0.742 335 HD23 LEU 45 HD23 LEU 45 78.044 -0.333 1.822 336 H GLN 46 HN GLN 46 79.793 3.557 3.458 337 HA GLN 46 HA GLN 46 80.331 4.091 6.328 338 HB2 GLN 46 HB2 GLN 46 82.151 4.582 3.952 339 HB3 GLN 46 HB1 GLN 46 82.436 5.218 5.574 340 HG2 GLN 46 HG2 GLN 46 82.474 2.930 6.478 341 HG3 GLN 46 HG1 GLN 46 82.165 2.280 4.871 342 HE21 GLN 46 HE21 GLN 46 84.651 2.696 7.000 343 HE22 GLN 46 HE22 GLN 46 85.939 2.885 5.915 344 H ALA 47 HN ALA 47 79.616 6.029 7.012 345 HA ALA 47 HA ALA 47 77.961 7.628 5.376 346 HB1 ALA 47 HB1 ALA 47 79.249 8.332 8.022 347 HB2 ALA 47 HB2 ALA 47 77.714 7.489 7.819 348 HB3 ALA 47 HB3 ALA 47 77.878 9.161 7.288 349 H ASN 48 HN ASN 48 79.646 7.840 3.608 350 HA ASN 48 HA ASN 48 81.788 9.736 3.987 351 HB2 ASN 48 HB2 ASN 48 80.538 8.563 1.495 352 HB3 ASN 48 HB1 ASN 48 81.986 9.564 1.513 353 HD21 ASN 48 HD21 ASN 48 81.921 6.778 0.631 354 HD22 ASN 48 HD22 ASN 48 82.911 5.900 1.695 355 H GLU 49 HN GLU 49 81.929 11.756 2.689 356 HA GLU 49 HA GLU 49 79.793 13.514 3.219 357 HB2 GLU 49 HB2 GLU 49 82.094 13.724 1.260 358 HB3 GLU 49 HB1 GLU 49 81.005 15.056 1.643 359 HG2 GLU 49 HG2 GLU 49 81.649 14.936 4.003 360 HG3 GLU 49 HG1 GLU 49 82.691 13.555 3.667 361 H MET 50 HN MET 50 80.810 11.908 0.219 362 HA MET 50 HA MET 50 78.739 12.962 -1.416 363 HB2 MET 50 HB2 MET 50 80.507 10.519 -1.667 364 HB3 MET 50 HB1 MET 50 79.365 11.020 -2.918 365 HG2 MET 50 HG2 MET 50 80.483 13.161 -3.153 366 HG3 MET 50 HG1 MET 50 81.548 12.801 -1.798 367 HE1 MET 50 HE1 MET 50 80.512 10.165 -4.818 368 HE2 MET 50 HE2 MET 50 81.464 11.074 -5.989 369 HE3 MET 50 HE3 MET 50 80.193 11.885 -5.083 370 H ASN 51 HN ASN 51 79.096 10.015 0.487 371 HA ASN 51 HA ASN 51 76.225 9.382 0.052 372 HB2 ASN 51 HB2 ASN 51 78.525 7.519 0.707 373 HB3 ASN 51 HB1 ASN 51 76.839 7.044 0.529 374 HD21 ASN 51 HD21 ASN 51 78.769 5.882 -1.165 375 HD22 ASN 51 HD22 ASN 51 78.555 6.470 -2.743 376 H ASP 52 HN ASP 52 75.171 10.151 1.808 377 HA ASP 52 HA ASP 52 76.369 9.734 4.485 378 HB2 ASP 52 HB2 ASP 52 74.660 11.488 5.167 379 HB3 ASP 52 HB1 ASP 52 75.983 12.058 4.156 380 H ILE 53 HN ILE 53 74.887 9.116 6.206 381 HA ILE 53 HA ILE 53 72.552 7.570 5.220 382 HB ILE 53 HB ILE 53 74.168 6.780 7.641 383 HG12 ILE 53 HG12 ILE 53 74.662 6.102 4.728 384 HG13 ILE 53 HG11 ILE 53 75.800 6.820 5.866 385 HG21 ILE 53 HG21 ILE 53 71.826 5.882 7.069 386 HG22 ILE 53 HG22 ILE 53 73.086 4.674 7.323 387 HG23 ILE 53 HG23 ILE 53 72.589 5.100 5.685 388 HD11 ILE 53 HD11 ILE 53 76.411 4.524 5.756 389 HD12 ILE 53 HD12 ILE 53 74.729 3.998 5.833 390 HD13 ILE 53 HD13 ILE 53 75.503 4.683 7.261 391 H THR 54 HN THR 54 70.683 8.014 6.140 392 HA THR 54 HA THR 54 70.661 9.530 8.693 393 HB THR 54 HB THR 54 68.949 9.976 6.237 394 HG1 THR 54 HG1 THR 54 70.365 12.064 7.219 395 HG21 THR 54 HG21 THR 54 68.927 11.194 9.000 396 HG22 THR 54 HG22 THR 54 67.600 10.402 8.151 397 HG23 THR 54 HG23 THR 54 68.181 11.973 7.605 398 H VAL 55 HN VAL 55 69.418 8.686 10.225 399 HA VAL 55 HA VAL 55 67.453 6.582 9.498 400 HB VAL 55 HB VAL 55 69.282 5.763 10.914 401 HG11 VAL 55 HG11 VAL 55 69.660 8.095 11.943 402 HG12 VAL 55 HG12 VAL 55 69.805 6.711 13.026 403 HG13 VAL 55 HG13 VAL 55 68.339 7.691 13.043 404 HG21 VAL 55 HG21 VAL 55 66.855 5.014 11.220 405 HG22 VAL 55 HG22 VAL 55 66.797 6.096 12.611 406 HG23 VAL 55 HG23 VAL 55 67.922 4.735 12.598 407 H GLU 56 HN GLU 56 65.364 6.971 9.904 408 HA GLU 56 HA GLU 56 64.660 9.336 11.559 409 HB2 GLU 56 HB2 GLU 56 63.209 8.052 9.239 410 HB3 GLU 56 HB1 GLU 56 62.535 9.331 10.243 411 HG2 GLU 56 HG2 GLU 56 64.346 10.837 9.608 412 HG3 GLU 56 HG1 GLU 56 65.126 9.553 8.686 413 H GLN 57 HN GLN 57 62.145 9.036 12.061 414 HA GLN 57 HA GLN 57 61.628 7.808 14.301 415 HB2 GLN 57 HB2 GLN 57 59.946 8.958 12.847 416 HB3 GLN 57 HB1 GLN 57 59.755 7.448 11.957 417 HG2 GLN 57 HG2 GLN 57 58.002 7.587 13.632 418 HG3 GLN 57 HG1 GLN 57 59.129 6.320 14.106 419 HE21 GLN 57 HE21 GLN 57 58.775 6.506 16.392 420 HE22 GLN 57 HE22 GLN 57 59.200 7.895 17.272 421 H GLY 58 HN GLY 58 61.170 5.847 15.207 422 HA2 GLY 58 HA2 GLY 58 61.266 3.576 15.536 423 HA3 GLY 58 HA1 GLY 58 60.652 3.436 13.892 424 H THR 59 HN THR 59 62.053 3.017 12.208 425 HA THR 59 HA THR 59 64.898 3.032 12.551 426 HB THR 59 HB THR 59 63.557 0.323 12.369 427 HG1 THR 59 HG1 THR 59 63.698 0.278 14.456 428 HG21 THR 59 HG21 THR 59 66.422 1.270 12.391 429 HG22 THR 59 HG22 THR 59 65.645 0.168 11.259 430 HG23 THR 59 HG23 THR 59 65.994 -0.361 12.902 431 H LEU 60 HN LEU 60 63.975 4.415 10.697 432 HA LEU 60 HA LEU 60 63.588 2.846 8.232 433 HB2 LEU 60 HB2 LEU 60 63.457 5.823 8.736 434 HB3 LEU 60 HB1 LEU 60 63.079 5.029 7.211 435 HG LEU 60 HG LEU 60 61.651 4.520 9.841 436 HD11 LEU 60 HD11 LEU 60 60.693 5.999 7.376 437 HD12 LEU 60 HD12 LEU 60 61.275 6.788 8.843 438 HD13 LEU 60 HD13 LEU 60 59.818 5.799 8.895 439 HD21 LEU 60 HD21 LEU 60 61.312 2.548 8.644 440 HD22 LEU 60 HD22 LEU 60 61.464 3.339 7.076 441 HD23 LEU 60 HD23 LEU 60 59.981 3.514 8.012 442 H HIS 61 HN HIS 61 65.250 2.471 6.895 443 HA HIS 61 HA HIS 61 67.761 4.006 7.285 444 HB2 HIS 61 HB2 HIS 61 67.311 1.289 6.015 445 HB3 HIS 61 HB1 HIS 61 68.873 2.073 6.262 446 HD1 HIS 61 HD1 HIS 61 68.345 -0.626 7.626 447 HD2 HIS 61 HD2 HIS 61 67.534 3.040 9.442 448 HE1 HIS 61 HE1 HIS 61 68.315 -1.055 10.120 449 H LEU 62 HN LEU 62 68.199 5.487 5.760 450 HA LEU 62 HA LEU 62 67.411 4.912 2.968 451 HB2 LEU 62 HB2 LEU 62 66.819 7.386 2.759 452 HB3 LEU 62 HB1 LEU 62 65.654 6.364 3.597 453 HG LEU 62 HG LEU 62 67.763 7.702 5.269 454 HD11 LEU 62 HD11 LEU 62 65.410 9.129 4.009 455 HD12 LEU 62 HD12 LEU 62 67.113 9.583 3.923 456 HD13 LEU 62 HD13 LEU 62 66.239 9.720 5.448 457 HD21 LEU 62 HD21 LEU 62 66.107 7.612 6.956 458 HD22 LEU 62 HD22 LEU 62 65.874 6.111 6.064 459 HD23 LEU 62 HD23 LEU 62 64.795 7.475 5.787 460 H LEU 63 HN LEU 63 69.163 4.968 1.747 461 HA LEU 63 HA LEU 63 71.528 6.431 2.618 462 HB2 LEU 63 HB2 LEU 63 70.970 4.449 0.408 463 HB3 LEU 63 HB1 LEU 63 72.428 5.428 0.375 464 HG LEU 63 HG LEU 63 72.598 3.098 1.437 465 HD11 LEU 63 HD11 LEU 63 73.609 5.663 2.617 466 HD12 LEU 63 HD12 LEU 63 74.488 4.354 1.844 467 HD13 LEU 63 HD13 LEU 63 73.906 4.165 3.494 468 HD21 LEU 63 HD21 LEU 63 71.811 2.785 3.661 469 HD22 LEU 63 HD22 LEU 63 70.443 3.424 2.749 470 HD23 LEU 63 HD23 LEU 63 71.355 4.481 3.823 471 H THR 64 HN THR 64 71.781 8.478 2.088 472 HA THR 64 HA THR 64 70.359 9.547 -0.275 473 HB THR 64 HB THR 64 71.534 10.967 2.125 474 HG1 THR 64 HG1 THR 64 69.301 9.628 1.819 475 HG21 THR 64 HG21 THR 64 70.249 12.911 1.214 476 HG22 THR 64 HG22 THR 64 69.923 11.968 -0.239 477 HG23 THR 64 HG23 THR 64 71.581 12.418 0.167 478 H LEU 65 HN LEU 65 71.783 9.105 -1.928 479 HA LEU 65 HA LEU 65 74.506 10.282 -1.710 480 HB2 LEU 65 HB2 LEU 65 74.584 8.867 -4.050 481 HB3 LEU 65 HB1 LEU 65 75.060 8.201 -2.489 482 HG LEU 65 HG LEU 65 72.170 8.063 -3.340 483 HD11 LEU 65 HD11 LEU 65 73.497 7.160 -5.226 484 HD12 LEU 65 HD12 LEU 65 72.603 5.887 -4.395 485 HD13 LEU 65 HD13 LEU 65 74.331 6.083 -4.107 486 HD21 LEU 65 HD21 LEU 65 72.000 6.422 -1.700 487 HD22 LEU 65 HD22 LEU 65 73.286 7.403 -0.998 488 HD23 LEU 65 HD23 LEU 65 73.682 5.920 -1.864 489 H HIS 66 HN HIS 66 75.152 11.851 -3.143 490 HA HIS 66 HA HIS 66 73.271 12.711 -5.255 491 HB2 HIS 66 HB2 HIS 66 73.556 15.068 -4.553 492 HB3 HIS 66 HB1 HIS 66 72.757 14.107 -3.308 493 HD1 HIS 66 HD1 HIS 66 75.906 15.973 -4.042 494 HD2 HIS 66 HD2 HIS 66 74.387 13.567 -0.994 495 HE1 HIS 66 HE1 HIS 66 77.454 16.265 -2.062 496 H LYS 67 HN LYS 67 74.257 14.128 -6.848 497 HA LYS 67 HA LYS 67 75.896 14.432 -8.432 498 HB2 LYS 67 HB2 LYS 67 76.501 16.059 -6.523 499 HB3 LYS 67 HB1 LYS 67 77.768 14.904 -6.112 500 HG2 LYS 67 HG2 LYS 67 78.703 15.081 -8.369 501 HG3 LYS 67 HG1 LYS 67 77.401 16.173 -8.844 502 HD2 LYS 67 HD2 LYS 67 78.141 17.800 -7.141 503 HD3 LYS 67 HD1 LYS 67 79.459 16.719 -6.684 504 HE2 LYS 67 HE2 LYS 67 80.355 16.835 -8.980 505 HE3 LYS 67 HE1 LYS 67 79.040 17.920 -9.435 506 HZ1 LYS 67 HZ1 LYS 67 80.176 18.987 -7.154 507 HZ2 LYS 67 HZ2 LYS 67 80.298 19.588 -8.739 508 HZ3 LYS 67 HZ3 LYS 67 81.480 18.528 -8.136 509 H VAL 68 HN VAL 68 75.727 12.059 -8.788 510 HA VAL 68 HA VAL 68 78.229 10.641 -8.039 511 HB VAL 68 HB VAL 68 76.117 9.672 -7.135 512 HG11 VAL 68 HG11 VAL 68 74.784 10.400 -9.209 513 HG12 VAL 68 HG12 VAL 68 74.445 8.791 -8.567 514 HG13 VAL 68 HG13 VAL 68 75.461 8.975 -9.997 515 HG21 VAL 68 HG21 VAL 68 76.639 7.410 -7.755 516 HG22 VAL 68 HG22 VAL 68 78.160 8.304 -7.749 517 HG23 VAL 68 HG23 VAL 68 77.358 7.932 -9.278 518 H THR 69 HN THR 69 79.540 9.989 -9.631 519 HA THR 69 HA THR 69 78.923 10.700 -12.363 520 HB THR 69 HB THR 69 81.177 10.192 -12.842 521 HG1 THR 69 HG1 THR 69 82.099 9.056 -10.657 522 HG21 THR 69 HG21 THR 69 82.389 11.411 -11.184 523 HG22 THR 69 HG22 THR 69 81.257 10.939 -9.915 524 HG23 THR 69 HG23 THR 69 80.751 12.070 -11.171 525 H LEU 70 HN LEU 70 80.340 8.566 -13.642 526 HA LEU 70 HA LEU 70 78.245 6.826 -14.273 527 HB2 LEU 70 HB2 LEU 70 80.145 7.192 -15.767 528 HB3 LEU 70 HB1 LEU 70 81.233 6.429 -14.612 529 HG LEU 70 HG LEU 70 80.029 4.292 -14.869 530 HD11 LEU 70 HD11 LEU 70 77.792 4.779 -15.336 531 HD12 LEU 70 HD12 LEU 70 78.368 4.312 -16.935 532 HD13 LEU 70 HD13 LEU 70 78.193 6.018 -16.524 533 HD21 LEU 70 HD21 LEU 70 80.702 5.536 -17.553 534 HD22 LEU 70 HD22 LEU 70 80.721 3.816 -17.169 535 HD23 LEU 70 HD23 LEU 70 81.894 4.901 -16.422 536 H GLU 71 HN GLU 71 80.788 6.582 -11.855 537 HA GLU 71 HA GLU 71 80.686 3.894 -11.200 538 HB2 GLU 71 HB2 GLU 71 80.979 6.258 -9.329 539 HB3 GLU 71 HB1 GLU 71 81.347 4.588 -8.904 540 HG2 GLU 71 HG2 GLU 71 82.660 6.124 -11.165 541 HG3 GLU 71 HG1 GLU 71 83.377 5.862 -9.578 542 H ASP 72 HN ASP 72 78.049 5.901 -11.262 543 HA ASP 72 HA ASP 72 76.592 5.382 -8.959 544 HB2 ASP 72 HB2 ASP 72 75.970 6.883 -10.929 545 HB3 ASP 72 HB1 ASP 72 75.380 5.424 -11.724 546 H ALA 73 HN ALA 73 77.026 3.373 -11.846 547 HA ALA 73 HA ALA 73 75.125 1.399 -11.253 548 HB1 ALA 73 HB1 ALA 73 77.722 1.301 -12.784 549 HB2 ALA 73 HB2 ALA 73 76.087 1.420 -13.428 550 HB3 ALA 73 HB3 ALA 73 76.631 -0.078 -12.673 551 H GLY 74 HN GLY 74 75.118 -0.382 -10.006 552 HA2 GLY 74 HA2 GLY 74 77.341 -1.712 -8.911 553 HA3 GLY 74 HA1 GLY 74 76.737 -0.560 -7.717 554 H THR 75 HN THR 75 76.538 -3.060 -6.868 555 HA THR 75 HA THR 75 73.684 -3.804 -7.289 556 HB THR 75 HB THR 75 76.037 -5.657 -6.829 557 HG1 THR 75 HG1 THR 75 75.800 -4.764 -8.947 558 HG21 THR 75 HG21 THR 75 74.226 -6.720 -5.783 559 HG22 THR 75 HG22 THR 75 74.163 -7.366 -7.423 560 HG23 THR 75 HG23 THR 75 73.055 -6.085 -6.939 561 H VAL 76 HN VAL 76 72.547 -3.429 -5.471 562 HA VAL 76 HA VAL 76 73.913 -3.376 -2.871 563 HB VAL 76 HB VAL 76 70.979 -2.886 -3.405 564 HG11 VAL 76 HG11 VAL 76 71.732 -3.303 -1.064 565 HG12 VAL 76 HG12 VAL 76 71.071 -1.687 -1.303 566 HG13 VAL 76 HG13 VAL 76 72.818 -1.920 -1.206 567 HG21 VAL 76 HG21 VAL 76 73.167 -0.793 -3.256 568 HG22 VAL 76 HG22 VAL 76 71.467 -0.537 -3.647 569 HG23 VAL 76 HG23 VAL 76 72.511 -1.386 -4.782 570 H SER 77 HN SER 77 73.793 -4.984 -1.401 571 HA SER 77 HA SER 77 71.779 -7.128 -1.791 572 HB2 SER 77 HB2 SER 77 73.615 -8.719 -1.057 573 HB3 SER 77 HB1 SER 77 73.793 -8.040 -2.674 574 HG SER 77 HG SER 77 74.956 -6.907 -0.350 575 H PHE 78 HN PHE 78 71.095 -8.180 0.048 576 HA PHE 78 HA PHE 78 72.127 -7.431 2.660 577 HB2 PHE 78 HB2 PHE 78 69.458 -6.918 3.138 578 HB3 PHE 78 HB1 PHE 78 70.667 -5.669 2.844 579 HD1 PHE 78 HD1 PHE 78 70.503 -4.250 0.986 580 HD2 PHE 78 HD2 PHE 78 68.244 -7.902 1.065 581 HE1 PHE 78 HE1 PHE 78 69.336 -3.570 -1.095 582 HE2 PHE 78 HE2 PHE 78 67.076 -7.221 -1.018 583 HZ PHE 78 HZ PHE 78 67.622 -5.058 -2.096 584 H HIS 79 HN HIS 79 71.422 -8.847 4.327 585 HA HIS 79 HA HIS 79 69.651 -11.074 3.558 586 HB2 HIS 79 HB2 HIS 79 72.450 -11.502 4.628 587 HB3 HIS 79 HB1 HIS 79 71.261 -12.757 4.280 588 HD1 HIS 79 HD1 HIS 79 70.352 -12.601 1.624 589 HD2 HIS 79 HD2 HIS 79 74.134 -11.087 2.494 590 HE1 HIS 79 HE1 HIS 79 71.607 -12.497 -0.582 591 H VAL 80 HN VAL 80 68.566 -11.969 5.221 592 HA VAL 80 HA VAL 80 69.170 -11.093 7.984 593 HB VAL 80 HB VAL 80 66.337 -11.423 7.011 594 HG11 VAL 80 HG11 VAL 80 67.655 -9.825 9.224 595 HG12 VAL 80 HG12 VAL 80 66.665 -11.271 9.413 596 HG13 VAL 80 HG13 VAL 80 65.935 -9.773 8.841 597 HG21 VAL 80 HG21 VAL 80 68.169 -9.059 6.618 598 HG22 VAL 80 HG22 VAL 80 66.425 -8.842 6.776 599 HG23 VAL 80 HG23 VAL 80 67.076 -9.815 5.457 600 H GLY 81 HN GLY 81 69.207 -12.727 9.428 601 HA2 GLY 81 HA2 GLY 81 69.308 -15.384 8.772 602 HA3 GLY 81 HA1 GLY 81 68.867 -14.810 10.373 603 H THR 82 HN THR 82 66.511 -13.456 8.729 604 HA THR 82 HA THR 82 64.686 -15.755 9.073 605 HB THR 82 HB THR 82 62.918 -13.946 8.935 606 HG1 THR 82 HG1 THR 82 65.126 -12.221 9.302 607 HG21 THR 82 HG21 THR 82 65.049 -13.726 11.080 608 HG22 THR 82 HG22 THR 82 63.685 -14.845 11.081 609 HG23 THR 82 HG23 THR 82 63.402 -13.108 11.221 610 H CYS 83 HN CYS 83 65.215 -13.046 6.803 611 HA CYS 83 HA CYS 83 64.514 -14.829 4.553 612 HB2 CYS 83 HB2 CYS 83 62.488 -13.508 5.222 613 HB3 CYS 83 HB1 CYS 83 63.394 -12.036 4.870 614 HG CYS 83 HG CYS 83 63.166 -14.116 2.584 615 H SER 84 HN SER 84 65.206 -13.903 2.439 616 HA SER 84 HA SER 84 67.397 -11.916 2.690 617 HB2 SER 84 HB2 SER 84 68.713 -13.344 1.093 618 HB3 SER 84 HB1 SER 84 68.498 -14.053 2.689 619 HG SER 84 HG SER 84 68.050 -15.440 0.803 620 H SER 85 HN SER 85 67.937 -10.815 0.745 621 HA SER 85 HA SER 85 66.401 -11.213 -1.652 622 HB2 SER 85 HB2 SER 85 64.680 -10.086 -0.394 623 HB3 SER 85 HB1 SER 85 65.813 -8.838 0.115 624 HG SER 85 HG SER 85 64.431 -8.320 -1.735 625 H GLU 86 HN GLU 86 66.867 -9.486 -3.275 626 HA GLU 86 HA GLU 86 69.389 -8.030 -2.825 627 HB2 GLU 86 HB2 GLU 86 70.334 -8.922 -4.911 628 HB3 GLU 86 HB1 GLU 86 70.019 -10.223 -3.760 629 HG2 GLU 86 HG2 GLU 86 67.831 -10.632 -4.896 630 HG3 GLU 86 HG1 GLU 86 68.273 -9.424 -6.104 631 H ALA 87 HN ALA 87 69.866 -6.539 -4.644 632 HA ALA 87 HA ALA 87 67.573 -5.744 -6.299 633 HB1 ALA 87 HB1 ALA 87 68.836 -4.002 -4.176 634 HB2 ALA 87 HB2 ALA 87 67.137 -4.444 -4.336 635 HB3 ALA 87 HB3 ALA 87 67.878 -3.353 -5.506 636 H GLN 88 HN GLN 88 68.172 -4.264 -8.011 637 HA GLN 88 HA GLN 88 71.104 -4.142 -8.512 638 HB2 GLN 88 HB2 GLN 88 68.883 -4.751 -10.469 639 HB3 GLN 88 HB1 GLN 88 70.554 -4.425 -10.925 640 HG2 GLN 88 HG2 GLN 88 71.333 -6.340 -9.638 641 HG3 GLN 88 HG1 GLN 88 69.703 -6.641 -9.038 642 HE21 GLN 88 HE21 GLN 88 71.595 -8.258 -10.890 643 HE22 GLN 88 HE22 GLN 88 70.612 -8.634 -12.222 644 H LEU 89 HN LEU 89 71.929 -2.286 -9.168 645 HA LEU 89 HA LEU 89 70.110 0.009 -9.643 646 HB2 LEU 89 HB2 LEU 89 71.506 0.294 -7.674 647 HB3 LEU 89 HB1 LEU 89 72.951 -0.110 -8.589 648 HG LEU 89 HG LEU 89 72.663 1.895 -9.978 649 HD11 LEU 89 HD11 LEU 89 70.399 2.370 -10.178 650 HD12 LEU 89 HD12 LEU 89 70.849 3.559 -8.959 651 HD13 LEU 89 HD13 LEU 89 70.067 2.054 -8.475 652 HD21 LEU 89 HD21 LEU 89 73.885 1.978 -7.783 653 HD22 LEU 89 HD22 LEU 89 72.407 2.578 -7.032 654 HD23 LEU 89 HD23 LEU 89 73.217 3.534 -8.276 655 H LYS 90 HN LYS 90 69.853 -0.099 -11.844 656 HA LYS 90 HA LYS 90 72.207 -0.329 -13.589 657 HB2 LYS 90 HB2 LYS 90 69.262 -0.111 -14.278 658 HB3 LYS 90 HB1 LYS 90 70.568 -0.456 -15.411 659 HG2 LYS 90 HG2 LYS 90 69.933 -2.220 -13.031 660 HG3 LYS 90 HG1 LYS 90 69.246 -2.479 -14.630 661 HD2 LYS 90 HD2 LYS 90 71.572 -2.650 -15.551 662 HD3 LYS 90 HD1 LYS 90 72.194 -2.537 -13.907 663 HE2 LYS 90 HE2 LYS 90 70.944 -4.546 -13.262 664 HE3 LYS 90 HE1 LYS 90 70.286 -4.669 -14.894 665 HZ1 LYS 90 HZ1 LYS 90 72.077 -6.033 -15.083 666 HZ2 LYS 90 HZ2 LYS 90 73.003 -5.183 -13.939 667 HZ3 LYS 90 HZ3 LYS 90 72.816 -4.568 -15.511 668 H VAL 91 HN VAL 91 72.294 1.162 -15.473 669 HA VAL 91 HA VAL 91 71.522 3.934 -14.710 670 HB VAL 91 HB VAL 91 74.019 2.918 -16.103 671 HG11 VAL 91 HG11 VAL 91 74.618 5.385 -16.172 672 HG12 VAL 91 HG12 VAL 91 72.931 5.725 -15.791 673 HG13 VAL 91 HG13 VAL 91 73.347 4.901 -17.293 674 HG21 VAL 91 HG21 VAL 91 73.597 4.547 -13.576 675 HG22 VAL 91 HG22 VAL 91 75.157 4.050 -14.229 676 HG23 VAL 91 HG23 VAL 91 74.027 2.838 -13.628 677 H THR 92 HN THR 92 70.226 4.919 -16.159 678 HA THR 92 HA THR 92 69.494 3.492 -18.568 679 HB THR 92 HB THR 92 67.569 4.487 -17.832 680 HG1 THR 92 HG1 THR 92 68.412 6.901 -18.914 681 HG21 THR 92 HG21 THR 92 69.404 6.555 -16.636 682 HG22 THR 92 HG22 THR 92 68.255 5.484 -15.827 683 HG23 THR 92 HG23 THR 92 67.671 6.858 -16.770 684 H ALA 93 HN ALA 93 69.400 4.572 -20.679 685 HA ALA 93 HA ALA 93 71.943 5.437 -21.508 686 HB1 ALA 93 HB1 ALA 93 69.326 5.860 -22.961 687 HB2 ALA 93 HB2 ALA 93 70.217 4.338 -22.950 688 HB3 ALA 93 HB3 ALA 93 70.938 5.775 -23.674 689 H GLY 94 HN GLY 94 72.823 7.395 -21.924 690 HA2 GLY 94 HA2 GLY 94 72.243 9.625 -20.462 691 HA3 GLY 94 HA1 GLY 94 73.062 9.693 -22.022 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 55.822 -11.329 21.491 2 H2 MET 1 HT2 MET 1 55.144 -10.116 20.515 3 H3 MET 1 HT3 MET 1 55.936 -9.702 21.961 4 HA MET 1 HA MET 1 57.251 -9.279 19.906 5 HB2 MET 1 HB2 MET 1 59.291 -10.596 20.869 6 HB3 MET 1 HB1 MET 1 58.527 -9.376 21.885 7 HG2 MET 1 HG2 MET 1 57.667 -12.268 21.981 8 HG3 MET 1 HG1 MET 1 59.007 -11.674 22.961 9 HE1 MET 1 HE1 MET 1 58.960 -9.604 24.165 10 HE2 MET 1 HE2 MET 1 58.432 -10.601 25.517 11 HE3 MET 1 HE3 MET 1 57.640 -9.058 25.207 12 H ALA 2 HN ALA 2 55.333 -11.745 19.603 13 HA ALA 2 HA ALA 2 56.667 -13.936 18.575 14 HB1 ALA 2 HB1 ALA 2 53.964 -12.780 18.202 15 HB2 ALA 2 HB2 ALA 2 54.435 -14.433 18.566 16 HB3 ALA 2 HB3 ALA 2 54.497 -13.859 16.904 17 HA PRO 3 HA PRO 3 56.670 -12.071 14.071 18 HB2 PRO 3 HB2 PRO 3 56.620 -9.180 14.370 19 HB3 PRO 3 HB1 PRO 3 55.490 -10.204 13.476 20 HG2 PRO 3 HG2 PRO 3 55.154 -8.946 16.078 21 HG3 PRO 3 HG1 PRO 3 53.946 -9.738 15.058 22 HD2 PRO 3 HD2 PRO 3 54.924 -10.766 17.468 23 HD3 PRO 3 HD1 PRO 3 54.102 -11.705 16.203 24 H GLU 4 HN GLU 4 58.713 -11.788 13.204 25 HA GLU 4 HA GLU 4 60.839 -10.859 15.028 26 HB2 GLU 4 HB2 GLU 4 62.380 -12.025 13.542 27 HB3 GLU 4 HB1 GLU 4 61.076 -13.112 14.015 28 HG2 GLU 4 HG2 GLU 4 59.914 -12.602 11.878 29 HG3 GLU 4 HG1 GLU 4 61.278 -11.594 11.396 30 H VAL 5 HN VAL 5 62.757 -10.284 12.943 31 HA VAL 5 HA VAL 5 62.209 -7.540 12.546 32 HB VAL 5 HB VAL 5 64.091 -9.094 10.770 33 HG11 VAL 5 HG11 VAL 5 63.653 -6.554 10.622 34 HG12 VAL 5 HG12 VAL 5 65.332 -7.080 10.722 35 HG13 VAL 5 HG13 VAL 5 64.523 -6.444 12.152 36 HG21 VAL 5 HG21 VAL 5 64.770 -10.047 12.791 37 HG22 VAL 5 HG22 VAL 5 64.255 -8.662 13.745 38 HG23 VAL 5 HG23 VAL 5 65.741 -8.577 12.795 39 H THR 6 HN THR 6 61.056 -6.466 10.986 40 HA THR 6 HA THR 6 59.746 -8.151 8.943 41 HB THR 6 HB THR 6 59.263 -5.247 9.619 42 HG1 THR 6 HG1 THR 6 58.306 -6.097 11.262 43 HG21 THR 6 HG21 THR 6 57.916 -7.227 7.800 44 HG22 THR 6 HG22 THR 6 58.436 -5.580 7.439 45 HG23 THR 6 HG23 THR 6 57.034 -5.857 8.473 46 H ILE 7 HN ILE 7 60.231 -8.183 6.859 47 HA ILE 7 HA ILE 7 62.203 -6.213 5.835 48 HB ILE 7 HB ILE 7 61.599 -8.951 4.744 49 HG12 ILE 7 HG12 ILE 7 62.474 -9.192 7.017 50 HG13 ILE 7 HG11 ILE 7 63.725 -9.636 5.860 51 HG21 ILE 7 HG21 ILE 7 63.794 -8.606 3.621 52 HG22 ILE 7 HG22 ILE 7 63.861 -6.981 4.304 53 HG23 ILE 7 HG23 ILE 7 62.597 -7.398 3.148 54 HD11 ILE 7 HD11 ILE 7 63.504 -7.123 7.517 55 HD12 ILE 7 HD12 ILE 7 64.518 -7.172 6.076 56 HD13 ILE 7 HD13 ILE 7 64.843 -8.261 7.423 57 H LEU 8 HN LEU 8 61.030 -4.679 4.931 58 HA LEU 8 HA LEU 8 59.182 -5.410 2.740 59 HB2 LEU 8 HB2 LEU 8 57.991 -4.454 4.752 60 HB3 LEU 8 HB1 LEU 8 58.943 -2.987 4.545 61 HG LEU 8 HG LEU 8 58.015 -2.727 2.253 62 HD11 LEU 8 HD11 LEU 8 57.384 -4.830 1.454 63 HD12 LEU 8 HD12 LEU 8 55.820 -4.179 1.928 64 HD13 LEU 8 HD13 LEU 8 56.662 -5.312 2.987 65 HD21 LEU 8 HD21 LEU 8 55.814 -1.980 2.974 66 HD22 LEU 8 HD22 LEU 8 56.961 -1.681 4.279 67 HD23 LEU 8 HD23 LEU 8 55.866 -3.059 4.370 68 H GLU 9 HN GLU 9 60.939 -5.238 1.286 69 HA GLU 9 HA GLU 9 61.977 -2.482 0.881 70 HB2 GLU 9 HB2 GLU 9 63.377 -4.990 -0.034 71 HB3 GLU 9 HB1 GLU 9 64.032 -3.364 0.164 72 HG2 GLU 9 HG2 GLU 9 63.627 -3.552 2.617 73 HG3 GLU 9 HG1 GLU 9 63.111 -5.220 2.367 74 HA PRO 10 HA PRO 10 59.605 -3.677 -2.871 75 HB2 PRO 10 HB2 PRO 10 58.706 -0.927 -3.099 76 HB3 PRO 10 HB1 PRO 10 57.740 -2.368 -2.742 77 HG2 PRO 10 HG2 PRO 10 58.298 -0.319 -0.944 78 HG3 PRO 10 HG1 PRO 10 57.742 -1.943 -0.512 79 HD2 PRO 10 HD2 PRO 10 60.487 -0.789 -0.326 80 HD3 PRO 10 HD1 PRO 10 59.720 -2.066 0.645 81 H LEU 11 HN LEU 11 62.338 -2.154 -2.229 82 HA LEU 11 HA LEU 11 62.892 -0.467 -4.420 83 HB2 LEU 11 HB2 LEU 11 64.806 -2.286 -2.934 84 HB3 LEU 11 HB1 LEU 11 65.231 -0.844 -3.858 85 HG LEU 11 HG LEU 11 63.441 -0.871 -1.412 86 HD11 LEU 11 HD11 LEU 11 65.641 -1.340 -0.644 87 HD12 LEU 11 HD12 LEU 11 65.444 0.398 -0.428 88 HD13 LEU 11 HD13 LEU 11 66.367 -0.217 -1.798 89 HD21 LEU 11 HD21 LEU 11 64.384 1.265 -3.321 90 HD22 LEU 11 HD22 LEU 11 64.078 1.684 -1.637 91 HD23 LEU 11 HD23 LEU 11 62.780 1.020 -2.623 92 H GLN 12 HN GLN 12 61.903 -1.576 -6.235 93 HA GLN 12 HA GLN 12 62.836 -4.169 -7.058 94 HB2 GLN 12 HB2 GLN 12 60.618 -2.957 -7.683 95 HB3 GLN 12 HB1 GLN 12 61.586 -2.119 -8.893 96 HG2 GLN 12 HG2 GLN 12 60.724 -3.999 -10.043 97 HG3 GLN 12 HG1 GLN 12 62.368 -4.469 -9.625 98 HE21 GLN 12 HE21 GLN 12 62.074 -6.732 -9.343 99 HE22 GLN 12 HE22 GLN 12 61.008 -7.399 -8.203 100 H ASP 13 HN ASP 13 63.026 -2.797 -9.898 101 HA ASP 13 HA ASP 13 65.929 -2.193 -9.725 102 HB2 ASP 13 HB2 ASP 13 64.235 -3.269 -11.999 103 HB3 ASP 13 HB1 ASP 13 65.922 -2.781 -12.168 104 H VAL 14 HN VAL 14 66.666 -0.222 -10.510 105 HA VAL 14 HA VAL 14 64.652 1.560 -11.793 106 HB VAL 14 HB VAL 14 65.629 3.459 -10.559 107 HG11 VAL 14 HG11 VAL 14 63.660 2.340 -9.613 108 HG12 VAL 14 HG12 VAL 14 64.732 2.867 -8.315 109 HG13 VAL 14 HG13 VAL 14 64.697 1.171 -8.795 110 HG21 VAL 14 HG21 VAL 14 67.145 2.933 -8.629 111 HG22 VAL 14 HG22 VAL 14 67.873 2.598 -10.200 112 HG23 VAL 14 HG23 VAL 14 67.249 1.274 -9.219 113 H GLN 15 HN GLN 15 65.532 3.182 -13.161 114 HA GLN 15 HA GLN 15 68.317 2.774 -14.067 115 HB2 GLN 15 HB2 GLN 15 65.835 2.797 -15.814 116 HB3 GLN 15 HB1 GLN 15 67.479 2.960 -16.435 117 HG2 GLN 15 HG2 GLN 15 68.082 0.788 -15.492 118 HG3 GLN 15 HG1 GLN 15 66.480 0.625 -14.780 119 HE21 GLN 15 HE21 GLN 15 68.099 -0.769 -17.154 120 HE22 GLN 15 HE22 GLN 15 66.908 -0.891 -18.358 121 H LEU 16 HN LEU 16 69.139 4.687 -13.474 122 HA LEU 16 HA LEU 16 67.723 7.173 -14.280 123 HB2 LEU 16 HB2 LEU 16 69.632 6.685 -11.988 124 HB3 LEU 16 HB1 LEU 16 68.902 8.235 -12.400 125 HG LEU 16 HG LEU 16 67.316 5.742 -11.734 126 HD11 LEU 16 HD11 LEU 16 66.912 6.847 -9.546 127 HD12 LEU 16 HD12 LEU 16 68.061 8.108 -9.994 128 HD13 LEU 16 HD13 LEU 16 68.611 6.444 -9.786 129 HD21 LEU 16 HD21 LEU 16 66.618 8.624 -12.316 130 HD22 LEU 16 HD22 LEU 16 65.570 7.658 -11.276 131 HD23 LEU 16 HD23 LEU 16 65.868 7.155 -12.936 132 H SER 17 HN SER 17 68.822 8.697 -15.421 133 HA SER 17 HA SER 17 71.179 7.918 -16.825 134 HB2 SER 17 HB2 SER 17 71.055 10.107 -17.855 135 HB3 SER 17 HB1 SER 17 69.428 9.443 -17.736 136 HG SER 17 HG SER 17 70.559 11.626 -16.504 137 H GLU 18 HN GLU 18 73.256 8.917 -16.783 138 HA GLU 18 HA GLU 18 74.328 9.279 -14.183 139 HB2 GLU 18 HB2 GLU 18 75.629 8.399 -16.091 140 HB3 GLU 18 HB1 GLU 18 75.563 9.987 -16.853 141 HG2 GLU 18 HG2 GLU 18 76.767 10.972 -14.951 142 HG3 GLU 18 HG1 GLU 18 76.793 9.405 -14.141 143 H GLY 19 HN GLY 19 75.118 11.088 -13.145 144 HA2 GLY 19 HA2 GLY 19 75.536 13.383 -12.812 145 HA3 GLY 19 HA1 GLY 19 74.693 13.739 -14.315 146 H GLN 20 HN GLN 20 72.917 11.555 -12.445 147 HA GLN 20 HA GLN 20 71.199 13.742 -11.396 148 HB2 GLN 20 HB2 GLN 20 69.493 12.736 -12.511 149 HB3 GLN 20 HB1 GLN 20 70.597 11.496 -13.084 150 HG2 GLN 20 HG2 GLN 20 69.155 11.402 -10.410 151 HG3 GLN 20 HG1 GLN 20 68.631 10.563 -11.864 152 HE21 GLN 20 HE21 GLN 20 69.818 9.581 -9.145 153 HE22 GLN 20 HE22 GLN 20 71.047 8.515 -9.626 154 H ASP 21 HN ASP 21 70.099 13.364 -9.390 155 HA ASP 21 HA ASP 21 71.796 12.126 -7.406 156 HB2 ASP 21 HB2 ASP 21 69.165 13.597 -7.273 157 HB3 ASP 21 HB1 ASP 21 69.927 12.891 -5.848 158 H ALA 22 HN ALA 22 71.343 10.337 -6.126 159 HA ALA 22 HA ALA 22 68.994 8.688 -6.900 160 HB1 ALA 22 HB1 ALA 22 71.804 7.732 -6.312 161 HB2 ALA 22 HB2 ALA 22 70.984 7.672 -7.869 162 HB3 ALA 22 HB3 ALA 22 70.405 6.683 -6.528 163 H SER 23 HN SER 23 68.008 7.531 -5.300 164 HA SER 23 HA SER 23 69.001 7.545 -2.574 165 HB2 SER 23 HB2 SER 23 67.961 9.753 -2.674 166 HB3 SER 23 HB1 SER 23 66.487 9.051 -3.333 167 HG SER 23 HG SER 23 67.526 8.040 -0.934 168 H PHE 24 HN PHE 24 67.755 6.147 -1.195 169 HA PHE 24 HA PHE 24 65.742 4.463 -2.574 170 HB2 PHE 24 HB2 PHE 24 68.074 3.497 -0.901 171 HB3 PHE 24 HB1 PHE 24 66.747 2.481 -1.465 172 HD1 PHE 24 HD1 PHE 24 66.232 2.611 -4.035 173 HD2 PHE 24 HD2 PHE 24 69.986 3.712 -2.264 174 HE1 PHE 24 HE1 PHE 24 67.353 2.297 -6.224 175 HE2 PHE 24 HE2 PHE 24 71.110 3.398 -4.455 176 HZ PHE 24 HZ PHE 24 69.795 2.688 -6.432 177 H GLN 25 HN GLN 25 64.219 3.467 -1.215 178 HA GLN 25 HA GLN 25 64.090 4.520 1.559 179 HB2 GLN 25 HB2 GLN 25 61.625 3.961 -0.086 180 HB3 GLN 25 HB1 GLN 25 61.801 4.977 1.345 181 HG2 GLN 25 HG2 GLN 25 61.638 6.532 -0.413 182 HG3 GLN 25 HG1 GLN 25 63.372 6.426 -0.126 183 HE21 GLN 25 HE21 GLN 25 60.949 4.555 -2.071 184 HE22 GLN 25 HE22 GLN 25 61.914 4.499 -3.465 185 H CYS 26 HN CYS 26 64.441 2.832 2.856 186 HA CYS 26 HA CYS 26 63.178 0.218 2.207 187 HB2 CYS 26 HB2 CYS 26 65.540 -0.120 2.206 188 HB3 CYS 26 HB1 CYS 26 65.762 0.878 3.640 189 HG CYS 26 HG CYS 26 64.152 -1.789 3.881 190 H ARG 27 HN ARG 27 61.857 -0.689 3.732 191 HA ARG 27 HA ARG 27 61.533 0.746 6.327 192 HB2 ARG 27 HB2 ARG 27 59.388 -0.631 4.686 193 HB3 ARG 27 HB1 ARG 27 59.152 0.237 6.204 194 HG2 ARG 27 HG2 ARG 27 60.008 2.308 5.097 195 HG3 ARG 27 HG1 ARG 27 60.104 1.418 3.582 196 HD2 ARG 27 HD2 ARG 27 57.565 1.730 5.198 197 HD3 ARG 27 HD1 ARG 27 57.992 2.751 3.827 198 HE ARG 27 HE ARG 27 58.160 0.048 3.037 199 HH11 ARG 27 HH11 ARG 27 56.673 -0.325 1.332 200 HH12 ARG 27 HH12 ARG 27 55.032 0.192 1.534 201 HH21 ARG 27 HH21 ARG 27 55.687 1.949 4.467 202 HH22 ARG 27 HH22 ARG 27 54.464 1.480 3.333 203 H LEU 28 HN LEU 28 61.922 -0.567 8.084 204 HA LEU 28 HA LEU 28 61.147 -3.387 7.907 205 HB2 LEU 28 HB2 LEU 28 63.329 -4.214 8.658 206 HB3 LEU 28 HB1 LEU 28 63.445 -3.410 7.098 207 HG LEU 28 HG LEU 28 63.920 -1.287 8.787 208 HD11 LEU 28 HD11 LEU 28 65.106 -3.755 10.104 209 HD12 LEU 28 HD12 LEU 28 63.925 -2.660 10.813 210 HD13 LEU 28 HD13 LEU 28 65.558 -2.096 10.487 211 HD21 LEU 28 HD21 LEU 28 66.373 -1.749 8.321 212 HD22 LEU 28 HD22 LEU 28 65.330 -1.767 6.899 213 HD23 LEU 28 HD23 LEU 28 65.874 -3.285 7.614 214 H SER 29 HN SER 29 60.588 -4.299 9.837 215 HA SER 29 HA SER 29 60.184 -2.488 12.031 216 HB2 SER 29 HB2 SER 29 59.169 -4.347 13.209 217 HB3 SER 29 HB1 SER 29 58.531 -4.261 11.573 218 HG SER 29 HG SER 29 60.512 -6.005 12.615 219 H ARG 30 HN ARG 30 60.914 -3.017 14.216 220 HA ARG 30 HA ARG 30 63.643 -2.894 14.430 221 HB2 ARG 30 HB2 ARG 30 63.317 -3.390 16.820 222 HB3 ARG 30 HB1 ARG 30 62.147 -2.222 16.207 223 HG2 ARG 30 HG2 ARG 30 60.488 -4.038 15.928 224 HG3 ARG 30 HG1 ARG 30 61.654 -5.190 16.576 225 HD2 ARG 30 HD2 ARG 30 60.740 -2.742 18.095 226 HD3 ARG 30 HD1 ARG 30 59.964 -4.313 18.253 227 HE ARG 30 HE ARG 30 62.538 -3.535 19.332 228 HH11 ARG 30 HH11 ARG 30 60.343 -6.066 18.459 229 HH12 ARG 30 HH12 ARG 30 61.170 -7.282 19.375 230 HH21 ARG 30 HH21 ARG 30 63.681 -5.163 20.451 231 HH22 ARG 30 HH22 ARG 30 63.057 -6.780 20.484 232 H ALA 31 HN ALA 31 65.129 -4.253 15.531 233 HA ALA 31 HA ALA 31 65.382 -6.779 14.280 234 HB1 ALA 31 HB1 ALA 31 66.973 -5.403 16.430 235 HB2 ALA 31 HB2 ALA 31 67.365 -5.557 14.718 236 HB3 ALA 31 HB3 ALA 31 67.409 -6.977 15.764 237 H SER 32 HN SER 32 65.662 -8.846 15.322 238 HA SER 32 HA SER 32 64.353 -9.140 17.954 239 HB2 SER 32 HB2 SER 32 62.755 -9.432 15.901 240 HB3 SER 32 HB1 SER 32 63.574 -10.978 15.703 241 HG SER 32 HG SER 32 61.851 -11.292 17.070 242 H GLY 33 HN GLY 33 65.615 -11.135 15.275 243 HA2 GLY 33 HA2 GLY 33 67.106 -12.760 17.245 244 HA3 GLY 33 HA1 GLY 33 66.709 -13.243 15.596 245 H GLN 34 HN GLN 34 67.626 -11.713 13.880 246 HA GLN 34 HA GLN 34 70.368 -10.890 14.623 247 HB2 GLN 34 HB2 GLN 34 70.278 -13.030 13.295 248 HB3 GLN 34 HB1 GLN 34 69.533 -12.113 11.987 249 HG2 GLN 34 HG2 GLN 34 71.919 -12.245 11.569 250 HG3 GLN 34 HG1 GLN 34 71.514 -10.584 11.999 251 HE21 GLN 34 HE21 GLN 34 73.427 -9.929 13.050 252 HE22 GLN 34 HE22 GLN 34 74.067 -10.710 14.415 253 H GLU 35 HN GLU 35 71.043 -8.934 13.895 254 HA GLU 35 HA GLU 35 69.036 -7.146 12.834 255 HB2 GLU 35 HB2 GLU 35 70.708 -6.462 14.558 256 HB3 GLU 35 HB1 GLU 35 71.977 -6.652 13.348 257 HG2 GLU 35 HG2 GLU 35 70.885 -4.959 11.924 258 HG3 GLU 35 HG1 GLU 35 69.607 -4.772 13.124 259 H ALA 36 HN ALA 36 69.095 -6.072 10.833 260 HA ALA 36 HA ALA 36 70.227 -7.582 8.672 261 HB1 ALA 36 HB1 ALA 36 68.966 -4.835 8.592 262 HB2 ALA 36 HB2 ALA 36 68.064 -6.349 8.523 263 HB3 ALA 36 HB3 ALA 36 69.196 -5.932 7.236 264 H ARG 37 HN ARG 37 71.779 -6.864 7.161 265 HA ARG 37 HA ARG 37 73.633 -4.763 8.158 266 HB2 ARG 37 HB2 ARG 37 74.331 -7.400 6.837 267 HB3 ARG 37 HB1 ARG 37 75.479 -6.183 7.401 268 HG2 ARG 37 HG2 ARG 37 74.690 -6.468 9.706 269 HG3 ARG 37 HG1 ARG 37 73.469 -7.619 9.169 270 HD2 ARG 37 HD2 ARG 37 75.200 -9.019 9.921 271 HD3 ARG 37 HD1 ARG 37 75.481 -8.945 8.184 272 HE ARG 37 HE ARG 37 77.418 -7.692 8.576 273 HH11 ARG 37 HH11 ARG 37 78.219 -9.259 10.814 274 HH12 ARG 37 HH12 ARG 37 78.271 -8.167 12.156 275 HH21 ARG 37 HH21 ARG 37 76.369 -5.726 10.576 276 HH22 ARG 37 HH22 ARG 37 77.234 -6.155 12.016 277 H TRP 38 HN TRP 38 74.634 -3.497 6.609 278 HA TRP 38 HA TRP 38 73.413 -3.543 3.913 279 HB2 TRP 38 HB2 TRP 38 73.604 -1.489 5.734 280 HB3 TRP 38 HB1 TRP 38 75.029 -1.182 4.750 281 HD1 TRP 38 HD1 TRP 38 74.677 -0.140 2.423 282 HE1 TRP 38 HE1 TRP 38 72.609 0.565 1.058 283 HE3 TRP 38 HE3 TRP 38 70.979 -2.211 5.278 284 HZ2 TRP 38 HZ2 TRP 38 69.775 0.288 1.157 285 HZ3 TRP 38 HZ3 TRP 38 68.603 -1.974 4.616 286 HH2 TRP 38 HH2 TRP 38 67.999 -0.727 2.558 287 H ALA 39 HN ALA 39 74.724 -3.261 2.048 288 HA ALA 39 HA ALA 39 77.586 -3.129 2.228 289 HB1 ALA 39 HB1 ALA 39 77.822 -5.446 1.059 290 HB2 ALA 39 HB2 ALA 39 76.242 -5.777 1.769 291 HB3 ALA 39 HB3 ALA 39 77.614 -5.397 2.810 292 H LEU 40 HN LEU 40 78.574 -2.802 0.222 293 HA LEU 40 HA LEU 40 76.776 -2.621 -2.138 294 HB2 LEU 40 HB2 LEU 40 77.384 -0.383 -1.120 295 HB3 LEU 40 HB1 LEU 40 79.064 -0.737 -1.499 296 HG LEU 40 HG LEU 40 76.923 -0.865 -3.638 297 HD11 LEU 40 HD11 LEU 40 78.507 1.587 -2.819 298 HD12 LEU 40 HD12 LEU 40 76.772 1.363 -2.601 299 HD13 LEU 40 HD13 LEU 40 77.448 1.467 -4.226 300 HD21 LEU 40 HD21 LEU 40 79.932 -0.768 -3.574 301 HD22 LEU 40 HD22 LEU 40 79.105 -0.030 -4.940 302 HD23 LEU 40 HD23 LEU 40 78.860 -1.735 -4.583 303 H GLY 41 HN GLY 41 77.485 -3.818 -3.829 304 HA2 GLY 41 HA2 GLY 41 78.995 -4.769 -5.327 305 HA3 GLY 41 HA1 GLY 41 80.317 -4.101 -4.376 306 H GLY 42 HN GLY 42 78.155 -5.686 -2.367 307 HA2 GLY 42 HA2 GLY 42 77.979 -7.977 -1.727 308 HA3 GLY 42 HA1 GLY 42 79.454 -8.324 -2.620 309 H VAL 43 HN VAL 43 80.381 -5.641 -1.248 310 HA VAL 43 HA VAL 43 81.364 -6.949 1.223 311 HB VAL 43 HB VAL 43 83.188 -5.137 0.995 312 HG11 VAL 43 HG11 VAL 43 83.568 -7.529 0.493 313 HG12 VAL 43 HG12 VAL 43 84.440 -6.496 -0.641 314 HG13 VAL 43 HG13 VAL 43 82.943 -7.283 -1.139 315 HG21 VAL 43 HG21 VAL 43 82.109 -5.113 -1.841 316 HG22 VAL 43 HG22 VAL 43 83.472 -4.185 -1.216 317 HG23 VAL 43 HG23 VAL 43 81.834 -3.817 -0.676 318 HA PRO 44 HA PRO 44 79.251 -3.875 3.670 319 HB2 PRO 44 HB2 PRO 44 81.485 -3.350 5.450 320 HB3 PRO 44 HB1 PRO 44 80.041 -4.320 5.767 321 HG2 PRO 44 HG2 PRO 44 82.723 -5.222 5.242 322 HG3 PRO 44 HG1 PRO 44 81.301 -6.183 5.664 323 HD2 PRO 44 HD2 PRO 44 82.599 -6.081 3.125 324 HD3 PRO 44 HD1 PRO 44 81.067 -6.891 3.513 325 H LEU 45 HN LEU 45 79.093 -1.619 3.698 326 HA LEU 45 HA LEU 45 81.346 -0.111 2.490 327 HB2 LEU 45 HB2 LEU 45 79.863 1.178 1.259 328 HB3 LEU 45 HB1 LEU 45 79.087 -0.399 1.216 329 HG LEU 45 HG LEU 45 78.356 1.932 3.023 330 HD11 LEU 45 HD11 LEU 45 77.705 1.854 0.513 331 HD12 LEU 45 HD12 LEU 45 76.418 2.131 1.686 332 HD13 LEU 45 HD13 LEU 45 76.634 0.532 0.973 333 HD21 LEU 45 HD21 LEU 45 78.045 -0.220 4.217 334 HD22 LEU 45 HD22 LEU 45 77.153 -0.859 2.841 335 HD23 LEU 45 HD23 LEU 45 76.490 0.476 3.780 336 H GLN 46 HN GLN 46 81.188 2.321 3.028 337 HA GLN 46 HA GLN 46 80.433 2.709 5.875 338 HB2 GLN 46 HB2 GLN 46 82.862 2.338 5.769 339 HB3 GLN 46 HB1 GLN 46 83.016 3.631 4.577 340 HG2 GLN 46 HG2 GLN 46 82.240 5.280 6.173 341 HG3 GLN 46 HG1 GLN 46 81.840 4.025 7.346 342 HE21 GLN 46 HE21 GLN 46 83.640 6.053 8.131 343 HE22 GLN 46 HE22 GLN 46 85.203 5.402 8.249 344 H ALA 47 HN ALA 47 79.391 4.548 6.298 345 HA ALA 47 HA ALA 47 78.187 6.090 4.354 346 HB1 ALA 47 HB1 ALA 47 77.644 7.665 6.123 347 HB2 ALA 47 HB2 ALA 47 78.929 7.009 7.138 348 HB3 ALA 47 HB3 ALA 47 77.523 6.019 6.745 349 H ASN 48 HN ASN 48 79.504 6.865 2.749 350 HA ASN 48 HA ASN 48 81.913 8.340 3.287 351 HB2 ASN 48 HB2 ASN 48 81.531 7.035 1.194 352 HB3 ASN 48 HB1 ASN 48 80.298 8.203 0.730 353 HD21 ASN 48 HD21 ASN 48 81.385 9.163 -1.054 354 HD22 ASN 48 HD22 ASN 48 82.863 9.987 -0.911 355 H GLU 49 HN GLU 49 82.144 10.598 2.316 356 HA GLU 49 HA GLU 49 80.473 12.368 3.710 357 HB2 GLU 49 HB2 GLU 49 82.218 12.862 1.281 358 HB3 GLU 49 HB1 GLU 49 81.507 14.128 2.282 359 HG2 GLU 49 HG2 GLU 49 83.377 11.974 3.310 360 HG3 GLU 49 HG1 GLU 49 83.874 13.613 2.900 361 H MET 50 HN MET 50 80.509 11.360 0.313 362 HA MET 50 HA MET 50 78.296 12.944 -0.513 363 HB2 MET 50 HB2 MET 50 79.451 10.402 -1.689 364 HB3 MET 50 HB1 MET 50 78.280 11.445 -2.494 365 HG2 MET 50 HG2 MET 50 81.007 12.370 -1.539 366 HG3 MET 50 HG1 MET 50 80.648 11.885 -3.194 367 HE1 MET 50 HE1 MET 50 80.865 15.541 -3.957 368 HE2 MET 50 HE2 MET 50 81.358 13.882 -4.281 369 HE3 MET 50 HE3 MET 50 81.898 14.683 -2.808 370 H ASN 51 HN ASN 51 78.623 9.645 0.704 371 HA ASN 51 HA ASN 51 75.718 9.190 0.518 372 HB2 ASN 51 HB2 ASN 51 77.341 7.464 -0.288 373 HB3 ASN 51 HB1 ASN 51 77.914 7.301 1.370 374 HD21 ASN 51 HD21 ASN 51 76.756 5.079 0.069 375 HD22 ASN 51 HD22 ASN 51 75.258 4.735 0.789 376 H ASP 52 HN ASP 52 74.652 10.037 2.228 377 HA ASP 52 HA ASP 52 75.731 9.608 4.956 378 HB2 ASP 52 HB2 ASP 52 73.712 11.605 3.903 379 HB3 ASP 52 HB1 ASP 52 74.159 11.427 5.600 380 H ILE 53 HN ILE 53 74.891 7.730 5.734 381 HA ILE 53 HA ILE 53 72.090 7.018 5.100 382 HB ILE 53 HB ILE 53 74.207 5.344 6.477 383 HG12 ILE 53 HG12 ILE 53 73.372 5.438 3.556 384 HG13 ILE 53 HG11 ILE 53 74.926 5.971 4.198 385 HG21 ILE 53 HG21 ILE 53 72.715 3.499 5.907 386 HG22 ILE 53 HG22 ILE 53 71.639 4.602 5.050 387 HG23 ILE 53 HG23 ILE 53 71.805 4.715 6.801 388 HD11 ILE 53 HD11 ILE 53 73.816 3.156 4.152 389 HD12 ILE 53 HD12 ILE 53 75.224 3.612 5.111 390 HD13 ILE 53 HD13 ILE 53 75.273 3.754 3.355 391 H THR 54 HN THR 54 70.498 7.074 6.668 392 HA THR 54 HA THR 54 71.320 7.219 9.495 393 HB THR 54 HB THR 54 71.257 9.547 8.847 394 HG1 THR 54 HG1 THR 54 69.009 8.607 10.278 395 HG21 THR 54 HG21 THR 54 68.383 9.150 8.007 396 HG22 THR 54 HG22 THR 54 69.713 9.086 6.850 397 HG23 THR 54 HG23 THR 54 69.399 10.565 7.758 398 H VAL 55 HN VAL 55 69.601 6.986 11.020 399 HA VAL 55 HA VAL 55 67.299 5.424 9.985 400 HB VAL 55 HB VAL 55 68.598 5.359 12.731 401 HG11 VAL 55 HG11 VAL 55 66.228 4.823 12.886 402 HG12 VAL 55 HG12 VAL 55 67.154 3.327 13.012 403 HG13 VAL 55 HG13 VAL 55 66.346 3.740 11.500 404 HG21 VAL 55 HG21 VAL 55 69.355 3.115 12.044 405 HG22 VAL 55 HG22 VAL 55 69.997 4.352 10.962 406 HG23 VAL 55 HG23 VAL 55 68.632 3.357 10.454 407 H GLU 56 HN GLU 56 65.243 6.055 10.507 408 HA GLU 56 HA GLU 56 64.980 8.516 12.166 409 HB2 GLU 56 HB2 GLU 56 63.375 7.616 9.761 410 HB3 GLU 56 HB1 GLU 56 62.923 8.962 10.802 411 HG2 GLU 56 HG2 GLU 56 65.553 8.752 9.309 412 HG3 GLU 56 HG1 GLU 56 64.164 9.689 8.761 413 H GLN 57 HN GLN 57 62.486 8.693 12.746 414 HA GLN 57 HA GLN 57 61.812 7.365 14.899 415 HB2 GLN 57 HB2 GLN 57 60.320 8.983 13.830 416 HB3 GLN 57 HB1 GLN 57 59.868 7.780 12.621 417 HG2 GLN 57 HG2 GLN 57 58.858 6.370 14.288 418 HG3 GLN 57 HG1 GLN 57 59.498 7.364 15.595 419 HE21 GLN 57 HE21 GLN 57 56.670 6.886 15.329 420 HE22 GLN 57 HE22 GLN 57 55.925 8.359 14.932 421 H GLY 58 HN GLY 58 60.951 5.416 15.625 422 HA2 GLY 58 HA2 GLY 58 60.620 3.134 15.648 423 HA3 GLY 58 HA1 GLY 58 59.992 3.324 14.013 424 H THR 59 HN THR 59 61.315 2.911 12.247 425 HA THR 59 HA THR 59 64.130 2.475 12.500 426 HB THR 59 HB THR 59 63.747 0.417 13.504 427 HG1 THR 59 HG1 THR 59 64.890 0.048 11.597 428 HG21 THR 59 HG21 THR 59 61.851 -1.068 12.734 429 HG22 THR 59 HG22 THR 59 61.283 0.297 11.771 430 HG23 THR 59 HG23 THR 59 61.366 0.426 13.528 431 H LEU 60 HN LEU 60 63.175 4.138 10.836 432 HA LEU 60 HA LEU 60 62.738 2.893 8.198 433 HB2 LEU 60 HB2 LEU 60 62.280 5.643 9.337 434 HB3 LEU 60 HB1 LEU 60 62.369 5.411 7.597 435 HG LEU 60 HG LEU 60 60.029 5.333 8.620 436 HD11 LEU 60 HD11 LEU 60 59.271 3.813 7.039 437 HD12 LEU 60 HD12 LEU 60 60.587 2.679 7.326 438 HD13 LEU 60 HD13 LEU 60 60.880 4.154 6.410 439 HD21 LEU 60 HD21 LEU 60 60.879 3.957 10.621 440 HD22 LEU 60 HD22 LEU 60 60.823 2.565 9.539 441 HD23 LEU 60 HD23 LEU 60 59.348 3.454 9.904 442 H HIS 61 HN HIS 61 64.348 2.858 6.709 443 HA HIS 61 HA HIS 61 66.883 4.262 7.346 444 HB2 HIS 61 HB2 HIS 61 66.297 1.779 5.723 445 HB3 HIS 61 HB1 HIS 61 67.858 2.595 5.695 446 HD1 HIS 61 HD1 HIS 61 65.485 0.974 8.211 447 HD2 HIS 61 HD2 HIS 61 69.531 1.876 7.769 448 HE1 HIS 61 HE1 HIS 61 66.675 -0.062 10.196 449 H LEU 62 HN LEU 62 67.876 5.559 5.834 450 HA LEU 62 HA LEU 62 66.530 5.935 3.234 451 HB2 LEU 62 HB2 LEU 62 67.328 8.169 5.119 452 HB3 LEU 62 HB1 LEU 62 66.727 8.362 3.478 453 HG LEU 62 HG LEU 62 64.687 6.897 4.420 454 HD11 LEU 62 HD11 LEU 62 66.009 6.849 6.711 455 HD12 LEU 62 HD12 LEU 62 64.263 7.083 6.717 456 HD13 LEU 62 HD13 LEU 62 65.343 8.465 6.914 457 HD21 LEU 62 HD21 LEU 62 63.508 9.013 4.897 458 HD22 LEU 62 HD22 LEU 62 64.544 9.191 3.481 459 HD23 LEU 62 HD23 LEU 62 65.055 9.849 5.035 460 H LEU 63 HN LEU 63 67.986 5.666 1.718 461 HA LEU 63 HA LEU 63 70.820 6.110 2.295 462 HB2 LEU 63 HB2 LEU 63 69.714 4.037 1.056 463 HB3 LEU 63 HB1 LEU 63 69.774 5.098 -0.342 464 HG LEU 63 HG LEU 63 71.784 3.888 -0.465 465 HD11 LEU 63 HD11 LEU 63 72.700 6.306 1.104 466 HD12 LEU 63 HD12 LEU 63 72.066 6.414 -0.538 467 HD13 LEU 63 HD13 LEU 63 73.520 5.480 -0.216 468 HD21 LEU 63 HD21 LEU 63 73.310 3.871 1.719 469 HD22 LEU 63 HD22 LEU 63 72.031 2.683 1.494 470 HD23 LEU 63 HD23 LEU 63 71.761 4.075 2.533 471 H THR 64 HN THR 64 71.404 8.195 2.064 472 HA THR 64 HA THR 64 70.211 9.786 -0.130 473 HB THR 64 HB THR 64 71.084 11.738 1.077 474 HG1 THR 64 HG1 THR 64 71.727 10.370 3.341 475 HG21 THR 64 HG21 THR 64 69.506 9.751 2.723 476 HG22 THR 64 HG22 THR 64 68.873 11.042 1.701 477 HG23 THR 64 HG23 THR 64 69.730 11.438 3.190 478 H LEU 65 HN LEU 65 71.377 9.180 -1.878 479 HA LEU 65 HA LEU 65 74.322 9.384 -1.760 480 HB2 LEU 65 HB2 LEU 65 73.263 7.294 -2.664 481 HB3 LEU 65 HB1 LEU 65 72.573 8.269 -3.961 482 HG LEU 65 HG LEU 65 74.867 8.992 -4.601 483 HD11 LEU 65 HD11 LEU 65 75.575 7.305 -2.227 484 HD12 LEU 65 HD12 LEU 65 76.307 8.801 -2.805 485 HD13 LEU 65 HD13 LEU 65 76.674 7.278 -3.608 486 HD21 LEU 65 HD21 LEU 65 75.602 6.629 -5.382 487 HD22 LEU 65 HD22 LEU 65 74.033 7.226 -5.912 488 HD23 LEU 65 HD23 LEU 65 74.132 6.066 -4.587 489 H HIS 66 HN HIS 66 75.277 11.133 -2.555 490 HA HIS 66 HA HIS 66 73.816 13.259 -3.777 491 HB2 HIS 66 HB2 HIS 66 75.976 13.315 -2.305 492 HB3 HIS 66 HB1 HIS 66 76.824 13.052 -3.828 493 HD1 HIS 66 HD1 HIS 66 74.166 14.807 -5.072 494 HD2 HIS 66 HD2 HIS 66 77.282 15.997 -2.576 495 HE1 HIS 66 HE1 HIS 66 74.296 17.332 -5.245 496 H LYS 67 HN LYS 67 75.917 14.084 -5.634 497 HA LYS 67 HA LYS 67 74.873 13.200 -8.056 498 HB2 LYS 67 HB2 LYS 67 77.571 14.360 -7.359 499 HB3 LYS 67 HB1 LYS 67 77.074 14.043 -9.019 500 HG2 LYS 67 HG2 LYS 67 75.145 15.512 -8.772 501 HG3 LYS 67 HG1 LYS 67 75.522 15.776 -7.069 502 HD2 LYS 67 HD2 LYS 67 77.393 16.487 -9.348 503 HD3 LYS 67 HD1 LYS 67 76.284 17.633 -8.600 504 HE2 LYS 67 HE2 LYS 67 77.936 18.072 -7.092 505 HE3 LYS 67 HE1 LYS 67 77.664 16.464 -6.422 506 HZ1 LYS 67 HZ1 LYS 67 79.771 17.420 -8.169 507 HZ2 LYS 67 HZ2 LYS 67 79.150 15.887 -8.561 508 HZ3 LYS 67 HZ3 LYS 67 79.797 16.177 -7.016 509 H VAL 68 HN VAL 68 74.686 11.016 -8.277 510 HA VAL 68 HA VAL 68 76.598 9.091 -7.606 511 HB VAL 68 HB VAL 68 74.112 8.797 -8.286 512 HG11 VAL 68 HG11 VAL 68 75.257 8.250 -11.025 513 HG12 VAL 68 HG12 VAL 68 74.670 9.863 -10.612 514 HG13 VAL 68 HG13 VAL 68 73.574 8.483 -10.548 515 HG21 VAL 68 HG21 VAL 68 74.481 6.482 -8.847 516 HG22 VAL 68 HG22 VAL 68 75.765 6.951 -7.734 517 HG23 VAL 68 HG23 VAL 68 76.092 6.827 -9.462 518 H THR 69 HN THR 69 77.680 7.639 -9.222 519 HA THR 69 HA THR 69 78.807 9.102 -11.527 520 HB THR 69 HB THR 69 81.046 8.354 -10.922 521 HG1 THR 69 HG1 THR 69 80.872 6.520 -9.837 522 HG21 THR 69 HG21 THR 69 79.703 9.559 -8.488 523 HG22 THR 69 HG22 THR 69 80.142 10.477 -9.928 524 HG23 THR 69 HG23 THR 69 81.399 9.722 -8.947 525 H LEU 70 HN LEU 70 79.756 7.621 -13.125 526 HA LEU 70 HA LEU 70 78.073 5.469 -13.753 527 HB2 LEU 70 HB2 LEU 70 79.516 6.692 -15.369 528 HB3 LEU 70 HB1 LEU 70 80.930 5.930 -14.648 529 HG LEU 70 HG LEU 70 79.944 3.693 -15.201 530 HD11 LEU 70 HD11 LEU 70 77.756 5.466 -16.249 531 HD12 LEU 70 HD12 LEU 70 77.655 3.896 -15.456 532 HD13 LEU 70 HD13 LEU 70 78.135 3.993 -17.146 533 HD21 LEU 70 HD21 LEU 70 81.620 4.660 -16.658 534 HD22 LEU 70 HD22 LEU 70 80.410 5.660 -17.461 535 HD23 LEU 70 HD23 LEU 70 80.382 3.909 -17.667 536 H GLU 71 HN GLU 71 81.197 5.603 -12.154 537 HA GLU 71 HA GLU 71 81.587 2.788 -11.899 538 HB2 GLU 71 HB2 GLU 71 82.784 5.175 -10.496 539 HB3 GLU 71 HB1 GLU 71 83.291 3.518 -10.169 540 HG2 GLU 71 HG2 GLU 71 83.914 3.207 -12.507 541 HG3 GLU 71 HG1 GLU 71 83.309 4.815 -12.910 542 H ASP 72 HN ASP 72 80.023 5.227 -9.902 543 HA ASP 72 HA ASP 72 79.864 3.729 -7.505 544 HB2 ASP 72 HB2 ASP 72 78.404 6.086 -8.651 545 HB3 ASP 72 HB1 ASP 72 77.767 5.320 -7.201 546 H ALA 73 HN ALA 73 77.677 3.934 -10.309 547 HA ALA 73 HA ALA 73 75.563 2.451 -9.209 548 HB1 ALA 73 HB1 ALA 73 76.486 2.826 -12.058 549 HB2 ALA 73 HB2 ALA 73 75.158 3.643 -11.233 550 HB3 ALA 73 HB3 ALA 73 75.026 1.931 -11.635 551 H GLY 74 HN GLY 74 75.124 0.294 -9.078 552 HA2 GLY 74 HA2 GLY 74 76.581 -1.755 -10.398 553 HA3 GLY 74 HA1 GLY 74 77.207 -1.535 -8.768 554 H THR 75 HN THR 75 76.186 -2.555 -7.127 555 HA THR 75 HA THR 75 73.355 -3.204 -7.280 556 HB THR 75 HB THR 75 75.441 -5.399 -7.191 557 HG1 THR 75 HG1 THR 75 73.787 -5.873 -9.074 558 HG21 THR 75 HG21 THR 75 72.446 -5.364 -6.820 559 HG22 THR 75 HG22 THR 75 73.672 -6.073 -5.767 560 HG23 THR 75 HG23 THR 75 73.304 -6.821 -7.321 561 H VAL 76 HN VAL 76 72.749 -2.455 -5.295 562 HA VAL 76 HA VAL 76 74.508 -2.907 -2.984 563 HB VAL 76 HB VAL 76 71.787 -1.584 -2.967 564 HG11 VAL 76 HG11 VAL 76 72.713 -2.291 -0.790 565 HG12 VAL 76 HG12 VAL 76 72.682 -0.532 -0.923 566 HG13 VAL 76 HG13 VAL 76 74.199 -1.404 -1.138 567 HG21 VAL 76 HG21 VAL 76 73.044 0.562 -3.108 568 HG22 VAL 76 HG22 VAL 76 73.219 -0.399 -4.576 569 HG23 VAL 76 HG23 VAL 76 74.527 -0.352 -3.396 570 H SER 77 HN SER 77 74.245 -4.565 -1.640 571 HA SER 77 HA SER 77 71.673 -6.040 -1.648 572 HB2 SER 77 HB2 SER 77 73.354 -7.173 -3.075 573 HB3 SER 77 HB1 SER 77 74.444 -7.254 -1.696 574 HG SER 77 HG SER 77 71.851 -8.184 -1.325 575 H PHE 78 HN PHE 78 71.067 -6.986 0.237 576 HA PHE 78 HA PHE 78 72.786 -6.758 2.609 577 HB2 PHE 78 HB2 PHE 78 70.383 -6.027 3.700 578 HB3 PHE 78 HB1 PHE 78 71.619 -4.875 3.203 579 HD1 PHE 78 HD1 PHE 78 70.696 -3.044 2.099 580 HD2 PHE 78 HD2 PHE 78 69.086 -6.958 1.352 581 HE1 PHE 78 HE1 PHE 78 69.145 -2.089 0.423 582 HE2 PHE 78 HE2 PHE 78 67.534 -5.992 -0.324 583 HZ PHE 78 HZ PHE 78 67.564 -3.562 -0.789 584 H HIS 79 HN HIS 79 72.021 -8.082 4.393 585 HA HIS 79 HA HIS 79 70.073 -10.172 3.674 586 HB2 HIS 79 HB2 HIS 79 71.748 -11.888 4.529 587 HB3 HIS 79 HB1 HIS 79 72.106 -11.179 2.953 588 HD1 HIS 79 HD1 HIS 79 73.650 -11.817 6.153 589 HD2 HIS 79 HD2 HIS 79 73.958 -8.804 3.285 590 HE1 HIS 79 HE1 HIS 79 75.877 -10.667 6.552 591 H VAL 80 HN VAL 80 69.109 -11.160 5.391 592 HA VAL 80 HA VAL 80 69.841 -10.294 8.118 593 HB VAL 80 HB VAL 80 66.950 -10.498 7.300 594 HG11 VAL 80 HG11 VAL 80 67.627 -10.379 9.702 595 HG12 VAL 80 HG12 VAL 80 66.643 -9.005 9.204 596 HG13 VAL 80 HG13 VAL 80 68.387 -8.821 9.380 597 HG21 VAL 80 HG21 VAL 80 67.117 -7.939 7.024 598 HG22 VAL 80 HG22 VAL 80 67.714 -8.933 5.696 599 HG23 VAL 80 HG23 VAL 80 68.850 -8.201 6.826 600 H GLY 81 HN GLY 81 69.781 -11.909 9.583 601 HA2 GLY 81 HA2 GLY 81 69.865 -14.553 8.954 602 HA3 GLY 81 HA1 GLY 81 69.323 -13.975 10.527 603 H THR 82 HN THR 82 67.038 -12.568 9.014 604 HA THR 82 HA THR 82 65.136 -14.747 9.249 605 HB THR 82 HB THR 82 63.446 -13.050 8.968 606 HG1 THR 82 HG1 THR 82 64.292 -11.871 7.301 607 HG21 THR 82 HG21 THR 82 65.777 -11.949 10.560 608 HG22 THR 82 HG22 THR 82 64.569 -13.087 11.154 609 HG23 THR 82 HG23 THR 82 64.096 -11.443 10.726 610 H CYS 83 HN CYS 83 65.417 -12.248 6.723 611 HA CYS 83 HA CYS 83 65.135 -14.362 4.654 612 HB2 CYS 83 HB2 CYS 83 63.021 -12.967 5.147 613 HB3 CYS 83 HB1 CYS 83 63.884 -11.633 4.381 614 HG CYS 83 HG CYS 83 64.022 -13.044 2.181 615 H SER 84 HN SER 84 65.474 -13.134 2.397 616 HA SER 84 HA SER 84 67.933 -11.483 2.595 617 HB2 SER 84 HB2 SER 84 67.387 -13.887 0.846 618 HB3 SER 84 HB1 SER 84 68.661 -12.721 0.490 619 HG SER 84 HG SER 84 68.794 -14.758 2.116 620 H SER 85 HN SER 85 68.242 -9.966 0.941 621 HA SER 85 HA SER 85 66.238 -9.666 -1.150 622 HB2 SER 85 HB2 SER 85 65.628 -7.365 -0.380 623 HB3 SER 85 HB1 SER 85 65.072 -8.635 0.706 624 HG SER 85 HG SER 85 66.172 -7.624 2.176 625 H GLU 86 HN GLU 86 66.748 -7.822 -2.577 626 HA GLU 86 HA GLU 86 69.310 -6.522 -2.305 627 HB2 GLU 86 HB2 GLU 86 70.180 -7.461 -4.478 628 HB3 GLU 86 HB1 GLU 86 70.164 -8.599 -3.132 629 HG2 GLU 86 HG2 GLU 86 68.131 -9.627 -3.941 630 HG3 GLU 86 HG1 GLU 86 67.950 -8.389 -5.185 631 H ALA 87 HN ALA 87 69.806 -5.197 -4.278 632 HA ALA 87 HA ALA 87 67.479 -4.474 -5.918 633 HB1 ALA 87 HB1 ALA 87 67.836 -2.056 -5.384 634 HB2 ALA 87 HB2 ALA 87 68.960 -2.538 -4.114 635 HB3 ALA 87 HB3 ALA 87 67.258 -2.988 -4.004 636 H GLN 88 HN GLN 88 68.049 -3.727 -7.942 637 HA GLN 88 HA GLN 88 70.959 -3.627 -8.541 638 HB2 GLN 88 HB2 GLN 88 68.568 -4.433 -10.203 639 HB3 GLN 88 HB1 GLN 88 70.128 -4.055 -10.935 640 HG2 GLN 88 HG2 GLN 88 69.990 -6.454 -10.547 641 HG3 GLN 88 HG1 GLN 88 71.186 -5.766 -9.448 642 HE21 GLN 88 HE21 GLN 88 70.958 -7.098 -7.626 643 HE22 GLN 88 HE22 GLN 88 69.497 -7.321 -6.792 644 H LEU 89 HN LEU 89 71.784 -1.726 -8.990 645 HA LEU 89 HA LEU 89 70.021 0.463 -9.942 646 HB2 LEU 89 HB2 LEU 89 71.093 0.952 -7.822 647 HB3 LEU 89 HB1 LEU 89 72.670 0.501 -8.470 648 HG LEU 89 HG LEU 89 72.555 2.377 -10.077 649 HD11 LEU 89 HD11 LEU 89 69.823 2.706 -8.843 650 HD12 LEU 89 HD12 LEU 89 70.282 2.734 -10.544 651 HD13 LEU 89 HD13 LEU 89 70.671 4.106 -9.511 652 HD21 LEU 89 HD21 LEU 89 72.535 4.241 -8.322 653 HD22 LEU 89 HD22 LEU 89 73.644 2.905 -8.030 654 HD23 LEU 89 HD23 LEU 89 72.123 2.990 -7.149 655 H LYS 90 HN LYS 90 70.096 0.472 -12.103 656 HA LYS 90 HA LYS 90 72.732 0.251 -13.452 657 HB2 LYS 90 HB2 LYS 90 69.935 -0.225 -14.526 658 HB3 LYS 90 HB1 LYS 90 71.400 -0.244 -15.503 659 HG2 LYS 90 HG2 LYS 90 72.297 -2.095 -14.155 660 HG3 LYS 90 HG1 LYS 90 70.850 -2.067 -13.142 661 HD2 LYS 90 HD2 LYS 90 69.453 -2.589 -15.102 662 HD3 LYS 90 HD1 LYS 90 70.888 -2.602 -16.128 663 HE2 LYS 90 HE2 LYS 90 71.821 -4.468 -14.835 664 HE3 LYS 90 HE1 LYS 90 70.418 -4.447 -13.767 665 HZ1 LYS 90 HZ1 LYS 90 69.495 -4.561 -16.401 666 HZ2 LYS 90 HZ2 LYS 90 69.371 -5.751 -15.193 667 HZ3 LYS 90 HZ3 LYS 90 70.708 -5.738 -16.242 668 H VAL 91 HN VAL 91 72.758 1.615 -15.537 669 HA VAL 91 HA VAL 91 71.644 4.302 -14.918 670 HB VAL 91 HB VAL 91 73.567 5.215 -16.117 671 HG11 VAL 91 HG11 VAL 91 74.266 3.157 -14.004 672 HG12 VAL 91 HG12 VAL 91 73.885 4.860 -13.739 673 HG13 VAL 91 HG13 VAL 91 75.375 4.405 -14.567 674 HG21 VAL 91 HG21 VAL 91 75.430 3.502 -16.675 675 HG22 VAL 91 HG22 VAL 91 74.059 3.596 -17.779 676 HG23 VAL 91 HG23 VAL 91 74.153 2.288 -16.599 677 H THR 92 HN THR 92 70.268 5.150 -16.331 678 HA THR 92 HA THR 92 69.362 3.705 -18.601 679 HB THR 92 HB THR 92 68.908 6.644 -18.063 680 HG1 THR 92 HG1 THR 92 67.508 6.087 -16.550 681 HG21 THR 92 HG21 THR 92 67.264 4.479 -19.410 682 HG22 THR 92 HG22 THR 92 68.064 5.829 -20.214 683 HG23 THR 92 HG23 THR 92 66.713 6.131 -19.121 684 H ALA 93 HN ALA 93 69.874 3.849 -20.719 685 HA ALA 93 HA ALA 93 71.589 6.024 -21.685 686 HB1 ALA 93 HB1 ALA 93 72.377 3.126 -22.017 687 HB2 ALA 93 HB2 ALA 93 73.110 4.222 -20.847 688 HB3 ALA 93 HB3 ALA 93 73.270 4.542 -22.574 689 H GLY 94 HN GLY 94 68.871 5.442 -22.268 690 HA2 GLY 94 HA2 GLY 94 68.663 3.944 -24.704 691 HA3 GLY 94 HA1 GLY 94 67.435 5.011 -24.031 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 55.682 -11.986 23.665 2 H2 MET 1 HT2 MET 1 54.933 -10.564 24.216 3 H3 MET 1 HT3 MET 1 56.603 -10.585 23.918 4 HA MET 1 HA MET 1 54.631 -11.122 21.784 5 HB2 MET 1 HB2 MET 1 55.811 -8.470 22.662 6 HB3 MET 1 HB1 MET 1 54.955 -8.725 21.144 7 HG2 MET 1 HG2 MET 1 52.952 -9.453 22.385 8 HG3 MET 1 HG1 MET 1 53.796 -9.187 23.909 9 HE1 MET 1 HE1 MET 1 55.059 -5.758 23.600 10 HE2 MET 1 HE2 MET 1 54.984 -7.281 24.481 11 HE3 MET 1 HE3 MET 1 53.850 -5.995 24.868 12 H ALA 2 HN ALA 2 57.512 -9.076 22.089 13 HA ALA 2 HA ALA 2 59.504 -9.070 20.943 14 HB1 ALA 2 HB1 ALA 2 59.122 -12.070 21.067 15 HB2 ALA 2 HB2 ALA 2 59.876 -11.080 22.315 16 HB3 ALA 2 HB3 ALA 2 60.638 -11.233 20.733 17 HA PRO 3 HA PRO 3 57.325 -9.754 16.913 18 HB2 PRO 3 HB2 PRO 3 58.173 -7.074 16.146 19 HB3 PRO 3 HB1 PRO 3 56.530 -7.685 16.375 20 HG2 PRO 3 HG2 PRO 3 57.828 -5.867 18.039 21 HG3 PRO 3 HG1 PRO 3 56.387 -6.808 18.460 22 HD2 PRO 3 HD2 PRO 3 59.207 -7.223 19.311 23 HD3 PRO 3 HD1 PRO 3 57.702 -7.709 20.119 24 H GLU 4 HN GLU 4 58.226 -10.260 14.937 25 HA GLU 4 HA GLU 4 61.084 -10.665 14.900 26 HB2 GLU 4 HB2 GLU 4 59.369 -12.281 13.962 27 HB3 GLU 4 HB1 GLU 4 59.114 -11.130 12.653 28 HG2 GLU 4 HG2 GLU 4 60.721 -12.770 11.891 29 HG3 GLU 4 HG1 GLU 4 61.585 -11.262 12.152 30 H VAL 5 HN VAL 5 62.523 -9.855 13.322 31 HA VAL 5 HA VAL 5 62.367 -7.102 12.778 32 HB VAL 5 HB VAL 5 63.963 -9.088 11.155 33 HG11 VAL 5 HG11 VAL 5 63.902 -6.532 10.718 34 HG12 VAL 5 HG12 VAL 5 65.477 -7.314 10.840 35 HG13 VAL 5 HG13 VAL 5 64.838 -6.401 12.208 36 HG21 VAL 5 HG21 VAL 5 64.266 -8.266 14.034 37 HG22 VAL 5 HG22 VAL 5 65.689 -8.682 13.070 38 HG23 VAL 5 HG23 VAL 5 64.410 -9.866 13.317 39 H THR 6 HN THR 6 61.424 -5.957 11.100 40 HA THR 6 HA THR 6 59.978 -7.614 9.104 41 HB THR 6 HB THR 6 58.807 -5.527 8.491 42 HG1 THR 6 HG1 THR 6 59.117 -3.739 9.826 43 HG21 THR 6 HG21 THR 6 57.750 -6.958 10.078 44 HG22 THR 6 HG22 THR 6 57.618 -5.325 10.732 45 HG23 THR 6 HG23 THR 6 58.829 -6.439 11.370 46 H ILE 7 HN ILE 7 60.428 -7.731 7.048 47 HA ILE 7 HA ILE 7 62.743 -6.200 6.010 48 HB ILE 7 HB ILE 7 61.692 -8.790 4.905 49 HG12 ILE 7 HG12 ILE 7 62.211 -9.131 7.325 50 HG13 ILE 7 HG11 ILE 7 63.308 -10.010 6.269 51 HG21 ILE 7 HG21 ILE 7 64.064 -8.977 4.137 52 HG22 ILE 7 HG22 ILE 7 64.370 -7.377 4.812 53 HG23 ILE 7 HG23 ILE 7 63.230 -7.571 3.479 54 HD11 ILE 7 HD11 ILE 7 64.996 -8.206 6.535 55 HD12 ILE 7 HD12 ILE 7 64.551 -8.927 8.081 56 HD13 ILE 7 HD13 ILE 7 63.898 -7.360 7.626 57 H LEU 8 HN LEU 8 60.584 -4.707 5.783 58 HA LEU 8 HA LEU 8 59.230 -5.248 3.240 59 HB2 LEU 8 HB2 LEU 8 57.942 -4.347 5.176 60 HB3 LEU 8 HB1 LEU 8 58.948 -2.904 5.144 61 HG LEU 8 HG LEU 8 58.169 -2.386 2.866 62 HD11 LEU 8 HD11 LEU 8 57.655 -4.350 1.741 63 HD12 LEU 8 HD12 LEU 8 56.029 -3.854 2.204 64 HD13 LEU 8 HD13 LEU 8 56.876 -5.083 3.142 65 HD21 LEU 8 HD21 LEU 8 56.872 -1.744 5.014 66 HD22 LEU 8 HD22 LEU 8 55.731 -3.005 4.545 67 HD23 LEU 8 HD23 LEU 8 56.001 -1.626 3.485 68 H GLU 9 HN GLU 9 61.264 -5.145 2.055 69 HA GLU 9 HA GLU 9 62.159 -2.364 1.513 70 HB2 GLU 9 HB2 GLU 9 63.811 -3.934 2.650 71 HB3 GLU 9 HB1 GLU 9 63.807 -4.875 1.159 72 HG2 GLU 9 HG2 GLU 9 64.855 -3.191 -0.067 73 HG3 GLU 9 HG1 GLU 9 64.328 -1.908 1.010 74 HA PRO 10 HA PRO 10 60.344 -4.106 -2.364 75 HB2 PRO 10 HB2 PRO 10 59.284 -1.470 -2.976 76 HB3 PRO 10 HB1 PRO 10 58.393 -2.939 -2.556 77 HG2 PRO 10 HG2 PRO 10 58.644 -0.664 -0.956 78 HG3 PRO 10 HG1 PRO 10 58.094 -2.258 -0.419 79 HD2 PRO 10 HD2 PRO 10 60.734 -0.950 -0.006 80 HD3 PRO 10 HD1 PRO 10 59.925 -2.197 0.960 81 H LEU 11 HN LEU 11 63.032 -3.512 -2.135 82 HA LEU 11 HA LEU 11 63.775 -1.466 -4.058 83 HB2 LEU 11 HB2 LEU 11 65.222 -3.377 -2.281 84 HB3 LEU 11 HB1 LEU 11 66.084 -2.774 -3.674 85 HG LEU 11 HG LEU 11 66.324 -1.455 -1.469 86 HD11 LEU 11 HD11 LEU 11 66.689 0.539 -2.623 87 HD12 LEU 11 HD12 LEU 11 65.334 0.286 -3.718 88 HD13 LEU 11 HD13 LEU 11 66.808 -0.659 -3.901 89 HD21 LEU 11 HD21 LEU 11 63.694 -1.508 -1.203 90 HD22 LEU 11 HD22 LEU 11 63.756 -0.076 -2.230 91 HD23 LEU 11 HD23 LEU 11 64.607 -0.095 -0.689 92 H GLN 12 HN GLN 12 62.589 -2.263 -5.876 93 HA GLN 12 HA GLN 12 63.149 -4.835 -7.016 94 HB2 GLN 12 HB2 GLN 12 61.805 -2.350 -8.097 95 HB3 GLN 12 HB1 GLN 12 61.898 -3.879 -8.974 96 HG2 GLN 12 HG2 GLN 12 60.698 -5.033 -7.220 97 HG3 GLN 12 HG1 GLN 12 60.744 -3.607 -6.187 98 HE21 GLN 12 HE21 GLN 12 58.246 -4.333 -6.446 99 HE22 GLN 12 HE22 GLN 12 57.402 -3.476 -7.641 100 H ASP 13 HN ASP 13 63.474 -1.878 -8.899 101 HA ASP 13 HA ASP 13 66.308 -1.916 -9.163 102 HB2 ASP 13 HB2 ASP 13 66.414 -2.725 -11.508 103 HB3 ASP 13 HB1 ASP 13 65.923 -3.990 -10.380 104 H VAL 14 HN VAL 14 66.946 0.037 -9.986 105 HA VAL 14 HA VAL 14 64.988 1.568 -11.618 106 HB VAL 14 HB VAL 14 65.640 3.627 -10.429 107 HG11 VAL 14 HG11 VAL 14 64.360 3.224 -8.416 108 HG12 VAL 14 HG12 VAL 14 64.698 1.494 -8.495 109 HG13 VAL 14 HG13 VAL 14 63.667 2.248 -9.709 110 HG21 VAL 14 HG21 VAL 14 67.852 3.030 -9.647 111 HG22 VAL 14 HG22 VAL 14 67.206 1.694 -8.697 112 HG23 VAL 14 HG23 VAL 14 66.849 3.357 -8.233 113 H GLN 15 HN GLN 15 65.907 3.196 -12.980 114 HA GLN 15 HA GLN 15 68.795 2.843 -13.554 115 HB2 GLN 15 HB2 GLN 15 67.827 3.383 -16.031 116 HB3 GLN 15 HB1 GLN 15 68.037 1.747 -15.426 117 HG2 GLN 15 HG2 GLN 15 65.462 3.243 -14.943 118 HG3 GLN 15 HG1 GLN 15 65.740 2.392 -16.458 119 HE21 GLN 15 HE21 GLN 15 63.839 1.762 -14.150 120 HE22 GLN 15 HE22 GLN 15 64.205 0.159 -13.730 121 H LEU 16 HN LEU 16 69.870 4.679 -13.393 122 HA LEU 16 HA LEU 16 68.478 7.258 -13.914 123 HB2 LEU 16 HB2 LEU 16 70.675 6.730 -11.907 124 HB3 LEU 16 HB1 LEU 16 69.796 8.240 -12.141 125 HG LEU 16 HG LEU 16 68.508 5.618 -11.326 126 HD11 LEU 16 HD11 LEU 16 69.180 8.052 -9.654 127 HD12 LEU 16 HD12 LEU 16 70.064 6.525 -9.621 128 HD13 LEU 16 HD13 LEU 16 68.383 6.581 -9.091 129 HD21 LEU 16 HD21 LEU 16 66.686 7.368 -10.625 130 HD22 LEU 16 HD22 LEU 16 66.814 6.918 -12.321 131 HD23 LEU 16 HD23 LEU 16 67.510 8.440 -11.757 132 H SER 17 HN SER 17 69.552 8.765 -15.118 133 HA SER 17 HA SER 17 71.929 7.877 -16.549 134 HB2 SER 17 HB2 SER 17 69.942 9.155 -17.582 135 HB3 SER 17 HB1 SER 17 70.620 10.583 -16.803 136 HG SER 17 HG SER 17 71.943 10.648 -18.424 137 H GLU 18 HN GLU 18 73.886 9.150 -16.632 138 HA GLU 18 HA GLU 18 74.961 9.792 -14.163 139 HB2 GLU 18 HB2 GLU 18 76.325 9.358 -16.145 140 HB3 GLU 18 HB1 GLU 18 75.774 10.866 -16.874 141 HG2 GLU 18 HG2 GLU 18 76.813 12.161 -15.094 142 HG3 GLU 18 HG1 GLU 18 77.245 10.688 -14.235 143 H GLY 19 HN GLY 19 75.282 11.638 -12.981 144 HA2 GLY 19 HA2 GLY 19 75.156 13.900 -12.411 145 HA3 GLY 19 HA1 GLY 19 74.332 14.221 -13.930 146 H GLN 20 HN GLN 20 72.819 11.605 -12.558 147 HA GLN 20 HA GLN 20 70.660 13.316 -11.487 148 HB2 GLN 20 HB2 GLN 20 70.685 10.451 -12.442 149 HB3 GLN 20 HB1 GLN 20 69.289 11.227 -11.699 150 HG2 GLN 20 HG2 GLN 20 69.316 12.966 -13.447 151 HG3 GLN 20 HG1 GLN 20 70.714 12.195 -14.194 152 HE21 GLN 20 HE21 GLN 20 68.856 12.239 -16.019 153 HE22 GLN 20 HE22 GLN 20 67.931 10.820 -16.115 154 H ASP 21 HN ASP 21 69.745 12.972 -9.491 155 HA ASP 21 HA ASP 21 71.480 11.966 -7.440 156 HB2 ASP 21 HB2 ASP 21 69.840 13.915 -7.251 157 HB3 ASP 21 HB1 ASP 21 68.567 12.700 -7.133 158 H ALA 22 HN ALA 22 71.003 10.251 -5.954 159 HA ALA 22 HA ALA 22 69.002 8.265 -6.859 160 HB1 ALA 22 HB1 ALA 22 71.864 7.634 -6.085 161 HB2 ALA 22 HB2 ALA 22 71.192 7.527 -7.712 162 HB3 ALA 22 HB3 ALA 22 70.609 6.449 -6.445 163 H SER 23 HN SER 23 67.929 7.255 -5.250 164 HA SER 23 HA SER 23 68.894 7.201 -2.531 165 HB2 SER 23 HB2 SER 23 66.526 8.948 -3.238 166 HB3 SER 23 HB1 SER 23 66.997 8.499 -1.600 167 HG SER 23 HG SER 23 68.768 9.742 -3.429 168 H PHE 24 HN PHE 24 67.466 6.011 -1.127 169 HA PHE 24 HA PHE 24 65.319 4.497 -2.484 170 HB2 PHE 24 HB2 PHE 24 67.512 3.302 -0.773 171 HB3 PHE 24 HB1 PHE 24 66.108 2.434 -1.387 172 HD1 PHE 24 HD1 PHE 24 69.488 3.201 -2.023 173 HD2 PHE 24 HD2 PHE 24 65.717 2.697 -4.021 174 HE1 PHE 24 HE1 PHE 24 70.676 2.737 -4.145 175 HE2 PHE 24 HE2 PHE 24 66.910 2.236 -6.147 176 HZ PHE 24 HZ PHE 24 69.389 2.254 -6.210 177 H GLN 25 HN GLN 25 63.711 3.717 -1.113 178 HA GLN 25 HA GLN 25 63.703 4.794 1.659 179 HB2 GLN 25 HB2 GLN 25 61.153 4.926 1.245 180 HB3 GLN 25 HB1 GLN 25 62.160 6.159 0.482 181 HG2 GLN 25 HG2 GLN 25 62.167 4.883 -1.618 182 HG3 GLN 25 HG1 GLN 25 61.201 3.617 -0.861 183 HE21 GLN 25 HE21 GLN 25 59.344 3.919 -2.238 184 HE22 GLN 25 HE22 GLN 25 58.396 5.324 -2.182 185 H CYS 26 HN CYS 26 63.142 3.330 3.224 186 HA CYS 26 HA CYS 26 61.769 0.849 2.476 187 HB2 CYS 26 HB2 CYS 26 64.138 0.327 2.113 188 HB3 CYS 26 HB1 CYS 26 64.515 0.849 3.755 189 HG CYS 26 HG CYS 26 63.667 -1.311 4.631 190 H ARG 27 HN ARG 27 61.225 -0.480 4.358 191 HA ARG 27 HA ARG 27 60.998 1.061 6.886 192 HB2 ARG 27 HB2 ARG 27 58.863 -0.592 5.510 193 HB3 ARG 27 HB1 ARG 27 58.720 0.093 7.128 194 HG2 ARG 27 HG2 ARG 27 58.925 2.346 6.248 195 HG3 ARG 27 HG1 ARG 27 59.244 1.730 4.628 196 HD2 ARG 27 HD2 ARG 27 56.914 2.408 4.767 197 HD3 ARG 27 HD1 ARG 27 56.992 0.651 4.650 198 HE ARG 27 HE ARG 27 56.211 0.499 6.854 199 HH11 ARG 27 HH11 ARG 27 56.536 1.605 9.011 200 HH12 ARG 27 HH12 ARG 27 55.994 3.249 9.078 201 HH21 ARG 27 HH21 ARG 27 55.700 3.565 5.636 202 HH22 ARG 27 HH22 ARG 27 55.520 4.359 7.163 203 H LEU 28 HN LEU 28 62.597 -0.112 7.965 204 HA LEU 28 HA LEU 28 62.198 -3.053 8.176 205 HB2 LEU 28 HB2 LEU 28 64.686 -1.422 8.741 206 HB3 LEU 28 HB1 LEU 28 64.555 -3.178 8.776 207 HG LEU 28 HG LEU 28 64.126 -1.430 6.336 208 HD11 LEU 28 HD11 LEU 28 66.364 -3.389 6.894 209 HD12 LEU 28 HD12 LEU 28 66.496 -1.663 7.235 210 HD13 LEU 28 HD13 LEU 28 66.260 -2.222 5.577 211 HD21 LEU 28 HD21 LEU 28 63.897 -4.393 6.856 212 HD22 LEU 28 HD22 LEU 28 64.351 -3.814 5.253 213 HD23 LEU 28 HD23 LEU 28 62.804 -3.342 5.952 214 H SER 29 HN SER 29 61.160 -3.587 10.016 215 HA SER 29 HA SER 29 61.078 -1.918 12.341 216 HB2 SER 29 HB2 SER 29 59.257 -3.514 11.908 217 HB3 SER 29 HB1 SER 29 60.389 -4.857 12.054 218 HG SER 29 HG SER 29 60.801 -3.600 14.207 219 H ARG 30 HN ARG 30 61.983 -2.438 14.415 220 HA ARG 30 HA ARG 30 64.713 -2.769 14.393 221 HB2 ARG 30 HB2 ARG 30 64.575 -3.019 16.804 222 HB3 ARG 30 HB1 ARG 30 63.469 -1.774 16.239 223 HG2 ARG 30 HG2 ARG 30 61.580 -3.295 16.415 224 HG3 ARG 30 HG1 ARG 30 62.647 -4.637 16.827 225 HD2 ARG 30 HD2 ARG 30 62.513 -2.112 18.477 226 HD3 ARG 30 HD1 ARG 30 61.490 -3.511 18.796 227 HE ARG 30 HE ARG 30 64.023 -4.550 18.693 228 HH11 ARG 30 HH11 ARG 30 62.214 -2.313 20.593 229 HH12 ARG 30 HH12 ARG 30 63.331 -2.317 21.918 230 HH21 ARG 30 HH21 ARG 30 65.597 -4.418 20.346 231 HH22 ARG 30 HH22 ARG 30 65.246 -3.510 21.779 232 H ALA 31 HN ALA 31 65.983 -4.306 15.599 233 HA ALA 31 HA ALA 31 65.955 -6.837 14.415 234 HB1 ALA 31 HB1 ALA 31 68.025 -5.923 15.135 235 HB2 ALA 31 HB2 ALA 31 67.729 -7.345 16.138 236 HB3 ALA 31 HB3 ALA 31 67.440 -5.731 16.786 237 H SER 32 HN SER 32 65.870 -8.917 15.486 238 HA SER 32 HA SER 32 64.299 -9.069 17.971 239 HB2 SER 32 HB2 SER 32 62.829 -9.237 15.818 240 HB3 SER 32 HB1 SER 32 63.554 -10.832 15.643 241 HG SER 32 HG SER 32 62.849 -11.247 17.814 242 H GLY 33 HN GLY 33 65.695 -11.051 15.365 243 HA2 GLY 33 HA2 GLY 33 66.994 -12.780 17.400 244 HA3 GLY 33 HA1 GLY 33 66.598 -13.272 15.752 245 H GLN 34 HN GLN 34 67.622 -11.889 14.008 246 HA GLN 34 HA GLN 34 70.379 -11.107 14.767 247 HB2 GLN 34 HB2 GLN 34 70.366 -13.234 13.514 248 HB3 GLN 34 HB1 GLN 34 69.502 -12.433 12.194 249 HG2 GLN 34 HG2 GLN 34 71.329 -10.940 11.779 250 HG3 GLN 34 HG1 GLN 34 72.151 -11.436 13.257 251 HE21 GLN 34 HE21 GLN 34 73.397 -11.612 10.666 252 HE22 GLN 34 HE22 GLN 34 73.640 -13.254 10.317 253 H GLU 35 HN GLU 35 71.240 -9.315 13.820 254 HA GLU 35 HA GLU 35 69.332 -7.397 12.777 255 HB2 GLU 35 HB2 GLU 35 71.009 -6.734 14.452 256 HB3 GLU 35 HB1 GLU 35 72.297 -7.132 13.313 257 HG2 GLU 35 HG2 GLU 35 71.511 -5.431 11.758 258 HG3 GLU 35 HG1 GLU 35 70.117 -5.089 12.785 259 H ALA 36 HN ALA 36 69.286 -6.503 10.788 260 HA ALA 36 HA ALA 36 70.310 -8.003 8.576 261 HB1 ALA 36 HB1 ALA 36 69.244 -6.231 7.228 262 HB2 ALA 36 HB2 ALA 36 68.995 -5.277 8.686 263 HB3 ALA 36 HB3 ALA 36 68.153 -6.814 8.486 264 H ARG 37 HN ARG 37 71.785 -7.277 6.969 265 HA ARG 37 HA ARG 37 73.649 -5.140 7.858 266 HB2 ARG 37 HB2 ARG 37 74.637 -7.400 8.152 267 HB3 ARG 37 HB1 ARG 37 74.402 -7.705 6.431 268 HG2 ARG 37 HG2 ARG 37 75.847 -5.822 5.861 269 HG3 ARG 37 HG1 ARG 37 76.025 -5.411 7.566 270 HD2 ARG 37 HD2 ARG 37 77.985 -6.656 6.860 271 HD3 ARG 37 HD1 ARG 37 77.045 -7.659 7.954 272 HE ARG 37 HE ARG 37 76.234 -8.195 5.301 273 HH11 ARG 37 HH11 ARG 37 78.496 -8.689 4.042 274 HH12 ARG 37 HH12 ARG 37 79.281 -10.064 4.742 275 HH21 ARG 37 HH21 ARG 37 77.450 -9.951 7.682 276 HH22 ARG 37 HH22 ARG 37 78.688 -10.777 6.799 277 H TRP 38 HN TRP 38 73.914 -3.568 6.501 278 HA TRP 38 HA TRP 38 72.851 -3.736 3.767 279 HB2 TRP 38 HB2 TRP 38 72.379 -1.834 5.460 280 HB3 TRP 38 HB1 TRP 38 74.027 -1.308 5.132 281 HD1 TRP 38 HD1 TRP 38 74.245 0.341 3.219 282 HE1 TRP 38 HE1 TRP 38 72.834 0.977 1.157 283 HE3 TRP 38 HE3 TRP 38 70.512 -3.108 3.621 284 HZ2 TRP 38 HZ2 TRP 38 70.434 0.117 -0.156 285 HZ3 TRP 38 HZ3 TRP 38 68.679 -3.183 1.959 286 HH2 TRP 38 HH2 TRP 38 68.632 -1.576 0.072 287 H ALA 39 HN ALA 39 74.192 -3.283 1.925 288 HA ALA 39 HA ALA 39 76.974 -2.651 2.260 289 HB1 ALA 39 HB1 ALA 39 76.169 -5.504 1.724 290 HB2 ALA 39 HB2 ALA 39 77.241 -4.893 2.983 291 HB3 ALA 39 HB3 ALA 39 77.762 -4.876 1.298 292 H LEU 40 HN LEU 40 78.124 -2.438 0.289 293 HA LEU 40 HA LEU 40 76.427 -2.392 -2.146 294 HB2 LEU 40 HB2 LEU 40 76.989 -0.118 -1.419 295 HB3 LEU 40 HB1 LEU 40 78.695 -0.544 -1.340 296 HG LEU 40 HG LEU 40 78.675 -1.001 -3.793 297 HD11 LEU 40 HD11 LEU 40 76.606 0.011 -5.000 298 HD12 LEU 40 HD12 LEU 40 75.782 -0.212 -3.457 299 HD13 LEU 40 HD13 LEU 40 76.451 -1.601 -4.311 300 HD21 LEU 40 HD21 LEU 40 79.400 1.181 -3.153 301 HD22 LEU 40 HD22 LEU 40 77.752 1.703 -2.804 302 HD23 LEU 40 HD23 LEU 40 78.255 1.428 -4.471 303 H GLY 41 HN GLY 41 77.045 -3.936 -3.517 304 HA2 GLY 41 HA2 GLY 41 78.491 -5.062 -4.968 305 HA3 GLY 41 HA1 GLY 41 79.862 -4.323 -4.143 306 H GLY 42 HN GLY 42 77.676 -5.564 -1.929 307 HA2 GLY 42 HA2 GLY 42 77.475 -7.627 -0.841 308 HA3 GLY 42 HA1 GLY 42 78.726 -8.286 -1.890 309 H VAL 43 HN VAL 43 79.776 -5.331 -0.776 310 HA VAL 43 HA VAL 43 81.310 -6.587 1.422 311 HB VAL 43 HB VAL 43 82.161 -4.098 -0.056 312 HG11 VAL 43 HG11 VAL 43 83.628 -6.296 1.432 313 HG12 VAL 43 HG12 VAL 43 83.383 -4.639 1.982 314 HG13 VAL 43 HG13 VAL 43 84.413 -4.962 0.588 315 HG21 VAL 43 HG21 VAL 43 82.640 -6.985 -0.860 316 HG22 VAL 43 HG22 VAL 43 83.497 -5.602 -1.538 317 HG23 VAL 43 HG23 VAL 43 81.759 -5.771 -1.790 318 HA PRO 44 HA PRO 44 79.083 -3.814 4.180 319 HB2 PRO 44 HB2 PRO 44 81.376 -3.358 5.908 320 HB3 PRO 44 HB1 PRO 44 79.968 -4.385 6.210 321 HG2 PRO 44 HG2 PRO 44 82.657 -5.151 5.405 322 HG3 PRO 44 HG1 PRO 44 81.336 -6.170 5.996 323 HD2 PRO 44 HD2 PRO 44 82.286 -6.142 3.378 324 HD3 PRO 44 HD1 PRO 44 80.698 -6.764 3.871 325 H LEU 45 HN LEU 45 78.802 -1.614 4.173 326 HA LEU 45 HA LEU 45 80.982 0.042 3.031 327 HB2 LEU 45 HB2 LEU 45 79.450 1.141 1.711 328 HB3 LEU 45 HB1 LEU 45 78.673 -0.430 1.818 329 HG LEU 45 HG LEU 45 77.988 2.017 3.489 330 HD11 LEU 45 HD11 LEU 45 76.347 0.525 1.433 331 HD12 LEU 45 HD12 LEU 45 77.302 1.960 1.057 332 HD13 LEU 45 HD13 LEU 45 75.963 2.067 2.202 333 HD21 LEU 45 HD21 LEU 45 77.703 -0.253 4.660 334 HD22 LEU 45 HD22 LEU 45 76.545 -0.654 3.395 335 HD23 LEU 45 HD23 LEU 45 76.235 0.697 4.482 336 H GLN 46 HN GLN 46 80.606 2.460 3.536 337 HA GLN 46 HA GLN 46 79.772 2.874 6.338 338 HB2 GLN 46 HB2 GLN 46 82.442 3.653 5.133 339 HB3 GLN 46 HB1 GLN 46 81.841 4.262 6.673 340 HG2 GLN 46 HG2 GLN 46 82.249 1.326 6.016 341 HG3 GLN 46 HG1 GLN 46 83.372 2.310 6.951 342 HE21 GLN 46 HE21 GLN 46 81.221 -0.020 7.519 343 HE22 GLN 46 HE22 GLN 46 80.528 0.515 8.973 344 H ALA 47 HN ALA 47 79.140 5.005 6.836 345 HA ALA 47 HA ALA 47 77.882 6.421 4.727 346 HB1 ALA 47 HB1 ALA 47 78.515 7.679 7.392 347 HB2 ALA 47 HB2 ALA 47 77.325 6.384 7.269 348 HB3 ALA 47 HB3 ALA 47 77.086 7.884 6.377 349 H ASN 48 HN ASN 48 79.730 6.675 3.276 350 HA ASN 48 HA ASN 48 81.926 8.357 3.979 351 HB2 ASN 48 HB2 ASN 48 80.966 7.831 1.174 352 HB3 ASN 48 HB1 ASN 48 82.608 8.149 1.730 353 HD21 ASN 48 HD21 ASN 48 83.603 6.405 3.160 354 HD22 ASN 48 HD22 ASN 48 83.116 4.796 2.919 355 H GLU 49 HN GLU 49 82.350 10.274 2.345 356 HA GLU 49 HA GLU 49 80.644 12.378 3.096 357 HB2 GLU 49 HB2 GLU 49 82.671 12.224 0.846 358 HB3 GLU 49 HB1 GLU 49 81.910 13.710 1.412 359 HG2 GLU 49 HG2 GLU 49 83.923 13.695 2.614 360 HG3 GLU 49 HG1 GLU 49 82.796 12.987 3.768 361 H MET 50 HN MET 50 80.942 10.574 0.049 362 HA MET 50 HA MET 50 78.708 12.007 -1.145 363 HB2 MET 50 HB2 MET 50 79.128 10.635 -3.098 364 HB3 MET 50 HB1 MET 50 80.667 11.241 -2.496 365 HG2 MET 50 HG2 MET 50 80.911 9.061 -1.221 366 HG3 MET 50 HG1 MET 50 79.506 8.470 -2.107 367 HE1 MET 50 HE1 MET 50 80.313 7.925 -5.514 368 HE2 MET 50 HE2 MET 50 80.235 9.681 -5.403 369 HE3 MET 50 HE3 MET 50 79.171 8.695 -4.406 370 H ASN 51 HN ASN 51 79.193 9.262 0.831 371 HA ASN 51 HA ASN 51 76.471 8.231 0.220 372 HB2 ASN 51 HB2 ASN 51 78.812 6.805 1.510 373 HB3 ASN 51 HB1 ASN 51 77.235 6.102 1.147 374 HD21 ASN 51 HD21 ASN 51 80.077 5.566 0.019 375 HD22 ASN 51 HD22 ASN 51 79.853 5.645 -1.661 376 H ASP 52 HN ASP 52 75.128 9.237 1.653 377 HA ASP 52 HA ASP 52 75.923 9.262 4.515 378 HB2 ASP 52 HB2 ASP 52 74.090 11.117 2.975 379 HB3 ASP 52 HB1 ASP 52 74.243 11.109 4.732 380 H ILE 53 HN ILE 53 74.733 8.106 5.867 381 HA ILE 53 HA ILE 53 72.090 7.096 4.958 382 HB ILE 53 HB ILE 53 74.101 5.633 6.692 383 HG12 ILE 53 HG12 ILE 53 73.384 5.278 3.764 384 HG13 ILE 53 HG11 ILE 53 74.926 5.871 4.378 385 HG21 ILE 53 HG21 ILE 53 71.639 4.605 5.258 386 HG22 ILE 53 HG22 ILE 53 71.612 5.126 6.942 387 HG23 ILE 53 HG23 ILE 53 72.613 3.760 6.457 388 HD11 ILE 53 HD11 ILE 53 75.247 3.546 3.919 389 HD12 ILE 53 HD12 ILE 53 73.738 3.112 4.723 390 HD13 ILE 53 HD13 ILE 53 75.107 3.685 5.674 391 H THR 54 HN THR 54 70.429 7.401 6.362 392 HA THR 54 HA THR 54 71.061 8.102 9.167 393 HB THR 54 HB THR 54 70.785 10.238 8.067 394 HG1 THR 54 HG1 THR 54 69.414 10.934 9.517 395 HG21 THR 54 HG21 THR 54 68.097 9.234 7.101 396 HG22 THR 54 HG22 THR 54 69.536 9.319 6.087 397 HG23 THR 54 HG23 THR 54 68.834 10.795 6.753 398 H VAL 55 HN VAL 55 69.376 7.752 10.641 399 HA VAL 55 HA VAL 55 67.307 5.843 9.701 400 HB VAL 55 HB VAL 55 68.746 6.114 12.349 401 HG11 VAL 55 HG11 VAL 55 67.332 3.992 12.862 402 HG12 VAL 55 HG12 VAL 55 66.267 4.570 11.580 403 HG13 VAL 55 HG13 VAL 55 66.553 5.564 13.013 404 HG21 VAL 55 HG21 VAL 55 69.423 3.778 11.821 405 HG22 VAL 55 HG22 VAL 55 69.979 4.921 10.594 406 HG23 VAL 55 HG23 VAL 55 68.576 3.903 10.278 407 H GLU 56 HN GLU 56 65.225 6.342 9.993 408 HA GLU 56 HA GLU 56 64.552 8.805 11.498 409 HB2 GLU 56 HB2 GLU 56 63.195 7.412 9.182 410 HB3 GLU 56 HB1 GLU 56 62.473 8.751 10.073 411 HG2 GLU 56 HG2 GLU 56 65.209 8.896 8.782 412 HG3 GLU 56 HG1 GLU 56 63.735 9.434 7.980 413 H GLN 57 HN GLN 57 62.454 8.827 12.582 414 HA GLN 57 HA GLN 57 62.175 6.899 14.532 415 HB2 GLN 57 HB2 GLN 57 61.096 9.142 14.544 416 HB3 GLN 57 HB1 GLN 57 59.935 8.549 13.356 417 HG2 GLN 57 HG2 GLN 57 59.093 6.892 14.892 418 HG3 GLN 57 HG1 GLN 57 60.374 7.242 16.051 419 HE21 GLN 57 HE21 GLN 57 57.522 7.462 16.651 420 HE22 GLN 57 HE22 GLN 57 57.210 9.097 16.989 421 H GLY 58 HN GLY 58 60.740 5.163 14.871 422 HA2 GLY 58 HA2 GLY 58 59.296 3.434 14.301 423 HA3 GLY 58 HA1 GLY 58 59.041 4.201 12.738 424 H THR 59 HN THR 59 62.311 3.883 13.544 425 HA THR 59 HA THR 59 64.001 2.537 12.809 426 HB THR 59 HB THR 59 62.080 0.322 12.160 427 HG1 THR 59 HG1 THR 59 62.709 1.346 14.712 428 HG21 THR 59 HG21 THR 59 64.733 0.370 13.628 429 HG22 THR 59 HG22 THR 59 64.570 0.096 11.893 430 HG23 THR 59 HG23 THR 59 63.879 -1.057 13.035 431 H LEU 60 HN LEU 60 62.341 4.230 11.014 432 HA LEU 60 HA LEU 60 62.266 2.837 8.481 433 HB2 LEU 60 HB2 LEU 60 61.692 5.618 9.435 434 HB3 LEU 60 HB1 LEU 60 61.997 5.379 7.712 435 HG LEU 60 HG LEU 60 60.224 3.696 7.608 436 HD11 LEU 60 HD11 LEU 60 59.982 4.245 10.571 437 HD12 LEU 60 HD12 LEU 60 60.323 2.704 9.791 438 HD13 LEU 60 HD13 LEU 60 58.730 3.439 9.638 439 HD21 LEU 60 HD21 LEU 60 59.535 5.969 7.200 440 HD22 LEU 60 HD22 LEU 60 59.440 6.305 8.927 441 HD23 LEU 60 HD23 LEU 60 58.283 5.203 8.179 442 H HIS 61 HN HIS 61 63.749 2.816 6.897 443 HA HIS 61 HA HIS 61 66.384 4.029 7.465 444 HB2 HIS 61 HB2 HIS 61 65.906 1.459 7.033 445 HB3 HIS 61 HB1 HIS 61 65.919 1.946 5.346 446 HD1 HIS 61 HD1 HIS 61 68.091 0.114 5.928 447 HD2 HIS 61 HD2 HIS 61 68.561 4.168 6.779 448 HE1 HIS 61 HE1 HIS 61 70.584 0.545 6.039 449 H LEU 62 HN LEU 62 67.535 5.061 5.748 450 HA LEU 62 HA LEU 62 66.154 5.656 3.267 451 HB2 LEU 62 HB2 LEU 62 65.184 7.380 4.610 452 HB3 LEU 62 HB1 LEU 62 66.731 7.762 5.357 453 HG LEU 62 HG LEU 62 67.593 8.657 3.279 454 HD11 LEU 62 HD11 LEU 62 66.754 7.232 1.593 455 HD12 LEU 62 HD12 LEU 62 65.913 8.753 1.294 456 HD13 LEU 62 HD13 LEU 62 65.083 7.437 2.120 457 HD21 LEU 62 HD21 LEU 62 66.056 10.074 4.678 458 HD22 LEU 62 HD22 LEU 62 64.733 9.609 3.607 459 HD23 LEU 62 HD23 LEU 62 66.094 10.539 2.978 460 H LEU 63 HN LEU 63 67.685 5.156 1.872 461 HA LEU 63 HA LEU 63 70.497 5.588 2.488 462 HB2 LEU 63 HB2 LEU 63 69.425 3.555 1.259 463 HB3 LEU 63 HB1 LEU 63 69.344 4.622 -0.134 464 HG LEU 63 HG LEU 63 71.367 3.483 -0.447 465 HD11 LEU 63 HD11 LEU 63 72.254 5.934 1.099 466 HD12 LEU 63 HD12 LEU 63 71.681 5.950 -0.571 467 HD13 LEU 63 HD13 LEU 63 73.151 5.083 -0.151 468 HD21 LEU 63 HD21 LEU 63 72.026 3.887 2.486 469 HD22 LEU 63 HD22 LEU 63 72.990 2.999 1.312 470 HD23 LEU 63 HD23 LEU 63 71.398 2.400 1.783 471 H THR 64 HN THR 64 71.144 7.707 2.275 472 HA THR 64 HA THR 64 69.992 9.302 0.070 473 HB THR 64 HB THR 64 71.702 10.191 2.409 474 HG1 THR 64 HG1 THR 64 68.912 10.440 1.972 475 HG21 THR 64 HG21 THR 64 70.704 12.430 1.733 476 HG22 THR 64 HG22 THR 64 70.171 11.645 0.245 477 HG23 THR 64 HG23 THR 64 71.891 11.763 0.612 478 H LEU 65 HN LEU 65 71.094 8.750 -1.728 479 HA LEU 65 HA LEU 65 74.056 8.935 -1.659 480 HB2 LEU 65 HB2 LEU 65 73.241 6.745 -2.381 481 HB3 LEU 65 HB1 LEU 65 72.224 7.499 -3.604 482 HG LEU 65 HG LEU 65 74.179 8.319 -4.795 483 HD11 LEU 65 HD11 LEU 65 76.472 7.390 -3.901 484 HD12 LEU 65 HD12 LEU 65 75.627 7.311 -2.355 485 HD13 LEU 65 HD13 LEU 65 75.801 8.855 -3.190 486 HD21 LEU 65 HD21 LEU 65 74.392 5.404 -3.983 487 HD22 LEU 65 HD22 LEU 65 75.256 6.109 -5.349 488 HD23 LEU 65 HD23 LEU 65 73.494 6.053 -5.355 489 H HIS 66 HN HIS 66 74.900 10.726 -2.503 490 HA HIS 66 HA HIS 66 73.603 11.997 -4.831 491 HB2 HIS 66 HB2 HIS 66 72.970 13.158 -2.639 492 HB3 HIS 66 HB1 HIS 66 74.668 13.619 -2.514 493 HD1 HIS 66 HD1 HIS 66 72.421 13.532 -5.594 494 HD2 HIS 66 HD2 HIS 66 74.676 16.256 -3.387 495 HE1 HIS 66 HE1 HIS 66 72.333 15.723 -6.858 496 H LYS 67 HN LYS 67 75.147 13.831 -5.636 497 HA LYS 67 HA LYS 67 77.137 14.268 -6.702 498 HB2 LYS 67 HB2 LYS 67 78.187 13.216 -4.063 499 HB3 LYS 67 HB1 LYS 67 79.202 13.956 -5.300 500 HG2 LYS 67 HG2 LYS 67 77.807 16.007 -5.184 501 HG3 LYS 67 HG1 LYS 67 76.857 15.268 -3.897 502 HD2 LYS 67 HD2 LYS 67 78.884 15.078 -2.502 503 HD3 LYS 67 HD1 LYS 67 79.839 15.812 -3.791 504 HE2 LYS 67 HE2 LYS 67 79.247 17.515 -2.140 505 HE3 LYS 67 HE1 LYS 67 78.408 17.844 -3.657 506 HZ1 LYS 67 HZ1 LYS 67 76.460 17.603 -2.663 507 HZ2 LYS 67 HZ2 LYS 67 77.270 17.522 -1.171 508 HZ3 LYS 67 HZ3 LYS 67 76.892 16.097 -2.016 509 H VAL 68 HN VAL 68 76.081 12.164 -7.791 510 HA VAL 68 HA VAL 68 78.080 9.978 -7.783 511 HB VAL 68 HB VAL 68 76.317 8.648 -8.887 512 HG11 VAL 68 HG11 VAL 68 75.074 8.226 -6.932 513 HG12 VAL 68 HG12 VAL 68 75.163 9.907 -6.400 514 HG13 VAL 68 HG13 VAL 68 76.597 8.883 -6.338 515 HG21 VAL 68 HG21 VAL 68 74.730 11.201 -8.512 516 HG22 VAL 68 HG22 VAL 68 73.979 9.637 -8.823 517 HG23 VAL 68 HG23 VAL 68 75.057 10.351 -10.021 518 H THR 69 HN THR 69 78.700 9.047 -9.748 519 HA THR 69 HA THR 69 78.307 10.642 -12.194 520 HB THR 69 HB THR 69 80.644 10.552 -12.755 521 HG1 THR 69 HG1 THR 69 81.738 9.697 -10.508 522 HG21 THR 69 HG21 THR 69 80.504 11.402 -9.856 523 HG22 THR 69 HG22 THR 69 79.815 12.355 -11.171 524 HG23 THR 69 HG23 THR 69 81.550 12.049 -11.120 525 H LEU 70 HN LEU 70 80.317 8.895 -13.517 526 HA LEU 70 HA LEU 70 78.605 6.907 -14.478 527 HB2 LEU 70 HB2 LEU 70 81.605 7.217 -14.509 528 HB3 LEU 70 HB1 LEU 70 80.834 5.809 -15.236 529 HG LEU 70 HG LEU 70 79.860 8.575 -15.961 530 HD11 LEU 70 HD11 LEU 70 82.188 7.147 -17.280 531 HD12 LEU 70 HD12 LEU 70 82.335 8.580 -16.264 532 HD13 LEU 70 HD13 LEU 70 81.469 8.671 -17.797 533 HD21 LEU 70 HD21 LEU 70 80.130 6.091 -17.673 534 HD22 LEU 70 HD22 LEU 70 79.114 7.503 -17.961 535 HD23 LEU 70 HD23 LEU 70 78.713 6.379 -16.669 536 H GLU 71 HN GLU 71 80.551 7.038 -11.636 537 HA GLU 71 HA GLU 71 80.722 4.225 -11.141 538 HB2 GLU 71 HB2 GLU 71 81.010 6.630 -9.326 539 HB3 GLU 71 HB1 GLU 71 81.294 4.968 -8.808 540 HG2 GLU 71 HG2 GLU 71 83.444 5.711 -9.405 541 HG3 GLU 71 HG1 GLU 71 82.918 4.842 -10.845 542 H ASP 72 HN ASP 72 78.083 6.189 -11.277 543 HA ASP 72 HA ASP 72 76.610 5.625 -8.967 544 HB2 ASP 72 HB2 ASP 72 75.912 7.229 -10.750 545 HB3 ASP 72 HB1 ASP 72 75.521 5.856 -11.784 546 H ALA 73 HN ALA 73 77.060 3.761 -11.938 547 HA ALA 73 HA ALA 73 75.190 1.741 -11.508 548 HB1 ALA 73 HB1 ALA 73 77.925 1.264 -12.690 549 HB2 ALA 73 HB2 ALA 73 76.648 2.109 -13.565 550 HB3 ALA 73 HB3 ALA 73 76.413 0.434 -13.067 551 H GLY 74 HN GLY 74 75.278 -0.266 -10.538 552 HA2 GLY 74 HA2 GLY 74 77.409 -1.501 -9.271 553 HA3 GLY 74 HA1 GLY 74 76.696 -0.422 -8.075 554 H THR 75 HN THR 75 76.195 -2.419 -6.909 555 HA THR 75 HA THR 75 73.510 -3.344 -7.561 556 HB THR 75 HB THR 75 75.808 -5.298 -7.282 557 HG1 THR 75 HG1 THR 75 74.961 -5.825 -9.457 558 HG21 THR 75 HG21 THR 75 73.954 -6.934 -7.878 559 HG22 THR 75 HG22 THR 75 72.817 -5.627 -7.549 560 HG23 THR 75 HG23 THR 75 73.858 -6.235 -6.263 561 H VAL 76 HN VAL 76 72.544 -2.840 -5.695 562 HA VAL 76 HA VAL 76 73.931 -2.994 -3.159 563 HB VAL 76 HB VAL 76 71.782 -2.221 -2.219 564 HG11 VAL 76 HG11 VAL 76 71.612 -0.100 -3.644 565 HG12 VAL 76 HG12 VAL 76 72.837 -0.825 -4.687 566 HG13 VAL 76 HG13 VAL 76 73.212 -0.474 -3.000 567 HG21 VAL 76 HG21 VAL 76 70.852 -2.657 -5.071 568 HG22 VAL 76 HG22 VAL 76 69.963 -1.673 -3.906 569 HG23 VAL 76 HG23 VAL 76 70.203 -3.393 -3.603 570 H SER 77 HN SER 77 73.771 -4.558 -1.628 571 HA SER 77 HA SER 77 71.726 -6.656 -1.888 572 HB2 SER 77 HB2 SER 77 73.731 -7.469 -3.132 573 HB3 SER 77 HB1 SER 77 74.674 -7.297 -1.656 574 HG SER 77 HG SER 77 73.320 -8.801 -0.670 575 H PHE 78 HN PHE 78 71.212 -7.673 0.008 576 HA PHE 78 HA PHE 78 72.752 -7.144 2.428 577 HB2 PHE 78 HB2 PHE 78 70.716 -6.308 3.628 578 HB3 PHE 78 HB1 PHE 78 71.332 -5.195 2.406 579 HD1 PHE 78 HD1 PHE 78 70.139 -4.827 0.314 580 HD2 PHE 78 HD2 PHE 78 68.623 -7.535 3.282 581 HE1 PHE 78 HE1 PHE 78 67.940 -4.844 -0.829 582 HE2 PHE 78 HE2 PHE 78 66.423 -7.556 2.138 583 HZ PHE 78 HZ PHE 78 66.082 -6.204 0.084 584 H HIS 79 HN HIS 79 72.220 -8.561 4.149 585 HA HIS 79 HA HIS 79 70.348 -10.764 3.484 586 HB2 HIS 79 HB2 HIS 79 72.615 -11.494 2.901 587 HB3 HIS 79 HB1 HIS 79 73.176 -11.073 4.518 588 HD1 HIS 79 HD1 HIS 79 71.075 -13.582 2.670 589 HD2 HIS 79 HD2 HIS 79 72.400 -12.891 6.562 590 HE1 HIS 79 HE1 HIS 79 70.535 -15.672 3.990 591 H VAL 80 HN VAL 80 69.054 -11.325 5.110 592 HA VAL 80 HA VAL 80 69.771 -10.538 7.879 593 HB VAL 80 HB VAL 80 66.934 -10.509 6.869 594 HG11 VAL 80 HG11 VAL 80 66.799 -8.715 8.671 595 HG12 VAL 80 HG12 VAL 80 68.421 -9.197 9.156 596 HG13 VAL 80 HG13 VAL 80 67.096 -10.351 9.244 597 HG21 VAL 80 HG21 VAL 80 67.910 -9.031 5.319 598 HG22 VAL 80 HG22 VAL 80 69.072 -8.418 6.493 599 HG23 VAL 80 HG23 VAL 80 67.371 -7.964 6.613 600 H GLY 81 HN GLY 81 69.616 -12.132 9.341 601 HA2 GLY 81 HA2 GLY 81 69.472 -14.783 8.841 602 HA3 GLY 81 HA1 GLY 81 68.919 -14.099 10.365 603 H THR 82 HN THR 82 66.789 -12.605 8.744 604 HA THR 82 HA THR 82 64.788 -14.734 8.895 605 HB THR 82 HB THR 82 63.211 -12.794 8.426 606 HG1 THR 82 HG1 THR 82 65.300 -11.100 9.129 607 HG21 THR 82 HG21 THR 82 63.560 -11.818 10.708 608 HG22 THR 82 HG22 THR 82 65.090 -12.691 10.801 609 HG23 THR 82 HG23 THR 82 63.571 -13.581 10.694 610 H CYS 83 HN CYS 83 65.197 -12.076 6.570 611 HA CYS 83 HA CYS 83 64.960 -14.021 4.342 612 HB2 CYS 83 HB2 CYS 83 62.805 -12.661 4.973 613 HB3 CYS 83 HB1 CYS 83 63.631 -11.329 4.162 614 HG CYS 83 HG CYS 83 63.361 -14.016 2.615 615 H SER 84 HN SER 84 65.775 -13.181 2.293 616 HA SER 84 HA SER 84 67.697 -10.945 2.560 617 HB2 SER 84 HB2 SER 84 68.306 -13.596 1.236 618 HB3 SER 84 HB1 SER 84 69.394 -12.220 1.392 619 HG SER 84 HG SER 84 68.997 -14.188 3.107 620 H SER 85 HN SER 85 68.251 -9.930 0.557 621 HA SER 85 HA SER 85 66.867 -10.705 -1.860 622 HB2 SER 85 HB2 SER 85 65.871 -8.494 -0.120 623 HB3 SER 85 HB1 SER 85 65.758 -8.303 -1.869 624 HG SER 85 HG SER 85 63.981 -9.415 -0.615 625 H GLU 86 HN GLU 86 67.326 -9.261 -3.660 626 HA GLU 86 HA GLU 86 69.595 -7.423 -3.291 627 HB2 GLU 86 HB2 GLU 86 70.542 -9.663 -3.794 628 HB3 GLU 86 HB1 GLU 86 69.595 -9.709 -5.279 629 HG2 GLU 86 HG2 GLU 86 70.740 -7.693 -6.093 630 HG3 GLU 86 HG1 GLU 86 71.663 -7.600 -4.593 631 H ALA 87 HN ALA 87 69.813 -5.899 -4.934 632 HA ALA 87 HA ALA 87 67.713 -5.819 -7.017 633 HB1 ALA 87 HB1 ALA 87 67.122 -4.385 -5.018 634 HB2 ALA 87 HB2 ALA 87 67.239 -3.519 -6.551 635 HB3 ALA 87 HB3 ALA 87 68.553 -3.424 -5.379 636 H GLN 88 HN GLN 88 68.265 -4.587 -8.861 637 HA GLN 88 HA GLN 88 71.183 -4.212 -9.218 638 HB2 GLN 88 HB2 GLN 88 68.969 -4.878 -11.155 639 HB3 GLN 88 HB1 GLN 88 70.576 -4.379 -11.678 640 HG2 GLN 88 HG2 GLN 88 71.578 -6.245 -10.434 641 HG3 GLN 88 HG1 GLN 88 69.984 -6.734 -9.858 642 HE21 GLN 88 HE21 GLN 88 71.111 -8.746 -11.187 643 HE22 GLN 88 HE22 GLN 88 70.563 -8.871 -12.786 644 H LEU 89 HN LEU 89 71.999 -2.321 -9.801 645 HA LEU 89 HA LEU 89 70.149 -0.059 -10.305 646 HB2 LEU 89 HB2 LEU 89 71.420 0.073 -8.162 647 HB3 LEU 89 HB1 LEU 89 72.920 0.006 -9.080 648 HG LEU 89 HG LEU 89 72.272 2.078 -10.278 649 HD11 LEU 89 HD11 LEU 89 70.327 3.366 -9.021 650 HD12 LEU 89 HD12 LEU 89 69.783 1.739 -8.620 651 HD13 LEU 89 HD13 LEU 89 69.946 2.227 -10.307 652 HD21 LEU 89 HD21 LEU 89 72.192 2.253 -7.249 653 HD22 LEU 89 HD22 LEU 89 72.535 3.604 -8.328 654 HD23 LEU 89 HD23 LEU 89 73.641 2.231 -8.250 655 H LYS 90 HN LYS 90 70.132 -0.109 -12.529 656 HA LYS 90 HA LYS 90 72.680 -0.148 -13.991 657 HB2 LYS 90 HB2 LYS 90 70.461 -1.432 -14.591 658 HB3 LYS 90 HB1 LYS 90 69.981 0.102 -15.304 659 HG2 LYS 90 HG2 LYS 90 71.978 0.104 -16.728 660 HG3 LYS 90 HG1 LYS 90 72.554 -1.375 -15.969 661 HD2 LYS 90 HD2 LYS 90 69.862 -1.263 -17.327 662 HD3 LYS 90 HD1 LYS 90 71.334 -1.571 -18.245 663 HE2 LYS 90 HE2 LYS 90 71.826 -3.479 -16.667 664 HE3 LYS 90 HE1 LYS 90 70.232 -3.234 -15.962 665 HZ1 LYS 90 HZ1 LYS 90 70.090 -3.322 -18.793 666 HZ2 LYS 90 HZ2 LYS 90 69.283 -4.277 -17.645 667 HZ3 LYS 90 HZ3 LYS 90 70.830 -4.725 -18.187 668 H VAL 91 HN VAL 91 72.808 1.421 -15.875 669 HA VAL 91 HA VAL 91 71.938 4.134 -15.041 670 HB VAL 91 HB VAL 91 74.485 3.191 -16.382 671 HG11 VAL 91 HG11 VAL 91 75.007 5.755 -16.192 672 HG12 VAL 91 HG12 VAL 91 73.252 5.935 -16.174 673 HG13 VAL 91 HG13 VAL 91 74.047 5.178 -17.553 674 HG21 VAL 91 HG21 VAL 91 75.581 4.002 -14.435 675 HG22 VAL 91 HG22 VAL 91 74.187 3.109 -13.832 676 HG23 VAL 91 HG23 VAL 91 74.150 4.873 -13.892 677 H THR 92 HN THR 92 70.756 5.245 -16.505 678 HA THR 92 HA THR 92 70.466 4.068 -19.226 679 HB THR 92 HB THR 92 68.353 4.065 -18.179 680 HG1 THR 92 HG1 THR 92 68.885 5.909 -20.082 681 HG21 THR 92 HG21 THR 92 67.455 6.063 -17.001 682 HG22 THR 92 HG22 THR 92 68.997 6.880 -17.263 683 HG23 THR 92 HG23 THR 92 68.923 5.445 -16.243 684 H ALA 93 HN ALA 93 70.970 5.253 -20.999 685 HA ALA 93 HA ALA 93 72.545 7.570 -20.773 686 HB1 ALA 93 HB1 ALA 93 72.438 7.707 -23.164 687 HB2 ALA 93 HB2 ALA 93 70.941 6.775 -23.210 688 HB3 ALA 93 HB3 ALA 93 72.451 5.993 -22.751 689 H GLY 94 HN GLY 94 72.091 9.716 -20.813 690 HA2 GLY 94 HA2 GLY 94 69.391 10.516 -20.194 691 HA3 GLY 94 HA1 GLY 94 70.799 11.568 -20.282 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 52.909 -8.473 14.029 2 H2 MET 1 HT2 MET 1 51.551 -9.331 13.480 3 H3 MET 1 HT3 MET 1 53.013 -10.145 13.768 4 HA MET 1 HA MET 1 51.933 -8.679 16.025 5 HB2 MET 1 HB2 MET 1 50.449 -10.809 16.437 6 HB3 MET 1 HB1 MET 1 49.834 -9.522 15.401 7 HG2 MET 1 HG2 MET 1 50.369 -10.713 13.417 8 HG3 MET 1 HG1 MET 1 51.393 -11.857 14.286 9 HE1 MET 1 HE1 MET 1 49.225 -14.434 15.755 10 HE2 MET 1 HE2 MET 1 50.481 -13.310 16.265 11 HE3 MET 1 HE3 MET 1 50.634 -14.151 14.726 12 H ALA 2 HN ALA 2 54.491 -9.613 15.169 13 HA ALA 2 HA ALA 2 55.086 -11.454 17.362 14 HB1 ALA 2 HB1 ALA 2 55.768 -12.000 14.465 15 HB2 ALA 2 HB2 ALA 2 54.742 -12.977 15.514 16 HB3 ALA 2 HB3 ALA 2 56.476 -12.873 15.822 17 HA PRO 3 HA PRO 3 58.577 -8.749 17.814 18 HB2 PRO 3 HB2 PRO 3 60.525 -10.807 18.397 19 HB3 PRO 3 HB1 PRO 3 59.683 -9.754 19.542 20 HG2 PRO 3 HG2 PRO 3 59.217 -12.557 18.964 21 HG3 PRO 3 HG1 PRO 3 58.546 -11.562 20.265 22 HD2 PRO 3 HD2 PRO 3 57.132 -12.529 18.017 23 HD3 PRO 3 HD1 PRO 3 56.574 -11.281 19.145 24 H GLU 4 HN GLU 4 58.754 -11.562 15.764 25 HA GLU 4 HA GLU 4 61.112 -11.524 14.477 26 HB2 GLU 4 HB2 GLU 4 59.208 -12.967 13.859 27 HB3 GLU 4 HB1 GLU 4 58.435 -11.593 13.069 28 HG2 GLU 4 HG2 GLU 4 60.358 -11.393 11.523 29 HG3 GLU 4 HG1 GLU 4 61.136 -12.763 12.319 30 H VAL 5 HN VAL 5 62.197 -10.396 12.976 31 HA VAL 5 HA VAL 5 61.843 -7.591 12.787 32 HB VAL 5 HB VAL 5 63.996 -8.885 12.579 33 HG11 VAL 5 HG11 VAL 5 63.100 -9.393 9.742 34 HG12 VAL 5 HG12 VAL 5 62.958 -10.598 11.019 35 HG13 VAL 5 HG13 VAL 5 64.546 -9.999 10.546 36 HG21 VAL 5 HG21 VAL 5 63.170 -6.902 10.452 37 HG22 VAL 5 HG22 VAL 5 64.829 -7.489 10.587 38 HG23 VAL 5 HG23 VAL 5 64.096 -6.598 11.922 39 H THR 6 HN THR 6 60.727 -6.362 11.274 40 HA THR 6 HA THR 6 59.150 -7.906 9.294 41 HB THR 6 HB THR 6 57.939 -5.777 8.905 42 HG1 THR 6 HG1 THR 6 60.038 -4.745 9.914 43 HG21 THR 6 HG21 THR 6 57.087 -5.596 11.365 44 HG22 THR 6 HG22 THR 6 58.182 -6.941 11.673 45 HG23 THR 6 HG23 THR 6 56.873 -7.117 10.504 46 H ILE 7 HN ILE 7 59.420 -7.805 7.131 47 HA ILE 7 HA ILE 7 61.566 -6.023 6.134 48 HB ILE 7 HB ILE 7 61.877 -8.604 6.285 49 HG12 ILE 7 HG12 ILE 7 63.118 -8.444 3.945 50 HG13 ILE 7 HG11 ILE 7 62.652 -6.747 4.059 51 HG21 ILE 7 HG21 ILE 7 60.606 -8.517 3.558 52 HG22 ILE 7 HG22 ILE 7 59.703 -9.007 4.998 53 HG23 ILE 7 HG23 ILE 7 61.116 -9.923 4.490 54 HD11 ILE 7 HD11 ILE 7 64.187 -8.278 6.191 55 HD12 ILE 7 HD12 ILE 7 63.789 -6.562 6.235 56 HD13 ILE 7 HD13 ILE 7 64.912 -7.175 5.022 57 H LEU 8 HN LEU 8 60.694 -4.440 5.191 58 HA LEU 8 HA LEU 8 58.648 -4.859 3.080 59 HB2 LEU 8 HB2 LEU 8 58.763 -2.789 5.265 60 HB3 LEU 8 HB1 LEU 8 58.074 -2.342 3.710 61 HG LEU 8 HG LEU 8 56.552 -4.358 3.901 62 HD11 LEU 8 HD11 LEU 8 56.276 -4.904 6.526 63 HD12 LEU 8 HD12 LEU 8 58.008 -4.575 6.510 64 HD13 LEU 8 HD13 LEU 8 57.340 -5.838 5.479 65 HD21 LEU 8 HD21 LEU 8 55.690 -2.153 4.337 66 HD22 LEU 8 HD22 LEU 8 56.418 -2.125 5.943 67 HD23 LEU 8 HD23 LEU 8 55.073 -3.214 5.604 68 H GLU 9 HN GLU 9 60.534 -5.070 1.705 69 HA GLU 9 HA GLU 9 61.875 -2.481 1.118 70 HB2 GLU 9 HB2 GLU 9 62.884 -5.315 0.924 71 HB3 GLU 9 HB1 GLU 9 63.720 -3.930 0.227 72 HG2 GLU 9 HG2 GLU 9 64.191 -2.985 2.314 73 HG3 GLU 9 HG1 GLU 9 62.890 -3.858 3.122 74 HA PRO 10 HA PRO 10 59.587 -3.631 -2.711 75 HB2 PRO 10 HB2 PRO 10 59.099 -0.812 -3.190 76 HB3 PRO 10 HB1 PRO 10 57.921 -2.061 -2.764 77 HG2 PRO 10 HG2 PRO 10 58.722 0.050 -1.123 78 HG3 PRO 10 HG1 PRO 10 57.868 -1.410 -0.594 79 HD2 PRO 10 HD2 PRO 10 60.751 -0.711 -0.304 80 HD3 PRO 10 HD1 PRO 10 59.732 -1.770 0.701 81 H LEU 11 HN LEU 11 62.322 -1.895 -1.882 82 HA LEU 11 HA LEU 11 63.203 -0.658 -4.218 83 HB2 LEU 11 HB2 LEU 11 64.756 -2.091 -2.055 84 HB3 LEU 11 HB1 LEU 11 65.503 -1.090 -3.300 85 HG LEU 11 HG LEU 11 63.364 -0.129 -1.376 86 HD11 LEU 11 HD11 LEU 11 66.378 0.191 -1.329 87 HD12 LEU 11 HD12 LEU 11 65.382 -0.641 -0.135 88 HD13 LEU 11 HD13 LEU 11 65.269 1.112 -0.312 89 HD21 LEU 11 HD21 LEU 11 64.595 2.120 -2.258 90 HD22 LEU 11 HD22 LEU 11 63.212 1.410 -3.088 91 HD23 LEU 11 HD23 LEU 11 64.838 1.097 -3.675 92 H GLN 12 HN GLN 12 62.467 -2.057 -5.945 93 HA GLN 12 HA GLN 12 63.764 -4.647 -6.265 94 HB2 GLN 12 HB2 GLN 12 61.438 -4.382 -6.980 95 HB3 GLN 12 HB1 GLN 12 61.911 -3.099 -8.096 96 HG2 GLN 12 HG2 GLN 12 63.313 -4.681 -9.352 97 HG3 GLN 12 HG1 GLN 12 62.918 -5.960 -8.209 98 HE21 GLN 12 HE21 GLN 12 62.318 -6.238 -10.978 99 HE22 GLN 12 HE22 GLN 12 60.630 -6.212 -11.168 100 H ASP 13 HN ASP 13 63.512 -1.770 -8.384 101 HA ASP 13 HA ASP 13 66.332 -1.576 -8.801 102 HB2 ASP 13 HB2 ASP 13 65.794 -3.682 -10.059 103 HB3 ASP 13 HB1 ASP 13 64.730 -2.732 -11.091 104 H VAL 14 HN VAL 14 66.870 0.317 -9.856 105 HA VAL 14 HA VAL 14 64.677 1.892 -11.070 106 HB VAL 14 HB VAL 14 65.579 3.910 -9.963 107 HG11 VAL 14 HG11 VAL 14 64.913 1.770 -7.930 108 HG12 VAL 14 HG12 VAL 14 63.707 2.463 -9.016 109 HG13 VAL 14 HG13 VAL 14 64.536 3.492 -7.851 110 HG21 VAL 14 HG21 VAL 14 67.172 3.670 -8.127 111 HG22 VAL 14 HG22 VAL 14 67.885 3.005 -9.594 112 HG23 VAL 14 HG23 VAL 14 67.228 1.924 -8.365 113 H GLN 15 HN GLN 15 65.456 3.674 -12.458 114 HA GLN 15 HA GLN 15 68.160 3.194 -13.586 115 HB2 GLN 15 HB2 GLN 15 66.926 3.934 -15.810 116 HB3 GLN 15 HB1 GLN 15 66.861 2.255 -15.274 117 HG2 GLN 15 HG2 GLN 15 64.762 4.229 -14.381 118 HG3 GLN 15 HG1 GLN 15 64.633 3.425 -15.943 119 HE21 GLN 15 HE21 GLN 15 63.535 3.140 -12.853 120 HE22 GLN 15 HE22 GLN 15 63.366 1.454 -12.758 121 H LEU 16 HN LEU 16 69.345 4.973 -13.262 122 HA LEU 16 HA LEU 16 68.039 7.640 -13.471 123 HB2 LEU 16 HB2 LEU 16 70.374 6.834 -11.727 124 HB3 LEU 16 HB1 LEU 16 69.649 8.438 -11.815 125 HG LEU 16 HG LEU 16 68.126 5.945 -11.005 126 HD11 LEU 16 HD11 LEU 16 69.900 6.386 -9.398 127 HD12 LEU 16 HD12 LEU 16 68.350 6.858 -8.697 128 HD13 LEU 16 HD13 LEU 16 69.448 8.089 -9.324 129 HD21 LEU 16 HD21 LEU 16 66.646 7.809 -9.968 130 HD22 LEU 16 HD22 LEU 16 66.560 7.587 -11.712 131 HD23 LEU 16 HD23 LEU 16 67.513 8.910 -11.040 132 H SER 17 HN SER 17 69.078 9.233 -14.581 133 HA SER 17 HA SER 17 71.110 8.411 -16.477 134 HB2 SER 17 HB2 SER 17 69.566 10.960 -16.008 135 HB3 SER 17 HB1 SER 17 70.903 10.896 -17.151 136 HG SER 17 HG SER 17 68.688 10.417 -17.947 137 H GLU 18 HN GLU 18 73.137 9.575 -16.740 138 HA GLU 18 HA GLU 18 74.569 9.832 -14.305 139 HB2 GLU 18 HB2 GLU 18 75.636 9.176 -16.432 140 HB3 GLU 18 HB1 GLU 18 75.338 10.794 -17.069 141 HG2 GLU 18 HG2 GLU 18 76.729 11.780 -15.308 142 HG3 GLU 18 HG1 GLU 18 76.976 10.189 -14.587 143 H GLY 19 HN GLY 19 75.434 11.656 -13.300 144 HA2 GLY 19 HA2 GLY 19 75.676 13.911 -12.774 145 HA3 GLY 19 HA1 GLY 19 74.771 14.322 -14.229 146 H GLN 20 HN GLN 20 73.189 11.960 -12.420 147 HA GLN 20 HA GLN 20 71.470 13.983 -11.085 148 HB2 GLN 20 HB2 GLN 20 70.665 11.390 -12.425 149 HB3 GLN 20 HB1 GLN 20 69.588 12.402 -11.465 150 HG2 GLN 20 HG2 GLN 20 70.002 14.297 -12.987 151 HG3 GLN 20 HG1 GLN 20 71.076 13.286 -13.954 152 HE21 GLN 20 HE21 GLN 20 69.143 14.181 -15.506 153 HE22 GLN 20 HE22 GLN 20 67.878 13.071 -15.720 154 H ASP 21 HN ASP 21 70.747 13.511 -9.038 155 HA ASP 21 HA ASP 21 72.400 11.744 -7.498 156 HB2 ASP 21 HB2 ASP 21 69.937 13.341 -6.762 157 HB3 ASP 21 HB1 ASP 21 70.963 12.489 -5.610 158 H ALA 22 HN ALA 22 71.513 10.099 -6.037 159 HA ALA 22 HA ALA 22 69.113 8.719 -7.098 160 HB1 ALA 22 HB1 ALA 22 71.290 7.664 -7.886 161 HB2 ALA 22 HB2 ALA 22 70.209 6.598 -6.990 162 HB3 ALA 22 HB3 ALA 22 71.621 7.290 -6.194 163 H SER 23 HN SER 23 68.192 7.188 -5.499 164 HA SER 23 HA SER 23 69.029 7.491 -2.743 165 HB2 SER 23 HB2 SER 23 66.805 8.439 -2.042 166 HB3 SER 23 HB1 SER 23 67.837 9.558 -2.927 167 HG SER 23 HG SER 23 66.617 8.573 -4.831 168 H PHE 24 HN PHE 24 67.798 6.218 -1.269 169 HA PHE 24 HA PHE 24 65.971 4.227 -2.435 170 HB2 PHE 24 HB2 PHE 24 68.419 3.571 -0.769 171 HB3 PHE 24 HB1 PHE 24 67.161 2.421 -1.207 172 HD1 PHE 24 HD1 PHE 24 70.354 3.486 -2.082 173 HD2 PHE 24 HD2 PHE 24 66.576 2.544 -3.888 174 HE1 PHE 24 HE1 PHE 24 71.494 3.003 -4.229 175 HE2 PHE 24 HE2 PHE 24 67.711 2.061 -6.029 176 HZ PHE 24 HZ PHE 24 70.171 2.281 -6.200 177 H GLN 25 HN GLN 25 64.494 3.376 -0.938 178 HA GLN 25 HA GLN 25 64.601 4.463 1.812 179 HB2 GLN 25 HB2 GLN 25 63.085 5.830 0.250 180 HB3 GLN 25 HB1 GLN 25 62.043 4.408 0.207 181 HG2 GLN 25 HG2 GLN 25 61.879 4.451 2.670 182 HG3 GLN 25 HG1 GLN 25 62.916 5.876 2.714 183 HE21 GLN 25 HE21 GLN 25 60.339 6.081 3.801 184 HE22 GLN 25 HE22 GLN 25 59.376 7.050 2.797 185 H CYS 26 HN CYS 26 64.284 2.926 3.267 186 HA CYS 26 HA CYS 26 62.764 0.492 2.510 187 HB2 CYS 26 HB2 CYS 26 65.045 -0.197 2.439 188 HB3 CYS 26 HB1 CYS 26 65.439 0.703 3.903 189 HG CYS 26 HG CYS 26 63.317 -1.390 4.465 190 H ARG 27 HN ARG 27 61.968 -0.713 4.379 191 HA ARG 27 HA ARG 27 61.693 0.815 6.887 192 HB2 ARG 27 HB2 ARG 27 59.727 1.387 5.439 193 HB3 ARG 27 HB1 ARG 27 59.335 -0.332 5.365 194 HG2 ARG 27 HG2 ARG 27 59.129 -0.387 7.834 195 HG3 ARG 27 HG1 ARG 27 59.488 1.340 7.895 196 HD2 ARG 27 HD2 ARG 27 57.502 1.807 6.522 197 HD3 ARG 27 HD1 ARG 27 57.152 0.085 6.426 198 HE ARG 27 HE ARG 27 57.324 0.804 9.144 199 HH11 ARG 27 HH11 ARG 27 55.315 0.729 10.242 200 HH12 ARG 27 HH12 ARG 27 53.884 1.263 9.426 201 HH21 ARG 27 HH21 ARG 27 55.485 1.763 6.389 202 HH22 ARG 27 HH22 ARG 27 53.978 1.845 7.240 203 H LEU 28 HN LEU 28 62.359 -0.617 8.420 204 HA LEU 28 HA LEU 28 61.210 -3.317 8.341 205 HB2 LEU 28 HB2 LEU 28 63.340 -4.436 8.614 206 HB3 LEU 28 HB1 LEU 28 63.335 -3.505 7.122 207 HG LEU 28 HG LEU 28 64.341 -1.642 8.914 208 HD11 LEU 28 HD11 LEU 28 64.433 -3.588 10.608 209 HD12 LEU 28 HD12 LEU 28 65.907 -2.651 10.385 210 HD13 LEU 28 HD13 LEU 28 65.736 -4.230 9.620 211 HD21 LEU 28 HD21 LEU 28 65.352 -1.983 6.769 212 HD22 LEU 28 HD22 LEU 28 65.771 -3.652 7.155 213 HD23 LEU 28 HD23 LEU 28 66.609 -2.323 7.956 214 H SER 29 HN SER 29 60.442 -3.821 10.237 215 HA SER 29 HA SER 29 60.835 -2.247 12.548 216 HB2 SER 29 HB2 SER 29 59.620 -4.001 13.750 217 HB3 SER 29 HB1 SER 29 58.815 -3.649 12.225 218 HG SER 29 HG SER 29 60.629 -5.773 12.758 219 H ARG 30 HN ARG 30 61.784 -2.992 14.554 220 HA ARG 30 HA ARG 30 64.475 -3.504 14.351 221 HB2 ARG 30 HB2 ARG 30 64.371 -3.973 16.776 222 HB3 ARG 30 HB1 ARG 30 63.467 -2.532 16.311 223 HG2 ARG 30 HG2 ARG 30 61.383 -3.892 16.252 224 HG3 ARG 30 HG1 ARG 30 62.306 -5.285 16.819 225 HD2 ARG 30 HD2 ARG 30 62.169 -2.659 18.315 226 HD3 ARG 30 HD1 ARG 30 61.089 -4.012 18.636 227 HE ARG 30 HE ARG 30 63.674 -5.030 18.760 228 HH11 ARG 30 HH11 ARG 30 61.302 -4.243 20.851 229 HH12 ARG 30 HH12 ARG 30 62.305 -3.682 22.148 230 HH21 ARG 30 HH21 ARG 30 65.186 -3.574 20.217 231 HH22 ARG 30 HH22 ARG 30 64.508 -3.304 21.789 232 H ALA 31 HN ALA 31 65.795 -5.175 15.003 233 HA ALA 31 HA ALA 31 65.440 -7.619 13.782 234 HB1 ALA 31 HB1 ALA 31 67.240 -6.785 16.045 235 HB2 ALA 31 HB2 ALA 31 67.634 -6.899 14.330 236 HB3 ALA 31 HB3 ALA 31 67.345 -8.364 15.267 237 H SER 32 HN SER 32 65.852 -9.741 15.136 238 HA SER 32 HA SER 32 64.266 -9.954 17.555 239 HB2 SER 32 HB2 SER 32 62.549 -11.353 16.724 240 HB3 SER 32 HB1 SER 32 62.636 -10.036 15.557 241 HG SER 32 HG SER 32 63.576 -12.687 15.361 242 H GLY 33 HN GLY 33 65.689 -11.759 14.840 243 HA2 GLY 33 HA2 GLY 33 66.764 -13.764 16.731 244 HA3 GLY 33 HA1 GLY 33 66.605 -13.972 14.988 245 H GLN 34 HN GLN 34 67.863 -12.267 13.681 246 HA GLN 34 HA GLN 34 70.511 -11.792 14.928 247 HB2 GLN 34 HB2 GLN 34 69.879 -12.692 12.107 248 HB3 GLN 34 HB1 GLN 34 71.474 -12.175 12.654 249 HG2 GLN 34 HG2 GLN 34 71.520 -13.959 14.326 250 HG3 GLN 34 HG1 GLN 34 69.890 -14.450 13.880 251 HE21 GLN 34 HE21 GLN 34 72.528 -15.958 13.668 252 HE22 GLN 34 HE22 GLN 34 72.621 -16.428 12.041 253 H GLU 35 HN GLU 35 71.705 -9.987 14.062 254 HA GLU 35 HA GLU 35 69.995 -7.708 13.576 255 HB2 GLU 35 HB2 GLU 35 72.013 -7.628 15.051 256 HB3 GLU 35 HB1 GLU 35 73.019 -7.851 13.620 257 HG2 GLU 35 HG2 GLU 35 72.925 -5.485 14.066 258 HG3 GLU 35 HG1 GLU 35 71.937 -5.782 12.640 259 H ALA 36 HN ALA 36 69.820 -6.498 11.727 260 HA ALA 36 HA ALA 36 70.443 -7.809 9.232 261 HB1 ALA 36 HB1 ALA 36 69.244 -5.093 9.833 262 HB2 ALA 36 HB2 ALA 36 68.359 -6.567 9.444 263 HB3 ALA 36 HB3 ALA 36 69.373 -5.801 8.222 264 H ARG 37 HN ARG 37 71.887 -7.129 7.644 265 HA ARG 37 HA ARG 37 73.818 -5.013 8.423 266 HB2 ARG 37 HB2 ARG 37 74.426 -7.726 7.231 267 HB3 ARG 37 HB1 ARG 37 75.601 -6.419 7.389 268 HG2 ARG 37 HG2 ARG 37 75.235 -6.382 9.834 269 HG3 ARG 37 HG1 ARG 37 74.065 -7.692 9.674 270 HD2 ARG 37 HD2 ARG 37 75.834 -9.136 8.710 271 HD3 ARG 37 HD1 ARG 37 77.004 -7.834 8.939 272 HE ARG 37 HE ARG 37 75.796 -9.490 11.039 273 HH11 ARG 37 HH11 ARG 37 75.766 -6.987 12.402 274 HH12 ARG 37 HH12 ARG 37 77.391 -6.740 12.949 275 HH21 ARG 37 HH21 ARG 37 78.757 -9.084 10.788 276 HH22 ARG 37 HH22 ARG 37 79.084 -7.935 12.042 277 H TRP 38 HN TRP 38 74.611 -3.750 6.840 278 HA TRP 38 HA TRP 38 73.230 -3.836 4.233 279 HB2 TRP 38 HB2 TRP 38 73.332 -1.784 5.903 280 HB3 TRP 38 HB1 TRP 38 74.929 -1.541 5.206 281 HD1 TRP 38 HD1 TRP 38 74.991 -0.160 3.088 282 HE1 TRP 38 HE1 TRP 38 73.284 0.585 1.309 283 HE3 TRP 38 HE3 TRP 38 70.891 -2.746 4.681 284 HZ2 TRP 38 HZ2 TRP 38 70.536 0.148 0.655 285 HZ3 TRP 38 HZ3 TRP 38 68.739 -2.561 3.465 286 HH2 TRP 38 HH2 TRP 38 68.557 -1.118 1.456 287 H ALA 39 HN ALA 39 74.545 -3.475 2.265 288 HA ALA 39 HA ALA 39 77.413 -3.593 2.470 289 HB1 ALA 39 HB1 ALA 39 75.928 -6.082 1.633 290 HB2 ALA 39 HB2 ALA 39 77.021 -5.903 3.004 291 HB3 ALA 39 HB3 ALA 39 77.648 -5.813 1.358 292 H LEU 40 HN LEU 40 78.485 -3.378 0.515 293 HA LEU 40 HA LEU 40 76.835 -2.911 -1.901 294 HB2 LEU 40 HB2 LEU 40 77.672 -0.811 -0.598 295 HB3 LEU 40 HB1 LEU 40 79.262 -1.256 -1.193 296 HG LEU 40 HG LEU 40 78.324 0.363 -2.716 297 HD11 LEU 40 HD11 LEU 40 79.520 -1.707 -3.634 298 HD12 LEU 40 HD12 LEU 40 78.546 -0.778 -4.771 299 HD13 LEU 40 HD13 LEU 40 77.920 -2.283 -4.103 300 HD21 LEU 40 HD21 LEU 40 75.878 -0.360 -1.995 301 HD22 LEU 40 HD22 LEU 40 75.988 -1.406 -3.410 302 HD23 LEU 40 HD23 LEU 40 76.168 0.337 -3.584 303 H GLY 41 HN GLY 41 77.482 -4.381 -3.381 304 HA2 GLY 41 HA2 GLY 41 78.868 -5.688 -4.687 305 HA3 GLY 41 HA1 GLY 41 80.214 -4.683 -4.141 306 H GLY 42 HN GLY 42 78.245 -6.057 -1.707 307 HA2 GLY 42 HA2 GLY 42 78.458 -7.966 -0.379 308 HA3 GLY 42 HA1 GLY 42 79.838 -8.470 -1.352 309 H VAL 43 HN VAL 43 80.243 -5.254 -0.579 310 HA VAL 43 HA VAL 43 82.001 -5.925 1.703 311 HB VAL 43 HB VAL 43 82.196 -3.512 -0.100 312 HG11 VAL 43 HG11 VAL 43 84.075 -4.835 1.878 313 HG12 VAL 43 HG12 VAL 43 83.300 -3.262 2.058 314 HG13 VAL 43 HG13 VAL 43 84.525 -3.501 0.814 315 HG21 VAL 43 HG21 VAL 43 84.165 -4.846 -1.064 316 HG22 VAL 43 HG22 VAL 43 82.556 -5.387 -1.540 317 HG23 VAL 43 HG23 VAL 43 83.445 -6.262 -0.293 318 HA PRO 44 HA PRO 44 79.066 -3.476 4.106 319 HB2 PRO 44 HB2 PRO 44 81.045 -2.885 6.148 320 HB3 PRO 44 HB1 PRO 44 79.682 -4.010 6.236 321 HG2 PRO 44 HG2 PRO 44 82.469 -4.623 5.975 322 HG3 PRO 44 HG1 PRO 44 81.106 -5.745 6.091 323 HD2 PRO 44 HD2 PRO 44 82.712 -5.183 3.776 324 HD3 PRO 44 HD1 PRO 44 81.297 -6.251 3.879 325 H LEU 45 HN LEU 45 78.625 -1.285 4.341 326 HA LEU 45 HA LEU 45 80.790 0.637 3.716 327 HB2 LEU 45 HB2 LEU 45 79.139 1.964 2.409 328 HB3 LEU 45 HB1 LEU 45 79.515 0.413 1.669 329 HG LEU 45 HG LEU 45 77.114 0.868 3.464 330 HD11 LEU 45 HD11 LEU 45 77.468 1.238 0.497 331 HD12 LEU 45 HD12 LEU 45 76.613 2.257 1.653 332 HD13 LEU 45 HD13 LEU 45 75.910 0.722 1.141 333 HD21 LEU 45 HD21 LEU 45 78.262 -1.476 2.069 334 HD22 LEU 45 HD22 LEU 45 76.552 -1.232 1.727 335 HD23 LEU 45 HD23 LEU 45 77.099 -1.404 3.389 336 H GLN 46 HN GLN 46 80.592 2.673 4.630 337 HA GLN 46 HA GLN 46 78.491 3.003 6.699 338 HB2 GLN 46 HB2 GLN 46 80.306 4.187 8.041 339 HB3 GLN 46 HB1 GLN 46 80.437 2.431 7.942 340 HG2 GLN 46 HG2 GLN 46 82.053 2.684 6.067 341 HG3 GLN 46 HG1 GLN 46 81.955 4.435 6.245 342 HE21 GLN 46 HE21 GLN 46 84.319 2.605 6.697 343 HE22 GLN 46 HE22 GLN 46 84.806 2.908 8.293 344 H ALA 47 HN ALA 47 78.289 5.325 7.377 345 HA ALA 47 HA ALA 47 77.641 6.945 5.233 346 HB1 ALA 47 HB1 ALA 47 77.333 8.709 6.802 347 HB2 ALA 47 HB2 ALA 47 78.505 8.009 7.922 348 HB3 ALA 47 HB3 ALA 47 76.949 7.213 7.659 349 H ASN 48 HN ASN 48 78.602 8.543 4.096 350 HA ASN 48 HA ASN 48 81.201 9.599 4.718 351 HB2 ASN 48 HB2 ASN 48 82.383 8.738 2.776 352 HB3 ASN 48 HB1 ASN 48 81.818 7.387 3.757 353 HD21 ASN 48 HD21 ASN 48 82.389 7.253 0.884 354 HD22 ASN 48 HD22 ASN 48 80.927 6.869 0.111 355 H GLU 49 HN GLU 49 81.954 10.649 2.337 356 HA GLU 49 HA GLU 49 80.074 12.731 1.949 357 HB2 GLU 49 HB2 GLU 49 82.492 11.887 0.342 358 HB3 GLU 49 HB1 GLU 49 81.564 13.352 0.018 359 HG2 GLU 49 HG2 GLU 49 82.012 14.174 2.279 360 HG3 GLU 49 HG1 GLU 49 82.874 12.687 2.669 361 H MET 50 HN MET 50 80.947 9.936 -0.095 362 HA MET 50 HA MET 50 79.144 10.578 -2.195 363 HB2 MET 50 HB2 MET 50 80.469 7.984 -1.397 364 HB3 MET 50 HB1 MET 50 79.495 8.173 -2.854 365 HG2 MET 50 HG2 MET 50 80.994 9.929 -3.666 366 HG3 MET 50 HG1 MET 50 81.947 9.828 -2.183 367 HE1 MET 50 HE1 MET 50 84.453 8.932 -3.238 368 HE2 MET 50 HE2 MET 50 83.449 9.909 -4.306 369 HE3 MET 50 HE3 MET 50 84.229 8.458 -4.927 370 H ASN 51 HN ASN 51 78.863 8.412 0.622 371 HA ASN 51 HA ASN 51 75.957 8.117 0.048 372 HB2 ASN 51 HB2 ASN 51 77.654 6.220 1.674 373 HB3 ASN 51 HB1 ASN 51 76.021 5.964 1.064 374 HD21 ASN 51 HD21 ASN 51 78.421 4.308 0.500 375 HD22 ASN 51 HD22 ASN 51 78.630 4.349 -1.183 376 H ASP 52 HN ASP 52 74.495 8.355 1.724 377 HA ASP 52 HA ASP 52 75.534 9.046 4.405 378 HB2 ASP 52 HB2 ASP 52 73.656 10.726 2.740 379 HB3 ASP 52 HB1 ASP 52 73.824 10.908 4.484 380 H ILE 53 HN ILE 53 74.670 7.462 5.613 381 HA ILE 53 HA ILE 53 71.901 6.585 5.069 382 HB ILE 53 HB ILE 53 72.433 4.563 6.152 383 HG12 ILE 53 HG12 ILE 53 74.925 5.905 7.256 384 HG13 ILE 53 HG11 ILE 53 73.499 5.458 8.193 385 HG21 ILE 53 HG21 ILE 53 75.133 5.214 4.985 386 HG22 ILE 53 HG22 ILE 53 73.712 5.175 3.950 387 HG23 ILE 53 HG23 ILE 53 74.187 3.735 4.838 388 HD11 ILE 53 HD11 ILE 53 73.863 3.073 7.365 389 HD12 ILE 53 HD12 ILE 53 75.056 3.681 8.517 390 HD13 ILE 53 HD13 ILE 53 75.445 3.611 6.797 391 H THR 54 HN THR 54 70.266 6.941 6.473 392 HA THR 54 HA THR 54 70.898 7.947 9.186 393 HB THR 54 HB THR 54 70.546 9.952 7.866 394 HG1 THR 54 HG1 THR 54 68.210 10.288 8.865 395 HG21 THR 54 HG21 THR 54 67.858 8.788 7.099 396 HG22 THR 54 HG22 THR 54 69.268 8.772 6.039 397 HG23 THR 54 HG23 THR 54 68.562 10.305 6.539 398 H VAL 55 HN VAL 55 69.178 7.764 10.701 399 HA VAL 55 HA VAL 55 67.087 5.789 9.947 400 HB VAL 55 HB VAL 55 67.253 4.960 12.268 401 HG11 VAL 55 HG11 VAL 55 69.958 5.012 10.902 402 HG12 VAL 55 HG12 VAL 55 68.612 4.008 10.360 403 HG13 VAL 55 HG13 VAL 55 69.321 3.748 11.955 404 HG21 VAL 55 HG21 VAL 55 69.409 5.690 13.496 405 HG22 VAL 55 HG22 VAL 55 68.059 6.825 13.508 406 HG23 VAL 55 HG23 VAL 55 69.413 7.076 12.405 407 H GLU 56 HN GLU 56 65.042 6.377 10.280 408 HA GLU 56 HA GLU 56 64.458 8.615 12.143 409 HB2 GLU 56 HB2 GLU 56 63.267 8.058 9.414 410 HB3 GLU 56 HB1 GLU 56 62.546 9.162 10.579 411 HG2 GLU 56 HG2 GLU 56 63.842 10.607 9.269 412 HG3 GLU 56 HG1 GLU 56 64.915 10.283 10.625 413 H GLN 57 HN GLN 57 61.925 8.632 12.450 414 HA GLN 57 HA GLN 57 61.226 6.561 14.112 415 HB2 GLN 57 HB2 GLN 57 60.058 8.803 13.780 416 HB3 GLN 57 HB1 GLN 57 59.226 8.053 12.420 417 HG2 GLN 57 HG2 GLN 57 57.802 7.849 14.364 418 HG3 GLN 57 HG1 GLN 57 58.433 6.249 13.980 419 HE21 GLN 57 HE21 GLN 57 58.463 5.372 16.113 420 HE22 GLN 57 HE22 GLN 57 59.412 6.017 17.365 421 H GLY 58 HN GLY 58 59.988 4.692 13.942 422 HA2 GLY 58 HA2 GLY 58 58.981 2.867 12.954 423 HA3 GLY 58 HA1 GLY 58 58.857 3.796 11.466 424 H THR 59 HN THR 59 62.011 3.686 12.774 425 HA THR 59 HA THR 59 63.939 2.656 12.092 426 HB THR 59 HB THR 59 62.284 0.324 11.143 427 HG1 THR 59 HG1 THR 59 62.688 1.283 13.753 428 HG21 THR 59 HG21 THR 59 65.013 0.684 12.406 429 HG22 THR 59 HG22 THR 59 64.613 -0.059 10.859 430 HG23 THR 59 HG23 THR 59 64.206 -0.879 12.363 431 H LEU 60 HN LEU 60 62.631 4.418 10.312 432 HA LEU 60 HA LEU 60 62.722 3.263 7.649 433 HB2 LEU 60 HB2 LEU 60 62.252 6.046 8.717 434 HB3 LEU 60 HB1 LEU 60 62.359 5.713 6.992 435 HG LEU 60 HG LEU 60 60.457 4.189 8.793 436 HD11 LEU 60 HD11 LEU 60 60.041 6.688 8.897 437 HD12 LEU 60 HD12 LEU 60 58.704 5.748 8.242 438 HD13 LEU 60 HD13 LEU 60 59.766 6.645 7.157 439 HD21 LEU 60 HD21 LEU 60 59.225 4.067 6.514 440 HD22 LEU 60 HD22 LEU 60 60.680 3.097 6.688 441 HD23 LEU 60 HD23 LEU 60 60.737 4.619 5.805 442 H HIS 61 HN HIS 61 64.420 3.228 6.332 443 HA HIS 61 HA HIS 61 66.869 4.708 7.111 444 HB2 HIS 61 HB2 HIS 61 66.498 2.173 5.491 445 HB3 HIS 61 HB1 HIS 61 68.039 3.008 5.687 446 HD1 HIS 61 HD1 HIS 61 68.139 0.291 6.812 447 HD2 HIS 61 HD2 HIS 61 66.584 3.451 9.045 448 HE1 HIS 61 HE1 HIS 61 68.264 -0.414 9.242 449 H LEU 62 HN LEU 62 68.088 5.730 5.432 450 HA LEU 62 HA LEU 62 66.853 6.020 2.800 451 HB2 LEU 62 HB2 LEU 62 65.676 7.632 4.342 452 HB3 LEU 62 HB1 LEU 62 67.228 8.427 4.589 453 HG LEU 62 HG LEU 62 67.274 8.517 1.939 454 HD11 LEU 62 HD11 LEU 62 64.312 8.291 2.553 455 HD12 LEU 62 HD12 LEU 62 65.258 7.174 1.571 456 HD13 LEU 62 HD13 LEU 62 64.985 8.823 1.014 457 HD21 LEU 62 HD21 LEU 62 67.274 10.534 3.223 458 HD22 LEU 62 HD22 LEU 62 65.615 10.273 3.758 459 HD23 LEU 62 HD23 LEU 62 65.942 10.688 2.076 460 H LEU 63 HN LEU 63 68.514 5.853 1.437 461 HA LEU 63 HA LEU 63 71.184 6.813 2.232 462 HB2 LEU 63 HB2 LEU 63 70.147 4.891 0.153 463 HB3 LEU 63 HB1 LEU 63 71.753 5.599 -0.012 464 HG LEU 63 HG LEU 63 72.468 4.670 2.078 465 HD11 LEU 63 HD11 LEU 63 70.807 3.211 3.383 466 HD12 LEU 63 HD12 LEU 63 69.543 4.000 2.438 467 HD13 LEU 63 HD13 LEU 63 70.577 4.954 3.498 468 HD21 LEU 63 HD21 LEU 63 72.460 3.123 0.165 469 HD22 LEU 63 HD22 LEU 63 70.819 2.625 0.571 470 HD23 LEU 63 HD23 LEU 63 72.148 2.258 1.670 471 H THR 64 HN THR 64 71.795 8.776 1.542 472 HA THR 64 HA THR 64 70.453 9.917 -0.843 473 HB THR 64 HB THR 64 71.764 11.258 1.533 474 HG1 THR 64 HG1 THR 64 69.741 10.898 2.081 475 HG21 THR 64 HG21 THR 64 72.387 12.634 -0.288 476 HG22 THR 64 HG22 THR 64 70.890 13.357 0.306 477 HG23 THR 64 HG23 THR 64 70.867 12.343 -1.135 478 H LEU 65 HN LEU 65 71.618 9.482 -2.529 479 HA LEU 65 HA LEU 65 74.556 9.509 -2.461 480 HB2 LEU 65 HB2 LEU 65 72.488 8.594 -4.456 481 HB3 LEU 65 HB1 LEU 65 74.161 8.819 -4.946 482 HG LEU 65 HG LEU 65 73.399 6.452 -4.189 483 HD11 LEU 65 HD11 LEU 65 75.766 7.188 -4.549 484 HD12 LEU 65 HD12 LEU 65 75.592 5.948 -3.307 485 HD13 LEU 65 HD13 LEU 65 75.847 7.629 -2.844 486 HD21 LEU 65 HD21 LEU 65 73.912 7.606 -1.431 487 HD22 LEU 65 HD22 LEU 65 73.379 5.981 -1.843 488 HD23 LEU 65 HD23 LEU 65 72.293 7.345 -2.078 489 H HIS 66 HN HIS 66 75.751 11.114 -3.195 490 HA HIS 66 HA HIS 66 74.488 13.559 -4.099 491 HB2 HIS 66 HB2 HIS 66 76.509 13.253 -2.468 492 HB3 HIS 66 HB1 HIS 66 77.466 13.122 -3.940 493 HD1 HIS 66 HD1 HIS 66 75.363 15.260 -5.378 494 HD2 HIS 66 HD2 HIS 66 77.745 15.830 -2.006 495 HE1 HIS 66 HE1 HIS 66 75.680 17.762 -5.140 496 H LYS 67 HN LYS 67 76.842 14.403 -5.651 497 HA LYS 67 HA LYS 67 75.917 13.800 -8.236 498 HB2 LYS 67 HB2 LYS 67 78.207 14.735 -8.960 499 HB3 LYS 67 HB1 LYS 67 77.133 15.806 -8.067 500 HG2 LYS 67 HG2 LYS 67 78.361 15.281 -5.976 501 HG3 LYS 67 HG1 LYS 67 79.431 14.218 -6.880 502 HD2 LYS 67 HD2 LYS 67 80.598 16.297 -6.683 503 HD3 LYS 67 HD1 LYS 67 80.009 16.222 -8.342 504 HE2 LYS 67 HE2 LYS 67 78.299 17.797 -7.937 505 HE3 LYS 67 HE1 LYS 67 78.376 17.573 -6.190 506 HZ1 LYS 67 HZ1 LYS 67 80.005 19.057 -6.009 507 HZ2 LYS 67 HZ2 LYS 67 79.599 19.542 -7.587 508 HZ3 LYS 67 HZ3 LYS 67 80.861 18.434 -7.335 509 H VAL 68 HN VAL 68 75.769 11.650 -8.671 510 HA VAL 68 HA VAL 68 78.170 9.965 -8.408 511 HB VAL 68 HB VAL 68 76.554 8.130 -9.092 512 HG11 VAL 68 HG11 VAL 68 77.213 8.564 -6.751 513 HG12 VAL 68 HG12 VAL 68 75.532 8.039 -6.854 514 HG13 VAL 68 HG13 VAL 68 75.911 9.741 -6.606 515 HG21 VAL 68 HG21 VAL 68 74.901 9.756 -10.119 516 HG22 VAL 68 HG22 VAL 68 74.482 10.255 -8.482 517 HG23 VAL 68 HG23 VAL 68 74.191 8.596 -9.002 518 H THR 69 HN THR 69 79.320 9.268 -10.059 519 HA THR 69 HA THR 69 78.771 10.319 -12.727 520 HB THR 69 HB THR 69 81.025 9.671 -13.234 521 HG1 THR 69 HG1 THR 69 81.634 8.538 -10.836 522 HG21 THR 69 HG21 THR 69 80.831 11.654 -11.806 523 HG22 THR 69 HG22 THR 69 82.280 10.744 -11.378 524 HG23 THR 69 HG23 THR 69 80.843 10.638 -10.365 525 H LEU 70 HN LEU 70 80.225 8.161 -14.054 526 HA LEU 70 HA LEU 70 78.056 6.488 -14.781 527 HB2 LEU 70 HB2 LEU 70 81.051 6.234 -15.198 528 HB3 LEU 70 HB1 LEU 70 79.908 5.041 -15.806 529 HG LEU 70 HG LEU 70 78.715 7.205 -16.845 530 HD11 LEU 70 HD11 LEU 70 80.402 8.730 -15.737 531 HD12 LEU 70 HD12 LEU 70 80.269 8.934 -17.482 532 HD13 LEU 70 HD13 LEU 70 81.626 8.038 -16.798 533 HD21 LEU 70 HD21 LEU 70 80.090 6.869 -18.905 534 HD22 LEU 70 HD22 LEU 70 79.557 5.351 -18.183 535 HD23 LEU 70 HD23 LEU 70 81.217 5.899 -17.956 536 H GLU 71 HN GLU 71 80.387 6.426 -12.266 537 HA GLU 71 HA GLU 71 80.354 3.664 -11.633 538 HB2 GLU 71 HB2 GLU 71 81.971 5.557 -10.848 539 HB3 GLU 71 HB1 GLU 71 80.773 5.841 -9.586 540 HG2 GLU 71 HG2 GLU 71 82.346 4.304 -8.658 541 HG3 GLU 71 HG1 GLU 71 80.929 3.344 -9.068 542 H ASP 72 HN ASP 72 77.866 5.825 -11.621 543 HA ASP 72 HA ASP 72 76.555 5.509 -9.185 544 HB2 ASP 72 HB2 ASP 72 75.822 7.027 -11.030 545 HB3 ASP 72 HB1 ASP 72 75.237 5.615 -11.908 546 H ALA 73 HN ALA 73 76.470 3.437 -12.079 547 HA ALA 73 HA ALA 73 74.568 1.587 -11.213 548 HB1 ALA 73 HB1 ALA 73 75.865 -0.037 -12.697 549 HB2 ALA 73 HB2 ALA 73 76.986 1.292 -12.994 550 HB3 ALA 73 HB3 ALA 73 75.295 1.442 -13.470 551 H GLY 74 HN GLY 74 74.553 0.073 -9.688 552 HA2 GLY 74 HA2 GLY 74 76.818 -1.394 -8.820 553 HA3 GLY 74 HA1 GLY 74 76.477 -0.096 -7.681 554 H THR 75 HN THR 75 76.224 -3.091 -7.524 555 HA THR 75 HA THR 75 73.332 -3.428 -7.088 556 HB THR 75 HB THR 75 75.641 -5.386 -7.043 557 HG1 THR 75 HG1 THR 75 75.095 -5.735 -9.043 558 HG21 THR 75 HG21 THR 75 72.670 -5.786 -6.615 559 HG22 THR 75 HG22 THR 75 73.966 -6.171 -5.483 560 HG23 THR 75 HG23 THR 75 73.790 -7.097 -6.972 561 H VAL 76 HN VAL 76 72.467 -3.240 -5.128 562 HA VAL 76 HA VAL 76 74.250 -3.221 -2.761 563 HB VAL 76 HB VAL 76 71.341 -2.420 -2.761 564 HG11 VAL 76 HG11 VAL 76 72.798 -2.696 -0.661 565 HG12 VAL 76 HG12 VAL 76 71.938 -1.168 -0.841 566 HG13 VAL 76 HG13 VAL 76 73.658 -1.259 -1.213 567 HG21 VAL 76 HG21 VAL 76 72.146 -0.085 -3.215 568 HG22 VAL 76 HG22 VAL 76 72.303 -1.166 -4.599 569 HG23 VAL 76 HG23 VAL 76 73.721 -0.758 -3.633 570 H SER 77 HN SER 77 74.225 -4.939 -1.431 571 HA SER 77 HA SER 77 71.906 -6.801 -1.547 572 HB2 SER 77 HB2 SER 77 73.870 -7.783 -2.654 573 HB3 SER 77 HB1 SER 77 74.838 -7.491 -1.211 574 HG SER 77 HG SER 77 72.542 -8.760 -0.589 575 H PHE 78 HN PHE 78 71.131 -7.556 0.348 576 HA PHE 78 HA PHE 78 72.576 -7.027 2.842 577 HB2 PHE 78 HB2 PHE 78 70.680 -5.893 3.868 578 HB3 PHE 78 HB1 PHE 78 71.207 -4.998 2.444 579 HD1 PHE 78 HD1 PHE 78 68.601 -7.218 3.831 580 HD2 PHE 78 HD2 PHE 78 69.829 -4.879 0.444 581 HE1 PHE 78 HE1 PHE 78 66.322 -7.406 2.877 582 HE2 PHE 78 HE2 PHE 78 67.548 -5.065 -0.513 583 HZ PHE 78 HZ PHE 78 65.793 -6.325 0.705 584 H HIS 79 HN HIS 79 71.758 -8.237 4.632 585 HA HIS 79 HA HIS 79 69.643 -10.186 4.102 586 HB2 HIS 79 HB2 HIS 79 71.079 -12.106 4.704 587 HB3 HIS 79 HB1 HIS 79 71.618 -11.326 3.216 588 HD1 HIS 79 HD1 HIS 79 72.631 -12.003 6.735 589 HD2 HIS 79 HD2 HIS 79 74.054 -9.796 3.498 590 HE1 HIS 79 HE1 HIS 79 75.015 -11.360 7.300 591 H VAL 80 HN VAL 80 68.797 -11.117 5.949 592 HA VAL 80 HA VAL 80 69.918 -10.386 8.550 593 HB VAL 80 HB VAL 80 68.500 -8.489 8.105 594 HG11 VAL 80 HG11 VAL 80 66.092 -10.269 7.733 595 HG12 VAL 80 HG12 VAL 80 67.103 -9.840 6.356 596 HG13 VAL 80 HG13 VAL 80 66.306 -8.579 7.287 597 HG21 VAL 80 HG21 VAL 80 67.103 -8.588 10.020 598 HG22 VAL 80 HG22 VAL 80 68.419 -9.712 10.366 599 HG23 VAL 80 HG23 VAL 80 66.849 -10.325 9.842 600 H GLY 81 HN GLY 81 70.298 -12.582 8.782 601 HA2 GLY 81 HA2 GLY 81 69.781 -14.852 9.009 602 HA3 GLY 81 HA1 GLY 81 68.802 -14.160 10.292 603 H THR 82 HN THR 82 66.571 -13.772 9.908 604 HA THR 82 HA THR 82 65.065 -15.755 8.889 605 HB THR 82 HB THR 82 63.238 -14.040 8.553 606 HG1 THR 82 HG1 THR 82 63.910 -11.925 9.363 607 HG21 THR 82 HG21 THR 82 64.887 -14.023 11.092 608 HG22 THR 82 HG22 THR 82 63.519 -15.071 10.717 609 HG23 THR 82 HG23 THR 82 63.265 -13.344 10.973 610 H CYS 83 HN CYS 83 64.773 -12.777 7.019 611 HA CYS 83 HA CYS 83 64.821 -14.392 4.539 612 HB2 CYS 83 HB2 CYS 83 62.763 -13.085 5.133 613 HB3 CYS 83 HB1 CYS 83 63.711 -11.611 4.945 614 HG CYS 83 HG CYS 83 62.411 -12.793 2.680 615 H SER 84 HN SER 84 65.558 -13.220 2.572 616 HA SER 84 HA SER 84 67.628 -11.194 2.960 617 HB2 SER 84 HB2 SER 84 68.817 -13.336 3.320 618 HB3 SER 84 HB1 SER 84 68.257 -13.898 1.748 619 HG SER 84 HG SER 84 70.100 -11.882 2.395 620 H SER 85 HN SER 85 68.070 -10.029 1.072 621 HA SER 85 HA SER 85 67.031 -10.909 -1.489 622 HB2 SER 85 HB2 SER 85 64.992 -10.012 -0.482 623 HB3 SER 85 HB1 SER 85 65.820 -8.505 -0.108 624 HG SER 85 HG SER 85 65.889 -9.445 -2.738 625 H GLU 86 HN GLU 86 67.294 -9.102 -3.148 626 HA GLU 86 HA GLU 86 69.489 -7.247 -2.534 627 HB2 GLU 86 HB2 GLU 86 70.776 -8.011 -4.491 628 HB3 GLU 86 HB1 GLU 86 70.599 -9.301 -3.302 629 HG2 GLU 86 HG2 GLU 86 68.636 -10.156 -4.605 630 HG3 GLU 86 HG1 GLU 86 68.977 -8.941 -5.834 631 H ALA 87 HN ALA 87 69.856 -5.708 -4.309 632 HA ALA 87 HA ALA 87 67.529 -5.320 -6.094 633 HB1 ALA 87 HB1 ALA 87 67.450 -3.897 -3.958 634 HB2 ALA 87 HB2 ALA 87 67.317 -3.041 -5.493 635 HB3 ALA 87 HB3 ALA 87 68.846 -3.043 -4.615 636 H GLN 88 HN GLN 88 67.989 -3.993 -7.950 637 HA GLN 88 HA GLN 88 70.878 -3.910 -8.658 638 HB2 GLN 88 HB2 GLN 88 68.457 -4.459 -10.389 639 HB3 GLN 88 HB1 GLN 88 70.096 -4.246 -11.002 640 HG2 GLN 88 HG2 GLN 88 69.325 -6.328 -8.940 641 HG3 GLN 88 HG1 GLN 88 69.437 -6.655 -10.668 642 HE21 GLN 88 HE21 GLN 88 71.186 -7.139 -7.952 643 HE22 GLN 88 HE22 GLN 88 72.760 -6.974 -8.569 644 H LEU 89 HN LEU 89 71.700 -2.052 -9.429 645 HA LEU 89 HA LEU 89 69.844 0.226 -9.894 646 HB2 LEU 89 HB2 LEU 89 71.539 0.262 -7.902 647 HB3 LEU 89 HB1 LEU 89 72.754 0.536 -9.148 648 HG LEU 89 HG LEU 89 70.303 2.249 -8.625 649 HD11 LEU 89 HD11 LEU 89 73.218 3.023 -8.427 650 HD12 LEU 89 HD12 LEU 89 72.331 2.373 -7.051 651 HD13 LEU 89 HD13 LEU 89 71.816 3.887 -7.794 652 HD21 LEU 89 HD21 LEU 89 72.402 2.309 -10.796 653 HD22 LEU 89 HD22 LEU 89 71.548 3.772 -10.319 654 HD23 LEU 89 HD23 LEU 89 70.649 2.403 -10.964 655 H LYS 90 HN LYS 90 69.636 0.451 -12.025 656 HA LYS 90 HA LYS 90 71.976 0.063 -13.794 657 HB2 LYS 90 HB2 LYS 90 69.031 0.203 -14.486 658 HB3 LYS 90 HB1 LYS 90 70.348 -0.173 -15.594 659 HG2 LYS 90 HG2 LYS 90 69.647 -1.813 -13.139 660 HG3 LYS 90 HG1 LYS 90 69.154 -2.213 -14.782 661 HD2 LYS 90 HD2 LYS 90 71.683 -2.105 -15.354 662 HD3 LYS 90 HD1 LYS 90 71.939 -2.196 -13.612 663 HE2 LYS 90 HE2 LYS 90 72.012 -4.446 -14.525 664 HE3 LYS 90 HE1 LYS 90 70.554 -4.270 -13.550 665 HZ1 LYS 90 HZ1 LYS 90 70.793 -4.866 -16.306 666 HZ2 LYS 90 HZ2 LYS 90 69.877 -3.451 -16.096 667 HZ3 LYS 90 HZ3 LYS 90 69.410 -4.889 -15.324 668 H VAL 91 HN VAL 91 72.215 1.581 -15.581 669 HA VAL 91 HA VAL 91 71.341 4.327 -14.847 670 HB VAL 91 HB VAL 91 73.499 4.967 -16.120 671 HG11 VAL 91 HG11 VAL 91 73.435 3.585 -13.428 672 HG12 VAL 91 HG12 VAL 91 73.427 5.316 -13.764 673 HG13 VAL 91 HG13 VAL 91 74.890 4.374 -14.035 674 HG21 VAL 91 HG21 VAL 91 74.156 2.083 -15.429 675 HG22 VAL 91 HG22 VAL 91 75.227 3.252 -16.199 676 HG23 VAL 91 HG23 VAL 91 73.814 2.649 -17.062 677 H THR 92 HN THR 92 70.151 5.359 -16.282 678 HA THR 92 HA THR 92 70.147 4.407 -19.109 679 HB THR 92 HB THR 92 67.805 5.454 -17.499 680 HG1 THR 92 HG1 THR 92 67.265 3.103 -18.280 681 HG21 THR 92 HG21 THR 92 66.565 4.578 -19.560 682 HG22 THR 92 HG22 THR 92 68.136 4.548 -20.361 683 HG23 THR 92 HG23 THR 92 67.474 6.072 -19.770 684 H ALA 93 HN ALA 93 70.630 5.899 -20.587 685 HA ALA 93 HA ALA 93 70.908 8.700 -19.779 686 HB1 ALA 93 HB1 ALA 93 72.694 7.529 -21.100 687 HB2 ALA 93 HB2 ALA 93 72.084 8.995 -21.869 688 HB3 ALA 93 HB3 ALA 93 71.556 7.413 -22.444 689 H GLY 94 HN GLY 94 68.538 6.739 -21.025 690 HA2 GLY 94 HA2 GLY 94 67.336 8.107 -23.110 691 HA3 GLY 94 HA1 GLY 94 66.459 7.167 -21.910 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 52.010 -6.625 16.005 2 H2 MET 1 HT2 MET 1 50.738 -6.964 17.078 3 H3 MET 1 HT3 MET 1 50.856 -7.802 15.606 4 HA MET 1 HA MET 1 52.773 -7.977 17.868 5 HB2 MET 1 HB2 MET 1 50.690 -9.885 16.768 6 HB3 MET 1 HB1 MET 1 51.931 -10.348 17.930 7 HG2 MET 1 HG2 MET 1 51.094 -8.627 19.499 8 HG3 MET 1 HG1 MET 1 49.831 -8.199 18.350 9 HE1 MET 1 HE1 MET 1 48.605 -11.394 17.364 10 HE2 MET 1 HE2 MET 1 48.368 -9.651 17.308 11 HE3 MET 1 HE3 MET 1 47.299 -10.646 18.289 12 H ALA 2 HN ALA 2 54.742 -8.008 16.895 13 HA ALA 2 HA ALA 2 55.431 -10.174 15.160 14 HB1 ALA 2 HB1 ALA 2 54.342 -8.748 13.493 15 HB2 ALA 2 HB2 ALA 2 56.080 -8.834 13.199 16 HB3 ALA 2 HB3 ALA 2 55.383 -7.400 13.954 17 HA PRO 3 HA PRO 3 58.861 -8.242 17.591 18 HB2 PRO 3 HB2 PRO 3 59.671 -10.908 18.411 19 HB3 PRO 3 HB1 PRO 3 59.024 -9.602 19.416 20 HG2 PRO 3 HG2 PRO 3 57.700 -11.978 18.769 21 HG3 PRO 3 HG1 PRO 3 56.953 -10.518 19.440 22 HD2 PRO 3 HD2 PRO 3 56.881 -11.544 16.650 23 HD3 PRO 3 HD1 PRO 3 55.736 -10.474 17.488 24 H GLU 4 HN GLU 4 58.674 -10.764 15.226 25 HA GLU 4 HA GLU 4 61.492 -10.999 14.738 26 HB2 GLU 4 HB2 GLU 4 59.888 -12.792 14.173 27 HB3 GLU 4 HB1 GLU 4 59.153 -11.739 12.966 28 HG2 GLU 4 HG2 GLU 4 61.242 -11.641 11.715 29 HG3 GLU 4 HG1 GLU 4 62.070 -12.569 12.963 30 H VAL 5 HN VAL 5 62.605 -10.283 12.855 31 HA VAL 5 HA VAL 5 62.255 -7.560 12.238 32 HB VAL 5 HB VAL 5 64.391 -8.911 12.069 33 HG11 VAL 5 HG11 VAL 5 64.791 -10.292 10.190 34 HG12 VAL 5 HG12 VAL 5 63.371 -9.693 9.339 35 HG13 VAL 5 HG13 VAL 5 63.179 -10.753 10.733 36 HG21 VAL 5 HG21 VAL 5 63.506 -7.289 9.664 37 HG22 VAL 5 HG22 VAL 5 65.183 -7.669 10.061 38 HG23 VAL 5 HG23 VAL 5 64.228 -6.651 11.141 39 H THR 6 HN THR 6 61.085 -6.518 10.688 40 HA THR 6 HA THR 6 59.661 -8.213 8.685 41 HB THR 6 HB THR 6 58.759 -5.428 9.361 42 HG1 THR 6 HG1 THR 6 57.414 -7.032 10.887 43 HG21 THR 6 HG21 THR 6 57.226 -7.977 8.787 44 HG22 THR 6 HG22 THR 6 57.711 -6.819 7.547 45 HG23 THR 6 HG23 THR 6 56.585 -6.334 8.815 46 H ILE 7 HN ILE 7 60.352 -7.999 6.626 47 HA ILE 7 HA ILE 7 61.895 -5.569 5.924 48 HB ILE 7 HB ILE 7 61.807 -8.242 4.523 49 HG12 ILE 7 HG12 ILE 7 64.022 -6.991 6.174 50 HG13 ILE 7 HG11 ILE 7 62.886 -8.176 6.822 51 HG21 ILE 7 HG21 ILE 7 63.372 -5.681 4.102 52 HG22 ILE 7 HG22 ILE 7 62.340 -6.512 2.940 53 HG23 ILE 7 HG23 ILE 7 63.878 -7.226 3.419 54 HD11 ILE 7 HD11 ILE 7 65.110 -9.092 5.931 55 HD12 ILE 7 HD12 ILE 7 64.496 -8.711 4.325 56 HD13 ILE 7 HD13 ILE 7 63.641 -9.870 5.343 57 H LEU 8 HN LEU 8 60.945 -4.107 4.847 58 HA LEU 8 HA LEU 8 58.935 -4.766 2.766 59 HB2 LEU 8 HB2 LEU 8 58.905 -2.472 4.745 60 HB3 LEU 8 HB1 LEU 8 57.834 -2.581 3.354 61 HG LEU 8 HG LEU 8 58.003 -4.690 5.529 62 HD11 LEU 8 HD11 LEU 8 56.055 -3.732 6.525 63 HD12 LEU 8 HD12 LEU 8 55.811 -2.635 5.169 64 HD13 LEU 8 HD13 LEU 8 57.165 -2.386 6.269 65 HD21 LEU 8 HD21 LEU 8 57.053 -5.755 3.666 66 HD22 LEU 8 HD22 LEU 8 56.279 -4.281 3.084 67 HD23 LEU 8 HD23 LEU 8 55.621 -5.133 4.480 68 H GLU 9 HN GLU 9 60.949 -4.770 1.486 69 HA GLU 9 HA GLU 9 62.004 -2.055 0.904 70 HB2 GLU 9 HB2 GLU 9 63.647 -3.628 1.772 71 HB3 GLU 9 HB1 GLU 9 63.241 -4.779 0.502 72 HG2 GLU 9 HG2 GLU 9 64.099 -3.359 -1.203 73 HG3 GLU 9 HG1 GLU 9 64.169 -1.975 -0.115 74 HA PRO 10 HA PRO 10 59.876 -3.241 -3.013 75 HB2 PRO 10 HB2 PRO 10 59.307 -0.440 -3.513 76 HB3 PRO 10 HB1 PRO 10 58.161 -1.729 -3.108 77 HG2 PRO 10 HG2 PRO 10 58.835 0.405 -1.454 78 HG3 PRO 10 HG1 PRO 10 58.064 -1.101 -0.930 79 HD2 PRO 10 HD2 PRO 10 60.919 -0.256 -0.660 80 HD3 PRO 10 HD1 PRO 10 59.939 -1.309 0.385 81 H LEU 11 HN LEU 11 62.559 -1.428 -2.153 82 HA LEU 11 HA LEU 11 63.390 -0.237 -4.564 83 HB2 LEU 11 HB2 LEU 11 64.995 -1.409 -2.276 84 HB3 LEU 11 HB1 LEU 11 65.686 -0.424 -3.560 85 HG LEU 11 HG LEU 11 63.387 0.545 -1.839 86 HD11 LEU 11 HD11 LEU 11 64.996 1.685 -0.427 87 HD12 LEU 11 HD12 LEU 11 66.335 1.116 -1.419 88 HD13 LEU 11 HD13 LEU 11 65.412 -0.028 -0.449 89 HD21 LEU 11 HD21 LEU 11 63.600 1.905 -3.788 90 HD22 LEU 11 HD22 LEU 11 65.361 1.847 -3.737 91 HD23 LEU 11 HD23 LEU 11 64.475 2.788 -2.540 92 H GLN 12 HN GLN 12 62.558 -2.049 -5.988 93 HA GLN 12 HA GLN 12 64.052 -4.494 -6.094 94 HB2 GLN 12 HB2 GLN 12 61.707 -4.355 -6.853 95 HB3 GLN 12 HB1 GLN 12 62.196 -3.270 -8.152 96 HG2 GLN 12 HG2 GLN 12 61.997 -5.557 -9.005 97 HG3 GLN 12 HG1 GLN 12 63.682 -5.051 -9.053 98 HE21 GLN 12 HE21 GLN 12 64.792 -7.001 -8.659 99 HE22 GLN 12 HE22 GLN 12 64.519 -7.990 -7.306 100 H ASP 13 HN ASP 13 63.776 -1.866 -8.533 101 HA ASP 13 HA ASP 13 66.605 -1.690 -8.893 102 HB2 ASP 13 HB2 ASP 13 66.702 -2.662 -11.171 103 HB3 ASP 13 HB1 ASP 13 66.336 -3.863 -9.936 104 H VAL 14 HN VAL 14 67.116 0.200 -9.854 105 HA VAL 14 HA VAL 14 65.093 1.527 -11.570 106 HB VAL 14 HB VAL 14 65.598 3.675 -10.454 107 HG11 VAL 14 HG11 VAL 14 64.607 1.427 -8.680 108 HG12 VAL 14 HG12 VAL 14 63.633 2.471 -9.714 109 HG13 VAL 14 HG13 VAL 14 64.432 3.137 -8.289 110 HG21 VAL 14 HG21 VAL 14 66.748 3.515 -8.199 111 HG22 VAL 14 HG22 VAL 14 67.804 3.254 -9.586 112 HG23 VAL 14 HG23 VAL 14 67.233 1.879 -8.644 113 H GLN 15 HN GLN 15 65.986 3.222 -12.935 114 HA GLN 15 HA GLN 15 68.908 3.075 -13.371 115 HB2 GLN 15 HB2 GLN 15 68.344 3.126 -15.884 116 HB3 GLN 15 HB1 GLN 15 68.154 1.591 -15.041 117 HG2 GLN 15 HG2 GLN 15 65.736 2.035 -14.774 118 HG3 GLN 15 HG1 GLN 15 65.922 3.561 -15.634 119 HE21 GLN 15 HE21 GLN 15 64.535 2.843 -17.406 120 HE22 GLN 15 HE22 GLN 15 65.067 1.673 -18.516 121 H LEU 16 HN LEU 16 69.687 5.063 -13.194 122 HA LEU 16 HA LEU 16 68.058 7.363 -14.146 123 HB2 LEU 16 HB2 LEU 16 70.025 7.236 -11.852 124 HB3 LEU 16 HB1 LEU 16 69.143 8.672 -12.370 125 HG LEU 16 HG LEU 16 67.834 6.092 -11.461 126 HD11 LEU 16 HD11 LEU 16 67.341 7.282 -9.383 127 HD12 LEU 16 HD12 LEU 16 68.171 8.714 -9.985 128 HD13 LEU 16 HD13 LEU 16 69.082 7.243 -9.651 129 HD21 LEU 16 HD21 LEU 16 66.820 8.763 -12.421 130 HD22 LEU 16 HD22 LEU 16 65.891 7.894 -11.200 131 HD23 LEU 16 HD23 LEU 16 66.206 7.147 -12.762 132 H SER 17 HN SER 17 68.965 8.689 -15.602 133 HA SER 17 HA SER 17 71.468 8.027 -16.804 134 HB2 SER 17 HB2 SER 17 69.917 10.599 -17.137 135 HB3 SER 17 HB1 SER 17 71.089 9.907 -18.253 136 HG SER 17 HG SER 17 69.674 8.321 -18.761 137 H GLU 18 HN GLU 18 73.314 9.457 -17.011 138 HA GLU 18 HA GLU 18 74.376 10.282 -14.556 139 HB2 GLU 18 HB2 GLU 18 75.747 9.701 -16.518 140 HB3 GLU 18 HB1 GLU 18 75.190 11.154 -17.341 141 HG2 GLU 18 HG2 GLU 18 77.383 11.567 -16.339 142 HG3 GLU 18 HG1 GLU 18 76.173 12.534 -15.506 143 H GLY 19 HN GLY 19 74.704 12.275 -13.621 144 HA2 GLY 19 HA2 GLY 19 74.507 14.599 -13.352 145 HA3 GLY 19 HA1 GLY 19 73.560 14.677 -14.832 146 H GLN 20 HN GLN 20 72.311 12.178 -13.067 147 HA GLN 20 HA GLN 20 70.213 13.917 -11.883 148 HB2 GLN 20 HB2 GLN 20 70.085 11.067 -12.894 149 HB3 GLN 20 HB1 GLN 20 68.775 11.880 -12.040 150 HG2 GLN 20 HG2 GLN 20 68.704 13.624 -13.772 151 HG3 GLN 20 HG1 GLN 20 70.033 12.840 -14.626 152 HE21 GLN 20 HE21 GLN 20 68.071 12.918 -16.321 153 HE22 GLN 20 HE22 GLN 20 67.114 11.515 -16.360 154 H ASP 21 HN ASP 21 69.489 13.527 -9.814 155 HA ASP 21 HA ASP 21 71.397 12.249 -8.038 156 HB2 ASP 21 HB2 ASP 21 69.949 13.120 -6.252 157 HB3 ASP 21 HB1 ASP 21 70.351 14.386 -7.410 158 H ALA 22 HN ALA 22 70.447 10.856 -6.227 159 HA ALA 22 HA ALA 22 68.210 9.160 -7.060 160 HB1 ALA 22 HB1 ALA 22 69.406 7.153 -7.176 161 HB2 ALA 22 HB2 ALA 22 70.796 7.813 -6.311 162 HB3 ALA 22 HB3 ALA 22 70.489 8.287 -7.981 163 H SER 23 HN SER 23 67.343 7.902 -5.337 164 HA SER 23 HA SER 23 68.494 8.209 -2.667 165 HB2 SER 23 HB2 SER 23 66.483 9.231 -1.734 166 HB3 SER 23 HB1 SER 23 67.156 10.264 -2.993 167 HG SER 23 HG SER 23 65.636 9.144 -4.428 168 H PHE 24 HN PHE 24 68.302 6.339 -1.672 169 HA PHE 24 HA PHE 24 66.177 4.440 -2.487 170 HB2 PHE 24 HB2 PHE 24 68.969 4.147 -1.423 171 HB3 PHE 24 HB1 PHE 24 67.799 2.908 -0.980 172 HD1 PHE 24 HD1 PHE 24 68.519 1.048 -2.244 173 HD2 PHE 24 HD2 PHE 24 67.971 4.838 -4.182 174 HE1 PHE 24 HE1 PHE 24 68.796 -0.039 -4.453 175 HE2 PHE 24 HE2 PHE 24 68.247 3.752 -6.388 176 HZ PHE 24 HZ PHE 24 68.659 1.314 -6.526 177 H GLN 25 HN GLN 25 64.478 4.304 -1.167 178 HA GLN 25 HA GLN 25 64.896 4.655 1.749 179 HB2 GLN 25 HB2 GLN 25 62.789 5.887 1.898 180 HB3 GLN 25 HB1 GLN 25 63.908 6.720 0.821 181 HG2 GLN 25 HG2 GLN 25 62.784 5.638 -1.124 182 HG3 GLN 25 HG1 GLN 25 61.613 4.927 -0.015 183 HE21 GLN 25 HE21 GLN 25 61.579 7.356 1.739 184 HE22 GLN 25 HE22 GLN 25 60.696 8.521 0.879 185 H CYS 26 HN CYS 26 63.987 3.113 2.979 186 HA CYS 26 HA CYS 26 61.771 1.503 1.945 187 HB2 CYS 26 HB2 CYS 26 63.040 -0.619 2.450 188 HB3 CYS 26 HB1 CYS 26 63.612 0.263 1.034 189 HG CYS 26 HG CYS 26 65.642 1.117 2.410 190 H ARG 27 HN ARG 27 60.694 0.290 3.542 191 HA ARG 27 HA ARG 27 61.156 1.252 6.292 192 HB2 ARG 27 HB2 ARG 27 58.820 -0.172 4.987 193 HB3 ARG 27 HB1 ARG 27 58.885 0.272 6.693 194 HG2 ARG 27 HG2 ARG 27 59.139 2.639 6.076 195 HG3 ARG 27 HG1 ARG 27 59.114 2.208 4.370 196 HD2 ARG 27 HD2 ARG 27 56.835 1.306 4.628 197 HD3 ARG 27 HD1 ARG 27 56.863 1.720 6.339 198 HE ARG 27 HE ARG 27 56.548 3.967 5.766 199 HH11 ARG 27 HH11 ARG 27 54.679 3.529 3.712 200 HH12 ARG 27 HH12 ARG 27 55.415 4.112 2.257 201 HH21 ARG 27 HH21 ARG 27 58.628 4.082 3.557 202 HH22 ARG 27 HH22 ARG 27 57.652 4.422 2.167 203 H LEU 28 HN LEU 28 61.905 -0.091 7.882 204 HA LEU 28 HA LEU 28 61.757 -3.009 7.491 205 HB2 LEU 28 HB2 LEU 28 63.979 -1.943 6.608 206 HB3 LEU 28 HB1 LEU 28 64.381 -1.774 8.315 207 HG LEU 28 HG LEU 28 63.631 -4.369 6.930 208 HD11 LEU 28 HD11 LEU 28 65.820 -3.772 6.214 209 HD12 LEU 28 HD12 LEU 28 66.061 -4.907 7.544 210 HD13 LEU 28 HD13 LEU 28 66.263 -3.174 7.814 211 HD21 LEU 28 HD21 LEU 28 62.954 -4.635 9.168 212 HD22 LEU 28 HD22 LEU 28 64.272 -3.646 9.790 213 HD23 LEU 28 HD23 LEU 28 64.595 -5.268 9.179 214 H SER 29 HN SER 29 60.574 -3.501 9.279 215 HA SER 29 HA SER 29 60.655 -2.115 11.736 216 HB2 SER 29 HB2 SER 29 59.857 -5.005 11.375 217 HB3 SER 29 HB1 SER 29 59.325 -3.891 12.629 218 HG SER 29 HG SER 29 57.893 -3.137 11.298 219 H ARG 30 HN ARG 30 61.565 -2.684 13.729 220 HA ARG 30 HA ARG 30 64.258 -3.362 13.708 221 HB2 ARG 30 HB2 ARG 30 64.109 -3.419 16.118 222 HB3 ARG 30 HB1 ARG 30 63.077 -2.127 15.512 223 HG2 ARG 30 HG2 ARG 30 61.119 -3.679 15.656 224 HG3 ARG 30 HG1 ARG 30 62.171 -4.890 16.391 225 HD2 ARG 30 HD2 ARG 30 62.704 -3.304 18.218 226 HD3 ARG 30 HD1 ARG 30 61.610 -2.126 17.501 227 HE ARG 30 HE ARG 30 60.303 -4.634 17.980 228 HH11 ARG 30 HH11 ARG 30 59.394 -4.978 20.097 229 HH12 ARG 30 HH12 ARG 30 59.122 -3.593 21.101 230 HH21 ARG 30 HH21 ARG 30 60.822 -1.413 19.010 231 HH22 ARG 30 HH22 ARG 30 59.932 -1.576 20.486 232 H ALA 31 HN ALA 31 65.406 -5.098 14.606 233 HA ALA 31 HA ALA 31 64.225 -7.711 14.016 234 HB1 ALA 31 HB1 ALA 31 67.087 -6.952 14.643 235 HB2 ALA 31 HB2 ALA 31 66.414 -7.137 13.022 236 HB3 ALA 31 HB3 ALA 31 66.525 -8.532 14.096 237 H SER 32 HN SER 32 65.501 -9.441 15.528 238 HA SER 32 HA SER 32 65.451 -8.682 18.338 239 HB2 SER 32 HB2 SER 32 63.384 -10.514 17.109 240 HB3 SER 32 HB1 SER 32 63.809 -10.588 18.818 241 HG SER 32 HG SER 32 63.458 -8.071 18.348 242 H GLY 33 HN GLY 33 65.515 -11.238 15.912 243 HA2 GLY 33 HA2 GLY 33 67.261 -12.925 17.531 244 HA3 GLY 33 HA1 GLY 33 66.624 -13.298 15.926 245 H GLN 34 HN GLN 34 67.485 -11.959 14.104 246 HA GLN 34 HA GLN 34 70.307 -11.185 14.564 247 HB2 GLN 34 HB2 GLN 34 69.134 -12.566 12.140 248 HB3 GLN 34 HB1 GLN 34 70.797 -11.995 12.281 249 HG2 GLN 34 HG2 GLN 34 70.802 -14.345 12.813 250 HG3 GLN 34 HG1 GLN 34 71.037 -13.464 14.321 251 HE21 GLN 34 HE21 GLN 34 70.033 -14.984 15.747 252 HE22 GLN 34 HE22 GLN 34 68.389 -15.392 15.645 253 H GLU 35 HN GLU 35 70.915 -9.236 13.882 254 HA GLU 35 HA GLU 35 68.943 -7.422 12.823 255 HB2 GLU 35 HB2 GLU 35 70.689 -6.760 14.486 256 HB3 GLU 35 HB1 GLU 35 71.908 -6.974 13.227 257 HG2 GLU 35 HG2 GLU 35 70.847 -5.275 11.845 258 HG3 GLU 35 HG1 GLU 35 69.530 -5.108 13.004 259 H ALA 36 HN ALA 36 69.035 -6.304 10.846 260 HA ALA 36 HA ALA 36 69.975 -7.871 8.623 261 HB1 ALA 36 HB1 ALA 36 69.085 -5.869 7.306 262 HB2 ALA 36 HB2 ALA 36 68.571 -5.214 8.861 263 HB3 ALA 36 HB3 ALA 36 67.913 -6.747 8.289 264 H ARG 37 HN ARG 37 71.560 -7.330 7.100 265 HA ARG 37 HA ARG 37 73.543 -5.308 8.003 266 HB2 ARG 37 HB2 ARG 37 74.037 -7.797 6.353 267 HB3 ARG 37 HB1 ARG 37 75.256 -6.689 6.975 268 HG2 ARG 37 HG2 ARG 37 73.347 -8.257 8.737 269 HG3 ARG 37 HG1 ARG 37 74.973 -8.796 8.338 270 HD2 ARG 37 HD2 ARG 37 74.165 -6.365 9.947 271 HD3 ARG 37 HD1 ARG 37 75.168 -7.715 10.447 272 HE ARG 37 HE ARG 37 76.029 -5.409 8.930 273 HH11 ARG 37 HH11 ARG 37 76.866 -7.889 7.382 274 HH12 ARG 37 HH12 ARG 37 78.436 -8.202 8.042 275 HH21 ARG 37 HH21 ARG 37 77.969 -6.166 10.810 276 HH22 ARG 37 HH22 ARG 37 79.061 -7.224 9.981 277 H TRP 38 HN TRP 38 74.231 -3.789 6.628 278 HA TRP 38 HA TRP 38 73.002 -3.637 3.940 279 HB2 TRP 38 HB2 TRP 38 72.862 -1.780 5.809 280 HB3 TRP 38 HB1 TRP 38 74.500 -1.392 5.296 281 HD1 TRP 38 HD1 TRP 38 74.632 -1.224 2.403 282 HE1 TRP 38 HE1 TRP 38 73.074 0.206 0.929 283 HE3 TRP 38 HE3 TRP 38 70.662 -0.679 5.571 284 HZ2 TRP 38 HZ2 TRP 38 70.484 1.406 1.062 285 HZ3 TRP 38 HZ3 TRP 38 68.664 0.609 4.869 286 HH2 TRP 38 HH2 TRP 38 68.569 1.650 2.621 287 H ALA 39 HN ALA 39 74.322 -3.498 2.083 288 HA ALA 39 HA ALA 39 77.103 -2.946 2.122 289 HB1 ALA 39 HB1 ALA 39 78.013 -5.182 1.710 290 HB2 ALA 39 HB2 ALA 39 76.414 -5.887 1.936 291 HB3 ALA 39 HB3 ALA 39 77.239 -5.123 3.291 292 H LEU 40 HN LEU 40 78.152 -3.424 0.004 293 HA LEU 40 HA LEU 40 76.283 -4.051 -2.175 294 HB2 LEU 40 HB2 LEU 40 76.688 -2.097 -3.418 295 HB3 LEU 40 HB1 LEU 40 76.409 -1.520 -1.782 296 HG LEU 40 HG LEU 40 79.139 -1.910 -3.068 297 HD11 LEU 40 HD11 LEU 40 79.179 0.609 -2.816 298 HD12 LEU 40 HD12 LEU 40 77.455 0.526 -2.459 299 HD13 LEU 40 HD13 LEU 40 78.056 -0.002 -4.031 300 HD21 LEU 40 HD21 LEU 40 78.234 -0.988 -0.326 301 HD22 LEU 40 HD22 LEU 40 79.819 -0.574 -0.977 302 HD23 LEU 40 HD23 LEU 40 79.393 -2.257 -0.705 303 H GLY 41 HN GLY 41 77.147 -5.368 -3.639 304 HA2 GLY 41 HA2 GLY 41 78.736 -6.460 -4.922 305 HA3 GLY 41 HA1 GLY 41 79.927 -5.294 -4.361 306 H GLY 42 HN GLY 42 78.316 -6.606 -1.731 307 HA2 GLY 42 HA2 GLY 42 78.696 -8.596 -0.477 308 HA3 GLY 42 HA1 GLY 42 80.139 -8.906 -1.434 309 H VAL 43 HN VAL 43 80.723 -5.869 -0.977 310 HA VAL 43 HA VAL 43 82.169 -6.290 1.557 311 HB VAL 43 HB VAL 43 82.573 -4.027 -0.394 312 HG11 VAL 43 HG11 VAL 43 84.667 -3.769 0.672 313 HG12 VAL 43 HG12 VAL 43 84.598 -5.376 1.395 314 HG13 VAL 43 HG13 VAL 43 83.557 -4.091 2.004 315 HG21 VAL 43 HG21 VAL 43 82.763 -6.195 -1.606 316 HG22 VAL 43 HG22 VAL 43 83.920 -6.750 -0.397 317 HG23 VAL 43 HG23 VAL 43 84.323 -5.395 -1.449 318 HA PRO 44 HA PRO 44 79.045 -3.546 3.364 319 HB2 PRO 44 HB2 PRO 44 80.740 -3.008 5.669 320 HB3 PRO 44 HB1 PRO 44 79.272 -3.993 5.591 321 HG2 PRO 44 HG2 PRO 44 81.966 -4.893 5.838 322 HG3 PRO 44 HG1 PRO 44 80.502 -5.873 5.698 323 HD2 PRO 44 HD2 PRO 44 82.565 -5.479 3.709 324 HD3 PRO 44 HD1 PRO 44 81.110 -6.491 3.596 325 H LEU 45 HN LEU 45 78.745 -1.369 3.195 326 HA LEU 45 HA LEU 45 81.034 0.254 2.350 327 HB2 LEU 45 HB2 LEU 45 79.013 1.969 2.076 328 HB3 LEU 45 HB1 LEU 45 79.293 0.701 0.894 329 HG LEU 45 HG LEU 45 77.620 -0.713 1.927 330 HD11 LEU 45 HD11 LEU 45 77.758 -0.291 4.251 331 HD12 LEU 45 HD12 LEU 45 76.205 0.407 3.800 332 HD13 LEU 45 HD13 LEU 45 77.611 1.450 4.031 333 HD21 LEU 45 HD21 LEU 45 76.550 2.111 1.687 334 HD22 LEU 45 HD22 LEU 45 75.654 0.619 1.416 335 HD23 LEU 45 HD23 LEU 45 76.941 1.084 0.307 336 H GLN 46 HN GLN 46 80.516 2.716 3.074 337 HA GLN 46 HA GLN 46 80.098 2.820 5.991 338 HB2 GLN 46 HB2 GLN 46 82.106 4.342 6.143 339 HB3 GLN 46 HB1 GLN 46 82.496 2.655 5.814 340 HG2 GLN 46 HG2 GLN 46 82.142 4.652 3.574 341 HG3 GLN 46 HG1 GLN 46 83.690 4.449 4.388 342 HE21 GLN 46 HE21 GLN 46 82.374 3.575 1.601 343 HE22 GLN 46 HE22 GLN 46 82.960 1.989 1.437 344 H ALA 47 HN ALA 47 79.560 4.954 6.737 345 HA ALA 47 HA ALA 47 77.886 6.376 4.954 346 HB1 ALA 47 HB1 ALA 47 78.990 7.036 7.687 347 HB2 ALA 47 HB2 ALA 47 77.372 6.463 7.281 348 HB3 ALA 47 HB3 ALA 47 77.868 8.094 6.830 349 H ASN 48 HN ASN 48 79.641 6.550 3.254 350 HA ASN 48 HA ASN 48 81.767 8.422 3.576 351 HB2 ASN 48 HB2 ASN 48 81.489 6.562 1.793 352 HB3 ASN 48 HB1 ASN 48 80.485 7.727 0.933 353 HD21 ASN 48 HD21 ASN 48 83.466 6.578 0.698 354 HD22 ASN 48 HD22 ASN 48 84.343 7.982 0.315 355 H GLU 49 HN GLU 49 81.916 10.532 2.517 356 HA GLU 49 HA GLU 49 79.813 12.239 3.179 357 HB2 GLU 49 HB2 GLU 49 82.145 12.988 2.814 358 HB3 GLU 49 HB1 GLU 49 81.947 12.708 1.082 359 HG2 GLU 49 HG2 GLU 49 80.162 14.359 0.971 360 HG3 GLU 49 HG1 GLU 49 80.213 14.577 2.719 361 H MET 50 HN MET 50 80.644 10.796 0.024 362 HA MET 50 HA MET 50 78.494 12.051 -1.381 363 HB2 MET 50 HB2 MET 50 78.955 10.104 -3.041 364 HB3 MET 50 HB1 MET 50 80.222 11.301 -2.779 365 HG2 MET 50 HG2 MET 50 81.444 9.848 -1.342 366 HG3 MET 50 HG1 MET 50 80.080 8.738 -1.181 367 HE1 MET 50 HE1 MET 50 82.400 7.566 -1.444 368 HE2 MET 50 HE2 MET 50 82.938 6.880 -2.973 369 HE3 MET 50 HE3 MET 50 81.426 6.334 -2.256 370 H ASN 51 HN ASN 51 78.886 9.033 0.363 371 HA ASN 51 HA ASN 51 76.018 8.377 -0.071 372 HB2 ASN 51 HB2 ASN 51 78.309 6.516 0.619 373 HB3 ASN 51 HB1 ASN 51 76.641 6.047 0.305 374 HD21 ASN 51 HD21 ASN 51 78.683 4.964 -1.310 375 HD22 ASN 51 HD22 ASN 51 78.576 5.631 -2.867 376 H ASP 52 HN ASP 52 74.989 9.212 1.694 377 HA ASP 52 HA ASP 52 76.170 8.724 4.371 378 HB2 ASP 52 HB2 ASP 52 74.140 10.741 3.402 379 HB3 ASP 52 HB1 ASP 52 74.538 10.494 5.097 380 H ILE 53 HN ILE 53 75.084 7.548 5.861 381 HA ILE 53 HA ILE 53 72.439 6.438 5.076 382 HB ILE 53 HB ILE 53 74.346 5.045 6.954 383 HG12 ILE 53 HG12 ILE 53 74.356 5.063 3.934 384 HG13 ILE 53 HG11 ILE 53 75.718 5.263 5.024 385 HG21 ILE 53 HG21 ILE 53 71.812 4.486 6.557 386 HG22 ILE 53 HG22 ILE 53 72.985 3.170 6.552 387 HG23 ILE 53 HG23 ILE 53 72.375 3.814 5.025 388 HD11 ILE 53 HD11 ILE 53 74.181 2.741 4.386 389 HD12 ILE 53 HD12 ILE 53 75.199 2.869 5.822 390 HD13 ILE 53 HD13 ILE 53 75.913 3.037 4.219 391 H THR 54 HN THR 54 70.800 6.811 6.434 392 HA THR 54 HA THR 54 71.377 7.417 9.268 393 HB THR 54 HB THR 54 71.294 9.613 8.313 394 HG1 THR 54 HG1 THR 54 69.666 8.803 10.099 395 HG21 THR 54 HG21 THR 54 69.212 10.280 6.992 396 HG22 THR 54 HG22 THR 54 68.859 8.558 6.870 397 HG23 THR 54 HG23 THR 54 70.338 9.206 6.162 398 H VAL 55 HN VAL 55 69.737 6.948 10.683 399 HA VAL 55 HA VAL 55 67.336 5.605 9.568 400 HB VAL 55 HB VAL 55 69.052 4.819 11.936 401 HG11 VAL 55 HG11 VAL 55 67.241 2.966 12.124 402 HG12 VAL 55 HG12 VAL 55 66.218 4.064 11.202 403 HG13 VAL 55 HG13 VAL 55 66.849 4.559 12.772 404 HG21 VAL 55 HG21 VAL 55 69.229 2.703 10.735 405 HG22 VAL 55 HG22 VAL 55 69.684 4.011 9.644 406 HG23 VAL 55 HG23 VAL 55 68.092 3.266 9.510 407 H GLU 56 HN GLU 56 65.436 6.331 10.308 408 HA GLU 56 HA GLU 56 65.433 8.167 12.646 409 HB2 GLU 56 HB2 GLU 56 63.807 8.305 10.096 410 HB3 GLU 56 HB1 GLU 56 63.569 9.343 11.503 411 HG2 GLU 56 HG2 GLU 56 65.868 10.179 11.304 412 HG3 GLU 56 HG1 GLU 56 66.151 9.111 9.931 413 H GLN 57 HN GLN 57 63.024 8.436 13.394 414 HA GLN 57 HA GLN 57 62.159 6.210 14.709 415 HB2 GLN 57 HB2 GLN 57 60.445 8.389 13.501 416 HB3 GLN 57 HB1 GLN 57 59.894 7.237 14.715 417 HG2 GLN 57 HG2 GLN 57 61.533 8.052 16.314 418 HG3 GLN 57 HG1 GLN 57 62.241 9.113 15.099 419 HE21 GLN 57 HE21 GLN 57 61.527 10.662 17.079 420 HE22 GLN 57 HE22 GLN 57 59.995 11.368 16.890 421 H GLY 58 HN GLY 58 60.571 4.594 14.342 422 HA2 GLY 58 HA2 GLY 58 59.296 3.112 13.106 423 HA3 GLY 58 HA1 GLY 58 59.272 4.298 11.804 424 H THR 59 HN THR 59 62.338 3.422 13.078 425 HA THR 59 HA THR 59 64.162 2.474 12.045 426 HB THR 59 HB THR 59 63.844 0.142 11.398 427 HG1 THR 59 HG1 THR 59 61.769 0.660 10.342 428 HG21 THR 59 HG21 THR 59 62.038 0.784 13.738 429 HG22 THR 59 HG22 THR 59 63.799 0.882 13.820 430 HG23 THR 59 HG23 THR 59 63.015 -0.666 13.502 431 H LEU 60 HN LEU 60 62.824 4.412 10.483 432 HA LEU 60 HA LEU 60 62.517 3.454 7.785 433 HB2 LEU 60 HB2 LEU 60 62.806 6.254 8.905 434 HB3 LEU 60 HB1 LEU 60 62.394 5.878 7.233 435 HG LEU 60 HG LEU 60 60.783 4.956 9.635 436 HD11 LEU 60 HD11 LEU 60 60.531 7.316 9.564 437 HD12 LEU 60 HD12 LEU 60 59.126 6.683 8.707 438 HD13 LEU 60 HD13 LEU 60 60.490 7.339 7.800 439 HD21 LEU 60 HD21 LEU 60 59.049 4.741 7.650 440 HD22 LEU 60 HD22 LEU 60 60.234 3.472 7.919 441 HD23 LEU 60 HD23 LEU 60 60.498 4.664 6.648 442 H HIS 61 HN HIS 61 63.964 3.477 6.138 443 HA HIS 61 HA HIS 61 66.777 4.154 6.798 444 HB2 HIS 61 HB2 HIS 61 65.616 2.245 4.755 445 HB3 HIS 61 HB1 HIS 61 67.332 2.624 4.904 446 HD1 HIS 61 HD1 HIS 61 68.447 2.020 7.282 447 HD2 HIS 61 HD2 HIS 61 64.709 0.319 6.560 448 HE1 HIS 61 HE1 HIS 61 68.178 0.142 8.959 449 H LEU 62 HN LEU 62 68.021 5.352 5.309 450 HA LEU 62 HA LEU 62 66.832 6.327 2.863 451 HB2 LEU 62 HB2 LEU 62 65.731 7.774 4.543 452 HB3 LEU 62 HB1 LEU 62 67.313 8.266 5.140 453 HG LEU 62 HG LEU 62 67.851 9.167 2.868 454 HD11 LEU 62 HD11 LEU 62 65.666 9.564 1.455 455 HD12 LEU 62 HD12 LEU 62 65.064 8.155 2.326 456 HD13 LEU 62 HD13 LEU 62 66.510 8.024 1.326 457 HD21 LEU 62 HD21 LEU 62 65.418 10.180 4.351 458 HD22 LEU 62 HD22 LEU 62 66.149 11.073 3.018 459 HD23 LEU 62 HD23 LEU 62 67.082 10.748 4.478 460 H LEU 63 HN LEU 63 68.600 5.775 1.728 461 HA LEU 63 HA LEU 63 71.243 6.713 2.602 462 HB2 LEU 63 HB2 LEU 63 71.267 4.404 2.112 463 HB3 LEU 63 HB1 LEU 63 70.281 4.612 0.671 464 HG LEU 63 HG LEU 63 72.086 5.538 -0.570 465 HD11 LEU 63 HD11 LEU 63 73.339 5.972 2.132 466 HD12 LEU 63 HD12 LEU 63 73.184 7.104 0.799 467 HD13 LEU 63 HD13 LEU 63 74.371 5.814 0.723 468 HD21 LEU 63 HD21 LEU 63 73.636 3.731 -0.564 469 HD22 LEU 63 HD22 LEU 63 72.150 3.030 0.080 470 HD23 LEU 63 HD23 LEU 63 73.458 3.481 1.173 471 H THR 64 HN THR 64 71.674 8.707 1.918 472 HA THR 64 HA THR 64 70.528 9.738 -0.551 473 HB THR 64 HB THR 64 71.960 11.794 0.187 474 HG1 THR 64 HG1 THR 64 73.049 11.519 1.932 475 HG21 THR 64 HG21 THR 64 69.608 11.933 0.438 476 HG22 THR 64 HG22 THR 64 70.243 12.263 2.049 477 HG23 THR 64 HG23 THR 64 69.582 10.672 1.671 478 H LEU 65 HN LEU 65 71.433 9.226 -2.384 479 HA LEU 65 HA LEU 65 74.389 9.046 -2.599 480 HB2 LEU 65 HB2 LEU 65 73.216 6.957 -3.149 481 HB3 LEU 65 HB1 LEU 65 72.196 7.813 -4.297 482 HG LEU 65 HG LEU 65 74.278 8.426 -5.588 483 HD11 LEU 65 HD11 LEU 65 75.505 6.669 -3.456 484 HD12 LEU 65 HD12 LEU 65 76.041 8.252 -4.017 485 HD13 LEU 65 HD13 LEU 65 76.255 6.837 -5.044 486 HD21 LEU 65 HD21 LEU 65 74.512 6.214 -6.600 487 HD22 LEU 65 HD22 LEU 65 72.824 6.484 -6.165 488 HD23 LEU 65 HD23 LEU 65 73.840 5.457 -5.154 489 H HIS 66 HN HIS 66 75.338 10.698 -3.668 490 HA HIS 66 HA HIS 66 73.902 12.003 -5.880 491 HB2 HIS 66 HB2 HIS 66 73.370 13.312 -3.835 492 HB3 HIS 66 HB1 HIS 66 75.097 13.568 -3.582 493 HD1 HIS 66 HD1 HIS 66 72.736 13.945 -6.572 494 HD2 HIS 66 HD2 HIS 66 75.834 15.987 -4.669 495 HE1 HIS 66 HE1 HIS 66 73.087 16.088 -7.875 496 H LYS 67 HN LYS 67 75.350 13.577 -7.034 497 HA LYS 67 HA LYS 67 77.251 13.932 -8.256 498 HB2 LYS 67 HB2 LYS 67 77.915 14.546 -5.792 499 HB3 LYS 67 HB1 LYS 67 78.876 13.074 -5.870 500 HG2 LYS 67 HG2 LYS 67 80.093 13.919 -7.806 501 HG3 LYS 67 HG1 LYS 67 79.063 15.350 -7.869 502 HD2 LYS 67 HD2 LYS 67 79.855 16.044 -5.653 503 HD3 LYS 67 HD1 LYS 67 80.857 14.597 -5.543 504 HE2 LYS 67 HE2 LYS 67 82.116 15.325 -7.545 505 HE3 LYS 67 HE1 LYS 67 81.123 16.779 -7.634 506 HZ1 LYS 67 HZ1 LYS 67 82.470 16.176 -5.107 507 HZ2 LYS 67 HZ2 LYS 67 82.099 17.679 -5.807 508 HZ3 LYS 67 HZ3 LYS 67 83.412 16.772 -6.386 509 H VAL 68 HN VAL 68 76.232 11.642 -9.028 510 HA VAL 68 HA VAL 68 78.209 9.492 -8.716 511 HB VAL 68 HB VAL 68 76.545 8.211 -10.170 512 HG11 VAL 68 HG11 VAL 68 75.102 7.748 -8.306 513 HG12 VAL 68 HG12 VAL 68 75.467 9.306 -7.567 514 HG13 VAL 68 HG13 VAL 68 76.717 8.064 -7.675 515 HG21 VAL 68 HG21 VAL 68 74.721 10.517 -9.437 516 HG22 VAL 68 HG22 VAL 68 74.340 9.118 -10.442 517 HG23 VAL 68 HG23 VAL 68 75.462 10.347 -11.028 518 H THR 69 HN THR 69 78.537 8.190 -10.731 519 HA THR 69 HA THR 69 79.011 9.831 -13.130 520 HB THR 69 HB THR 69 81.144 9.814 -11.931 521 HG1 THR 69 HG1 THR 69 82.329 8.483 -13.495 522 HG21 THR 69 HG21 THR 69 80.814 6.801 -11.904 523 HG22 THR 69 HG22 THR 69 80.682 7.856 -10.498 524 HG23 THR 69 HG23 THR 69 82.227 7.686 -11.331 525 H LEU 70 HN LEU 70 79.226 8.485 -15.041 526 HA LEU 70 HA LEU 70 77.345 6.464 -15.243 527 HB2 LEU 70 HB2 LEU 70 79.793 7.064 -16.897 528 HB3 LEU 70 HB1 LEU 70 78.645 5.805 -17.342 529 HG LEU 70 HG LEU 70 77.813 8.666 -16.787 530 HD11 LEU 70 HD11 LEU 70 79.329 8.788 -18.643 531 HD12 LEU 70 HD12 LEU 70 77.697 8.852 -19.309 532 HD13 LEU 70 HD13 LEU 70 78.624 7.355 -19.390 533 HD21 LEU 70 HD21 LEU 70 75.850 7.386 -16.721 534 HD22 LEU 70 HD22 LEU 70 76.458 6.193 -17.865 535 HD23 LEU 70 HD23 LEU 70 75.923 7.770 -18.438 536 H GLU 71 HN GLU 71 80.222 6.275 -13.544 537 HA GLU 71 HA GLU 71 80.378 3.321 -13.868 538 HB2 GLU 71 HB2 GLU 71 82.499 5.314 -13.042 539 HB3 GLU 71 HB1 GLU 71 82.704 3.563 -12.983 540 HG2 GLU 71 HG2 GLU 71 81.994 5.120 -15.487 541 HG3 GLU 71 HG1 GLU 71 83.622 4.586 -15.076 542 H ASP 72 HN ASP 72 79.071 5.536 -11.843 543 HA ASP 72 HA ASP 72 79.982 4.763 -9.291 544 HB2 ASP 72 HB2 ASP 72 78.708 6.792 -9.554 545 HB3 ASP 72 HB1 ASP 72 77.323 5.899 -10.174 546 H ALA 73 HN ALA 73 77.067 3.680 -11.083 547 HA ALA 73 HA ALA 73 75.650 1.891 -10.661 548 HB1 ALA 73 HB1 ALA 73 77.274 0.652 -11.841 549 HB2 ALA 73 HB2 ALA 73 77.008 -0.284 -10.371 550 HB3 ALA 73 HB3 ALA 73 78.434 0.744 -10.515 551 H GLY 74 HN GLY 74 75.784 -0.312 -8.992 552 HA2 GLY 74 HA2 GLY 74 76.657 -0.202 -6.441 553 HA3 GLY 74 HA1 GLY 74 75.320 0.938 -6.402 554 H THR 75 HN THR 75 76.252 -2.393 -6.570 555 HA THR 75 HA THR 75 73.489 -3.337 -6.814 556 HB THR 75 HB THR 75 74.558 -5.596 -6.694 557 HG1 THR 75 HG1 THR 75 76.922 -4.030 -6.677 558 HG21 THR 75 HG21 THR 75 75.618 -3.615 -8.724 559 HG22 THR 75 HG22 THR 75 74.181 -4.628 -8.874 560 HG23 THR 75 HG23 THR 75 75.784 -5.364 -8.882 561 H VAL 76 HN VAL 76 72.504 -2.690 -4.893 562 HA VAL 76 HA VAL 76 73.741 -3.139 -2.335 563 HB VAL 76 HB VAL 76 70.824 -2.572 -2.828 564 HG11 VAL 76 HG11 VAL 76 71.015 -1.443 -0.650 565 HG12 VAL 76 HG12 VAL 76 72.727 -1.861 -0.580 566 HG13 VAL 76 HG13 VAL 76 71.504 -3.132 -0.521 567 HG21 VAL 76 HG21 VAL 76 71.459 -0.168 -2.728 568 HG22 VAL 76 HG22 VAL 76 72.153 -0.968 -4.139 569 HG23 VAL 76 HG23 VAL 76 73.158 -0.635 -2.728 570 H SER 77 HN SER 77 73.040 -4.547 -0.712 571 HA SER 77 HA SER 77 71.204 -6.706 -1.350 572 HB2 SER 77 HB2 SER 77 73.243 -7.584 -2.325 573 HB3 SER 77 HB1 SER 77 74.151 -7.204 -0.864 574 HG SER 77 HG SER 77 73.087 -8.783 0.210 575 H PHE 78 HN PHE 78 70.562 -7.893 0.481 576 HA PHE 78 HA PHE 78 71.468 -6.854 3.110 577 HB2 PHE 78 HB2 PHE 78 68.609 -7.447 2.299 578 HB3 PHE 78 HB1 PHE 78 69.155 -6.812 3.852 579 HD1 PHE 78 HD1 PHE 78 70.014 -4.516 4.046 580 HD2 PHE 78 HD2 PHE 78 68.553 -6.053 0.311 581 HE1 PHE 78 HE1 PHE 78 69.924 -2.220 3.128 582 HE2 PHE 78 HE2 PHE 78 68.465 -3.750 -0.603 583 HZ PHE 78 HZ PHE 78 69.152 -1.832 0.807 584 H HIS 79 HN HIS 79 71.532 -8.391 4.767 585 HA HIS 79 HA HIS 79 70.578 -11.117 4.166 586 HB2 HIS 79 HB2 HIS 79 72.918 -11.041 3.403 587 HB3 HIS 79 HB1 HIS 79 73.419 -10.491 5.001 588 HD1 HIS 79 HD1 HIS 79 71.293 -13.383 3.671 589 HD2 HIS 79 HD2 HIS 79 74.253 -12.637 6.510 590 HE1 HIS 79 HE1 HIS 79 71.786 -15.600 4.793 591 H VAL 80 HN VAL 80 69.330 -11.676 5.817 592 HA VAL 80 HA VAL 80 70.254 -11.103 8.572 593 HB VAL 80 HB VAL 80 68.459 -9.541 8.133 594 HG11 VAL 80 HG11 VAL 80 66.912 -11.971 7.224 595 HG12 VAL 80 HG12 VAL 80 67.359 -10.575 6.251 596 HG13 VAL 80 HG13 VAL 80 66.176 -10.408 7.549 597 HG21 VAL 80 HG21 VAL 80 67.186 -11.791 9.687 598 HG22 VAL 80 HG22 VAL 80 67.091 -10.057 9.983 599 HG23 VAL 80 HG23 VAL 80 68.588 -10.924 10.317 600 H GLY 81 HN GLY 81 70.194 -12.782 9.926 601 HA2 GLY 81 HA2 GLY 81 70.292 -15.373 9.239 602 HA3 GLY 81 HA1 GLY 81 69.669 -14.870 10.800 603 H THR 82 HN THR 82 67.371 -13.521 9.284 604 HA THR 82 HA THR 82 65.619 -15.844 9.356 605 HB THR 82 HB THR 82 63.819 -14.192 9.074 606 HG1 THR 82 HG1 THR 82 64.354 -12.446 8.066 607 HG21 THR 82 HG21 THR 82 64.168 -13.004 11.171 608 HG22 THR 82 HG22 THR 82 65.909 -13.265 11.063 609 HG23 THR 82 HG23 THR 82 64.826 -14.634 11.318 610 H CYS 83 HN CYS 83 65.646 -13.154 7.051 611 HA CYS 83 HA CYS 83 65.543 -15.092 4.802 612 HB2 CYS 83 HB2 CYS 83 63.956 -12.522 5.042 613 HB3 CYS 83 HB1 CYS 83 63.900 -13.671 3.702 614 HG CYS 83 HG CYS 83 62.259 -14.990 4.996 615 H SER 84 HN SER 84 65.528 -13.288 2.712 616 HA SER 84 HA SER 84 67.646 -11.336 3.077 617 HB2 SER 84 HB2 SER 84 69.225 -12.360 1.559 618 HB3 SER 84 HB1 SER 84 68.868 -13.499 2.852 619 HG SER 84 HG SER 84 67.272 -14.401 1.388 620 H SER 85 HN SER 85 68.123 -10.158 1.051 621 HA SER 85 HA SER 85 66.221 -10.457 -1.143 622 HB2 SER 85 HB2 SER 85 65.513 -8.042 -0.925 623 HB3 SER 85 HB1 SER 85 64.871 -9.117 0.315 624 HG SER 85 HG SER 85 65.692 -7.418 1.421 625 H GLU 86 HN GLU 86 66.640 -8.788 -2.875 626 HA GLU 86 HA GLU 86 69.389 -7.715 -2.836 627 HB2 GLU 86 HB2 GLU 86 69.900 -8.720 -4.996 628 HB3 GLU 86 HB1 GLU 86 69.498 -9.980 -3.828 629 HG2 GLU 86 HG2 GLU 86 67.141 -9.942 -4.705 630 HG3 GLU 86 HG1 GLU 86 67.680 -8.835 -5.964 631 H ALA 87 HN ALA 87 69.828 -6.146 -4.440 632 HA ALA 87 HA ALA 87 67.666 -5.104 -6.092 633 HB1 ALA 87 HB1 ALA 87 68.899 -3.475 -3.850 634 HB2 ALA 87 HB2 ALA 87 67.210 -3.974 -3.971 635 HB3 ALA 87 HB3 ALA 87 67.875 -2.817 -5.124 636 H GLN 88 HN GLN 88 68.474 -3.580 -7.700 637 HA GLN 88 HA GLN 88 71.423 -3.350 -7.816 638 HB2 GLN 88 HB2 GLN 88 71.347 -3.848 -10.239 639 HB3 GLN 88 HB1 GLN 88 70.875 -5.218 -9.238 640 HG2 GLN 88 HG2 GLN 88 68.494 -4.631 -9.597 641 HG3 GLN 88 HG1 GLN 88 68.992 -3.321 -10.667 642 HE21 GLN 88 HE21 GLN 88 67.719 -4.584 -12.360 643 HE22 GLN 88 HE22 GLN 88 68.493 -5.875 -13.146 644 H LEU 89 HN LEU 89 72.237 -1.521 -8.516 645 HA LEU 89 HA LEU 89 70.386 0.627 -9.386 646 HB2 LEU 89 HB2 LEU 89 71.628 0.937 -7.199 647 HB3 LEU 89 HB1 LEU 89 73.126 0.910 -8.124 648 HG LEU 89 HG LEU 89 71.949 2.803 -9.550 649 HD11 LEU 89 HD11 LEU 89 69.757 2.644 -8.454 650 HD12 LEU 89 HD12 LEU 89 70.477 4.222 -8.151 651 HD13 LEU 89 HD13 LEU 89 70.499 2.986 -6.893 652 HD21 LEU 89 HD21 LEU 89 73.156 3.126 -6.790 653 HD22 LEU 89 HD22 LEU 89 72.791 4.506 -7.829 654 HD23 LEU 89 HD23 LEU 89 73.958 3.293 -8.354 655 H LYS 90 HN LYS 90 70.520 1.028 -11.493 656 HA LYS 90 HA LYS 90 73.139 0.749 -12.868 657 HB2 LYS 90 HB2 LYS 90 71.194 -0.852 -13.503 658 HB3 LYS 90 HB1 LYS 90 70.464 0.565 -14.255 659 HG2 LYS 90 HG2 LYS 90 72.425 0.875 -15.674 660 HG3 LYS 90 HG1 LYS 90 73.259 -0.445 -14.860 661 HD2 LYS 90 HD2 LYS 90 72.378 -1.347 -16.907 662 HD3 LYS 90 HD1 LYS 90 71.372 -1.970 -15.601 663 HE2 LYS 90 HE2 LYS 90 69.586 -0.505 -16.122 664 HE3 LYS 90 HE1 LYS 90 70.618 0.559 -17.078 665 HZ1 LYS 90 HZ1 LYS 90 69.245 -0.821 -18.490 666 HZ2 LYS 90 HZ2 LYS 90 69.870 -2.229 -17.770 667 HZ3 LYS 90 HZ3 LYS 90 70.881 -1.219 -18.692 668 H VAL 91 HN VAL 91 73.365 2.206 -14.774 669 HA VAL 91 HA VAL 91 71.938 4.779 -14.385 670 HB VAL 91 HB VAL 91 74.119 5.830 -15.182 671 HG11 VAL 91 HG11 VAL 91 73.846 4.400 -12.530 672 HG12 VAL 91 HG12 VAL 91 73.523 6.097 -12.892 673 HG13 VAL 91 HG13 VAL 91 75.183 5.500 -12.868 674 HG21 VAL 91 HG21 VAL 91 75.145 3.744 -16.040 675 HG22 VAL 91 HG22 VAL 91 75.160 3.084 -14.405 676 HG23 VAL 91 HG23 VAL 91 76.153 4.484 -14.800 677 H THR 92 HN THR 92 70.937 5.534 -16.126 678 HA THR 92 HA THR 92 71.004 4.064 -18.594 679 HB THR 92 HB THR 92 69.670 6.656 -17.793 680 HG1 THR 92 HG1 THR 92 68.073 5.391 -17.298 681 HG21 THR 92 HG21 THR 92 68.315 6.195 -19.932 682 HG22 THR 92 HG22 THR 92 69.651 5.147 -20.409 683 HG23 THR 92 HG23 THR 92 69.930 6.867 -20.142 684 H ALA 93 HN ALA 93 72.103 4.457 -20.433 685 HA ALA 93 HA ALA 93 74.349 6.199 -20.417 686 HB1 ALA 93 HB1 ALA 93 74.778 5.417 -22.615 687 HB2 ALA 93 HB2 ALA 93 73.081 5.020 -22.889 688 HB3 ALA 93 HB3 ALA 93 74.043 4.051 -21.774 689 H GLY 94 HN GLY 94 74.722 8.107 -21.598 690 HA2 GLY 94 HA2 GLY 94 72.940 9.389 -23.324 691 HA3 GLY 94 HA1 GLY 94 72.559 9.938 -21.697 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 57.109 -6.558 13.097 2 H2 MET 1 HT2 MET 1 56.118 -7.855 12.627 3 H3 MET 1 HT3 MET 1 57.532 -8.143 13.524 4 HA MET 1 HA MET 1 56.156 -6.387 15.081 5 HB2 MET 1 HB2 MET 1 54.296 -8.397 13.781 6 HB3 MET 1 HB1 MET 1 53.917 -7.529 15.268 7 HG2 MET 1 HG2 MET 1 54.248 -5.372 14.045 8 HG3 MET 1 HG1 MET 1 54.493 -6.294 12.560 9 HE1 MET 1 HE1 MET 1 52.046 -4.033 12.799 10 HE2 MET 1 HE2 MET 1 51.127 -4.996 11.645 11 HE3 MET 1 HE3 MET 1 52.880 -4.907 11.507 12 H ALA 2 HN ALA 2 54.699 -9.454 15.308 13 HA ALA 2 HA ALA 2 56.162 -10.135 17.648 14 HB1 ALA 2 HB1 ALA 2 54.620 -12.254 16.200 15 HB2 ALA 2 HB2 ALA 2 53.733 -10.841 16.766 16 HB3 ALA 2 HB3 ALA 2 54.629 -11.835 17.912 17 HA PRO 3 HA PRO 3 58.347 -13.310 14.804 18 HB2 PRO 3 HB2 PRO 3 58.276 -12.378 12.052 19 HB3 PRO 3 HB1 PRO 3 57.582 -13.863 12.723 20 HG2 PRO 3 HG2 PRO 3 56.118 -11.713 11.762 21 HG3 PRO 3 HG1 PRO 3 55.502 -12.960 12.858 22 HD2 PRO 3 HD2 PRO 3 56.386 -10.170 13.486 23 HD3 PRO 3 HD1 PRO 3 55.119 -11.159 14.247 24 H GLU 4 HN GLU 4 60.320 -13.060 13.042 25 HA GLU 4 HA GLU 4 62.258 -11.465 14.228 26 HB2 GLU 4 HB2 GLU 4 62.074 -12.460 11.373 27 HB3 GLU 4 HB1 GLU 4 63.522 -11.740 12.075 28 HG2 GLU 4 HG2 GLU 4 62.116 -14.196 13.158 29 HG3 GLU 4 HG1 GLU 4 63.554 -14.227 12.136 30 H VAL 5 HN VAL 5 63.555 -9.951 12.487 31 HA VAL 5 HA VAL 5 62.318 -7.448 12.536 32 HB VAL 5 HB VAL 5 64.788 -8.015 12.228 33 HG11 VAL 5 HG11 VAL 5 64.253 -9.633 10.329 34 HG12 VAL 5 HG12 VAL 5 65.622 -8.549 10.074 35 HG13 VAL 5 HG13 VAL 5 64.076 -8.209 9.308 36 HG21 VAL 5 HG21 VAL 5 64.513 -5.736 11.983 37 HG22 VAL 5 HG22 VAL 5 63.273 -5.904 10.737 38 HG23 VAL 5 HG23 VAL 5 64.976 -6.106 10.325 39 H THR 6 HN THR 6 60.800 -6.483 11.179 40 HA THR 6 HA THR 6 59.679 -8.161 9.063 41 HB THR 6 HB THR 6 58.926 -5.299 9.653 42 HG1 THR 6 HG1 THR 6 57.527 -7.464 10.714 43 HG21 THR 6 HG21 THR 6 57.353 -7.632 8.539 44 HG22 THR 6 HG22 THR 6 58.089 -6.361 7.565 45 HG23 THR 6 HG23 THR 6 56.794 -5.966 8.693 46 H ILE 7 HN ILE 7 60.344 -8.137 6.998 47 HA ILE 7 HA ILE 7 61.979 -5.830 6.112 48 HB ILE 7 HB ILE 7 61.917 -8.553 4.835 49 HG12 ILE 7 HG12 ILE 7 63.494 -7.506 7.192 50 HG13 ILE 7 HG11 ILE 7 62.550 -8.987 7.097 51 HG21 ILE 7 HG21 ILE 7 63.926 -7.847 3.789 52 HG22 ILE 7 HG22 ILE 7 64.149 -6.515 4.921 53 HG23 ILE 7 HG23 ILE 7 62.881 -6.430 3.700 54 HD11 ILE 7 HD11 ILE 7 64.237 -9.609 5.178 55 HD12 ILE 7 HD12 ILE 7 64.731 -9.789 6.863 56 HD13 ILE 7 HD13 ILE 7 65.250 -8.378 5.937 57 H LEU 8 HN LEU 8 61.101 -4.471 4.852 58 HA LEU 8 HA LEU 8 59.200 -5.343 2.752 59 HB2 LEU 8 HB2 LEU 8 59.098 -2.769 4.352 60 HB3 LEU 8 HB1 LEU 8 58.036 -3.184 3.012 61 HG LEU 8 HG LEU 8 58.271 -4.812 5.561 62 HD11 LEU 8 HD11 LEU 8 56.086 -3.809 6.147 63 HD12 LEU 8 HD12 LEU 8 56.170 -2.796 4.707 64 HD13 LEU 8 HD13 LEU 8 57.339 -2.575 6.008 65 HD21 LEU 8 HD21 LEU 8 56.528 -4.953 3.092 66 HD22 LEU 8 HD22 LEU 8 55.962 -5.609 4.626 67 HD23 LEU 8 HD23 LEU 8 57.422 -6.250 3.883 68 H GLU 9 HN GLU 9 60.320 -5.188 0.925 69 HA GLU 9 HA GLU 9 62.109 -2.847 0.520 70 HB2 GLU 9 HB2 GLU 9 63.319 -4.474 -1.053 71 HB3 GLU 9 HB1 GLU 9 63.528 -4.694 0.684 72 HG2 GLU 9 HG2 GLU 9 61.285 -6.159 -0.695 73 HG3 GLU 9 HG1 GLU 9 62.927 -6.768 -0.868 74 HA PRO 10 HA PRO 10 58.975 -2.710 -2.852 75 HB2 PRO 10 HB2 PRO 10 59.059 0.187 -2.736 76 HB3 PRO 10 HB1 PRO 10 57.727 -0.882 -2.272 77 HG2 PRO 10 HG2 PRO 10 59.264 0.650 -0.521 78 HG3 PRO 10 HG1 PRO 10 58.230 -0.711 -0.067 79 HD2 PRO 10 HD2 PRO 10 61.199 -0.618 -0.344 80 HD3 PRO 10 HD1 PRO 10 60.185 -1.647 0.696 81 H LEU 11 HN LEU 11 62.128 -1.677 -2.354 82 HA LEU 11 HA LEU 11 62.695 -0.288 -4.772 83 HB2 LEU 11 HB2 LEU 11 64.553 -1.909 -3.017 84 HB3 LEU 11 HB1 LEU 11 65.034 -0.692 -4.197 85 HG LEU 11 HG LEU 11 63.271 -0.151 -1.791 86 HD11 LEU 11 HD11 LEU 11 65.505 -0.740 -1.052 87 HD12 LEU 11 HD12 LEU 11 65.301 1.004 -0.899 88 HD13 LEU 11 HD13 LEU 11 66.227 0.341 -2.245 89 HD21 LEU 11 HD21 LEU 11 62.756 1.619 -3.185 90 HD22 LEU 11 HD22 LEU 11 64.261 1.504 -4.089 91 HD23 LEU 11 HD23 LEU 11 64.243 2.272 -2.500 92 H GLN 12 HN GLN 12 61.593 -1.666 -6.348 93 HA GLN 12 HA GLN 12 62.454 -4.360 -6.804 94 HB2 GLN 12 HB2 GLN 12 60.998 -2.408 -8.608 95 HB3 GLN 12 HB1 GLN 12 61.225 -4.123 -8.953 96 HG2 GLN 12 HG2 GLN 12 59.847 -3.053 -6.475 97 HG3 GLN 12 HG1 GLN 12 59.000 -3.600 -7.920 98 HE21 GLN 12 HE21 GLN 12 59.682 -4.682 -4.920 99 HE22 GLN 12 HE22 GLN 12 59.886 -6.336 -5.226 100 H ASP 13 HN ASP 13 62.941 -1.380 -8.713 101 HA ASP 13 HA ASP 13 65.710 -1.800 -9.172 102 HB2 ASP 13 HB2 ASP 13 64.911 -3.681 -10.543 103 HB3 ASP 13 HB1 ASP 13 63.856 -2.590 -11.436 104 H VAL 14 HN VAL 14 66.604 0.089 -9.969 105 HA VAL 14 HA VAL 14 64.801 2.014 -11.315 106 HB VAL 14 HB VAL 14 65.729 3.845 -9.927 107 HG11 VAL 14 HG11 VAL 14 64.432 1.621 -8.324 108 HG12 VAL 14 HG12 VAL 14 63.567 2.754 -9.365 109 HG13 VAL 14 HG13 VAL 14 64.407 3.339 -7.928 110 HG21 VAL 14 HG21 VAL 14 67.825 2.838 -9.225 111 HG22 VAL 14 HG22 VAL 14 66.968 1.527 -8.413 112 HG23 VAL 14 HG23 VAL 14 66.863 3.171 -7.786 113 H GLN 15 HN GLN 15 65.862 3.659 -12.510 114 HA GLN 15 HA GLN 15 68.672 3.053 -13.259 115 HB2 GLN 15 HB2 GLN 15 68.105 3.699 -15.560 116 HB3 GLN 15 HB1 GLN 15 67.116 2.338 -15.034 117 HG2 GLN 15 HG2 GLN 15 65.309 3.981 -14.427 118 HG3 GLN 15 HG1 GLN 15 66.287 5.251 -15.157 119 HE21 GLN 15 HE21 GLN 15 64.157 5.294 -16.562 120 HE22 GLN 15 HE22 GLN 15 64.171 4.314 -17.946 121 H LEU 16 HN LEU 16 70.044 4.737 -13.191 122 HA LEU 16 HA LEU 16 68.918 7.464 -12.811 123 HB2 LEU 16 HB2 LEU 16 71.502 6.361 -11.698 124 HB3 LEU 16 HB1 LEU 16 70.782 7.931 -11.354 125 HG LEU 16 HG LEU 16 69.511 5.261 -10.701 126 HD11 LEU 16 HD11 LEU 16 71.393 5.545 -9.268 127 HD12 LEU 16 HD12 LEU 16 69.994 6.063 -8.326 128 HD13 LEU 16 HD13 LEU 16 71.065 7.264 -9.053 129 HD21 LEU 16 HD21 LEU 16 68.673 8.142 -10.347 130 HD22 LEU 16 HD22 LEU 16 68.104 6.909 -9.220 131 HD23 LEU 16 HD23 LEU 16 67.724 6.776 -10.935 132 H SER 17 HN SER 17 69.445 8.870 -14.353 133 HA SER 17 HA SER 17 71.442 8.245 -16.336 134 HB2 SER 17 HB2 SER 17 69.531 9.510 -17.074 135 HB3 SER 17 HB1 SER 17 69.768 10.709 -15.809 136 HG SER 17 HG SER 17 70.767 10.715 -18.237 137 H GLU 18 HN GLU 18 73.471 9.249 -16.578 138 HA GLU 18 HA GLU 18 74.846 9.874 -14.211 139 HB2 GLU 18 HB2 GLU 18 75.975 9.082 -16.251 140 HB3 GLU 18 HB1 GLU 18 75.584 10.599 -17.059 141 HG2 GLU 18 HG2 GLU 18 77.874 10.688 -16.216 142 HG3 GLU 18 HG1 GLU 18 76.885 11.823 -15.309 143 H GLY 19 HN GLY 19 75.306 11.733 -13.166 144 HA2 GLY 19 HA2 GLY 19 75.520 14.056 -12.860 145 HA3 GLY 19 HA1 GLY 19 74.614 14.327 -14.344 146 H GLN 20 HN GLN 20 72.937 12.019 -12.701 147 HA GLN 20 HA GLN 20 71.191 14.026 -11.374 148 HB2 GLN 20 HB2 GLN 20 70.502 11.431 -12.766 149 HB3 GLN 20 HB1 GLN 20 69.361 12.348 -11.781 150 HG2 GLN 20 HG2 GLN 20 69.631 14.300 -13.228 151 HG3 GLN 20 HG1 GLN 20 70.846 13.456 -14.181 152 HE21 GLN 20 HE21 GLN 20 69.029 14.123 -15.877 153 HE22 GLN 20 HE22 GLN 20 67.846 12.941 -16.164 154 H ASP 21 HN ASP 21 70.745 13.784 -9.275 155 HA ASP 21 HA ASP 21 72.117 11.742 -7.766 156 HB2 ASP 21 HB2 ASP 21 71.243 12.895 -5.805 157 HB3 ASP 21 HB1 ASP 21 71.903 14.070 -6.940 158 H ALA 22 HN ALA 22 70.812 10.639 -5.934 159 HA ALA 22 HA ALA 22 68.068 9.977 -6.578 160 HB1 ALA 22 HB1 ALA 22 68.424 7.628 -7.019 161 HB2 ALA 22 HB2 ALA 22 70.164 7.812 -6.789 162 HB3 ALA 22 HB3 ALA 22 69.369 8.577 -8.167 163 H SER 23 HN SER 23 67.316 8.110 -5.127 164 HA SER 23 HA SER 23 68.781 7.804 -2.641 165 HB2 SER 23 HB2 SER 23 66.834 8.655 -1.287 166 HB3 SER 23 HB1 SER 23 67.720 9.904 -2.157 167 HG SER 23 HG SER 23 65.959 9.133 -3.853 168 H PHE 24 HN PHE 24 67.673 6.324 -1.152 169 HA PHE 24 HA PHE 24 65.735 4.528 -2.505 170 HB2 PHE 24 HB2 PHE 24 68.167 3.773 -0.881 171 HB3 PHE 24 HB1 PHE 24 66.897 2.643 -1.319 172 HD1 PHE 24 HD1 PHE 24 69.826 4.482 -2.479 173 HD2 PHE 24 HD2 PHE 24 66.447 2.147 -3.715 174 HE1 PHE 24 HE1 PHE 24 70.891 4.104 -4.690 175 HE2 PHE 24 HE2 PHE 24 67.503 1.770 -5.922 176 HZ PHE 24 HZ PHE 24 69.728 2.744 -6.411 177 H GLN 25 HN GLN 25 64.294 3.423 -1.106 178 HA GLN 25 HA GLN 25 64.150 4.449 1.676 179 HB2 GLN 25 HB2 GLN 25 62.531 5.634 0.199 180 HB3 GLN 25 HB1 GLN 25 61.809 4.080 -0.214 181 HG2 GLN 25 HG2 GLN 25 61.255 3.690 2.148 182 HG3 GLN 25 HG1 GLN 25 62.017 5.219 2.591 183 HE21 GLN 25 HE21 GLN 25 59.304 4.878 3.220 184 HE22 GLN 25 HE22 GLN 25 58.358 5.855 2.205 185 H CYS 26 HN CYS 26 63.912 2.897 3.166 186 HA CYS 26 HA CYS 26 62.689 0.321 2.418 187 HB2 CYS 26 HB2 CYS 26 65.157 0.074 2.151 188 HB3 CYS 26 HB1 CYS 26 65.349 0.514 3.848 189 HG CYS 26 HG CYS 26 65.059 -2.201 3.278 190 H ARG 27 HN ARG 27 62.224 -1.031 4.357 191 HA ARG 27 HA ARG 27 61.990 0.525 6.866 192 HB2 ARG 27 HB2 ARG 27 59.716 -0.769 5.362 193 HB3 ARG 27 HB1 ARG 27 59.618 -0.371 7.075 194 HG2 ARG 27 HG2 ARG 27 60.084 1.982 6.578 195 HG3 ARG 27 HG1 ARG 27 60.252 1.601 4.863 196 HD2 ARG 27 HD2 ARG 27 57.921 0.838 4.788 197 HD3 ARG 27 HD1 ARG 27 57.742 1.170 6.509 198 HE ARG 27 HE ARG 27 58.608 3.479 5.028 199 HH11 ARG 27 HH11 ARG 27 56.093 1.934 6.733 200 HH12 ARG 27 HH12 ARG 27 54.851 3.024 6.214 201 HH21 ARG 27 HH21 ARG 27 56.907 4.730 4.001 202 HH22 ARG 27 HH22 ARG 27 55.314 4.612 4.669 203 H LEU 28 HN LEU 28 62.789 -0.650 8.475 204 HA LEU 28 HA LEU 28 62.446 -3.594 8.406 205 HB2 LEU 28 HB2 LEU 28 64.859 -2.078 9.409 206 HB3 LEU 28 HB1 LEU 28 64.646 -3.827 9.446 207 HG LEU 28 HG LEU 28 64.677 -2.136 6.924 208 HD11 LEU 28 HD11 LEU 28 66.880 -3.096 6.521 209 HD12 LEU 28 HD12 LEU 28 66.769 -4.054 7.998 210 HD13 LEU 28 HD13 LEU 28 66.884 -2.296 8.092 211 HD21 LEU 28 HD21 LEU 28 65.060 -4.585 5.988 212 HD22 LEU 28 HD22 LEU 28 63.432 -4.029 6.342 213 HD23 LEU 28 HD23 LEU 28 64.270 -5.070 7.488 214 H SER 29 HN SER 29 60.814 -3.875 9.911 215 HA SER 29 HA SER 29 60.501 -2.285 12.245 216 HB2 SER 29 HB2 SER 29 58.681 -3.709 11.296 217 HB3 SER 29 HB1 SER 29 59.557 -5.135 11.855 218 HG SER 29 HG SER 29 59.410 -3.376 13.845 219 H ARG 30 HN ARG 30 60.575 -3.314 14.501 220 HA ARG 30 HA ARG 30 63.205 -3.743 15.235 221 HB2 ARG 30 HB2 ARG 30 62.347 -4.475 17.402 222 HB3 ARG 30 HB1 ARG 30 61.415 -3.103 16.808 223 HG2 ARG 30 HG2 ARG 30 59.654 -4.627 16.000 224 HG3 ARG 30 HG1 ARG 30 60.581 -6.015 16.565 225 HD2 ARG 30 HD2 ARG 30 60.473 -5.136 18.876 226 HD3 ARG 30 HD1 ARG 30 59.498 -3.783 18.303 227 HE ARG 30 HE ARG 30 58.208 -6.100 17.454 228 HH11 ARG 30 HH11 ARG 30 57.166 -7.572 18.955 229 HH12 ARG 30 HH12 ARG 30 56.744 -6.953 20.516 230 HH21 ARG 30 HH21 ARG 30 58.535 -4.012 20.124 231 HH22 ARG 30 HH22 ARG 30 57.516 -4.936 21.176 232 H ALA 31 HN ALA 31 64.504 -5.424 15.574 233 HA ALA 31 HA ALA 31 63.799 -7.969 14.326 234 HB1 ALA 31 HB1 ALA 31 66.487 -7.293 15.499 235 HB2 ALA 31 HB2 ALA 31 65.986 -6.627 13.946 236 HB3 ALA 31 HB3 ALA 31 66.101 -8.371 14.159 237 H SER 32 HN SER 32 65.301 -9.787 15.545 238 HA SER 32 HA SER 32 64.796 -9.774 18.428 239 HB2 SER 32 HB2 SER 32 62.671 -10.610 17.470 240 HB3 SER 32 HB1 SER 32 63.564 -11.855 16.601 241 HG SER 32 HG SER 32 63.566 -11.480 19.418 242 H GLY 33 HN GLY 33 65.493 -12.013 15.746 243 HA2 GLY 33 HA2 GLY 33 67.498 -13.430 17.233 244 HA3 GLY 33 HA1 GLY 33 67.156 -13.600 15.508 245 H GLN 34 HN GLN 34 68.193 -12.236 14.010 246 HA GLN 34 HA GLN 34 70.419 -10.608 15.089 247 HB2 GLN 34 HB2 GLN 34 70.418 -12.440 12.677 248 HB3 GLN 34 HB1 GLN 34 71.711 -11.299 13.053 249 HG2 GLN 34 HG2 GLN 34 72.126 -12.411 15.186 250 HG3 GLN 34 HG1 GLN 34 70.766 -13.498 14.914 251 HE21 GLN 34 HE21 GLN 34 73.896 -13.848 15.048 252 HE22 GLN 34 HE22 GLN 34 74.213 -14.828 13.700 253 H GLU 35 HN GLU 35 70.858 -8.684 14.119 254 HA GLU 35 HA GLU 35 68.701 -7.479 12.628 255 HB2 GLU 35 HB2 GLU 35 69.952 -6.262 14.395 256 HB3 GLU 35 HB1 GLU 35 71.402 -6.344 13.398 257 HG2 GLU 35 HG2 GLU 35 70.288 -5.066 11.625 258 HG3 GLU 35 HG1 GLU 35 68.799 -5.030 12.565 259 H ALA 36 HN ALA 36 68.850 -6.515 10.573 260 HA ALA 36 HA ALA 36 70.365 -7.981 8.630 261 HB1 ALA 36 HB1 ALA 36 69.298 -6.471 7.007 262 HB2 ALA 36 HB2 ALA 36 68.732 -5.445 8.325 263 HB3 ALA 36 HB3 ALA 36 68.106 -7.085 8.155 264 H ARG 37 HN ARG 37 71.913 -7.070 7.124 265 HA ARG 37 HA ARG 37 73.392 -4.717 8.182 266 HB2 ARG 37 HB2 ARG 37 74.531 -7.276 7.020 267 HB3 ARG 37 HB1 ARG 37 75.471 -5.839 7.422 268 HG2 ARG 37 HG2 ARG 37 75.735 -6.992 9.414 269 HG3 ARG 37 HG1 ARG 37 74.236 -6.155 9.798 270 HD2 ARG 37 HD2 ARG 37 72.964 -8.159 9.016 271 HD3 ARG 37 HD1 ARG 37 74.492 -8.988 8.738 272 HE ARG 37 HE ARG 37 73.276 -8.393 11.325 273 HH11 ARG 37 HH11 ARG 37 74.012 -10.959 11.604 274 HH12 ARG 37 HH12 ARG 37 75.688 -11.019 12.043 275 HH21 ARG 37 HH21 ARG 37 76.344 -7.774 10.997 276 HH22 ARG 37 HH22 ARG 37 77.011 -9.211 11.698 277 H TRP 38 HN TRP 38 73.890 -3.178 6.786 278 HA TRP 38 HA TRP 38 72.876 -3.269 4.090 279 HB2 TRP 38 HB2 TRP 38 73.262 -1.282 5.921 280 HB3 TRP 38 HB1 TRP 38 74.700 -1.055 4.935 281 HD1 TRP 38 HD1 TRP 38 74.320 0.627 3.091 282 HE1 TRP 38 HE1 TRP 38 72.332 1.363 1.624 283 HE3 TRP 38 HE3 TRP 38 70.704 -2.511 4.869 284 HZ2 TRP 38 HZ2 TRP 38 69.572 0.701 1.250 285 HZ3 TRP 38 HZ3 TRP 38 68.407 -2.438 3.940 286 HH2 TRP 38 HH2 TRP 38 67.837 -0.836 2.135 287 H ALA 39 HN ALA 39 74.223 -2.888 2.143 288 HA ALA 39 HA ALA 39 77.073 -3.116 2.315 289 HB1 ALA 39 HB1 ALA 39 76.547 -5.418 2.915 290 HB2 ALA 39 HB2 ALA 39 77.293 -5.361 1.318 291 HB3 ALA 39 HB3 ALA 39 75.551 -5.585 1.469 292 H LEU 40 HN LEU 40 78.128 -2.998 0.306 293 HA LEU 40 HA LEU 40 76.396 -2.506 -2.048 294 HB2 LEU 40 HB2 LEU 40 77.359 -0.397 -0.998 295 HB3 LEU 40 HB1 LEU 40 78.956 -1.007 -1.407 296 HG LEU 40 HG LEU 40 78.095 0.613 -3.080 297 HD11 LEU 40 HD11 LEU 40 78.119 -2.023 -4.513 298 HD12 LEU 40 HD12 LEU 40 79.556 -1.517 -3.620 299 HD13 LEU 40 HD13 LEU 40 78.926 -0.510 -4.921 300 HD21 LEU 40 HD21 LEU 40 76.121 0.352 -4.266 301 HD22 LEU 40 HD22 LEU 40 75.647 -0.343 -2.718 302 HD23 LEU 40 HD23 LEU 40 76.092 -1.400 -4.060 303 H GLY 41 HN GLY 41 76.807 -4.000 -3.528 304 HA2 GLY 41 HA2 GLY 41 78.067 -5.236 -5.049 305 HA3 GLY 41 HA1 GLY 41 79.536 -4.674 -4.255 306 H GLY 42 HN GLY 42 77.433 -5.715 -1.904 307 HA2 GLY 42 HA2 GLY 42 76.967 -7.907 -1.052 308 HA3 GLY 42 HA1 GLY 42 78.314 -8.537 -1.989 309 H VAL 43 HN VAL 43 79.647 -5.840 -0.853 310 HA VAL 43 HA VAL 43 80.658 -7.168 1.583 311 HB VAL 43 HB VAL 43 82.593 -5.534 1.278 312 HG11 VAL 43 HG11 VAL 43 83.658 -6.952 -0.393 313 HG12 VAL 43 HG12 VAL 43 82.089 -7.512 -0.966 314 HG13 VAL 43 HG13 VAL 43 82.648 -7.959 0.644 315 HG21 VAL 43 HG21 VAL 43 81.415 -5.310 -1.504 316 HG22 VAL 43 HG22 VAL 43 82.839 -4.484 -0.873 317 HG23 VAL 43 HG23 VAL 43 81.235 -4.056 -0.278 318 HA PRO 44 HA PRO 44 78.911 -3.890 4.015 319 HB2 PRO 44 HB2 PRO 44 81.111 -3.683 5.909 320 HB3 PRO 44 HB1 PRO 44 79.537 -4.459 6.133 321 HG2 PRO 44 HG2 PRO 44 81.990 -5.769 5.921 322 HG3 PRO 44 HG1 PRO 44 80.393 -6.516 5.763 323 HD2 PRO 44 HD2 PRO 44 82.360 -5.840 3.641 324 HD3 PRO 44 HD1 PRO 44 81.051 -7.036 3.645 325 H LEU 45 HN LEU 45 79.059 -1.647 4.518 326 HA LEU 45 HA LEU 45 81.415 -0.211 3.427 327 HB2 LEU 45 HB2 LEU 45 79.599 1.549 2.721 328 HB3 LEU 45 HB1 LEU 45 79.892 0.149 1.692 329 HG LEU 45 HG LEU 45 77.994 -1.027 2.701 330 HD11 LEU 45 HD11 LEU 45 77.898 -0.267 4.933 331 HD12 LEU 45 HD12 LEU 45 76.460 0.433 4.195 332 HD13 LEU 45 HD13 LEU 45 77.890 1.430 4.448 333 HD21 LEU 45 HD21 LEU 45 76.393 0.058 1.445 334 HD22 LEU 45 HD22 LEU 45 77.808 0.919 0.845 335 HD23 LEU 45 HD23 LEU 45 76.795 1.650 2.088 336 H GLN 46 HN GLN 46 80.904 2.294 3.996 337 HA GLN 46 HA GLN 46 79.925 2.517 6.763 338 HB2 GLN 46 HB2 GLN 46 82.376 2.075 6.881 339 HB3 GLN 46 HB1 GLN 46 82.652 3.507 5.890 340 HG2 GLN 46 HG2 GLN 46 81.623 4.931 7.577 341 HG3 GLN 46 HG1 GLN 46 81.188 3.524 8.544 342 HE21 GLN 46 HE21 GLN 46 82.615 3.184 10.243 343 HE22 GLN 46 HE22 GLN 46 84.268 3.569 10.222 344 H ALA 47 HN ALA 47 79.277 4.626 7.322 345 HA ALA 47 HA ALA 47 78.041 6.149 5.385 346 HB1 ALA 47 HB1 ALA 47 79.110 6.977 8.088 347 HB2 ALA 47 HB2 ALA 47 77.473 6.448 7.697 348 HB3 ALA 47 HB3 ALA 47 78.067 7.996 7.096 349 H ASN 48 HN ASN 48 79.568 6.298 3.642 350 HA ASN 48 HA ASN 48 81.953 7.909 3.952 351 HB2 ASN 48 HB2 ASN 48 81.820 6.010 2.353 352 HB3 ASN 48 HB1 ASN 48 80.609 6.901 1.433 353 HD21 ASN 48 HD21 ASN 48 82.186 6.880 -0.407 354 HD22 ASN 48 HD22 ASN 48 83.472 7.988 -0.414 355 H GLU 49 HN GLU 49 82.311 9.851 2.597 356 HA GLU 49 HA GLU 49 80.393 11.833 3.089 357 HB2 GLU 49 HB2 GLU 49 82.789 12.288 2.655 358 HB3 GLU 49 HB1 GLU 49 82.555 11.836 0.967 359 HG2 GLU 49 HG2 GLU 49 80.897 13.651 0.706 360 HG3 GLU 49 HG1 GLU 49 81.126 14.100 2.394 361 H MET 50 HN MET 50 81.098 10.019 0.109 362 HA MET 50 HA MET 50 79.148 11.316 -1.487 363 HB2 MET 50 HB2 MET 50 80.526 8.639 -1.741 364 HB3 MET 50 HB1 MET 50 79.427 9.283 -2.964 365 HG2 MET 50 HG2 MET 50 80.838 11.308 -3.155 366 HG3 MET 50 HG1 MET 50 81.944 10.643 -1.956 367 HE1 MET 50 HE1 MET 50 83.122 11.538 -4.773 368 HE2 MET 50 HE2 MET 50 84.256 10.191 -4.861 369 HE3 MET 50 HE3 MET 50 83.882 10.921 -3.298 370 H ASN 51 HN ASN 51 79.053 8.433 0.563 371 HA ASN 51 HA ASN 51 76.147 8.150 0.022 372 HB2 ASN 51 HB2 ASN 51 78.127 6.168 1.171 373 HB3 ASN 51 HB1 ASN 51 76.407 5.870 0.937 374 HD21 ASN 51 HD21 ASN 51 79.285 5.180 -0.480 375 HD22 ASN 51 HD22 ASN 51 78.811 5.130 -2.110 376 H ASP 52 HN ASP 52 74.977 9.200 1.509 377 HA ASP 52 HA ASP 52 75.899 9.269 4.319 378 HB2 ASP 52 HB2 ASP 52 73.963 10.998 2.766 379 HB3 ASP 52 HB1 ASP 52 74.137 11.073 4.519 380 H ILE 53 HN ILE 53 74.533 8.563 5.950 381 HA ILE 53 HA ILE 53 72.081 7.137 5.077 382 HB ILE 53 HB ILE 53 73.987 6.243 7.257 383 HG12 ILE 53 HG12 ILE 53 73.642 5.264 4.401 384 HG13 ILE 53 HG11 ILE 53 75.064 6.083 5.042 385 HG21 ILE 53 HG21 ILE 53 71.536 5.593 7.365 386 HG22 ILE 53 HG22 ILE 53 72.647 4.232 7.228 387 HG23 ILE 53 HG23 ILE 53 71.758 4.790 5.813 388 HD11 ILE 53 HD11 ILE 53 73.987 3.380 5.887 389 HD12 ILE 53 HD12 ILE 53 75.301 4.221 6.709 390 HD13 ILE 53 HD13 ILE 53 75.497 3.701 5.036 391 H THR 54 HN THR 54 70.308 7.692 6.120 392 HA THR 54 HA THR 54 70.538 9.173 8.684 393 HB THR 54 HB THR 54 68.631 9.660 6.385 394 HG1 THR 54 HG1 THR 54 70.751 10.478 6.122 395 HG21 THR 54 HG21 THR 54 67.388 10.113 8.335 396 HG22 THR 54 HG22 THR 54 68.061 11.682 7.890 397 HG23 THR 54 HG23 THR 54 68.794 10.746 9.192 398 H VAL 55 HN VAL 55 69.363 8.430 10.307 399 HA VAL 55 HA VAL 55 67.362 6.303 9.776 400 HB VAL 55 HB VAL 55 69.170 6.805 12.152 401 HG11 VAL 55 HG11 VAL 55 67.095 6.097 13.100 402 HG12 VAL 55 HG12 VAL 55 68.080 4.639 12.985 403 HG13 VAL 55 HG13 VAL 55 66.813 4.941 11.798 404 HG21 VAL 55 HG21 VAL 55 70.019 5.637 10.035 405 HG22 VAL 55 HG22 VAL 55 68.879 4.346 10.416 406 HG23 VAL 55 HG23 VAL 55 70.182 4.729 11.538 407 H GLU 56 HN GLU 56 65.326 6.619 10.390 408 HA GLU 56 HA GLU 56 64.675 8.770 12.314 409 HB2 GLU 56 HB2 GLU 56 64.413 9.733 10.083 410 HB3 GLU 56 HB1 GLU 56 63.413 8.369 9.586 411 HG2 GLU 56 HG2 GLU 56 61.710 8.972 11.231 412 HG3 GLU 56 HG1 GLU 56 62.727 10.274 11.846 413 H GLN 57 HN GLN 57 62.569 8.506 13.299 414 HA GLN 57 HA GLN 57 61.992 6.061 14.324 415 HB2 GLN 57 HB2 GLN 57 59.556 6.913 14.472 416 HB3 GLN 57 HB1 GLN 57 60.817 7.849 15.269 417 HG2 GLN 57 HG2 GLN 57 60.927 9.395 13.398 418 HG3 GLN 57 HG1 GLN 57 59.783 8.415 12.480 419 HE21 GLN 57 HE21 GLN 57 58.493 10.541 12.478 420 HE22 GLN 57 HE22 GLN 57 57.496 10.853 13.815 421 H GLY 58 HN GLY 58 60.076 4.638 13.974 422 HA2 GLY 58 HA2 GLY 58 58.826 3.206 12.663 423 HA3 GLY 58 HA1 GLY 58 58.884 4.426 11.387 424 H THR 59 HN THR 59 61.887 3.566 12.705 425 HA THR 59 HA THR 59 63.739 2.599 11.781 426 HB THR 59 HB THR 59 63.470 0.305 11.035 427 HG1 THR 59 HG1 THR 59 60.728 0.348 11.333 428 HG21 THR 59 HG21 THR 59 61.588 1.034 13.290 429 HG22 THR 59 HG22 THR 59 63.330 0.810 13.437 430 HG23 THR 59 HG23 THR 59 62.297 -0.558 13.025 431 H LEU 60 HN LEU 60 62.265 4.550 10.231 432 HA LEU 60 HA LEU 60 62.240 3.723 7.482 433 HB2 LEU 60 HB2 LEU 60 62.161 6.425 8.841 434 HB3 LEU 60 HB1 LEU 60 62.148 6.257 7.089 435 HG LEU 60 HG LEU 60 60.143 4.730 8.754 436 HD11 LEU 60 HD11 LEU 60 59.960 7.080 9.480 437 HD12 LEU 60 HD12 LEU 60 58.574 6.634 8.487 438 HD13 LEU 60 HD13 LEU 60 59.878 7.600 7.798 439 HD21 LEU 60 HD21 LEU 60 60.464 4.354 6.241 440 HD22 LEU 60 HD22 LEU 60 59.892 6.002 6.011 441 HD23 LEU 60 HD23 LEU 60 58.832 4.795 6.731 442 H HIS 61 HN HIS 61 63.886 3.639 6.081 443 HA HIS 61 HA HIS 61 66.517 4.760 6.886 444 HB2 HIS 61 HB2 HIS 61 65.827 2.384 5.145 445 HB3 HIS 61 HB1 HIS 61 67.454 3.036 5.329 446 HD1 HIS 61 HD1 HIS 61 64.708 1.348 7.304 447 HD2 HIS 61 HD2 HIS 61 68.733 2.342 7.735 448 HE1 HIS 61 HE1 HIS 61 65.518 0.168 9.393 449 H LEU 62 HN LEU 62 67.761 5.825 5.303 450 HA LEU 62 HA LEU 62 66.562 6.304 2.674 451 HB2 LEU 62 HB2 LEU 62 65.483 7.987 4.075 452 HB3 LEU 62 HB1 LEU 62 67.046 8.507 4.693 453 HG LEU 62 HG LEU 62 67.718 9.256 2.456 454 HD11 LEU 62 HD11 LEU 62 65.757 9.309 0.717 455 HD12 LEU 62 HD12 LEU 62 65.097 7.983 1.676 456 HD13 LEU 62 HD13 LEU 62 66.680 7.821 0.915 457 HD21 LEU 62 HD21 LEU 62 65.858 11.009 2.148 458 HD22 LEU 62 HD22 LEU 62 66.636 10.947 3.728 459 HD23 LEU 62 HD23 LEU 62 65.047 10.219 3.499 460 H LEU 63 HN LEU 63 68.290 5.704 1.457 461 HA LEU 63 HA LEU 63 70.991 6.520 2.249 462 HB2 LEU 63 HB2 LEU 63 69.804 4.479 0.525 463 HB3 LEU 63 HB1 LEU 63 71.086 5.324 -0.317 464 HG LEU 63 HG LEU 63 71.837 3.269 0.892 465 HD11 LEU 63 HD11 LEU 63 73.117 5.677 2.176 466 HD12 LEU 63 HD12 LEU 63 73.283 5.359 0.455 467 HD13 LEU 63 HD13 LEU 63 73.871 4.186 1.629 468 HD21 LEU 63 HD21 LEU 63 71.701 3.006 3.194 469 HD22 LEU 63 HD22 LEU 63 70.189 3.851 2.877 470 HD23 LEU 63 HD23 LEU 63 71.575 4.732 3.502 471 H THR 64 HN THR 64 71.368 8.650 1.874 472 HA THR 64 HA THR 64 70.235 9.906 -0.524 473 HB THR 64 HB THR 64 71.872 11.094 1.727 474 HG1 THR 64 HG1 THR 64 70.015 11.449 2.678 475 HG21 THR 64 HG21 THR 64 70.893 13.232 0.796 476 HG22 THR 64 HG22 THR 64 70.356 12.296 -0.599 477 HG23 THR 64 HG23 THR 64 72.076 12.450 -0.251 478 H LEU 65 HN LEU 65 71.332 9.485 -2.310 479 HA LEU 65 HA LEU 65 74.278 9.389 -2.266 480 HB2 LEU 65 HB2 LEU 65 73.177 7.537 -3.387 481 HB3 LEU 65 HB1 LEU 65 72.260 8.649 -4.398 482 HG LEU 65 HG LEU 65 74.308 9.423 -5.486 483 HD11 LEU 65 HD11 LEU 65 75.992 9.379 -3.838 484 HD12 LEU 65 HD12 LEU 65 76.447 8.038 -4.887 485 HD13 LEU 65 HD13 LEU 65 75.619 7.722 -3.362 486 HD21 LEU 65 HD21 LEU 65 73.290 7.456 -6.462 487 HD22 LEU 65 HD22 LEU 65 74.063 6.408 -5.273 488 HD23 LEU 65 HD23 LEU 65 75.038 7.228 -6.492 489 H HIS 66 HN HIS 66 75.226 11.309 -2.489 490 HA HIS 66 HA HIS 66 73.982 13.423 -4.094 491 HB2 HIS 66 HB2 HIS 66 75.618 13.339 -1.753 492 HB3 HIS 66 HB1 HIS 66 76.563 14.167 -2.985 493 HD1 HIS 66 HD1 HIS 66 74.177 14.862 -0.445 494 HD2 HIS 66 HD2 HIS 66 74.731 16.266 -4.331 495 HE1 HIS 66 HE1 HIS 66 72.916 17.052 -0.601 496 H LYS 67 HN LYS 67 74.888 14.338 -5.907 497 HA LYS 67 HA LYS 67 75.910 14.176 -7.980 498 HB2 LYS 67 HB2 LYS 67 78.221 13.997 -6.039 499 HB3 LYS 67 HB1 LYS 67 78.408 14.292 -7.769 500 HG2 LYS 67 HG2 LYS 67 77.017 16.305 -7.603 501 HG3 LYS 67 HG1 LYS 67 76.764 16.006 -5.883 502 HD2 LYS 67 HD2 LYS 67 79.182 16.231 -5.479 503 HD3 LYS 67 HD1 LYS 67 79.448 16.513 -7.201 504 HE2 LYS 67 HE2 LYS 67 78.037 18.527 -7.103 505 HE3 LYS 67 HE1 LYS 67 77.739 18.243 -5.387 506 HZ1 LYS 67 HZ1 LYS 67 79.486 19.819 -5.576 507 HZ2 LYS 67 HZ2 LYS 67 80.336 18.850 -6.684 508 HZ3 LYS 67 HZ3 LYS 67 80.184 18.361 -5.064 509 H VAL 68 HN VAL 68 75.227 12.293 -8.951 510 HA VAL 68 HA VAL 68 76.315 9.736 -8.226 511 HB VAL 68 HB VAL 68 74.001 10.207 -9.267 512 HG11 VAL 68 HG11 VAL 68 73.819 10.426 -11.610 513 HG12 VAL 68 HG12 VAL 68 75.493 9.927 -11.880 514 HG13 VAL 68 HG13 VAL 68 75.143 11.518 -11.199 515 HG21 VAL 68 HG21 VAL 68 73.940 8.015 -10.285 516 HG22 VAL 68 HG22 VAL 68 75.072 7.932 -8.937 517 HG23 VAL 68 HG23 VAL 68 75.676 8.051 -10.590 518 H THR 69 HN THR 69 77.529 8.356 -9.609 519 HA THR 69 HA THR 69 79.214 9.683 -11.635 520 HB THR 69 HB THR 69 80.268 7.794 -9.515 521 HG1 THR 69 HG1 THR 69 80.086 9.540 -8.344 522 HG21 THR 69 HG21 THR 69 81.531 7.799 -11.621 523 HG22 THR 69 HG22 THR 69 82.460 8.594 -10.353 524 HG23 THR 69 HG23 THR 69 81.629 9.558 -11.573 525 H LEU 70 HN LEU 70 80.141 8.162 -13.165 526 HA LEU 70 HA LEU 70 78.358 6.212 -14.077 527 HB2 LEU 70 HB2 LEU 70 81.329 6.536 -14.556 528 HB3 LEU 70 HB1 LEU 70 80.318 5.402 -15.444 529 HG LEU 70 HG LEU 70 79.689 8.361 -15.285 530 HD11 LEU 70 HD11 LEU 70 80.761 8.576 -17.494 531 HD12 LEU 70 HD12 LEU 70 81.259 6.885 -17.424 532 HD13 LEU 70 HD13 LEU 70 81.928 8.052 -16.280 533 HD21 LEU 70 HD21 LEU 70 78.569 7.687 -17.548 534 HD22 LEU 70 HD22 LEU 70 77.769 7.209 -16.057 535 HD23 LEU 70 HD23 LEU 70 78.721 6.032 -16.961 536 H GLU 71 HN GLU 71 80.816 6.101 -11.664 537 HA GLU 71 HA GLU 71 81.135 3.251 -11.591 538 HB2 GLU 71 HB2 GLU 71 81.822 5.421 -9.598 539 HB3 GLU 71 HB1 GLU 71 82.267 3.725 -9.407 540 HG2 GLU 71 HG2 GLU 71 83.028 5.412 -11.806 541 HG3 GLU 71 HG1 GLU 71 84.084 5.132 -10.424 542 H ASP 72 HN ASP 72 78.593 5.229 -10.724 543 HA ASP 72 HA ASP 72 77.738 4.188 -8.259 544 HB2 ASP 72 HB2 ASP 72 76.791 6.204 -9.405 545 HB3 ASP 72 HB1 ASP 72 75.976 5.122 -10.531 546 H ALA 73 HN ALA 73 77.223 3.067 -11.569 547 HA ALA 73 HA ALA 73 75.276 1.174 -11.302 548 HB1 ALA 73 HB1 ALA 73 77.844 1.110 -12.883 549 HB2 ALA 73 HB2 ALA 73 76.220 1.486 -13.453 550 HB3 ALA 73 HB3 ALA 73 76.636 -0.169 -13.011 551 H GLY 74 HN GLY 74 74.972 -0.581 -10.100 552 HA2 GLY 74 HA2 GLY 74 76.926 -2.529 -9.513 553 HA3 GLY 74 HA1 GLY 74 76.766 -1.457 -8.126 554 H THR 75 HN THR 75 75.889 -3.097 -6.816 555 HA THR 75 HA THR 75 73.018 -3.531 -7.191 556 HB THR 75 HB THR 75 74.851 -5.882 -6.691 557 HG1 THR 75 HG1 THR 75 73.968 -4.687 -9.053 558 HG21 THR 75 HG21 THR 75 72.008 -5.842 -7.705 559 HG22 THR 75 HG22 THR 75 72.387 -5.876 -5.983 560 HG23 THR 75 HG23 THR 75 72.901 -7.199 -7.026 561 H VAL 76 HN VAL 76 72.357 -2.609 -5.313 562 HA VAL 76 HA VAL 76 73.887 -2.925 -2.855 563 HB VAL 76 HB VAL 76 71.122 -1.740 -3.032 564 HG11 VAL 76 HG11 VAL 76 72.425 -2.106 -0.847 565 HG12 VAL 76 HG12 VAL 76 71.772 -0.495 -1.139 566 HG13 VAL 76 HG13 VAL 76 73.486 -0.814 -1.411 567 HG21 VAL 76 HG21 VAL 76 72.162 -0.610 -4.827 568 HG22 VAL 76 HG22 VAL 76 73.730 -0.591 -4.024 569 HG23 VAL 76 HG23 VAL 76 72.436 0.460 -3.452 570 H SER 77 HN SER 77 73.475 -4.363 -1.242 571 HA SER 77 HA SER 77 70.884 -5.721 -1.105 572 HB2 SER 77 HB2 SER 77 72.013 -7.963 -1.087 573 HB3 SER 77 HB1 SER 77 72.037 -7.156 -2.654 574 HG SER 77 HG SER 77 74.120 -7.360 -2.524 575 H PHE 78 HN PHE 78 70.724 -7.141 0.785 576 HA PHE 78 HA PHE 78 72.669 -6.639 2.932 577 HB2 PHE 78 HB2 PHE 78 70.872 -6.047 4.509 578 HB3 PHE 78 HB1 PHE 78 70.965 -4.882 3.191 579 HD1 PHE 78 HD1 PHE 78 69.049 -7.683 4.633 580 HD2 PHE 78 HD2 PHE 78 69.204 -4.731 1.516 581 HE1 PHE 78 HE1 PHE 78 66.670 -8.123 4.096 582 HE2 PHE 78 HE2 PHE 78 66.823 -5.173 0.981 583 HZ PHE 78 HZ PHE 78 65.556 -6.868 2.273 584 H HIS 79 HN HIS 79 72.730 -8.272 4.485 585 HA HIS 79 HA HIS 79 71.106 -10.685 3.869 586 HB2 HIS 79 HB2 HIS 79 73.991 -10.424 4.720 587 HB3 HIS 79 HB1 HIS 79 73.101 -11.943 4.812 588 HD1 HIS 79 HD1 HIS 79 74.497 -9.472 2.334 589 HD2 HIS 79 HD2 HIS 79 72.537 -13.153 2.305 590 HE1 HIS 79 HE1 HIS 79 74.645 -10.346 -0.040 591 H VAL 80 HN VAL 80 69.918 -11.496 5.422 592 HA VAL 80 HA VAL 80 70.435 -10.707 8.238 593 HB VAL 80 HB VAL 80 67.684 -11.454 7.269 594 HG11 VAL 80 HG11 VAL 80 68.390 -11.090 9.715 595 HG12 VAL 80 HG12 VAL 80 66.958 -10.231 9.148 596 HG13 VAL 80 HG13 VAL 80 68.495 -9.379 9.298 597 HG21 VAL 80 HG21 VAL 80 69.068 -8.797 6.880 598 HG22 VAL 80 HG22 VAL 80 67.315 -8.957 6.918 599 HG23 VAL 80 HG23 VAL 80 68.249 -9.776 5.667 600 H GLY 81 HN GLY 81 70.666 -12.372 9.645 601 HA2 GLY 81 HA2 GLY 81 71.141 -14.975 8.859 602 HA3 GLY 81 HA1 GLY 81 70.678 -14.520 10.494 603 H THR 82 HN THR 82 68.163 -13.434 8.788 604 HA THR 82 HA THR 82 66.614 -15.925 9.158 605 HB THR 82 HB THR 82 64.723 -14.574 9.502 606 HG1 THR 82 HG1 THR 82 66.242 -12.612 8.155 607 HG21 THR 82 HG21 THR 82 66.552 -14.361 11.260 608 HG22 THR 82 HG22 THR 82 65.367 -13.057 11.239 609 HG23 THR 82 HG23 THR 82 66.958 -12.812 10.524 610 H CYS 83 HN CYS 83 66.901 -13.162 6.915 611 HA CYS 83 HA CYS 83 66.625 -14.950 4.628 612 HB2 CYS 83 HB2 CYS 83 64.788 -13.255 3.739 613 HB3 CYS 83 HB1 CYS 83 64.327 -14.621 4.758 614 HG CYS 83 HG CYS 83 63.553 -12.013 5.537 615 H SER 84 HN SER 84 67.031 -13.786 2.565 616 HA SER 84 HA SER 84 68.445 -11.206 2.915 617 HB2 SER 84 HB2 SER 84 70.172 -12.920 2.935 618 HB3 SER 84 HB1 SER 84 69.513 -13.644 1.471 619 HG SER 84 HG SER 84 69.844 -11.104 0.942 620 H SER 85 HN SER 85 68.333 -9.812 1.220 621 HA SER 85 HA SER 85 66.907 -10.673 -1.228 622 HB2 SER 85 HB2 SER 85 66.291 -8.250 0.468 623 HB3 SER 85 HB1 SER 85 65.689 -8.482 -1.169 624 HG SER 85 HG SER 85 64.308 -9.220 0.627 625 H GLU 86 HN GLU 86 67.219 -9.210 -3.043 626 HA GLU 86 HA GLU 86 69.677 -7.557 -2.855 627 HB2 GLU 86 HB2 GLU 86 68.963 -9.570 -5.004 628 HB3 GLU 86 HB1 GLU 86 70.271 -8.400 -5.135 629 HG2 GLU 86 HG2 GLU 86 71.384 -10.305 -4.342 630 HG3 GLU 86 HG1 GLU 86 71.083 -9.404 -2.858 631 H ALA 87 HN ALA 87 69.858 -5.911 -4.441 632 HA ALA 87 HA ALA 87 67.383 -5.178 -5.886 633 HB1 ALA 87 HB1 ALA 87 69.050 -3.333 -4.150 634 HB2 ALA 87 HB2 ALA 87 67.400 -3.863 -3.819 635 HB3 ALA 87 HB3 ALA 87 67.732 -2.820 -5.205 636 H GLN 88 HN GLN 88 67.741 -4.195 -7.857 637 HA GLN 88 HA GLN 88 70.556 -4.177 -8.778 638 HB2 GLN 88 HB2 GLN 88 68.028 -4.308 -10.434 639 HB3 GLN 88 HB1 GLN 88 69.684 -4.539 -10.998 640 HG2 GLN 88 HG2 GLN 88 68.829 -6.737 -10.705 641 HG3 GLN 88 HG1 GLN 88 69.834 -6.446 -9.287 642 HE21 GLN 88 HE21 GLN 88 68.792 -7.333 -7.497 643 HE22 GLN 88 HE22 GLN 88 67.132 -7.197 -7.175 644 H LEU 89 HN LEU 89 71.512 -2.376 -9.291 645 HA LEU 89 HA LEU 89 69.912 0.069 -9.835 646 HB2 LEU 89 HB2 LEU 89 71.275 -0.068 -7.651 647 HB3 LEU 89 HB1 LEU 89 72.703 0.016 -8.677 648 HG LEU 89 HG LEU 89 70.457 2.058 -8.669 649 HD11 LEU 89 HD11 LEU 89 71.894 1.901 -6.565 650 HD12 LEU 89 HD12 LEU 89 71.895 3.468 -7.374 651 HD13 LEU 89 HD13 LEU 89 73.262 2.372 -7.574 652 HD21 LEU 89 HD21 LEU 89 72.443 3.377 -9.829 653 HD22 LEU 89 HD22 LEU 89 71.450 2.281 -10.779 654 HD23 LEU 89 HD23 LEU 89 73.035 1.760 -10.208 655 H LYS 90 HN LYS 90 70.052 0.514 -11.954 656 HA LYS 90 HA LYS 90 72.567 -0.092 -13.409 657 HB2 LYS 90 HB2 LYS 90 69.729 0.246 -14.405 658 HB3 LYS 90 HB1 LYS 90 71.132 0.015 -15.447 659 HG2 LYS 90 HG2 LYS 90 71.612 -2.130 -14.332 660 HG3 LYS 90 HG1 LYS 90 70.207 -1.910 -13.291 661 HD2 LYS 90 HD2 LYS 90 70.124 -2.075 -16.325 662 HD3 LYS 90 HD1 LYS 90 69.729 -3.402 -15.235 663 HE2 LYS 90 HE2 LYS 90 68.200 -0.866 -15.762 664 HE3 LYS 90 HE1 LYS 90 67.610 -2.522 -15.674 665 HZ1 LYS 90 HZ1 LYS 90 66.898 -1.494 -13.714 666 HZ2 LYS 90 HZ2 LYS 90 68.398 -0.745 -13.444 667 HZ3 LYS 90 HZ3 LYS 90 68.236 -2.425 -13.246 668 H VAL 91 HN VAL 91 73.353 1.459 -14.914 669 HA VAL 91 HA VAL 91 72.467 4.250 -14.394 670 HB VAL 91 HB VAL 91 75.243 3.125 -14.849 671 HG11 VAL 91 HG11 VAL 91 75.921 5.579 -14.641 672 HG12 VAL 91 HG12 VAL 91 74.231 5.977 -14.940 673 HG13 VAL 91 HG13 VAL 91 75.165 5.126 -16.167 674 HG21 VAL 91 HG21 VAL 91 75.705 4.122 -12.679 675 HG22 VAL 91 HG22 VAL 91 74.281 3.092 -12.532 676 HG23 VAL 91 HG23 VAL 91 74.096 4.843 -12.629 677 H THR 92 HN THR 92 71.882 5.404 -16.132 678 HA THR 92 HA THR 92 71.961 4.119 -18.752 679 HB THR 92 HB THR 92 70.919 6.892 -18.175 680 HG1 THR 92 HG1 THR 92 70.156 4.713 -16.971 681 HG21 THR 92 HG21 THR 92 71.102 6.087 -20.533 682 HG22 THR 92 HG22 THR 92 69.432 6.378 -20.039 683 HG23 THR 92 HG23 THR 92 70.055 4.728 -20.114 684 H ALA 93 HN ALA 93 73.357 4.579 -20.348 685 HA ALA 93 HA ALA 93 75.651 6.190 -19.820 686 HB1 ALA 93 HB1 ALA 93 75.810 4.215 -21.238 687 HB2 ALA 93 HB2 ALA 93 76.275 5.647 -22.155 688 HB3 ALA 93 HB3 ALA 93 74.683 4.927 -22.394 689 H GLY 94 HN GLY 94 72.625 7.190 -20.443 690 HA2 GLY 94 HA2 GLY 94 73.314 9.345 -22.325 691 HA3 GLY 94 HA1 GLY 94 71.699 8.930 -21.759 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 52.152 -5.917 15.442 2 H2 MET 1 HT2 MET 1 52.394 -5.622 17.097 3 H3 MET 1 HT3 MET 1 50.872 -6.124 16.535 4 HA MET 1 HA MET 1 52.793 -7.752 17.554 5 HB2 MET 1 HB2 MET 1 50.530 -8.386 15.629 6 HB3 MET 1 HB1 MET 1 51.343 -9.564 16.657 7 HG2 MET 1 HG2 MET 1 49.954 -7.095 17.727 8 HG3 MET 1 HG1 MET 1 49.182 -8.673 17.630 9 HE1 MET 1 HE1 MET 1 49.726 -10.635 18.703 10 HE2 MET 1 HE2 MET 1 50.637 -10.833 20.195 11 HE3 MET 1 HE3 MET 1 51.481 -10.857 18.651 12 H ALA 2 HN ALA 2 54.826 -7.602 16.647 13 HA ALA 2 HA ALA 2 55.386 -9.236 14.383 14 HB1 ALA 2 HB1 ALA 2 55.515 -6.238 14.021 15 HB2 ALA 2 HB2 ALA 2 54.603 -7.398 13.056 16 HB3 ALA 2 HB3 ALA 2 56.364 -7.379 12.977 17 HA PRO 3 HA PRO 3 58.814 -8.305 17.377 18 HB2 PRO 3 HB2 PRO 3 59.085 -11.156 17.870 19 HB3 PRO 3 HB1 PRO 3 58.586 -9.887 19.004 20 HG2 PRO 3 HG2 PRO 3 56.927 -11.881 17.986 21 HG3 PRO 3 HG1 PRO 3 56.392 -10.379 18.753 22 HD2 PRO 3 HD2 PRO 3 56.455 -11.084 15.855 23 HD3 PRO 3 HD1 PRO 3 55.378 -9.966 16.721 24 H GLU 4 HN GLU 4 58.391 -10.326 14.615 25 HA GLU 4 HA GLU 4 61.202 -10.952 14.268 26 HB2 GLU 4 HB2 GLU 4 59.366 -12.452 13.477 27 HB3 GLU 4 HB1 GLU 4 58.929 -11.222 12.290 28 HG2 GLU 4 HG2 GLU 4 61.127 -11.372 11.253 29 HG3 GLU 4 HG1 GLU 4 61.674 -12.492 12.500 30 H VAL 5 HN VAL 5 62.481 -10.224 12.472 31 HA VAL 5 HA VAL 5 62.493 -7.423 12.100 32 HB VAL 5 HB VAL 5 63.716 -9.328 10.101 33 HG11 VAL 5 HG11 VAL 5 63.821 -6.748 10.007 34 HG12 VAL 5 HG12 VAL 5 65.329 -7.640 9.823 35 HG13 VAL 5 HG13 VAL 5 64.942 -6.880 11.365 36 HG21 VAL 5 HG21 VAL 5 65.690 -9.059 12.025 37 HG22 VAL 5 HG22 VAL 5 64.665 -10.478 11.839 38 HG23 VAL 5 HG23 VAL 5 64.244 -9.247 13.020 39 H THR 6 HN THR 6 61.460 -6.117 10.604 40 HA THR 6 HA THR 6 59.853 -7.559 8.523 41 HB THR 6 HB THR 6 59.272 -4.772 9.504 42 HG1 THR 6 HG1 THR 6 57.714 -6.906 10.331 43 HG21 THR 6 HG21 THR 6 57.676 -6.889 8.053 44 HG22 THR 6 HG22 THR 6 58.317 -5.400 7.357 45 HG23 THR 6 HG23 THR 6 57.044 -5.330 8.575 46 H ILE 7 HN ILE 7 60.234 -7.163 6.424 47 HA ILE 7 HA ILE 7 61.996 -4.861 5.741 48 HB ILE 7 HB ILE 7 61.868 -7.383 4.098 49 HG12 ILE 7 HG12 ILE 7 63.478 -6.851 6.603 50 HG13 ILE 7 HG11 ILE 7 62.480 -8.250 6.228 51 HG21 ILE 7 HG21 ILE 7 64.184 -5.494 4.539 52 HG22 ILE 7 HG22 ILE 7 62.922 -5.120 3.370 53 HG23 ILE 7 HG23 ILE 7 63.895 -6.578 3.177 54 HD11 ILE 7 HD11 ILE 7 64.497 -9.184 5.690 55 HD12 ILE 7 HD12 ILE 7 65.254 -7.626 5.378 56 HD13 ILE 7 HD13 ILE 7 64.232 -8.373 4.150 57 H LEU 8 HN LEU 8 61.149 -3.416 4.459 58 HA LEU 8 HA LEU 8 59.129 -4.215 2.459 59 HB2 LEU 8 HB2 LEU 8 58.364 -2.853 4.675 60 HB3 LEU 8 HB1 LEU 8 58.846 -1.497 3.666 61 HG LEU 8 HG LEU 8 56.471 -1.943 3.376 62 HD11 LEU 8 HD11 LEU 8 56.436 -2.174 0.924 63 HD12 LEU 8 HD12 LEU 8 58.076 -2.816 0.952 64 HD13 LEU 8 HD13 LEU 8 57.773 -1.149 1.438 65 HD21 LEU 8 HD21 LEU 8 56.877 -4.582 2.034 66 HD22 LEU 8 HD22 LEU 8 55.544 -4.012 3.030 67 HD23 LEU 8 HD23 LEU 8 57.022 -4.582 3.795 68 H GLU 9 HN GLU 9 60.718 -4.218 0.856 69 HA GLU 9 HA GLU 9 61.899 -1.563 0.199 70 HB2 GLU 9 HB2 GLU 9 63.639 -3.048 -1.014 71 HB3 GLU 9 HB1 GLU 9 63.719 -2.942 0.746 72 HG2 GLU 9 HG2 GLU 9 62.796 -5.080 1.056 73 HG3 GLU 9 HG1 GLU 9 62.079 -5.118 -0.553 74 HA PRO 10 HA PRO 10 59.247 -2.843 -3.366 75 HB2 PRO 10 HB2 PRO 10 58.367 -0.085 -3.621 76 HB3 PRO 10 HB1 PRO 10 57.409 -1.499 -3.157 77 HG2 PRO 10 HG2 PRO 10 58.088 0.599 -1.466 78 HG3 PRO 10 HG1 PRO 10 57.568 -1.013 -0.943 79 HD2 PRO 10 HD2 PRO 10 60.331 0.132 -1.031 80 HD3 PRO 10 HD1 PRO 10 59.641 -1.066 0.080 81 H LEU 11 HN LEU 11 61.817 -0.695 -2.832 82 HA LEU 11 HA LEU 11 62.116 0.067 -5.653 83 HB2 LEU 11 HB2 LEU 11 64.331 1.101 -4.542 84 HB3 LEU 11 HB1 LEU 11 62.774 1.907 -4.423 85 HG LEU 11 HG LEU 11 62.390 0.884 -2.215 86 HD11 LEU 11 HD11 LEU 11 65.151 -0.312 -2.632 87 HD12 LEU 11 HD12 LEU 11 63.633 -1.205 -2.501 88 HD13 LEU 11 HD13 LEU 11 64.264 -0.328 -1.109 89 HD21 LEU 11 HD21 LEU 11 64.427 1.999 -1.052 90 HD22 LEU 11 HD22 LEU 11 63.414 3.014 -2.079 91 HD23 LEU 11 HD23 LEU 11 64.953 2.412 -2.684 92 H GLN 12 HN GLN 12 62.193 -2.552 -5.641 93 HA GLN 12 HA GLN 12 64.833 -3.611 -5.159 94 HB2 GLN 12 HB2 GLN 12 63.896 -5.677 -6.167 95 HB3 GLN 12 HB1 GLN 12 62.927 -5.055 -4.831 96 HG2 GLN 12 HG2 GLN 12 61.420 -3.947 -6.463 97 HG3 GLN 12 HG1 GLN 12 62.364 -4.640 -7.782 98 HE21 GLN 12 HE21 GLN 12 59.503 -5.199 -7.063 99 HE22 GLN 12 HE22 GLN 12 59.426 -6.872 -6.791 100 H ASP 13 HN ASP 13 63.673 -1.647 -7.533 101 HA ASP 13 HA ASP 13 65.849 -2.370 -9.345 102 HB2 ASP 13 HB2 ASP 13 63.809 -3.698 -10.053 103 HB3 ASP 13 HB1 ASP 13 63.018 -2.162 -10.398 104 H VAL 14 HN VAL 14 66.871 -0.454 -9.403 105 HA VAL 14 HA VAL 14 65.274 2.026 -9.808 106 HB VAL 14 HB VAL 14 67.799 1.510 -8.235 107 HG11 VAL 14 HG11 VAL 14 68.259 3.560 -9.418 108 HG12 VAL 14 HG12 VAL 14 67.749 4.012 -7.795 109 HG13 VAL 14 HG13 VAL 14 66.621 4.155 -9.140 110 HG21 VAL 14 HG21 VAL 14 65.559 1.143 -7.171 111 HG22 VAL 14 HG22 VAL 14 65.180 2.837 -7.485 112 HG23 VAL 14 HG23 VAL 14 66.496 2.414 -6.389 113 H GLN 15 HN GLN 15 65.768 3.273 -11.542 114 HA GLN 15 HA GLN 15 68.329 2.817 -12.945 115 HB2 GLN 15 HB2 GLN 15 65.574 2.844 -14.174 116 HB3 GLN 15 HB1 GLN 15 67.063 2.991 -15.108 117 HG2 GLN 15 HG2 GLN 15 67.837 0.832 -14.297 118 HG3 GLN 15 HG1 GLN 15 66.432 0.688 -13.240 119 HE21 GLN 15 HE21 GLN 15 67.460 -0.780 -15.877 120 HE22 GLN 15 HE22 GLN 15 66.035 -0.885 -16.794 121 H LEU 16 HN LEU 16 69.268 4.732 -12.431 122 HA LEU 16 HA LEU 16 67.818 7.229 -13.138 123 HB2 LEU 16 HB2 LEU 16 70.021 6.767 -11.111 124 HB3 LEU 16 HB1 LEU 16 69.279 8.326 -11.466 125 HG LEU 16 HG LEU 16 67.705 5.899 -10.539 126 HD11 LEU 16 HD11 LEU 16 67.625 7.206 -8.347 127 HD12 LEU 16 HD12 LEU 16 68.975 8.153 -8.973 128 HD13 LEU 16 HD13 LEU 16 69.153 6.415 -8.724 129 HD21 LEU 16 HD21 LEU 16 66.105 7.819 -9.858 130 HD22 LEU 16 HD22 LEU 16 66.218 7.442 -11.573 131 HD23 LEU 16 HD23 LEU 16 67.080 8.834 -10.920 132 H SER 17 HN SER 17 68.759 8.705 -14.483 133 HA SER 17 HA SER 17 70.912 7.801 -16.157 134 HB2 SER 17 HB2 SER 17 70.587 9.862 -17.380 135 HB3 SER 17 HB1 SER 17 69.003 9.211 -16.974 136 HG SER 17 HG SER 17 68.649 10.918 -15.821 137 H GLU 18 HN GLU 18 72.820 9.224 -16.636 138 HA GLU 18 HA GLU 18 74.309 9.658 -14.242 139 HB2 GLU 18 HB2 GLU 18 75.377 8.936 -16.330 140 HB3 GLU 18 HB1 GLU 18 74.951 10.468 -17.094 141 HG2 GLU 18 HG2 GLU 18 76.310 11.678 -15.439 142 HG3 GLU 18 HG1 GLU 18 76.716 10.159 -14.644 143 H GLY 19 HN GLY 19 75.033 11.571 -13.318 144 HA2 GLY 19 HA2 GLY 19 75.158 13.867 -12.926 145 HA3 GLY 19 HA1 GLY 19 74.181 14.147 -14.363 146 H GLN 20 HN GLN 20 72.664 11.771 -12.656 147 HA GLN 20 HA GLN 20 70.791 13.691 -11.398 148 HB2 GLN 20 HB2 GLN 20 69.917 12.144 -13.159 149 HB3 GLN 20 HB1 GLN 20 70.361 10.783 -12.130 150 HG2 GLN 20 HG2 GLN 20 68.008 11.277 -11.780 151 HG3 GLN 20 HG1 GLN 20 68.892 11.738 -10.330 152 HE21 GLN 20 HE21 GLN 20 67.696 13.533 -9.591 153 HE22 GLN 20 HE22 GLN 20 67.369 14.904 -10.535 154 H ASP 21 HN ASP 21 70.070 13.361 -9.282 155 HA ASP 21 HA ASP 21 71.975 12.091 -7.532 156 HB2 ASP 21 HB2 ASP 21 70.612 12.956 -5.731 157 HB3 ASP 21 HB1 ASP 21 70.792 14.206 -6.956 158 H ALA 22 HN ALA 22 71.503 10.389 -6.036 159 HA ALA 22 HA ALA 22 69.165 8.693 -6.662 160 HB1 ALA 22 HB1 ALA 22 72.013 7.671 -6.562 161 HB2 ALA 22 HB2 ALA 22 71.095 7.933 -8.043 162 HB3 ALA 22 HB3 ALA 22 70.563 6.721 -6.877 163 H SER 23 HN SER 23 68.496 7.360 -4.978 164 HA SER 23 HA SER 23 70.034 7.094 -2.550 165 HB2 SER 23 HB2 SER 23 67.528 8.784 -2.453 166 HB3 SER 23 HB1 SER 23 68.539 8.328 -1.084 167 HG SER 23 HG SER 23 69.378 10.235 -1.613 168 H PHE 24 HN PHE 24 68.624 6.040 -0.791 169 HA PHE 24 HA PHE 24 66.525 4.330 -2.017 170 HB2 PHE 24 HB2 PHE 24 68.793 3.492 -0.193 171 HB3 PHE 24 HB1 PHE 24 67.365 2.503 -0.472 172 HD1 PHE 24 HD1 PHE 24 67.013 1.367 -2.595 173 HD2 PHE 24 HD2 PHE 24 70.369 3.987 -2.021 174 HE1 PHE 24 HE1 PHE 24 68.046 0.499 -4.670 175 HE2 PHE 24 HE2 PHE 24 71.404 3.107 -4.095 176 HZ PHE 24 HZ PHE 24 70.241 1.365 -5.419 177 H GLN 25 HN GLN 25 64.794 3.866 -0.740 178 HA GLN 25 HA GLN 25 64.708 4.875 2.040 179 HB2 GLN 25 HB2 GLN 25 62.717 5.522 -0.158 180 HB3 GLN 25 HB1 GLN 25 62.433 5.814 1.558 181 HG2 GLN 25 HG2 GLN 25 64.315 7.334 1.673 182 HG3 GLN 25 HG1 GLN 25 64.785 6.944 0.020 183 HE21 GLN 25 HE21 GLN 25 64.461 9.543 0.182 184 HE22 GLN 25 HE22 GLN 25 62.943 10.085 -0.346 185 H CYS 26 HN CYS 26 64.057 3.205 3.290 186 HA CYS 26 HA CYS 26 61.804 1.562 2.416 187 HB2 CYS 26 HB2 CYS 26 62.898 -0.519 2.447 188 HB3 CYS 26 HB1 CYS 26 64.004 0.523 1.555 189 HG CYS 26 HG CYS 26 65.664 -0.202 3.259 190 H ARG 27 HN ARG 27 61.069 0.059 4.121 191 HA ARG 27 HA ARG 27 61.488 1.229 6.806 192 HB2 ARG 27 HB2 ARG 27 59.254 -0.485 5.686 193 HB3 ARG 27 HB1 ARG 27 59.389 -0.027 7.378 194 HG2 ARG 27 HG2 ARG 27 59.277 2.325 6.792 195 HG3 ARG 27 HG1 ARG 27 59.230 1.929 5.074 196 HD2 ARG 27 HD2 ARG 27 57.163 0.984 7.079 197 HD3 ARG 27 HD1 ARG 27 56.976 2.432 6.093 198 HE ARG 27 HE ARG 27 57.574 0.281 4.384 199 HH11 ARG 27 HH11 ARG 27 55.525 0.988 3.036 200 HH12 ARG 27 HH12 ARG 27 54.053 0.377 3.715 201 HH21 ARG 27 HH21 ARG 27 55.474 -0.343 6.794 202 HH22 ARG 27 HH22 ARG 27 54.027 -0.389 5.843 203 H LEU 28 HN LEU 28 62.316 -0.004 8.454 204 HA LEU 28 HA LEU 28 62.656 -2.892 7.998 205 HB2 LEU 28 HB2 LEU 28 64.711 -1.397 7.343 206 HB3 LEU 28 HB1 LEU 28 64.959 -1.296 9.079 207 HG LEU 28 HG LEU 28 66.287 -3.125 8.215 208 HD11 LEU 28 HD11 LEU 28 65.573 -4.873 9.657 209 HD12 LEU 28 HD12 LEU 28 63.878 -4.413 9.503 210 HD13 LEU 28 HD13 LEU 28 64.998 -3.387 10.404 211 HD21 LEU 28 HD21 LEU 28 63.904 -4.691 7.292 212 HD22 LEU 28 HD22 LEU 28 65.568 -4.733 6.722 213 HD23 LEU 28 HD23 LEU 28 64.503 -3.422 6.225 214 H SER 29 HN SER 29 61.183 -3.429 9.663 215 HA SER 29 HA SER 29 61.131 -2.176 12.184 216 HB2 SER 29 HB2 SER 29 60.366 -5.024 11.489 217 HB3 SER 29 HB1 SER 29 60.021 -4.231 13.015 218 HG SER 29 HG SER 29 58.638 -2.882 12.031 219 H ARG 30 HN ARG 30 61.972 -2.851 14.166 220 HA ARG 30 HA ARG 30 64.690 -3.295 14.218 221 HB2 ARG 30 HB2 ARG 30 64.430 -3.583 16.611 222 HB3 ARG 30 HB1 ARG 30 63.334 -2.330 16.036 223 HG2 ARG 30 HG2 ARG 30 61.484 -3.967 15.977 224 HG3 ARG 30 HG1 ARG 30 62.568 -5.219 16.580 225 HD2 ARG 30 HD2 ARG 30 61.970 -2.637 18.050 226 HD3 ARG 30 HD1 ARG 30 61.164 -4.170 18.370 227 HE ARG 30 HE ARG 30 63.649 -4.957 18.712 228 HH11 ARG 30 HH11 ARG 30 61.969 -3.820 21.046 229 HH12 ARG 30 HH12 ARG 30 63.119 -2.751 21.777 230 HH21 ARG 30 HH21 ARG 30 65.230 -2.728 19.018 231 HH22 ARG 30 HH22 ARG 30 64.967 -2.123 20.620 232 H ALA 31 HN ALA 31 65.991 -4.958 15.023 233 HA ALA 31 HA ALA 31 65.436 -7.513 13.888 234 HB1 ALA 31 HB1 ALA 31 67.671 -6.805 15.778 235 HB2 ALA 31 HB2 ALA 31 67.702 -6.437 14.054 236 HB3 ALA 31 HB3 ALA 31 67.636 -8.115 14.596 237 H SER 32 HN SER 32 66.243 -9.461 15.346 238 HA SER 32 HA SER 32 65.206 -9.432 18.050 239 HB2 SER 32 HB2 SER 32 63.544 -11.188 17.662 240 HB3 SER 32 HB1 SER 32 63.155 -9.754 16.715 241 HG SER 32 HG SER 32 64.279 -12.205 15.882 242 H GLY 33 HN GLY 33 66.063 -11.534 15.321 243 HA2 GLY 33 HA2 GLY 33 67.564 -13.334 17.108 244 HA3 GLY 33 HA1 GLY 33 67.105 -13.667 15.440 245 H GLN 34 HN GLN 34 68.050 -11.996 13.835 246 HA GLN 34 HA GLN 34 70.861 -11.384 14.557 247 HB2 GLN 34 HB2 GLN 34 69.820 -12.503 11.939 248 HB3 GLN 34 HB1 GLN 34 71.463 -11.917 12.195 249 HG2 GLN 34 HG2 GLN 34 71.820 -13.580 13.958 250 HG3 GLN 34 HG1 GLN 34 70.155 -14.129 13.801 251 HE21 GLN 34 HE21 GLN 34 71.738 -16.202 13.410 252 HE22 GLN 34 HE22 GLN 34 72.026 -16.531 11.770 253 H GLU 35 HN GLU 35 71.764 -9.551 13.544 254 HA GLU 35 HA GLU 35 69.812 -7.455 13.013 255 HB2 GLU 35 HB2 GLU 35 71.730 -5.955 13.134 256 HB3 GLU 35 HB1 GLU 35 71.744 -7.065 14.502 257 HG2 GLU 35 HG2 GLU 35 73.306 -8.542 13.200 258 HG3 GLU 35 HG1 GLU 35 73.401 -7.273 11.982 259 H ALA 36 HN ALA 36 69.408 -6.518 11.093 260 HA ALA 36 HA ALA 36 70.311 -7.811 8.679 261 HB1 ALA 36 HB1 ALA 36 68.002 -6.807 9.090 262 HB2 ALA 36 HB2 ALA 36 68.772 -6.377 7.562 263 HB3 ALA 36 HB3 ALA 36 68.765 -5.227 8.897 264 H ARG 37 HN ARG 37 71.475 -6.794 6.954 265 HA ARG 37 HA ARG 37 72.828 -4.259 7.550 266 HB2 ARG 37 HB2 ARG 37 75.053 -5.198 7.119 267 HB3 ARG 37 HB1 ARG 37 74.301 -5.945 8.526 268 HG2 ARG 37 HG2 ARG 37 73.546 -7.831 7.044 269 HG3 ARG 37 HG1 ARG 37 74.490 -7.112 5.736 270 HD2 ARG 37 HD2 ARG 37 75.644 -7.882 8.428 271 HD3 ARG 37 HD1 ARG 37 75.717 -8.909 7.000 272 HE ARG 37 HE ARG 37 76.758 -6.377 6.335 273 HH11 ARG 37 HH11 ARG 37 78.144 -6.480 8.926 274 HH12 ARG 37 HH12 ARG 37 79.550 -7.439 8.608 275 HH21 ARG 37 HH21 ARG 37 78.313 -8.740 5.651 276 HH22 ARG 37 HH22 ARG 37 79.645 -8.719 6.757 277 H TRP 38 HN TRP 38 73.589 -3.153 5.786 278 HA TRP 38 HA TRP 38 72.400 -3.851 3.234 279 HB2 TRP 38 HB2 TRP 38 74.116 -1.533 4.135 280 HB3 TRP 38 HB1 TRP 38 73.480 -1.695 2.502 281 HD1 TRP 38 HD1 TRP 38 72.616 -0.546 5.921 282 HE1 TRP 38 HE1 TRP 38 70.189 0.278 5.985 283 HE3 TRP 38 HE3 TRP 38 70.971 -2.272 1.403 284 HZ2 TRP 38 HZ2 TRP 38 67.838 0.212 4.353 285 HZ3 TRP 38 HZ3 TRP 38 68.627 -1.875 0.681 286 HH2 TRP 38 HH2 TRP 38 67.060 -0.642 2.156 287 H ALA 39 HN ALA 39 73.994 -3.280 1.273 288 HA ALA 39 HA ALA 39 76.721 -4.073 1.635 289 HB1 ALA 39 HB1 ALA 39 75.215 -6.076 -0.017 290 HB2 ALA 39 HB2 ALA 39 75.235 -6.245 1.737 291 HB3 ALA 39 HB3 ALA 39 76.749 -6.256 0.836 292 H LEU 40 HN LEU 40 77.925 -3.253 0.028 293 HA LEU 40 HA LEU 40 76.670 -2.738 -2.599 294 HB2 LEU 40 HB2 LEU 40 76.631 -0.609 -1.399 295 HB3 LEU 40 HB1 LEU 40 78.334 -0.776 -0.988 296 HG LEU 40 HG LEU 40 78.946 -0.653 -3.374 297 HD11 LEU 40 HD11 LEU 40 77.128 -1.631 -4.537 298 HD12 LEU 40 HD12 LEU 40 77.020 0.076 -4.955 299 HD13 LEU 40 HD13 LEU 40 75.951 -0.598 -3.728 300 HD21 LEU 40 HD21 LEU 40 78.508 1.659 -3.712 301 HD22 LEU 40 HD22 LEU 40 78.556 1.445 -1.961 302 HD23 LEU 40 HD23 LEU 40 77.007 1.587 -2.794 303 H GLY 41 HN GLY 41 77.851 -3.631 -4.183 304 HA2 GLY 41 HA2 GLY 41 79.709 -4.278 -5.415 305 HA3 GLY 41 HA1 GLY 41 80.722 -3.431 -4.248 306 H GLY 42 HN GLY 42 78.606 -5.494 -2.687 307 HA2 GLY 42 HA2 GLY 42 78.751 -7.793 -2.113 308 HA3 GLY 42 HA1 GLY 42 80.393 -7.835 -2.749 309 H VAL 43 HN VAL 43 80.709 -5.128 -1.265 310 HA VAL 43 HA VAL 43 81.336 -6.318 1.377 311 HB VAL 43 HB VAL 43 83.114 -4.626 1.533 312 HG11 VAL 43 HG11 VAL 43 83.528 -6.837 0.445 313 HG12 VAL 43 HG12 VAL 43 84.580 -5.562 -0.168 314 HG13 VAL 43 HG13 VAL 43 83.193 -6.095 -1.118 315 HG21 VAL 43 HG21 VAL 43 82.130 -2.818 0.251 316 HG22 VAL 43 HG22 VAL 43 82.067 -3.819 -1.199 317 HG23 VAL 43 HG23 VAL 43 83.623 -3.296 -0.556 318 HA PRO 44 HA PRO 44 78.383 -3.623 3.275 319 HB2 PRO 44 HB2 PRO 44 80.146 -2.738 5.413 320 HB3 PRO 44 HB1 PRO 44 78.819 -3.904 5.500 321 HG2 PRO 44 HG2 PRO 44 81.667 -4.405 5.472 322 HG3 PRO 44 HG1 PRO 44 80.346 -5.555 5.720 323 HD2 PRO 44 HD2 PRO 44 82.007 -5.397 3.434 324 HD3 PRO 44 HD1 PRO 44 80.501 -6.322 3.568 325 H LEU 45 HN LEU 45 77.821 -1.485 3.074 326 HA LEU 45 HA LEU 45 79.696 0.251 1.735 327 HB2 LEU 45 HB2 LEU 45 77.879 1.635 1.240 328 HB3 LEU 45 HB1 LEU 45 77.157 0.033 1.287 329 HG LEU 45 HG LEU 45 77.069 2.110 3.508 330 HD11 LEU 45 HD11 LEU 45 74.589 1.896 3.073 331 HD12 LEU 45 HD12 LEU 45 74.989 0.941 1.642 332 HD13 LEU 45 HD13 LEU 45 75.503 2.624 1.749 333 HD21 LEU 45 HD21 LEU 45 76.171 -0.775 3.363 334 HD22 LEU 45 HD22 LEU 45 75.455 0.357 4.513 335 HD23 LEU 45 HD23 LEU 45 77.177 -0.018 4.595 336 H GLN 46 HN GLN 46 79.842 2.598 2.435 337 HA GLN 46 HA GLN 46 80.114 2.831 5.383 338 HB2 GLN 46 HB2 GLN 46 82.122 3.580 3.250 339 HB3 GLN 46 HB1 GLN 46 82.212 4.157 4.916 340 HG2 GLN 46 HG2 GLN 46 82.363 1.888 5.760 341 HG3 GLN 46 HG1 GLN 46 82.092 1.227 4.149 342 HE21 GLN 46 HE21 GLN 46 84.534 2.019 6.345 343 HE22 GLN 46 HE22 GLN 46 85.836 2.097 5.259 344 H ALA 47 HN ALA 47 79.603 4.795 6.251 345 HA ALA 47 HA ALA 47 77.992 6.557 4.668 346 HB1 ALA 47 HB1 ALA 47 79.035 7.102 7.449 347 HB2 ALA 47 HB2 ALA 47 77.680 6.017 7.141 348 HB3 ALA 47 HB3 ALA 47 77.561 7.721 6.702 349 H ASN 48 HN ASN 48 80.063 6.791 3.202 350 HA ASN 48 HA ASN 48 82.036 8.695 4.082 351 HB2 ASN 48 HB2 ASN 48 81.277 7.623 1.353 352 HB3 ASN 48 HB1 ASN 48 82.596 8.762 1.610 353 HD21 ASN 48 HD21 ASN 48 82.882 6.005 0.604 354 HD22 ASN 48 HD22 ASN 48 83.847 5.177 1.729 355 H GLU 49 HN GLU 49 82.270 10.881 3.093 356 HA GLU 49 HA GLU 49 80.181 12.569 3.497 357 HB2 GLU 49 HB2 GLU 49 81.266 14.183 2.008 358 HB3 GLU 49 HB1 GLU 49 82.464 13.337 2.986 359 HG2 GLU 49 HG2 GLU 49 82.895 11.794 1.091 360 HG3 GLU 49 HG1 GLU 49 81.741 12.697 0.111 361 H MET 50 HN MET 50 80.750 10.700 0.552 362 HA MET 50 HA MET 50 78.776 11.943 -1.061 363 HB2 MET 50 HB2 MET 50 80.068 9.214 -1.115 364 HB3 MET 50 HB1 MET 50 78.862 9.697 -2.307 365 HG2 MET 50 HG2 MET 50 80.222 11.595 -2.984 366 HG3 MET 50 HG1 MET 50 81.392 11.251 -1.713 367 HE1 MET 50 HE1 MET 50 79.648 10.266 -4.836 368 HE2 MET 50 HE2 MET 50 79.577 8.588 -4.303 369 HE3 MET 50 HE3 MET 50 80.640 9.036 -5.633 370 H ASN 51 HN ASN 51 78.650 9.109 1.085 371 HA ASN 51 HA ASN 51 75.736 8.908 0.668 372 HB2 ASN 51 HB2 ASN 51 77.747 7.044 1.937 373 HB3 ASN 51 HB1 ASN 51 76.005 6.770 1.967 374 HD21 ASN 51 HD21 ASN 51 78.787 6.095 0.194 375 HD22 ASN 51 HD22 ASN 51 78.056 5.712 -1.289 376 H ASP 52 HN ASP 52 74.292 8.911 2.421 377 HA ASP 52 HA ASP 52 75.356 9.767 5.044 378 HB2 ASP 52 HB2 ASP 52 73.373 11.276 3.341 379 HB3 ASP 52 HB1 ASP 52 73.430 11.469 5.093 380 H ILE 53 HN ILE 53 74.757 7.924 6.070 381 HA ILE 53 HA ILE 53 72.093 6.805 5.748 382 HB ILE 53 HB ILE 53 74.428 6.051 7.519 383 HG12 ILE 53 HG12 ILE 53 73.278 4.653 5.094 384 HG13 ILE 53 HG11 ILE 53 74.649 5.761 5.017 385 HG21 ILE 53 HG21 ILE 53 72.406 5.303 8.612 386 HG22 ILE 53 HG22 ILE 53 73.136 3.907 7.820 387 HG23 ILE 53 HG23 ILE 53 71.745 4.710 7.091 388 HD11 ILE 53 HD11 ILE 53 75.926 4.356 6.532 389 HD12 ILE 53 HD12 ILE 53 75.334 3.370 5.197 390 HD13 ILE 53 HD13 ILE 53 74.536 3.291 6.766 391 H THR 54 HN THR 54 70.399 7.268 6.981 392 HA THR 54 HA THR 54 70.812 8.359 9.692 393 HB THR 54 HB THR 54 70.500 10.321 8.279 394 HG1 THR 54 HG1 THR 54 67.984 9.864 9.427 395 HG21 THR 54 HG21 THR 54 67.803 9.269 7.454 396 HG22 THR 54 HG22 THR 54 69.236 8.912 6.491 397 HG23 THR 54 HG23 THR 54 68.735 10.585 6.741 398 H VAL 55 HN VAL 55 69.052 8.036 11.087 399 HA VAL 55 HA VAL 55 67.058 6.046 10.146 400 HB VAL 55 HB VAL 55 68.536 6.253 12.777 401 HG11 VAL 55 HG11 VAL 55 67.136 4.070 13.192 402 HG12 VAL 55 HG12 VAL 55 66.026 4.768 12.012 403 HG13 VAL 55 HG13 VAL 55 66.393 5.640 13.499 404 HG21 VAL 55 HG21 VAL 55 69.723 5.163 10.913 405 HG22 VAL 55 HG22 VAL 55 68.337 4.108 10.638 406 HG23 VAL 55 HG23 VAL 55 69.264 3.975 12.133 407 H GLU 56 HN GLU 56 65.005 6.560 10.407 408 HA GLU 56 HA GLU 56 64.294 8.794 12.232 409 HB2 GLU 56 HB2 GLU 56 63.199 8.182 9.473 410 HB3 GLU 56 HB1 GLU 56 62.566 9.416 10.564 411 HG2 GLU 56 HG2 GLU 56 64.700 10.599 10.533 412 HG3 GLU 56 HG1 GLU 56 65.420 9.328 9.543 413 H GLN 57 HN GLN 57 61.680 8.768 12.204 414 HA GLN 57 HA GLN 57 60.878 6.657 13.829 415 HB2 GLN 57 HB2 GLN 57 59.702 8.840 13.608 416 HB3 GLN 57 HB1 GLN 57 59.116 8.337 12.020 417 HG2 GLN 57 HG2 GLN 57 58.000 6.386 13.061 418 HG3 GLN 57 HG1 GLN 57 58.577 6.905 14.639 419 HE21 GLN 57 HE21 GLN 57 56.979 7.943 15.778 420 HE22 GLN 57 HE22 GLN 57 55.773 8.925 15.098 421 H GLY 58 HN GLY 58 59.521 4.806 13.404 422 HA2 GLY 58 HA2 GLY 58 58.721 3.013 12.181 423 HA3 GLY 58 HA1 GLY 58 58.752 4.052 10.757 424 H THR 59 HN THR 59 61.586 3.628 12.701 425 HA THR 59 HA THR 59 63.683 2.865 12.149 426 HB THR 59 HB THR 59 63.791 0.541 11.714 427 HG1 THR 59 HG1 THR 59 62.479 0.507 9.862 428 HG21 THR 59 HG21 THR 59 61.089 0.896 13.019 429 HG22 THR 59 HG22 THR 59 62.590 1.349 13.829 430 HG23 THR 59 HG23 THR 59 62.313 -0.327 13.363 431 H LEU 60 HN LEU 60 62.270 4.508 10.145 432 HA LEU 60 HA LEU 60 62.827 3.449 7.570 433 HB2 LEU 60 HB2 LEU 60 62.219 6.212 8.594 434 HB3 LEU 60 HB1 LEU 60 62.659 5.960 6.908 435 HG LEU 60 HG LEU 60 60.474 4.315 8.197 436 HD11 LEU 60 HD11 LEU 60 58.852 5.980 7.278 437 HD12 LEU 60 HD12 LEU 60 60.203 7.044 6.891 438 HD13 LEU 60 HD13 LEU 60 59.841 6.654 8.571 439 HD21 LEU 60 HD21 LEU 60 59.668 4.364 5.771 440 HD22 LEU 60 HD22 LEU 60 61.174 3.497 6.035 441 HD23 LEU 60 HD23 LEU 60 61.201 5.122 5.354 442 H HIS 61 HN HIS 61 64.579 3.435 6.390 443 HA HIS 61 HA HIS 61 67.019 4.797 7.386 444 HB2 HIS 61 HB2 HIS 61 66.627 2.255 5.793 445 HB3 HIS 61 HB1 HIS 61 68.185 3.070 5.918 446 HD1 HIS 61 HD1 HIS 61 65.511 1.575 8.186 447 HD2 HIS 61 HD2 HIS 61 69.582 2.475 8.245 448 HE1 HIS 61 HE1 HIS 61 66.418 0.652 10.357 449 H LEU 62 HN LEU 62 68.310 5.910 5.857 450 HA LEU 62 HA LEU 62 67.371 6.152 3.117 451 HB2 LEU 62 HB2 LEU 62 65.946 7.712 4.537 452 HB3 LEU 62 HB1 LEU 62 67.418 8.619 4.857 453 HG LEU 62 HG LEU 62 66.535 7.995 2.023 454 HD11 LEU 62 HD11 LEU 62 65.409 10.151 1.939 455 HD12 LEU 62 HD12 LEU 62 65.822 10.468 3.624 456 HD13 LEU 62 HD13 LEU 62 64.694 9.172 3.217 457 HD21 LEU 62 HD21 LEU 62 68.705 8.840 1.874 458 HD22 LEU 62 HD22 LEU 62 68.540 9.837 3.317 459 HD23 LEU 62 HD23 LEU 62 67.786 10.341 1.808 460 H LEU 63 HN LEU 63 69.356 5.718 2.239 461 HA LEU 63 HA LEU 63 71.678 7.242 3.240 462 HB2 LEU 63 HB2 LEU 63 72.810 5.750 1.369 463 HB3 LEU 63 HB1 LEU 63 72.459 5.075 2.954 464 HG LEU 63 HG LEU 63 70.268 4.898 0.918 465 HD11 LEU 63 HD11 LEU 63 71.276 2.852 -0.050 466 HD12 LEU 63 HD12 LEU 63 72.762 3.195 0.836 467 HD13 LEU 63 HD13 LEU 63 72.217 4.303 -0.421 468 HD21 LEU 63 HD21 LEU 63 69.809 2.805 2.028 469 HD22 LEU 63 HD22 LEU 63 70.173 3.974 3.295 470 HD23 LEU 63 HD23 LEU 63 71.395 2.799 2.806 471 H THR 64 HN THR 64 71.700 9.268 2.376 472 HA THR 64 HA THR 64 70.659 9.709 -0.317 473 HB THR 64 HB THR 64 71.907 11.743 1.542 474 HG1 THR 64 HG1 THR 64 69.171 11.541 1.359 475 HG21 THR 64 HG21 THR 64 71.479 12.271 -0.920 476 HG22 THR 64 HG22 THR 64 70.690 13.342 0.240 477 HG23 THR 64 HG23 THR 64 69.765 12.073 -0.565 478 H LEU 65 HN LEU 65 71.904 9.332 -1.988 479 HA LEU 65 HA LEU 65 74.822 9.803 -1.824 480 HB2 LEU 65 HB2 LEU 65 73.766 7.571 -2.630 481 HB3 LEU 65 HB1 LEU 65 73.349 8.452 -4.094 482 HG LEU 65 HG LEU 65 76.193 8.475 -3.050 483 HD11 LEU 65 HD11 LEU 65 74.957 6.400 -4.884 484 HD12 LEU 65 HD12 LEU 65 75.542 6.110 -3.246 485 HD13 LEU 65 HD13 LEU 65 76.677 6.550 -4.523 486 HD21 LEU 65 HD21 LEU 65 74.877 8.874 -5.747 487 HD22 LEU 65 HD22 LEU 65 76.617 8.679 -5.554 488 HD23 LEU 65 HD23 LEU 65 75.802 10.051 -4.816 489 H HIS 66 HN HIS 66 75.577 11.646 -2.657 490 HA HIS 66 HA HIS 66 73.829 13.370 -4.203 491 HB2 HIS 66 HB2 HIS 66 75.307 14.185 -2.346 492 HB3 HIS 66 HB1 HIS 66 76.693 13.873 -3.393 493 HD1 HIS 66 HD1 HIS 66 73.297 15.520 -4.028 494 HD2 HIS 66 HD2 HIS 66 77.367 16.273 -4.562 495 HE1 HIS 66 HE1 HIS 66 73.467 17.750 -5.229 496 H LYS 67 HN LYS 67 73.876 13.765 -6.294 497 HA LYS 67 HA LYS 67 74.286 13.296 -8.529 498 HB2 LYS 67 HB2 LYS 67 76.967 14.246 -7.493 499 HB3 LYS 67 HB1 LYS 67 76.588 14.057 -9.203 500 HG2 LYS 67 HG2 LYS 67 74.753 15.675 -9.006 501 HG3 LYS 67 HG1 LYS 67 75.063 15.833 -7.274 502 HD2 LYS 67 HD2 LYS 67 77.310 16.700 -7.728 503 HD3 LYS 67 HD1 LYS 67 77.066 16.483 -9.459 504 HE2 LYS 67 HE2 LYS 67 76.577 18.758 -9.165 505 HE3 LYS 67 HE1 LYS 67 74.974 18.025 -9.099 506 HZ1 LYS 67 HZ1 LYS 67 76.155 19.581 -7.167 507 HZ2 LYS 67 HZ2 LYS 67 76.232 18.000 -6.553 508 HZ3 LYS 67 HZ3 LYS 67 74.734 18.667 -6.999 509 H VAL 68 HN VAL 68 73.950 10.992 -8.427 510 HA VAL 68 HA VAL 68 75.866 9.069 -7.805 511 HB VAL 68 HB VAL 68 73.336 8.834 -8.460 512 HG11 VAL 68 HG11 VAL 68 72.875 8.241 -10.726 513 HG12 VAL 68 HG12 VAL 68 74.592 8.171 -11.135 514 HG13 VAL 68 HG13 VAL 68 73.819 9.726 -10.813 515 HG21 VAL 68 HG21 VAL 68 74.639 6.926 -7.702 516 HG22 VAL 68 HG22 VAL 68 75.467 6.823 -9.256 517 HG23 VAL 68 HG23 VAL 68 73.751 6.445 -9.145 518 H THR 69 HN THR 69 77.056 7.659 -9.277 519 HA THR 69 HA THR 69 77.977 8.954 -11.759 520 HB THR 69 HB THR 69 80.281 8.618 -11.200 521 HG1 THR 69 HG1 THR 69 80.840 7.630 -9.230 522 HG21 THR 69 HG21 THR 69 79.055 10.599 -10.200 523 HG22 THR 69 HG22 THR 69 80.531 10.135 -9.351 524 HG23 THR 69 HG23 THR 69 78.955 9.685 -8.699 525 H LEU 70 HN LEU 70 79.224 7.394 -13.113 526 HA LEU 70 HA LEU 70 77.769 5.001 -13.455 527 HB2 LEU 70 HB2 LEU 70 80.387 6.027 -14.537 528 HB3 LEU 70 HB1 LEU 70 79.894 4.368 -14.871 529 HG LEU 70 HG LEU 70 79.201 6.028 -16.638 530 HD11 LEU 70 HD11 LEU 70 77.268 4.869 -17.105 531 HD12 LEU 70 HD12 LEU 70 76.626 5.030 -15.472 532 HD13 LEU 70 HD13 LEU 70 77.868 3.828 -15.820 533 HD21 LEU 70 HD21 LEU 70 78.697 7.800 -14.800 534 HD22 LEU 70 HD22 LEU 70 77.135 6.993 -14.662 535 HD23 LEU 70 HD23 LEU 70 77.620 7.714 -16.193 536 H GLU 71 HN GLU 71 80.767 5.778 -11.820 537 HA GLU 71 HA GLU 71 81.547 3.113 -11.234 538 HB2 GLU 71 HB2 GLU 71 82.223 5.703 -9.822 539 HB3 GLU 71 HB1 GLU 71 83.023 4.159 -9.536 540 HG2 GLU 71 HG2 GLU 71 82.909 5.553 -12.228 541 HG3 GLU 71 HG1 GLU 71 84.279 5.624 -11.124 542 H ASP 72 HN ASP 72 79.527 5.482 -9.537 543 HA ASP 72 HA ASP 72 79.366 4.106 -7.071 544 HB2 ASP 72 HB2 ASP 72 77.699 6.213 -8.417 545 HB3 ASP 72 HB1 ASP 72 77.080 5.430 -6.967 546 H ALA 73 HN ALA 73 77.474 3.824 -10.051 547 HA ALA 73 HA ALA 73 75.399 2.220 -9.034 548 HB1 ALA 73 HB1 ALA 73 75.423 3.276 -11.300 549 HB2 ALA 73 HB2 ALA 73 74.974 1.570 -11.322 550 HB3 ALA 73 HB3 ALA 73 76.597 2.061 -11.804 551 H GLY 74 HN GLY 74 75.146 0.039 -8.756 552 HA2 GLY 74 HA2 GLY 74 76.940 -1.951 -9.669 553 HA3 GLY 74 HA1 GLY 74 77.345 -1.524 -8.008 554 H THR 75 HN THR 75 76.757 -3.819 -7.646 555 HA THR 75 HA THR 75 73.858 -4.379 -7.628 556 HB THR 75 HB THR 75 76.197 -6.202 -7.023 557 HG1 THR 75 HG1 THR 75 76.327 -6.460 -9.086 558 HG21 THR 75 HG21 THR 75 73.285 -6.814 -7.605 559 HG22 THR 75 HG22 THR 75 74.045 -6.905 -6.016 560 HG23 THR 75 HG23 THR 75 74.552 -8.000 -7.297 561 H VAL 76 HN VAL 76 72.733 -4.102 -5.805 562 HA VAL 76 HA VAL 76 74.180 -3.943 -3.224 563 HB VAL 76 HB VAL 76 72.037 -2.839 -2.444 564 HG11 VAL 76 HG11 VAL 76 73.686 -1.629 -4.674 565 HG12 VAL 76 HG12 VAL 76 73.957 -1.481 -2.937 566 HG13 VAL 76 HG13 VAL 76 72.563 -0.701 -3.683 567 HG21 VAL 76 HG21 VAL 76 71.451 -2.452 -5.385 568 HG22 VAL 76 HG22 VAL 76 70.389 -2.185 -4.002 569 HG23 VAL 76 HG23 VAL 76 70.772 -3.828 -4.511 570 H SER 77 HN SER 77 73.393 -5.081 -1.403 571 HA SER 77 HA SER 77 71.137 -6.867 -1.644 572 HB2 SER 77 HB2 SER 77 72.487 -8.929 -1.201 573 HB3 SER 77 HB1 SER 77 72.759 -8.241 -2.799 574 HG SER 77 HG SER 77 74.741 -8.652 -1.908 575 H PHE 78 HN PHE 78 70.666 -7.993 0.370 576 HA PHE 78 HA PHE 78 72.169 -7.118 2.750 577 HB2 PHE 78 HB2 PHE 78 70.172 -6.353 3.891 578 HB3 PHE 78 HB1 PHE 78 70.317 -5.464 2.372 579 HD1 PHE 78 HD1 PHE 78 68.552 -8.185 4.124 580 HD2 PHE 78 HD2 PHE 78 68.749 -5.820 0.547 581 HE1 PHE 78 HE1 PHE 78 66.345 -9.064 3.428 582 HE2 PHE 78 HE2 PHE 78 66.538 -6.692 -0.152 583 HZ PHE 78 HZ PHE 78 65.333 -8.318 1.284 584 H HIS 79 HN HIS 79 71.672 -8.397 4.650 585 HA HIS 79 HA HIS 79 70.143 -10.875 4.176 586 HB2 HIS 79 HB2 HIS 79 73.057 -10.723 4.943 587 HB3 HIS 79 HB1 HIS 79 72.074 -12.162 5.208 588 HD1 HIS 79 HD1 HIS 79 73.158 -9.870 2.369 589 HD2 HIS 79 HD2 HIS 79 71.789 -13.760 2.954 590 HE1 HIS 79 HE1 HIS 79 73.326 -11.036 0.122 591 H VAL 80 HN VAL 80 69.174 -11.694 5.915 592 HA VAL 80 HA VAL 80 69.871 -10.806 8.615 593 HB VAL 80 HB VAL 80 68.198 -9.177 8.025 594 HG11 VAL 80 HG11 VAL 80 67.167 -10.115 6.100 595 HG12 VAL 80 HG12 VAL 80 65.897 -10.033 7.321 596 HG13 VAL 80 HG13 VAL 80 66.685 -11.568 6.979 597 HG21 VAL 80 HG21 VAL 80 68.041 -10.528 10.246 598 HG22 VAL 80 HG22 VAL 80 66.639 -11.297 9.506 599 HG23 VAL 80 HG23 VAL 80 66.653 -9.555 9.771 600 H GLY 81 HN GLY 81 69.378 -12.331 10.171 601 HA2 GLY 81 HA2 GLY 81 69.456 -14.983 9.638 602 HA3 GLY 81 HA1 GLY 81 68.689 -14.347 11.083 603 H THR 82 HN THR 82 66.745 -13.014 8.984 604 HA THR 82 HA THR 82 64.838 -15.230 9.079 605 HB THR 82 HB THR 82 63.225 -13.502 8.283 606 HG1 THR 82 HG1 THR 82 64.836 -11.403 8.789 607 HG21 THR 82 HG21 THR 82 63.815 -13.930 10.726 608 HG22 THR 82 HG22 THR 82 63.124 -12.345 10.381 609 HG23 THR 82 HG23 THR 82 64.861 -12.514 10.629 610 H CYS 83 HN CYS 83 65.448 -12.798 6.564 611 HA CYS 83 HA CYS 83 65.782 -14.945 4.569 612 HB2 CYS 83 HB2 CYS 83 63.361 -14.052 4.744 613 HB3 CYS 83 HB1 CYS 83 63.999 -12.584 4.006 614 HG CYS 83 HG CYS 83 63.628 -13.836 1.885 615 H SER 84 HN SER 84 66.010 -13.552 2.310 616 HA SER 84 HA SER 84 67.662 -11.198 2.629 617 HB2 SER 84 HB2 SER 84 69.624 -12.246 1.480 618 HB3 SER 84 HB1 SER 84 69.347 -12.867 3.105 619 HG SER 84 HG SER 84 67.930 -14.433 1.732 620 H SER 85 HN SER 85 68.372 -10.364 0.506 621 HA SER 85 HA SER 85 67.259 -11.536 -1.870 622 HB2 SER 85 HB2 SER 85 66.040 -8.961 -0.869 623 HB3 SER 85 HB1 SER 85 65.692 -9.755 -2.404 624 HG SER 85 HG SER 85 64.928 -11.542 -1.211 625 H GLU 86 HN GLU 86 67.431 -9.909 -3.736 626 HA GLU 86 HA GLU 86 69.753 -8.110 -3.391 627 HB2 GLU 86 HB2 GLU 86 70.566 -9.008 -5.633 628 HB3 GLU 86 HB1 GLU 86 70.775 -10.075 -4.246 629 HG2 GLU 86 HG2 GLU 86 68.312 -10.222 -5.989 630 HG3 GLU 86 HG1 GLU 86 69.781 -11.104 -6.400 631 H ALA 87 HN ALA 87 69.916 -6.480 -4.929 632 HA ALA 87 HA ALA 87 67.753 -6.106 -6.867 633 HB1 ALA 87 HB1 ALA 87 68.388 -4.242 -4.584 634 HB2 ALA 87 HB2 ALA 87 66.822 -4.906 -5.045 635 HB3 ALA 87 HB3 ALA 87 67.593 -3.680 -6.054 636 H GLN 88 HN GLN 88 68.344 -4.640 -8.559 637 HA GLN 88 HA GLN 88 71.270 -4.161 -8.710 638 HB2 GLN 88 HB2 GLN 88 69.235 -4.634 -10.896 639 HB3 GLN 88 HB1 GLN 88 70.930 -4.231 -11.173 640 HG2 GLN 88 HG2 GLN 88 71.645 -6.225 -9.969 641 HG3 GLN 88 HG1 GLN 88 69.976 -6.615 -9.567 642 HE21 GLN 88 HE21 GLN 88 71.671 -8.425 -11.055 643 HE22 GLN 88 HE22 GLN 88 71.038 -8.560 -12.625 644 H LEU 89 HN LEU 89 72.026 -2.211 -8.828 645 HA LEU 89 HA LEU 89 70.196 0.077 -9.222 646 HB2 LEU 89 HB2 LEU 89 71.517 0.121 -7.145 647 HB3 LEU 89 HB1 LEU 89 73.001 -0.083 -8.070 648 HG LEU 89 HG LEU 89 72.659 2.088 -9.161 649 HD11 LEU 89 HD11 LEU 89 70.326 2.361 -9.352 650 HD12 LEU 89 HD12 LEU 89 70.779 3.546 -8.132 651 HD13 LEU 89 HD13 LEU 89 70.055 2.014 -7.645 652 HD21 LEU 89 HD21 LEU 89 72.780 3.529 -7.066 653 HD22 LEU 89 HD22 LEU 89 73.907 2.174 -7.115 654 HD23 LEU 89 HD23 LEU 89 72.442 2.065 -6.141 655 H LYS 90 HN LYS 90 70.131 -0.302 -11.528 656 HA LYS 90 HA LYS 90 72.623 0.105 -13.029 657 HB2 LYS 90 HB2 LYS 90 69.795 -0.566 -13.919 658 HB3 LYS 90 HB1 LYS 90 71.193 -0.437 -14.990 659 HG2 LYS 90 HG2 LYS 90 72.316 -2.258 -13.823 660 HG3 LYS 90 HG1 LYS 90 71.030 -2.321 -12.622 661 HD2 LYS 90 HD2 LYS 90 70.517 -4.090 -14.104 662 HD3 LYS 90 HD1 LYS 90 69.439 -2.787 -14.600 663 HE2 LYS 90 HE2 LYS 90 70.825 -2.233 -16.473 664 HE3 LYS 90 HE1 LYS 90 72.144 -3.247 -15.895 665 HZ1 LYS 90 HZ1 LYS 90 70.146 -5.014 -16.026 666 HZ2 LYS 90 HZ2 LYS 90 71.253 -4.735 -17.286 667 HZ3 LYS 90 HZ3 LYS 90 69.729 -3.986 -17.310 668 H VAL 91 HN VAL 91 72.324 1.610 -15.024 669 HA VAL 91 HA VAL 91 70.985 4.116 -14.132 670 HB VAL 91 HB VAL 91 72.729 5.232 -15.612 671 HG11 VAL 91 HG11 VAL 91 74.491 5.047 -13.856 672 HG12 VAL 91 HG12 VAL 91 73.624 3.681 -13.154 673 HG13 VAL 91 HG13 VAL 91 72.883 5.282 -13.170 674 HG21 VAL 91 HG21 VAL 91 74.632 4.015 -16.313 675 HG22 VAL 91 HG22 VAL 91 73.288 2.942 -16.703 676 HG23 VAL 91 HG23 VAL 91 74.255 2.651 -15.259 677 H THR 92 HN THR 92 69.706 5.190 -15.593 678 HA THR 92 HA THR 92 68.554 3.679 -17.697 679 HB THR 92 HB THR 92 68.427 6.683 -17.331 680 HG1 THR 92 HG1 THR 92 66.297 5.431 -16.409 681 HG21 THR 92 HG21 THR 92 66.539 4.691 -18.616 682 HG22 THR 92 HG22 THR 92 67.559 5.839 -19.483 683 HG23 THR 92 HG23 THR 92 66.247 6.424 -18.459 684 H ALA 93 HN ALA 93 69.005 3.572 -19.832 685 HA ALA 93 HA ALA 93 71.559 4.321 -20.775 686 HB1 ALA 93 HB1 ALA 93 70.425 2.441 -21.747 687 HB2 ALA 93 HB2 ALA 93 70.626 3.652 -23.014 688 HB3 ALA 93 HB3 ALA 93 69.058 3.444 -22.232 689 H GLY 94 HN GLY 94 72.268 6.028 -22.026 690 HA2 GLY 94 HA2 GLY 94 70.750 7.806 -23.516 691 HA3 GLY 94 HA1 GLY 94 70.808 8.471 -21.889 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 55.547 -15.707 21.760 2 H2 MET 1 HT2 MET 1 54.846 -14.211 21.353 3 H3 MET 1 HT3 MET 1 55.884 -14.331 22.694 4 HA MET 1 HA MET 1 57.756 -14.305 21.456 5 HB2 MET 1 HB2 MET 1 57.757 -15.164 19.071 6 HB3 MET 1 HB1 MET 1 57.363 -16.380 20.288 7 HG2 MET 1 HG2 MET 1 54.935 -15.968 19.853 8 HG3 MET 1 HG1 MET 1 55.385 -14.861 18.561 9 HE1 MET 1 HE1 MET 1 58.036 -16.541 17.195 10 HE2 MET 1 HE2 MET 1 56.833 -15.343 16.722 11 HE3 MET 1 HE3 MET 1 56.934 -16.873 15.852 12 H ALA 2 HN ALA 2 58.507 -12.450 20.518 13 HA ALA 2 HA ALA 2 56.593 -10.439 19.772 14 HB1 ALA 2 HB1 ALA 2 58.497 -9.644 20.954 15 HB2 ALA 2 HB2 ALA 2 58.751 -9.114 19.289 16 HB3 ALA 2 HB3 ALA 2 59.608 -10.522 19.904 17 HA PRO 3 HA PRO 3 56.375 -11.149 15.421 18 HB2 PRO 3 HB2 PRO 3 56.861 -8.400 14.606 19 HB3 PRO 3 HB1 PRO 3 55.330 -9.285 14.623 20 HG2 PRO 3 HG2 PRO 3 56.244 -7.254 16.444 21 HG3 PRO 3 HG1 PRO 3 54.679 -8.077 16.412 22 HD2 PRO 3 HD2 PRO 3 56.738 -8.408 18.357 23 HD3 PRO 3 HD1 PRO 3 55.256 -9.372 18.204 24 H GLU 4 HN GLU 4 57.745 -11.603 13.712 25 HA GLU 4 HA GLU 4 60.565 -11.485 14.218 26 HB2 GLU 4 HB2 GLU 4 59.281 -13.314 12.943 27 HB3 GLU 4 HB1 GLU 4 59.268 -12.199 11.579 28 HG2 GLU 4 HG2 GLU 4 61.171 -13.660 11.313 29 HG3 GLU 4 HG1 GLU 4 61.790 -12.080 11.763 30 H VAL 5 HN VAL 5 62.118 -10.570 12.649 31 HA VAL 5 HA VAL 5 61.848 -7.834 12.319 32 HB VAL 5 HB VAL 5 63.927 -7.919 11.263 33 HG11 VAL 5 HG11 VAL 5 63.739 -9.425 13.407 34 HG12 VAL 5 HG12 VAL 5 65.203 -9.509 12.427 35 HG13 VAL 5 HG13 VAL 5 63.976 -10.760 12.280 36 HG21 VAL 5 HG21 VAL 5 64.669 -9.896 9.863 37 HG22 VAL 5 HG22 VAL 5 63.312 -9.008 9.178 38 HG23 VAL 5 HG23 VAL 5 63.036 -10.539 10.006 39 H THR 6 HN THR 6 61.019 -6.512 10.716 40 HA THR 6 HA THR 6 59.364 -7.897 8.689 41 HB THR 6 HB THR 6 59.426 -4.964 9.389 42 HG1 THR 6 HG1 THR 6 57.229 -6.202 10.174 43 HG21 THR 6 HG21 THR 6 57.126 -5.097 8.348 44 HG22 THR 6 HG22 THR 6 57.575 -6.704 7.768 45 HG23 THR 6 HG23 THR 6 58.481 -5.290 7.239 46 H ILE 7 HN ILE 7 60.000 -8.104 6.658 47 HA ILE 7 HA ILE 7 62.152 -6.327 5.643 48 HB ILE 7 HB ILE 7 61.292 -9.012 4.591 49 HG12 ILE 7 HG12 ILE 7 62.209 -9.356 6.810 50 HG13 ILE 7 HG11 ILE 7 63.433 -9.826 5.633 51 HG21 ILE 7 HG21 ILE 7 63.589 -7.145 3.985 52 HG22 ILE 7 HG22 ILE 7 62.375 -7.771 2.870 53 HG23 ILE 7 HG23 ILE 7 63.610 -8.845 3.520 54 HD11 ILE 7 HD11 ILE 7 63.343 -7.366 7.370 55 HD12 ILE 7 HD12 ILE 7 64.283 -7.366 5.879 56 HD13 ILE 7 HD13 ILE 7 64.657 -8.521 7.160 57 H LEU 8 HN LEU 8 60.761 -4.684 4.990 58 HA LEU 8 HA LEU 8 59.001 -5.289 2.677 59 HB2 LEU 8 HB2 LEU 8 58.895 -3.084 4.736 60 HB3 LEU 8 HB1 LEU 8 58.039 -2.977 3.203 61 HG LEU 8 HG LEU 8 57.715 -5.311 5.102 62 HD11 LEU 8 HD11 LEU 8 55.647 -4.205 5.874 63 HD12 LEU 8 HD12 LEU 8 56.020 -2.807 4.870 64 HD13 LEU 8 HD13 LEU 8 57.059 -3.214 6.232 65 HD21 LEU 8 HD21 LEU 8 56.333 -4.371 2.591 66 HD22 LEU 8 HD22 LEU 8 55.424 -5.290 3.786 67 HD23 LEU 8 HD23 LEU 8 56.849 -5.998 3.036 68 H GLU 9 HN GLU 9 60.074 -4.924 0.885 69 HA GLU 9 HA GLU 9 61.874 -2.571 0.735 70 HB2 GLU 9 HB2 GLU 9 63.217 -3.894 -0.860 71 HB3 GLU 9 HB1 GLU 9 63.167 -4.604 0.755 72 HG2 GLU 9 HG2 GLU 9 61.031 -5.883 -0.357 73 HG3 GLU 9 HG1 GLU 9 61.992 -5.617 -1.807 74 HA PRO 10 HA PRO 10 58.732 -1.989 -2.555 75 HB2 PRO 10 HB2 PRO 10 59.196 0.872 -2.384 76 HB3 PRO 10 HB1 PRO 10 57.736 -0.021 -1.935 77 HG2 PRO 10 HG2 PRO 10 59.511 1.242 -0.169 78 HG3 PRO 10 HG1 PRO 10 58.250 0.079 0.264 79 HD2 PRO 10 HD2 PRO 10 61.181 -0.327 0.107 80 HD3 PRO 10 HD1 PRO 10 59.959 -1.268 0.987 81 H LEU 11 HN LEU 11 61.963 -1.318 -2.032 82 HA LEU 11 HA LEU 11 62.752 -0.045 -4.446 83 HB2 LEU 11 HB2 LEU 11 64.328 -1.854 -2.600 84 HB3 LEU 11 HB1 LEU 11 65.005 -0.720 -3.771 85 HG LEU 11 HG LEU 11 63.210 0.086 -1.460 86 HD11 LEU 11 HD11 LEU 11 65.412 1.050 -0.571 87 HD12 LEU 11 HD12 LEU 11 66.218 0.010 -1.749 88 HD13 LEU 11 HD13 LEU 11 65.232 -0.703 -0.477 89 HD21 LEU 11 HD21 LEU 11 64.708 1.578 -3.616 90 HD22 LEU 11 HD22 LEU 11 64.397 2.350 -2.065 91 HD23 LEU 11 HD23 LEU 11 63.051 1.802 -3.060 92 H GLN 12 HN GLN 12 61.420 -1.364 -5.933 93 HA GLN 12 HA GLN 12 62.002 -4.117 -6.394 94 HB2 GLN 12 HB2 GLN 12 59.867 -3.196 -7.052 95 HB3 GLN 12 HB1 GLN 12 60.647 -2.004 -8.082 96 HG2 GLN 12 HG2 GLN 12 59.725 -3.929 -9.363 97 HG3 GLN 12 HG1 GLN 12 61.462 -3.753 -9.574 98 HE21 GLN 12 HE21 GLN 12 62.058 -5.938 -9.872 99 HE22 GLN 12 HE22 GLN 12 61.761 -7.160 -8.731 100 H ASP 13 HN ASP 13 63.078 -1.083 -7.854 101 HA ASP 13 HA ASP 13 65.605 -2.088 -8.632 102 HB2 ASP 13 HB2 ASP 13 64.141 -3.301 -10.297 103 HB3 ASP 13 HB1 ASP 13 63.668 -1.732 -10.935 104 H VAL 14 HN VAL 14 66.943 -0.431 -9.356 105 HA VAL 14 HA VAL 14 65.695 2.261 -9.592 106 HB VAL 14 HB VAL 14 68.286 1.446 -8.254 107 HG11 VAL 14 HG11 VAL 14 68.786 3.472 -9.394 108 HG12 VAL 14 HG12 VAL 14 68.397 3.953 -7.746 109 HG13 VAL 14 HG13 VAL 14 67.204 4.159 -9.029 110 HG21 VAL 14 HG21 VAL 14 66.542 1.141 -6.699 111 HG22 VAL 14 HG22 VAL 14 65.633 2.528 -7.294 112 HG23 VAL 14 HG23 VAL 14 67.102 2.774 -6.352 113 H GLN 15 HN GLN 15 66.250 3.460 -11.303 114 HA GLN 15 HA GLN 15 68.628 2.771 -12.895 115 HB2 GLN 15 HB2 GLN 15 67.360 2.688 -14.963 116 HB3 GLN 15 HB1 GLN 15 66.705 1.498 -13.840 117 HG2 GLN 15 HG2 GLN 15 64.993 3.249 -13.152 118 HG3 GLN 15 HG1 GLN 15 65.557 4.211 -14.520 119 HE21 GLN 15 HE21 GLN 15 63.831 4.008 -15.990 120 HE22 GLN 15 HE22 GLN 15 63.248 2.518 -16.557 121 H LEU 16 HN LEU 16 69.700 4.556 -13.440 122 HA LEU 16 HA LEU 16 68.371 7.006 -14.165 123 HB2 LEU 16 HB2 LEU 16 69.366 8.364 -12.341 124 HB3 LEU 16 HB1 LEU 16 68.169 7.209 -11.764 125 HG LEU 16 HG LEU 16 70.467 5.691 -11.579 126 HD11 LEU 16 HD11 LEU 16 71.242 8.549 -10.907 127 HD12 LEU 16 HD12 LEU 16 71.918 7.573 -12.210 128 HD13 LEU 16 HD13 LEU 16 72.199 7.115 -10.531 129 HD21 LEU 16 HD21 LEU 16 68.735 6.046 -9.819 130 HD22 LEU 16 HD22 LEU 16 69.480 7.603 -9.439 131 HD23 LEU 16 HD23 LEU 16 70.379 6.106 -9.183 132 H SER 17 HN SER 17 69.723 8.414 -15.264 133 HA SER 17 HA SER 17 72.085 7.320 -16.392 134 HB2 SER 17 HB2 SER 17 71.293 10.240 -16.351 135 HB3 SER 17 HB1 SER 17 72.328 9.426 -17.526 136 HG SER 17 HG SER 17 69.557 9.036 -17.057 137 H GLU 18 HN GLU 18 74.253 7.815 -16.042 138 HA GLU 18 HA GLU 18 74.980 8.286 -13.355 139 HB2 GLU 18 HB2 GLU 18 76.387 7.719 -15.888 140 HB3 GLU 18 HB1 GLU 18 77.342 8.671 -14.753 141 HG2 GLU 18 HG2 GLU 18 77.194 7.038 -13.067 142 HG3 GLU 18 HG1 GLU 18 75.873 6.188 -13.872 143 H GLY 19 HN GLY 19 76.044 9.875 -12.361 144 HA2 GLY 19 HA2 GLY 19 76.954 11.996 -12.057 145 HA3 GLY 19 HA1 GLY 19 76.351 12.483 -13.637 146 H GLN 20 HN GLN 20 73.828 10.928 -12.454 147 HA GLN 20 HA GLN 20 72.518 13.365 -11.462 148 HB2 GLN 20 HB2 GLN 20 71.473 10.659 -12.323 149 HB3 GLN 20 HB1 GLN 20 70.446 11.923 -11.642 150 HG2 GLN 20 HG2 GLN 20 71.094 13.446 -13.456 151 HG3 GLN 20 HG1 GLN 20 72.163 12.212 -14.127 152 HE21 GLN 20 HE21 GLN 20 70.491 12.731 -16.039 153 HE22 GLN 20 HE22 GLN 20 69.127 11.720 -16.089 154 H ASP 21 HN ASP 21 71.092 13.182 -9.547 155 HA ASP 21 HA ASP 21 72.487 11.905 -7.375 156 HB2 ASP 21 HB2 ASP 21 69.937 13.517 -7.517 157 HB3 ASP 21 HB1 ASP 21 70.572 12.844 -6.015 158 H ALA 22 HN ALA 22 71.408 10.499 -5.813 159 HA ALA 22 HA ALA 22 69.181 8.878 -6.793 160 HB1 ALA 22 HB1 ALA 22 71.165 7.779 -7.746 161 HB2 ALA 22 HB2 ALA 22 70.430 6.781 -6.491 162 HB3 ALA 22 HB3 ALA 22 71.895 7.699 -6.143 163 H SER 23 HN SER 23 68.295 7.492 -5.142 164 HA SER 23 HA SER 23 69.297 7.663 -2.435 165 HB2 SER 23 HB2 SER 23 67.217 8.743 -1.555 166 HB3 SER 23 HB1 SER 23 68.221 9.819 -2.525 167 HG SER 23 HG SER 23 66.562 8.508 -4.139 168 H PHE 24 HN PHE 24 67.929 6.457 -0.907 169 HA PHE 24 HA PHE 24 66.101 4.525 -2.218 170 HB2 PHE 24 HB2 PHE 24 68.335 3.890 -0.292 171 HB3 PHE 24 HB1 PHE 24 67.071 2.761 -0.749 172 HD1 PHE 24 HD1 PHE 24 70.063 4.587 -1.908 173 HD2 PHE 24 HD2 PHE 24 66.953 1.828 -2.964 174 HE1 PHE 24 HE1 PHE 24 71.331 3.925 -3.941 175 HE2 PHE 24 HE2 PHE 24 68.209 1.169 -4.986 176 HZ PHE 24 HZ PHE 24 70.393 2.209 -5.474 177 H GLN 25 HN GLN 25 64.454 3.749 -0.967 178 HA GLN 25 HA GLN 25 64.175 4.714 1.801 179 HB2 GLN 25 HB2 GLN 25 62.146 5.064 -0.415 180 HB3 GLN 25 HB1 GLN 25 61.772 5.245 1.296 181 HG2 GLN 25 HG2 GLN 25 63.423 7.027 1.504 182 HG3 GLN 25 HG1 GLN 25 63.886 6.821 -0.185 183 HE21 GLN 25 HE21 GLN 25 63.097 9.322 0.206 184 HE22 GLN 25 HE22 GLN 25 61.490 9.598 -0.263 185 H CYS 26 HN CYS 26 63.621 3.064 3.070 186 HA CYS 26 HA CYS 26 61.879 0.933 2.043 187 HB2 CYS 26 HB2 CYS 26 64.003 -0.018 1.528 188 HB3 CYS 26 HB1 CYS 26 64.695 0.516 3.057 189 HG CYS 26 HG CYS 26 62.685 -1.210 4.049 190 H ARG 27 HN ARG 27 61.159 -0.515 3.765 191 HA ARG 27 HA ARG 27 61.106 0.816 6.426 192 HB2 ARG 27 HB2 ARG 27 58.938 0.976 5.233 193 HB3 ARG 27 HB1 ARG 27 58.905 -0.783 5.090 194 HG2 ARG 27 HG2 ARG 27 58.916 -1.005 7.532 195 HG3 ARG 27 HG1 ARG 27 59.021 0.748 7.703 196 HD2 ARG 27 HD2 ARG 27 56.865 0.950 6.459 197 HD3 ARG 27 HD1 ARG 27 56.745 -0.810 6.446 198 HE ARG 27 HE ARG 27 56.383 0.950 8.756 199 HH11 ARG 27 HH11 ARG 27 57.574 -0.838 10.385 200 HH12 ARG 27 HH12 ARG 27 56.573 -2.248 10.492 201 HH21 ARG 27 HH21 ARG 27 54.743 -1.485 7.641 202 HH22 ARG 27 HH22 ARG 27 54.968 -2.617 8.937 203 H LEU 28 HN LEU 28 62.123 -0.392 7.912 204 HA LEU 28 HA LEU 28 61.897 -3.339 7.717 205 HB2 LEU 28 HB2 LEU 28 64.128 -2.221 6.849 206 HB3 LEU 28 HB1 LEU 28 64.490 -2.069 8.565 207 HG LEU 28 HG LEU 28 63.747 -4.658 7.160 208 HD11 LEU 28 HD11 LEU 28 66.420 -3.608 8.136 209 HD12 LEU 28 HD12 LEU 28 65.949 -3.863 6.456 210 HD13 LEU 28 HD13 LEU 28 66.132 -5.242 7.540 211 HD21 LEU 28 HD21 LEU 28 64.715 -5.575 9.380 212 HD22 LEU 28 HD22 LEU 28 63.101 -4.875 9.419 213 HD23 LEU 28 HD23 LEU 28 64.481 -3.940 10.003 214 H SER 29 HN SER 29 60.677 -3.761 9.492 215 HA SER 29 HA SER 29 60.727 -2.242 11.882 216 HB2 SER 29 HB2 SER 29 59.459 -4.026 12.904 217 HB3 SER 29 HB1 SER 29 58.862 -3.807 11.264 218 HG SER 29 HG SER 29 59.958 -5.974 12.404 219 H ARG 30 HN ARG 30 61.543 -2.874 13.937 220 HA ARG 30 HA ARG 30 64.244 -3.329 14.006 221 HB2 ARG 30 HB2 ARG 30 63.961 -3.710 16.392 222 HB3 ARG 30 HB1 ARG 30 62.907 -2.407 15.845 223 HG2 ARG 30 HG2 ARG 30 61.032 -4.050 15.675 224 HG3 ARG 30 HG1 ARG 30 62.096 -5.288 16.348 225 HD2 ARG 30 HD2 ARG 30 62.442 -3.839 18.350 226 HD3 ARG 30 HD1 ARG 30 61.268 -2.702 17.695 227 HE ARG 30 HE ARG 30 60.704 -5.314 18.865 228 HH11 ARG 30 HH11 ARG 30 59.042 -3.171 19.809 229 HH12 ARG 30 HH12 ARG 30 57.611 -3.258 18.834 230 HH21 ARG 30 HH21 ARG 30 59.086 -5.203 16.369 231 HH22 ARG 30 HH22 ARG 30 57.636 -4.406 16.888 232 H ALA 31 HN ALA 31 65.487 -5.055 14.920 233 HA ALA 31 HA ALA 31 65.006 -7.521 13.604 234 HB1 ALA 31 HB1 ALA 31 67.095 -8.236 14.578 235 HB2 ALA 31 HB2 ALA 31 67.042 -6.918 15.751 236 HB3 ALA 31 HB3 ALA 31 67.261 -6.566 14.035 237 H SER 32 HN SER 32 65.395 -9.622 14.911 238 HA SER 32 HA SER 32 63.617 -9.618 17.307 239 HB2 SER 32 HB2 SER 32 62.423 -10.713 15.517 240 HB3 SER 32 HB1 SER 32 63.847 -11.636 15.058 241 HG SER 32 HG SER 32 62.226 -12.726 16.410 242 H GLY 33 HN GLY 33 66.639 -9.825 16.267 243 HA2 GLY 33 HA2 GLY 33 68.026 -10.532 18.419 244 HA3 GLY 33 HA1 GLY 33 67.571 -12.122 17.798 245 H GLN 34 HN GLN 34 67.520 -10.965 15.034 246 HA GLN 34 HA GLN 34 70.432 -10.839 14.538 247 HB2 GLN 34 HB2 GLN 34 68.272 -12.253 12.976 248 HB3 GLN 34 HB1 GLN 34 69.895 -11.962 12.347 249 HG2 GLN 34 HG2 GLN 34 70.888 -13.231 14.150 250 HG3 GLN 34 HG1 GLN 34 69.327 -13.399 14.950 251 HE21 GLN 34 HE21 GLN 34 71.461 -15.118 13.078 252 HE22 GLN 34 HE22 GLN 34 70.373 -16.175 12.319 253 H GLU 35 HN GLU 35 71.043 -8.962 13.749 254 HA GLU 35 HA GLU 35 69.065 -7.208 12.478 255 HB2 GLU 35 HB2 GLU 35 70.511 -6.317 14.277 256 HB3 GLU 35 HB1 GLU 35 71.924 -6.638 13.277 257 HG2 GLU 35 HG2 GLU 35 71.081 -5.130 11.543 258 HG3 GLU 35 HG1 GLU 35 69.608 -4.857 12.470 259 H ALA 36 HN ALA 36 69.366 -6.255 10.464 260 HA ALA 36 HA ALA 36 70.655 -7.923 8.493 261 HB1 ALA 36 HB1 ALA 36 68.434 -6.776 8.182 262 HB2 ALA 36 HB2 ALA 36 69.598 -6.481 6.887 263 HB3 ALA 36 HB3 ALA 36 69.305 -5.246 8.110 264 H ARG 37 HN ARG 37 71.923 -6.840 6.713 265 HA ARG 37 HA ARG 37 73.605 -4.599 7.594 266 HB2 ARG 37 HB2 ARG 37 75.667 -5.812 7.076 267 HB3 ARG 37 HB1 ARG 37 74.772 -6.642 8.346 268 HG2 ARG 37 HG2 ARG 37 73.812 -8.170 6.632 269 HG3 ARG 37 HG1 ARG 37 74.801 -7.373 5.405 270 HD2 ARG 37 HD2 ARG 37 75.885 -8.751 7.875 271 HD3 ARG 37 HD1 ARG 37 75.872 -9.443 6.255 272 HE ARG 37 HE ARG 37 77.665 -7.393 7.242 273 HH11 ARG 37 HH11 ARG 37 79.210 -8.988 5.692 274 HH12 ARG 37 HH12 ARG 37 79.105 -8.427 4.055 275 HH21 ARG 37 HH21 ARG 37 76.212 -6.584 4.590 276 HH22 ARG 37 HH22 ARG 37 77.407 -7.064 3.432 277 H TRP 38 HN TRP 38 74.495 -3.421 5.907 278 HA TRP 38 HA TRP 38 73.160 -3.658 3.359 279 HB2 TRP 38 HB2 TRP 38 75.240 -1.774 4.466 280 HB3 TRP 38 HB1 TRP 38 74.662 -1.668 2.801 281 HD1 TRP 38 HD1 TRP 38 73.955 -0.380 6.126 282 HE1 TRP 38 HE1 TRP 38 71.602 0.653 6.246 283 HE3 TRP 38 HE3 TRP 38 71.952 -2.244 1.817 284 HZ2 TRP 38 HZ2 TRP 38 69.183 0.686 4.723 285 HZ3 TRP 38 HZ3 TRP 38 69.618 -1.699 1.177 286 HH2 TRP 38 HH2 TRP 38 68.232 -0.238 2.623 287 H ALA 39 HN ALA 39 74.645 -3.236 1.351 288 HA ALA 39 HA ALA 39 77.226 -4.481 1.382 289 HB1 ALA 39 HB1 ALA 39 75.172 -5.999 -0.212 290 HB2 ALA 39 HB2 ALA 39 75.481 -6.405 1.477 291 HB3 ALA 39 HB3 ALA 39 76.783 -6.510 0.294 292 H LEU 40 HN LEU 40 78.173 -2.987 0.146 293 HA LEU 40 HA LEU 40 76.926 -2.269 -2.446 294 HB2 LEU 40 HB2 LEU 40 77.286 -0.490 -0.598 295 HB3 LEU 40 HB1 LEU 40 78.992 -0.628 -0.979 296 HG LEU 40 HG LEU 40 78.064 1.227 -2.226 297 HD11 LEU 40 HD11 LEU 40 78.818 0.694 -4.393 298 HD12 LEU 40 HD12 LEU 40 78.312 -0.990 -4.256 299 HD13 LEU 40 HD13 LEU 40 79.707 -0.407 -3.339 300 HD21 LEU 40 HD21 LEU 40 76.177 -0.570 -3.738 301 HD22 LEU 40 HD22 LEU 40 76.132 1.177 -3.520 302 HD23 LEU 40 HD23 LEU 40 75.683 0.119 -2.191 303 H GLY 41 HN GLY 41 77.903 -3.324 -4.052 304 HA2 GLY 41 HA2 GLY 41 79.586 -4.041 -5.452 305 HA3 GLY 41 HA1 GLY 41 80.718 -3.108 -4.477 306 H GLY 42 HN GLY 42 78.760 -5.327 -2.741 307 HA2 GLY 42 HA2 GLY 42 79.155 -7.611 -2.191 308 HA3 GLY 42 HA1 GLY 42 80.778 -7.474 -2.851 309 H VAL 43 HN VAL 43 81.012 -4.811 -1.367 310 HA VAL 43 HA VAL 43 81.663 -5.954 1.286 311 HB VAL 43 HB VAL 43 83.418 -4.265 1.434 312 HG11 VAL 43 HG11 VAL 43 84.882 -5.122 -0.303 313 HG12 VAL 43 HG12 VAL 43 83.496 -5.636 -1.272 314 HG13 VAL 43 HG13 VAL 43 83.850 -6.439 0.260 315 HG21 VAL 43 HG21 VAL 43 82.323 -3.398 -1.257 316 HG22 VAL 43 HG22 VAL 43 83.878 -2.868 -0.619 317 HG23 VAL 43 HG23 VAL 43 82.387 -2.439 0.221 318 HA PRO 44 HA PRO 44 78.640 -3.221 3.050 319 HB2 PRO 44 HB2 PRO 44 80.232 -2.410 5.342 320 HB3 PRO 44 HB1 PRO 44 78.894 -3.564 5.290 321 HG2 PRO 44 HG2 PRO 44 81.680 -4.117 5.576 322 HG3 PRO 44 HG1 PRO 44 80.340 -5.269 5.502 323 HD2 PRO 44 HD2 PRO 44 82.343 -4.763 3.480 324 HD3 PRO 44 HD1 PRO 44 80.996 -5.913 3.424 325 H LEU 45 HN LEU 45 78.112 -1.051 3.030 326 HA LEU 45 HA LEU 45 80.150 0.781 1.993 327 HB2 LEU 45 HB2 LEU 45 77.942 2.312 2.006 328 HB3 LEU 45 HB1 LEU 45 78.248 1.145 0.727 329 HG LEU 45 HG LEU 45 76.864 -0.528 1.884 330 HD11 LEU 45 HD11 LEU 45 76.758 1.644 3.979 331 HD12 LEU 45 HD12 LEU 45 77.103 -0.073 4.181 332 HD13 LEU 45 HD13 LEU 45 75.454 0.461 3.852 333 HD21 LEU 45 HD21 LEU 45 74.660 0.783 1.805 334 HD22 LEU 45 HD22 LEU 45 75.633 0.807 0.337 335 HD23 LEU 45 HD23 LEU 45 75.638 2.199 1.418 336 H GLN 46 HN GLN 46 80.182 3.016 2.902 337 HA GLN 46 HA GLN 46 79.605 3.106 5.803 338 HB2 GLN 46 HB2 GLN 46 82.246 3.743 4.456 339 HB3 GLN 46 HB1 GLN 46 81.844 4.222 6.106 340 HG2 GLN 46 HG2 GLN 46 81.502 1.867 6.721 341 HG3 GLN 46 HG1 GLN 46 81.860 1.373 5.067 342 HE21 GLN 46 HE21 GLN 46 83.895 0.344 5.274 343 HE22 GLN 46 HE22 GLN 46 85.257 1.075 5.968 344 H ALA 47 HN ALA 47 79.448 5.229 6.662 345 HA ALA 47 HA ALA 47 78.034 7.026 5.021 346 HB1 ALA 47 HB1 ALA 47 77.845 8.392 6.921 347 HB2 ALA 47 HB2 ALA 47 79.377 7.825 7.594 348 HB3 ALA 47 HB3 ALA 47 77.972 6.758 7.576 349 H ASN 48 HN ASN 48 79.658 7.154 3.231 350 HA ASN 48 HA ASN 48 82.076 8.660 3.615 351 HB2 ASN 48 HB2 ASN 48 80.510 7.863 1.158 352 HB3 ASN 48 HB1 ASN 48 81.976 8.831 1.068 353 HD21 ASN 48 HD21 ASN 48 81.761 6.176 -0.067 354 HD22 ASN 48 HD22 ASN 48 82.832 5.172 0.783 355 H GLU 49 HN GLU 49 82.476 10.780 2.612 356 HA GLU 49 HA GLU 49 80.700 12.743 3.481 357 HB2 GLU 49 HB2 GLU 49 82.823 12.844 1.331 358 HB3 GLU 49 HB1 GLU 49 81.963 14.267 1.921 359 HG2 GLU 49 HG2 GLU 49 82.783 13.857 4.189 360 HG3 GLU 49 HG1 GLU 49 83.581 12.375 3.660 361 H MET 50 HN MET 50 81.147 11.452 0.165 362 HA MET 50 HA MET 50 79.025 13.012 -0.952 363 HB2 MET 50 HB2 MET 50 80.413 10.522 -1.959 364 HB3 MET 50 HB1 MET 50 79.204 11.411 -2.877 365 HG2 MET 50 HG2 MET 50 80.635 13.472 -2.614 366 HG3 MET 50 HG1 MET 50 81.886 12.448 -1.911 367 HE1 MET 50 HE1 MET 50 83.228 10.278 -4.516 368 HE2 MET 50 HE2 MET 50 81.686 9.645 -3.944 369 HE3 MET 50 HE3 MET 50 82.757 10.482 -2.823 370 H ASN 51 HN ASN 51 79.235 9.724 0.345 371 HA ASN 51 HA ASN 51 76.305 9.414 -0.009 372 HB2 ASN 51 HB2 ASN 51 77.814 7.658 -0.996 373 HB3 ASN 51 HB1 ASN 51 78.334 7.271 0.642 374 HD21 ASN 51 HD21 ASN 51 77.349 5.147 0.651 375 HD22 ASN 51 HD22 ASN 51 75.663 4.946 0.666 376 H ASP 52 HN ASP 52 75.209 9.999 1.729 377 HA ASP 52 HA ASP 52 76.305 9.424 4.425 378 HB2 ASP 52 HB2 ASP 52 75.822 11.817 3.877 379 HB3 ASP 52 HB1 ASP 52 74.135 11.381 3.625 380 H ILE 53 HN ILE 53 75.035 8.292 5.891 381 HA ILE 53 HA ILE 53 72.451 7.211 4.906 382 HB ILE 53 HB ILE 53 74.301 5.531 4.744 383 HG12 ILE 53 HG12 ILE 53 72.364 4.805 6.962 384 HG13 ILE 53 HG11 ILE 53 71.855 4.949 5.283 385 HG21 ILE 53 HG21 ILE 53 74.312 5.654 7.764 386 HG22 ILE 53 HG22 ILE 53 75.514 6.476 6.769 387 HG23 ILE 53 HG23 ILE 53 75.381 4.715 6.719 388 HD11 ILE 53 HD11 ILE 53 73.212 2.746 6.593 389 HD12 ILE 53 HD12 ILE 53 74.178 3.303 5.229 390 HD13 ILE 53 HD13 ILE 53 72.505 2.805 4.983 391 H THR 54 HN THR 54 70.820 7.260 6.350 392 HA THR 54 HA THR 54 71.445 7.865 9.179 393 HB THR 54 HB THR 54 70.166 9.806 9.234 394 HG1 THR 54 HG1 THR 54 68.780 10.287 7.351 395 HG21 THR 54 HG21 THR 54 71.222 9.821 6.398 396 HG22 THR 54 HG22 THR 54 72.221 10.073 7.832 397 HG23 THR 54 HG23 THR 54 70.940 11.222 7.434 398 H VAL 55 HN VAL 55 69.681 7.531 10.628 399 HA VAL 55 HA VAL 55 67.580 5.699 9.613 400 HB VAL 55 HB VAL 55 67.681 4.717 11.981 401 HG11 VAL 55 HG11 VAL 55 68.640 3.676 9.859 402 HG12 VAL 55 HG12 VAL 55 69.402 3.163 11.364 403 HG13 VAL 55 HG13 VAL 55 70.198 4.353 10.336 404 HG21 VAL 55 HG21 VAL 55 69.077 6.644 12.868 405 HG22 VAL 55 HG22 VAL 55 70.429 6.001 11.934 406 HG23 VAL 55 HG23 VAL 55 69.723 5.045 13.235 407 H GLU 56 HN GLU 56 65.553 6.293 10.020 408 HA GLU 56 HA GLU 56 65.054 8.488 11.965 409 HB2 GLU 56 HB2 GLU 56 63.686 7.920 9.325 410 HB3 GLU 56 HB1 GLU 56 63.212 9.179 10.461 411 HG2 GLU 56 HG2 GLU 56 65.988 8.985 9.265 412 HG3 GLU 56 HG1 GLU 56 64.699 9.969 8.566 413 H GLN 57 HN GLN 57 62.813 8.559 12.752 414 HA GLN 57 HA GLN 57 62.006 6.395 14.188 415 HB2 GLN 57 HB2 GLN 57 60.372 8.599 12.931 416 HB3 GLN 57 HB1 GLN 57 59.674 7.432 14.059 417 HG2 GLN 57 HG2 GLN 57 61.299 8.072 15.768 418 HG3 GLN 57 HG1 GLN 57 62.081 9.178 14.641 419 HE21 GLN 57 HE21 GLN 57 60.664 9.756 17.256 420 HE22 GLN 57 HE22 GLN 57 59.472 10.897 16.859 421 H GLY 58 HN GLY 58 60.403 4.763 13.962 422 HA2 GLY 58 HA2 GLY 58 59.144 3.165 12.860 423 HA3 GLY 58 HA1 GLY 58 59.097 4.243 11.466 424 H THR 59 HN THR 59 62.200 3.547 12.744 425 HA THR 59 HA THR 59 64.034 2.537 11.797 426 HB THR 59 HB THR 59 63.799 0.190 11.286 427 HG1 THR 59 HG1 THR 59 62.032 -0.115 10.146 428 HG21 THR 59 HG21 THR 59 61.904 0.950 13.515 429 HG22 THR 59 HG22 THR 59 63.662 0.932 13.655 430 HG23 THR 59 HG23 THR 59 62.784 -0.570 13.356 431 H LEU 60 HN LEU 60 62.511 4.321 10.112 432 HA LEU 60 HA LEU 60 62.406 3.128 7.475 433 HB2 LEU 60 HB2 LEU 60 62.293 6.033 8.330 434 HB3 LEU 60 HB1 LEU 60 61.887 5.412 6.735 435 HG LEU 60 HG LEU 60 60.492 4.585 9.299 436 HD11 LEU 60 HD11 LEU 60 60.095 6.964 8.740 437 HD12 LEU 60 HD12 LEU 60 58.636 6.001 8.527 438 HD13 LEU 60 HD13 LEU 60 59.580 6.494 7.123 439 HD21 LEU 60 HD21 LEU 60 58.754 3.927 7.369 440 HD22 LEU 60 HD22 LEU 60 60.047 2.833 7.849 441 HD23 LEU 60 HD23 LEU 60 60.227 3.822 6.402 442 H HIS 61 HN HIS 61 64.157 2.794 6.248 443 HA HIS 61 HA HIS 61 66.712 4.012 6.918 444 HB2 HIS 61 HB2 HIS 61 65.911 2.101 4.713 445 HB3 HIS 61 HB1 HIS 61 67.563 2.604 5.064 446 HD1 HIS 61 HD1 HIS 61 68.582 1.814 7.374 447 HD2 HIS 61 HD2 HIS 61 64.868 0.157 6.454 448 HE1 HIS 61 HE1 HIS 61 68.247 -0.127 8.966 449 H LEU 62 HN LEU 62 67.818 5.529 5.656 450 HA LEU 62 HA LEU 62 66.556 6.446 3.162 451 HB2 LEU 62 HB2 LEU 62 65.475 7.854 4.814 452 HB3 LEU 62 HB1 LEU 62 67.013 8.207 5.592 453 HG LEU 62 HG LEU 62 67.779 9.366 3.534 454 HD11 LEU 62 HD11 LEU 62 65.043 8.504 2.568 455 HD12 LEU 62 HD12 LEU 62 66.598 8.301 1.766 456 HD13 LEU 62 HD13 LEU 62 65.863 9.897 1.865 457 HD21 LEU 62 HD21 LEU 62 66.275 11.307 3.739 458 HD22 LEU 62 HD22 LEU 62 66.636 10.628 5.326 459 HD23 LEU 62 HD23 LEU 62 65.081 10.303 4.562 460 H LEU 63 HN LEU 63 68.335 5.727 2.040 461 HA LEU 63 HA LEU 63 70.995 6.671 2.835 462 HB2 LEU 63 HB2 LEU 63 70.580 4.304 2.157 463 HB3 LEU 63 HB1 LEU 63 70.145 4.879 0.557 464 HG LEU 63 HG LEU 63 72.388 5.762 0.208 465 HD11 LEU 63 HD11 LEU 63 72.697 5.022 3.115 466 HD12 LEU 63 HD12 LEU 63 73.242 6.468 2.274 467 HD13 LEU 63 HD13 LEU 63 74.110 4.953 2.061 468 HD21 LEU 63 HD21 LEU 63 71.835 3.367 -0.252 469 HD22 LEU 63 HD22 LEU 63 72.448 2.957 1.351 470 HD23 LEU 63 HD23 LEU 63 73.542 3.610 0.129 471 H THR 64 HN THR 64 71.361 8.717 2.280 472 HA THR 64 HA THR 64 70.316 9.783 -0.252 473 HB THR 64 HB THR 64 71.748 11.174 2.024 474 HG1 THR 64 HG1 THR 64 69.632 11.883 2.514 475 HG21 THR 64 HG21 THR 64 72.014 12.528 0.117 476 HG22 THR 64 HG22 THR 64 70.563 13.174 0.882 477 HG23 THR 64 HG23 THR 64 70.422 12.113 -0.518 478 H LEU 65 HN LEU 65 71.654 9.028 -1.852 479 HA LEU 65 HA LEU 65 74.570 9.479 -1.588 480 HB2 LEU 65 HB2 LEU 65 73.461 7.244 -2.378 481 HB3 LEU 65 HB1 LEU 65 73.204 8.098 -3.897 482 HG LEU 65 HG LEU 65 75.895 7.789 -2.529 483 HD11 LEU 65 HD11 LEU 65 76.351 6.198 -4.411 484 HD12 LEU 65 HD12 LEU 65 74.648 6.303 -4.858 485 HD13 LEU 65 HD13 LEU 65 75.110 5.626 -3.299 486 HD21 LEU 65 HD21 LEU 65 76.618 8.427 -4.953 487 HD22 LEU 65 HD22 LEU 65 76.046 9.706 -3.890 488 HD23 LEU 65 HD23 LEU 65 74.971 9.039 -5.119 489 H HIS 66 HN HIS 66 75.334 11.368 -2.422 490 HA HIS 66 HA HIS 66 73.803 12.665 -4.623 491 HB2 HIS 66 HB2 HIS 66 75.587 13.873 -2.493 492 HB3 HIS 66 HB1 HIS 66 74.963 14.761 -3.878 493 HD1 HIS 66 HD1 HIS 66 73.971 15.950 -1.423 494 HD2 HIS 66 HD2 HIS 66 72.091 12.591 -3.018 495 HE1 HIS 66 HE1 HIS 66 71.638 15.893 -0.433 496 H LYS 67 HN LYS 67 74.995 13.678 -6.306 497 HA LYS 67 HA LYS 67 76.610 13.659 -7.948 498 HB2 LYS 67 HB2 LYS 67 78.350 13.558 -5.470 499 HB3 LYS 67 HB1 LYS 67 78.948 13.895 -7.095 500 HG2 LYS 67 HG2 LYS 67 77.461 15.854 -7.246 501 HG3 LYS 67 HG1 LYS 67 76.842 15.514 -5.630 502 HD2 LYS 67 HD2 LYS 67 79.094 15.810 -4.687 503 HD3 LYS 67 HD1 LYS 67 79.737 16.114 -6.303 504 HE2 LYS 67 HE2 LYS 67 79.337 18.243 -5.149 505 HE3 LYS 67 HE1 LYS 67 78.237 18.073 -6.521 506 HZ1 LYS 67 HZ1 LYS 67 77.548 18.532 -3.897 507 HZ2 LYS 67 HZ2 LYS 67 77.131 16.911 -4.184 508 HZ3 LYS 67 HZ3 LYS 67 76.503 18.139 -5.174 509 H VAL 68 HN VAL 68 75.527 11.290 -8.003 510 HA VAL 68 HA VAL 68 76.904 9.024 -7.224 511 HB VAL 68 HB VAL 68 74.625 9.314 -8.540 512 HG11 VAL 68 HG11 VAL 68 75.945 10.166 -10.587 513 HG12 VAL 68 HG12 VAL 68 74.712 8.940 -10.885 514 HG13 VAL 68 HG13 VAL 68 76.418 8.484 -10.833 515 HG21 VAL 68 HG21 VAL 68 75.500 7.189 -7.585 516 HG22 VAL 68 HG22 VAL 68 76.455 6.946 -9.046 517 HG23 VAL 68 HG23 VAL 68 74.696 6.931 -9.134 518 H THR 69 HN THR 69 78.254 7.549 -8.449 519 HA THR 69 HA THR 69 79.986 8.835 -10.478 520 HB THR 69 HB THR 69 81.959 7.908 -9.416 521 HG1 THR 69 HG1 THR 69 81.514 6.173 -8.314 522 HG21 THR 69 HG21 THR 69 82.109 9.370 -7.571 523 HG22 THR 69 HG22 THR 69 80.397 9.209 -7.191 524 HG23 THR 69 HG23 THR 69 80.902 10.122 -8.612 525 H LEU 70 HN LEU 70 81.335 7.191 -11.620 526 HA LEU 70 HA LEU 70 79.730 5.123 -12.680 527 HB2 LEU 70 HB2 LEU 70 82.675 5.769 -12.812 528 HB3 LEU 70 HB1 LEU 70 82.062 4.272 -13.509 529 HG LEU 70 HG LEU 70 80.467 5.600 -14.883 530 HD11 LEU 70 HD11 LEU 70 80.918 8.064 -15.066 531 HD12 LEU 70 HD12 LEU 70 81.963 7.933 -13.649 532 HD13 LEU 70 HD13 LEU 70 80.236 7.592 -13.511 533 HD21 LEU 70 HD21 LEU 70 83.408 6.304 -15.094 534 HD22 LEU 70 HD22 LEU 70 82.230 6.594 -16.374 535 HD23 LEU 70 HD23 LEU 70 82.589 4.942 -15.862 536 H GLU 71 HN GLU 71 82.225 5.274 -10.214 537 HA GLU 71 HA GLU 71 82.422 2.481 -9.710 538 HB2 GLU 71 HB2 GLU 71 83.119 4.876 -7.992 539 HB3 GLU 71 HB1 GLU 71 83.520 3.214 -7.578 540 HG2 GLU 71 HG2 GLU 71 84.384 4.593 -10.133 541 HG3 GLU 71 HG1 GLU 71 85.402 4.414 -8.704 542 H ASP 72 HN ASP 72 80.370 5.042 -8.394 543 HA ASP 72 HA ASP 72 79.362 3.634 -6.172 544 HB2 ASP 72 HB2 ASP 72 78.182 5.831 -7.870 545 HB3 ASP 72 HB1 ASP 72 77.382 5.200 -6.433 546 H ALA 73 HN ALA 73 78.204 3.801 -9.539 547 HA ALA 73 HA ALA 73 75.835 2.339 -9.178 548 HB1 ALA 73 HB1 ALA 73 77.610 2.244 -11.626 549 HB2 ALA 73 HB2 ALA 73 76.502 3.565 -11.270 550 HB3 ALA 73 HB3 ALA 73 75.875 1.942 -11.550 551 H GLY 74 HN GLY 74 75.365 0.180 -9.163 552 HA2 GLY 74 HA2 GLY 74 76.947 -1.953 -9.915 553 HA3 GLY 74 HA1 GLY 74 77.434 -1.578 -8.265 554 H THR 75 HN THR 75 76.645 -3.487 -7.428 555 HA THR 75 HA THR 75 73.711 -3.910 -7.530 556 HB THR 75 HB THR 75 75.910 -5.848 -6.765 557 HG1 THR 75 HG1 THR 75 74.779 -6.617 -8.944 558 HG21 THR 75 HG21 THR 75 73.680 -6.317 -5.780 559 HG22 THR 75 HG22 THR 75 74.144 -7.530 -6.971 560 HG23 THR 75 HG23 THR 75 72.977 -6.279 -7.396 561 H VAL 76 HN VAL 76 72.579 -3.459 -5.721 562 HA VAL 76 HA VAL 76 74.039 -3.302 -3.136 563 HB VAL 76 HB VAL 76 71.346 -2.029 -3.569 564 HG11 VAL 76 HG11 VAL 76 72.462 -2.172 -1.322 565 HG12 VAL 76 HG12 VAL 76 72.127 -0.523 -1.849 566 HG13 VAL 76 HG13 VAL 76 73.762 -1.171 -1.963 567 HG21 VAL 76 HG21 VAL 76 74.014 -0.985 -4.528 568 HG22 VAL 76 HG22 VAL 76 72.633 0.069 -4.217 569 HG23 VAL 76 HG23 VAL 76 72.529 -1.180 -5.460 570 H SER 77 HN SER 77 73.460 -4.683 -1.562 571 HA SER 77 HA SER 77 70.789 -5.842 -1.501 572 HB2 SER 77 HB2 SER 77 72.073 -7.325 -3.033 573 HB3 SER 77 HB1 SER 77 73.225 -7.621 -1.736 574 HG SER 77 HG SER 77 71.761 -8.775 -0.682 575 H PHE 78 HN PHE 78 70.543 -7.293 0.411 576 HA PHE 78 HA PHE 78 72.446 -6.821 2.587 577 HB2 PHE 78 HB2 PHE 78 70.652 -5.997 4.072 578 HB3 PHE 78 HB1 PHE 78 70.944 -4.907 2.717 579 HD1 PHE 78 HD1 PHE 78 69.344 -4.746 0.849 580 HD2 PHE 78 HD2 PHE 78 68.604 -7.288 4.235 581 HE1 PHE 78 HE1 PHE 78 66.963 -4.948 0.177 582 HE2 PHE 78 HE2 PHE 78 66.225 -7.488 3.561 583 HZ PHE 78 HZ PHE 78 65.408 -6.318 1.535 584 H HIS 79 HN HIS 79 72.244 -8.328 4.302 585 HA HIS 79 HA HIS 79 70.398 -10.603 3.786 586 HB2 HIS 79 HB2 HIS 79 73.290 -10.746 4.674 587 HB3 HIS 79 HB1 HIS 79 72.199 -12.116 4.464 588 HD1 HIS 79 HD1 HIS 79 71.282 -12.491 1.961 589 HD2 HIS 79 HD2 HIS 79 74.514 -9.886 2.315 590 HE1 HIS 79 HE1 HIS 79 72.253 -12.241 -0.363 591 H VAL 80 HN VAL 80 69.441 -11.519 5.504 592 HA VAL 80 HA VAL 80 70.160 -10.599 8.224 593 HB VAL 80 HB VAL 80 67.296 -11.110 7.460 594 HG11 VAL 80 HG11 VAL 80 68.693 -9.451 9.585 595 HG12 VAL 80 HG12 VAL 80 67.774 -10.936 9.832 596 HG13 VAL 80 HG13 VAL 80 66.949 -9.461 9.327 597 HG21 VAL 80 HG21 VAL 80 67.230 -8.517 7.239 598 HG22 VAL 80 HG22 VAL 80 67.783 -9.465 5.862 599 HG23 VAL 80 HG23 VAL 80 68.954 -8.666 6.906 600 H GLY 81 HN GLY 81 70.309 -12.175 9.703 601 HA2 GLY 81 HA2 GLY 81 70.591 -14.830 9.058 602 HA3 GLY 81 HA1 GLY 81 70.206 -14.259 10.677 603 H THR 82 HN THR 82 67.671 -13.143 9.011 604 HA THR 82 HA THR 82 66.068 -15.591 9.494 605 HB THR 82 HB THR 82 64.186 -14.160 9.865 606 HG1 THR 82 HG1 THR 82 65.309 -12.586 8.223 607 HG21 THR 82 HG21 THR 82 66.597 -12.896 11.192 608 HG22 THR 82 HG22 THR 82 65.856 -14.409 11.709 609 HG23 THR 82 HG23 THR 82 64.941 -12.904 11.800 610 H CYS 83 HN CYS 83 66.504 -12.892 7.216 611 HA CYS 83 HA CYS 83 65.742 -14.629 5.009 612 HB2 CYS 83 HB2 CYS 83 63.592 -13.628 5.932 613 HB3 CYS 83 HB1 CYS 83 64.206 -12.062 5.409 614 HG CYS 83 HG CYS 83 64.096 -14.293 3.259 615 H SER 84 HN SER 84 66.293 -13.740 2.943 616 HA SER 84 HA SER 84 68.031 -11.340 3.045 617 HB2 SER 84 HB2 SER 84 68.610 -14.027 1.803 618 HB3 SER 84 HB1 SER 84 69.506 -12.565 1.399 619 HG SER 84 HG SER 84 69.717 -14.161 3.564 620 H SER 85 HN SER 85 68.344 -10.260 1.035 621 HA SER 85 HA SER 85 66.631 -10.927 -1.221 622 HB2 SER 85 HB2 SER 85 65.017 -9.744 0.070 623 HB3 SER 85 HB1 SER 85 66.182 -8.505 0.524 624 HG SER 85 HG SER 85 65.322 -9.060 -2.130 625 H GLU 86 HN GLU 86 67.070 -9.594 -3.106 626 HA GLU 86 HA GLU 86 69.599 -8.053 -2.948 627 HB2 GLU 86 HB2 GLU 86 68.776 -10.076 -5.031 628 HB3 GLU 86 HB1 GLU 86 70.105 -8.935 -5.245 629 HG2 GLU 86 HG2 GLU 86 71.219 -9.828 -3.256 630 HG3 GLU 86 HG1 GLU 86 69.880 -10.937 -2.981 631 H ALA 87 HN ALA 87 69.935 -6.535 -4.651 632 HA ALA 87 HA ALA 87 67.634 -5.674 -6.227 633 HB1 ALA 87 HB1 ALA 87 68.037 -3.283 -5.303 634 HB2 ALA 87 HB2 ALA 87 68.807 -4.097 -3.942 635 HB3 ALA 87 HB3 ALA 87 67.109 -4.409 -4.311 636 H GLN 88 HN GLN 88 68.246 -4.378 -8.006 637 HA GLN 88 HA GLN 88 71.181 -4.178 -8.447 638 HB2 GLN 88 HB2 GLN 88 68.935 -4.785 -10.369 639 HB3 GLN 88 HB1 GLN 88 70.574 -4.374 -10.886 640 HG2 GLN 88 HG2 GLN 88 71.473 -6.251 -9.585 641 HG3 GLN 88 HG1 GLN 88 69.851 -6.658 -9.028 642 HE21 GLN 88 HE21 GLN 88 69.313 -8.558 -10.111 643 HE22 GLN 88 HE22 GLN 88 69.477 -8.795 -11.781 644 H LEU 89 HN LEU 89 72.057 -2.371 -9.200 645 HA LEU 89 HA LEU 89 70.280 -0.054 -9.771 646 HB2 LEU 89 HB2 LEU 89 71.744 -0.046 -7.596 647 HB3 LEU 89 HB1 LEU 89 73.089 0.243 -8.697 648 HG LEU 89 HG LEU 89 70.569 1.927 -8.544 649 HD11 LEU 89 HD11 LEU 89 71.766 3.503 -7.291 650 HD12 LEU 89 HD12 LEU 89 73.331 2.856 -7.775 651 HD13 LEU 89 HD13 LEU 89 72.343 1.984 -6.607 652 HD21 LEU 89 HD21 LEU 89 71.364 2.160 -10.752 653 HD22 LEU 89 HD22 LEU 89 73.054 2.033 -10.257 654 HD23 LEU 89 HD23 LEU 89 72.140 3.500 -9.912 655 H LYS 90 HN LYS 90 70.307 0.097 -11.926 656 HA LYS 90 HA LYS 90 72.892 -0.171 -13.357 657 HB2 LYS 90 HB2 LYS 90 71.540 -0.623 -15.367 658 HB3 LYS 90 HB1 LYS 90 71.204 -1.790 -14.089 659 HG2 LYS 90 HG2 LYS 90 69.193 -0.493 -13.445 660 HG3 LYS 90 HG1 LYS 90 69.518 0.645 -14.754 661 HD2 LYS 90 HD2 LYS 90 69.330 -1.187 -16.401 662 HD3 LYS 90 HD1 LYS 90 69.008 -2.328 -15.090 663 HE2 LYS 90 HE2 LYS 90 66.977 -1.077 -14.487 664 HE3 LYS 90 HE1 LYS 90 67.300 0.086 -15.771 665 HZ1 LYS 90 HZ1 LYS 90 67.142 -1.710 -17.384 666 HZ2 LYS 90 HZ2 LYS 90 65.708 -1.573 -16.487 667 HZ3 LYS 90 HZ3 LYS 90 66.810 -2.820 -16.146 668 H VAL 91 HN VAL 91 73.223 1.245 -15.181 669 HA VAL 91 HA VAL 91 72.086 3.945 -14.715 670 HB VAL 91 HB VAL 91 74.164 4.794 -15.694 671 HG11 VAL 91 HG11 VAL 91 74.240 4.465 -13.311 672 HG12 VAL 91 HG12 VAL 91 75.765 3.855 -13.950 673 HG13 VAL 91 HG13 VAL 91 74.485 2.728 -13.499 674 HG21 VAL 91 HG21 VAL 91 74.770 3.148 -17.299 675 HG22 VAL 91 HG22 VAL 91 74.701 1.846 -16.114 676 HG23 VAL 91 HG23 VAL 91 76.015 3.019 -16.057 677 H THR 92 HN THR 92 70.958 4.883 -16.313 678 HA THR 92 HA THR 92 70.878 3.553 -18.968 679 HB THR 92 HB THR 92 68.774 5.214 -17.558 680 HG1 THR 92 HG1 THR 92 67.727 3.032 -17.843 681 HG21 THR 92 HG21 THR 92 68.896 3.910 -20.277 682 HG22 THR 92 HG22 THR 92 68.498 5.583 -19.887 683 HG23 THR 92 HG23 THR 92 67.362 4.290 -19.493 684 H ALA 93 HN ALA 93 71.600 4.682 -20.661 685 HA ALA 93 HA ALA 93 72.491 7.418 -20.291 686 HB1 ALA 93 HB1 ALA 93 73.397 7.181 -22.563 687 HB2 ALA 93 HB2 ALA 93 72.575 5.631 -22.735 688 HB3 ALA 93 HB3 ALA 93 73.868 5.817 -21.552 689 H GLY 94 HN GLY 94 70.822 6.101 -23.145 690 HA2 GLY 94 HA2 GLY 94 68.559 7.880 -22.839 691 HA3 GLY 94 HA1 GLY 94 69.685 8.371 -24.098 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 55.079 -16.051 7.115 2 H2 MET 1 HT2 MET 1 54.680 -15.378 5.608 3 H3 MET 1 HT3 MET 1 53.572 -15.309 6.893 4 HA MET 1 HA MET 1 56.153 -13.866 6.662 5 HB2 MET 1 HB2 MET 1 53.252 -13.005 6.835 6 HB3 MET 1 HB1 MET 1 54.616 -11.896 6.959 7 HG2 MET 1 HG2 MET 1 55.353 -12.424 4.729 8 HG3 MET 1 HG1 MET 1 54.213 -13.765 4.610 9 HE1 MET 1 HE1 MET 1 53.341 -9.268 4.558 10 HE2 MET 1 HE2 MET 1 54.720 -9.983 3.730 11 HE3 MET 1 HE3 MET 1 54.588 -10.114 5.481 12 H ALA 2 HN ALA 2 56.886 -15.036 8.595 13 HA ALA 2 HA ALA 2 55.538 -14.989 11.065 14 HB1 ALA 2 HB1 ALA 2 57.346 -16.477 10.977 15 HB2 ALA 2 HB2 ALA 2 58.006 -15.162 11.947 16 HB3 ALA 2 HB3 ALA 2 58.414 -15.286 10.237 17 HA PRO 3 HA PRO 3 55.686 -10.809 12.461 18 HB2 PRO 3 HB2 PRO 3 57.044 -11.279 14.976 19 HB3 PRO 3 HB1 PRO 3 55.313 -11.026 14.705 20 HG2 PRO 3 HG2 PRO 3 56.775 -13.526 15.150 21 HG3 PRO 3 HG1 PRO 3 55.045 -13.193 15.311 22 HD2 PRO 3 HD2 PRO 3 56.129 -14.720 13.285 23 HD3 PRO 3 HD1 PRO 3 54.591 -13.843 13.134 24 H GLU 4 HN GLU 4 58.600 -12.071 14.054 25 HA GLU 4 HA GLU 4 60.770 -11.246 14.040 26 HB2 GLU 4 HB2 GLU 4 60.198 -11.548 11.080 27 HB3 GLU 4 HB1 GLU 4 61.804 -11.402 11.785 28 HG2 GLU 4 HG2 GLU 4 59.832 -13.590 12.483 29 HG3 GLU 4 HG1 GLU 4 61.130 -13.764 11.305 30 H VAL 5 HN VAL 5 62.176 -9.697 12.244 31 HA VAL 5 HA VAL 5 61.468 -7.045 12.918 32 HB VAL 5 HB VAL 5 63.724 -7.277 12.322 33 HG11 VAL 5 HG11 VAL 5 62.664 -9.129 10.198 34 HG12 VAL 5 HG12 VAL 5 63.911 -9.418 11.411 35 HG13 VAL 5 HG13 VAL 5 64.271 -8.423 10.002 36 HG21 VAL 5 HG21 VAL 5 62.719 -6.499 9.580 37 HG22 VAL 5 HG22 VAL 5 64.112 -5.873 10.465 38 HG23 VAL 5 HG23 VAL 5 62.483 -5.429 10.960 39 H THR 6 HN THR 6 60.629 -5.349 11.366 40 HA THR 6 HA THR 6 58.518 -6.577 9.707 41 HB THR 6 HB THR 6 59.108 -3.648 10.214 42 HG1 THR 6 HG1 THR 6 57.809 -5.583 11.594 43 HG21 THR 6 HG21 THR 6 56.799 -3.354 9.295 44 HG22 THR 6 HG22 THR 6 56.819 -5.055 8.831 45 HG23 THR 6 HG23 THR 6 57.960 -3.926 8.101 46 H ILE 7 HN ILE 7 59.818 -7.564 8.136 47 HA ILE 7 HA ILE 7 61.625 -5.953 6.560 48 HB ILE 7 HB ILE 7 62.064 -8.282 7.211 49 HG12 ILE 7 HG12 ILE 7 62.026 -8.182 4.201 50 HG13 ILE 7 HG11 ILE 7 63.014 -7.033 5.097 51 HG21 ILE 7 HG21 ILE 7 59.559 -8.915 6.537 52 HG22 ILE 7 HG22 ILE 7 60.855 -10.104 6.437 53 HG23 ILE 7 HG23 ILE 7 60.317 -9.272 4.984 54 HD11 ILE 7 HD11 ILE 7 64.035 -9.353 4.368 55 HD12 ILE 7 HD12 ILE 7 63.199 -9.948 5.802 56 HD13 ILE 7 HD13 ILE 7 64.412 -8.674 5.952 57 H LEU 8 HN LEU 8 60.454 -4.457 5.624 58 HA LEU 8 HA LEU 8 58.746 -5.259 3.334 59 HB2 LEU 8 HB2 LEU 8 58.381 -2.861 5.160 60 HB3 LEU 8 HB1 LEU 8 57.472 -3.145 3.678 61 HG LEU 8 HG LEU 8 57.515 -5.009 6.074 62 HD11 LEU 8 HD11 LEU 8 55.363 -4.172 6.643 63 HD12 LEU 8 HD12 LEU 8 55.208 -3.309 5.113 64 HD13 LEU 8 HD13 LEU 8 56.344 -2.739 6.337 65 HD21 LEU 8 HD21 LEU 8 56.987 -6.411 4.289 66 HD22 LEU 8 HD22 LEU 8 56.248 -5.118 3.343 67 HD23 LEU 8 HD23 LEU 8 55.381 -5.824 4.706 68 H GLU 9 HN GLU 9 60.701 -5.183 2.094 69 HA GLU 9 HA GLU 9 61.693 -2.433 1.542 70 HB2 GLU 9 HB2 GLU 9 63.831 -3.544 0.875 71 HB3 GLU 9 HB1 GLU 9 63.452 -3.670 2.591 72 HG2 GLU 9 HG2 GLU 9 62.275 -5.965 1.721 73 HG3 GLU 9 HG1 GLU 9 63.522 -5.808 0.494 74 HA PRO 10 HA PRO 10 59.909 -4.115 -2.361 75 HB2 PRO 10 HB2 PRO 10 58.917 -1.460 -2.979 76 HB3 PRO 10 HB1 PRO 10 57.985 -2.914 -2.591 77 HG2 PRO 10 HG2 PRO 10 58.228 -0.658 -0.966 78 HG3 PRO 10 HG1 PRO 10 57.652 -2.251 -0.451 79 HD2 PRO 10 HD2 PRO 10 60.303 -0.975 0.009 80 HD3 PRO 10 HD1 PRO 10 59.457 -2.205 0.973 81 H LEU 11 HN LEU 11 62.547 -2.654 -1.582 82 HA LEU 11 HA LEU 11 63.269 -0.983 -3.766 83 HB2 LEU 11 HB2 LEU 11 65.051 -2.663 -1.986 84 HB3 LEU 11 HB1 LEU 11 65.562 -1.300 -2.978 85 HG LEU 11 HG LEU 11 63.546 -1.139 -0.715 86 HD11 LEU 11 HD11 LEU 11 66.495 -0.496 -0.892 87 HD12 LEU 11 HD12 LEU 11 65.675 -1.546 0.266 88 HD13 LEU 11 HD13 LEU 11 65.451 0.203 0.348 89 HD21 LEU 11 HD21 LEU 11 64.661 0.844 -2.696 90 HD22 LEU 11 HD22 LEU 11 64.237 1.401 -1.076 91 HD23 LEU 11 HD23 LEU 11 63.007 0.666 -2.106 92 H GLN 12 HN GLN 12 62.362 -2.357 -5.539 93 HA GLN 12 HA GLN 12 63.579 -4.873 -6.164 94 HB2 GLN 12 HB2 GLN 12 61.318 -4.168 -6.965 95 HB3 GLN 12 HB1 GLN 12 62.100 -2.978 -8.006 96 HG2 GLN 12 HG2 GLN 12 63.366 -4.823 -9.112 97 HG3 GLN 12 HG1 GLN 12 62.491 -5.984 -8.117 98 HE21 GLN 12 HE21 GLN 12 61.093 -6.979 -9.628 99 HE22 GLN 12 HE22 GLN 12 60.009 -6.122 -10.614 100 H ASP 13 HN ASP 13 63.654 -1.880 -8.092 101 HA ASP 13 HA ASP 13 66.460 -1.611 -8.198 102 HB2 ASP 13 HB2 ASP 13 66.802 -2.357 -10.567 103 HB3 ASP 13 HB1 ASP 13 66.504 -3.677 -9.437 104 H VAL 14 HN VAL 14 67.117 0.132 -9.529 105 HA VAL 14 HA VAL 14 64.958 1.654 -10.866 106 HB VAL 14 HB VAL 14 65.983 3.729 -9.838 107 HG11 VAL 14 HG11 VAL 14 63.860 2.638 -9.045 108 HG12 VAL 14 HG12 VAL 14 64.731 3.483 -7.765 109 HG13 VAL 14 HG13 VAL 14 64.815 1.724 -7.878 110 HG21 VAL 14 HG21 VAL 14 67.265 1.631 -8.049 111 HG22 VAL 14 HG22 VAL 14 67.294 3.369 -7.759 112 HG23 VAL 14 HG23 VAL 14 68.127 2.695 -9.160 113 H GLN 15 HN GLN 15 65.764 3.335 -12.316 114 HA GLN 15 HA GLN 15 68.519 2.890 -13.305 115 HB2 GLN 15 HB2 GLN 15 67.538 3.166 -15.642 116 HB3 GLN 15 HB1 GLN 15 67.207 1.631 -14.840 117 HG2 GLN 15 HG2 GLN 15 64.993 2.445 -14.155 118 HG3 GLN 15 HG1 GLN 15 65.324 4.007 -14.903 119 HE21 GLN 15 HE21 GLN 15 63.561 3.740 -16.466 120 HE22 GLN 15 HE22 GLN 15 63.690 2.635 -17.747 121 H LEU 16 HN LEU 16 69.576 4.703 -13.961 122 HA LEU 16 HA LEU 16 68.146 7.179 -14.464 123 HB2 LEU 16 HB2 LEU 16 69.335 8.431 -12.703 124 HB3 LEU 16 HB1 LEU 16 68.214 7.247 -12.047 125 HG LEU 16 HG LEU 16 71.012 6.261 -12.486 126 HD11 LEU 16 HD11 LEU 16 71.616 7.265 -10.180 127 HD12 LEU 16 HD12 LEU 16 70.320 8.420 -10.497 128 HD13 LEU 16 HD13 LEU 16 71.705 8.327 -11.585 129 HD21 LEU 16 HD21 LEU 16 69.017 6.048 -10.207 130 HD22 LEU 16 HD22 LEU 16 70.559 5.194 -10.292 131 HD23 LEU 16 HD23 LEU 16 69.289 4.842 -11.466 132 H SER 17 HN SER 17 69.430 8.802 -15.386 133 HA SER 17 HA SER 17 71.756 7.815 -16.794 134 HB2 SER 17 HB2 SER 17 71.507 9.681 -18.160 135 HB3 SER 17 HB1 SER 17 69.855 9.451 -17.594 136 HG SER 17 HG SER 17 71.087 11.622 -17.406 137 H GLU 18 HN GLU 18 73.738 9.262 -16.918 138 HA GLU 18 HA GLU 18 74.898 9.493 -14.342 139 HB2 GLU 18 HB2 GLU 18 76.166 9.105 -16.475 140 HB3 GLU 18 HB1 GLU 18 75.872 10.793 -16.896 141 HG2 GLU 18 HG2 GLU 18 77.006 11.520 -14.834 142 HG3 GLU 18 HG1 GLU 18 77.279 9.837 -14.387 143 H GLY 19 HN GLY 19 75.286 11.251 -13.037 144 HA2 GLY 19 HA2 GLY 19 75.264 13.461 -12.307 145 HA3 GLY 19 HA1 GLY 19 74.670 13.952 -13.889 146 H GLN 20 HN GLN 20 72.837 11.403 -12.695 147 HA GLN 20 HA GLN 20 70.640 13.230 -11.992 148 HB2 GLN 20 HB2 GLN 20 70.718 10.274 -12.617 149 HB3 GLN 20 HB1 GLN 20 69.254 11.153 -12.185 150 HG2 GLN 20 HG2 GLN 20 71.051 11.894 -14.514 151 HG3 GLN 20 HG1 GLN 20 69.588 10.922 -14.672 152 HE21 GLN 20 HE21 GLN 20 70.684 14.078 -14.932 153 HE22 GLN 20 HE22 GLN 20 69.224 14.894 -14.639 154 H ASP 21 HN ASP 21 69.306 12.739 -10.126 155 HA ASP 21 HA ASP 21 70.936 12.005 -7.822 156 HB2 ASP 21 HB2 ASP 21 68.158 13.153 -8.123 157 HB3 ASP 21 HB1 ASP 21 68.822 12.665 -6.566 158 H ALA 22 HN ALA 22 69.881 10.618 -6.117 159 HA ALA 22 HA ALA 22 67.956 8.657 -6.969 160 HB1 ALA 22 HB1 ALA 22 70.635 7.470 -6.299 161 HB2 ALA 22 HB2 ALA 22 70.321 8.012 -7.946 162 HB3 ALA 22 HB3 ALA 22 69.301 6.771 -7.218 163 H SER 23 HN SER 23 67.380 7.194 -5.214 164 HA SER 23 HA SER 23 68.571 7.504 -2.610 165 HB2 SER 23 HB2 SER 23 65.886 8.787 -3.164 166 HB3 SER 23 HB1 SER 23 66.506 8.452 -1.550 167 HG SER 23 HG SER 23 68.414 9.692 -2.300 168 H PHE 24 HN PHE 24 67.482 6.132 -0.990 169 HA PHE 24 HA PHE 24 65.661 4.110 -2.192 170 HB2 PHE 24 HB2 PHE 24 67.945 3.553 -0.296 171 HB3 PHE 24 HB1 PHE 24 66.789 2.374 -0.893 172 HD1 PHE 24 HD1 PHE 24 69.941 3.927 -1.477 173 HD2 PHE 24 HD2 PHE 24 66.584 2.143 -3.483 174 HE1 PHE 24 HE1 PHE 24 71.354 3.504 -3.471 175 HE2 PHE 24 HE2 PHE 24 67.999 1.727 -5.477 176 HZ PHE 24 HZ PHE 24 70.380 2.399 -5.465 177 H GLN 25 HN GLN 25 64.149 3.217 -0.847 178 HA GLN 25 HA GLN 25 63.817 4.455 1.833 179 HB2 GLN 25 HB2 GLN 25 61.557 3.628 0.008 180 HB3 GLN 25 HB1 GLN 25 61.482 4.651 1.443 181 HG2 GLN 25 HG2 GLN 25 62.802 5.327 -1.201 182 HG3 GLN 25 HG1 GLN 25 61.349 6.064 -0.533 183 HE21 GLN 25 HE21 GLN 25 64.312 7.026 -1.124 184 HE22 GLN 25 HE22 GLN 25 64.692 7.899 0.281 185 H CYS 26 HN CYS 26 63.746 2.996 3.436 186 HA CYS 26 HA CYS 26 62.711 0.284 2.890 187 HB2 CYS 26 HB2 CYS 26 65.299 0.426 2.848 188 HB3 CYS 26 HB1 CYS 26 65.167 0.660 4.592 189 HG CYS 26 HG CYS 26 63.593 -1.663 4.374 190 H ARG 27 HN ARG 27 61.735 -0.716 4.593 191 HA ARG 27 HA ARG 27 61.379 0.880 7.074 192 HB2 ARG 27 HB2 ARG 27 59.328 -0.734 5.535 193 HB3 ARG 27 HB1 ARG 27 59.049 0.061 7.084 194 HG2 ARG 27 HG2 ARG 27 59.507 2.242 6.102 195 HG3 ARG 27 HG1 ARG 27 59.942 1.491 4.566 196 HD2 ARG 27 HD2 ARG 27 57.649 2.337 4.453 197 HD3 ARG 27 HD1 ARG 27 57.644 0.575 4.382 198 HE ARG 27 HE ARG 27 57.387 1.455 7.072 199 HH11 ARG 27 HH11 ARG 27 55.297 1.945 7.909 200 HH12 ARG 27 HH12 ARG 27 53.906 1.507 6.975 201 HH21 ARG 27 HH21 ARG 27 55.751 0.539 4.199 202 HH22 ARG 27 HH22 ARG 27 54.164 0.702 4.873 203 H LEU 28 HN LEU 28 62.717 -0.316 8.442 204 HA LEU 28 HA LEU 28 62.060 -3.203 8.699 205 HB2 LEU 28 HB2 LEU 28 64.724 -1.859 9.171 206 HB3 LEU 28 HB1 LEU 28 64.373 -3.562 9.458 207 HG LEU 28 HG LEU 28 64.188 -2.153 6.775 208 HD11 LEU 28 HD11 LEU 28 66.232 -4.000 8.014 209 HD12 LEU 28 HD12 LEU 28 66.492 -2.410 7.294 210 HD13 LEU 28 HD13 LEU 28 66.098 -3.792 6.268 211 HD21 LEU 28 HD21 LEU 28 62.645 -3.878 6.551 212 HD22 LEU 28 HD22 LEU 28 63.458 -4.913 7.729 213 HD23 LEU 28 HD23 LEU 28 64.119 -4.733 6.104 214 H SER 29 HN SER 29 60.828 -3.461 10.467 215 HA SER 29 HA SER 29 60.984 -1.666 12.699 216 HB2 SER 29 HB2 SER 29 58.881 -2.826 12.326 217 HB3 SER 29 HB1 SER 29 59.678 -4.387 12.496 218 HG SER 29 HG SER 29 60.017 -3.976 14.624 219 H ARG 30 HN ARG 30 61.333 -2.695 14.954 220 HA ARG 30 HA ARG 30 64.010 -3.137 15.297 221 HB2 ARG 30 HB2 ARG 30 63.434 -3.977 17.545 222 HB3 ARG 30 HB1 ARG 30 62.545 -2.518 17.112 223 HG2 ARG 30 HG2 ARG 30 60.572 -3.802 16.559 224 HG3 ARG 30 HG1 ARG 30 61.438 -5.322 16.788 225 HD2 ARG 30 HD2 ARG 30 60.124 -4.841 18.778 226 HD3 ARG 30 HD1 ARG 30 61.837 -4.699 19.159 227 HE ARG 30 HE ARG 30 61.573 -2.365 19.369 228 HH11 ARG 30 HH11 ARG 30 58.881 -3.694 17.722 229 HH12 ARG 30 HH12 ARG 30 57.769 -2.459 18.211 230 HH21 ARG 30 HH21 ARG 30 60.071 -0.841 20.246 231 HH22 ARG 30 HH22 ARG 30 58.442 -0.845 19.657 232 H ALA 31 HN ALA 31 65.296 -4.820 15.824 233 HA ALA 31 HA ALA 31 65.094 -7.114 14.219 234 HB1 ALA 31 HB1 ALA 31 67.251 -6.280 14.802 235 HB2 ALA 31 HB2 ALA 31 67.097 -7.864 15.563 236 HB3 ALA 31 HB3 ALA 31 66.901 -6.400 16.527 237 H SER 32 HN SER 32 65.183 -9.314 14.888 238 HA SER 32 HA SER 32 63.881 -9.982 17.448 239 HB2 SER 32 HB2 SER 32 62.934 -10.721 14.683 240 HB3 SER 32 HB1 SER 32 62.534 -11.707 16.088 241 HG SER 32 HG SER 32 60.939 -10.295 16.156 242 H GLY 33 HN GLY 33 64.488 -11.978 14.598 243 HA2 GLY 33 HA2 GLY 33 65.951 -13.925 16.065 244 HA3 GLY 33 HA1 GLY 33 65.841 -13.824 14.306 245 H GLN 34 HN GLN 34 67.294 -12.460 13.169 246 HA GLN 34 HA GLN 34 69.688 -11.624 14.701 247 HB2 GLN 34 HB2 GLN 34 69.575 -12.967 11.994 248 HB3 GLN 34 HB1 GLN 34 71.021 -12.215 12.669 249 HG2 GLN 34 HG2 GLN 34 70.879 -13.700 14.631 250 HG3 GLN 34 HG1 GLN 34 69.441 -14.458 13.953 251 HE21 GLN 34 HE21 GLN 34 72.220 -15.586 14.521 252 HE22 GLN 34 HE22 GLN 34 72.703 -16.274 13.046 253 H GLU 35 HN GLU 35 70.855 -9.887 13.829 254 HA GLU 35 HA GLU 35 69.199 -7.768 12.867 255 HB2 GLU 35 HB2 GLU 35 71.077 -7.451 14.446 256 HB3 GLU 35 HB1 GLU 35 72.202 -7.919 13.170 257 HG2 GLU 35 HG2 GLU 35 71.566 -6.026 11.814 258 HG3 GLU 35 HG1 GLU 35 70.261 -5.609 12.926 259 H ALA 36 HN ALA 36 69.464 -6.562 10.923 260 HA ALA 36 HA ALA 36 70.204 -8.220 8.627 261 HB1 ALA 36 HB1 ALA 36 69.090 -6.578 7.292 262 HB2 ALA 36 HB2 ALA 36 69.095 -5.407 8.611 263 HB3 ALA 36 HB3 ALA 36 68.080 -6.845 8.711 264 H ARG 37 HN ARG 37 71.828 -7.733 7.183 265 HA ARG 37 HA ARG 37 73.810 -5.710 8.070 266 HB2 ARG 37 HB2 ARG 37 74.098 -8.269 6.492 267 HB3 ARG 37 HB1 ARG 37 75.382 -7.063 6.597 268 HG2 ARG 37 HG2 ARG 37 75.434 -7.275 9.026 269 HG3 ARG 37 HG1 ARG 37 74.072 -8.397 8.988 270 HD2 ARG 37 HD2 ARG 37 75.422 -9.963 7.624 271 HD3 ARG 37 HD1 ARG 37 76.782 -8.848 7.705 272 HE ARG 37 HE ARG 37 76.008 -9.388 10.336 273 HH11 ARG 37 HH11 ARG 37 77.137 -11.076 7.541 274 HH12 ARG 37 HH12 ARG 37 78.019 -12.265 8.439 275 HH21 ARG 37 HH21 ARG 37 77.184 -10.934 11.531 276 HH22 ARG 37 HH22 ARG 37 78.045 -12.186 10.698 277 H TRP 38 HN TRP 38 74.559 -4.199 6.676 278 HA TRP 38 HA TRP 38 73.215 -3.984 4.040 279 HB2 TRP 38 HB2 TRP 38 72.984 -2.196 6.010 280 HB3 TRP 38 HB1 TRP 38 74.538 -1.645 5.396 281 HD1 TRP 38 HD1 TRP 38 74.614 -0.612 2.974 282 HE1 TRP 38 HE1 TRP 38 72.781 0.343 1.435 283 HE3 TRP 38 HE3 TRP 38 70.463 -2.485 5.280 284 HZ2 TRP 38 HZ2 TRP 38 69.934 0.316 1.211 285 HZ3 TRP 38 HZ3 TRP 38 68.201 -2.005 4.385 286 HH2 TRP 38 HH2 TRP 38 67.931 -0.606 2.352 287 H ALA 39 HN ALA 39 74.531 -3.766 2.207 288 HA ALA 39 HA ALA 39 77.325 -3.116 2.472 289 HB1 ALA 39 HB1 ALA 39 77.297 -5.453 3.302 290 HB2 ALA 39 HB2 ALA 39 78.245 -5.263 1.827 291 HB3 ALA 39 HB3 ALA 39 76.628 -5.969 1.755 292 H LEU 40 HN LEU 40 78.444 -3.022 0.494 293 HA LEU 40 HA LEU 40 76.779 -3.194 -1.945 294 HB2 LEU 40 HB2 LEU 40 76.971 -0.838 -1.087 295 HB3 LEU 40 HB1 LEU 40 78.712 -0.954 -1.307 296 HG LEU 40 HG LEU 40 76.748 -1.492 -3.552 297 HD11 LEU 40 HD11 LEU 40 76.360 0.786 -2.773 298 HD12 LEU 40 HD12 LEU 40 77.231 0.835 -4.305 299 HD13 LEU 40 HD13 LEU 40 78.092 1.117 -2.793 300 HD21 LEU 40 HD21 LEU 40 79.734 -1.213 -3.330 301 HD22 LEU 40 HD22 LEU 40 78.963 -0.595 -4.787 302 HD23 LEU 40 HD23 LEU 40 78.778 -2.282 -4.351 303 H GLY 41 HN GLY 41 77.704 -4.449 -3.423 304 HA2 GLY 41 HA2 GLY 41 79.376 -5.259 -4.829 305 HA3 GLY 41 HA1 GLY 41 80.562 -4.343 -3.908 306 H GLY 42 HN GLY 42 78.642 -6.079 -1.798 307 HA2 GLY 42 HA2 GLY 42 78.791 -8.352 -1.046 308 HA3 GLY 42 HA1 GLY 42 80.348 -8.498 -1.855 309 H VAL 43 HN VAL 43 80.961 -5.709 -0.741 310 HA VAL 43 HA VAL 43 81.872 -6.610 1.931 311 HB VAL 43 HB VAL 43 83.558 -4.738 1.627 312 HG11 VAL 43 HG11 VAL 43 84.917 -6.031 -0.033 313 HG12 VAL 43 HG12 VAL 43 83.493 -7.012 -0.376 314 HG13 VAL 43 HG13 VAL 43 84.218 -7.043 1.232 315 HG21 VAL 43 HG21 VAL 43 83.839 -3.801 -0.582 316 HG22 VAL 43 HG22 VAL 43 82.151 -3.575 -0.125 317 HG23 VAL 43 HG23 VAL 43 82.596 -4.862 -1.244 318 HA PRO 44 HA PRO 44 79.279 -3.551 3.826 319 HB2 PRO 44 HB2 PRO 44 81.282 -2.507 5.651 320 HB3 PRO 44 HB1 PRO 44 79.947 -3.610 6.005 321 HG2 PRO 44 HG2 PRO 44 82.750 -4.218 5.792 322 HG3 PRO 44 HG1 PRO 44 81.421 -5.299 6.229 323 HD2 PRO 44 HD2 PRO 44 82.916 -5.313 3.791 324 HD3 PRO 44 HD1 PRO 44 81.485 -6.290 4.180 325 H LEU 45 HN LEU 45 78.787 -1.418 3.480 326 HA LEU 45 HA LEU 45 80.690 0.155 1.896 327 HB2 LEU 45 HB2 LEU 45 78.861 1.369 1.080 328 HB3 LEU 45 HB1 LEU 45 78.240 -0.269 1.231 329 HG LEU 45 HG LEU 45 77.768 2.039 3.147 330 HD11 LEU 45 HD11 LEU 45 75.412 1.646 2.480 331 HD12 LEU 45 HD12 LEU 45 75.952 0.391 1.367 332 HD13 LEU 45 HD13 LEU 45 76.421 2.068 1.095 333 HD21 LEU 45 HD21 LEU 45 76.983 -0.890 3.324 334 HD22 LEU 45 HD22 LEU 45 76.288 0.378 4.330 335 HD23 LEU 45 HD23 LEU 45 78.003 -0.005 4.460 336 H GLN 46 HN GLN 46 80.011 2.701 2.321 337 HA GLN 46 HA GLN 46 80.237 3.270 5.202 338 HB2 GLN 46 HB2 GLN 46 82.547 2.975 4.196 339 HB3 GLN 46 HB1 GLN 46 82.199 4.364 3.171 340 HG2 GLN 46 HG2 GLN 46 83.431 5.133 5.110 341 HG3 GLN 46 HG1 GLN 46 81.778 5.715 5.249 342 HE21 GLN 46 HE21 GLN 46 81.676 5.757 7.571 343 HE22 GLN 46 HE22 GLN 46 81.793 4.352 8.515 344 H ALA 47 HN ALA 47 79.808 5.475 5.721 345 HA ALA 47 HA ALA 47 77.833 6.670 4.009 346 HB1 ALA 47 HB1 ALA 47 79.123 7.805 6.502 347 HB2 ALA 47 HB2 ALA 47 77.735 6.718 6.509 348 HB3 ALA 47 HB3 ALA 47 77.599 8.315 5.772 349 H ASN 48 HN ASN 48 79.658 6.674 2.282 350 HA ASN 48 HA ASN 48 81.679 8.657 2.366 351 HB2 ASN 48 HB2 ASN 48 81.551 6.680 0.785 352 HB3 ASN 48 HB1 ASN 48 80.333 7.578 -0.116 353 HD21 ASN 48 HD21 ASN 48 83.747 7.770 0.988 354 HD22 ASN 48 HD22 ASN 48 84.243 8.819 -0.249 355 H GLU 49 HN GLU 49 81.650 10.411 0.539 356 HA GLU 49 HA GLU 49 79.665 12.304 1.269 357 HB2 GLU 49 HB2 GLU 49 81.641 12.267 -1.023 358 HB3 GLU 49 HB1 GLU 49 80.636 13.653 -0.600 359 HG2 GLU 49 HG2 GLU 49 81.633 13.727 1.640 360 HG3 GLU 49 HG1 GLU 49 82.596 12.296 1.273 361 H MET 50 HN MET 50 80.108 10.175 -1.512 362 HA MET 50 HA MET 50 77.922 11.175 -3.028 363 HB2 MET 50 HB2 MET 50 79.371 8.532 -3.083 364 HB3 MET 50 HB1 MET 50 78.125 8.984 -4.245 365 HG2 MET 50 HG2 MET 50 79.440 10.994 -4.856 366 HG3 MET 50 HG1 MET 50 80.700 10.498 -3.729 367 HE1 MET 50 HE1 MET 50 81.161 7.424 -4.015 368 HE2 MET 50 HE2 MET 50 82.275 8.785 -3.933 369 HE3 MET 50 HE3 MET 50 82.453 7.583 -5.208 370 H ASN 51 HN ASN 51 78.225 8.565 -0.645 371 HA ASN 51 HA ASN 51 75.261 8.352 -0.604 372 HB2 ASN 51 HB2 ASN 51 76.422 6.374 -1.659 373 HB3 ASN 51 HB1 ASN 51 77.152 6.054 -0.087 374 HD21 ASN 51 HD21 ASN 51 75.839 3.969 -0.181 375 HD22 ASN 51 HD22 ASN 51 74.206 4.028 0.280 376 H ASP 52 HN ASP 52 74.310 8.574 1.293 377 HA ASP 52 HA ASP 52 75.985 8.597 3.740 378 HB2 ASP 52 HB2 ASP 52 73.645 10.342 2.960 379 HB3 ASP 52 HB1 ASP 52 74.291 10.255 4.596 380 H ILE 53 HN ILE 53 75.237 7.551 5.494 381 HA ILE 53 HA ILE 53 72.742 5.981 5.191 382 HB ILE 53 HB ILE 53 74.965 5.369 7.140 383 HG12 ILE 53 HG12 ILE 53 76.026 5.480 4.933 384 HG13 ILE 53 HG11 ILE 53 75.885 3.804 5.452 385 HG21 ILE 53 HG21 ILE 53 74.048 3.069 6.854 386 HG22 ILE 53 HG22 ILE 53 72.810 3.727 5.785 387 HG23 ILE 53 HG23 ILE 53 72.858 4.209 7.482 388 HD11 ILE 53 HD11 ILE 53 74.167 5.251 3.430 389 HD12 ILE 53 HD12 ILE 53 73.729 3.687 4.098 390 HD13 ILE 53 HD13 ILE 53 75.208 3.862 3.162 391 H THR 54 HN THR 54 71.094 6.471 6.563 392 HA THR 54 HA THR 54 71.726 7.603 9.200 393 HB THR 54 HB THR 54 71.459 9.601 7.860 394 HG1 THR 54 HG1 THR 54 70.349 9.269 9.971 395 HG21 THR 54 HG21 THR 54 70.262 9.057 5.932 396 HG22 THR 54 HG22 THR 54 69.031 9.898 6.872 397 HG23 THR 54 HG23 THR 54 69.046 8.137 6.815 398 H VAL 55 HN VAL 55 69.988 7.559 10.680 399 HA VAL 55 HA VAL 55 67.881 5.574 10.026 400 HB VAL 55 HB VAL 55 67.914 5.080 12.481 401 HG11 VAL 55 HG11 VAL 55 70.165 3.910 12.413 402 HG12 VAL 55 HG12 VAL 55 70.464 4.728 10.879 403 HG13 VAL 55 HG13 VAL 55 69.126 3.587 11.024 404 HG21 VAL 55 HG21 VAL 55 69.953 5.853 13.726 405 HG22 VAL 55 HG22 VAL 55 68.863 7.170 13.300 406 HG23 VAL 55 HG23 VAL 55 70.336 6.907 12.366 407 H GLU 56 HN GLU 56 65.799 6.172 10.326 408 HA GLU 56 HA GLU 56 65.271 8.791 11.629 409 HB2 GLU 56 HB2 GLU 56 63.916 7.469 9.273 410 HB3 GLU 56 HB1 GLU 56 63.243 8.858 10.127 411 HG2 GLU 56 HG2 GLU 56 65.229 10.182 9.616 412 HG3 GLU 56 HG1 GLU 56 65.999 8.790 8.860 413 H GLN 57 HN GLN 57 62.716 8.836 12.049 414 HA GLN 57 HA GLN 57 62.293 7.128 14.256 415 HB2 GLN 57 HB2 GLN 57 61.302 9.481 13.637 416 HB3 GLN 57 HB1 GLN 57 60.036 8.541 12.856 417 HG2 GLN 57 HG2 GLN 57 60.870 8.150 15.748 418 HG3 GLN 57 HG1 GLN 57 59.543 9.192 15.247 419 HE21 GLN 57 HE21 GLN 57 59.696 6.450 16.737 420 HE22 GLN 57 HE22 GLN 57 58.537 5.515 15.921 421 H GLY 58 HN GLY 58 60.875 5.406 14.570 422 HA2 GLY 58 HA2 GLY 58 59.467 3.645 14.014 423 HA3 GLY 58 HA1 GLY 58 59.317 4.310 12.392 424 H THR 59 HN THR 59 62.542 4.034 13.427 425 HA THR 59 HA THR 59 64.248 2.587 12.938 426 HB THR 59 HB THR 59 62.265 0.443 12.235 427 HG1 THR 59 HG1 THR 59 61.658 0.271 14.253 428 HG21 THR 59 HG21 THR 59 63.930 -0.989 13.345 429 HG22 THR 59 HG22 THR 59 64.880 0.435 13.772 430 HG23 THR 59 HG23 THR 59 64.702 -0.027 12.082 431 H LEU 60 HN LEU 60 62.742 4.242 10.962 432 HA LEU 60 HA LEU 60 62.938 2.833 8.436 433 HB2 LEU 60 HB2 LEU 60 62.159 5.586 9.332 434 HB3 LEU 60 HB1 LEU 60 62.630 5.372 7.647 435 HG LEU 60 HG LEU 60 60.938 3.624 7.368 436 HD11 LEU 60 HD11 LEU 60 60.349 4.177 10.289 437 HD12 LEU 60 HD12 LEU 60 60.920 2.661 9.594 438 HD13 LEU 60 HD13 LEU 60 59.298 3.243 9.226 439 HD21 LEU 60 HD21 LEU 60 58.917 5.041 7.685 440 HD22 LEU 60 HD22 LEU 60 60.253 5.945 6.970 441 HD23 LEU 60 HD23 LEU 60 59.869 6.142 8.681 442 H HIS 61 HN HIS 61 64.541 2.943 6.932 443 HA HIS 61 HA HIS 61 67.034 4.386 7.675 444 HB2 HIS 61 HB2 HIS 61 66.645 1.896 5.984 445 HB3 HIS 61 HB1 HIS 61 68.185 2.716 6.226 446 HD1 HIS 61 HD1 HIS 61 68.253 -0.061 7.214 447 HD2 HIS 61 HD2 HIS 61 66.756 3.014 9.597 448 HE1 HIS 61 HE1 HIS 61 68.368 -0.886 9.610 449 H LEU 62 HN LEU 62 67.733 5.968 6.322 450 HA LEU 62 HA LEU 62 66.511 6.161 3.614 451 HB2 LEU 62 HB2 LEU 62 65.715 7.802 5.438 452 HB3 LEU 62 HB1 LEU 62 67.309 8.527 5.314 453 HG LEU 62 HG LEU 62 65.697 9.734 3.920 454 HD11 LEU 62 HD11 LEU 62 68.149 9.260 3.173 455 HD12 LEU 62 HD12 LEU 62 67.017 9.945 2.011 456 HD13 LEU 62 HD13 LEU 62 67.397 8.229 1.953 457 HD21 LEU 62 HD21 LEU 62 64.429 7.391 3.504 458 HD22 LEU 62 HD22 LEU 62 65.368 7.455 2.012 459 HD23 LEU 62 HD23 LEU 62 64.256 8.763 2.417 460 H LEU 63 HN LEU 63 67.998 5.982 2.027 461 HA LEU 63 HA LEU 63 70.797 6.810 2.575 462 HB2 LEU 63 HB2 LEU 63 69.544 4.749 0.816 463 HB3 LEU 63 HB1 LEU 63 71.006 5.521 0.220 464 HG LEU 63 HG LEU 63 72.275 4.797 2.116 465 HD11 LEU 63 HD11 LEU 63 70.957 3.301 3.860 466 HD12 LEU 63 HD12 LEU 63 69.573 4.248 3.313 467 HD13 LEU 63 HD13 LEU 63 70.968 5.054 4.024 468 HD21 LEU 63 HD21 LEU 63 71.840 2.285 2.068 469 HD22 LEU 63 HD22 LEU 63 72.046 3.042 0.489 470 HD23 LEU 63 HD23 LEU 63 70.431 2.629 1.066 471 H THR 64 HN THR 64 71.230 8.807 1.932 472 HA THR 64 HA THR 64 69.707 9.969 -0.311 473 HB THR 64 HB THR 64 71.560 11.254 1.710 474 HG1 THR 64 HG1 THR 64 68.797 11.657 1.533 475 HG21 THR 64 HG21 THR 64 70.434 13.352 0.827 476 HG22 THR 64 HG22 THR 64 69.817 12.366 -0.498 477 HG23 THR 64 HG23 THR 64 71.556 12.575 -0.289 478 H LEU 65 HN LEU 65 70.597 9.620 -2.209 479 HA LEU 65 HA LEU 65 73.549 9.817 -2.497 480 HB2 LEU 65 HB2 LEU 65 72.650 7.644 -3.140 481 HB3 LEU 65 HB1 LEU 65 71.514 8.404 -4.243 482 HG LEU 65 HG LEU 65 74.495 8.858 -4.483 483 HD11 LEU 65 HD11 LEU 65 74.613 7.029 -6.084 484 HD12 LEU 65 HD12 LEU 65 72.897 6.690 -5.872 485 HD13 LEU 65 HD13 LEU 65 74.022 6.415 -4.542 486 HD21 LEU 65 HD21 LEU 65 73.381 8.900 -7.034 487 HD22 LEU 65 HD22 LEU 65 73.700 10.319 -6.047 488 HD23 LEU 65 HD23 LEU 65 72.093 9.605 -6.061 489 H HIS 66 HN HIS 66 74.352 11.454 -3.618 490 HA HIS 66 HA HIS 66 72.801 12.773 -5.700 491 HB2 HIS 66 HB2 HIS 66 73.107 15.015 -4.652 492 HB3 HIS 66 HB1 HIS 66 72.015 13.971 -3.741 493 HD1 HIS 66 HD1 HIS 66 75.813 13.907 -3.725 494 HD2 HIS 66 HD2 HIS 66 72.650 14.682 -1.124 495 HE1 HIS 66 HE1 HIS 66 76.838 14.248 -1.435 496 H LYS 67 HN LYS 67 74.114 14.473 -6.794 497 HA LYS 67 HA LYS 67 75.993 14.834 -8.084 498 HB2 LYS 67 HB2 LYS 67 77.092 15.024 -5.269 499 HB3 LYS 67 HB1 LYS 67 77.945 15.579 -6.712 500 HG2 LYS 67 HG2 LYS 67 76.104 17.103 -7.247 501 HG3 LYS 67 HG1 LYS 67 75.198 16.531 -5.850 502 HD2 LYS 67 HD2 LYS 67 76.998 17.356 -4.359 503 HD3 LYS 67 HD1 LYS 67 77.876 17.958 -5.767 504 HE2 LYS 67 HE2 LYS 67 76.633 19.817 -4.848 505 HE3 LYS 67 HE1 LYS 67 75.834 19.333 -6.343 506 HZ1 LYS 67 HZ1 LYS 67 74.619 17.773 -4.520 507 HZ2 LYS 67 HZ2 LYS 67 74.011 19.257 -5.076 508 HZ3 LYS 67 HZ3 LYS 67 74.886 19.186 -3.621 509 H VAL 68 HN VAL 68 76.119 12.803 -9.086 510 HA VAL 68 HA VAL 68 78.400 11.155 -8.184 511 HB VAL 68 HB VAL 68 77.094 9.133 -8.851 512 HG11 VAL 68 HG11 VAL 68 75.722 9.109 -6.775 513 HG12 VAL 68 HG12 VAL 68 75.965 10.849 -6.619 514 HG13 VAL 68 HG13 VAL 68 77.339 9.752 -6.496 515 HG21 VAL 68 HG21 VAL 68 74.655 9.347 -9.037 516 HG22 VAL 68 HG22 VAL 68 75.435 10.355 -10.257 517 HG23 VAL 68 HG23 VAL 68 74.774 11.090 -8.799 518 H THR 69 HN THR 69 79.198 9.707 -9.853 519 HA THR 69 HA THR 69 78.887 10.828 -12.585 520 HB THR 69 HB THR 69 81.204 10.330 -12.977 521 HG1 THR 69 HG1 THR 69 81.137 8.402 -11.613 522 HG21 THR 69 HG21 THR 69 80.626 12.415 -11.696 523 HG22 THR 69 HG22 THR 69 82.264 11.827 -11.404 524 HG23 THR 69 HG23 THR 69 80.997 11.539 -10.211 525 H LEU 70 HN LEU 70 80.608 8.725 -13.621 526 HA LEU 70 HA LEU 70 78.649 6.804 -14.287 527 HB2 LEU 70 HB2 LEU 70 81.669 6.644 -14.492 528 HB3 LEU 70 HB1 LEU 70 80.539 5.562 -15.298 529 HG LEU 70 HG LEU 70 80.596 8.570 -15.696 530 HD11 LEU 70 HD11 LEU 70 81.803 6.309 -17.313 531 HD12 LEU 70 HD12 LEU 70 82.650 7.668 -16.575 532 HD13 LEU 70 HD13 LEU 70 81.573 7.940 -17.943 533 HD21 LEU 70 HD21 LEU 70 78.445 7.888 -16.336 534 HD22 LEU 70 HD22 LEU 70 78.990 6.299 -16.867 535 HD23 LEU 70 HD23 LEU 70 79.324 7.721 -17.852 536 H GLU 71 HN GLU 71 80.871 7.104 -11.647 537 HA GLU 71 HA GLU 71 81.213 4.447 -10.850 538 HB2 GLU 71 HB2 GLU 71 80.997 6.942 -9.146 539 HB3 GLU 71 HB1 GLU 71 81.586 5.384 -8.572 540 HG2 GLU 71 HG2 GLU 71 82.805 6.945 -10.868 541 HG3 GLU 71 HG1 GLU 71 83.435 6.924 -9.223 542 H ASP 72 HN ASP 72 78.323 5.951 -11.258 543 HA ASP 72 HA ASP 72 76.848 5.236 -8.963 544 HB2 ASP 72 HB2 ASP 72 76.186 5.914 -11.809 545 HB3 ASP 72 HB1 ASP 72 74.911 5.252 -10.787 546 H ALA 73 HN ALA 73 77.680 3.424 -11.872 547 HA ALA 73 HA ALA 73 75.924 1.276 -11.616 548 HB1 ALA 73 HB1 ALA 73 78.802 1.227 -12.556 549 HB2 ALA 73 HB2 ALA 73 77.406 1.636 -13.553 550 HB3 ALA 73 HB3 ALA 73 77.579 0.006 -12.905 551 H GLY 74 HN GLY 74 75.711 -0.309 -10.160 552 HA2 GLY 74 HA2 GLY 74 77.727 -1.743 -8.891 553 HA3 GLY 74 HA1 GLY 74 77.313 -0.420 -7.804 554 H THR 75 HN THR 75 76.922 -3.267 -7.371 555 HA THR 75 HA THR 75 73.958 -3.457 -7.315 556 HB THR 75 HB THR 75 76.047 -5.644 -7.128 557 HG1 THR 75 HG1 THR 75 74.234 -4.973 -9.202 558 HG21 THR 75 HG21 THR 75 73.021 -5.679 -7.212 559 HG22 THR 75 HG22 THR 75 74.058 -6.259 -5.908 560 HG23 THR 75 HG23 THR 75 74.026 -7.108 -7.452 561 H VAL 76 HN VAL 76 73.100 -2.988 -5.371 562 HA VAL 76 HA VAL 76 74.726 -3.324 -2.946 563 HB VAL 76 HB VAL 76 71.904 -2.262 -3.077 564 HG11 VAL 76 HG11 VAL 76 72.597 -1.115 -1.015 565 HG12 VAL 76 HG12 VAL 76 74.208 -1.812 -1.166 566 HG13 VAL 76 HG13 VAL 76 72.821 -2.859 -0.866 567 HG21 VAL 76 HG21 VAL 76 74.525 -0.802 -3.521 568 HG22 VAL 76 HG22 VAL 76 73.020 0.016 -3.111 569 HG23 VAL 76 HG23 VAL 76 73.152 -0.880 -4.623 570 H SER 77 HN SER 77 74.511 -5.026 -1.632 571 HA SER 77 HA SER 77 72.075 -6.719 -1.848 572 HB2 SER 77 HB2 SER 77 73.626 -8.655 -1.399 573 HB3 SER 77 HB1 SER 77 73.844 -7.898 -2.974 574 HG SER 77 HG SER 77 75.755 -8.327 -1.480 575 H PHE 78 HN PHE 78 71.315 -7.612 0.025 576 HA PHE 78 HA PHE 78 72.764 -7.371 2.521 577 HB2 PHE 78 HB2 PHE 78 70.816 -6.079 3.559 578 HB3 PHE 78 HB1 PHE 78 71.912 -5.163 2.525 579 HD1 PHE 78 HD1 PHE 78 71.253 -4.500 0.256 580 HD2 PHE 78 HD2 PHE 78 68.543 -6.567 2.861 581 HE1 PHE 78 HE1 PHE 78 69.363 -3.876 -1.220 582 HE2 PHE 78 HE2 PHE 78 66.651 -5.942 1.382 583 HZ PHE 78 HZ PHE 78 67.062 -4.598 -0.657 584 H HIS 79 HN HIS 79 71.717 -8.519 4.267 585 HA HIS 79 HA HIS 79 69.271 -9.978 3.714 586 HB2 HIS 79 HB2 HIS 79 70.313 -12.209 3.900 587 HB3 HIS 79 HB1 HIS 79 70.889 -11.336 2.479 588 HD1 HIS 79 HD1 HIS 79 73.236 -9.946 2.943 589 HD2 HIS 79 HD2 HIS 79 72.371 -13.109 5.515 590 HE1 HIS 79 HE1 HIS 79 75.414 -10.556 4.091 591 H VAL 80 HN VAL 80 68.430 -11.052 5.487 592 HA VAL 80 HA VAL 80 69.775 -10.637 8.093 593 HB VAL 80 HB VAL 80 67.904 -9.040 7.793 594 HG11 VAL 80 HG11 VAL 80 66.572 -10.470 6.240 595 HG12 VAL 80 HG12 VAL 80 65.616 -9.853 7.589 596 HG13 VAL 80 HG13 VAL 80 66.179 -11.523 7.599 597 HG21 VAL 80 HG21 VAL 80 66.637 -9.673 9.839 598 HG22 VAL 80 HG22 VAL 80 68.380 -9.856 10.050 599 HG23 VAL 80 HG23 VAL 80 67.368 -11.277 9.776 600 H GLY 81 HN GLY 81 69.889 -12.387 9.361 601 HA2 GLY 81 HA2 GLY 81 69.919 -14.930 8.649 602 HA3 GLY 81 HA1 GLY 81 69.348 -14.486 10.248 603 H THR 82 HN THR 82 66.903 -13.191 9.148 604 HA THR 82 HA THR 82 65.245 -15.546 9.117 605 HB THR 82 HB THR 82 64.328 -12.736 8.507 606 HG1 THR 82 HG1 THR 82 64.148 -13.450 11.097 607 HG21 THR 82 HG21 THR 82 62.850 -14.927 8.455 608 HG22 THR 82 HG22 THR 82 62.234 -13.475 9.243 609 HG23 THR 82 HG23 THR 82 62.928 -14.775 10.210 610 H CYS 83 HN CYS 83 65.095 -12.794 6.873 611 HA CYS 83 HA CYS 83 64.837 -14.696 4.602 612 HB2 CYS 83 HB2 CYS 83 62.761 -13.309 5.313 613 HB3 CYS 83 HB1 CYS 83 63.630 -11.930 4.641 614 HG CYS 83 HG CYS 83 63.131 -12.745 2.356 615 H SER 84 HN SER 84 65.056 -12.967 2.509 616 HA SER 84 HA SER 84 67.363 -11.232 2.921 617 HB2 SER 84 HB2 SER 84 68.656 -12.380 1.100 618 HB3 SER 84 HB1 SER 84 68.531 -13.304 2.593 619 HG SER 84 HG SER 84 67.779 -14.004 0.153 620 H SER 85 HN SER 85 67.872 -9.947 1.085 621 HA SER 85 HA SER 85 66.275 -9.977 -1.283 622 HB2 SER 85 HB2 SER 85 64.501 -9.064 -0.037 623 HB3 SER 85 HB1 SER 85 65.577 -8.073 0.943 624 HG SER 85 HG SER 85 64.612 -6.779 -0.604 625 H GLU 86 HN GLU 86 66.989 -8.430 -2.802 626 HA GLU 86 HA GLU 86 69.198 -6.661 -2.026 627 HB2 GLU 86 HB2 GLU 86 70.651 -7.555 -3.803 628 HB3 GLU 86 HB1 GLU 86 70.283 -8.790 -2.598 629 HG2 GLU 86 HG2 GLU 86 68.453 -9.631 -4.067 630 HG3 GLU 86 HG1 GLU 86 68.925 -8.453 -5.288 631 H ALA 87 HN ALA 87 69.717 -5.094 -3.622 632 HA ALA 87 HA ALA 87 67.698 -4.709 -5.758 633 HB1 ALA 87 HB1 ALA 87 68.796 -2.597 -3.879 634 HB2 ALA 87 HB2 ALA 87 67.150 -3.225 -3.876 635 HB3 ALA 87 HB3 ALA 87 67.734 -2.290 -5.251 636 H GLN 88 HN GLN 88 68.473 -3.530 -7.593 637 HA GLN 88 HA GLN 88 71.434 -3.329 -7.768 638 HB2 GLN 88 HB2 GLN 88 70.623 -5.297 -8.999 639 HB3 GLN 88 HB1 GLN 88 69.534 -4.265 -9.931 640 HG2 GLN 88 HG2 GLN 88 71.392 -3.054 -10.891 641 HG3 GLN 88 HG1 GLN 88 72.536 -3.861 -9.822 642 HE21 GLN 88 HE21 GLN 88 73.762 -5.134 -11.238 643 HE22 GLN 88 HE22 GLN 88 73.101 -6.237 -12.346 644 H LEU 89 HN LEU 89 72.273 -1.580 -8.673 645 HA LEU 89 HA LEU 89 70.435 0.536 -9.655 646 HB2 LEU 89 HB2 LEU 89 71.837 0.954 -7.566 647 HB3 LEU 89 HB1 LEU 89 73.255 0.889 -8.607 648 HG LEU 89 HG LEU 89 70.911 2.749 -9.111 649 HD11 LEU 89 HD11 LEU 89 72.523 4.501 -8.175 650 HD12 LEU 89 HD12 LEU 89 73.439 3.152 -7.505 651 HD13 LEU 89 HD13 LEU 89 71.774 3.424 -6.999 652 HD21 LEU 89 HD21 LEU 89 72.095 2.721 -11.113 653 HD22 LEU 89 HD22 LEU 89 73.632 2.344 -10.338 654 HD23 LEU 89 HD23 LEU 89 72.984 3.982 -10.268 655 H LYS 90 HN LYS 90 70.523 0.890 -11.788 656 HA LYS 90 HA LYS 90 73.031 0.258 -13.250 657 HB2 LYS 90 HB2 LYS 90 71.597 -0.371 -15.176 658 HB3 LYS 90 HB1 LYS 90 71.363 -1.412 -13.774 659 HG2 LYS 90 HG2 LYS 90 69.331 -0.227 -13.165 660 HG3 LYS 90 HG1 LYS 90 69.595 0.958 -14.443 661 HD2 LYS 90 HD2 LYS 90 67.942 -0.674 -15.198 662 HD3 LYS 90 HD1 LYS 90 69.420 -0.877 -16.133 663 HE2 LYS 90 HE2 LYS 90 70.019 -2.853 -14.973 664 HE3 LYS 90 HE1 LYS 90 68.910 -2.513 -13.643 665 HZ1 LYS 90 HZ1 LYS 90 67.459 -3.797 -14.709 666 HZ2 LYS 90 HZ2 LYS 90 68.427 -3.872 -16.103 667 HZ3 LYS 90 HZ3 LYS 90 67.337 -2.587 -15.893 668 H VAL 91 HN VAL 91 73.408 1.470 -15.187 669 HA VAL 91 HA VAL 91 72.220 4.192 -15.116 670 HB VAL 91 HB VAL 91 74.391 4.915 -16.142 671 HG11 VAL 91 HG11 VAL 91 75.689 4.635 -13.990 672 HG12 VAL 91 HG12 VAL 91 74.400 3.571 -13.430 673 HG13 VAL 91 HG13 VAL 91 74.054 5.263 -13.780 674 HG21 VAL 91 HG21 VAL 91 76.306 3.323 -15.882 675 HG22 VAL 91 HG22 VAL 91 75.113 2.768 -17.056 676 HG23 VAL 91 HG23 VAL 91 75.155 2.061 -15.441 677 H THR 92 HN THR 92 71.392 5.017 -16.933 678 HA THR 92 HA THR 92 71.321 3.292 -19.324 679 HB THR 92 HB THR 92 69.432 4.774 -19.990 680 HG1 THR 92 HG1 THR 92 69.094 6.531 -18.909 681 HG21 THR 92 HG21 THR 92 69.365 3.426 -17.285 682 HG22 THR 92 HG22 THR 92 68.874 2.752 -18.840 683 HG23 THR 92 HG23 THR 92 67.916 4.029 -18.090 684 H ALA 93 HN ALA 93 72.223 3.867 -21.205 685 HA ALA 93 HA ALA 93 72.878 6.580 -21.905 686 HB1 ALA 93 HB1 ALA 93 75.377 6.015 -22.123 687 HB2 ALA 93 HB2 ALA 93 75.051 4.681 -21.016 688 HB3 ALA 93 HB3 ALA 93 74.774 6.344 -20.498 689 H GLY 94 HN GLY 94 72.705 3.206 -22.486 690 HA2 GLY 94 HA2 GLY 94 73.740 3.305 -25.195 691 HA3 GLY 94 HA1 GLY 94 73.050 1.905 -24.385 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 52.289 -5.861 15.374 2 H2 MET 1 HT2 MET 1 53.312 -6.654 16.476 3 H3 MET 1 HT3 MET 1 51.627 -6.747 16.659 4 HA MET 1 HA MET 1 52.517 -8.799 15.737 5 HB2 MET 1 HB2 MET 1 50.775 -7.050 13.984 6 HB3 MET 1 HB1 MET 1 51.110 -8.732 13.579 7 HG2 MET 1 HG2 MET 1 49.049 -8.743 14.791 8 HG3 MET 1 HG1 MET 1 50.270 -9.334 15.914 9 HE1 MET 1 HE1 MET 1 48.725 -6.054 14.509 10 HE2 MET 1 HE2 MET 1 47.937 -5.418 15.950 11 HE3 MET 1 HE3 MET 1 47.448 -6.983 15.305 12 H ALA 2 HN ALA 2 54.864 -8.235 15.514 13 HA ALA 2 HA ALA 2 55.757 -8.708 12.874 14 HB1 ALA 2 HB1 ALA 2 55.194 -6.388 12.440 15 HB2 ALA 2 HB2 ALA 2 56.948 -6.538 12.508 16 HB3 ALA 2 HB3 ALA 2 56.066 -5.869 13.881 17 HA PRO 3 HA PRO 3 58.376 -9.200 16.941 18 HB2 PRO 3 HB2 PRO 3 58.670 -11.977 16.147 19 HB3 PRO 3 HB1 PRO 3 57.855 -11.331 17.581 20 HG2 PRO 3 HG2 PRO 3 56.707 -12.207 15.011 21 HG3 PRO 3 HG1 PRO 3 55.939 -12.080 16.601 22 HD2 PRO 3 HD2 PRO 3 55.368 -10.361 14.582 23 HD3 PRO 3 HD1 PRO 3 55.351 -9.848 16.285 24 H GLU 4 HN GLU 4 58.820 -10.978 13.857 25 HA GLU 4 HA GLU 4 61.667 -10.728 13.932 26 HB2 GLU 4 HB2 GLU 4 59.796 -12.221 12.452 27 HB3 GLU 4 HB1 GLU 4 60.557 -11.194 11.246 28 HG2 GLU 4 HG2 GLU 4 61.926 -13.133 13.136 29 HG3 GLU 4 HG1 GLU 4 61.836 -13.234 11.377 30 H VAL 5 HN VAL 5 62.952 -9.557 12.252 31 HA VAL 5 HA VAL 5 62.324 -6.812 12.197 32 HB VAL 5 HB VAL 5 64.613 -8.059 11.802 33 HG11 VAL 5 HG11 VAL 5 63.815 -7.650 8.917 34 HG12 VAL 5 HG12 VAL 5 63.695 -9.215 9.715 35 HG13 VAL 5 HG13 VAL 5 65.264 -8.434 9.547 36 HG21 VAL 5 HG21 VAL 5 65.334 -6.034 10.310 37 HG22 VAL 5 HG22 VAL 5 64.706 -5.722 11.925 38 HG23 VAL 5 HG23 VAL 5 63.663 -5.502 10.519 39 H THR 6 HN THR 6 61.026 -5.610 10.821 40 HA THR 6 HA THR 6 59.413 -7.029 8.930 41 HB THR 6 HB THR 6 59.773 -4.067 9.408 42 HG1 THR 6 HG1 THR 6 57.349 -5.344 9.605 43 HG21 THR 6 HG21 THR 6 57.580 -4.079 7.923 44 HG22 THR 6 HG22 THR 6 58.325 -5.515 7.218 45 HG23 THR 6 HG23 THR 6 59.169 -3.965 7.169 46 H ILE 7 HN ILE 7 59.701 -7.383 6.793 47 HA ILE 7 HA ILE 7 62.257 -6.459 5.613 48 HB ILE 7 HB ILE 7 61.666 -8.927 6.121 49 HG12 ILE 7 HG12 ILE 7 62.789 -9.528 3.766 50 HG13 ILE 7 HG11 ILE 7 62.962 -7.776 3.663 51 HG21 ILE 7 HG21 ILE 7 60.494 -9.002 3.366 52 HG22 ILE 7 HG22 ILE 7 59.439 -8.557 4.707 53 HG23 ILE 7 HG23 ILE 7 60.265 -10.112 4.717 54 HD11 ILE 7 HD11 ILE 7 63.920 -9.448 6.010 55 HD12 ILE 7 HD12 ILE 7 64.215 -7.729 5.754 56 HD13 ILE 7 HD13 ILE 7 64.952 -8.919 4.684 57 H LEU 8 HN LEU 8 59.760 -4.933 5.493 58 HA LEU 8 HA LEU 8 58.808 -5.218 2.751 59 HB2 LEU 8 HB2 LEU 8 58.061 -3.557 5.112 60 HB3 LEU 8 HB1 LEU 8 57.757 -2.828 3.539 61 HG LEU 8 HG LEU 8 56.498 -4.891 2.874 62 HD11 LEU 8 HD11 LEU 8 56.027 -6.626 4.374 63 HD12 LEU 8 HD12 LEU 8 56.453 -5.664 5.789 64 HD13 LEU 8 HD13 LEU 8 57.716 -6.282 4.729 65 HD21 LEU 8 HD21 LEU 8 54.559 -4.437 4.483 66 HD22 LEU 8 HD22 LEU 8 55.196 -3.031 3.625 67 HD23 LEU 8 HD23 LEU 8 55.641 -3.316 5.308 68 H GLU 9 HN GLU 9 60.630 -4.918 1.511 69 HA GLU 9 HA GLU 9 61.780 -2.178 1.456 70 HB2 GLU 9 HB2 GLU 9 63.729 -3.534 0.288 71 HB3 GLU 9 HB1 GLU 9 63.609 -3.484 2.046 72 HG2 GLU 9 HG2 GLU 9 62.665 -5.644 2.171 73 HG3 GLU 9 HG1 GLU 9 62.235 -5.653 0.463 74 HA PRO 10 HA PRO 10 59.656 -2.891 -2.576 75 HB2 PRO 10 HB2 PRO 10 59.294 -0.018 -2.811 76 HB3 PRO 10 HB1 PRO 10 58.059 -1.264 -2.582 77 HG2 PRO 10 HG2 PRO 10 58.853 0.637 -0.688 78 HG3 PRO 10 HG1 PRO 10 57.890 -0.814 -0.374 79 HD2 PRO 10 HD2 PRO 10 60.746 -0.307 0.244 80 HD3 PRO 10 HD1 PRO 10 59.625 -1.481 0.965 81 H LEU 11 HN LEU 11 62.584 -2.403 -1.918 82 HA LEU 11 HA LEU 11 63.525 -0.644 -4.022 83 HB2 LEU 11 HB2 LEU 11 65.070 -2.609 -2.309 84 HB3 LEU 11 HB1 LEU 11 65.750 -1.303 -3.279 85 HG LEU 11 HG LEU 11 63.846 -0.954 -0.943 86 HD11 LEU 11 HD11 LEU 11 66.836 -0.704 -1.241 87 HD12 LEU 11 HD12 LEU 11 65.909 -1.510 0.027 88 HD13 LEU 11 HD13 LEU 11 65.974 0.250 -0.036 89 HD21 LEU 11 HD21 LEU 11 65.046 0.946 -2.954 90 HD22 LEU 11 HD22 LEU 11 64.742 1.507 -1.311 91 HD23 LEU 11 HD23 LEU 11 63.410 0.908 -2.292 92 H GLN 12 HN GLN 12 62.254 -1.857 -5.666 93 HA GLN 12 HA GLN 12 63.092 -4.483 -6.453 94 HB2 GLN 12 HB2 GLN 12 61.414 -2.358 -7.791 95 HB3 GLN 12 HB1 GLN 12 61.711 -3.946 -8.502 96 HG2 GLN 12 HG2 GLN 12 60.724 -5.047 -6.564 97 HG3 GLN 12 HG1 GLN 12 60.530 -3.499 -5.746 98 HE21 GLN 12 HE21 GLN 12 58.291 -3.162 -5.720 99 HE22 GLN 12 HE22 GLN 12 57.293 -3.249 -7.090 100 H ASP 13 HN ASP 13 63.275 -1.436 -8.314 101 HA ASP 13 HA ASP 13 66.058 -1.651 -8.885 102 HB2 ASP 13 HB2 ASP 13 65.368 -3.550 -10.257 103 HB3 ASP 13 HB1 ASP 13 64.158 -2.554 -11.065 104 H VAL 14 HN VAL 14 66.777 0.312 -9.560 105 HA VAL 14 HA VAL 14 64.784 2.208 -10.686 106 HB VAL 14 HB VAL 14 65.978 4.013 -9.477 107 HG11 VAL 14 HG11 VAL 14 64.888 1.742 -7.789 108 HG12 VAL 14 HG12 VAL 14 63.956 3.055 -8.505 109 HG13 VAL 14 HG13 VAL 14 65.113 3.395 -7.216 110 HG21 VAL 14 HG21 VAL 14 68.135 2.676 -9.241 111 HG22 VAL 14 HG22 VAL 14 67.339 1.778 -7.950 112 HG23 VAL 14 HG23 VAL 14 67.606 3.512 -7.785 113 H GLN 15 HN GLN 15 65.420 3.509 -12.341 114 HA GLN 15 HA GLN 15 68.182 3.187 -13.385 115 HB2 GLN 15 HB2 GLN 15 65.559 3.066 -14.900 116 HB3 GLN 15 HB1 GLN 15 67.137 3.205 -15.677 117 HG2 GLN 15 HG2 GLN 15 67.859 1.098 -14.671 118 HG3 GLN 15 HG1 GLN 15 66.346 0.976 -13.777 119 HE21 GLN 15 HE21 GLN 15 67.822 -0.314 -16.429 120 HE22 GLN 15 HE22 GLN 15 66.461 -0.631 -17.394 121 H LEU 16 HN LEU 16 69.118 5.133 -13.266 122 HA LEU 16 HA LEU 16 67.576 7.561 -14.022 123 HB2 LEU 16 HB2 LEU 16 69.471 7.062 -11.750 124 HB3 LEU 16 HB1 LEU 16 69.452 8.661 -12.474 125 HG LEU 16 HG LEU 16 67.958 8.471 -10.502 126 HD11 LEU 16 HD11 LEU 16 67.500 9.919 -12.674 127 HD12 LEU 16 HD12 LEU 16 66.313 9.831 -11.377 128 HD13 LEU 16 HD13 LEU 16 66.101 8.855 -12.826 129 HD21 LEU 16 HD21 LEU 16 66.169 7.010 -10.357 130 HD22 LEU 16 HD22 LEU 16 67.337 6.005 -11.213 131 HD23 LEU 16 HD23 LEU 16 66.042 6.810 -12.100 132 H SER 17 HN SER 17 68.743 9.183 -15.197 133 HA SER 17 HA SER 17 70.771 8.143 -16.953 134 HB2 SER 17 HB2 SER 17 69.491 10.844 -16.600 135 HB3 SER 17 HB1 SER 17 70.864 10.629 -17.678 136 HG SER 17 HG SER 17 69.595 9.664 -19.042 137 H GLU 18 HN GLU 18 72.943 8.983 -17.175 138 HA GLU 18 HA GLU 18 74.377 9.100 -14.761 139 HB2 GLU 18 HB2 GLU 18 75.378 8.428 -16.920 140 HB3 GLU 18 HB1 GLU 18 75.241 10.089 -17.493 141 HG2 GLU 18 HG2 GLU 18 76.717 9.438 -14.939 142 HG3 GLU 18 HG1 GLU 18 77.516 9.333 -16.504 143 H GLY 19 HN GLY 19 75.149 10.731 -13.518 144 HA2 GLY 19 HA2 GLY 19 75.666 12.928 -12.890 145 HA3 GLY 19 HA1 GLY 19 74.928 13.511 -14.375 146 H GLN 20 HN GLN 20 72.732 11.410 -13.125 147 HA GLN 20 HA GLN 20 71.136 13.601 -11.996 148 HB2 GLN 20 HB2 GLN 20 70.425 10.755 -12.732 149 HB3 GLN 20 HB1 GLN 20 69.294 11.905 -12.031 150 HG2 GLN 20 HG2 GLN 20 70.812 12.361 -14.615 151 HG3 GLN 20 HG1 GLN 20 69.149 11.783 -14.519 152 HE21 GLN 20 HE21 GLN 20 67.576 13.295 -13.343 153 HE22 GLN 20 HE22 GLN 20 67.849 14.966 -13.464 154 H ASP 21 HN ASP 21 69.744 13.031 -10.082 155 HA ASP 21 HA ASP 21 71.459 12.104 -7.926 156 HB2 ASP 21 HB2 ASP 21 68.710 13.349 -8.029 157 HB3 ASP 21 HB1 ASP 21 69.417 12.750 -6.530 158 H ALA 22 HN ALA 22 70.570 10.623 -6.275 159 HA ALA 22 HA ALA 22 68.527 8.741 -7.144 160 HB1 ALA 22 HB1 ALA 22 70.169 6.808 -6.709 161 HB2 ALA 22 HB2 ALA 22 71.446 8.007 -6.919 162 HB3 ALA 22 HB3 ALA 22 70.328 7.666 -8.241 163 H SER 23 HN SER 23 67.812 7.376 -5.425 164 HA SER 23 HA SER 23 69.016 7.653 -2.801 165 HB2 SER 23 HB2 SER 23 66.877 8.519 -1.788 166 HB3 SER 23 HB1 SER 23 67.747 9.688 -2.775 167 HG SER 23 HG SER 23 65.860 8.053 -4.025 168 H PHE 24 HN PHE 24 67.987 6.296 -1.203 169 HA PHE 24 HA PHE 24 66.266 4.155 -2.325 170 HB2 PHE 24 HB2 PHE 24 68.764 3.846 -0.646 171 HB3 PHE 24 HB1 PHE 24 67.623 2.543 -0.957 172 HD1 PHE 24 HD1 PHE 24 70.330 4.578 -2.328 173 HD2 PHE 24 HD2 PHE 24 67.264 1.723 -3.284 174 HE1 PHE 24 HE1 PHE 24 71.455 4.093 -4.485 175 HE2 PHE 24 HE2 PHE 24 68.387 1.241 -5.440 176 HZ PHE 24 HZ PHE 24 70.482 2.423 -6.041 177 H GLN 25 HN GLN 25 64.833 3.228 -0.874 178 HA GLN 25 HA GLN 25 64.733 4.290 1.882 179 HB2 GLN 25 HB2 GLN 25 63.222 5.644 0.479 180 HB3 GLN 25 HB1 GLN 25 62.405 4.176 -0.052 181 HG2 GLN 25 HG2 GLN 25 61.717 3.689 2.241 182 HG3 GLN 25 HG1 GLN 25 62.603 5.096 2.829 183 HE21 GLN 25 HE21 GLN 25 61.206 6.827 3.204 184 HE22 GLN 25 HE22 GLN 25 59.826 7.180 2.280 185 H CYS 26 HN CYS 26 64.643 2.631 3.261 186 HA CYS 26 HA CYS 26 63.227 0.150 2.447 187 HB2 CYS 26 HB2 CYS 26 65.601 -0.288 2.274 188 HB3 CYS 26 HB1 CYS 26 65.884 0.387 3.878 189 HG CYS 26 HG CYS 26 65.397 -2.412 3.570 190 H ARG 27 HN ARG 27 61.750 -0.539 3.848 191 HA ARG 27 HA ARG 27 61.568 0.764 6.486 192 HB2 ARG 27 HB2 ARG 27 59.636 0.541 4.672 193 HB3 ARG 27 HB1 ARG 27 59.443 -1.060 5.376 194 HG2 ARG 27 HG2 ARG 27 59.469 1.460 7.070 195 HG3 ARG 27 HG1 ARG 27 57.996 0.805 6.371 196 HD2 ARG 27 HD2 ARG 27 58.435 -1.356 7.522 197 HD3 ARG 27 HD1 ARG 27 59.854 -0.643 8.280 198 HE ARG 27 HE ARG 27 57.049 0.103 8.832 199 HH11 ARG 27 HH11 ARG 27 58.698 -1.138 10.982 200 HH12 ARG 27 HH12 ARG 27 59.242 0.232 11.892 201 HH21 ARG 27 HH21 ARG 27 58.514 2.516 9.390 202 HH22 ARG 27 HH22 ARG 27 59.143 2.296 10.988 203 H LEU 28 HN LEU 28 62.667 -0.308 8.005 204 HA LEU 28 HA LEU 28 62.305 -3.247 8.200 205 HB2 LEU 28 HB2 LEU 28 64.724 -1.672 9.104 206 HB3 LEU 28 HB1 LEU 28 64.508 -3.416 9.213 207 HG LEU 28 HG LEU 28 64.644 -1.803 6.654 208 HD11 LEU 28 HD11 LEU 28 66.579 -3.773 7.907 209 HD12 LEU 28 HD12 LEU 28 66.809 -2.027 7.812 210 HD13 LEU 28 HD13 LEU 28 66.786 -2.996 6.338 211 HD21 LEU 28 HD21 LEU 28 63.263 -3.656 6.139 212 HD22 LEU 28 HD22 LEU 28 64.139 -4.725 7.233 213 HD23 LEU 28 HD23 LEU 28 64.874 -4.225 5.709 214 H SER 29 HN SER 29 61.412 -3.932 10.046 215 HA SER 29 HA SER 29 60.939 -1.951 12.179 216 HB2 SER 29 HB2 SER 29 59.763 -4.696 11.704 217 HB3 SER 29 HB1 SER 29 59.409 -3.696 13.105 218 HG SER 29 HG SER 29 58.296 -3.598 10.713 219 H ARG 30 HN ARG 30 60.964 -3.078 14.467 220 HA ARG 30 HA ARG 30 63.634 -3.571 15.098 221 HB2 ARG 30 HB2 ARG 30 62.831 -4.243 17.305 222 HB3 ARG 30 HB1 ARG 30 61.968 -2.814 16.741 223 HG2 ARG 30 HG2 ARG 30 60.104 -4.280 15.972 224 HG3 ARG 30 HG1 ARG 30 60.958 -5.674 16.635 225 HD2 ARG 30 HD2 ARG 30 60.913 -4.639 18.874 226 HD3 ARG 30 HD1 ARG 30 60.061 -3.248 18.217 227 HE ARG 30 HE ARG 30 58.620 -5.613 17.612 228 HH11 ARG 30 HH11 ARG 30 59.803 -4.314 20.539 229 HH12 ARG 30 HH12 ARG 30 58.273 -4.332 21.350 230 HH21 ARG 30 HH21 ARG 30 56.486 -5.296 18.544 231 HH22 ARG 30 HH22 ARG 30 56.398 -4.874 20.222 232 H ALA 31 HN ALA 31 64.868 -5.316 15.346 233 HA ALA 31 HA ALA 31 64.077 -7.740 14.015 234 HB1 ALA 31 HB1 ALA 31 66.350 -8.404 14.234 235 HB2 ALA 31 HB2 ALA 31 66.628 -7.271 15.556 236 HB3 ALA 31 HB3 ALA 31 66.382 -6.669 13.916 237 H SER 32 HN SER 32 65.137 -9.805 15.223 238 HA SER 32 HA SER 32 64.255 -9.896 18.025 239 HB2 SER 32 HB2 SER 32 62.765 -11.753 17.668 240 HB3 SER 32 HB1 SER 32 62.280 -10.465 16.570 241 HG SER 32 HG SER 32 63.939 -12.683 15.943 242 H GLY 33 HN GLY 33 65.155 -12.093 15.365 243 HA2 GLY 33 HA2 GLY 33 67.022 -13.495 17.150 244 HA3 GLY 33 HA1 GLY 33 66.494 -14.032 15.556 245 H GLN 34 HN GLN 34 67.206 -12.589 13.698 246 HA GLN 34 HA GLN 34 69.928 -11.534 14.198 247 HB2 GLN 34 HB2 GLN 34 68.933 -13.157 11.850 248 HB3 GLN 34 HB1 GLN 34 70.482 -12.319 11.878 249 HG2 GLN 34 HG2 GLN 34 69.630 -14.393 13.917 250 HG3 GLN 34 HG1 GLN 34 70.655 -14.731 12.524 251 HE21 GLN 34 HE21 GLN 34 70.866 -14.095 15.772 252 HE22 GLN 34 HE22 GLN 34 72.400 -13.371 15.819 253 H GLU 35 HN GLU 35 70.451 -9.634 13.426 254 HA GLU 35 HA GLU 35 68.379 -8.026 12.155 255 HB2 GLU 35 HB2 GLU 35 69.911 -6.157 12.540 256 HB3 GLU 35 HB1 GLU 35 69.704 -7.091 14.020 257 HG2 GLU 35 HG2 GLU 35 71.818 -8.312 13.505 258 HG3 GLU 35 HG1 GLU 35 72.039 -7.284 12.089 259 H ALA 36 HN ALA 36 68.556 -7.087 10.132 260 HA ALA 36 HA ALA 36 70.025 -8.556 8.170 261 HB1 ALA 36 HB1 ALA 36 69.100 -6.934 6.585 262 HB2 ALA 36 HB2 ALA 36 68.607 -5.889 7.918 263 HB3 ALA 36 HB3 ALA 36 67.843 -7.463 7.703 264 H ARG 37 HN ARG 37 71.800 -7.877 6.924 265 HA ARG 37 HA ARG 37 73.457 -5.778 8.192 266 HB2 ARG 37 HB2 ARG 37 74.242 -7.988 6.269 267 HB3 ARG 37 HB1 ARG 37 75.345 -6.824 7.001 268 HG2 ARG 37 HG2 ARG 37 73.575 -8.522 8.757 269 HG3 ARG 37 HG1 ARG 37 75.066 -9.193 8.101 270 HD2 ARG 37 HD2 ARG 37 76.324 -7.275 9.085 271 HD3 ARG 37 HD1 ARG 37 74.827 -6.692 9.806 272 HE ARG 37 HE ARG 37 74.890 -8.482 11.335 273 HH11 ARG 37 HH11 ARG 37 77.892 -7.905 10.004 274 HH12 ARG 37 HH12 ARG 37 78.583 -9.446 10.388 275 HH21 ARG 37 HH21 ARG 37 75.567 -10.842 11.386 276 HH22 ARG 37 HH22 ARG 37 77.263 -11.113 11.168 277 H TRP 38 HN TRP 38 74.281 -4.114 7.033 278 HA TRP 38 HA TRP 38 72.999 -3.572 4.425 279 HB2 TRP 38 HB2 TRP 38 72.886 -2.043 6.556 280 HB3 TRP 38 HB1 TRP 38 74.524 -1.576 6.103 281 HD1 TRP 38 HD1 TRP 38 74.841 -0.104 3.983 282 HE1 TRP 38 HE1 TRP 38 73.200 1.204 2.485 283 HE3 TRP 38 HE3 TRP 38 70.423 -2.101 5.572 284 HZ2 TRP 38 HZ2 TRP 38 70.381 1.378 2.025 285 HZ3 TRP 38 HZ3 TRP 38 68.277 -1.348 4.594 286 HH2 TRP 38 HH2 TRP 38 68.250 0.389 2.823 287 H ALA 39 HN ALA 39 74.256 -3.486 2.559 288 HA ALA 39 HA ALA 39 77.015 -2.751 2.616 289 HB1 ALA 39 HB1 ALA 39 77.927 -4.995 1.980 290 HB2 ALA 39 HB2 ALA 39 76.368 -5.695 2.408 291 HB3 ALA 39 HB3 ALA 39 77.349 -4.909 3.642 292 H LEU 40 HN LEU 40 77.994 -2.682 0.569 293 HA LEU 40 HA LEU 40 76.260 -3.290 -1.765 294 HB2 LEU 40 HB2 LEU 40 76.386 -0.825 -1.238 295 HB3 LEU 40 HB1 LEU 40 78.122 -0.907 -1.511 296 HG LEU 40 HG LEU 40 76.087 -1.792 -3.583 297 HD11 LEU 40 HD11 LEU 40 76.554 0.444 -4.654 298 HD12 LEU 40 HD12 LEU 40 77.369 0.922 -3.166 299 HD13 LEU 40 HD13 LEU 40 75.648 0.544 -3.145 300 HD21 LEU 40 HD21 LEU 40 78.118 -2.650 -4.335 301 HD22 LEU 40 HD22 LEU 40 79.073 -1.404 -3.534 302 HD23 LEU 40 HD23 LEU 40 78.217 -1.037 -5.028 303 H GLY 41 HN GLY 41 77.225 -4.761 -3.032 304 HA2 GLY 41 HA2 GLY 41 78.956 -5.655 -4.357 305 HA3 GLY 41 HA1 GLY 41 80.116 -4.640 -3.500 306 H GLY 42 HN GLY 42 78.257 -5.862 -1.137 307 HA2 GLY 42 HA2 GLY 42 78.221 -7.921 0.042 308 HA3 GLY 42 HA1 GLY 42 79.612 -8.463 -0.887 309 H VAL 43 HN VAL 43 80.257 -5.328 0.021 310 HA VAL 43 HA VAL 43 81.754 -6.240 2.413 311 HB VAL 43 HB VAL 43 83.313 -4.379 1.902 312 HG11 VAL 43 HG11 VAL 43 82.750 -6.340 -0.341 313 HG12 VAL 43 HG12 VAL 43 83.803 -6.607 1.046 314 HG13 VAL 43 HG13 VAL 43 84.243 -5.416 -0.177 315 HG21 VAL 43 HG21 VAL 43 81.528 -4.071 -0.531 316 HG22 VAL 43 HG22 VAL 43 83.101 -3.298 -0.342 317 HG23 VAL 43 HG23 VAL 43 81.776 -2.877 0.741 318 HA PRO 44 HA PRO 44 79.374 -3.609 5.055 319 HB2 PRO 44 HB2 PRO 44 81.647 -2.336 6.351 320 HB3 PRO 44 HB1 PRO 44 80.594 -3.611 6.986 321 HG2 PRO 44 HG2 PRO 44 83.283 -3.834 5.901 322 HG3 PRO 44 HG1 PRO 44 82.330 -5.040 6.776 323 HD2 PRO 44 HD2 PRO 44 82.959 -5.156 4.058 324 HD3 PRO 44 HD1 PRO 44 81.655 -6.071 4.840 325 H LEU 45 HN LEU 45 78.495 -1.594 4.872 326 HA LEU 45 HA LEU 45 79.657 0.213 2.913 327 HB2 LEU 45 HB2 LEU 45 77.103 -0.553 3.374 328 HB3 LEU 45 HB1 LEU 45 77.127 0.911 4.338 329 HG LEU 45 HG LEU 45 78.042 2.119 2.278 330 HD11 LEU 45 HD11 LEU 45 78.848 0.403 0.844 331 HD12 LEU 45 HD12 LEU 45 77.320 0.858 0.106 332 HD13 LEU 45 HD13 LEU 45 77.416 -0.597 1.097 333 HD21 LEU 45 HD21 LEU 45 75.625 2.126 3.038 334 HD22 LEU 45 HD22 LEU 45 75.337 0.798 1.909 335 HD23 LEU 45 HD23 LEU 45 75.838 2.376 1.303 336 H GLN 46 HN GLN 46 79.680 2.573 3.314 337 HA GLN 46 HA GLN 46 80.185 3.329 6.126 338 HB2 GLN 46 HB2 GLN 46 82.087 3.786 3.813 339 HB3 GLN 46 HB1 GLN 46 82.251 4.515 5.411 340 HG2 GLN 46 HG2 GLN 46 82.373 2.266 6.425 341 HG3 GLN 46 HG1 GLN 46 82.221 1.541 4.825 342 HE21 GLN 46 HE21 GLN 46 84.466 0.626 5.620 343 HE22 GLN 46 HE22 GLN 46 85.826 1.560 5.222 344 H ALA 47 HN ALA 47 79.837 5.509 6.582 345 HA ALA 47 HA ALA 47 78.004 6.871 4.847 346 HB1 ALA 47 HB1 ALA 47 79.322 7.549 7.470 347 HB2 ALA 47 HB2 ALA 47 77.622 7.218 7.144 348 HB3 ALA 47 HB3 ALA 47 78.339 8.735 6.610 349 H ASN 48 HN ASN 48 79.835 6.701 3.088 350 HA ASN 48 HA ASN 48 81.976 8.568 3.142 351 HB2 ASN 48 HB2 ASN 48 81.860 6.609 1.616 352 HB3 ASN 48 HB1 ASN 48 80.561 7.409 0.734 353 HD21 ASN 48 HD21 ASN 48 82.613 6.977 -0.901 354 HD22 ASN 48 HD22 ASN 48 83.592 8.348 -1.114 355 H GLU 49 HN GLU 49 82.150 10.629 2.351 356 HA GLU 49 HA GLU 49 80.191 12.478 2.614 357 HB2 GLU 49 HB2 GLU 49 82.398 12.450 0.546 358 HB3 GLU 49 HB1 GLU 49 81.446 13.875 0.961 359 HG2 GLU 49 HG2 GLU 49 83.048 12.265 2.968 360 HG3 GLU 49 HG1 GLU 49 83.638 13.732 2.189 361 H MET 50 HN MET 50 80.823 10.586 -0.325 362 HA MET 50 HA MET 50 78.868 11.851 -1.948 363 HB2 MET 50 HB2 MET 50 80.228 9.161 -2.079 364 HB3 MET 50 HB1 MET 50 79.030 9.657 -3.272 365 HG2 MET 50 HG2 MET 50 80.378 11.673 -3.774 366 HG3 MET 50 HG1 MET 50 81.592 11.143 -2.610 367 HE1 MET 50 HE1 MET 50 83.001 9.295 -2.695 368 HE2 MET 50 HE2 MET 50 83.365 8.239 -4.057 369 HE3 MET 50 HE3 MET 50 81.933 7.936 -3.076 370 H ASN 51 HN ASN 51 78.779 9.045 0.203 371 HA ASN 51 HA ASN 51 75.853 8.800 -0.241 372 HB2 ASN 51 HB2 ASN 51 77.630 6.717 1.019 373 HB3 ASN 51 HB1 ASN 51 76.036 6.512 0.292 374 HD21 ASN 51 HD21 ASN 51 77.706 4.778 -0.805 375 HD22 ASN 51 HD22 ASN 51 78.329 5.300 -2.296 376 H ASP 52 HN ASP 52 74.549 9.373 1.381 377 HA ASP 52 HA ASP 52 75.682 9.667 4.105 378 HB2 ASP 52 HB2 ASP 52 74.747 11.725 2.956 379 HB3 ASP 52 HB1 ASP 52 73.173 10.938 3.010 380 H ILE 53 HN ILE 53 74.355 8.956 5.866 381 HA ILE 53 HA ILE 53 72.139 7.142 5.141 382 HB ILE 53 HB ILE 53 74.408 6.424 7.024 383 HG12 ILE 53 HG12 ILE 53 73.721 5.328 4.274 384 HG13 ILE 53 HG11 ILE 53 75.074 6.404 4.617 385 HG21 ILE 53 HG21 ILE 53 72.102 4.784 5.946 386 HG22 ILE 53 HG22 ILE 53 72.143 5.490 7.563 387 HG23 ILE 53 HG23 ILE 53 73.313 4.253 7.111 388 HD11 ILE 53 HD11 ILE 53 74.668 3.563 5.541 389 HD12 ILE 53 HD12 ILE 53 75.797 4.643 6.360 390 HD13 ILE 53 HD13 ILE 53 76.033 4.245 4.657 391 H THR 54 HN THR 54 70.412 7.475 6.412 392 HA THR 54 HA THR 54 70.831 8.744 9.062 393 HB THR 54 HB THR 54 69.139 10.312 8.703 394 HG1 THR 54 HG1 THR 54 67.756 10.132 6.847 395 HG21 THR 54 HG21 THR 54 70.198 10.129 5.894 396 HG22 THR 54 HG22 THR 54 71.259 10.573 7.233 397 HG23 THR 54 HG23 THR 54 69.854 11.569 6.853 398 H VAL 55 HN VAL 55 69.378 8.222 10.648 399 HA VAL 55 HA VAL 55 67.533 5.962 10.098 400 HB VAL 55 HB VAL 55 69.448 5.063 11.250 401 HG11 VAL 55 HG11 VAL 55 69.069 7.133 13.423 402 HG12 VAL 55 HG12 VAL 55 70.209 7.357 12.096 403 HG13 VAL 55 HG13 VAL 55 70.413 6.013 13.216 404 HG21 VAL 55 HG21 VAL 55 67.416 5.575 13.432 405 HG22 VAL 55 HG22 VAL 55 68.398 4.132 13.174 406 HG23 VAL 55 HG23 VAL 55 67.074 4.506 12.072 407 H GLU 56 HN GLU 56 65.496 6.303 10.720 408 HA GLU 56 HA GLU 56 64.927 8.379 12.764 409 HB2 GLU 56 HB2 GLU 56 63.528 7.893 10.131 410 HB3 GLU 56 HB1 GLU 56 62.812 8.829 11.444 411 HG2 GLU 56 HG2 GLU 56 64.724 10.370 11.417 412 HG3 GLU 56 HG1 GLU 56 65.486 9.421 10.139 413 H GLN 57 HN GLN 57 62.323 8.124 13.124 414 HA GLN 57 HA GLN 57 61.751 6.352 14.982 415 HB2 GLN 57 HB2 GLN 57 59.878 6.842 12.657 416 HB3 GLN 57 HB1 GLN 57 59.412 6.254 14.252 417 HG2 GLN 57 HG2 GLN 57 60.775 8.903 13.722 418 HG3 GLN 57 HG1 GLN 57 59.046 8.700 13.987 419 HE21 GLN 57 HE21 GLN 57 61.539 9.859 15.624 420 HE22 GLN 57 HE22 GLN 57 61.221 9.277 17.186 421 H GLY 58 HN GLY 58 60.921 4.260 15.245 422 HA2 GLY 58 HA2 GLY 58 60.835 1.992 14.892 423 HA3 GLY 58 HA1 GLY 58 60.443 2.387 13.221 424 H THR 59 HN THR 59 62.174 2.734 11.734 425 HA THR 59 HA THR 59 64.886 2.455 12.199 426 HB THR 59 HB THR 59 64.590 -0.177 11.115 427 HG1 THR 59 HG1 THR 59 63.090 -1.094 12.242 428 HG21 THR 59 HG21 THR 59 66.479 0.413 12.460 429 HG22 THR 59 HG22 THR 59 65.602 -0.844 13.333 430 HG23 THR 59 HG23 THR 59 65.453 0.843 13.828 431 H LEU 60 HN LEU 60 63.531 4.036 10.598 432 HA LEU 60 HA LEU 60 63.339 3.017 7.897 433 HB2 LEU 60 HB2 LEU 60 63.096 5.765 9.128 434 HB3 LEU 60 HB1 LEU 60 63.045 5.521 7.386 435 HG LEU 60 HG LEU 60 61.220 3.993 9.258 436 HD11 LEU 60 HD11 LEU 60 60.899 6.433 9.610 437 HD12 LEU 60 HD12 LEU 60 59.501 5.693 8.830 438 HD13 LEU 60 HD13 LEU 60 60.648 6.634 7.877 439 HD21 LEU 60 HD21 LEU 60 61.265 4.598 6.285 440 HD22 LEU 60 HD22 LEU 60 59.790 4.081 7.096 441 HD23 LEU 60 HD23 LEU 60 61.196 3.025 7.080 442 H HIS 61 HN HIS 61 64.850 3.166 6.309 443 HA HIS 61 HA HIS 61 67.438 4.477 6.969 444 HB2 HIS 61 HB2 HIS 61 66.848 2.072 5.220 445 HB3 HIS 61 HB1 HIS 61 68.409 2.885 5.284 446 HD1 HIS 61 HD1 HIS 61 66.030 0.912 7.477 447 HD2 HIS 61 HD2 HIS 61 69.980 2.241 7.517 448 HE1 HIS 61 HE1 HIS 61 67.148 -0.224 9.444 449 H LEU 62 HN LEU 62 68.374 5.804 5.372 450 HA LEU 62 HA LEU 62 67.001 6.117 2.811 451 HB2 LEU 62 HB2 LEU 62 65.858 7.552 4.672 452 HB3 LEU 62 HB1 LEU 62 67.283 8.577 4.526 453 HG LEU 62 HG LEU 62 65.447 7.804 2.237 454 HD11 LEU 62 HD11 LEU 62 65.770 10.429 3.726 455 HD12 LEU 62 HD12 LEU 62 64.388 9.340 3.857 456 HD13 LEU 62 HD13 LEU 62 64.723 10.158 2.332 457 HD21 LEU 62 HD21 LEU 62 67.543 8.217 1.249 458 HD22 LEU 62 HD22 LEU 62 67.975 9.441 2.443 459 HD23 LEU 62 HD23 LEU 62 66.783 9.806 1.196 460 H LEU 63 HN LEU 63 68.696 6.011 1.458 461 HA LEU 63 HA LEU 63 71.229 7.300 2.194 462 HB2 LEU 63 HB2 LEU 63 70.465 5.102 0.319 463 HB3 LEU 63 HB1 LEU 63 71.888 6.057 -0.069 464 HG LEU 63 HG LEU 63 72.935 5.495 2.027 465 HD11 LEU 63 HD11 LEU 63 70.194 4.447 2.715 466 HD12 LEU 63 HD12 LEU 63 71.236 5.523 3.645 467 HD13 LEU 63 HD13 LEU 63 71.619 3.809 3.534 468 HD21 LEU 63 HD21 LEU 63 73.086 3.046 1.822 469 HD22 LEU 63 HD22 LEU 63 73.064 3.796 0.225 470 HD23 LEU 63 HD23 LEU 63 71.609 3.026 0.859 471 H THR 64 HN THR 64 71.898 9.109 1.335 472 HA THR 64 HA THR 64 70.386 10.242 -0.952 473 HB THR 64 HB THR 64 72.076 11.651 1.125 474 HG1 THR 64 HG1 THR 64 70.177 12.196 2.049 475 HG21 THR 64 HG21 THR 64 70.962 13.675 0.131 476 HG22 THR 64 HG22 THR 64 70.355 12.631 -1.156 477 HG23 THR 64 HG23 THR 64 72.091 12.863 -0.953 478 H LEU 65 HN LEU 65 71.474 9.604 -2.710 479 HA LEU 65 HA LEU 65 74.419 9.757 -2.783 480 HB2 LEU 65 HB2 LEU 65 72.313 8.501 -4.528 481 HB3 LEU 65 HB1 LEU 65 73.933 8.768 -5.158 482 HG LEU 65 HG LEU 65 73.489 6.475 -4.135 483 HD11 LEU 65 HD11 LEU 65 75.685 6.259 -3.352 484 HD12 LEU 65 HD12 LEU 65 75.705 7.871 -2.650 485 HD13 LEU 65 HD13 LEU 65 75.788 7.672 -4.397 486 HD21 LEU 65 HD21 LEU 65 73.696 7.983 -1.511 487 HD22 LEU 65 HD22 LEU 65 73.466 6.253 -1.739 488 HD23 LEU 65 HD23 LEU 65 72.178 7.376 -2.180 489 H HIS 66 HN HIS 66 75.451 11.425 -3.655 490 HA HIS 66 HA HIS 66 74.116 13.065 -5.713 491 HB2 HIS 66 HB2 HIS 66 74.030 14.012 -3.239 492 HB3 HIS 66 HB1 HIS 66 75.706 14.448 -3.559 493 HD1 HIS 66 HD1 HIS 66 75.831 15.568 -6.237 494 HD2 HIS 66 HD2 HIS 66 72.415 16.129 -3.921 495 HE1 HIS 66 HE1 HIS 66 74.609 17.540 -7.237 496 H LYS 67 HN LYS 67 75.641 14.414 -6.923 497 HA LYS 67 HA LYS 67 77.545 14.623 -8.207 498 HB2 LYS 67 HB2 LYS 67 79.043 13.649 -5.762 499 HB3 LYS 67 HB1 LYS 67 79.646 14.683 -7.053 500 HG2 LYS 67 HG2 LYS 67 77.362 15.509 -5.242 501 HG3 LYS 67 HG1 LYS 67 79.044 15.864 -4.870 502 HD2 LYS 67 HD2 LYS 67 79.267 17.104 -6.986 503 HD3 LYS 67 HD1 LYS 67 77.589 16.742 -7.386 504 HE2 LYS 67 HE2 LYS 67 76.872 17.906 -5.303 505 HE3 LYS 67 HE1 LYS 67 78.554 18.342 -5.002 506 HZ1 LYS 67 HZ1 LYS 67 78.143 20.128 -6.236 507 HZ2 LYS 67 HZ2 LYS 67 76.670 19.507 -6.810 508 HZ3 LYS 67 HZ3 LYS 67 78.126 19.097 -7.583 509 H VAL 68 HN VAL 68 76.110 12.240 -8.441 510 HA VAL 68 HA VAL 68 78.086 10.069 -8.522 511 HB VAL 68 HB VAL 68 75.779 9.720 -7.599 512 HG11 VAL 68 HG11 VAL 68 74.639 11.161 -9.323 513 HG12 VAL 68 HG12 VAL 68 73.900 9.576 -9.102 514 HG13 VAL 68 HG13 VAL 68 74.927 9.880 -10.500 515 HG21 VAL 68 HG21 VAL 68 76.575 8.097 -10.032 516 HG22 VAL 68 HG22 VAL 68 75.448 7.568 -8.783 517 HG23 VAL 68 HG23 VAL 68 77.143 7.843 -8.383 518 H THR 69 HN THR 69 78.957 9.274 -10.329 519 HA THR 69 HA THR 69 78.060 10.350 -12.950 520 HB THR 69 HB THR 69 80.373 10.369 -13.667 521 HG1 THR 69 HG1 THR 69 81.243 9.720 -11.094 522 HG21 THR 69 HG21 THR 69 81.207 12.151 -12.284 523 HG22 THR 69 HG22 THR 69 80.251 11.603 -10.906 524 HG23 THR 69 HG23 THR 69 79.449 12.299 -12.315 525 H LEU 70 HN LEU 70 80.076 8.650 -14.291 526 HA LEU 70 HA LEU 70 78.561 6.480 -15.017 527 HB2 LEU 70 HB2 LEU 70 81.572 6.696 -14.857 528 HB3 LEU 70 HB1 LEU 70 80.734 5.362 -15.644 529 HG LEU 70 HG LEU 70 80.282 8.271 -16.371 530 HD11 LEU 70 HD11 LEU 70 82.617 7.707 -16.819 531 HD12 LEU 70 HD12 LEU 70 81.730 7.789 -18.342 532 HD13 LEU 70 HD13 LEU 70 82.129 6.222 -17.636 533 HD21 LEU 70 HD21 LEU 70 79.379 5.611 -17.481 534 HD22 LEU 70 HD22 LEU 70 79.577 6.978 -18.575 535 HD23 LEU 70 HD23 LEU 70 78.448 7.089 -17.231 536 H GLU 71 HN GLU 71 80.453 6.883 -12.124 537 HA GLU 71 HA GLU 71 80.625 4.165 -11.355 538 HB2 GLU 71 HB2 GLU 71 81.009 5.067 -9.072 539 HB3 GLU 71 HB1 GLU 71 82.021 5.840 -10.289 540 HG2 GLU 71 HG2 GLU 71 80.300 7.682 -10.427 541 HG3 GLU 71 HG1 GLU 71 79.492 6.945 -9.044 542 H ASP 72 HN ASP 72 77.904 5.523 -12.161 543 HA ASP 72 HA ASP 72 76.139 5.352 -9.987 544 HB2 ASP 72 HB2 ASP 72 75.836 5.234 -12.973 545 HB3 ASP 72 HB1 ASP 72 74.449 4.829 -11.966 546 H ALA 73 HN ALA 73 77.342 2.854 -12.198 547 HA ALA 73 HA ALA 73 75.551 0.806 -11.650 548 HB1 ALA 73 HB1 ALA 73 77.460 -0.745 -12.107 549 HB2 ALA 73 HB2 ALA 73 78.543 0.647 -12.095 550 HB3 ALA 73 HB3 ALA 73 77.283 0.521 -13.322 551 H GLY 74 HN GLY 74 75.231 -0.615 -9.980 552 HA2 GLY 74 HA2 GLY 74 77.112 -1.049 -7.874 553 HA3 GLY 74 HA1 GLY 74 75.855 0.076 -7.372 554 H THR 75 HN THR 75 75.968 -2.158 -5.946 555 HA THR 75 HA THR 75 73.462 -3.496 -6.594 556 HB THR 75 HB THR 75 74.574 -5.766 -6.210 557 HG1 THR 75 HG1 THR 75 76.836 -5.685 -6.882 558 HG21 THR 75 HG21 THR 75 73.819 -4.851 -8.450 559 HG22 THR 75 HG22 THR 75 75.122 -6.034 -8.531 560 HG23 THR 75 HG23 THR 75 75.481 -4.317 -8.705 561 H VAL 76 HN VAL 76 72.477 -2.956 -4.695 562 HA VAL 76 HA VAL 76 73.967 -3.329 -2.179 563 HB VAL 76 HB VAL 76 71.179 -2.228 -2.526 564 HG11 VAL 76 HG11 VAL 76 71.738 -1.226 -0.286 565 HG12 VAL 76 HG12 VAL 76 73.212 -2.193 -0.281 566 HG13 VAL 76 HG13 VAL 76 71.637 -2.985 -0.277 567 HG21 VAL 76 HG21 VAL 76 72.482 -0.013 -2.101 568 HG22 VAL 76 HG22 VAL 76 72.525 -0.695 -3.726 569 HG23 VAL 76 HG23 VAL 76 73.897 -0.915 -2.642 570 H SER 77 HN SER 77 73.620 -4.942 -0.838 571 HA SER 77 HA SER 77 71.283 -6.705 -1.224 572 HB2 SER 77 HB2 SER 77 73.405 -7.619 -2.265 573 HB3 SER 77 HB1 SER 77 74.085 -7.678 -0.641 574 HG SER 77 HG SER 77 72.806 -9.300 -0.160 575 H PHE 78 HN PHE 78 70.617 -7.828 0.609 576 HA PHE 78 HA PHE 78 71.707 -6.889 3.202 577 HB2 PHE 78 HB2 PHE 78 68.787 -7.417 2.627 578 HB3 PHE 78 HB1 PHE 78 69.488 -6.669 4.063 579 HD1 PHE 78 HD1 PHE 78 71.100 -4.588 3.497 580 HD2 PHE 78 HD2 PHE 78 67.866 -5.966 1.034 581 HE1 PHE 78 HE1 PHE 78 70.973 -2.367 2.412 582 HE2 PHE 78 HE2 PHE 78 67.735 -3.742 -0.045 583 HZ PHE 78 HZ PHE 78 69.292 -1.939 0.646 584 H HIS 79 HN HIS 79 72.110 -8.464 4.642 585 HA HIS 79 HA HIS 79 71.206 -11.218 3.981 586 HB2 HIS 79 HB2 HIS 79 73.666 -10.831 3.831 587 HB3 HIS 79 HB1 HIS 79 73.664 -10.393 5.537 588 HD1 HIS 79 HD1 HIS 79 73.645 -12.278 7.227 589 HD2 HIS 79 HD2 HIS 79 72.889 -13.619 3.352 590 HE1 HIS 79 HE1 HIS 79 73.697 -14.809 7.323 591 H VAL 80 HN VAL 80 69.558 -11.716 5.226 592 HA VAL 80 HA VAL 80 69.651 -11.013 8.110 593 HB VAL 80 HB VAL 80 67.084 -11.757 6.729 594 HG11 VAL 80 HG11 VAL 80 67.446 -11.229 9.244 595 HG12 VAL 80 HG12 VAL 80 66.089 -10.456 8.423 596 HG13 VAL 80 HG13 VAL 80 67.570 -9.551 8.727 597 HG21 VAL 80 HG21 VAL 80 67.760 -10.172 5.130 598 HG22 VAL 80 HG22 VAL 80 68.621 -9.194 6.315 599 HG23 VAL 80 HG23 VAL 80 66.858 -9.189 6.282 600 H GLY 81 HN GLY 81 69.764 -12.724 9.468 601 HA2 GLY 81 HA2 GLY 81 70.286 -15.306 8.565 602 HA3 GLY 81 HA1 GLY 81 69.826 -14.906 10.214 603 H THR 82 HN THR 82 67.297 -13.755 8.540 604 HA THR 82 HA THR 82 65.811 -16.321 8.723 605 HB THR 82 HB THR 82 64.712 -14.931 10.220 606 HG1 THR 82 HG1 THR 82 63.036 -15.348 8.983 607 HG21 THR 82 HG21 THR 82 65.380 -12.666 8.334 608 HG22 THR 82 HG22 THR 82 66.067 -12.961 9.931 609 HG23 THR 82 HG23 THR 82 64.378 -12.482 9.774 610 H CYS 83 HN CYS 83 66.156 -13.363 6.750 611 HA CYS 83 HA CYS 83 65.236 -14.917 4.401 612 HB2 CYS 83 HB2 CYS 83 64.313 -12.115 5.069 613 HB3 CYS 83 HB1 CYS 83 63.854 -13.060 3.653 614 HG CYS 83 HG CYS 83 63.069 -13.915 6.566 615 H SER 84 HN SER 84 65.627 -13.594 2.332 616 HA SER 84 HA SER 84 68.128 -12.009 2.506 617 HB2 SER 84 HB2 SER 84 69.072 -13.221 0.640 618 HB3 SER 84 HB1 SER 84 68.626 -14.386 1.883 619 HG SER 84 HG SER 84 66.854 -13.658 -0.199 620 H SER 85 HN SER 85 68.496 -10.620 0.677 621 HA SER 85 HA SER 85 66.392 -10.289 -1.292 622 HB2 SER 85 HB2 SER 85 66.045 -7.868 -0.627 623 HB3 SER 85 HB1 SER 85 65.328 -9.065 0.448 624 HG SER 85 HG SER 85 67.615 -8.822 1.459 625 H GLU 86 HN GLU 86 66.899 -8.643 -2.886 626 HA GLU 86 HA GLU 86 69.681 -7.679 -2.935 627 HB2 GLU 86 HB2 GLU 86 68.415 -9.461 -5.026 628 HB3 GLU 86 HB1 GLU 86 69.868 -8.507 -5.314 629 HG2 GLU 86 HG2 GLU 86 71.021 -9.668 -3.489 630 HG3 GLU 86 HG1 GLU 86 69.561 -10.589 -3.130 631 H ALA 87 HN ALA 87 70.047 -6.040 -4.547 632 HA ALA 87 HA ALA 87 67.677 -4.864 -5.830 633 HB1 ALA 87 HB1 ALA 87 69.493 -3.409 -3.894 634 HB2 ALA 87 HB2 ALA 87 67.754 -3.664 -3.744 635 HB3 ALA 87 HB3 ALA 87 68.384 -2.600 -5.002 636 H GLN 88 HN GLN 88 68.154 -3.649 -7.666 637 HA GLN 88 HA GLN 88 70.984 -3.753 -8.566 638 HB2 GLN 88 HB2 GLN 88 68.438 -4.145 -10.143 639 HB3 GLN 88 HB1 GLN 88 70.037 -3.980 -10.866 640 HG2 GLN 88 HG2 GLN 88 70.824 -5.932 -9.588 641 HG3 GLN 88 HG1 GLN 88 69.232 -6.099 -8.855 642 HE21 GLN 88 HE21 GLN 88 70.790 -7.924 -10.768 643 HE22 GLN 88 HE22 GLN 88 69.705 -8.213 -12.040 644 H LEU 89 HN LEU 89 71.904 -1.959 -9.166 645 HA LEU 89 HA LEU 89 70.264 0.462 -9.691 646 HB2 LEU 89 HB2 LEU 89 71.573 0.769 -7.670 647 HB3 LEU 89 HB1 LEU 89 73.030 0.185 -8.469 648 HG LEU 89 HG LEU 89 72.981 2.132 -9.995 649 HD11 LEU 89 HD11 LEU 89 70.429 2.718 -8.489 650 HD12 LEU 89 HD12 LEU 89 70.694 2.686 -10.233 651 HD13 LEU 89 HD13 LEU 89 71.342 4.009 -9.268 652 HD21 LEU 89 HD21 LEU 89 74.161 2.260 -7.810 653 HD22 LEU 89 HD22 LEU 89 72.702 2.931 -7.084 654 HD23 LEU 89 HD23 LEU 89 73.558 3.832 -8.335 655 H LYS 90 HN LYS 90 70.284 1.013 -11.751 656 HA LYS 90 HA LYS 90 72.732 0.586 -13.364 657 HB2 LYS 90 HB2 LYS 90 69.875 -0.001 -14.182 658 HB3 LYS 90 HB1 LYS 90 71.260 -0.024 -15.272 659 HG2 LYS 90 HG2 LYS 90 72.318 -1.779 -13.893 660 HG3 LYS 90 HG1 LYS 90 70.923 -1.762 -12.810 661 HD2 LYS 90 HD2 LYS 90 69.456 -2.398 -14.697 662 HD3 LYS 90 HD1 LYS 90 70.860 -2.442 -15.765 663 HE2 LYS 90 HE2 LYS 90 71.873 -4.205 -14.377 664 HE3 LYS 90 HE1 LYS 90 70.483 -4.157 -13.293 665 HZ1 LYS 90 HZ1 LYS 90 69.782 -5.798 -14.654 666 HZ2 LYS 90 HZ2 LYS 90 70.716 -5.274 -15.973 667 HZ3 LYS 90 HZ3 LYS 90 69.248 -4.498 -15.604 668 H VAL 91 HN VAL 91 72.926 2.019 -15.169 669 HA VAL 91 HA VAL 91 71.375 4.531 -14.881 670 HB VAL 91 HB VAL 91 73.805 4.658 -14.228 671 HG11 VAL 91 HG11 VAL 91 74.421 2.993 -16.135 672 HG12 VAL 91 HG12 VAL 91 75.521 4.328 -15.793 673 HG13 VAL 91 HG13 VAL 91 74.423 4.425 -17.169 674 HG21 VAL 91 HG21 VAL 91 72.901 6.745 -14.804 675 HG22 VAL 91 HG22 VAL 91 72.617 6.279 -16.479 676 HG23 VAL 91 HG23 VAL 91 74.255 6.620 -15.924 677 H THR 92 HN THR 92 70.359 5.278 -16.649 678 HA THR 92 HA THR 92 70.390 3.634 -19.043 679 HB THR 92 HB THR 92 68.227 4.351 -18.286 680 HG1 THR 92 HG1 THR 92 69.149 4.784 -20.654 681 HG21 THR 92 HG21 THR 92 67.657 6.760 -18.141 682 HG22 THR 92 HG22 THR 92 69.337 7.163 -18.488 683 HG23 THR 92 HG23 THR 92 68.924 6.319 -16.996 684 H ALA 93 HN ALA 93 70.406 4.712 -21.196 685 HA ALA 93 HA ALA 93 71.353 6.039 -22.811 686 HB1 ALA 93 HB1 ALA 93 72.397 7.930 -20.718 687 HB2 ALA 93 HB2 ALA 93 70.681 7.894 -21.120 688 HB3 ALA 93 HB3 ALA 93 71.871 8.273 -22.363 689 H GLY 94 HN GLY 94 72.806 3.998 -21.064 690 HA2 GLY 94 HA2 GLY 94 75.539 4.655 -22.015 691 HA3 GLY 94 HA1 GLY 94 75.275 4.019 -20.392
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