NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
646229 | 6ucj | 50007 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 THR 1 HT1 THR 1 -3.217 -4.259 -1.142 2 H2 THR 1 HT2 THR 1 -2.866 -4.525 0.500 3 H3 THR 1 HT3 THR 1 -3.139 -5.842 -0.538 4 HA THR 1 HA THR 1 -0.822 -5.729 -0.212 5 HB THR 1 HB THR 1 -2.063 -5.492 -2.709 6 HG1 THR 1 HG1 THR 1 -0.412 -6.744 -3.282 7 HG21 THR 1 HG21 THR 1 -0.547 -4.182 -4.075 8 HG22 THR 1 HG22 THR 1 0.441 -3.783 -2.672 9 HG23 THR 1 HG23 THR 1 -1.198 -3.142 -2.810 10 HA PRO 2 HA PRO 2 0.924 -1.856 0.967 11 HB2 PRO 2 HB2 PRO 2 3.538 -2.122 0.240 12 HB3 PRO 2 HB1 PRO 2 2.815 -3.019 1.589 13 HG2 PRO 2 HG2 PRO 2 3.421 -3.925 -1.177 14 HG3 PRO 2 HG1 PRO 2 3.572 -4.796 0.358 15 HD2 PRO 2 HD2 PRO 2 1.475 -5.145 -1.398 16 HD3 PRO 2 HD1 PRO 2 1.366 -5.461 0.347 17 H ILE 3 HN ILE 3 1.728 0.185 0.224 18 HA ILE 3 HA ILE 3 1.857 0.487 -2.713 19 HB ILE 3 HB ILE 3 -0.350 1.223 -1.618 20 HG12 ILE 3 HG12 ILE 3 -0.191 3.493 -2.908 21 HG13 ILE 3 HG11 ILE 3 1.422 2.936 -3.351 22 HG21 ILE 3 HG21 ILE 3 0.891 2.298 0.334 23 HG22 ILE 3 HG22 ILE 3 -0.354 3.295 -0.418 24 HG23 ILE 3 HG23 ILE 3 1.347 3.586 -0.781 25 HD11 ILE 3 HD11 ILE 3 -1.224 1.596 -3.943 26 HD12 ILE 3 HD12 ILE 3 0.322 0.767 -4.121 27 HD13 ILE 3 HD13 ILE 3 -0.032 2.191 -5.098 28 H GLU 4 HN GLU 4 3.302 2.007 -3.486 29 HA GLU 4 HA GLU 4 5.655 2.478 -2.126 30 HB2 GLU 4 HB2 GLU 4 6.151 4.163 -3.814 31 HB3 GLU 4 HB1 GLU 4 5.341 2.791 -4.570 32 HG2 GLU 4 HG2 GLU 4 3.181 4.010 -4.412 33 HG3 GLU 4 HG1 GLU 4 4.034 5.396 -3.735 34 H SER 5 HN SER 5 6.458 4.055 -0.808 35 HA SER 5 HA SER 5 4.589 5.569 0.743 36 HB2 SER 5 HB2 SER 5 6.514 6.314 1.989 37 HB3 SER 5 HB1 SER 5 6.732 4.605 1.622 38 HG SER 5 HG SER 5 8.554 5.274 0.803 39 H HIS 6 HN HIS 6 4.737 7.911 1.078 40 HA HIS 6 HA HIS 6 5.305 9.317 -1.461 41 HB2 HIS 6 HB2 HIS 6 3.600 10.933 -0.790 42 HB3 HIS 6 HB1 HIS 6 2.923 9.304 -0.784 43 HD1 HIS 6 HD1 HIS 6 4.146 12.005 1.558 44 HD2 HIS 6 HD2 HIS 6 2.129 8.361 1.751 45 HE1 HIS 6 HE1 HIS 6 3.292 11.783 3.932 46 HE2 HIS 6 HE2 HIS 6 2.061 9.567 4.066 47 H GLN 7 HN GLN 7 7.204 8.738 0.725 48 HA GLN 7 HA GLN 7 7.668 10.938 2.389 49 HB2 GLN 7 HB2 GLN 7 8.816 8.675 2.454 50 HB3 GLN 7 HB1 GLN 7 9.832 9.247 1.130 51 HG2 GLN 7 HG2 GLN 7 10.508 11.192 2.529 52 HG3 GLN 7 HG1 GLN 7 9.560 10.534 3.862 53 HE21 GLN 7 HE21 GLN 7 10.306 8.465 4.818 54 HE22 GLN 7 HE22 GLN 7 11.915 7.964 4.613 55 H VAL 8 HN VAL 8 8.617 12.888 2.122 56 HA VAL 8 HA VAL 8 9.800 13.515 -0.510 57 HB VAL 8 HB VAL 8 7.498 14.397 -0.434 58 HG11 VAL 8 HG11 VAL 8 7.501 14.615 2.098 59 HG12 VAL 8 HG12 VAL 8 6.818 15.990 1.231 60 HG13 VAL 8 HG13 VAL 8 8.450 16.087 1.892 61 HG21 VAL 8 HG21 VAL 8 9.579 16.584 -0.124 62 HG22 VAL 8 HG22 VAL 8 8.053 16.706 -0.999 63 HG23 VAL 8 HG23 VAL 8 9.330 15.647 -1.597 64 H GLU 9 HN GLU 9 11.550 14.889 -0.475 65 HA GLU 9 HA GLU 9 12.361 16.004 2.128 66 HB2 GLU 9 HB2 GLU 9 14.772 15.305 1.262 67 HB3 GLU 9 HB1 GLU 9 13.776 14.189 2.196 68 HG2 GLU 9 HG2 GLU 9 14.763 13.162 0.129 69 HG3 GLU 9 HG1 GLU 9 13.003 13.094 0.176 70 H LYS 10 HN LYS 10 14.402 17.431 1.755 71 HA LYS 10 HA LYS 10 14.200 18.857 -0.817 72 HB2 LYS 10 HB2 LYS 10 14.482 20.997 0.606 73 HB3 LYS 10 HB1 LYS 10 12.883 20.255 0.540 74 HG2 LYS 10 HG2 LYS 10 14.668 19.233 2.671 75 HG3 LYS 10 HG1 LYS 10 14.139 20.905 2.864 76 HD2 LYS 10 HD2 LYS 10 11.776 20.129 2.484 77 HD3 LYS 10 HD1 LYS 10 12.372 18.469 2.511 78 HE2 LYS 10 HE2 LYS 10 13.264 18.822 4.784 79 HE3 LYS 10 HE1 LYS 10 12.670 20.482 4.760 80 HZ1 LYS 10 HZ1 LYS 10 10.835 18.235 4.245 81 HZ2 LYS 10 HZ2 LYS 10 10.483 19.795 4.818 82 HZ3 LYS 10 HZ3 LYS 10 11.233 18.662 5.838 83 H ARG 11 HN ARG 11 16.041 20.495 -0.999 84 HA ARG 11 HA ARG 11 18.488 19.315 0.158 85 HB2 ARG 11 HB2 ARG 11 19.523 20.488 -1.989 86 HB3 ARG 11 HB1 ARG 11 18.860 18.862 -2.058 87 HG2 ARG 11 HG2 ARG 11 17.946 19.972 -3.941 88 HG3 ARG 11 HG1 ARG 11 16.636 19.980 -2.773 89 HD2 ARG 11 HD2 ARG 11 18.564 22.282 -2.856 90 HD3 ARG 11 HD1 ARG 11 17.278 22.187 -4.050 91 HE ARG 11 HE ARG 11 16.976 22.775 -1.232 92 HH11 ARG 11 HH11 ARG 11 15.432 21.608 -4.135 93 HH12 ARG 11 HH12 ARG 11 13.842 22.020 -3.595 94 HH21 ARG 11 HH21 ARG 11 14.887 23.299 -0.554 95 HH22 ARG 11 HH22 ARG 11 13.532 22.969 -1.582 96 H LYS 12 HN LYS 12 17.681 20.963 1.871 97 HA LYS 12 HA LYS 12 17.861 23.714 1.549 98 HB2 LYS 12 HB2 LYS 12 18.002 23.859 3.880 99 HB3 LYS 12 HB1 LYS 12 17.218 22.298 3.633 100 HG2 LYS 12 HG2 LYS 12 19.564 21.274 3.692 101 HG3 LYS 12 HG1 LYS 12 20.118 22.834 4.300 102 HD2 LYS 12 HD2 LYS 12 19.679 21.639 6.273 103 HD3 LYS 12 HD1 LYS 12 18.200 22.572 6.045 104 HE2 LYS 12 HE2 LYS 12 17.589 20.277 6.556 105 HE3 LYS 12 HE1 LYS 12 17.202 20.596 4.865 106 HZ1 LYS 12 HZ1 LYS 12 18.511 18.468 5.534 107 HZ2 LYS 12 HZ2 LYS 12 19.846 19.518 5.547 108 HZ3 LYS 12 HZ3 LYS 12 18.933 19.318 4.129 109 H CYS 13 HN CYS 13 19.553 25.220 1.995 110 HA CYS 13 HA CYS 13 22.124 24.338 0.974 111 HB2 CYS 13 HB2 CYS 13 20.652 26.760 0.972 112 HB3 CYS 13 HB1 CYS 13 22.141 27.070 1.863 113 H ASN 14 HN ASN 14 22.993 23.054 2.617 114 HA ASN 14 HA ASN 14 23.781 24.540 5.049 115 HB2 ASN 14 HB2 ASN 14 22.005 22.673 5.318 116 HB3 ASN 14 HB1 ASN 14 23.349 21.564 5.044 117 HD21 ASN 14 HD21 ASN 14 23.500 20.766 7.217 118 HD22 ASN 14 HD22 ASN 14 23.941 21.756 8.524 119 H THR 15 HN THR 15 25.214 24.173 2.494 120 HA THR 15 HA THR 15 27.520 22.608 3.490 121 HB THR 15 HB THR 15 26.368 21.688 1.439 122 HG1 THR 15 HG1 THR 15 28.367 21.433 0.347 123 HG21 THR 15 HG21 THR 15 26.496 22.848 -0.628 124 HG22 THR 15 HG22 THR 15 27.619 24.041 0.021 125 HG23 THR 15 HG23 THR 15 25.930 24.053 0.529 126 H ALA 16 HN ALA 16 29.636 23.382 2.753 127 HA ALA 16 HA ALA 16 30.021 26.110 3.331 128 HB1 ALA 16 HB1 ALA 16 31.759 23.930 2.232 129 HB2 ALA 16 HB2 ALA 16 31.893 24.802 3.759 130 HB3 ALA 16 HB3 ALA 16 32.350 25.591 2.250 131 H THR 17 HN THR 17 29.829 24.375 0.250 132 HA THR 17 HA THR 17 30.705 26.334 -1.498 133 HB THR 17 HB THR 17 28.398 24.414 -1.901 134 HG1 THR 17 HG1 THR 17 29.889 22.973 -2.235 135 HG21 THR 17 HG21 THR 17 29.005 24.675 -4.310 136 HG22 THR 17 HG22 THR 17 30.124 25.960 -3.854 137 HG23 THR 17 HG23 THR 17 28.392 26.165 -3.592 138 H CYS 18 HN CYS 18 27.525 25.978 0.018 139 HA CYS 18 HA CYS 18 26.221 28.047 -1.395 140 HB2 CYS 18 HB2 CYS 18 25.326 26.197 0.285 141 HB3 CYS 18 HB1 CYS 18 25.516 27.505 1.454 142 H ALA 19 HN ALA 19 28.439 28.052 1.291 143 HA ALA 19 HA ALA 19 27.893 30.575 2.392 144 HB1 ALA 19 HB1 ALA 19 29.548 28.682 3.145 145 HB2 ALA 19 HB2 ALA 19 29.917 30.366 3.517 146 HB3 ALA 19 HB3 ALA 19 30.708 29.570 2.157 147 H THR 20 HN THR 20 29.948 29.619 -0.339 148 HA THR 20 HA THR 20 31.096 32.136 -0.851 149 HB THR 20 HB THR 20 30.391 29.923 -2.796 150 HG1 THR 20 HG1 THR 20 31.838 29.459 -1.003 151 HG21 THR 20 HG21 THR 20 32.277 30.988 -4.118 152 HG22 THR 20 HG22 THR 20 32.161 32.365 -3.022 153 HG23 THR 20 HG23 THR 20 30.790 31.932 -4.043 154 H GLN 21 HN GLN 21 28.048 30.679 -1.880 155 HA GLN 21 HA GLN 21 27.220 32.561 -3.753 156 HB2 GLN 21 HB2 GLN 21 26.062 30.403 -3.207 157 HB3 GLN 21 HB1 GLN 21 25.426 31.173 -1.753 158 HG2 GLN 21 HG2 GLN 21 24.323 32.888 -3.109 159 HG3 GLN 21 HG1 GLN 21 25.002 32.187 -4.577 160 HE21 GLN 21 HE21 GLN 21 22.097 32.447 -3.647 161 HE22 GLN 21 HE22 GLN 21 21.485 30.867 -3.745 162 H ARG 22 HN ARG 22 27.120 32.700 -0.219 163 HA ARG 22 HA ARG 22 25.458 35.001 -0.068 164 HB2 ARG 22 HB2 ARG 22 25.731 34.875 2.198 165 HB3 ARG 22 HB1 ARG 22 26.249 33.249 1.778 166 HG2 ARG 22 HG2 ARG 22 28.017 33.869 3.117 167 HG3 ARG 22 HG1 ARG 22 28.632 34.457 1.581 168 HD2 ARG 22 HD2 ARG 22 28.741 36.520 2.475 169 HD3 ARG 22 HD1 ARG 22 26.985 36.515 2.594 170 HE ARG 22 HE ARG 22 27.186 36.111 4.873 171 HH11 ARG 22 HH11 ARG 22 30.227 35.531 3.266 172 HH12 ARG 22 HH12 ARG 22 31.107 35.344 4.742 173 HH21 ARG 22 HH21 ARG 22 28.361 35.862 6.786 174 HH22 ARG 22 HH22 ARG 22 30.060 35.529 6.724 175 H LEU 23 HN LEU 23 28.843 34.542 -0.701 176 HA LEU 23 HA LEU 23 29.802 37.104 -0.016 177 HB2 LEU 23 HB2 LEU 23 31.263 35.173 -0.588 178 HB3 LEU 23 HB1 LEU 23 30.754 35.319 -2.270 179 HG LEU 23 HG LEU 23 31.592 37.690 -2.249 180 HD11 LEU 23 HD11 LEU 23 31.568 38.232 0.077 181 HD12 LEU 23 HD12 LEU 23 33.271 38.160 -0.374 182 HD13 LEU 23 HD13 LEU 23 32.530 36.813 0.491 183 HD21 LEU 23 HD21 LEU 23 33.895 37.068 -2.555 184 HD22 LEU 23 HD22 LEU 23 32.927 35.679 -3.048 185 HD23 LEU 23 HD23 LEU 23 33.726 35.683 -1.476 186 H ALA 24 HN ALA 24 28.288 35.848 -2.950 187 HA ALA 24 HA ALA 24 28.642 38.130 -4.577 188 HB1 ALA 24 HB1 ALA 24 26.168 36.453 -4.785 189 HB2 ALA 24 HB2 ALA 24 27.733 35.717 -5.130 190 HB3 ALA 24 HB3 ALA 24 27.187 37.108 -6.067 191 H ASN 25 HN ASN 25 26.174 37.238 -2.223 192 HA ASN 25 HA ASN 25 24.389 39.381 -2.743 193 HB2 ASN 25 HB2 ASN 25 24.845 37.657 -0.305 194 HB3 ASN 25 HB1 ASN 25 23.566 38.865 -0.406 195 HD21 ASN 25 HD21 ASN 25 22.090 38.601 -2.438 196 HD22 ASN 25 HD22 ASN 25 21.719 37.010 -2.901 197 H PHE 26 HN PHE 26 27.381 39.156 -0.999 198 HA PHE 26 HA PHE 26 27.053 41.391 0.718 199 HB2 PHE 26 HB2 PHE 26 28.820 39.637 0.969 200 HB3 PHE 26 HB1 PHE 26 29.637 40.321 -0.436 201 HD1 PHE 26 HD1 PHE 26 28.426 41.107 2.997 202 HD2 PHE 26 HD2 PHE 26 30.973 42.277 -0.257 203 HE1 PHE 26 HE1 PHE 26 29.485 42.821 4.443 204 HE2 PHE 26 HE2 PHE 26 32.033 43.991 1.188 205 HZ PHE 26 HZ PHE 26 31.289 44.263 3.539 206 H LEU 27 HN LEU 27 28.230 41.050 -2.601 207 HA LEU 27 HA LEU 27 29.268 43.638 -2.907 208 HB2 LEU 27 HB2 LEU 27 29.675 41.792 -4.505 209 HB3 LEU 27 HB1 LEU 27 27.984 41.818 -4.974 210 HG LEU 27 HG LEU 27 29.727 43.015 -6.484 211 HD11 LEU 27 HD11 LEU 27 27.415 44.798 -5.754 212 HD12 LEU 27 HD12 LEU 27 27.121 43.204 -6.449 213 HD13 LEU 27 HD13 LEU 27 28.060 44.396 -7.344 214 HD21 LEU 27 HD21 LEU 27 30.653 44.276 -4.413 215 HD22 LEU 27 HD22 LEU 27 29.259 45.336 -4.616 216 HD23 LEU 27 HD23 LEU 27 30.443 45.180 -5.912 217 H VAL 28 HN VAL 28 26.003 42.358 -3.470 218 HA VAL 28 HA VAL 28 24.960 44.941 -4.262 219 HB VAL 28 HB VAL 28 22.773 43.819 -4.237 220 HG11 VAL 28 HG11 VAL 28 24.437 43.566 -6.146 221 HG12 VAL 28 HG12 VAL 28 23.206 42.308 -6.045 222 HG13 VAL 28 HG13 VAL 28 24.843 41.988 -5.471 223 HG21 VAL 28 HG21 VAL 28 24.321 41.412 -3.230 224 HG22 VAL 28 HG22 VAL 28 22.604 41.455 -3.625 225 HG23 VAL 28 HG23 VAL 28 23.215 42.376 -2.252 226 H HIS 29 HN HIS 29 25.258 43.097 -1.310 227 HA HIS 29 HA HIS 29 23.404 44.665 0.209 228 HB2 HIS 29 HB2 HIS 29 24.060 42.369 0.862 229 HB3 HIS 29 HB1 HIS 29 25.700 42.939 1.169 230 HD1 HIS 29 HD1 HIS 29 22.143 43.727 2.307 231 HD2 HIS 29 HD2 HIS 29 26.054 43.891 3.741 232 HE1 HIS 29 HE1 HIS 29 21.989 44.458 4.728 233 HE2 HIS 29 HE2 HIS 29 24.365 44.562 5.616 234 H SER 30 HN SER 30 26.734 44.963 -0.687 235 HA SER 30 HA SER 30 26.947 47.366 1.018 236 HB2 SER 30 HB2 SER 30 28.530 45.590 1.690 237 HB3 SER 30 HB1 SER 30 29.210 45.592 0.065 238 HG SER 30 HG SER 30 30.378 47.214 0.679 239 H SER 31 HN SER 31 26.045 46.857 -1.879 240 HA SER 31 HA SER 31 27.939 47.973 -3.642 241 HB2 SER 31 HB2 SER 31 26.003 46.746 -4.460 242 HB3 SER 31 HB1 SER 31 24.918 47.959 -3.789 243 HG SER 31 HG SER 31 25.520 48.135 -6.101 244 H ASN 32 HN ASN 32 25.467 49.449 -1.589 245 HA ASN 32 HA ASN 32 25.637 52.060 -2.671 246 HB2 ASN 32 HB2 ASN 32 24.608 52.739 -0.490 247 HB3 ASN 32 HB1 ASN 32 23.741 51.450 -1.323 248 HD21 ASN 32 HD21 ASN 32 24.831 52.317 1.704 249 HD22 ASN 32 HD22 ASN 32 24.990 50.772 2.389 250 H ASN 33 HN ASN 33 27.291 50.472 0.034 251 HA ASN 33 HA ASN 33 28.680 52.778 0.901 252 HB2 ASN 33 HB2 ASN 33 29.242 49.830 1.259 253 HB3 ASN 33 HB1 ASN 33 30.238 51.086 1.993 254 HD21 ASN 33 HD21 ASN 33 28.727 52.864 3.166 255 HD22 ASN 33 HD22 ASN 33 27.510 52.203 4.147 256 H PHE 34 HN PHE 34 29.389 50.238 -1.406 257 HA PHE 34 HA PHE 34 32.054 50.618 -1.963 258 HB2 PHE 34 HB2 PHE 34 30.677 48.891 -3.050 259 HB3 PHE 34 HB1 PHE 34 29.854 50.137 -3.988 260 HD1 PHE 34 HD1 PHE 34 33.231 48.701 -3.283 261 HD2 PHE 34 HD2 PHE 34 30.772 50.928 -6.013 262 HE1 PHE 34 HE1 PHE 34 35.042 48.626 -4.976 263 HE2 PHE 34 HE2 PHE 34 32.584 50.853 -7.705 264 HZ PHE 34 HZ PHE 34 34.719 49.703 -7.186 265 H GLY 35 HN GLY 35 29.305 52.520 -3.140 266 HA2 GLY 35 HA2 GLY 35 30.705 54.198 -4.919 267 HA3 GLY 35 HA1 GLY 35 29.192 54.603 -4.106 268 H ALA 36 HN ALA 36 29.858 54.684 -1.479 269 HA ALA 36 HA ALA 36 31.250 57.171 -1.296 270 HB1 ALA 36 HB1 ALA 36 31.031 56.693 1.221 271 HB2 ALA 36 HB2 ALA 36 30.137 55.251 0.742 272 HB3 ALA 36 HB3 ALA 36 29.538 56.849 0.297 273 H ILE 37 HN ILE 37 32.246 53.869 -1.139 274 HA ILE 37 HA ILE 37 34.598 54.259 0.440 275 HB ILE 37 HB ILE 37 33.655 52.059 -1.384 276 HG12 ILE 37 HG12 ILE 37 34.291 52.087 1.580 277 HG13 ILE 37 HG11 ILE 37 32.687 52.438 0.938 278 HG21 ILE 37 HG21 ILE 37 35.670 50.801 -0.434 279 HG22 ILE 37 HG22 ILE 37 36.311 52.376 0.032 280 HG23 ILE 37 HG23 ILE 37 36.028 52.007 -1.669 281 HD11 ILE 37 HD11 ILE 37 34.161 49.900 0.214 282 HD12 ILE 37 HD12 ILE 37 32.439 50.248 0.060 283 HD13 ILE 37 HD13 ILE 37 33.149 50.008 1.655 284 H LEU 38 HN LEU 38 33.951 54.124 -3.051 285 HA LEU 38 HA LEU 38 36.683 54.361 -3.829 286 HB2 LEU 38 HB2 LEU 38 35.911 54.497 -6.033 287 HB3 LEU 38 HB1 LEU 38 34.672 53.538 -5.228 288 HG LEU 38 HG LEU 38 33.710 56.059 -4.817 289 HD11 LEU 38 HD11 LEU 38 35.628 56.899 -6.281 290 HD12 LEU 38 HD12 LEU 38 34.011 57.396 -6.778 291 HD13 LEU 38 HD13 LEU 38 34.831 56.086 -7.627 292 HD21 LEU 38 HD21 LEU 38 32.067 55.503 -6.470 293 HD22 LEU 38 HD22 LEU 38 32.608 53.972 -5.782 294 HD23 LEU 38 HD23 LEU 38 33.209 54.492 -7.356 295 H SER 39 HN SER 39 34.357 56.642 -2.707 296 HA SER 39 HA SER 39 35.340 58.988 -3.956 297 HB2 SER 39 HB2 SER 39 33.166 58.918 -2.816 298 HB3 SER 39 HB1 SER 39 33.974 58.650 -1.274 299 HG SER 39 HG SER 39 33.472 60.949 -2.515 300 H SER 40 HN SER 40 36.195 57.340 -0.939 301 HA SER 40 HA SER 40 38.264 59.330 -0.376 302 HB2 SER 40 HB2 SER 40 37.352 56.886 1.157 303 HB3 SER 40 HB1 SER 40 38.605 57.998 1.699 304 HG SER 40 HG SER 40 36.955 59.671 1.444 305 H THR 41 HN THR 41 38.341 57.349 -2.679 306 HA THR 41 HA THR 41 40.229 55.336 -2.224 307 HB THR 41 HB THR 41 38.884 55.587 -4.304 308 HG1 THR 41 HG1 THR 41 40.556 54.904 -5.637 309 HG21 THR 41 HG21 THR 41 39.595 57.186 -6.001 310 HG22 THR 41 HG22 THR 41 40.888 57.766 -4.951 311 HG23 THR 41 HG23 THR 41 39.202 58.051 -4.515 312 H ASN 42 HN ASN 42 40.614 58.773 -2.437 313 HA ASN 42 HA ASN 42 43.468 58.646 -2.956 314 HB2 ASN 42 HB2 ASN 42 43.406 61.055 -2.850 315 HB3 ASN 42 HB1 ASN 42 42.025 60.506 -3.797 316 HD21 ASN 42 HD21 ASN 42 41.858 63.039 -2.631 317 HD22 ASN 42 HD22 ASN 42 40.763 63.004 -1.334 318 H VAL 43 HN VAL 43 41.920 57.663 -0.362 319 HA VAL 43 HA VAL 43 43.327 59.189 1.676 320 HB VAL 43 HB VAL 43 40.934 58.159 1.815 321 HG11 VAL 43 HG11 VAL 43 42.520 55.798 2.840 322 HG12 VAL 43 HG12 VAL 43 41.889 55.853 1.194 323 HG13 VAL 43 HG13 VAL 43 40.782 55.911 2.566 324 HG21 VAL 43 HG21 VAL 43 43.047 58.024 3.979 325 HG22 VAL 43 HG22 VAL 43 41.339 57.733 4.305 326 HG23 VAL 43 HG23 VAL 43 41.865 59.302 3.697 327 H GLY 44 HN GLY 44 44.550 57.185 -0.431 328 HA2 GLY 44 HA2 GLY 44 46.587 56.066 -0.379 329 HA3 GLY 44 HA1 GLY 44 46.584 56.198 1.376 330 H SER 45 HN SER 45 43.729 54.959 -0.122 331 HA SER 45 HA SER 45 44.505 52.218 0.677 332 HB2 SER 45 HB2 SER 45 42.181 51.829 1.302 333 HB3 SER 45 HB1 SER 45 42.806 53.223 2.179 334 HG SER 45 HG SER 45 40.692 53.475 1.141 335 H ASN 46 HN ASN 46 44.666 53.647 -1.958 336 HA ASN 46 HA ASN 46 42.699 52.150 -3.545 337 HB2 ASN 46 HB2 ASN 46 43.425 53.544 -5.410 338 HB3 ASN 46 HB1 ASN 46 43.015 54.556 -4.026 339 HD21 ASN 46 HD21 ASN 46 44.656 55.810 -5.775 340 HD22 ASN 46 HD22 ASN 46 46.263 55.831 -5.228 341 H THR 47 HN THR 47 45.070 50.944 -2.153 342 HA THR 47 HA THR 47 46.769 50.113 -4.381 343 HB THR 47 HB THR 47 47.399 48.642 -2.053 344 HG1 THR 47 HG1 THR 47 47.706 50.532 -0.662 345 HG21 THR 47 HG21 THR 47 48.951 49.546 -3.767 346 HG22 THR 47 HG22 THR 47 49.440 49.990 -2.131 347 HG23 THR 47 HG23 THR 47 48.639 51.174 -3.164 348 H TYR 48 HN TYR 48 43.844 49.342 -4.053 349 HA TYR 48 HA TYR 48 44.248 46.494 -4.597 350 HB2 TYR 48 HB2 TYR 48 42.688 45.712 -3.029 351 HB3 TYR 48 HB1 TYR 48 43.610 46.913 -2.124 352 HD1 TYR 48 HD1 TYR 48 40.357 45.863 -3.059 353 HD2 TYR 48 HD2 TYR 48 42.680 49.383 -2.246 354 HE1 TYR 48 HE1 TYR 48 38.274 47.138 -2.630 355 HE2 TYR 48 HE2 TYR 48 40.597 50.659 -1.818 356 HH TYR 48 HH TYR 48 37.511 49.469 -2.647 357 H GLY 49 HN GLY 49 43.432 49.093 -5.998 358 HA2 GLY 49 HA2 GLY 49 40.704 48.968 -6.698 359 HA3 GLY 49 HA1 GLY 49 41.970 49.731 -7.654 360 H LYS 50 HN LYS 50 39.605 47.904 -8.286 361 HA LYS 50 HA LYS 50 40.602 45.423 -9.219 362 HB2 LYS 50 HB2 LYS 50 38.196 47.066 -10.020 363 HB3 LYS 50 HB1 LYS 50 38.524 45.454 -10.657 364 HG2 LYS 50 HG2 LYS 50 38.628 44.622 -8.278 365 HG3 LYS 50 HG1 LYS 50 38.070 46.213 -7.759 366 HD2 LYS 50 HD2 LYS 50 36.574 44.508 -9.765 367 HD3 LYS 50 HD1 LYS 50 36.236 44.483 -8.034 368 HE2 LYS 50 HE2 LYS 50 36.113 46.936 -9.816 369 HE3 LYS 50 HE1 LYS 50 34.722 46.041 -9.206 370 HZ1 LYS 50 HZ1 LYS 50 35.673 46.485 -6.925 371 HZ2 LYS 50 HZ2 LYS 50 35.016 47.823 -7.740 372 HZ3 LYS 50 HZ3 LYS 50 36.700 47.612 -7.667 373 H ARG 51 HN ARG 51 40.327 48.612 -10.698 374 HA ARG 51 HA ARG 51 40.817 48.014 -13.356 375 HB2 ARG 51 HB2 ARG 51 41.591 50.275 -13.606 376 HB3 ARG 51 HB1 ARG 51 40.302 50.283 -12.402 377 HG2 ARG 51 HG2 ARG 51 42.054 50.166 -10.609 378 HG3 ARG 51 HG1 ARG 51 43.285 50.340 -11.861 379 HD2 ARG 51 HD2 ARG 51 42.253 52.485 -12.553 380 HD3 ARG 51 HD1 ARG 51 41.071 52.321 -11.259 381 HE ARG 51 HE ARG 51 43.841 53.111 -10.981 382 HH11 ARG 51 HH11 ARG 51 41.051 51.731 -9.406 383 HH12 ARG 51 HH12 ARG 51 41.577 52.181 -7.822 384 HH21 ARG 51 HH21 ARG 51 44.501 53.687 -8.899 385 HH22 ARG 51 HH22 ARG 51 43.517 53.280 -7.533 386 H ASN 52 HN ASN 52 42.984 47.846 -10.650 387 HA ASN 52 HA ASN 52 45.472 48.089 -11.863 388 HB2 ASN 52 HB2 ASN 52 44.715 47.566 -9.363 389 HB3 ASN 52 HB1 ASN 52 45.100 45.918 -9.856 390 HD21 ASN 52 HD21 ASN 52 47.246 46.715 -11.730 391 HD22 ASN 52 HD22 ASN 52 48.544 47.239 -10.771 392 H ALA 53 HN ALA 53 43.191 45.431 -11.932 393 HA ALA 53 HA ALA 53 44.909 43.425 -12.938 394 HB1 ALA 53 HB1 ALA 53 41.929 43.789 -13.326 395 HB2 ALA 53 HB2 ALA 53 42.704 42.911 -12.007 396 HB3 ALA 53 HB3 ALA 53 42.829 42.309 -13.660 397 H VAL 54 HN VAL 54 42.891 45.855 -14.569 398 HA VAL 54 HA VAL 54 43.528 44.899 -17.200 399 HB VAL 54 HB VAL 54 41.561 46.485 -16.207 400 HG11 VAL 54 HG11 VAL 54 43.353 48.372 -17.754 401 HG12 VAL 54 HG12 VAL 54 43.309 48.341 -15.991 402 HG13 VAL 54 HG13 VAL 54 41.857 48.750 -16.902 403 HG21 VAL 54 HG21 VAL 54 41.129 47.040 -18.652 404 HG22 VAL 54 HG22 VAL 54 41.380 45.329 -18.305 405 HG23 VAL 54 HG23 VAL 54 42.681 46.285 -19.014 406 H GLU 55 HN GLU 55 45.067 46.999 -14.928 407 HA GLU 55 HA GLU 55 46.612 48.455 -16.878 408 HB2 GLU 55 HB2 GLU 55 46.009 49.264 -14.534 409 HB3 GLU 55 HB1 GLU 55 47.256 48.165 -13.943 410 HG2 GLU 55 HG2 GLU 55 47.859 50.138 -16.138 411 HG3 GLU 55 HG1 GLU 55 47.926 50.627 -14.446 412 H VAL 56 HN VAL 56 47.472 46.038 -14.390 413 HA VAL 56 HA VAL 56 50.105 45.607 -15.077 414 HB VAL 56 HB VAL 56 49.087 44.567 -13.121 415 HG11 VAL 56 HG11 VAL 56 46.891 44.070 -14.203 416 HG12 VAL 56 HG12 VAL 56 47.554 42.681 -13.343 417 HG13 VAL 56 HG13 VAL 56 47.663 42.763 -15.101 418 HG21 VAL 56 HG21 VAL 56 50.149 42.395 -13.291 419 HG22 VAL 56 HG22 VAL 56 51.112 43.542 -14.222 420 HG23 VAL 56 HG23 VAL 56 50.028 42.424 -15.050 421 H LEU 57 HN LEU 57 47.210 44.386 -16.660 422 HA LEU 57 HA LEU 57 48.471 42.477 -18.328 423 HB2 LEU 57 HB2 LEU 57 45.840 43.706 -18.102 424 HB3 LEU 57 HB1 LEU 57 46.306 43.450 -19.784 425 HG LEU 57 HG LEU 57 46.928 41.088 -19.175 426 HD11 LEU 57 HD11 LEU 57 47.223 41.519 -16.741 427 HD12 LEU 57 HD12 LEU 57 46.106 40.190 -17.051 428 HD13 LEU 57 HD13 LEU 57 45.484 41.777 -16.597 429 HD21 LEU 57 HD21 LEU 57 44.705 41.760 -20.164 430 HD22 LEU 57 HD22 LEU 57 44.053 41.804 -18.525 431 HD23 LEU 57 HD23 LEU 57 44.643 40.284 -19.199 432 H LYS 58 HN LYS 58 47.803 45.925 -18.702 433 HA LYS 58 HA LYS 58 48.696 46.164 -21.396 434 HB2 LYS 58 HB2 LYS 58 48.422 48.160 -19.145 435 HB3 LYS 58 HB1 LYS 58 48.916 48.607 -20.778 436 HG2 LYS 58 HG2 LYS 58 46.388 47.036 -20.249 437 HG3 LYS 58 HG1 LYS 58 46.410 48.800 -20.245 438 HD2 LYS 58 HD2 LYS 58 47.458 48.696 -22.548 439 HD3 LYS 58 HD1 LYS 58 47.132 46.962 -22.541 440 HE2 LYS 58 HE2 LYS 58 44.986 49.042 -22.065 441 HE3 LYS 58 HE1 LYS 58 45.350 48.382 -23.660 442 HZ1 LYS 58 HZ1 LYS 58 44.784 46.620 -21.357 443 HZ2 LYS 58 HZ2 LYS 58 44.699 46.261 -23.015 444 HZ3 LYS 58 HZ3 LYS 58 43.529 47.264 -22.299 445 H ARG 59 HN ARG 59 50.311 46.577 -18.259 446 HA ARG 59 HA ARG 59 52.791 47.457 -19.323 447 HB2 ARG 59 HB2 ARG 59 51.935 47.628 -16.906 448 HB3 ARG 59 HB1 ARG 59 52.476 45.958 -16.728 449 HG2 ARG 59 HG2 ARG 59 54.461 47.702 -18.015 450 HG3 ARG 59 HG1 ARG 59 54.071 48.176 -16.362 451 HD2 ARG 59 HD2 ARG 59 54.486 45.844 -15.618 452 HD3 ARG 59 HD1 ARG 59 54.940 45.416 -17.265 453 HE ARG 59 HE ARG 59 56.562 47.542 -16.635 454 HH11 ARG 59 HH11 ARG 59 55.877 44.427 -15.224 455 HH12 ARG 59 HH12 ARG 59 57.458 44.255 -14.545 456 HH21 ARG 59 HH21 ARG 59 58.619 47.291 -15.736 457 HH22 ARG 59 HH22 ARG 59 59.002 45.864 -14.831 458 H GLU 60 HN GLU 60 51.390 44.289 -18.810 459 HA GLU 60 HA GLU 60 53.880 43.081 -19.861 460 HB2 GLU 60 HB2 GLU 60 51.894 41.900 -17.905 461 HB3 GLU 60 HB1 GLU 60 53.271 41.041 -18.596 462 HG2 GLU 60 HG2 GLU 60 53.547 43.631 -17.055 463 HG3 GLU 60 HG1 GLU 60 53.677 42.044 -16.300 464 HA PRO 61 HA PRO 61 50.359 42.212 -22.761 465 HB2 PRO 61 HB2 PRO 61 51.676 42.936 -25.039 466 HB3 PRO 61 HB1 PRO 61 50.786 44.089 -24.025 467 HG2 PRO 61 HG2 PRO 61 53.711 43.570 -24.183 468 HG3 PRO 61 HG1 PRO 61 52.842 45.101 -23.984 469 HD2 PRO 61 HD2 PRO 61 54.047 43.757 -21.904 470 HD3 PRO 61 HD1 PRO 61 52.667 44.857 -21.698 471 H LEU 62 HN LEU 62 53.498 41.063 -22.221 472 HA LEU 62 HA LEU 62 53.962 39.310 -24.345 473 HB2 LEU 62 HB2 LEU 62 55.565 39.878 -22.490 474 HB3 LEU 62 HB1 LEU 62 54.650 38.788 -21.448 475 HG LEU 62 HG LEU 62 55.399 37.651 -24.069 476 HD11 LEU 62 HD11 LEU 62 57.404 39.055 -23.415 477 HD12 LEU 62 HD12 LEU 62 57.728 37.326 -23.543 478 HD13 LEU 62 HD13 LEU 62 57.530 38.071 -21.957 479 HD21 LEU 62 HD21 LEU 62 55.959 35.724 -22.591 480 HD22 LEU 62 HD22 LEU 62 54.327 36.328 -22.303 481 HD23 LEU 62 HD23 LEU 62 55.628 36.734 -21.184 482 H ASN 63 HN ASN 63 52.070 38.886 -21.378 483 HA ASN 63 HA ASN 63 51.485 36.142 -21.731 484 HB2 ASN 63 HB2 ASN 63 49.850 36.431 -20.022 485 HB3 ASN 63 HB1 ASN 63 51.175 37.522 -19.621 486 HD21 ASN 63 HD21 ASN 63 48.086 37.631 -19.169 487 HD22 ASN 63 HD22 ASN 63 47.678 39.192 -19.696 488 H TYR 64 HN TYR 64 50.094 39.058 -23.064 489 HA TYR 64 HA TYR 64 47.683 37.819 -24.014 490 HB2 TYR 64 HB2 TYR 64 47.850 40.253 -23.591 491 HB3 TYR 64 HB1 TYR 64 49.013 40.388 -24.910 492 HD1 TYR 64 HD1 TYR 64 45.518 39.376 -24.098 493 HD2 TYR 64 HD2 TYR 64 48.299 40.505 -27.170 494 HE1 TYR 64 HE1 TYR 64 43.655 39.532 -25.727 495 HE2 TYR 64 HE2 TYR 64 46.436 40.661 -28.800 496 HH TYR 64 HH TYR 64 44.071 40.927 -28.866 497 H LEU 65 HN LEU 65 50.827 38.635 -25.416 498 HA LEU 65 HA LEU 65 50.178 37.794 -28.062 499 HB2 LEU 65 HB2 LEU 65 52.843 38.176 -26.677 500 HB3 LEU 65 HB1 LEU 65 52.656 37.866 -28.403 501 HG LEU 65 HG LEU 65 51.313 40.176 -26.977 502 HD11 LEU 65 HD11 LEU 65 53.112 41.535 -28.164 503 HD12 LEU 65 HD12 LEU 65 53.962 40.014 -28.435 504 HD13 LEU 65 HD13 LEU 65 53.669 40.581 -26.790 505 HD21 LEU 65 HD21 LEU 65 51.254 41.013 -29.399 506 HD22 LEU 65 HD22 LEU 65 50.196 39.653 -29.029 507 HD23 LEU 65 HD23 LEU 65 51.721 39.379 -29.871 508 HA PRO 66 HA PRO 66 50.544 33.408 -27.992 509 HB2 PRO 66 HB2 PRO 66 52.741 33.596 -30.002 510 HB3 PRO 66 HB1 PRO 66 51.221 32.684 -30.072 511 HG2 PRO 66 HG2 PRO 66 51.563 34.916 -31.477 512 HG3 PRO 66 HG1 PRO 66 50.000 34.505 -30.750 513 HD2 PRO 66 HD2 PRO 66 52.001 36.546 -29.881 514 HD3 PRO 66 HD1 PRO 66 50.229 36.572 -29.749 515 H LEU 67 HN LEU 67 51.649 31.900 -26.812 516 HA LEU 67 HA LEU 67 54.469 32.462 -26.135 517 HB2 LEU 67 HB2 LEU 67 52.336 32.740 -24.370 518 HB3 LEU 67 HB1 LEU 67 53.004 31.153 -23.987 519 HG LEU 67 HG LEU 67 54.813 33.534 -24.355 520 HD11 LEU 67 HD11 LEU 67 53.603 32.647 -21.723 521 HD12 LEU 67 HD12 LEU 67 53.025 34.039 -22.637 522 HD13 LEU 67 HD13 LEU 67 54.668 34.025 -21.997 523 HD21 LEU 67 HD21 LEU 67 55.924 31.398 -24.297 524 HD22 LEU 67 HD22 LEU 67 54.968 30.874 -22.911 525 HD23 LEU 67 HD23 LEU 67 56.175 32.146 -22.720 Start of MODEL 2 1 H1 THR 1 HT1 THR 1 -3.793 -4.834 -1.263 2 H2 THR 1 HT2 THR 1 -3.693 -3.178 -0.898 3 H3 THR 1 HT3 THR 1 -4.050 -4.301 0.326 4 HA THR 1 HA THR 1 -1.893 -5.228 0.249 5 HB THR 1 HB THR 1 -1.978 -4.141 -2.402 6 HG1 THR 1 HG1 THR 1 -0.200 -5.769 -0.932 7 HG21 THR 1 HG21 THR 1 0.303 -3.201 -2.549 8 HG22 THR 1 HG22 THR 1 0.452 -3.291 -0.797 9 HG23 THR 1 HG23 THR 1 -0.735 -2.209 -1.528 10 HA PRO 2 HA PRO 2 -0.858 -1.842 2.914 11 HB2 PRO 2 HB2 PRO 2 1.753 -2.371 3.508 12 HB3 PRO 2 HB1 PRO 2 0.401 -3.324 4.152 13 HG2 PRO 2 HG2 PRO 2 2.252 -3.939 1.907 14 HG3 PRO 2 HG1 PRO 2 1.574 -5.014 3.141 15 HD2 PRO 2 HD2 PRO 2 0.607 -4.861 0.573 16 HD3 PRO 2 HD1 PRO 2 -0.382 -5.348 1.966 17 H ILE 3 HN ILE 3 0.216 0.179 2.994 18 HA ILE 3 HA ILE 3 0.769 1.461 0.612 19 HB ILE 3 HB ILE 3 0.354 2.581 2.804 20 HG12 ILE 3 HG12 ILE 3 2.091 4.395 2.436 21 HG13 ILE 3 HG11 ILE 3 2.821 3.349 1.219 22 HG21 ILE 3 HG21 ILE 3 1.986 1.089 4.049 23 HG22 ILE 3 HG22 ILE 3 2.133 2.810 4.406 24 HG23 ILE 3 HG23 ILE 3 3.287 2.033 3.323 25 HD11 ILE 3 HD11 ILE 3 -0.104 4.116 1.139 26 HD12 ILE 3 HD12 ILE 3 0.871 3.414 -0.153 27 HD13 ILE 3 HD13 ILE 3 1.146 5.081 0.354 28 H GLU 4 HN GLU 4 2.478 1.639 -0.718 29 HA GLU 4 HA GLU 4 4.619 -0.191 -0.587 30 HB2 GLU 4 HB2 GLU 4 5.550 1.053 -2.478 31 HB3 GLU 4 HB1 GLU 4 3.813 0.827 -2.691 32 HG2 GLU 4 HG2 GLU 4 3.419 3.099 -1.784 33 HG3 GLU 4 HG1 GLU 4 5.160 3.326 -1.624 34 H SER 5 HN SER 5 6.967 0.542 -0.696 35 HA SER 5 HA SER 5 7.726 1.653 1.771 36 HB2 SER 5 HB2 SER 5 9.332 1.360 -0.777 37 HB3 SER 5 HB1 SER 5 10.008 1.710 0.811 38 HG SER 5 HG SER 5 10.103 -0.469 0.605 39 H HIS 6 HN HIS 6 8.487 3.666 2.366 40 HA HIS 6 HA HIS 6 7.599 5.877 0.680 41 HB2 HIS 6 HB2 HIS 6 8.072 7.262 2.673 42 HB3 HIS 6 HB1 HIS 6 6.992 5.919 3.045 43 HD1 HIS 6 HD1 HIS 6 10.640 6.920 3.362 44 HD2 HIS 6 HD2 HIS 6 7.980 4.132 4.953 45 HE1 HIS 6 HE1 HIS 6 11.862 5.762 5.255 46 HE2 HIS 6 HE2 HIS 6 10.253 4.059 6.235 47 H GLN 7 HN GLN 7 10.264 4.126 0.515 48 HA GLN 7 HA GLN 7 12.375 6.013 0.823 49 HB2 GLN 7 HB2 GLN 7 12.643 3.508 0.759 50 HB3 GLN 7 HB1 GLN 7 12.343 3.584 -0.978 51 HG2 GLN 7 HG2 GLN 7 14.258 5.117 -1.245 52 HG3 GLN 7 HG1 GLN 7 14.562 5.039 0.490 53 HE21 GLN 7 HE21 GLN 7 16.533 3.876 0.540 54 HE22 GLN 7 HE22 GLN 7 16.730 2.330 -0.130 55 H VAL 8 HN VAL 8 12.985 7.628 -0.472 56 HA VAL 8 HA VAL 8 12.154 7.577 -3.303 57 HB VAL 8 HB VAL 8 10.573 9.008 -2.067 58 HG11 VAL 8 HG11 VAL 8 12.145 9.601 -0.222 59 HG12 VAL 8 HG12 VAL 8 11.371 11.019 -0.929 60 HG13 VAL 8 HG13 VAL 8 13.038 10.624 -1.348 61 HG21 VAL 8 HG21 VAL 8 11.417 9.560 -4.409 62 HG22 VAL 8 HG22 VAL 8 12.504 10.724 -3.651 63 HG23 VAL 8 HG23 VAL 8 10.757 10.923 -3.504 64 H GLU 9 HN GLU 9 13.616 8.426 -4.732 65 HA GLU 9 HA GLU 9 16.149 9.427 -3.576 66 HB2 GLU 9 HB2 GLU 9 17.039 8.488 -5.890 67 HB3 GLU 9 HB1 GLU 9 16.864 7.435 -4.488 68 HG2 GLU 9 HG2 GLU 9 15.891 6.444 -6.558 69 HG3 GLU 9 HG1 GLU 9 14.691 6.663 -5.287 70 H LYS 10 HN LYS 10 17.326 10.962 -4.866 71 HA LYS 10 HA LYS 10 15.757 12.314 -6.958 72 HB2 LYS 10 HB2 LYS 10 16.042 14.469 -5.962 73 HB3 LYS 10 HB1 LYS 10 15.392 13.414 -4.706 74 HG2 LYS 10 HG2 LYS 10 17.850 12.978 -4.055 75 HG3 LYS 10 HG1 LYS 10 18.230 14.386 -5.047 76 HD2 LYS 10 HD2 LYS 10 16.647 15.743 -3.705 77 HD3 LYS 10 HD1 LYS 10 16.321 14.336 -2.691 78 HE2 LYS 10 HE2 LYS 10 18.822 14.241 -2.229 79 HE3 LYS 10 HE1 LYS 10 18.938 15.823 -2.999 80 HZ1 LYS 10 HZ1 LYS 10 16.931 15.429 -0.900 81 HZ2 LYS 10 HZ2 LYS 10 17.792 16.831 -1.326 82 HZ3 LYS 10 HZ3 LYS 10 18.554 15.600 -0.437 83 H ARG 11 HN ARG 11 17.044 13.818 -8.238 84 HA ARG 11 HA ARG 11 19.942 13.503 -8.050 85 HB2 ARG 11 HB2 ARG 11 19.828 13.150 -10.674 86 HB3 ARG 11 HB1 ARG 11 19.757 11.784 -9.568 87 HG2 ARG 11 HG2 ARG 11 18.012 11.503 -11.213 88 HG3 ARG 11 HG1 ARG 11 17.233 11.910 -9.691 89 HD2 ARG 11 HD2 ARG 11 17.945 14.269 -11.283 90 HD3 ARG 11 HD1 ARG 11 16.826 13.193 -12.109 91 HE ARG 11 HE ARG 11 16.216 14.864 -9.880 92 HH11 ARG 11 HH11 ARG 11 15.560 11.737 -11.278 93 HH12 ARG 11 HH12 ARG 11 13.988 11.617 -10.569 94 HH21 ARG 11 HH21 ARG 11 14.151 14.689 -8.978 95 HH22 ARG 11 HH22 ARG 11 13.192 13.277 -9.274 96 H LYS 12 HN LYS 12 21.117 15.102 -9.194 97 HA LYS 12 HA LYS 12 19.473 17.410 -10.044 98 HB2 LYS 12 HB2 LYS 12 21.205 18.878 -9.136 99 HB3 LYS 12 HB1 LYS 12 20.596 17.806 -7.875 100 HG2 LYS 12 HG2 LYS 12 22.515 16.286 -8.252 101 HG3 LYS 12 HG1 LYS 12 23.135 17.390 -9.480 102 HD2 LYS 12 HD2 LYS 12 23.346 19.172 -7.811 103 HD3 LYS 12 HD1 LYS 12 22.664 18.115 -6.573 104 HE2 LYS 12 HE2 LYS 12 25.105 18.125 -6.392 105 HE3 LYS 12 HE1 LYS 12 24.554 16.535 -6.919 106 HZ1 LYS 12 HZ1 LYS 12 25.080 17.101 -9.178 107 HZ2 LYS 12 HZ2 LYS 12 26.451 17.367 -8.211 108 HZ3 LYS 12 HZ3 LYS 12 25.510 18.681 -8.735 109 H CYS 13 HN CYS 13 20.220 18.632 -11.779 110 HA CYS 13 HA CYS 13 21.838 17.157 -13.675 111 HB2 CYS 13 HB2 CYS 13 19.714 18.700 -14.063 112 HB3 CYS 13 HB1 CYS 13 20.945 19.957 -14.194 113 H ASN 14 HN ASN 14 23.962 17.157 -13.174 114 HA ASN 14 HA ASN 14 25.255 19.701 -12.454 115 HB2 ASN 14 HB2 ASN 14 27.235 18.194 -11.976 116 HB3 ASN 14 HB1 ASN 14 25.826 17.942 -10.946 117 HD21 ASN 14 HD21 ASN 14 25.808 15.708 -10.560 118 HD22 ASN 14 HD22 ASN 14 25.890 14.526 -11.776 119 H THR 15 HN THR 15 24.918 17.451 -15.060 120 HA THR 15 HA THR 15 27.266 17.721 -16.480 121 HB THR 15 HB THR 15 25.308 16.290 -17.110 122 HG1 THR 15 HG1 THR 15 26.079 18.004 -19.221 123 HG21 THR 15 HG21 THR 15 24.218 18.804 -18.384 124 HG22 THR 15 HG22 THR 15 23.658 18.212 -16.820 125 HG23 THR 15 HG23 THR 15 23.441 17.225 -18.266 126 H ALA 16 HN ALA 16 27.514 18.992 -18.569 127 HA ALA 16 HA ALA 16 27.390 21.800 -17.920 128 HB1 ALA 16 HB1 ALA 16 28.246 20.587 -20.548 129 HB2 ALA 16 HB2 ALA 16 29.296 20.635 -19.132 130 HB3 ALA 16 HB3 ALA 16 28.727 22.138 -19.858 131 H THR 17 HN THR 17 25.536 19.590 -19.876 132 HA THR 17 HA THR 17 24.369 21.335 -21.711 133 HB THR 17 HB THR 17 23.146 18.929 -20.340 134 HG1 THR 17 HG1 THR 17 24.608 19.327 -22.730 135 HG21 THR 17 HG21 THR 17 21.713 18.902 -22.423 136 HG22 THR 17 HG22 THR 17 22.320 20.519 -22.780 137 HG23 THR 17 HG23 THR 17 21.376 20.234 -21.318 138 H CYS 18 HN CYS 18 23.216 20.463 -18.444 139 HA CYS 18 HA CYS 18 20.969 22.207 -18.517 140 HB2 CYS 18 HB2 CYS 18 22.458 20.880 -16.251 141 HB3 CYS 18 HB1 CYS 18 21.032 21.888 -15.997 142 H ALA 19 HN ALA 19 24.290 22.551 -17.352 143 HA ALA 19 HA ALA 19 24.063 24.990 -16.009 144 HB1 ALA 19 HB1 ALA 19 26.107 23.405 -16.285 145 HB2 ALA 19 HB2 ALA 19 26.395 25.140 -16.156 146 HB3 ALA 19 HB3 ALA 19 26.443 24.353 -17.733 147 H THR 20 HN THR 20 24.766 24.367 -19.446 148 HA THR 20 HA THR 20 24.981 27.041 -20.263 149 HB THR 20 HB THR 20 24.003 24.641 -21.828 150 HG1 THR 20 HG1 THR 20 26.012 24.133 -21.417 151 HG21 THR 20 HG21 THR 20 25.038 27.350 -22.707 152 HG22 THR 20 HG22 THR 20 23.410 26.718 -22.952 153 HG23 THR 20 HG23 THR 20 24.777 25.981 -23.787 154 H GLN 21 HN GLN 21 22.169 25.006 -19.707 155 HA GLN 21 HA GLN 21 20.237 26.474 -21.089 156 HB2 GLN 21 HB2 GLN 21 18.805 24.998 -20.177 157 HB3 GLN 21 HB1 GLN 21 20.230 24.245 -19.466 158 HG2 GLN 21 HG2 GLN 21 19.954 25.790 -17.486 159 HG3 GLN 21 HG1 GLN 21 18.418 26.306 -18.180 160 HE21 GLN 21 HE21 GLN 21 17.781 25.264 -15.913 161 HE22 GLN 21 HE22 GLN 21 17.367 23.619 -15.970 162 H ARG 22 HN ARG 22 21.801 27.119 -18.014 163 HA ARG 22 HA ARG 22 19.920 29.225 -17.343 164 HB2 ARG 22 HB2 ARG 22 20.960 29.346 -15.286 165 HB3 ARG 22 HB1 ARG 22 21.324 27.682 -15.725 166 HG2 ARG 22 HG2 ARG 22 23.447 28.348 -15.164 167 HG3 ARG 22 HG1 ARG 22 23.466 28.877 -16.841 168 HD2 ARG 22 HD2 ARG 22 23.906 30.952 -16.080 169 HD3 ARG 22 HD1 ARG 22 22.261 30.988 -15.453 170 HE ARG 22 HE ARG 22 23.119 30.682 -13.316 171 HH11 ARG 22 HH11 ARG 22 25.550 29.965 -15.711 172 HH12 ARG 22 HH12 ARG 22 26.822 29.820 -14.549 173 HH21 ARG 22 HH21 ARG 22 24.800 30.486 -11.819 174 HH22 ARG 22 HH22 ARG 22 26.403 30.112 -12.359 175 H LEU 23 HN LEU 23 22.867 28.913 -19.093 176 HA LEU 23 HA LEU 23 23.868 31.545 -18.849 177 HB2 LEU 23 HB2 LEU 23 25.188 29.700 -19.814 178 HB3 LEU 23 HB1 LEU 23 24.084 29.627 -21.186 179 HG LEU 23 HG LEU 23 24.656 31.997 -21.727 180 HD11 LEU 23 HD11 LEU 23 25.332 32.857 -19.596 181 HD12 LEU 23 HD12 LEU 23 26.779 32.860 -20.604 182 HD13 LEU 23 HD13 LEU 23 26.547 31.595 -19.398 183 HD21 LEU 23 HD21 LEU 23 27.024 31.495 -22.459 184 HD22 LEU 23 HD22 LEU 23 25.847 30.262 -22.911 185 HD23 LEU 23 HD23 LEU 23 26.923 29.994 -21.539 186 H ALA 24 HN ALA 24 21.695 30.055 -21.237 187 HA ALA 24 HA ALA 24 21.260 32.388 -22.776 188 HB1 ALA 24 HB1 ALA 24 19.043 31.084 -23.321 189 HB2 ALA 24 HB2 ALA 24 19.830 29.777 -22.436 190 HB3 ALA 24 HB3 ALA 24 20.595 30.454 -23.874 191 H ASN 25 HN ASN 25 19.616 31.037 -19.948 192 HA ASN 25 HA ASN 25 17.476 32.932 -19.930 193 HB2 ASN 25 HB2 ASN 25 17.529 30.659 -18.777 194 HB3 ASN 25 HB1 ASN 25 18.540 31.416 -17.547 195 HD21 ASN 25 HD21 ASN 25 16.914 31.300 -15.866 196 HD22 ASN 25 HD22 ASN 25 15.499 32.235 -15.923 197 H PHE 26 HN PHE 26 20.739 32.886 -18.701 198 HA PHE 26 HA PHE 26 20.496 34.989 -16.810 199 HB2 PHE 26 HB2 PHE 26 22.413 33.432 -16.865 200 HB3 PHE 26 HB1 PHE 26 22.927 34.132 -18.400 201 HD1 PHE 26 HD1 PHE 26 22.244 34.955 -14.825 202 HD2 PHE 26 HD2 PHE 26 24.190 36.135 -18.469 203 HE1 PHE 26 HE1 PHE 26 23.428 36.762 -13.608 204 HE2 PHE 26 HE2 PHE 26 25.374 37.942 -17.251 205 HZ PHE 26 HZ PHE 26 24.993 38.256 -14.821 206 H LEU 27 HN LEU 27 21.145 34.923 -20.280 207 HA LEU 27 HA LEU 27 21.931 37.600 -20.582 208 HB2 LEU 27 HB2 LEU 27 22.209 35.866 -22.332 209 HB3 LEU 27 HB1 LEU 27 20.467 35.789 -22.535 210 HG LEU 27 HG LEU 27 21.868 37.186 -24.217 211 HD11 LEU 27 HD11 LEU 27 19.585 38.746 -23.029 212 HD12 LEU 27 HD12 LEU 27 19.298 37.177 -23.781 213 HD13 LEU 27 HD13 LEU 27 20.002 38.490 -24.722 214 HD21 LEU 27 HD21 LEU 27 23.026 38.409 -22.246 215 HD22 LEU 27 HD22 LEU 27 21.549 39.367 -22.158 216 HD23 LEU 27 HD23 LEU 27 22.515 39.371 -23.632 217 H VAL 28 HN VAL 28 18.717 36.084 -20.671 218 HA VAL 28 HA VAL 28 17.395 38.629 -21.126 219 HB VAL 28 HB VAL 28 15.318 37.340 -20.914 220 HG11 VAL 28 HG11 VAL 28 16.593 37.337 -23.058 221 HG12 VAL 28 HG12 VAL 28 15.659 35.859 -22.825 222 HG13 VAL 28 HG13 VAL 28 17.400 35.855 -22.545 223 HG21 VAL 28 HG21 VAL 28 17.139 34.993 -20.290 224 HG22 VAL 28 HG22 VAL 28 15.383 34.940 -20.446 225 HG23 VAL 28 HG23 VAL 28 16.123 35.817 -19.107 226 H HIS 29 HN HIS 29 18.260 36.620 -18.406 227 HA HIS 29 HA HIS 29 16.519 37.847 -16.509 228 HB2 HIS 29 HB2 HIS 29 17.570 35.640 -16.137 229 HB3 HIS 29 HB1 HIS 29 19.150 36.419 -16.055 230 HD1 HIS 29 HD1 HIS 29 15.764 36.646 -14.307 231 HD2 HIS 29 HD2 HIS 29 19.808 37.269 -13.509 232 HE1 HIS 29 HE1 HIS 29 15.928 37.219 -11.846 233 HE2 HIS 29 HE2 HIS 29 18.387 37.602 -11.343 234 H SER 30 HN SER 30 19.572 38.685 -17.897 235 HA SER 30 HA SER 30 19.745 40.987 -16.054 236 HB2 SER 30 HB2 SER 30 21.707 39.037 -16.621 237 HB3 SER 30 HB1 SER 30 22.244 40.522 -17.402 238 HG SER 30 HG SER 30 22.549 41.388 -15.506 239 H SER 31 HN SER 31 18.491 40.481 -18.857 240 HA SER 31 HA SER 31 19.921 42.119 -20.689 241 HB2 SER 31 HB2 SER 31 18.273 40.503 -21.474 242 HB3 SER 31 HB1 SER 31 16.994 41.348 -20.607 243 HG SER 31 HG SER 31 17.220 41.876 -22.892 244 H ASN 32 HN ASN 32 17.301 42.777 -18.386 245 HA ASN 32 HA ASN 32 16.722 45.398 -19.199 246 HB2 ASN 32 HB2 ASN 32 15.778 45.684 -16.956 247 HB3 ASN 32 HB1 ASN 32 15.319 44.122 -17.632 248 HD21 ASN 32 HD21 ASN 32 16.152 45.369 -14.753 249 HD22 ASN 32 HD22 ASN 32 17.046 44.084 -14.097 250 H ASN 33 HN ASN 33 19.328 44.087 -17.286 251 HA ASN 33 HA ASN 33 20.171 46.594 -16.187 252 HB2 ASN 33 HB2 ASN 33 21.566 43.925 -16.456 253 HB3 ASN 33 HB1 ASN 33 22.270 45.316 -15.633 254 HD21 ASN 33 HD21 ASN 33 20.255 46.372 -14.135 255 HD22 ASN 33 HD22 ASN 33 19.599 45.218 -13.077 256 H PHE 34 HN PHE 34 20.706 44.856 -19.132 257 HA PHE 34 HA PHE 34 23.128 45.972 -19.996 258 HB2 PHE 34 HB2 PHE 34 21.968 44.090 -21.135 259 HB3 PHE 34 HB1 PHE 34 20.747 45.224 -21.714 260 HD1 PHE 34 HD1 PHE 34 24.407 44.498 -21.773 261 HD2 PHE 34 HD2 PHE 34 21.124 46.540 -23.646 262 HE1 PHE 34 HE1 PHE 34 25.870 45.096 -23.685 263 HE2 PHE 34 HE2 PHE 34 22.587 47.138 -25.558 264 HZ PHE 34 HZ PHE 34 24.960 46.416 -25.577 265 H GLY 35 HN GLY 35 19.807 47.167 -20.273 266 HA2 GLY 35 HA2 GLY 35 20.393 49.452 -21.861 267 HA3 GLY 35 HA1 GLY 35 18.966 49.232 -20.836 268 H ALA 36 HN ALA 36 19.991 49.061 -18.330 269 HA ALA 36 HA ALA 36 20.487 51.733 -17.645 270 HB1 ALA 36 HB1 ALA 36 21.034 50.846 -15.399 271 HB2 ALA 36 HB2 ALA 36 21.070 49.215 -16.068 272 HB3 ALA 36 HB3 ALA 36 19.562 50.128 -16.053 273 H ILE 37 HN ILE 37 22.679 49.025 -18.198 274 HA ILE 37 HA ILE 37 25.058 50.203 -17.259 275 HB ILE 37 HB ILE 37 24.512 48.067 -19.314 276 HG12 ILE 37 HG12 ILE 37 25.887 47.893 -16.623 277 HG13 ILE 37 HG11 ILE 37 24.139 47.739 -16.791 278 HG21 ILE 37 HG21 ILE 37 27.015 47.614 -19.069 279 HG22 ILE 37 HG22 ILE 37 27.144 49.229 -18.373 280 HG23 ILE 37 HG23 ILE 37 26.583 49.026 -20.032 281 HD11 ILE 37 HD11 ILE 37 26.090 46.054 -18.375 282 HD12 ILE 37 HD12 ILE 37 24.354 45.805 -18.190 283 HD13 ILE 37 HD13 ILE 37 25.433 45.547 -16.819 284 H LEU 38 HN LEU 38 23.455 50.312 -20.413 285 HA LEU 38 HA LEU 38 25.479 51.514 -21.910 286 HB2 LEU 38 HB2 LEU 38 23.414 50.623 -22.905 287 HB3 LEU 38 HB1 LEU 38 22.484 51.910 -22.141 288 HG LEU 38 HG LEU 38 23.834 53.590 -23.394 289 HD11 LEU 38 HD11 LEU 38 25.889 52.419 -23.767 290 HD12 LEU 38 HD12 LEU 38 25.163 52.645 -25.358 291 HD13 LEU 38 HD13 LEU 38 25.059 51.078 -24.556 292 HD21 LEU 38 HD21 LEU 38 21.667 52.641 -24.270 293 HD22 LEU 38 HD22 LEU 38 22.616 51.496 -25.218 294 HD23 LEU 38 HD23 LEU 38 22.753 53.226 -25.531 295 H SER 39 HN SER 39 23.065 52.966 -19.758 296 HA SER 39 HA SER 39 23.660 55.667 -20.403 297 HB2 SER 39 HB2 SER 39 21.591 55.021 -19.244 298 HB3 SER 39 HB1 SER 39 22.529 54.483 -17.854 299 HG SER 39 HG SER 39 22.175 56.499 -17.279 300 H SER 40 HN SER 40 24.917 53.406 -17.995 301 HA SER 40 HA SER 40 26.767 55.425 -16.966 302 HB2 SER 40 HB2 SER 40 26.287 52.548 -16.161 303 HB3 SER 40 HB1 SER 40 27.414 53.642 -15.363 304 HG SER 40 HG SER 40 24.680 53.491 -15.218 305 H THR 41 HN THR 41 26.920 54.231 -19.738 306 HA THR 41 HA THR 41 29.032 52.423 -19.987 307 HB THR 41 HB THR 41 27.571 53.119 -21.858 308 HG1 THR 41 HG1 THR 41 30.275 53.762 -22.388 309 HG21 THR 41 HG21 THR 41 27.933 55.268 -22.951 310 HG22 THR 41 HG22 THR 41 29.196 55.675 -21.789 311 HG23 THR 41 HG23 THR 41 27.520 55.537 -21.258 312 H ASN 42 HN ASN 42 29.057 55.756 -19.066 313 HA ASN 42 HA ASN 42 31.848 56.180 -19.714 314 HB2 ASN 42 HB2 ASN 42 31.550 58.366 -18.759 315 HB3 ASN 42 HB1 ASN 42 30.131 58.006 -19.741 316 HD21 ASN 42 HD21 ASN 42 30.162 59.889 -17.498 317 HD22 ASN 42 HD22 ASN 42 29.095 59.279 -16.328 318 H VAL 43 HN VAL 43 30.613 54.184 -17.539 319 HA VAL 43 HA VAL 43 32.137 55.050 -15.207 320 HB VAL 43 HB VAL 43 29.810 53.945 -15.154 321 HG11 VAL 43 HG11 VAL 43 31.447 51.410 -15.354 322 HG12 VAL 43 HG12 VAL 43 30.608 52.094 -16.745 323 HG13 VAL 43 HG13 VAL 43 29.692 51.576 -15.331 324 HG21 VAL 43 HG21 VAL 43 31.919 52.582 -13.463 325 HG22 VAL 43 HG22 VAL 43 30.268 53.003 -13.012 326 HG23 VAL 43 HG23 VAL 43 31.474 54.272 -13.222 327 H GLY 44 HN GLY 44 33.293 54.057 -17.902 328 HA2 GLY 44 HA2 GLY 44 35.288 53.034 -18.454 329 HA3 GLY 44 HA1 GLY 44 35.506 52.639 -16.751 330 H SER 45 HN SER 45 32.578 51.750 -18.405 331 HA SER 45 HA SER 45 33.476 48.930 -18.441 332 HB2 SER 45 HB2 SER 45 31.236 48.262 -17.805 333 HB3 SER 45 HB1 SER 45 31.834 49.430 -16.630 334 HG SER 45 HG SER 45 29.741 49.977 -17.280 335 H ASN 46 HN ASN 46 33.417 51.061 -20.563 336 HA ASN 46 HA ASN 46 31.371 50.048 -22.396 337 HB2 ASN 46 HB2 ASN 46 32.060 51.873 -23.859 338 HB3 ASN 46 HB1 ASN 46 31.756 52.488 -22.235 339 HD21 ASN 46 HD21 ASN 46 33.367 54.108 -23.709 340 HD22 ASN 46 HD22 ASN 46 34.995 53.947 -23.256 341 H THR 47 HN THR 47 33.711 48.426 -21.515 342 HA THR 47 HA THR 47 35.351 48.209 -23.915 343 HB THR 47 HB THR 47 35.745 46.059 -22.042 344 HG1 THR 47 HG1 THR 47 36.249 47.323 -20.249 345 HG21 THR 47 HG21 THR 47 37.411 46.979 -23.626 346 HG22 THR 47 HG22 THR 47 38.000 47.024 -21.964 347 HG23 THR 47 HG23 THR 47 37.408 48.498 -22.730 348 H TYR 48 HN TYR 48 32.359 47.494 -23.752 349 HA TYR 48 HA TYR 48 32.649 44.804 -24.940 350 HB2 TYR 48 HB2 TYR 48 30.555 44.125 -23.981 351 HB3 TYR 48 HB1 TYR 48 31.548 44.773 -22.675 352 HD1 TYR 48 HD1 TYR 48 28.523 45.205 -24.659 353 HD2 TYR 48 HD2 TYR 48 31.138 47.088 -21.820 354 HE1 TYR 48 HE1 TYR 48 26.766 46.880 -24.152 355 HE2 TYR 48 HE2 TYR 48 29.381 48.763 -21.312 356 HH TYR 48 HH TYR 48 26.693 49.248 -23.246 357 H GLY 49 HN GLY 49 32.411 47.724 -25.950 358 HA2 GLY 49 HA2 GLY 49 29.924 48.030 -27.245 359 HA3 GLY 49 HA1 GLY 49 31.429 48.808 -27.723 360 H LYS 50 HN LYS 50 29.138 47.313 -29.157 361 HA LYS 50 HA LYS 50 30.232 44.987 -30.350 362 HB2 LYS 50 HB2 LYS 50 28.072 46.901 -31.247 363 HB3 LYS 50 HB1 LYS 50 28.481 45.426 -32.123 364 HG2 LYS 50 HG2 LYS 50 28.092 44.141 -29.991 365 HG3 LYS 50 HG1 LYS 50 27.489 45.632 -29.268 366 HD2 LYS 50 HD2 LYS 50 26.362 44.468 -31.825 367 HD3 LYS 50 HD1 LYS 50 25.699 44.111 -30.230 368 HE2 LYS 50 HE2 LYS 50 25.982 46.880 -31.435 369 HE3 LYS 50 HE1 LYS 50 24.477 45.971 -31.299 370 HZ1 LYS 50 HZ1 LYS 50 25.195 45.850 -28.806 371 HZ2 LYS 50 HZ2 LYS 50 24.393 47.221 -29.410 372 HZ3 LYS 50 HZ3 LYS 50 26.078 47.244 -29.199 373 H ARG 51 HN ARG 51 30.321 48.407 -31.214 374 HA ARG 51 HA ARG 51 31.286 48.321 -33.789 375 HB2 ARG 51 HB2 ARG 51 32.246 50.499 -33.400 376 HB3 ARG 51 HB1 ARG 51 30.746 50.392 -32.479 377 HG2 ARG 51 HG2 ARG 51 32.082 49.754 -30.463 378 HG3 ARG 51 HG1 ARG 51 33.554 50.015 -31.399 379 HD2 ARG 51 HD2 ARG 51 32.869 52.358 -31.803 380 HD3 ARG 51 HD1 ARG 51 31.423 52.095 -30.835 381 HE ARG 51 HE ARG 51 34.117 52.479 -29.851 382 HH11 ARG 51 HH11 ARG 51 30.950 51.174 -29.189 383 HH12 ARG 51 HH12 ARG 51 31.148 51.252 -27.473 384 HH21 ARG 51 HH21 ARG 51 34.344 52.572 -27.606 385 HH22 ARG 51 HH22 ARG 51 33.055 52.038 -26.580 386 H ASN 52 HN ASN 52 32.954 47.495 -30.837 387 HA ASN 52 HA ASN 52 35.613 47.632 -31.780 388 HB2 ASN 52 HB2 ASN 52 34.582 47.183 -29.370 389 HB3 ASN 52 HB1 ASN 52 34.830 45.503 -29.843 390 HD21 ASN 52 HD21 ASN 52 37.218 46.029 -31.488 391 HD22 ASN 52 HD22 ASN 52 38.469 46.422 -30.411 392 H ALA 53 HN ALA 53 33.188 45.067 -31.856 393 HA ALA 53 HA ALA 53 34.837 43.016 -32.885 394 HB1 ALA 53 HB1 ALA 53 32.715 41.940 -33.560 395 HB2 ALA 53 HB2 ALA 53 31.857 43.439 -33.204 396 HB3 ALA 53 HB3 ALA 53 32.647 42.545 -31.905 397 H VAL 54 HN VAL 54 32.693 45.341 -34.530 398 HA VAL 54 HA VAL 54 33.348 44.397 -37.150 399 HB VAL 54 HB VAL 54 31.348 45.934 -36.163 400 HG11 VAL 54 HG11 VAL 54 33.074 47.870 -37.724 401 HG12 VAL 54 HG12 VAL 54 33.050 47.837 -35.961 402 HG13 VAL 54 HG13 VAL 54 31.577 48.206 -36.855 403 HG21 VAL 54 HG21 VAL 54 30.743 46.322 -38.515 404 HG22 VAL 54 HG22 VAL 54 31.405 44.700 -38.315 405 HG23 VAL 54 HG23 VAL 54 32.400 45.979 -39.010 406 H GLU 55 HN GLU 55 34.865 46.573 -34.930 407 HA GLU 55 HA GLU 55 36.321 48.075 -36.899 408 HB2 GLU 55 HB2 GLU 55 35.813 48.838 -34.533 409 HB3 GLU 55 HB1 GLU 55 37.059 47.714 -33.990 410 HG2 GLU 55 HG2 GLU 55 37.653 49.707 -36.166 411 HG3 GLU 55 HG1 GLU 55 37.726 50.193 -34.474 412 H VAL 56 HN VAL 56 37.353 45.614 -34.512 413 HA VAL 56 HA VAL 56 39.952 45.269 -35.349 414 HB VAL 56 HB VAL 56 38.574 44.116 -33.429 415 HG11 VAL 56 HG11 VAL 56 38.610 41.894 -35.482 416 HG12 VAL 56 HG12 VAL 56 37.176 42.872 -35.172 417 HG13 VAL 56 HG13 VAL 56 37.864 41.884 -33.884 418 HG21 VAL 56 HG21 VAL 56 40.344 42.283 -33.402 419 HG22 VAL 56 HG22 VAL 56 40.964 43.928 -33.541 420 HG23 VAL 56 HG23 VAL 56 40.879 42.894 -34.968 421 H LEU 57 HN LEU 57 37.017 44.169 -36.890 422 HA LEU 57 HA LEU 57 38.187 42.253 -38.624 423 HB2 LEU 57 HB2 LEU 57 35.595 43.598 -38.360 424 HB3 LEU 57 HB1 LEU 57 36.032 43.250 -40.033 425 HG LEU 57 HG LEU 57 36.658 40.891 -39.164 426 HD11 LEU 57 HD11 LEU 57 36.480 41.663 -36.743 427 HD12 LEU 57 HD12 LEU 57 35.615 40.175 -37.128 428 HD13 LEU 57 HD13 LEU 57 34.732 41.693 -36.971 429 HD21 LEU 57 HD21 LEU 57 34.727 41.301 -40.605 430 HD22 LEU 57 HD22 LEU 57 33.781 41.858 -39.224 431 HD23 LEU 57 HD23 LEU 57 34.271 40.167 -39.333 432 H LYS 58 HN LYS 58 37.601 45.725 -38.887 433 HA LYS 58 HA LYS 58 38.463 46.019 -41.591 434 HB2 LYS 58 HB2 LYS 58 38.231 47.956 -39.284 435 HB3 LYS 58 HB1 LYS 58 38.719 48.441 -40.908 436 HG2 LYS 58 HG2 LYS 58 36.183 46.874 -40.432 437 HG3 LYS 58 HG1 LYS 58 36.212 48.634 -40.324 438 HD2 LYS 58 HD2 LYS 58 37.197 48.703 -42.630 439 HD3 LYS 58 HD1 LYS 58 36.971 46.956 -42.731 440 HE2 LYS 58 HE2 LYS 58 34.740 48.934 -42.186 441 HE3 LYS 58 HE1 LYS 58 35.095 48.247 -43.772 442 HZ1 LYS 58 HZ1 LYS 58 34.169 46.850 -41.336 443 HZ2 LYS 58 HZ2 LYS 58 34.881 46.013 -42.632 444 HZ3 LYS 58 HZ3 LYS 58 33.443 46.887 -42.868 445 H ARG 59 HN ARG 59 40.103 46.271 -38.456 446 HA ARG 59 HA ARG 59 42.565 47.248 -39.407 447 HB2 ARG 59 HB2 ARG 59 41.918 47.236 -37.023 448 HB3 ARG 59 HB1 ARG 59 42.054 45.477 -37.006 449 HG2 ARG 59 HG2 ARG 59 44.425 45.619 -37.582 450 HG3 ARG 59 HG1 ARG 59 44.312 47.374 -37.715 451 HD2 ARG 59 HD2 ARG 59 43.699 47.524 -35.335 452 HD3 ARG 59 HD1 ARG 59 43.789 45.770 -35.196 453 HE ARG 59 HE ARG 59 46.247 46.674 -36.200 454 HH11 ARG 59 HH11 ARG 59 44.310 46.924 -33.310 455 HH12 ARG 59 HH12 ARG 59 45.678 47.112 -32.269 456 HH21 ARG 59 HH21 ARG 59 48.014 46.922 -34.815 457 HH22 ARG 59 HH22 ARG 59 47.762 47.112 -33.112 458 H GLU 60 HN GLU 60 41.308 43.956 -39.118 459 HA GLU 60 HA GLU 60 43.767 42.982 -40.450 460 HB2 GLU 60 HB2 GLU 60 41.903 41.500 -38.580 461 HB3 GLU 60 HB1 GLU 60 43.304 40.802 -39.393 462 HG2 GLU 60 HG2 GLU 60 43.462 43.203 -37.553 463 HG3 GLU 60 HG1 GLU 60 43.745 41.547 -37.021 464 HA PRO 61 HA PRO 61 40.190 42.259 -43.311 465 HB2 PRO 61 HB2 PRO 61 41.373 43.265 -45.545 466 HB3 PRO 61 HB1 PRO 61 40.515 44.283 -44.371 467 HG2 PRO 61 HG2 PRO 61 43.438 43.853 -44.724 468 HG3 PRO 61 HG1 PRO 61 42.553 45.335 -44.327 469 HD2 PRO 61 HD2 PRO 61 43.882 43.800 -42.458 470 HD3 PRO 61 HD1 PRO 61 42.510 44.859 -42.074 471 H LEU 62 HN LEU 62 43.446 41.266 -43.083 472 HA LEU 62 HA LEU 62 43.792 39.706 -45.383 473 HB2 LEU 62 HB2 LEU 62 45.602 40.256 -43.788 474 HB3 LEU 62 HB1 LEU 62 44.861 39.184 -42.600 475 HG LEU 62 HG LEU 62 45.194 37.884 -45.191 476 HD11 LEU 62 HD11 LEU 62 47.160 39.475 -45.188 477 HD12 LEU 62 HD12 LEU 62 47.605 37.768 -45.216 478 HD13 LEU 62 HD13 LEU 62 47.716 38.684 -43.712 479 HD21 LEU 62 HD21 LEU 62 46.388 36.234 -43.653 480 HD22 LEU 62 HD22 LEU 62 44.715 36.593 -43.226 481 HD23 LEU 62 HD23 LEU 62 46.034 37.346 -42.331 482 H ASN 63 HN ASN 63 42.252 38.950 -42.277 483 HA ASN 63 HA ASN 63 41.884 36.189 -42.762 484 HB2 ASN 63 HB2 ASN 63 40.462 36.196 -40.875 485 HB3 ASN 63 HB1 ASN 63 41.638 37.468 -40.550 486 HD21 ASN 63 HD21 ASN 63 38.571 37.023 -39.904 487 HD22 ASN 63 HD22 ASN 63 37.903 38.539 -40.272 488 H TYR 64 HN TYR 64 40.162 39.032 -43.800 489 HA TYR 64 HA TYR 64 37.757 37.676 -44.586 490 HB2 TYR 64 HB2 TYR 64 37.793 40.088 -44.068 491 HB3 TYR 64 HB1 TYR 64 38.843 40.365 -45.458 492 HD1 TYR 64 HD1 TYR 64 35.496 39.047 -44.465 493 HD2 TYR 64 HD2 TYR 64 37.949 40.582 -47.640 494 HE1 TYR 64 HE1 TYR 64 33.510 39.159 -45.946 495 HE2 TYR 64 HE2 TYR 64 35.963 40.693 -49.121 496 HH TYR 64 HH TYR 64 33.355 39.119 -48.818 497 H LEU 65 HN LEU 65 40.688 38.782 -46.226 498 HA LEU 65 HA LEU 65 39.888 38.054 -48.851 499 HB2 LEU 65 HB2 LEU 65 42.635 38.431 -47.633 500 HB3 LEU 65 HB1 LEU 65 42.335 38.228 -49.358 501 HG LEU 65 HG LEU 65 41.038 40.397 -47.690 502 HD11 LEU 65 HD11 LEU 65 42.704 41.923 -48.535 503 HD12 LEU 65 HD12 LEU 65 43.405 40.671 -49.562 504 HD13 LEU 65 HD13 LEU 65 43.561 40.564 -47.808 505 HD21 LEU 65 HD21 LEU 65 40.775 41.387 -50.039 506 HD22 LEU 65 HD22 LEU 65 39.784 39.973 -49.685 507 HD23 LEU 65 HD23 LEU 65 41.249 39.803 -50.653 508 HA PRO 66 HA PRO 66 40.365 33.689 -49.115 509 HB2 PRO 66 HB2 PRO 66 42.436 34.090 -51.229 510 HB3 PRO 66 HB1 PRO 66 40.949 33.123 -51.274 511 HG2 PRO 66 HG2 PRO 66 41.119 35.455 -52.538 512 HG3 PRO 66 HG1 PRO 66 39.622 34.938 -51.743 513 HD2 PRO 66 HD2 PRO 66 41.606 36.993 -50.868 514 HD3 PRO 66 HD1 PRO 66 39.847 36.942 -50.618 515 H LEU 67 HN LEU 67 41.560 32.147 -48.086 516 HA LEU 67 HA LEU 67 44.439 32.558 -47.706 517 HB2 LEU 67 HB2 LEU 67 42.504 33.116 -45.692 518 HB3 LEU 67 HB1 LEU 67 43.372 31.655 -45.219 519 HG LEU 67 HG LEU 67 44.765 34.172 -46.162 520 HD11 LEU 67 HD11 LEU 67 44.020 33.250 -43.377 521 HD12 LEU 67 HD12 LEU 67 43.636 34.792 -44.143 522 HD13 LEU 67 HD13 LEU 67 45.298 34.426 -43.683 523 HD21 LEU 67 HD21 LEU 67 46.053 32.083 -46.356 524 HD22 LEU 67 HD22 LEU 67 45.703 31.699 -44.671 525 HD23 LEU 67 HD23 LEU 67 46.712 33.090 -45.066 Start of MODEL 3 1 H1 THR 1 HT1 THR 1 -3.824 -6.062 -1.168 2 H2 THR 1 HT2 THR 1 -3.171 -4.622 -1.788 3 H3 THR 1 HT3 THR 1 -4.289 -4.569 -0.510 4 HA THR 1 HA THR 1 -2.567 -6.011 0.729 5 HB THR 1 HB THR 1 -1.292 -5.668 -1.734 6 HG1 THR 1 HG1 THR 1 0.301 -6.813 -0.723 7 HG21 THR 1 HG21 THR 1 0.686 -4.341 -1.284 8 HG22 THR 1 HG22 THR 1 0.143 -4.008 0.358 9 HG23 THR 1 HG23 THR 1 -0.733 -3.331 -1.017 10 HA PRO 2 HA PRO 2 -2.503 -2.215 2.976 11 HB2 PRO 2 HB2 PRO 2 -0.415 -2.564 4.685 12 HB3 PRO 2 HB1 PRO 2 -1.932 -3.475 4.824 13 HG2 PRO 2 HG2 PRO 2 0.687 -4.318 3.698 14 HG3 PRO 2 HG1 PRO 2 -0.484 -5.242 4.654 15 HD2 PRO 2 HD2 PRO 2 -0.235 -5.441 1.909 16 HD3 PRO 2 HD1 PRO 2 -1.717 -5.837 2.805 17 H ILE 3 HN ILE 3 -1.485 -0.174 3.182 18 HA ILE 3 HA ILE 3 0.104 0.698 1.077 19 HB ILE 3 HB ILE 3 -1.264 2.046 2.830 20 HG12 ILE 3 HG12 ILE 3 0.377 4.016 2.485 21 HG13 ILE 3 HG11 ILE 3 1.374 2.858 1.603 22 HG21 ILE 3 HG21 ILE 3 0.200 1.145 4.722 23 HG22 ILE 3 HG22 ILE 3 -0.053 2.891 4.708 24 HG23 ILE 3 HG23 ILE 3 1.467 2.215 4.122 25 HD11 ILE 3 HD11 ILE 3 -1.550 3.319 0.974 26 HD12 ILE 3 HD12 ILE 3 -0.364 2.447 0.002 27 HD13 ILE 3 HD13 ILE 3 -0.248 4.198 0.173 28 H GLU 4 HN GLU 4 2.277 0.993 0.758 29 HA GLU 4 HA GLU 4 4.055 -0.728 2.202 30 HB2 GLU 4 HB2 GLU 4 5.765 0.095 0.681 31 HB3 GLU 4 HB1 GLU 4 4.290 -0.242 -0.226 32 HG2 GLU 4 HG2 GLU 4 3.680 2.167 -0.071 33 HG3 GLU 4 HG1 GLU 4 5.211 2.478 0.744 34 H SER 5 HN SER 5 6.269 0.230 2.884 35 HA SER 5 HA SER 5 5.805 1.961 5.095 36 HB2 SER 5 HB2 SER 5 8.172 1.771 5.510 37 HB3 SER 5 HB1 SER 5 7.585 0.195 4.985 38 HG SER 5 HG SER 5 9.534 0.927 3.924 39 H HIS 6 HN HIS 6 6.926 4.013 5.475 40 HA HIS 6 HA HIS 6 6.734 5.728 3.113 41 HB2 HIS 6 HB2 HIS 6 6.842 7.579 4.729 42 HB3 HIS 6 HB1 HIS 6 5.582 6.426 5.168 43 HD1 HIS 6 HD1 HIS 6 9.080 7.487 6.143 44 HD2 HIS 6 HD2 HIS 6 5.990 5.109 7.619 45 HE1 HIS 6 HE1 HIS 6 9.736 6.843 8.503 46 HE2 HIS 6 HE2 HIS 6 7.862 5.393 9.416 47 H GLN 7 HN GLN 7 9.024 3.838 3.647 48 HA GLN 7 HA GLN 7 11.296 5.475 4.287 49 HB2 GLN 7 HB2 GLN 7 11.075 2.921 4.527 50 HB3 GLN 7 HB1 GLN 7 11.398 2.860 2.794 51 HG2 GLN 7 HG2 GLN 7 13.499 4.097 3.131 52 HG3 GLN 7 HG1 GLN 7 13.178 4.181 4.862 53 HE21 GLN 7 HE21 GLN 7 14.235 2.579 6.028 54 HE22 GLN 7 HE22 GLN 7 14.651 1.048 5.426 55 H VAL 8 HN VAL 8 11.175 7.244 2.864 56 HA VAL 8 HA VAL 8 12.119 6.635 0.145 57 HB VAL 8 HB VAL 8 9.691 7.042 -0.015 58 HG11 VAL 8 HG11 VAL 8 9.473 8.459 1.998 59 HG12 VAL 8 HG12 VAL 8 8.804 9.267 0.580 60 HG13 VAL 8 HG13 VAL 8 10.389 9.735 1.196 61 HG21 VAL 8 HG21 VAL 8 11.330 7.831 -1.781 62 HG22 VAL 8 HG22 VAL 8 11.256 9.429 -1.037 63 HG23 VAL 8 HG23 VAL 8 9.806 8.719 -1.747 64 H GLU 9 HN GLU 9 13.457 8.217 -0.760 65 HA GLU 9 HA GLU 9 14.133 10.514 0.958 66 HB2 GLU 9 HB2 GLU 9 16.582 9.965 0.092 67 HB3 GLU 9 HB1 GLU 9 15.940 9.219 1.555 68 HG2 GLU 9 HG2 GLU 9 17.013 7.581 -0.014 69 HG3 GLU 9 HG1 GLU 9 15.325 7.216 0.334 70 H LYS 10 HN LYS 10 15.262 12.231 -0.172 71 HA LYS 10 HA LYS 10 15.059 12.138 -3.106 72 HB2 LYS 10 HB2 LYS 10 14.088 14.484 -3.004 73 HB3 LYS 10 HB1 LYS 10 13.000 13.186 -2.511 74 HG2 LYS 10 HG2 LYS 10 14.627 14.219 -0.300 75 HG3 LYS 10 HG1 LYS 10 13.572 15.440 -1.013 76 HD2 LYS 10 HD2 LYS 10 11.654 14.365 -0.357 77 HD3 LYS 10 HD1 LYS 10 12.369 12.762 -0.535 78 HE2 LYS 10 HE2 LYS 10 13.689 13.123 1.522 79 HE3 LYS 10 HE1 LYS 10 12.964 14.720 1.705 80 HZ1 LYS 10 HZ1 LYS 10 11.657 12.076 1.902 81 HZ2 LYS 10 HZ2 LYS 10 10.759 13.495 1.640 82 HZ3 LYS 10 HZ3 LYS 10 11.692 13.324 3.050 83 H ARG 11 HN ARG 11 16.168 14.036 -4.118 84 HA ARG 11 HA ARG 11 18.214 15.281 -2.440 85 HB2 ARG 11 HB2 ARG 11 19.893 14.668 -4.361 86 HB3 ARG 11 HB1 ARG 11 19.575 13.516 -3.070 87 HG2 ARG 11 HG2 ARG 11 19.492 12.330 -5.175 88 HG3 ARG 11 HG1 ARG 11 17.849 12.428 -4.559 89 HD2 ARG 11 HD2 ARG 11 18.654 14.701 -6.261 90 HD3 ARG 11 HD1 ARG 11 18.611 13.150 -7.089 91 HE ARG 11 HE ARG 11 16.345 14.644 -6.152 92 HH11 ARG 11 HH11 ARG 11 17.584 11.442 -6.762 93 HH12 ARG 11 HH12 ARG 11 16.016 10.754 -7.006 94 HH21 ARG 11 HH21 ARG 11 14.309 13.718 -6.476 95 HH22 ARG 11 HH22 ARG 11 14.173 12.031 -6.845 96 H LYS 12 HN LYS 12 19.468 16.940 -3.688 97 HA LYS 12 HA LYS 12 17.813 18.103 -5.846 98 HB2 LYS 12 HB2 LYS 12 18.266 20.325 -4.941 99 HB3 LYS 12 HB1 LYS 12 17.488 19.323 -3.716 100 HG2 LYS 12 HG2 LYS 12 19.696 18.820 -2.727 101 HG3 LYS 12 HG1 LYS 12 20.468 19.841 -3.941 102 HD2 LYS 12 HD2 LYS 12 19.232 21.794 -3.125 103 HD3 LYS 12 HD1 LYS 12 18.393 20.788 -1.943 104 HE2 LYS 12 HE2 LYS 12 20.261 21.947 -0.864 105 HE3 LYS 12 HE1 LYS 12 20.581 20.213 -0.913 106 HZ1 LYS 12 HZ1 LYS 12 22.411 21.846 -1.651 107 HZ2 LYS 12 HZ2 LYS 12 21.521 21.955 -3.094 108 HZ3 LYS 12 HZ3 LYS 12 22.132 20.455 -2.580 109 H CYS 13 HN CYS 13 18.908 19.256 -7.451 110 HA CYS 13 HA CYS 13 21.340 18.255 -8.331 111 HB2 CYS 13 HB2 CYS 13 19.642 19.638 -9.638 112 HB3 CYS 13 HB1 CYS 13 20.396 21.062 -8.920 113 H ASN 14 HN ASN 14 23.143 18.265 -7.121 114 HA ASN 14 HA ASN 14 24.002 20.847 -5.957 115 HB2 ASN 14 HB2 ASN 14 25.209 19.497 -4.248 116 HB3 ASN 14 HB1 ASN 14 23.459 19.295 -4.178 117 HD21 ASN 14 HD21 ASN 14 23.189 17.127 -3.559 118 HD22 ASN 14 HD22 ASN 14 23.913 15.811 -4.349 119 H THR 15 HN THR 15 24.545 19.566 -8.639 120 HA THR 15 HA THR 15 27.419 19.024 -8.446 121 HB THR 15 HB THR 15 26.157 17.511 -9.858 122 HG1 THR 15 HG1 THR 15 27.267 17.967 -11.857 123 HG21 THR 15 HG21 THR 15 25.192 20.070 -11.135 124 HG22 THR 15 HG22 THR 15 24.236 18.738 -10.486 125 HG23 THR 15 HG23 THR 15 25.130 18.529 -11.990 126 H ALA 16 HN ALA 16 28.761 20.026 -10.265 127 HA ALA 16 HA ALA 16 28.816 22.830 -9.907 128 HB1 ALA 16 HB1 ALA 16 30.259 20.906 -11.698 129 HB2 ALA 16 HB2 ALA 16 30.898 21.927 -10.410 130 HB3 ALA 16 HB3 ALA 16 30.437 22.642 -11.955 131 H THR 17 HN THR 17 27.589 20.793 -12.523 132 HA THR 17 HA THR 17 27.143 22.648 -14.511 133 HB THR 17 HB THR 17 25.320 20.376 -13.686 134 HG1 THR 17 HG1 THR 17 27.563 19.922 -14.225 135 HG21 THR 17 HG21 THR 17 24.691 20.484 -16.141 136 HG22 THR 17 HG22 THR 17 25.511 22.044 -16.202 137 HG23 THR 17 HG23 THR 17 24.105 21.826 -15.160 138 H CYS 18 HN CYS 18 24.969 21.887 -11.785 139 HA CYS 18 HA CYS 18 23.021 23.840 -12.503 140 HB2 CYS 18 HB2 CYS 18 23.568 22.221 -10.033 141 HB3 CYS 18 HB1 CYS 18 22.360 23.506 -10.011 142 H ALA 19 HN ALA 19 26.009 23.939 -10.733 143 HA ALA 19 HA ALA 19 25.616 26.243 -9.177 144 HB1 ALA 19 HB1 ALA 19 27.630 24.569 -9.305 145 HB2 ALA 19 HB2 ALA 19 27.920 26.251 -8.864 146 HB3 ALA 19 HB3 ALA 19 28.249 25.702 -10.507 147 H THR 20 HN THR 20 26.861 25.904 -12.500 148 HA THR 20 HA THR 20 27.322 28.631 -12.980 149 HB THR 20 HB THR 20 26.522 26.459 -14.934 150 HG1 THR 20 HG1 THR 20 28.815 26.444 -15.261 151 HG21 THR 20 HG21 THR 20 27.751 29.199 -15.330 152 HG22 THR 20 HG22 THR 20 26.189 28.643 -15.930 153 HG23 THR 20 HG23 THR 20 27.678 27.958 -16.581 154 H GLN 21 HN GLN 21 24.399 26.670 -13.274 155 HA GLN 21 HA GLN 21 22.789 28.485 -14.662 156 HB2 GLN 21 HB2 GLN 21 21.218 26.909 -14.364 157 HB3 GLN 21 HB1 GLN 21 22.440 25.990 -13.490 158 HG2 GLN 21 HG2 GLN 21 21.734 27.189 -11.387 159 HG3 GLN 21 HG1 GLN 21 20.411 27.908 -12.306 160 HE21 GLN 21 HE21 GLN 21 20.840 25.544 -10.135 161 HE22 GLN 21 HE22 GLN 21 19.741 24.383 -10.707 162 H ARG 22 HN ARG 22 23.795 28.444 -11.307 163 HA ARG 22 HA ARG 22 21.827 30.337 -10.425 164 HB2 ARG 22 HB2 ARG 22 22.726 30.088 -8.337 165 HB3 ARG 22 HB1 ARG 22 23.347 28.616 -9.072 166 HG2 ARG 22 HG2 ARG 22 25.301 29.433 -8.170 167 HG3 ARG 22 HG1 ARG 22 25.374 30.244 -9.727 168 HD2 ARG 22 HD2 ARG 22 25.423 32.210 -8.628 169 HD3 ARG 22 HD1 ARG 22 23.778 31.890 -8.087 170 HE ARG 22 HE ARG 22 24.620 31.318 -5.996 171 HH11 ARG 22 HH11 ARG 22 27.199 31.489 -8.341 172 HH12 ARG 22 HH12 ARG 22 28.447 31.356 -7.151 173 HH21 ARG 22 HH21 ARG 22 26.272 31.145 -4.467 174 HH22 ARG 22 HH22 ARG 22 27.929 31.162 -4.973 175 H LEU 23 HN LEU 23 24.911 30.532 -11.985 176 HA LEU 23 HA LEU 23 25.579 33.199 -11.261 177 HB2 LEU 23 HB2 LEU 23 27.217 31.613 -12.213 178 HB3 LEU 23 HB1 LEU 23 26.339 31.633 -13.741 179 HG LEU 23 HG LEU 23 26.715 34.106 -13.871 180 HD11 LEU 23 HD11 LEU 23 27.016 34.701 -11.573 181 HD12 LEU 23 HD12 LEU 23 28.578 34.964 -12.348 182 HD13 LEU 23 HD13 LEU 23 28.312 33.522 -11.367 183 HD21 LEU 23 HD21 LEU 23 29.197 33.915 -14.318 184 HD22 LEU 23 HD22 LEU 23 28.223 32.666 -15.093 185 HD23 LEU 23 HD23 LEU 23 29.133 32.293 -13.629 186 H ALA 24 HN ALA 24 23.652 31.776 -13.847 187 HA ALA 24 HA ALA 24 23.310 34.120 -15.399 188 HB1 ALA 24 HB1 ALA 24 21.183 32.013 -15.193 189 HB2 ALA 24 HB2 ALA 24 22.735 31.624 -15.934 190 HB3 ALA 24 HB3 ALA 24 21.732 32.907 -16.610 191 H ASN 25 HN ASN 25 21.530 32.760 -12.666 192 HA ASN 25 HA ASN 25 19.359 34.588 -12.716 193 HB2 ASN 25 HB2 ASN 25 20.557 32.918 -10.500 194 HB3 ASN 25 HB1 ASN 25 19.092 33.879 -10.309 195 HD21 ASN 25 HD21 ASN 25 17.458 33.432 -12.300 196 HD22 ASN 25 HD22 ASN 25 17.236 31.788 -12.660 197 H PHE 26 HN PHE 26 22.569 34.680 -11.289 198 HA PHE 26 HA PHE 26 22.154 36.934 -9.611 199 HB2 PHE 26 HB2 PHE 26 24.050 35.394 -9.322 200 HB3 PHE 26 HB1 PHE 26 24.715 35.921 -10.867 201 HD1 PHE 26 HD1 PHE 26 23.786 37.073 -7.452 202 HD2 PHE 26 HD2 PHE 26 25.944 37.953 -11.060 203 HE1 PHE 26 HE1 PHE 26 24.883 38.992 -6.328 204 HE2 PHE 26 HE2 PHE 26 27.041 39.872 -9.936 205 HZ PHE 26 HZ PHE 26 26.510 40.392 -7.570 206 H LEU 27 HN LEU 27 23.214 36.587 -12.972 207 HA LEU 27 HA LEU 27 23.999 39.252 -13.381 208 HB2 LEU 27 HB2 LEU 27 24.538 37.387 -14.928 209 HB3 LEU 27 HB1 LEU 27 22.843 37.264 -15.367 210 HG LEU 27 HG LEU 27 24.454 38.551 -16.943 211 HD11 LEU 27 HD11 LEU 27 22.025 40.166 -16.202 212 HD12 LEU 27 HD12 LEU 27 21.848 38.541 -16.864 213 HD13 LEU 27 HD13 LEU 27 22.672 39.788 -17.797 214 HD21 LEU 27 HD21 LEU 27 25.330 39.935 -14.937 215 HD22 LEU 27 HD22 LEU 27 23.850 40.875 -15.118 216 HD23 LEU 27 HD23 LEU 27 25.004 40.785 -16.447 217 H VAL 28 HN VAL 28 20.853 37.654 -13.721 218 HA VAL 28 HA VAL 28 19.555 40.106 -14.593 219 HB VAL 28 HB VAL 28 17.500 38.782 -14.547 220 HG11 VAL 28 HG11 VAL 28 19.202 38.578 -16.432 221 HG12 VAL 28 HG12 VAL 28 18.073 37.232 -16.278 222 HG13 VAL 28 HG13 VAL 28 19.724 37.071 -15.679 223 HG21 VAL 28 HG21 VAL 28 19.243 36.576 -13.403 224 HG22 VAL 28 HG22 VAL 28 17.536 36.439 -13.822 225 HG23 VAL 28 HG23 VAL 28 18.035 37.483 -12.492 226 H HIS 29 HN HIS 29 20.102 38.380 -11.611 227 HA HIS 29 HA HIS 29 18.108 39.736 -10.079 228 HB2 HIS 29 HB2 HIS 29 19.084 37.587 -9.365 229 HB3 HIS 29 HB1 HIS 29 20.652 38.370 -9.165 230 HD1 HIS 29 HD1 HIS 29 17.082 38.754 -7.867 231 HD2 HIS 29 HD2 HIS 29 21.006 39.464 -6.650 232 HE1 HIS 29 HE1 HIS 29 16.954 39.561 -5.470 233 HE2 HIS 29 HE2 HIS 29 19.338 39.998 -4.714 234 H SER 30 HN SER 30 21.333 40.475 -11.095 235 HA SER 30 HA SER 30 21.243 42.938 -9.467 236 HB2 SER 30 HB2 SER 30 23.083 41.429 -8.794 237 HB3 SER 30 HB1 SER 30 23.715 41.483 -10.437 238 HG SER 30 HG SER 30 23.273 43.768 -8.812 239 H SER 31 HN SER 31 20.375 42.195 -12.342 240 HA SER 31 HA SER 31 22.058 43.603 -14.134 241 HB2 SER 31 HB2 SER 31 20.406 41.993 -14.938 242 HB3 SER 31 HB1 SER 31 19.098 42.993 -14.312 243 HG SER 31 HG SER 31 19.210 44.030 -16.126 244 H ASN 32 HN ASN 32 19.267 44.582 -12.190 245 HA ASN 32 HA ASN 32 18.928 47.153 -13.288 246 HB2 ASN 32 HB2 ASN 32 17.773 47.667 -11.152 247 HB3 ASN 32 HB1 ASN 32 17.233 46.148 -11.864 248 HD21 ASN 32 HD21 ASN 32 17.972 47.426 -8.926 249 HD22 ASN 32 HD22 ASN 32 18.573 46.044 -8.145 250 H ASN 33 HN ASN 33 21.051 45.918 -10.770 251 HA ASN 33 HA ASN 33 21.941 48.477 -9.879 252 HB2 ASN 33 HB2 ASN 33 23.122 45.708 -9.592 253 HB3 ASN 33 HB1 ASN 33 23.831 47.143 -8.854 254 HD21 ASN 33 HD21 ASN 33 21.841 48.543 -7.738 255 HD22 ASN 33 HD22 ASN 33 20.891 47.602 -6.693 256 H PHE 34 HN PHE 34 23.084 46.109 -12.206 257 HA PHE 34 HA PHE 34 25.581 47.058 -12.869 258 HB2 PHE 34 HB2 PHE 34 24.590 45.042 -13.878 259 HB3 PHE 34 HB1 PHE 34 23.481 46.052 -14.806 260 HD1 PHE 34 HD1 PHE 34 27.107 45.392 -14.207 261 HD2 PHE 34 HD2 PHE 34 24.144 47.011 -16.862 262 HE1 PHE 34 HE1 PHE 34 28.838 45.687 -15.958 263 HE2 PHE 34 HE2 PHE 34 25.875 47.306 -18.613 264 HZ PHE 34 HZ PHE 34 28.222 46.644 -18.161 265 H GLY 35 HN GLY 35 22.443 48.286 -13.956 266 HA2 GLY 35 HA2 GLY 35 23.407 50.207 -15.800 267 HA3 GLY 35 HA1 GLY 35 21.846 50.264 -14.971 268 H ALA 36 HN ALA 36 22.482 50.542 -12.365 269 HA ALA 36 HA ALA 36 23.115 53.262 -12.122 270 HB1 ALA 36 HB1 ALA 36 22.821 52.982 -9.835 271 HB2 ALA 36 HB2 ALA 36 23.553 51.377 -9.833 272 HB3 ALA 36 HB3 ALA 36 21.924 51.602 -10.470 273 H ILE 37 HN ILE 37 25.108 50.372 -11.831 274 HA ILE 37 HA ILE 37 27.423 51.552 -10.748 275 HB ILE 37 HB ILE 37 27.003 49.118 -12.479 276 HG12 ILE 37 HG12 ILE 37 27.860 49.380 -9.583 277 HG13 ILE 37 HG11 ILE 37 26.173 49.222 -10.072 278 HG21 ILE 37 HG21 ILE 37 29.377 48.555 -11.734 279 HG22 ILE 37 HG22 ILE 37 29.542 50.252 -11.283 280 HG23 ILE 37 HG23 ILE 37 29.244 49.811 -12.965 281 HD11 ILE 37 HD11 ILE 37 28.294 47.247 -10.937 282 HD12 ILE 37 HD12 ILE 37 26.542 47.058 -11.004 283 HD13 ILE 37 HD13 ILE 37 27.370 47.048 -9.448 284 H LEU 38 HN LEU 38 26.287 51.177 -14.070 285 HA LEU 38 HA LEU 38 28.592 51.965 -15.439 286 HB2 LEU 38 HB2 LEU 38 26.590 51.014 -16.537 287 HB3 LEU 38 HB1 LEU 38 25.710 52.505 -16.200 288 HG LEU 38 HG LEU 38 27.440 53.761 -17.510 289 HD11 LEU 38 HD11 LEU 38 29.343 52.320 -17.367 290 HD12 LEU 38 HD12 LEU 38 28.845 52.290 -19.058 291 HD13 LEU 38 HD13 LEU 38 28.435 50.944 -17.995 292 HD21 LEU 38 HD21 LEU 38 25.271 52.863 -18.485 293 HD22 LEU 38 HD22 LEU 38 26.205 51.505 -19.111 294 HD23 LEU 38 HD23 LEU 38 26.555 53.144 -19.660 295 H SER 39 HN SER 39 26.131 53.869 -13.803 296 HA SER 39 HA SER 39 26.787 56.399 -14.866 297 HB2 SER 39 HB2 SER 39 24.736 55.997 -13.576 298 HB3 SER 39 HB1 SER 39 25.695 55.687 -12.132 299 HG SER 39 HG SER 39 25.239 58.083 -13.523 300 H SER 40 HN SER 40 28.038 54.594 -12.088 301 HA SER 40 HA SER 40 29.972 56.720 -11.523 302 HB2 SER 40 HB2 SER 40 29.347 54.129 -10.094 303 HB3 SER 40 HB1 SER 40 30.573 55.282 -9.574 304 HG SER 40 HG SER 40 28.875 56.854 -9.486 305 H THR 41 HN THR 41 30.033 54.930 -13.958 306 HA THR 41 HA THR 41 32.068 53.024 -13.800 307 HB THR 41 HB THR 41 30.611 53.330 -15.772 308 HG1 THR 41 HG1 THR 41 33.337 53.731 -16.425 309 HG21 THR 41 HG21 THR 41 31.067 55.160 -17.340 310 HG22 THR 41 HG22 THR 41 32.312 55.790 -16.262 311 HG23 THR 41 HG23 THR 41 30.621 55.809 -15.762 312 H ASN 42 HN ASN 42 32.227 56.484 -13.716 313 HA ASN 42 HA ASN 42 35.064 56.570 -14.362 314 HB2 ASN 42 HB2 ASN 42 34.857 58.964 -14.110 315 HB3 ASN 42 HB1 ASN 42 33.494 58.380 -15.063 316 HD21 ASN 42 HD21 ASN 42 33.673 60.821 -13.283 317 HD22 ASN 42 HD22 ASN 42 32.405 60.643 -12.169 318 H VAL 43 HN VAL 43 33.739 55.289 -11.821 319 HA VAL 43 HA VAL 43 34.716 56.784 -9.604 320 HB VAL 43 HB VAL 43 32.941 55.026 -9.467 321 HG11 VAL 43 HG11 VAL 43 35.264 53.089 -9.645 322 HG12 VAL 43 HG12 VAL 43 34.178 53.426 -10.993 323 HG13 VAL 43 HG13 VAL 43 33.549 52.696 -9.517 324 HG21 VAL 43 HG21 VAL 43 35.341 54.403 -7.724 325 HG22 VAL 43 HG22 VAL 43 33.637 54.216 -7.307 326 HG23 VAL 43 HG23 VAL 43 34.327 55.828 -7.498 327 H GLY 44 HN GLY 44 36.163 54.543 -11.830 328 HA2 GLY 44 HA2 GLY 44 38.645 54.795 -11.976 329 HA3 GLY 44 HA1 GLY 44 38.654 54.582 -10.228 330 H SER 45 HN SER 45 36.431 52.761 -12.181 331 HA SER 45 HA SER 45 38.151 50.371 -11.969 332 HB2 SER 45 HB2 SER 45 36.169 49.052 -11.312 333 HB3 SER 45 HB1 SER 45 36.544 50.298 -10.126 334 HG SER 45 HG SER 45 34.313 50.238 -10.680 335 H ASN 46 HN ASN 46 37.628 52.101 -14.241 336 HA ASN 46 HA ASN 46 35.846 50.493 -15.929 337 HB2 ASN 46 HB2 ASN 46 35.955 52.290 -17.513 338 HB3 ASN 46 HB1 ASN 46 35.703 53.004 -15.922 339 HD21 ASN 46 HD21 ASN 46 36.837 54.572 -17.982 340 HD22 ASN 46 HD22 ASN 46 38.468 54.869 -17.619 341 H THR 47 HN THR 47 38.510 49.554 -14.979 342 HA THR 47 HA THR 47 40.123 49.522 -17.413 343 HB THR 47 HB THR 47 40.762 47.918 -14.964 344 HG1 THR 47 HG1 THR 47 41.206 50.698 -15.293 345 HG21 THR 47 HG21 THR 47 42.137 47.879 -17.088 346 HG22 THR 47 HG22 THR 47 43.026 48.360 -15.642 347 HG23 THR 47 HG23 THR 47 42.499 49.581 -16.801 348 H TYR 48 HN TYR 48 37.422 48.140 -17.125 349 HA TYR 48 HA TYR 48 38.347 45.476 -18.007 350 HB2 TYR 48 HB2 TYR 48 36.469 44.431 -16.938 351 HB3 TYR 48 HB1 TYR 48 37.267 45.439 -15.731 352 HD1 TYR 48 HD1 TYR 48 34.208 44.812 -17.547 353 HD2 TYR 48 HD2 TYR 48 36.342 47.768 -15.275 354 HE1 TYR 48 HE1 TYR 48 32.097 46.065 -17.194 355 HE2 TYR 48 HE2 TYR 48 34.231 49.020 -14.922 356 HH TYR 48 HH TYR 48 31.866 48.675 -14.947 357 H GLY 49 HN GLY 49 37.559 48.052 -19.403 358 HA2 GLY 49 HA2 GLY 49 35.050 47.787 -20.639 359 HA3 GLY 49 HA1 GLY 49 36.426 48.659 -21.308 360 H LYS 50 HN LYS 50 34.378 46.830 -22.533 361 HA LYS 50 HA LYS 50 35.592 44.389 -23.284 362 HB2 LYS 50 HB2 LYS 50 33.452 46.075 -24.592 363 HB3 LYS 50 HB1 LYS 50 33.943 44.494 -25.203 364 HG2 LYS 50 HG2 LYS 50 33.451 43.537 -22.929 365 HG3 LYS 50 HG1 LYS 50 32.791 45.107 -22.467 366 HD2 LYS 50 HD2 LYS 50 31.813 43.641 -24.920 367 HD3 LYS 50 HD1 LYS 50 31.118 43.344 -23.326 368 HE2 LYS 50 HE2 LYS 50 31.356 46.120 -24.504 369 HE3 LYS 50 HE1 LYS 50 29.931 45.108 -24.737 370 HZ1 LYS 50 HZ1 LYS 50 30.928 45.431 -22.010 371 HZ2 LYS 50 HZ2 LYS 50 29.333 45.280 -22.573 372 HZ3 LYS 50 HZ3 LYS 50 30.150 46.762 -22.714 373 H ARG 51 HN ARG 51 35.681 47.632 -24.676 374 HA ARG 51 HA ARG 51 36.795 47.169 -27.148 375 HB2 ARG 51 HB2 ARG 51 37.761 49.398 -27.015 376 HB3 ARG 51 HB1 ARG 51 36.160 49.403 -26.276 377 HG2 ARG 51 HG2 ARG 51 37.170 49.219 -24.042 378 HG3 ARG 51 HG1 ARG 51 38.779 49.166 -24.761 379 HD2 ARG 51 HD2 ARG 51 38.434 51.423 -24.064 380 HD3 ARG 51 HD1 ARG 51 38.262 51.419 -25.812 381 HE ARG 51 HE ARG 51 36.126 51.794 -23.841 382 HH11 ARG 51 HH11 ARG 51 37.027 51.332 -27.189 383 HH12 ARG 51 HH12 ARG 51 35.537 51.965 -27.792 384 HH21 ARG 51 HH21 ARG 51 34.205 52.623 -24.670 385 HH22 ARG 51 HH22 ARG 51 33.950 52.687 -26.382 386 H ASN 52 HN ASN 52 38.309 46.885 -24.013 387 HA ASN 52 HA ASN 52 41.010 46.919 -24.790 388 HB2 ASN 52 HB2 ASN 52 40.282 46.994 -22.439 389 HB3 ASN 52 HB1 ASN 52 39.709 45.332 -22.565 390 HD21 ASN 52 HD21 ASN 52 41.217 43.733 -22.049 391 HD22 ASN 52 HD22 ASN 52 42.894 43.979 -21.965 392 H ALA 53 HN ALA 53 38.632 44.306 -24.708 393 HA ALA 53 HA ALA 53 40.400 42.187 -25.336 394 HB1 ALA 53 HB1 ALA 53 38.187 41.151 -26.250 395 HB2 ALA 53 HB2 ALA 53 37.434 42.588 -25.558 396 HB3 ALA 53 HB3 ALA 53 38.333 41.479 -24.523 397 H VAL 54 HN VAL 54 38.372 44.265 -27.401 398 HA VAL 54 HA VAL 54 39.217 42.981 -29.828 399 HB VAL 54 HB VAL 54 37.099 44.547 -29.180 400 HG11 VAL 54 HG11 VAL 54 38.854 46.318 -30.896 401 HG12 VAL 54 HG12 VAL 54 38.708 46.536 -29.152 402 HG13 VAL 54 HG13 VAL 54 37.289 46.705 -30.183 403 HG21 VAL 54 HG21 VAL 54 36.750 44.691 -31.680 404 HG22 VAL 54 HG22 VAL 54 37.157 43.078 -31.095 405 HG23 VAL 54 HG23 VAL 54 38.388 44.067 -31.881 406 H GLU 55 HN GLU 55 40.497 45.472 -27.815 407 HA GLU 55 HA GLU 55 42.028 46.800 -29.851 408 HB2 GLU 55 HB2 GLU 55 41.322 47.791 -27.613 409 HB3 GLU 55 HB1 GLU 55 42.597 46.815 -26.884 410 HG2 GLU 55 HG2 GLU 55 43.192 48.594 -29.239 411 HG3 GLU 55 HG1 GLU 55 43.160 49.255 -27.606 412 H VAL 56 HN VAL 56 42.956 44.666 -27.141 413 HA VAL 56 HA VAL 56 45.635 44.334 -27.834 414 HB VAL 56 HB VAL 56 44.623 43.586 -25.691 415 HG11 VAL 56 HG11 VAL 56 43.569 41.294 -27.376 416 HG12 VAL 56 HG12 VAL 56 42.579 42.579 -26.684 417 HG13 VAL 56 HG13 VAL 56 43.423 41.448 -25.626 418 HG21 VAL 56 HG21 VAL 56 45.942 41.285 -27.156 419 HG22 VAL 56 HG22 VAL 56 46.035 41.657 -25.435 420 HG23 VAL 56 HG23 VAL 56 46.828 42.707 -26.609 421 H LEU 57 HN LEU 57 42.761 42.796 -29.124 422 HA LEU 57 HA LEU 57 44.007 40.636 -30.445 423 HB2 LEU 57 HB2 LEU 57 41.385 41.894 -30.433 424 HB3 LEU 57 HB1 LEU 57 41.845 41.370 -32.053 425 HG LEU 57 HG LEU 57 42.578 39.162 -30.856 426 HD11 LEU 57 HD11 LEU 57 42.195 40.240 -28.572 427 HD12 LEU 57 HD12 LEU 57 41.451 38.659 -28.807 428 HD13 LEU 57 HD13 LEU 57 40.468 40.119 -28.909 429 HD21 LEU 57 HD21 LEU 57 40.626 39.533 -32.444 430 HD22 LEU 57 HD22 LEU 57 39.616 39.779 -31.019 431 HD23 LEU 57 HD23 LEU 57 40.406 38.224 -31.283 432 H LYS 58 HN LYS 58 43.405 43.981 -31.412 433 HA LYS 58 HA LYS 58 44.161 43.794 -34.116 434 HB2 LYS 58 HB2 LYS 58 44.289 46.072 -32.138 435 HB3 LYS 58 HB1 LYS 58 44.695 46.256 -33.844 436 HG2 LYS 58 HG2 LYS 58 42.072 45.036 -32.980 437 HG3 LYS 58 HG1 LYS 58 42.264 46.781 -33.143 438 HD2 LYS 58 HD2 LYS 58 43.079 46.414 -35.488 439 HD3 LYS 58 HD1 LYS 58 42.691 44.703 -35.308 440 HE2 LYS 58 HE2 LYS 58 40.687 46.944 -34.927 441 HE3 LYS 58 HE1 LYS 58 40.870 46.023 -36.420 442 HZ1 LYS 58 HZ1 LYS 58 40.311 44.021 -35.274 443 HZ2 LYS 58 HZ2 LYS 58 39.109 45.173 -34.933 444 HZ3 LYS 58 HZ3 LYS 58 40.296 44.811 -33.773 445 H ARG 59 HN ARG 59 46.073 44.343 -31.184 446 HA ARG 59 HA ARG 59 48.537 44.682 -32.651 447 HB2 ARG 59 HB2 ARG 59 47.894 45.641 -30.320 448 HB3 ARG 59 HB1 ARG 59 48.391 44.059 -29.717 449 HG2 ARG 59 HG2 ARG 59 50.598 44.322 -30.719 450 HG3 ARG 59 HG1 ARG 59 50.113 45.848 -31.458 451 HD2 ARG 59 HD2 ARG 59 49.725 46.796 -29.199 452 HD3 ARG 59 HD1 ARG 59 50.270 45.282 -28.484 453 HE ARG 59 HE ARG 59 52.283 46.171 -30.218 454 HH11 ARG 59 HH11 ARG 59 50.702 47.163 -27.272 455 HH12 ARG 59 HH12 ARG 59 52.091 47.996 -26.667 456 HH21 ARG 59 HH21 ARG 59 54.083 47.266 -29.403 457 HH22 ARG 59 HH22 ARG 59 53.995 48.056 -27.864 458 H GLU 60 HN GLU 60 46.715 42.007 -32.285 459 HA GLU 60 HA GLU 60 49.094 40.260 -32.210 460 HB2 GLU 60 HB2 GLU 60 46.393 39.671 -30.974 461 HB3 GLU 60 HB1 GLU 60 47.764 38.563 -31.031 462 HG2 GLU 60 HG2 GLU 60 47.889 41.300 -29.744 463 HG3 GLU 60 HG1 GLU 60 47.523 39.825 -28.851 464 HA PRO 61 HA PRO 61 46.408 39.650 -36.004 465 HB2 PRO 61 HB2 PRO 61 48.415 40.044 -37.831 466 HB3 PRO 61 HB1 PRO 61 47.379 41.345 -37.214 467 HG2 PRO 61 HG2 PRO 61 50.150 40.598 -36.431 468 HG3 PRO 61 HG1 PRO 61 49.418 42.202 -36.610 469 HD2 PRO 61 HD2 PRO 61 49.808 41.007 -34.176 470 HD3 PRO 61 HD1 PRO 61 48.499 42.168 -34.489 471 H LEU 62 HN LEU 62 49.228 38.300 -34.622 472 HA LEU 62 HA LEU 62 49.913 36.288 -36.449 473 HB2 LEU 62 HB2 LEU 62 51.237 36.926 -34.431 474 HB3 LEU 62 HB1 LEU 62 50.028 36.121 -33.430 475 HG LEU 62 HG LEU 62 51.048 34.506 -35.684 476 HD11 LEU 62 HD11 LEU 62 53.113 35.672 -34.986 477 HD12 LEU 62 HD12 LEU 62 53.164 33.967 -34.540 478 HD13 LEU 62 HD13 LEU 62 52.818 35.189 -33.316 479 HD21 LEU 62 HD21 LEU 62 51.169 32.831 -33.776 480 HD22 LEU 62 HD22 LEU 62 49.566 33.504 -34.072 481 HD23 LEU 62 HD23 LEU 62 50.537 34.099 -32.725 482 H ASN 63 HN ASN 63 47.466 36.402 -33.901 483 HA ASN 63 HA ASN 63 46.703 33.693 -33.960 484 HB2 ASN 63 HB2 ASN 63 44.795 34.351 -32.723 485 HB3 ASN 63 HB1 ASN 63 46.063 35.482 -32.252 486 HD21 ASN 63 HD21 ASN 63 43.017 35.814 -32.385 487 HD22 ASN 63 HD22 ASN 63 42.794 37.206 -33.330 488 H TYR 64 HN TYR 64 46.124 36.269 -36.189 489 HA TYR 64 HA TYR 64 43.746 35.181 -37.365 490 HB2 TYR 64 HB2 TYR 64 44.340 37.581 -37.527 491 HB3 TYR 64 HB1 TYR 64 45.731 37.152 -38.523 492 HD1 TYR 64 HD1 TYR 64 42.015 37.004 -38.344 493 HD2 TYR 64 HD2 TYR 64 45.494 36.680 -40.842 494 HE1 TYR 64 HE1 TYR 64 40.566 36.967 -40.357 495 HE2 TYR 64 HE2 TYR 64 44.045 36.642 -42.855 496 HH TYR 64 HH TYR 64 40.681 37.393 -42.711 497 H LEU 65 HN LEU 65 47.206 34.999 -38.047 498 HA LEU 65 HA LEU 65 46.929 33.589 -40.515 499 HB2 LEU 65 HB2 LEU 65 49.263 33.871 -38.608 500 HB3 LEU 65 HB1 LEU 65 49.369 33.115 -40.197 501 HG LEU 65 HG LEU 65 48.358 35.936 -39.769 502 HD11 LEU 65 HD11 LEU 65 50.630 36.574 -40.698 503 HD12 LEU 65 HD12 LEU 65 51.133 34.907 -40.416 504 HD13 LEU 65 HD13 LEU 65 50.658 35.927 -39.058 505 HD21 LEU 65 HD21 LEU 65 49.009 36.036 -42.245 506 HD22 LEU 65 HD22 LEU 65 47.601 35.049 -41.859 507 HD23 LEU 65 HD23 LEU 65 49.156 34.280 -42.176 508 HA PRO 66 HA PRO 66 46.207 29.406 -39.351 509 HB2 PRO 66 HB2 PRO 66 48.755 28.634 -40.699 510 HB3 PRO 66 HB1 PRO 66 47.112 28.018 -40.955 511 HG2 PRO 66 HG2 PRO 66 48.257 29.672 -42.694 512 HG3 PRO 66 HG1 PRO 66 46.526 29.762 -42.328 513 HD2 PRO 66 HD2 PRO 66 48.730 31.581 -41.459 514 HD3 PRO 66 HD1 PRO 66 47.027 31.953 -41.803 515 H LEU 67 HN LEU 67 46.642 28.126 -37.604 516 HA LEU 67 HA LEU 67 49.335 28.190 -36.423 517 HB2 LEU 67 HB2 LEU 67 47.107 29.608 -35.379 518 HB3 LEU 67 HB1 LEU 67 47.407 28.238 -34.309 519 HG LEU 67 HG LEU 67 49.687 29.954 -35.274 520 HD11 LEU 67 HD11 LEU 67 48.071 30.437 -32.754 521 HD12 LEU 67 HD12 LEU 67 47.908 31.402 -34.222 522 HD13 LEU 67 HD13 LEU 67 49.436 31.387 -33.341 523 HD21 LEU 67 HD21 LEU 67 49.992 27.706 -34.110 524 HD22 LEU 67 HD22 LEU 67 49.283 28.448 -32.676 525 HD23 LEU 67 HD23 LEU 67 50.795 29.072 -33.335 Start of MODEL 4 1 H1 THR 1 HT1 THR 1 -4.591 -5.244 0.629 2 H2 THR 1 HT2 THR 1 -4.557 -3.736 -0.152 3 H3 THR 1 HT3 THR 1 -4.613 -3.817 1.545 4 HA THR 1 HA THR 1 -2.427 -5.093 1.359 5 HB THR 1 HB THR 1 -3.039 -4.527 -1.382 6 HG1 THR 1 HG1 THR 1 -0.906 -5.739 0.013 7 HG21 THR 1 HG21 THR 1 -0.915 -3.485 -2.092 8 HG22 THR 1 HG22 THR 1 -0.471 -3.236 -0.406 9 HG23 THR 1 HG23 THR 1 -1.861 -2.388 -1.088 10 HA PRO 2 HA PRO 2 -1.280 -1.212 3.168 11 HB2 PRO 2 HB2 PRO 2 1.424 -1.477 3.396 12 HB3 PRO 2 HB1 PRO 2 0.278 -2.375 4.410 13 HG2 PRO 2 HG2 PRO 2 1.804 -3.277 2.021 14 HG3 PRO 2 HG1 PRO 2 1.424 -4.148 3.517 15 HD2 PRO 2 HD2 PRO 2 0.057 -4.517 1.159 16 HD3 PRO 2 HD1 PRO 2 -0.651 -4.810 2.761 17 H ILE 3 HN ILE 3 -0.400 0.845 2.696 18 HA ILE 3 HA ILE 3 -0.107 1.454 -0.075 19 HB ILE 3 HB ILE 3 -1.059 3.018 1.627 20 HG12 ILE 3 HG12 ILE 3 0.236 5.036 0.779 21 HG13 ILE 3 HG11 ILE 3 1.330 3.904 -0.016 22 HG21 ILE 3 HG21 ILE 3 0.696 2.466 3.363 23 HG22 ILE 3 HG22 ILE 3 0.413 4.192 3.137 24 HG23 ILE 3 HG23 ILE 3 1.835 3.430 2.424 25 HD11 ILE 3 HD11 ILE 3 -1.663 3.830 -0.446 26 HD12 ILE 3 HD12 ILE 3 -0.409 3.048 -1.409 27 HD13 ILE 3 HD13 ILE 3 -0.588 4.802 -1.451 28 H GLU 4 HN GLU 4 1.679 1.758 -1.294 29 HA GLU 4 HA GLU 4 4.182 0.730 -0.368 30 HB2 GLU 4 HB2 GLU 4 5.004 1.298 -2.593 31 HB3 GLU 4 HB1 GLU 4 3.418 0.537 -2.721 32 HG2 GLU 4 HG2 GLU 4 2.373 2.786 -2.856 33 HG3 GLU 4 HG1 GLU 4 3.977 3.516 -2.803 34 H SER 5 HN SER 5 6.118 1.818 0.002 35 HA SER 5 HA SER 5 5.875 4.413 1.186 36 HB2 SER 5 HB2 SER 5 8.223 4.197 1.687 37 HB3 SER 5 HB1 SER 5 7.464 2.631 1.955 38 HG SER 5 HG SER 5 8.975 3.493 -0.288 39 H HIS 6 HN HIS 6 7.239 6.267 0.582 40 HA HIS 6 HA HIS 6 7.351 6.555 -2.354 41 HB2 HIS 6 HB2 HIS 6 7.216 8.984 -1.924 42 HB3 HIS 6 HB1 HIS 6 5.838 8.122 -1.239 43 HD1 HIS 6 HD1 HIS 6 9.087 9.775 -0.226 44 HD2 HIS 6 HD2 HIS 6 5.648 8.241 1.565 45 HE1 HIS 6 HE1 HIS 6 9.188 10.449 2.214 46 HE2 HIS 6 HE2 HIS 6 7.098 9.521 3.319 47 H GLN 7 HN GLN 7 9.435 5.396 -0.492 48 HA GLN 7 HA GLN 7 11.586 7.314 -0.448 49 HB2 GLN 7 HB2 GLN 7 11.334 5.437 1.203 50 HB3 GLN 7 HB1 GLN 7 11.744 4.314 -0.095 51 HG2 GLN 7 HG2 GLN 7 13.894 5.474 -0.427 52 HG3 GLN 7 HG1 GLN 7 13.488 6.599 0.868 53 HE21 GLN 7 HE21 GLN 7 14.421 6.025 2.828 54 HE22 GLN 7 HE22 GLN 7 14.763 4.437 3.318 55 H VAL 8 HN VAL 8 13.042 7.712 -1.999 56 HA VAL 8 HA VAL 8 13.434 5.735 -4.143 57 HB VAL 8 HB VAL 8 11.777 7.334 -4.988 58 HG11 VAL 8 HG11 VAL 8 12.446 9.216 -3.489 59 HG12 VAL 8 HG12 VAL 8 12.325 9.707 -5.179 60 HG13 VAL 8 HG13 VAL 8 13.908 9.426 -4.453 61 HG21 VAL 8 HG21 VAL 8 14.485 7.938 -6.204 62 HG22 VAL 8 HG22 VAL 8 12.923 7.910 -7.022 63 HG23 VAL 8 HG23 VAL 8 13.644 6.407 -6.447 64 H GLU 9 HN GLU 9 15.499 5.603 -4.881 65 HA GLU 9 HA GLU 9 17.414 7.719 -4.274 66 HB2 GLU 9 HB2 GLU 9 18.948 5.742 -3.389 67 HB3 GLU 9 HB1 GLU 9 17.872 6.619 -2.303 68 HG2 GLU 9 HG2 GLU 9 17.711 4.123 -2.075 69 HG3 GLU 9 HG1 GLU 9 16.181 4.894 -2.485 70 H LYS 10 HN LYS 10 19.485 7.386 -5.357 71 HA LYS 10 HA LYS 10 19.440 5.373 -7.504 72 HB2 LYS 10 HB2 LYS 10 20.301 7.207 -9.059 73 HB3 LYS 10 HB1 LYS 10 18.587 7.272 -8.646 74 HG2 LYS 10 HG2 LYS 10 20.422 8.716 -6.812 75 HG3 LYS 10 HG1 LYS 10 20.231 9.409 -8.424 76 HD2 LYS 10 HD2 LYS 10 18.050 9.982 -8.065 77 HD3 LYS 10 HD1 LYS 10 17.723 8.536 -7.109 78 HE2 LYS 10 HE2 LYS 10 18.903 9.510 -5.191 79 HE3 LYS 10 HE1 LYS 10 19.299 10.941 -6.142 80 HZ1 LYS 10 HZ1 LYS 10 16.647 10.034 -5.204 81 HZ2 LYS 10 HZ2 LYS 10 16.805 11.143 -6.482 82 HZ3 LYS 10 HZ3 LYS 10 17.407 11.527 -4.940 83 H ARG 11 HN ARG 11 21.481 4.763 -8.267 84 HA ARG 11 HA ARG 11 23.835 5.998 -7.058 85 HB2 ARG 11 HB2 ARG 11 24.616 3.486 -6.638 86 HB3 ARG 11 HB1 ARG 11 23.760 4.408 -5.412 87 HG2 ARG 11 HG2 ARG 11 22.672 2.299 -5.482 88 HG3 ARG 11 HG1 ARG 11 21.595 3.370 -6.361 89 HD2 ARG 11 HD2 ARG 11 23.719 1.845 -7.842 90 HD3 ARG 11 HD1 ARG 11 22.232 1.034 -7.375 91 HE ARG 11 HE ARG 11 22.524 3.048 -9.429 92 HH11 ARG 11 HH11 ARG 11 20.350 1.490 -7.189 93 HH12 ARG 11 HH12 ARG 11 18.939 1.867 -8.115 94 HH21 ARG 11 HH21 ARG 11 20.663 3.523 -10.618 95 HH22 ARG 11 HH22 ARG 11 19.112 3.010 -10.043 96 H LYS 12 HN LYS 12 23.571 6.531 -9.494 97 HA LYS 12 HA LYS 12 24.534 4.418 -11.257 98 HB2 LYS 12 HB2 LYS 12 24.223 6.040 -13.042 99 HB3 LYS 12 HB1 LYS 12 22.789 6.020 -12.014 100 HG2 LYS 12 HG2 LYS 12 23.677 7.990 -10.780 101 HG3 LYS 12 HG1 LYS 12 25.051 8.035 -11.885 102 HD2 LYS 12 HD2 LYS 12 23.555 8.396 -13.785 103 HD3 LYS 12 HD1 LYS 12 22.148 8.260 -12.731 104 HE2 LYS 12 HE2 LYS 12 22.547 10.608 -13.037 105 HE3 LYS 12 HE1 LYS 12 23.088 10.212 -11.406 106 HZ1 LYS 12 HZ1 LYS 12 24.899 11.334 -12.147 107 HZ2 LYS 12 HZ2 LYS 12 24.657 10.904 -13.773 108 HZ3 LYS 12 HZ3 LYS 12 25.331 9.785 -12.687 109 H CYS 13 HN CYS 13 26.488 4.386 -12.279 110 HA CYS 13 HA CYS 13 28.814 4.459 -12.137 111 HB2 CYS 13 HB2 CYS 13 27.936 6.091 -13.906 112 HB3 CYS 13 HB1 CYS 13 28.333 7.365 -12.753 113 H ASN 14 HN ASN 14 29.139 4.136 -9.863 114 HA ASN 14 HA ASN 14 29.978 6.602 -8.457 115 HB2 ASN 14 HB2 ASN 14 27.928 5.316 -7.545 116 HB3 ASN 14 HB1 ASN 14 29.098 4.100 -7.035 117 HD21 ASN 14 HD21 ASN 14 29.026 4.499 -4.762 118 HD22 ASN 14 HD22 ASN 14 29.491 5.978 -4.071 119 H THR 15 HN THR 15 31.539 4.862 -10.233 120 HA THR 15 HA THR 15 33.359 3.512 -8.367 121 HB THR 15 HB THR 15 32.633 2.271 -10.370 122 HG1 THR 15 HG1 THR 15 34.707 1.687 -11.014 123 HG21 THR 15 HG21 THR 15 33.495 3.035 -12.594 124 HG22 THR 15 HG22 THR 15 33.974 4.555 -11.841 125 HG23 THR 15 HG23 THR 15 32.271 4.105 -11.913 126 H ALA 16 HN ALA 16 35.770 3.709 -9.366 127 HA ALA 16 HA ALA 16 36.559 6.403 -8.796 128 HB1 ALA 16 HB1 ALA 16 38.040 3.919 -9.638 129 HB2 ALA 16 HB2 ALA 16 38.079 4.748 -8.082 130 HB3 ALA 16 HB3 ALA 16 38.857 5.474 -9.488 131 H THR 17 HN THR 17 36.068 4.522 -11.706 132 HA THR 17 HA THR 17 37.501 6.070 -13.547 133 HB THR 17 HB THR 17 34.909 4.557 -13.948 134 HG1 THR 17 HG1 THR 17 36.224 2.962 -13.632 135 HG21 THR 17 HG21 THR 17 35.713 4.485 -16.335 136 HG22 THR 17 HG22 THR 17 36.943 5.669 -15.895 137 HG23 THR 17 HG23 THR 17 35.234 6.091 -15.784 138 H CYS 18 HN CYS 18 34.158 6.418 -12.382 139 HA CYS 18 HA CYS 18 33.414 8.562 -14.041 140 HB2 CYS 18 HB2 CYS 18 32.317 7.171 -11.787 141 HB3 CYS 18 HB1 CYS 18 32.151 8.907 -11.527 142 H ALA 19 HN ALA 19 35.221 8.448 -11.032 143 HA ALA 19 HA ALA 19 35.130 11.136 -10.284 144 HB1 ALA 19 HB1 ALA 19 36.279 9.043 -9.167 145 HB2 ALA 19 HB2 ALA 19 36.913 10.663 -8.879 146 HB3 ALA 19 HB3 ALA 19 37.695 9.606 -10.054 147 H THR 20 HN THR 20 37.279 9.484 -12.579 148 HA THR 20 HA THR 20 38.967 11.631 -13.180 149 HB THR 20 HB THR 20 37.995 9.422 -15.011 150 HG1 THR 20 HG1 THR 20 40.016 8.507 -14.355 151 HG21 THR 20 HG21 THR 20 40.303 11.371 -15.193 152 HG22 THR 20 HG22 THR 20 38.979 11.167 -16.341 153 HG23 THR 20 HG23 THR 20 40.195 9.903 -16.164 154 H GLN 21 HN GLN 21 35.787 10.769 -14.473 155 HA GLN 21 HA GLN 21 35.650 12.569 -16.593 156 HB2 GLN 21 HB2 GLN 21 33.514 11.868 -16.765 157 HB3 GLN 21 HB1 GLN 21 33.922 10.765 -15.453 158 HG2 GLN 21 HG2 GLN 21 33.225 12.592 -13.837 159 HG3 GLN 21 HG1 GLN 21 32.605 13.483 -15.226 160 HE21 GLN 21 HE21 GLN 21 30.495 13.110 -13.873 161 HE22 GLN 21 HE22 GLN 21 29.635 11.685 -14.206 162 H ARG 22 HN ARG 22 35.405 13.146 -13.149 163 HA ARG 22 HA ARG 22 34.278 15.780 -13.446 164 HB2 ARG 22 HB2 ARG 22 34.175 15.850 -11.160 165 HB3 ARG 22 HB1 ARG 22 34.288 14.108 -11.370 166 HG2 ARG 22 HG2 ARG 22 35.951 14.393 -9.806 167 HG3 ARG 22 HG1 ARG 22 36.915 14.646 -11.253 168 HD2 ARG 22 HD2 ARG 22 37.442 16.689 -10.470 169 HD3 ARG 22 HD1 ARG 22 35.754 17.147 -10.669 170 HE ARG 22 HE ARG 22 35.496 16.986 -8.371 171 HH11 ARG 22 HH11 ARG 22 38.413 15.353 -9.365 172 HH12 ARG 22 HH12 ARG 22 38.949 15.073 -7.745 173 HH21 ARG 22 HH21 ARG 22 36.221 16.605 -6.265 174 HH22 ARG 22 HH22 ARG 22 37.718 15.775 -6.000 175 H LEU 23 HN LEU 23 37.450 14.413 -13.524 176 HA LEU 23 HA LEU 23 38.992 16.661 -12.821 177 HB2 LEU 23 HB2 LEU 23 39.940 14.394 -13.102 178 HB3 LEU 23 HB1 LEU 23 39.644 14.494 -14.837 179 HG LEU 23 HG LEU 23 41.107 16.524 -14.922 180 HD11 LEU 23 HD11 LEU 23 40.971 17.352 -12.682 181 HD12 LEU 23 HD12 LEU 23 42.633 16.801 -12.891 182 HD13 LEU 23 HD13 LEU 23 41.478 15.804 -12.006 183 HD21 LEU 23 HD21 LEU 23 43.202 15.294 -14.749 184 HD22 LEU 23 HD22 LEU 23 41.961 14.212 -15.381 185 HD23 LEU 23 HD23 LEU 23 42.451 14.099 -13.690 186 H ALA 24 HN ALA 24 37.594 15.630 -15.901 187 HA ALA 24 HA ALA 24 38.729 17.694 -17.492 188 HB1 ALA 24 HB1 ALA 24 36.049 16.493 -18.105 189 HB2 ALA 24 HB2 ALA 24 37.493 15.485 -18.185 190 HB3 ALA 24 HB3 ALA 24 37.360 16.916 -19.206 191 H ASN 25 HN ASN 25 35.741 17.408 -15.639 192 HA ASN 25 HA ASN 25 34.528 19.814 -16.500 193 HB2 ASN 25 HB2 ASN 25 34.249 18.190 -13.968 194 HB3 ASN 25 HB1 ASN 25 33.273 19.619 -14.301 195 HD21 ASN 25 HD21 ASN 25 32.173 16.933 -14.068 196 HD22 ASN 25 HD22 ASN 25 31.525 16.522 -15.582 197 H PHE 26 HN PHE 26 36.993 19.101 -14.132 198 HA PHE 26 HA PHE 26 36.893 21.524 -12.668 199 HB2 PHE 26 HB2 PHE 26 38.092 19.498 -11.897 200 HB3 PHE 26 HB1 PHE 26 39.276 19.730 -13.184 201 HD1 PHE 26 HD1 PHE 26 37.795 21.323 -10.158 202 HD2 PHE 26 HD2 PHE 26 41.055 21.288 -12.954 203 HE1 PHE 26 HE1 PHE 26 39.041 22.918 -8.725 204 HE2 PHE 26 HE2 PHE 26 42.301 22.883 -11.522 205 HZ PHE 26 HZ PHE 26 41.294 23.698 -9.407 206 H LEU 27 HN LEU 27 38.487 20.600 -15.669 207 HA LEU 27 HA LEU 27 40.208 22.805 -15.903 208 HB2 LEU 27 HB2 LEU 27 40.355 20.755 -17.302 209 HB3 LEU 27 HB1 LEU 27 38.847 21.191 -18.090 210 HG LEU 27 HG LEU 27 41.087 21.725 -19.288 211 HD11 LEU 27 HD11 LEU 27 39.282 24.124 -19.078 212 HD12 LEU 27 HD12 LEU 27 38.684 22.614 -19.764 213 HD13 LEU 27 HD13 LEU 27 40.061 23.433 -20.499 214 HD21 LEU 27 HD21 LEU 27 41.984 22.865 -17.149 215 HD22 LEU 27 HD22 LEU 27 40.984 24.237 -17.620 216 HD23 LEU 27 HD23 LEU 27 42.268 23.676 -18.688 217 H VAL 28 HN VAL 28 36.825 22.359 -16.845 218 HA VAL 28 HA VAL 28 36.679 25.068 -17.930 219 HB VAL 28 HB VAL 28 34.330 24.514 -18.403 220 HG11 VAL 28 HG11 VAL 28 36.248 23.766 -19.901 221 HG12 VAL 28 HG12 VAL 28 34.748 22.857 -20.082 222 HG13 VAL 28 HG13 VAL 28 36.089 22.172 -19.164 223 HG21 VAL 28 HG21 VAL 28 34.954 21.825 -17.144 224 HG22 VAL 28 HG22 VAL 28 33.414 22.338 -17.832 225 HG23 VAL 28 HG23 VAL 28 34.012 23.090 -16.354 226 H HIS 29 HN HIS 29 36.010 23.389 -14.968 227 HA HIS 29 HA HIS 29 34.239 25.356 -13.865 228 HB2 HIS 29 HB2 HIS 29 34.415 22.973 -13.072 229 HB3 HIS 29 HB1 HIS 29 35.978 23.388 -12.367 230 HD1 HIS 29 HD1 HIS 29 32.396 24.713 -12.251 231 HD2 HIS 29 HD2 HIS 29 35.745 24.356 -9.794 232 HE1 HIS 29 HE1 HIS 29 31.709 25.583 -9.973 233 HE2 HIS 29 HE2 HIS 29 33.740 25.372 -8.464 234 H SER 30 HN SER 30 37.679 24.898 -14.030 235 HA SER 30 HA SER 30 38.074 27.288 -12.347 236 HB2 SER 30 HB2 SER 30 39.230 25.274 -11.540 237 HB3 SER 30 HB1 SER 30 40.070 25.133 -13.081 238 HG SER 30 HG SER 30 41.450 26.513 -12.328 239 H SER 31 HN SER 31 37.517 26.898 -15.395 240 HA SER 31 HA SER 31 39.850 27.846 -16.736 241 HB2 SER 31 HB2 SER 31 38.095 26.625 -17.931 242 HB3 SER 31 HB1 SER 31 36.944 27.911 -17.580 243 HG SER 31 HG SER 31 38.197 27.879 -19.689 244 H ASN 32 HN ASN 32 37.254 29.392 -15.009 245 HA ASN 32 HA ASN 32 37.404 31.961 -16.164 246 HB2 ASN 32 HB2 ASN 32 36.307 32.735 -14.122 247 HB3 ASN 32 HB1 ASN 32 35.568 31.239 -14.685 248 HD21 ASN 32 HD21 ASN 32 35.827 32.417 -11.868 249 HD22 ASN 32 HD22 ASN 32 36.527 31.167 -10.958 250 H ASN 33 HN ASN 33 39.137 30.485 -13.449 251 HA ASN 33 HA ASN 33 40.558 32.846 -12.741 252 HB2 ASN 33 HB2 ASN 33 41.057 29.922 -12.161 253 HB3 ASN 33 HB1 ASN 33 42.072 31.214 -11.523 254 HD21 ASN 33 HD21 ASN 33 40.559 33.110 -10.518 255 HD22 ASN 33 HD22 ASN 33 39.343 32.539 -9.481 256 H PHE 34 HN PHE 34 41.217 30.095 -14.828 257 HA PHE 34 HA PHE 34 43.888 30.400 -15.411 258 HB2 PHE 34 HB2 PHE 34 42.507 28.579 -16.316 259 HB3 PHE 34 HB1 PHE 34 41.681 29.727 -17.371 260 HD1 PHE 34 HD1 PHE 34 45.058 28.362 -16.540 261 HD2 PHE 34 HD2 PHE 34 42.593 30.311 -19.468 262 HE1 PHE 34 HE1 PHE 34 46.863 28.116 -18.224 263 HE2 PHE 34 HE2 PHE 34 44.398 30.067 -21.151 264 HZ PHE 34 HZ PHE 34 46.533 28.969 -20.529 265 H GLY 35 HN GLY 35 41.156 32.189 -16.804 266 HA2 GLY 35 HA2 GLY 35 42.609 33.655 -18.727 267 HA3 GLY 35 HA1 GLY 35 41.075 34.146 -18.007 268 H ALA 36 HN ALA 36 41.624 34.583 -15.411 269 HA ALA 36 HA ALA 36 42.921 37.078 -15.427 270 HB1 ALA 36 HB1 ALA 36 42.388 37.211 -13.172 271 HB2 ALA 36 HB2 ALA 36 42.701 35.498 -12.891 272 HB3 ALA 36 HB3 ALA 36 41.226 36.000 -13.716 273 H ILE 37 HN ILE 37 44.086 33.844 -14.729 274 HA ILE 37 HA ILE 37 46.543 34.535 -13.518 275 HB ILE 37 HB ILE 37 45.637 32.108 -15.063 276 HG12 ILE 37 HG12 ILE 37 46.372 32.458 -12.143 277 HG13 ILE 37 HG11 ILE 37 44.728 32.659 -12.748 278 HG21 ILE 37 HG21 ILE 37 47.755 31.069 -14.084 279 HG22 ILE 37 HG22 ILE 37 48.311 32.715 -13.779 280 HG23 ILE 37 HG23 ILE 37 48.002 32.180 -15.431 281 HD11 ILE 37 HD11 ILE 37 45.331 30.339 -11.836 282 HD12 ILE 37 HD12 ILE 37 46.333 30.151 -13.274 283 HD13 ILE 37 HD13 ILE 37 44.593 30.384 -13.436 284 H LEU 38 HN LEU 38 45.571 34.117 -16.886 285 HA LEU 38 HA LEU 38 48.101 34.206 -18.092 286 HB2 LEU 38 HB2 LEU 38 46.023 33.597 -19.288 287 HB3 LEU 38 HB1 LEU 38 45.479 35.270 -19.174 288 HG LEU 38 HG LEU 38 47.536 35.972 -20.421 289 HD11 LEU 38 HD11 LEU 38 49.054 34.181 -19.964 290 HD12 LEU 38 HD12 LEU 38 48.689 34.073 -21.685 291 HD13 LEU 38 HD13 LEU 38 47.911 32.972 -20.549 292 HD21 LEU 38 HD21 LEU 38 45.303 35.466 -21.517 293 HD22 LEU 38 HD22 LEU 38 45.943 33.872 -21.915 294 HD23 LEU 38 HD23 LEU 38 46.701 35.317 -22.583 295 H SER 39 HN SER 39 46.061 36.746 -16.810 296 HA SER 39 HA SER 39 47.276 38.967 -18.052 297 HB2 SER 39 HB2 SER 39 45.158 39.119 -16.804 298 HB3 SER 39 HB1 SER 39 46.017 38.782 -15.304 299 HG SER 39 HG SER 39 45.811 41.097 -16.734 300 H SER 40 HN SER 40 48.056 37.218 -15.070 301 HA SER 40 HA SER 40 50.418 38.916 -14.673 302 HB2 SER 40 HB2 SER 40 49.227 36.744 -12.935 303 HB3 SER 40 HB1 SER 40 50.616 37.740 -12.511 304 HG SER 40 HG SER 40 49.334 39.464 -12.311 305 H THR 41 HN THR 41 50.082 36.818 -16.833 306 HA THR 41 HA THR 41 51.691 34.575 -16.241 307 HB THR 41 HB THR 41 50.158 34.867 -18.237 308 HG1 THR 41 HG1 THR 41 52.824 34.150 -18.863 309 HG21 THR 41 HG21 THR 41 50.991 36.020 -20.176 310 HG22 THR 41 HG22 THR 41 52.549 36.310 -19.403 311 HG23 THR 41 HG23 THR 41 51.106 37.139 -18.818 312 H ASN 42 HN ASN 42 52.482 37.877 -16.918 313 HA ASN 42 HA ASN 42 55.264 37.245 -17.562 314 HB2 ASN 42 HB2 ASN 42 55.514 39.601 -18.010 315 HB3 ASN 42 HB1 ASN 42 54.025 39.050 -18.775 316 HD21 ASN 42 HD21 ASN 42 54.272 41.782 -18.195 317 HD22 ASN 42 HD22 ASN 42 53.242 42.186 -16.908 318 H VAL 43 HN VAL 43 54.020 36.737 -14.873 319 HA VAL 43 HA VAL 43 55.409 38.630 -13.141 320 HB VAL 43 HB VAL 43 53.086 37.617 -12.698 321 HG11 VAL 43 HG11 VAL 43 54.723 35.320 -11.607 322 HG12 VAL 43 HG12 VAL 43 53.968 35.259 -13.200 323 HG13 VAL 43 HG13 VAL 43 52.970 35.437 -11.758 324 HG21 VAL 43 HG21 VAL 43 55.088 37.249 -10.458 325 HG22 VAL 43 HG22 VAL 43 53.414 37.788 -10.343 326 HG23 VAL 43 HG23 VAL 43 54.633 38.845 -11.054 327 H GLY 44 HN GLY 44 56.757 36.564 -14.986 328 HA2 GLY 44 HA2 GLY 44 59.020 35.849 -14.605 329 HA3 GLY 44 HA1 GLY 44 58.598 35.539 -12.924 330 H SER 45 HN SER 45 55.982 34.320 -14.083 331 HA SER 45 HA SER 45 57.091 31.624 -14.346 332 HB2 SER 45 HB2 SER 45 54.766 30.887 -14.012 333 HB3 SER 45 HB1 SER 45 55.279 31.979 -12.729 334 HG SER 45 HG SER 45 53.773 33.302 -13.337 335 H ASN 46 HN ASN 46 57.353 33.519 -16.544 336 HA ASN 46 HA ASN 46 55.484 32.469 -18.553 337 HB2 ASN 46 HB2 ASN 46 56.292 34.239 -19.989 338 HB3 ASN 46 HB1 ASN 46 55.900 34.927 -18.414 339 HD21 ASN 46 HD21 ASN 46 57.690 36.353 -19.998 340 HD22 ASN 46 HD22 ASN 46 59.260 36.218 -19.368 341 H THR 47 HN THR 47 57.803 30.964 -17.305 342 HA THR 47 HA THR 47 59.537 30.564 -19.636 343 HB THR 47 HB THR 47 59.796 29.048 -17.060 344 HG1 THR 47 HG1 THR 47 60.458 30.765 -16.042 345 HG21 THR 47 HG21 THR 47 61.213 28.622 -19.125 346 HG22 THR 47 HG22 THR 47 62.116 29.007 -17.660 347 HG23 THR 47 HG23 THR 47 61.880 30.239 -18.900 348 H TYR 48 HN TYR 48 56.663 29.717 -19.499 349 HA TYR 48 HA TYR 48 57.119 26.887 -20.197 350 HB2 TYR 48 HB2 TYR 48 55.220 26.149 -19.011 351 HB3 TYR 48 HB1 TYR 48 56.030 27.244 -17.891 352 HD1 TYR 48 HD1 TYR 48 52.951 26.474 -19.471 353 HD2 TYR 48 HD2 TYR 48 55.305 29.776 -18.055 354 HE1 TYR 48 HE1 TYR 48 50.913 27.884 -19.371 355 HE2 TYR 48 HE2 TYR 48 53.268 31.186 -17.955 356 HH TYR 48 HH TYR 48 50.563 30.617 -19.501 357 H GLY 49 HN GLY 49 56.727 29.514 -21.680 358 HA2 GLY 49 HA2 GLY 49 54.192 29.596 -22.890 359 HA3 GLY 49 HA1 GLY 49 55.676 30.224 -23.598 360 H LYS 50 HN LYS 50 53.279 28.517 -24.562 361 HA LYS 50 HA LYS 50 54.344 25.993 -25.344 362 HB2 LYS 50 HB2 LYS 50 52.015 27.633 -26.354 363 HB3 LYS 50 HB1 LYS 50 52.407 26.030 -26.977 364 HG2 LYS 50 HG2 LYS 50 52.281 25.146 -24.636 365 HG3 LYS 50 HG1 LYS 50 51.732 26.737 -24.108 366 HD2 LYS 50 HD2 LYS 50 50.331 25.197 -26.300 367 HD3 LYS 50 HD1 LYS 50 49.898 25.017 -24.600 368 HE2 LYS 50 HE2 LYS 50 49.926 27.645 -26.114 369 HE3 LYS 50 HE1 LYS 50 48.480 26.707 -25.741 370 HZ1 LYS 50 HZ1 LYS 50 50.300 28.099 -23.877 371 HZ2 LYS 50 HZ2 LYS 50 49.272 26.857 -23.342 372 HZ3 LYS 50 HZ3 LYS 50 48.619 28.263 -24.036 373 H ARG 51 HN ARG 51 54.429 29.204 -26.710 374 HA ARG 51 HA ARG 51 55.019 28.705 -29.366 375 HB2 ARG 51 HB2 ARG 51 56.144 30.859 -29.397 376 HB3 ARG 51 HB1 ARG 51 54.706 30.962 -28.382 377 HG2 ARG 51 HG2 ARG 51 56.086 30.669 -26.368 378 HG3 ARG 51 HG1 ARG 51 57.532 30.523 -27.366 379 HD2 ARG 51 HD2 ARG 51 57.478 32.784 -26.613 380 HD3 ARG 51 HD1 ARG 51 56.982 32.822 -28.298 381 HE ARG 51 HE ARG 51 55.281 33.300 -25.960 382 HH11 ARG 51 HH11 ARG 51 55.512 32.846 -29.420 383 HH12 ARG 51 HH12 ARG 51 53.984 33.589 -29.731 384 HH21 ARG 51 HH21 ARG 51 53.301 34.272 -26.411 385 HH22 ARG 51 HH22 ARG 51 52.739 34.386 -28.046 386 H ASN 52 HN ASN 52 56.977 28.124 -26.559 387 HA ASN 52 HA ASN 52 59.536 28.084 -27.698 388 HB2 ASN 52 HB2 ASN 52 58.658 27.720 -25.213 389 HB3 ASN 52 HB1 ASN 52 58.824 26.024 -25.664 390 HD21 ASN 52 HD21 ASN 52 61.107 26.465 -27.488 391 HD22 ASN 52 HD22 ASN 52 62.440 26.832 -26.504 392 H ALA 53 HN ALA 53 56.978 25.665 -27.660 393 HA ALA 53 HA ALA 53 58.476 23.492 -28.672 394 HB1 ALA 53 HB1 ALA 53 56.317 22.498 -29.215 395 HB2 ALA 53 HB2 ALA 53 55.526 24.065 -29.040 396 HB3 ALA 53 HB3 ALA 53 56.234 23.273 -27.633 397 H VAL 54 HN VAL 54 56.531 25.986 -30.313 398 HA VAL 54 HA VAL 54 57.039 24.934 -32.931 399 HB VAL 54 HB VAL 54 55.199 26.660 -31.915 400 HG11 VAL 54 HG11 VAL 54 57.027 28.377 -33.612 401 HG12 VAL 54 HG12 VAL 54 57.043 28.427 -31.849 402 HG13 VAL 54 HG13 VAL 54 55.584 28.874 -32.729 403 HG21 VAL 54 HG21 VAL 54 54.609 27.077 -34.309 404 HG22 VAL 54 HG22 VAL 54 54.965 25.381 -33.980 405 HG23 VAL 54 HG23 VAL 54 56.167 26.395 -34.779 406 H GLU 55 HN GLU 55 58.776 26.979 -30.767 407 HA GLU 55 HA GLU 55 60.326 28.321 -32.799 408 HB2 GLU 55 HB2 GLU 55 59.841 29.187 -30.438 409 HB3 GLU 55 HB1 GLU 55 61.072 28.050 -29.888 410 HG2 GLU 55 HG2 GLU 55 61.640 29.973 -32.137 411 HG3 GLU 55 HG1 GLU 55 61.816 30.472 -30.455 412 H VAL 56 HN VAL 56 61.152 25.910 -30.287 413 HA VAL 56 HA VAL 56 63.728 25.333 -31.140 414 HB VAL 56 HB VAL 56 62.698 24.506 -29.030 415 HG11 VAL 56 HG11 VAL 56 61.396 22.457 -30.847 416 HG12 VAL 56 HG12 VAL 56 60.541 23.791 -30.073 417 HG13 VAL 56 HG13 VAL 56 61.277 22.526 -29.089 418 HG21 VAL 56 HG21 VAL 56 63.923 22.438 -28.993 419 HG22 VAL 56 HG22 VAL 56 64.781 23.510 -30.101 420 HG23 VAL 56 HG23 VAL 56 63.744 22.232 -30.736 421 H LEU 57 HN LEU 57 60.652 24.174 -32.392 422 HA LEU 57 HA LEU 57 61.623 22.057 -33.972 423 HB2 LEU 57 HB2 LEU 57 59.145 23.569 -33.739 424 HB3 LEU 57 HB1 LEU 57 59.495 23.139 -35.413 425 HG LEU 57 HG LEU 57 60.029 20.776 -34.436 426 HD11 LEU 57 HD11 LEU 57 59.854 21.684 -32.056 427 HD12 LEU 57 HD12 LEU 57 58.934 20.216 -32.384 428 HD13 LEU 57 HD13 LEU 57 58.113 21.775 -32.317 429 HD21 LEU 57 HD21 LEU 57 58.066 21.482 -35.892 430 HD22 LEU 57 HD22 LEU 57 57.145 21.704 -34.404 431 HD23 LEU 57 HD23 LEU 57 57.755 20.106 -34.834 432 H LYS 58 HN LYS 58 61.197 25.505 -34.671 433 HA LYS 58 HA LYS 58 62.060 25.394 -37.387 434 HB2 LYS 58 HB2 LYS 58 61.918 27.642 -35.373 435 HB3 LYS 58 HB1 LYS 58 62.401 27.874 -37.053 436 HG2 LYS 58 HG2 LYS 58 59.809 26.509 -36.308 437 HG3 LYS 58 HG1 LYS 58 59.920 28.257 -36.516 438 HD2 LYS 58 HD2 LYS 58 60.914 27.825 -38.805 439 HD3 LYS 58 HD1 LYS 58 60.504 26.123 -38.585 440 HE2 LYS 58 HE2 LYS 58 58.502 28.391 -38.401 441 HE3 LYS 58 HE1 LYS 58 58.755 27.406 -39.842 442 HZ1 LYS 58 HZ1 LYS 58 57.861 26.461 -37.175 443 HZ2 LYS 58 HZ2 LYS 58 58.251 25.434 -38.471 444 HZ3 LYS 58 HZ3 LYS 58 56.941 26.508 -38.599 445 H ARG 59 HN ARG 59 63.725 26.081 -34.324 446 HA ARG 59 HA ARG 59 66.220 26.774 -35.429 447 HB2 ARG 59 HB2 ARG 59 65.467 27.107 -33.036 448 HB3 ARG 59 HB1 ARG 59 65.793 25.393 -32.776 449 HG2 ARG 59 HG2 ARG 59 67.968 26.886 -34.112 450 HG3 ARG 59 HG1 ARG 59 67.655 27.360 -32.442 451 HD2 ARG 59 HD2 ARG 59 67.819 24.988 -31.751 452 HD3 ARG 59 HD1 ARG 59 68.173 24.537 -33.416 453 HE ARG 59 HE ARG 59 70.023 26.501 -32.660 454 HH11 ARG 59 HH11 ARG 59 69.133 23.239 -31.807 455 HH12 ARG 59 HH12 ARG 59 70.731 22.807 -31.306 456 HH21 ARG 59 HH21 ARG 59 72.101 25.910 -32.000 457 HH22 ARG 59 HH22 ARG 59 72.402 24.308 -31.414 458 H GLU 60 HN GLU 60 64.796 23.647 -34.628 459 HA GLU 60 HA GLU 60 67.218 22.337 -35.713 460 HB2 GLU 60 HB2 GLU 60 66.716 21.836 -33.321 461 HB3 GLU 60 HB1 GLU 60 65.168 21.158 -33.826 462 HG2 GLU 60 HG2 GLU 60 66.333 19.519 -35.243 463 HG3 GLU 60 HG1 GLU 60 67.887 20.204 -34.769 464 HA PRO 61 HA PRO 61 63.707 21.497 -38.629 465 HB2 PRO 61 HB2 PRO 61 65.120 21.982 -40.917 466 HB3 PRO 61 HB1 PRO 61 64.286 23.253 -40.002 467 HG2 PRO 61 HG2 PRO 61 67.172 22.533 -40.043 468 HG3 PRO 61 HG1 PRO 61 66.406 24.128 -39.974 469 HD2 PRO 61 HD2 PRO 61 67.465 22.868 -37.773 470 HD3 PRO 61 HD1 PRO 61 66.142 24.050 -37.684 471 H LEU 62 HN LEU 62 66.739 20.164 -37.930 472 HA LEU 62 HA LEU 62 67.128 18.260 -39.933 473 HB2 LEU 62 HB2 LEU 62 68.795 18.751 -38.197 474 HB3 LEU 62 HB1 LEU 62 67.737 18.050 -36.973 475 HG LEU 62 HG LEU 62 67.822 15.875 -38.190 476 HD11 LEU 62 HD11 LEU 62 68.275 16.569 -40.439 477 HD12 LEU 62 HD12 LEU 62 69.699 15.677 -39.904 478 HD13 LEU 62 HD13 LEU 62 69.727 17.440 -39.947 479 HD21 LEU 62 HD21 LEU 62 70.275 15.430 -37.689 480 HD22 LEU 62 HD22 LEU 62 69.361 16.151 -36.365 481 HD23 LEU 62 HD23 LEU 62 70.435 17.152 -37.343 482 H ASN 63 HN ASN 63 65.155 18.143 -36.987 483 HA ASN 63 HA ASN 63 64.388 15.441 -37.156 484 HB2 ASN 63 HB2 ASN 63 62.647 16.006 -35.596 485 HB3 ASN 63 HB1 ASN 63 64.070 16.956 -35.175 486 HD21 ASN 63 HD21 ASN 63 61.116 17.560 -34.747 487 HD22 ASN 63 HD22 ASN 63 60.884 19.078 -35.469 488 H TYR 64 HN TYR 64 63.326 18.269 -38.879 489 HA TYR 64 HA TYR 64 60.836 17.168 -39.787 490 HB2 TYR 64 HB2 TYR 64 61.287 19.613 -39.669 491 HB3 TYR 64 HB1 TYR 64 62.460 19.431 -40.974 492 HD1 TYR 64 HD1 TYR 64 58.871 18.991 -40.086 493 HD2 TYR 64 HD2 TYR 64 61.769 19.263 -43.245 494 HE1 TYR 64 HE1 TYR 64 57.040 19.126 -41.754 495 HE2 TYR 64 HE2 TYR 64 59.938 19.397 -44.913 496 HH TYR 64 HH TYR 64 56.870 20.161 -44.215 497 H LEU 65 HN LEU 65 64.104 17.447 -41.087 498 HA LEU 65 HA LEU 65 63.479 16.319 -43.642 499 HB2 LEU 65 HB2 LEU 65 66.115 16.682 -42.199 500 HB3 LEU 65 HB1 LEU 65 65.963 16.155 -43.874 501 HG LEU 65 HG LEU 65 64.768 18.735 -42.834 502 HD11 LEU 65 HD11 LEU 65 66.677 19.895 -43.710 503 HD12 LEU 65 HD12 LEU 65 67.318 18.421 -44.435 504 HD13 LEU 65 HD13 LEU 65 67.306 18.608 -42.682 505 HD21 LEU 65 HD21 LEU 65 64.864 19.237 -45.343 506 HD22 LEU 65 HD22 LEU 65 63.687 18.021 -44.847 507 HD23 LEU 65 HD23 LEU 65 65.215 17.524 -45.574 508 HA PRO 66 HA PRO 66 63.488 11.972 -42.945 509 HB2 PRO 66 HB2 PRO 66 65.747 11.698 -44.872 510 HB3 PRO 66 HB1 PRO 66 64.155 10.915 -44.879 511 HG2 PRO 66 HG2 PRO 66 64.737 12.892 -46.562 512 HG3 PRO 66 HG1 PRO 66 63.122 12.717 -45.854 513 HD2 PRO 66 HD2 PRO 66 65.268 14.686 -45.183 514 HD3 PRO 66 HD1 PRO 66 63.502 14.879 -45.140 515 H LEU 67 HN LEU 67 64.444 10.545 -41.546 516 HA LEU 67 HA LEU 67 67.274 10.440 -41.096 517 HB2 LEU 67 HB2 LEU 67 66.062 12.504 -39.764 518 HB3 LEU 67 HB1 LEU 67 65.971 11.206 -38.573 519 HG LEU 67 HG LEU 67 68.526 11.843 -40.054 520 HD11 LEU 67 HD11 LEU 67 67.756 12.842 -37.300 521 HD12 LEU 67 HD12 LEU 67 67.635 13.832 -38.755 522 HD13 LEU 67 HD13 LEU 67 69.208 13.241 -38.219 523 HD21 LEU 67 HD21 LEU 67 68.374 9.644 -38.959 524 HD22 LEU 67 HD22 LEU 67 67.899 10.418 -37.447 525 HD23 LEU 67 HD23 LEU 67 69.517 10.676 -38.099 Start of MODEL 5 1 H1 THR 1 HT1 THR 1 -2.791 -3.070 -1.758 2 H2 THR 1 HT2 THR 1 -3.191 -2.817 -0.127 3 H3 THR 1 HT3 THR 1 -3.705 -4.228 -0.921 4 HA THR 1 HA THR 1 -1.925 -4.979 0.308 5 HB THR 1 HB THR 1 -1.739 -4.839 -2.481 6 HG1 THR 1 HG1 THR 1 -1.009 -6.773 -2.121 7 HG21 THR 1 HG21 THR 1 0.623 -4.580 -2.968 8 HG22 THR 1 HG22 THR 1 0.987 -4.299 -1.267 9 HG23 THR 1 HG23 THR 1 0.052 -3.111 -2.180 10 HA PRO 2 HA PRO 2 0.707 -1.951 2.138 11 HB2 PRO 2 HB2 PRO 2 2.941 -3.385 2.756 12 HB3 PRO 2 HB1 PRO 2 1.395 -3.594 3.602 13 HG2 PRO 2 HG2 PRO 2 2.629 -5.263 1.473 14 HG3 PRO 2 HG1 PRO 2 1.703 -5.754 2.902 15 HD2 PRO 2 HD2 PRO 2 0.641 -5.633 0.361 16 HD3 PRO 2 HD1 PRO 2 -0.324 -5.477 1.844 17 H ILE 3 HN ILE 3 2.592 -0.630 1.858 18 HA ILE 3 HA ILE 3 3.904 -0.966 -0.774 19 HB ILE 3 HB ILE 3 2.324 1.012 -0.483 20 HG12 ILE 3 HG12 ILE 3 4.175 2.642 -1.351 21 HG13 ILE 3 HG11 ILE 3 5.233 1.235 -1.236 22 HG21 ILE 3 HG21 ILE 3 3.120 1.438 1.895 23 HG22 ILE 3 HG22 ILE 3 3.053 2.864 0.859 24 HG23 ILE 3 HG23 ILE 3 4.601 2.091 1.195 25 HD11 ILE 3 HD11 ILE 3 2.684 1.463 -2.860 26 HD12 ILE 3 HD12 ILE 3 3.577 -0.041 -2.634 27 HD13 ILE 3 HD13 ILE 3 4.327 1.311 -3.482 28 H GLU 4 HN GLU 4 6.105 -0.759 -0.892 29 HA GLU 4 HA GLU 4 7.708 -1.426 1.254 30 HB2 GLU 4 HB2 GLU 4 9.607 -0.652 -0.090 31 HB3 GLU 4 HB1 GLU 4 8.450 -1.525 -1.095 32 HG2 GLU 4 HG2 GLU 4 7.457 0.637 -1.800 33 HG3 GLU 4 HG1 GLU 4 8.667 1.488 -0.840 34 H SER 5 HN SER 5 9.453 -0.089 2.263 35 HA SER 5 HA SER 5 8.431 1.938 3.844 36 HB2 SER 5 HB2 SER 5 11.270 1.355 3.004 37 HB3 SER 5 HB1 SER 5 10.860 2.586 4.195 38 HG SER 5 HG SER 5 11.078 -0.046 4.522 39 H HIS 6 HN HIS 6 8.145 4.086 3.657 40 HA HIS 6 HA HIS 6 8.561 5.282 1.021 41 HB2 HIS 6 HB2 HIS 6 7.155 7.104 1.879 42 HB3 HIS 6 HB1 HIS 6 6.371 5.542 2.120 43 HD1 HIS 6 HD1 HIS 6 8.188 8.262 4.004 44 HD2 HIS 6 HD2 HIS 6 6.034 4.787 4.820 45 HE1 HIS 6 HE1 HIS 6 7.801 8.230 6.507 46 HE2 HIS 6 HE2 HIS 6 6.489 6.117 7.020 47 H GLN 7 HN GLN 7 10.772 4.746 3.019 48 HA GLN 7 HA GLN 7 11.662 7.156 4.165 49 HB2 GLN 7 HB2 GLN 7 12.568 4.863 4.652 50 HB3 GLN 7 HB1 GLN 7 13.407 4.927 3.101 51 HG2 GLN 7 HG2 GLN 7 14.582 6.973 3.815 52 HG3 GLN 7 HG1 GLN 7 13.745 6.915 5.366 53 HE21 GLN 7 HE21 GLN 7 15.041 6.026 6.968 54 HE22 GLN 7 HE22 GLN 7 16.190 4.800 6.726 55 H VAL 8 HN VAL 8 12.763 8.872 3.392 56 HA VAL 8 HA VAL 8 13.580 8.814 0.550 57 HB VAL 8 HB VAL 8 11.545 10.139 0.761 58 HG11 VAL 8 HG11 VAL 8 11.597 10.698 3.108 59 HG12 VAL 8 HG12 VAL 8 11.633 12.213 2.205 60 HG13 VAL 8 HG13 VAL 8 13.115 11.576 2.918 61 HG21 VAL 8 HG21 VAL 8 13.493 10.901 -0.699 62 HG22 VAL 8 HG22 VAL 8 13.897 12.038 0.586 63 HG23 VAL 8 HG23 VAL 8 12.348 12.164 -0.246 64 H GLU 9 HN GLU 9 15.430 10.001 0.009 65 HA GLU 9 HA GLU 9 17.025 10.971 2.302 66 HB2 GLU 9 HB2 GLU 9 18.993 10.195 0.707 67 HB3 GLU 9 HB1 GLU 9 18.214 9.059 1.807 68 HG2 GLU 9 HG2 GLU 9 18.453 8.168 -0.519 69 HG3 GLU 9 HG1 GLU 9 16.779 8.237 0.024 70 H LYS 10 HN LYS 10 18.872 12.397 1.551 71 HA LYS 10 HA LYS 10 18.161 13.967 -0.839 72 HB2 LYS 10 HB2 LYS 10 18.752 16.032 0.584 73 HB3 LYS 10 HB1 LYS 10 17.173 15.290 0.844 74 HG2 LYS 10 HG2 LYS 10 19.362 14.162 2.479 75 HG3 LYS 10 HG1 LYS 10 18.943 15.835 2.849 76 HD2 LYS 10 HD2 LYS 10 16.821 15.293 3.567 77 HD3 LYS 10 HD1 LYS 10 16.695 13.906 2.483 78 HE2 LYS 10 HE2 LYS 10 18.363 12.702 3.905 79 HE3 LYS 10 HE1 LYS 10 18.336 14.062 5.028 80 HZ1 LYS 10 HZ1 LYS 10 16.107 12.242 4.324 81 HZ2 LYS 10 HZ2 LYS 10 15.868 13.712 5.143 82 HZ3 LYS 10 HZ3 LYS 10 16.811 12.487 5.848 83 H ARG 11 HN ARG 11 19.974 15.699 -1.170 84 HA ARG 11 HA ARG 11 22.598 14.592 -0.452 85 HB2 ARG 11 HB2 ARG 11 23.210 15.283 -2.946 86 HB3 ARG 11 HB1 ARG 11 22.612 13.678 -2.554 87 HG2 ARG 11 HG2 ARG 11 21.345 14.356 -4.438 88 HG3 ARG 11 HG1 ARG 11 20.254 14.608 -3.087 89 HD2 ARG 11 HD2 ARG 11 22.043 16.844 -3.997 90 HD3 ARG 11 HD1 ARG 11 20.568 16.494 -4.886 91 HE ARG 11 HE ARG 11 20.754 17.682 -2.256 92 HH11 ARG 11 HH11 ARG 11 18.765 15.886 -4.489 93 HH12 ARG 11 HH12 ARG 11 17.282 16.390 -3.755 94 HH21 ARG 11 HH21 ARG 11 18.803 18.319 -1.317 95 HH22 ARG 11 HH22 ARG 11 17.301 17.758 -1.971 96 H LYS 12 HN LYS 12 22.031 16.568 0.988 97 HA LYS 12 HA LYS 12 22.059 19.187 0.054 98 HB2 LYS 12 HB2 LYS 12 22.796 19.824 2.266 99 HB3 LYS 12 HB1 LYS 12 21.673 18.474 2.425 100 HG2 LYS 12 HG2 LYS 12 23.636 16.919 2.509 101 HG3 LYS 12 HG1 LYS 12 24.699 18.327 2.515 102 HD2 LYS 12 HD2 LYS 12 23.629 19.136 4.583 103 HD3 LYS 12 HD1 LYS 12 22.558 17.734 4.580 104 HE2 LYS 12 HE2 LYS 12 24.352 17.199 6.075 105 HE3 LYS 12 HE1 LYS 12 24.650 16.285 4.597 106 HZ1 LYS 12 HZ1 LYS 12 26.680 17.219 4.860 107 HZ2 LYS 12 HZ2 LYS 12 26.088 18.577 5.691 108 HZ3 LYS 12 HZ3 LYS 12 25.953 18.488 4.000 109 H CYS 13 HN CYS 13 23.774 20.760 -0.047 110 HA CYS 13 HA CYS 13 26.030 19.869 -1.513 111 HB2 CYS 13 HB2 CYS 13 24.967 22.433 -0.537 112 HB3 CYS 13 HB1 CYS 13 26.725 22.380 -0.666 113 H ASN 14 HN ASN 14 27.337 18.451 -0.419 114 HA ASN 14 HA ASN 14 28.673 19.524 1.989 115 HB2 ASN 14 HB2 ASN 14 28.871 17.165 2.777 116 HB3 ASN 14 HB1 ASN 14 27.208 17.743 2.705 117 HD21 ASN 14 HD21 ASN 14 26.237 15.662 2.326 118 HD22 ASN 14 HD22 ASN 14 26.498 14.787 0.895 119 H THR 15 HN THR 15 29.336 19.464 -0.984 120 HA THR 15 HA THR 15 31.943 18.091 -0.722 121 HB THR 15 HB THR 15 30.331 17.029 -2.357 122 HG1 THR 15 HG1 THR 15 31.968 17.045 -4.045 123 HG21 THR 15 HG21 THR 15 30.918 19.467 -4.041 124 HG22 THR 15 HG22 THR 15 29.436 19.306 -3.101 125 HG23 THR 15 HG23 THR 15 29.794 18.155 -4.388 126 H ALA 16 HN ALA 16 33.675 19.028 -2.015 127 HA ALA 16 HA ALA 16 33.931 21.810 -1.604 128 HB1 ALA 16 HB1 ALA 16 35.633 20.395 -3.614 129 HB2 ALA 16 HB2 ALA 16 35.730 19.908 -1.922 130 HB3 ALA 16 HB3 ALA 16 36.093 21.571 -2.383 131 H THR 17 HN THR 17 33.052 19.907 -4.445 132 HA THR 17 HA THR 17 33.299 21.789 -6.455 133 HB THR 17 HB THR 17 31.063 19.775 -6.115 134 HG1 THR 17 HG1 THR 17 33.540 19.612 -7.484 135 HG21 THR 17 HG21 THR 17 30.931 19.917 -8.583 136 HG22 THR 17 HG22 THR 17 32.144 21.197 -8.564 137 HG23 THR 17 HG23 THR 17 30.566 21.467 -7.824 138 H CYS 18 HN CYS 18 30.642 21.390 -4.135 139 HA CYS 18 HA CYS 18 28.928 23.348 -5.226 140 HB2 CYS 18 HB2 CYS 18 28.446 21.583 -3.397 141 HB3 CYS 18 HB1 CYS 18 29.105 22.776 -2.277 142 H ALA 19 HN ALA 19 31.756 23.556 -3.192 143 HA ALA 19 HA ALA 19 31.405 26.117 -2.104 144 HB1 ALA 19 HB1 ALA 19 33.262 24.341 -1.676 145 HB2 ALA 19 HB2 ALA 19 33.679 26.051 -1.564 146 HB3 ALA 19 HB3 ALA 19 34.096 25.135 -3.012 147 H THR 20 HN THR 20 32.758 25.089 -5.222 148 HA THR 20 HA THR 20 33.629 27.606 -6.111 149 HB THR 20 HB THR 20 32.530 25.290 -7.726 150 HG1 THR 20 HG1 THR 20 35.194 26.053 -7.134 151 HG21 THR 20 HG21 THR 20 34.098 27.760 -8.497 152 HG22 THR 20 HG22 THR 20 32.516 27.264 -9.098 153 HG23 THR 20 HG23 THR 20 33.954 26.343 -9.536 154 H GLN 21 HN GLN 21 30.471 26.031 -6.277 155 HA GLN 21 HA GLN 21 29.151 27.872 -7.920 156 HB2 GLN 21 HB2 GLN 21 28.229 25.672 -7.222 157 HB3 GLN 21 HB1 GLN 21 27.972 26.323 -5.603 158 HG2 GLN 21 HG2 GLN 21 26.458 28.017 -6.473 159 HG3 GLN 21 HG1 GLN 21 26.789 27.508 -8.128 160 HE21 GLN 21 HE21 GLN 21 24.307 27.366 -6.129 161 HE22 GLN 21 HE22 GLN 21 23.731 25.793 -6.403 162 H ARG 22 HN ARG 22 29.833 27.962 -4.450 163 HA ARG 22 HA ARG 22 28.142 30.161 -3.856 164 HB2 ARG 22 HB2 ARG 22 28.940 30.001 -1.725 165 HB3 ARG 22 HB1 ARG 22 29.476 28.432 -2.310 166 HG2 ARG 22 HG2 ARG 22 31.457 29.178 -1.408 167 HG3 ARG 22 HG1 ARG 22 31.639 29.863 -3.016 168 HD2 ARG 22 HD2 ARG 22 31.866 31.864 -1.992 169 HD3 ARG 22 HD1 ARG 22 30.139 31.773 -1.660 170 HE ARG 22 HE ARG 22 30.653 31.378 0.561 171 HH11 ARG 22 HH11 ARG 22 33.441 30.731 -1.431 172 HH12 ARG 22 HH12 ARG 22 34.490 30.465 -0.082 173 HH21 ARG 22 HH21 ARG 22 32.044 31.019 2.304 174 HH22 ARG 22 HH22 ARG 22 33.707 30.626 2.020 175 H LEU 23 HN LEU 23 31.221 29.942 -5.391 176 HA LEU 23 HA LEU 23 32.154 32.580 -4.837 177 HB2 LEU 23 HB2 LEU 23 33.628 30.763 -5.668 178 HB3 LEU 23 HB1 LEU 23 32.775 30.801 -7.210 179 HG LEU 23 HG LEU 23 33.398 33.224 -7.428 180 HD11 LEU 23 HD11 LEU 23 33.782 33.864 -5.156 181 HD12 LEU 23 HD12 LEU 23 35.359 33.919 -5.942 182 HD13 LEU 23 HD13 LEU 23 34.935 32.553 -4.909 183 HD21 LEU 23 HD21 LEU 23 35.858 32.737 -7.850 184 HD22 LEU 23 HD22 LEU 23 34.734 31.618 -8.620 185 HD23 LEU 23 HD23 LEU 23 35.582 31.143 -7.149 186 H ALA 24 HN ALA 24 30.214 31.139 -7.410 187 HA ALA 24 HA ALA 24 30.053 33.376 -9.110 188 HB1 ALA 24 HB1 ALA 24 27.762 31.465 -8.729 189 HB2 ALA 24 HB2 ALA 24 29.260 30.936 -9.495 190 HB3 ALA 24 HB3 ALA 24 28.319 32.244 -10.210 191 H ASN 25 HN ASN 25 28.202 32.451 -6.257 192 HA ASN 25 HA ASN 25 26.178 34.423 -6.472 193 HB2 ASN 25 HB2 ASN 25 27.281 32.811 -4.183 194 HB3 ASN 25 HB1 ASN 25 26.036 34.032 -3.930 195 HD21 ASN 25 HD21 ASN 25 25.324 31.405 -3.379 196 HD22 ASN 25 HD22 ASN 25 24.284 30.816 -4.585 197 H PHE 26 HN PHE 26 29.483 34.534 -5.411 198 HA PHE 26 HA PHE 26 29.319 36.865 -3.797 199 HB2 PHE 26 HB2 PHE 26 31.241 35.281 -3.775 200 HB3 PHE 26 HB1 PHE 26 31.698 35.860 -5.377 201 HD1 PHE 26 HD1 PHE 26 31.224 36.877 -1.834 202 HD2 PHE 26 HD2 PHE 26 32.814 37.952 -5.677 203 HE1 PHE 26 HE1 PHE 26 32.414 38.794 -0.805 204 HE2 PHE 26 HE2 PHE 26 34.005 39.869 -4.648 205 HZ PHE 26 HZ PHE 26 33.805 40.289 -2.212 206 H LEU 27 HN LEU 27 29.854 36.344 -7.256 207 HA LEU 27 HA LEU 27 30.583 38.967 -7.933 208 HB2 LEU 27 HB2 LEU 27 30.834 37.042 -9.460 209 HB3 LEU 27 HB1 LEU 27 29.088 36.892 -9.572 210 HG LEU 27 HG LEU 27 30.387 38.105 -11.476 211 HD11 LEU 27 HD11 LEU 27 28.071 39.711 -10.421 212 HD12 LEU 27 HD12 LEU 27 27.831 38.046 -10.951 213 HD13 LEU 27 HD13 LEU 27 28.449 39.251 -12.079 214 HD21 LEU 27 HD21 LEU 27 31.541 39.620 -9.713 215 HD22 LEU 27 HD22 LEU 27 30.026 40.520 -9.707 216 HD23 LEU 27 HD23 LEU 27 30.955 40.370 -11.196 217 H VAL 28 HN VAL 28 27.386 37.396 -7.888 218 HA VAL 28 HA VAL 28 25.982 39.806 -8.591 219 HB VAL 28 HB VAL 28 23.958 38.527 -8.064 220 HG11 VAL 28 HG11 VAL 28 25.278 38.189 -10.214 221 HG12 VAL 28 HG12 VAL 28 24.204 36.862 -9.770 222 HG13 VAL 28 HG13 VAL 28 25.938 36.729 -9.479 223 HG21 VAL 28 HG21 VAL 28 25.904 36.411 -7.090 224 HG22 VAL 28 HG22 VAL 28 24.161 36.201 -7.250 225 HG23 VAL 28 HG23 VAL 28 24.806 37.342 -6.071 226 H HIS 29 HN HIS 29 26.943 38.240 -5.607 227 HA HIS 29 HA HIS 29 25.289 39.822 -3.892 228 HB2 HIS 29 HB2 HIS 29 26.199 37.636 -3.196 229 HB3 HIS 29 HB1 HIS 29 27.831 38.302 -3.260 230 HD1 HIS 29 HD1 HIS 29 24.519 39.009 -1.501 231 HD2 HIS 29 HD2 HIS 29 28.614 39.501 -0.893 232 HE1 HIS 29 HE1 HIS 29 24.789 39.937 0.840 233 HE2 HIS 29 HE2 HIS 29 27.280 40.242 1.226 234 H SER 30 HN SER 30 28.366 40.259 -5.415 235 HA SER 30 HA SER 30 28.699 42.795 -3.939 236 HB2 SER 30 HB2 SER 30 30.497 41.077 -3.517 237 HB3 SER 30 HB1 SER 30 30.932 41.204 -5.218 238 HG SER 30 HG SER 30 31.280 43.443 -4.860 239 H SER 31 HN SER 31 27.331 42.001 -6.570 240 HA SER 31 HA SER 31 28.780 43.068 -8.737 241 HB2 SER 31 HB2 SER 31 26.791 41.686 -9.052 242 HB3 SER 31 HB1 SER 31 25.790 42.924 -8.301 243 HG SER 31 HG SER 31 27.406 43.316 -10.604 244 H ASN 32 HN ASN 32 26.462 44.602 -6.505 245 HA ASN 32 HA ASN 32 26.463 47.126 -7.783 246 HB2 ASN 32 HB2 ASN 32 25.607 47.930 -5.544 247 HB3 ASN 32 HB1 ASN 32 24.684 46.620 -6.278 248 HD21 ASN 32 HD21 ASN 32 26.069 47.580 -3.374 249 HD22 ASN 32 HD22 ASN 32 26.224 46.055 -2.643 250 H ASN 33 HN ASN 33 28.365 45.808 -5.101 251 HA ASN 33 HA ASN 33 29.751 48.248 -4.591 252 HB2 ASN 33 HB2 ASN 33 30.356 45.384 -3.829 253 HB3 ASN 33 HB1 ASN 33 31.334 46.752 -3.300 254 HD21 ASN 33 HD21 ASN 33 29.707 48.665 -2.442 255 HD22 ASN 33 HD22 ASN 33 28.564 48.112 -1.316 256 H PHE 34 HN PHE 34 30.269 45.499 -6.669 257 HA PHE 34 HA PHE 34 32.933 45.668 -7.331 258 HB2 PHE 34 HB2 PHE 34 31.410 43.962 -8.239 259 HB3 PHE 34 HB1 PHE 34 30.634 45.188 -9.241 260 HD1 PHE 34 HD1 PHE 34 33.995 43.710 -8.500 261 HD2 PHE 34 HD2 PHE 34 31.469 45.647 -11.384 262 HE1 PHE 34 HE1 PHE 34 35.737 43.394 -10.237 263 HE2 PHE 34 HE2 PHE 34 33.211 45.332 -13.121 264 HZ PHE 34 HZ PHE 34 35.345 44.205 -12.548 265 H GLY 35 HN GLY 35 30.251 47.549 -8.717 266 HA2 GLY 35 HA2 GLY 35 31.792 49.057 -10.551 267 HA3 GLY 35 HA1 GLY 35 30.211 49.511 -9.910 268 H ALA 36 HN ALA 36 30.712 49.801 -7.227 269 HA ALA 36 HA ALA 36 31.825 52.377 -7.119 270 HB1 ALA 36 HB1 ALA 36 31.822 51.926 -4.582 271 HB2 ALA 36 HB2 ALA 36 31.124 50.359 -4.993 272 HB3 ALA 36 HB3 ALA 36 30.273 51.843 -5.422 273 H ILE 37 HN ILE 37 33.249 49.211 -6.555 274 HA ILE 37 HA ILE 37 35.614 50.020 -5.274 275 HB ILE 37 HB ILE 37 34.973 47.664 -7.044 276 HG12 ILE 37 HG12 ILE 37 35.645 47.818 -4.093 277 HG13 ILE 37 HG11 ILE 37 33.994 47.922 -4.703 278 HG21 ILE 37 HG21 ILE 37 37.170 46.750 -6.122 279 HG22 ILE 37 HG22 ILE 37 37.560 48.407 -5.659 280 HG23 ILE 37 HG23 ILE 37 37.324 47.998 -7.359 281 HD11 ILE 37 HD11 ILE 37 34.839 45.591 -3.990 282 HD12 ILE 37 HD12 ILE 37 35.809 45.628 -5.462 283 HD13 ILE 37 HD13 ILE 37 34.051 45.715 -5.561 284 H LEU 38 HN LEU 38 34.738 49.781 -8.679 285 HA LEU 38 HA LEU 38 37.249 50.232 -9.843 286 HB2 LEU 38 HB2 LEU 38 35.267 49.505 -11.115 287 HB3 LEU 38 HB1 LEU 38 34.522 51.081 -10.852 288 HG LEU 38 HG LEU 38 36.456 52.147 -12.024 289 HD11 LEU 38 HD11 LEU 38 38.203 50.545 -11.691 290 HD12 LEU 38 HD12 LEU 38 37.864 50.539 -13.421 291 HD13 LEU 38 HD13 LEU 38 37.239 49.247 -12.395 292 HD21 LEU 38 HD21 LEU 38 34.317 51.433 -13.186 293 HD22 LEU 38 HD22 LEU 38 35.167 49.975 -13.698 294 HD23 LEU 38 HD23 LEU 38 35.723 51.557 -14.243 295 H SER 39 HN SER 39 34.874 52.470 -8.515 296 HA SER 39 HA SER 39 35.949 54.867 -9.528 297 HB2 SER 39 HB2 SER 39 33.743 54.758 -8.465 298 HB3 SER 39 HB1 SER 39 34.494 54.366 -6.921 299 HG SER 39 HG SER 39 34.667 56.754 -8.433 300 H SER 40 HN SER 40 36.696 52.994 -6.619 301 HA SER 40 HA SER 40 38.770 54.911 -5.849 302 HB2 SER 40 HB2 SER 40 37.819 52.369 -4.510 303 HB3 SER 40 HB1 SER 40 39.010 53.484 -3.847 304 HG SER 40 HG SER 40 36.748 53.773 -3.170 305 H THR 41 HN THR 41 38.935 53.181 -8.292 306 HA THR 41 HA THR 41 40.750 51.070 -7.937 307 HB THR 41 HB THR 41 39.536 51.432 -10.035 308 HG1 THR 41 HG1 THR 41 42.315 51.748 -10.466 309 HG21 THR 41 HG21 THR 41 40.184 53.250 -11.544 310 HG22 THR 41 HG22 THR 41 41.358 53.832 -10.363 311 HG23 THR 41 HG23 THR 41 39.633 53.910 -10.005 312 H ASN 42 HN ASN 42 41.215 54.487 -7.755 313 HA ASN 42 HA ASN 42 44.090 54.323 -8.199 314 HB2 ASN 42 HB2 ASN 42 44.084 56.723 -7.921 315 HB3 ASN 42 HB1 ASN 42 42.752 56.277 -8.986 316 HD21 ASN 42 HD21 ASN 42 42.543 58.724 -7.680 317 HD22 ASN 42 HD22 ASN 42 41.380 58.630 -6.447 318 H VAL 43 HN VAL 43 42.550 53.068 -5.822 319 HA VAL 43 HA VAL 43 43.736 54.473 -3.561 320 HB VAL 43 HB VAL 43 41.416 53.300 -3.648 321 HG11 VAL 43 HG11 VAL 43 43.080 50.915 -2.823 322 HG12 VAL 43 HG12 VAL 43 42.529 51.136 -4.483 323 HG13 VAL 43 HG13 VAL 43 41.355 50.976 -3.178 324 HG21 VAL 43 HG21 VAL 43 43.433 53.027 -1.408 325 HG22 VAL 43 HG22 VAL 43 41.736 52.594 -1.206 326 HG23 VAL 43 HG23 VAL 43 42.183 54.254 -1.599 327 H GLY 44 HN GLY 44 45.251 52.865 -5.764 328 HA2 GLY 44 HA2 GLY 44 47.532 52.158 -5.309 329 HA3 GLY 44 HA1 GLY 44 46.935 51.367 -3.854 330 H SER 45 HN SER 45 44.520 50.522 -5.619 331 HA SER 45 HA SER 45 45.776 48.040 -6.540 332 HB2 SER 45 HB2 SER 45 43.473 47.186 -6.663 333 HB3 SER 45 HB1 SER 45 43.811 47.866 -5.074 334 HG SER 45 HG SER 45 41.780 48.492 -6.256 335 H ASN 46 HN ASN 46 45.963 50.650 -7.995 336 HA ASN 46 HA ASN 46 44.329 50.325 -10.360 337 HB2 ASN 46 HB2 ASN 46 45.495 52.284 -11.188 338 HB3 ASN 46 HB1 ASN 46 45.019 52.556 -9.513 339 HD21 ASN 46 HD21 ASN 46 47.523 53.237 -11.459 340 HD22 ASN 46 HD22 ASN 46 48.821 53.073 -10.377 341 H THR 47 HN THR 47 46.910 48.597 -9.300 342 HA THR 47 HA THR 47 48.300 48.451 -11.870 343 HB THR 47 HB THR 47 48.927 46.727 -9.493 344 HG1 THR 47 HG1 THR 47 49.241 48.483 -8.405 345 HG21 THR 47 HG21 THR 47 50.188 46.275 -11.490 346 HG22 THR 47 HG22 THR 47 51.251 47.158 -10.395 347 HG23 THR 47 HG23 THR 47 50.494 47.992 -11.752 348 H TYR 48 HN TYR 48 45.505 47.523 -11.520 349 HA TYR 48 HA TYR 48 45.856 44.635 -12.030 350 HB2 TYR 48 HB2 TYR 48 43.667 44.282 -11.281 351 HB3 TYR 48 HB1 TYR 48 44.259 45.535 -10.191 352 HD1 TYR 48 HD1 TYR 48 41.662 44.630 -12.435 353 HD2 TYR 48 HD2 TYR 48 43.871 48.018 -10.989 354 HE1 TYR 48 HE1 TYR 48 39.836 46.136 -13.174 355 HE2 TYR 48 HE2 TYR 48 42.045 49.524 -11.728 356 HH TYR 48 HH TYR 48 40.198 49.469 -13.436 357 H GLY 49 HN GLY 49 46.151 47.083 -13.889 358 HA2 GLY 49 HA2 GLY 49 44.117 47.280 -15.742 359 HA3 GLY 49 HA1 GLY 49 45.826 47.422 -16.145 360 H LYS 50 HN LYS 50 43.011 45.501 -16.389 361 HA LYS 50 HA LYS 50 44.227 42.988 -16.986 362 HB2 LYS 50 HB2 LYS 50 41.493 44.122 -17.602 363 HB3 LYS 50 HB1 LYS 50 41.969 42.465 -17.977 364 HG2 LYS 50 HG2 LYS 50 42.582 42.179 -15.545 365 HG3 LYS 50 HG1 LYS 50 41.860 43.759 -15.240 366 HD2 LYS 50 HD2 LYS 50 40.369 41.485 -16.573 367 HD3 LYS 50 HD1 LYS 50 40.312 41.793 -14.837 368 HE2 LYS 50 HE2 LYS 50 39.513 43.763 -17.001 369 HE3 LYS 50 HE1 LYS 50 38.401 42.855 -15.978 370 HZ1 LYS 50 HZ1 LYS 50 39.779 43.916 -14.077 371 HZ2 LYS 50 HZ2 LYS 50 38.573 44.828 -14.852 372 HZ3 LYS 50 HZ3 LYS 50 40.207 45.058 -15.256 373 H ARG 51 HN ARG 51 43.316 45.806 -18.879 374 HA ARG 51 HA ARG 51 43.403 44.778 -21.454 375 HB2 ARG 51 HB2 ARG 51 43.830 47.018 -22.207 376 HB3 ARG 51 HB1 ARG 51 42.778 47.124 -20.795 377 HG2 ARG 51 HG2 ARG 51 44.815 47.501 -19.378 378 HG3 ARG 51 HG1 ARG 51 45.778 47.558 -20.855 379 HD2 ARG 51 HD2 ARG 51 44.376 49.433 -21.674 380 HD3 ARG 51 HD1 ARG 51 43.472 49.400 -20.163 381 HE ARG 51 HE ARG 51 46.127 50.480 -20.568 382 HH11 ARG 51 HH11 ARG 51 43.852 49.168 -18.272 383 HH12 ARG 51 HH12 ARG 51 44.587 49.952 -16.917 384 HH21 ARG 51 HH21 ARG 51 47.063 51.494 -18.779 385 HH22 ARG 51 HH22 ARG 51 46.393 51.260 -17.199 386 H ASN 52 HN ASN 52 45.993 45.245 -19.204 387 HA ASN 52 HA ASN 52 48.206 45.543 -20.845 388 HB2 ASN 52 HB2 ASN 52 47.886 45.230 -18.196 389 HB3 ASN 52 HB1 ASN 52 48.460 43.614 -18.603 390 HD21 ASN 52 HD21 ASN 52 50.145 44.504 -20.862 391 HD22 ASN 52 HD22 ASN 52 51.465 45.323 -20.179 392 H ALA 53 HN ALA 53 46.139 42.790 -20.419 393 HA ALA 53 HA ALA 53 47.893 40.765 -21.357 394 HB1 ALA 53 HB1 ALA 53 45.815 39.479 -21.760 395 HB2 ALA 53 HB2 ALA 53 44.872 40.936 -21.446 396 HB3 ALA 53 HB3 ALA 53 45.840 40.218 -20.158 397 H VAL 54 HN VAL 54 45.592 42.910 -22.999 398 HA VAL 54 HA VAL 54 45.982 41.716 -25.575 399 HB VAL 54 HB VAL 54 44.064 43.306 -24.568 400 HG11 VAL 54 HG11 VAL 54 45.659 45.188 -26.320 401 HG12 VAL 54 HG12 VAL 54 45.772 45.220 -24.560 402 HG13 VAL 54 HG13 VAL 54 44.231 45.550 -25.351 403 HG21 VAL 54 HG21 VAL 54 43.223 43.465 -26.814 404 HG22 VAL 54 HG22 VAL 54 44.144 41.963 -26.726 405 HG23 VAL 54 HG23 VAL 54 44.849 43.387 -27.492 406 H GLU 55 HN GLU 55 47.640 44.127 -23.714 407 HA GLU 55 HA GLU 55 48.922 45.438 -25.911 408 HB2 GLU 55 HB2 GLU 55 48.602 46.329 -23.524 409 HB3 GLU 55 HB1 GLU 55 49.987 45.327 -23.092 410 HG2 GLU 55 HG2 GLU 55 50.109 47.246 -25.416 411 HG3 GLU 55 HG1 GLU 55 50.452 47.779 -23.772 412 H VAL 56 HN VAL 56 50.166 43.173 -23.441 413 HA VAL 56 HA VAL 56 52.702 42.774 -24.460 414 HB VAL 56 HB VAL 56 52.039 41.832 -22.325 415 HG11 VAL 56 HG11 VAL 56 50.272 40.000 -23.977 416 HG12 VAL 56 HG12 VAL 56 49.715 41.269 -22.887 417 HG13 VAL 56 HG13 VAL 56 50.545 39.855 -22.241 418 HG21 VAL 56 HG21 VAL 56 53.058 39.633 -22.544 419 HG22 VAL 56 HG22 VAL 56 53.872 40.740 -23.651 420 HG23 VAL 56 HG23 VAL 56 52.683 39.592 -24.267 421 H LEU 57 HN LEU 57 49.654 41.476 -25.605 422 HA LEU 57 HA LEU 57 50.756 39.479 -27.315 423 HB2 LEU 57 HB2 LEU 57 48.123 40.642 -26.787 424 HB3 LEU 57 HB1 LEU 57 48.363 40.226 -28.484 425 HG LEU 57 HG LEU 57 49.047 37.953 -27.847 426 HD11 LEU 57 HD11 LEU 57 50.077 38.297 -25.716 427 HD12 LEU 57 HD12 LEU 57 48.655 37.301 -25.409 428 HD13 LEU 57 HD13 LEU 57 48.617 39.027 -25.052 429 HD21 LEU 57 HD21 LEU 57 46.640 38.454 -28.221 430 HD22 LEU 57 HD22 LEU 57 46.459 38.790 -26.499 431 HD23 LEU 57 HD23 LEU 57 46.865 37.162 -27.041 432 H LYS 58 HN LYS 58 49.825 42.862 -27.783 433 HA LYS 58 HA LYS 58 50.333 42.956 -30.585 434 HB2 LYS 58 HB2 LYS 58 50.216 45.095 -28.455 435 HB3 LYS 58 HB1 LYS 58 50.459 45.448 -30.166 436 HG2 LYS 58 HG2 LYS 58 48.139 43.773 -29.192 437 HG3 LYS 58 HG1 LYS 58 48.038 45.529 -29.316 438 HD2 LYS 58 HD2 LYS 58 48.791 45.296 -31.728 439 HD3 LYS 58 HD1 LYS 58 48.569 43.555 -31.550 440 HE2 LYS 58 HE2 LYS 58 46.407 45.614 -31.024 441 HE3 LYS 58 HE1 LYS 58 46.567 44.700 -32.523 442 HZ1 LYS 58 HZ1 LYS 58 46.179 42.685 -31.398 443 HZ2 LYS 58 HZ2 LYS 58 44.994 43.761 -30.828 444 HZ3 LYS 58 HZ3 LYS 58 46.350 43.401 -29.870 445 H ARG 59 HN ARG 59 52.298 43.794 -27.739 446 HA ARG 59 HA ARG 59 54.554 44.696 -29.197 447 HB2 ARG 59 HB2 ARG 59 54.047 45.111 -26.742 448 HB3 ARG 59 HB1 ARG 59 54.608 43.467 -26.439 449 HG2 ARG 59 HG2 ARG 59 56.414 45.072 -28.129 450 HG3 ARG 59 HG1 ARG 59 56.238 45.670 -26.479 451 HD2 ARG 59 HD2 ARG 59 56.795 43.443 -25.599 452 HD3 ARG 59 HD1 ARG 59 56.942 42.821 -27.240 453 HE ARG 59 HE ARG 59 58.673 44.979 -27.097 454 HH11 ARG 59 HH11 ARG 59 58.237 41.939 -25.444 455 HH12 ARG 59 HH12 ARG 59 59.919 41.757 -25.088 456 HH21 ARG 59 HH21 ARG 59 60.865 44.714 -26.618 457 HH22 ARG 59 HH22 ARG 59 61.400 43.316 -25.747 458 H GLU 60 HN GLU 60 53.441 41.522 -28.248 459 HA GLU 60 HA GLU 60 55.902 40.359 -29.412 460 HB2 GLU 60 HB2 GLU 60 55.571 39.897 -26.978 461 HB3 GLU 60 HB1 GLU 60 54.061 39.079 -27.382 462 HG2 GLU 60 HG2 GLU 60 55.271 37.490 -28.801 463 HG3 GLU 60 HG1 GLU 60 56.787 38.326 -28.474 464 HA PRO 61 HA PRO 61 52.276 39.211 -32.088 465 HB2 PRO 61 HB2 PRO 61 53.523 39.773 -34.459 466 HB3 PRO 61 HB1 PRO 61 52.616 40.976 -33.523 467 HG2 PRO 61 HG2 PRO 61 55.553 40.535 -33.698 468 HG3 PRO 61 HG1 PRO 61 54.640 42.051 -33.613 469 HD2 PRO 61 HD2 PRO 61 55.923 40.956 -31.451 470 HD3 PRO 61 HD1 PRO 61 54.480 41.983 -31.310 471 H LEU 62 HN LEU 62 55.413 38.117 -31.515 472 HA LEU 62 HA LEU 62 55.859 36.228 -33.528 473 HB2 LEU 62 HB2 LEU 62 57.568 36.844 -31.882 474 HB3 LEU 62 HB1 LEU 62 56.613 36.109 -30.596 475 HG LEU 62 HG LEU 62 56.783 33.914 -31.756 476 HD11 LEU 62 HD11 LEU 62 57.061 34.582 -34.046 477 HD12 LEU 62 HD12 LEU 62 58.557 33.776 -33.573 478 HD13 LEU 62 HD13 LEU 62 58.492 35.537 -33.657 479 HD21 LEU 62 HD21 LEU 62 59.049 33.473 -31.105 480 HD22 LEU 62 HD22 LEU 62 58.464 34.742 -30.029 481 HD23 LEU 62 HD23 LEU 62 59.522 35.149 -31.381 482 H ASN 63 HN ASN 63 54.059 35.993 -30.482 483 HA ASN 63 HA ASN 63 53.448 33.243 -30.630 484 HB2 ASN 63 HB2 ASN 63 51.895 33.647 -28.892 485 HB3 ASN 63 HB1 ASN 63 53.176 34.830 -28.639 486 HD21 ASN 63 HD21 ASN 63 50.102 34.850 -28.099 487 HD22 ASN 63 HD22 ASN 63 49.605 36.329 -28.767 488 H TYR 64 HN TYR 64 52.144 36.003 -32.281 489 HA TYR 64 HA TYR 64 49.635 34.804 -32.988 490 HB2 TYR 64 HB2 TYR 64 50.012 37.263 -32.935 491 HB3 TYR 64 HB1 TYR 64 51.087 37.100 -34.323 492 HD1 TYR 64 HD1 TYR 64 47.630 36.142 -33.222 493 HD2 TYR 64 HD2 TYR 64 50.194 37.294 -36.471 494 HE1 TYR 64 HE1 TYR 64 45.674 36.198 -34.746 495 HE2 TYR 64 HE2 TYR 64 48.238 37.350 -37.995 496 HH TYR 64 HH TYR 64 45.421 35.910 -37.423 497 H LEU 65 HN LEU 65 52.767 35.228 -34.586 498 HA LEU 65 HA LEU 65 51.978 33.993 -37.039 499 HB2 LEU 65 HB2 LEU 65 54.691 34.576 -35.833 500 HB3 LEU 65 HB1 LEU 65 54.467 33.906 -37.449 501 HG LEU 65 HG LEU 65 53.041 36.428 -36.619 502 HD11 LEU 65 HD11 LEU 65 54.881 37.753 -37.439 503 HD12 LEU 65 HD12 LEU 65 55.759 36.312 -37.954 504 HD13 LEU 65 HD13 LEU 65 55.536 36.642 -36.236 505 HD21 LEU 65 HD21 LEU 65 53.040 36.815 -39.042 506 HD22 LEU 65 HD22 LEU 65 52.368 35.222 -38.695 507 HD23 LEU 65 HD23 LEU 65 54.021 35.371 -39.292 508 HA PRO 66 HA PRO 66 52.263 29.671 -36.248 509 HB2 PRO 66 HB2 PRO 66 54.363 29.456 -38.355 510 HB3 PRO 66 HB1 PRO 66 52.819 28.595 -38.207 511 HG2 PRO 66 HG2 PRO 66 53.154 30.552 -39.978 512 HG3 PRO 66 HG1 PRO 66 51.615 30.314 -39.132 513 HD2 PRO 66 HD2 PRO 66 53.699 32.411 -38.694 514 HD3 PRO 66 HD1 PRO 66 51.935 32.510 -38.498 515 H LEU 67 HN LEU 67 53.396 28.339 -34.895 516 HA LEU 67 HA LEU 67 56.254 28.357 -34.690 517 HB2 LEU 67 HB2 LEU 67 54.985 30.384 -33.265 518 HB3 LEU 67 HB1 LEU 67 55.265 29.123 -32.063 519 HG LEU 67 HG LEU 67 57.375 30.223 -33.944 520 HD11 LEU 67 HD11 LEU 67 56.976 30.659 -30.968 521 HD12 LEU 67 HD12 LEU 67 56.644 31.856 -32.220 522 HD13 LEU 67 HD13 LEU 67 58.296 31.305 -31.944 523 HD21 LEU 67 HD21 LEU 67 57.866 27.936 -33.348 524 HD22 LEU 67 HD22 LEU 67 57.445 28.230 -31.660 525 HD23 LEU 67 HD23 LEU 67 58.892 28.966 -32.350 Start of MODEL 6 1 H1 THR 1 HT1 THR 1 -3.272 -4.557 -2.043 2 H2 THR 1 HT2 THR 1 -3.394 -3.019 -1.333 3 H3 THR 1 HT3 THR 1 -4.288 -4.321 -0.706 4 HA THR 1 HA THR 1 -2.533 -5.235 0.363 5 HB THR 1 HB THR 1 -1.300 -4.787 -2.110 6 HG1 THR 1 HG1 THR 1 0.339 -6.101 -1.121 7 HG21 THR 1 HG21 THR 1 0.862 -3.814 -1.597 8 HG22 THR 1 HG22 THR 1 0.411 -3.596 0.092 9 HG23 THR 1 HG23 THR 1 -0.391 -2.652 -1.166 10 HA PRO 2 HA PRO 2 -1.904 -1.763 3.006 11 HB2 PRO 2 HB2 PRO 2 0.247 -2.524 4.505 12 HB3 PRO 2 HB1 PRO 2 -1.364 -3.246 4.683 13 HG2 PRO 2 HG2 PRO 2 1.036 -4.295 3.277 14 HG3 PRO 2 HG1 PRO 2 -0.180 -5.154 4.237 15 HD2 PRO 2 HD2 PRO 2 -0.152 -5.129 1.483 16 HD3 PRO 2 HD1 PRO 2 -1.620 -5.381 2.452 17 H ILE 3 HN ILE 3 -0.669 0.129 3.333 18 HA ILE 3 HA ILE 3 0.951 0.980 1.208 19 HB ILE 3 HB ILE 3 -0.333 2.361 2.994 20 HG12 ILE 3 HG12 ILE 3 1.520 4.192 2.776 21 HG13 ILE 3 HG11 ILE 3 2.353 2.995 1.784 22 HG21 ILE 3 HG21 ILE 3 1.026 1.276 4.868 23 HG22 ILE 3 HG22 ILE 3 0.905 3.034 4.923 24 HG23 ILE 3 HG23 ILE 3 2.380 2.270 4.331 25 HD11 ILE 3 HD11 ILE 3 -0.372 4.219 1.307 26 HD12 ILE 3 HD12 ILE 3 0.191 2.786 0.447 27 HD13 ILE 3 HD13 ILE 3 1.052 4.315 0.270 28 H GLU 4 HN GLU 4 3.154 1.208 0.955 29 HA GLU 4 HA GLU 4 4.818 -0.749 2.144 30 HB2 GLU 4 HB2 GLU 4 6.642 0.354 0.944 31 HB3 GLU 4 HB1 GLU 4 5.225 0.213 -0.098 32 HG2 GLU 4 HG2 GLU 4 4.594 2.542 0.462 33 HG3 GLU 4 HG1 GLU 4 6.038 2.681 1.464 34 H SER 5 HN SER 5 7.023 -0.030 3.112 35 HA SER 5 HA SER 5 6.545 1.062 5.660 36 HB2 SER 5 HB2 SER 5 9.153 0.743 4.160 37 HB3 SER 5 HB1 SER 5 9.013 1.094 5.880 38 HG SER 5 HG SER 5 8.287 -0.893 6.239 39 H HIS 6 HN HIS 6 6.979 3.061 6.561 40 HA HIS 6 HA HIS 6 7.122 5.279 4.641 41 HB2 HIS 6 HB2 HIS 6 6.371 6.671 6.532 42 HB3 HIS 6 HB1 HIS 6 5.274 5.319 6.252 43 HD1 HIS 6 HD1 HIS 6 8.047 6.428 8.582 44 HD2 HIS 6 HD2 HIS 6 5.081 3.505 8.383 45 HE1 HIS 6 HE1 HIS 6 8.011 5.289 10.843 46 HE2 HIS 6 HE2 HIS 6 6.208 3.504 10.738 47 H GLN 7 HN GLN 7 9.468 3.640 5.456 48 HA GLN 7 HA GLN 7 11.121 4.922 7.296 49 HB2 GLN 7 HB2 GLN 7 11.620 2.741 6.205 50 HB3 GLN 7 HB1 GLN 7 11.985 3.605 4.711 51 HG2 GLN 7 HG2 GLN 7 13.751 4.876 5.876 52 HG3 GLN 7 HG1 GLN 7 13.391 4.007 7.367 53 HE21 GLN 7 HE21 GLN 7 14.955 2.428 7.701 54 HE22 GLN 7 HE22 GLN 7 15.628 1.452 6.486 55 H VAL 8 HN VAL 8 12.325 6.738 7.283 56 HA VAL 8 HA VAL 8 12.535 8.251 4.754 57 HB VAL 8 HB VAL 8 10.761 9.245 6.131 58 HG11 VAL 8 HG11 VAL 8 11.731 8.398 8.311 59 HG12 VAL 8 HG12 VAL 8 11.200 10.079 8.349 60 HG13 VAL 8 HG13 VAL 8 12.917 9.699 8.211 61 HG21 VAL 8 HG21 VAL 8 12.411 10.647 4.780 62 HG22 VAL 8 HG22 VAL 8 13.249 10.965 6.299 63 HG23 VAL 8 HG23 VAL 8 11.582 11.499 6.083 64 H GLU 9 HN GLU 9 14.369 9.605 4.567 65 HA GLU 9 HA GLU 9 16.471 9.186 6.597 66 HB2 GLU 9 HB2 GLU 9 18.013 9.236 4.439 67 HB3 GLU 9 HB1 GLU 9 17.301 7.730 5.017 68 HG2 GLU 9 HG2 GLU 9 17.008 8.093 2.551 69 HG3 GLU 9 HG1 GLU 9 15.485 7.907 3.419 70 H LYS 10 HN LYS 10 18.335 10.735 6.237 71 HA LYS 10 HA LYS 10 17.466 13.293 5.070 72 HB2 LYS 10 HB2 LYS 10 18.235 14.495 7.082 73 HB3 LYS 10 HB1 LYS 10 16.900 13.404 7.453 74 HG2 LYS 10 HG2 LYS 10 18.600 11.680 8.150 75 HG3 LYS 10 HG1 LYS 10 19.847 12.913 7.957 76 HD2 LYS 10 HD2 LYS 10 18.755 14.329 9.625 77 HD3 LYS 10 HD1 LYS 10 17.438 13.165 9.781 78 HE2 LYS 10 HE2 LYS 10 19.045 11.456 10.561 79 HE3 LYS 10 HE1 LYS 10 20.353 12.631 10.425 80 HZ1 LYS 10 HZ1 LYS 10 18.080 12.605 12.304 81 HZ2 LYS 10 HZ2 LYS 10 18.891 14.055 11.947 82 HZ3 LYS 10 HZ3 LYS 10 19.737 12.754 12.639 83 H ARG 11 HN ARG 11 19.260 14.814 4.782 84 HA ARG 11 HA ARG 11 21.935 13.644 4.885 85 HB2 ARG 11 HB2 ARG 11 22.179 14.642 2.428 86 HB3 ARG 11 HB1 ARG 11 21.663 12.986 2.709 87 HG2 ARG 11 HG2 ARG 11 20.136 13.855 1.111 88 HG3 ARG 11 HG1 ARG 11 19.245 13.887 2.623 89 HD2 ARG 11 HD2 ARG 11 20.837 16.291 1.780 90 HD3 ARG 11 HD1 ARG 11 19.257 16.001 1.067 91 HE ARG 11 HE ARG 11 19.793 16.841 3.781 92 HH11 ARG 11 HH11 ARG 11 17.548 15.264 1.628 93 HH12 ARG 11 HH12 ARG 11 16.174 15.604 2.621 94 HH21 ARG 11 HH21 ARG 11 17.980 17.270 5.059 95 HH22 ARG 11 HH22 ARG 11 16.414 16.731 4.551 96 H LYS 12 HN LYS 12 21.576 15.427 6.618 97 HA LYS 12 HA LYS 12 21.549 18.150 5.880 98 HB2 LYS 12 HB2 LYS 12 22.278 18.603 8.124 99 HB3 LYS 12 HB1 LYS 12 21.180 17.225 8.199 100 HG2 LYS 12 HG2 LYS 12 23.188 15.710 8.119 101 HG3 LYS 12 HG1 LYS 12 24.209 17.142 8.254 102 HD2 LYS 12 HD2 LYS 12 23.076 17.729 10.383 103 HD3 LYS 12 HD1 LYS 12 22.112 16.257 10.259 104 HE2 LYS 12 HE2 LYS 12 23.946 15.723 11.699 105 HE3 LYS 12 HE1 LYS 12 24.315 14.977 10.144 106 HZ1 LYS 12 HZ1 LYS 12 25.421 17.484 11.269 107 HZ2 LYS 12 HZ2 LYS 12 25.579 17.071 9.629 108 HZ3 LYS 12 HZ3 LYS 12 26.260 16.078 10.827 109 H CYS 13 HN CYS 13 23.276 19.674 5.798 110 HA CYS 13 HA CYS 13 25.512 18.817 4.285 111 HB2 CYS 13 HB2 CYS 13 24.534 21.358 5.435 112 HB3 CYS 13 HB1 CYS 13 26.277 21.263 5.184 113 H ASN 14 HN ASN 14 26.777 17.312 5.323 114 HA ASN 14 HA ASN 14 28.180 18.271 7.742 115 HB2 ASN 14 HB2 ASN 14 26.468 16.347 8.050 116 HB3 ASN 14 HB1 ASN 14 27.672 15.352 7.231 117 HD21 ASN 14 HD21 ASN 14 28.339 14.128 9.084 118 HD22 ASN 14 HD22 ASN 14 29.113 14.838 10.417 119 H THR 15 HN THR 15 28.853 18.379 4.821 120 HA THR 15 HA THR 15 31.403 16.893 4.988 121 HB THR 15 HB THR 15 29.763 15.875 3.366 122 HG1 THR 15 HG1 THR 15 32.031 17.030 2.129 123 HG21 THR 15 HG21 THR 15 30.309 18.362 1.734 124 HG22 THR 15 HG22 THR 15 28.839 18.149 2.685 125 HG23 THR 15 HG23 THR 15 29.198 17.045 1.358 126 H ALA 16 HN ALA 16 33.098 17.799 3.563 127 HA ALA 16 HA ALA 16 33.461 20.564 4.057 128 HB1 ALA 16 HB1 ALA 16 35.026 19.161 1.930 129 HB2 ALA 16 HB2 ALA 16 35.189 18.620 3.601 130 HB3 ALA 16 HB3 ALA 16 35.577 20.286 3.171 131 H THR 17 HN THR 17 32.404 18.758 1.212 132 HA THR 17 HA THR 17 32.605 20.676 -0.762 133 HB THR 17 HB THR 17 30.345 18.705 -0.341 134 HG1 THR 17 HG1 THR 17 32.359 17.719 -0.472 135 HG21 THR 17 HG21 THR 17 30.197 18.912 -2.865 136 HG22 THR 17 HG22 THR 17 31.242 20.326 -2.732 137 HG23 THR 17 HG23 THR 17 29.654 20.328 -1.966 138 H CYS 18 HN CYS 18 30.015 20.290 1.643 139 HA CYS 18 HA CYS 18 28.366 22.371 0.661 140 HB2 CYS 18 HB2 CYS 18 27.816 20.513 2.379 141 HB3 CYS 18 HB1 CYS 18 28.508 21.616 3.569 142 H ALA 19 HN ALA 19 31.235 22.359 2.628 143 HA ALA 19 HA ALA 19 30.984 24.833 3.929 144 HB1 ALA 19 HB1 ALA 19 32.819 22.970 4.111 145 HB2 ALA 19 HB2 ALA 19 33.251 24.654 4.412 146 HB3 ALA 19 HB3 ALA 19 33.628 23.911 2.857 147 H THR 20 HN THR 20 32.139 24.027 0.679 148 HA THR 20 HA THR 20 33.018 26.636 -0.003 149 HB THR 20 HB THR 20 32.024 24.404 -1.795 150 HG1 THR 20 HG1 THR 20 33.966 23.621 -1.598 151 HG21 THR 20 HG21 THR 20 33.614 26.918 -2.368 152 HG22 THR 20 HG22 THR 20 32.007 26.524 -2.979 153 HG23 THR 20 HG23 THR 20 33.406 25.592 -3.512 154 H GLN 21 HN GLN 21 29.913 24.983 -0.265 155 HA GLN 21 HA GLN 21 28.553 26.837 -1.858 156 HB2 GLN 21 HB2 GLN 21 27.689 24.595 -1.262 157 HB3 GLN 21 HB1 GLN 21 27.418 25.157 0.388 158 HG2 GLN 21 HG2 GLN 21 25.841 26.833 -0.385 159 HG3 GLN 21 HG1 GLN 21 26.194 26.442 -2.067 160 HE21 GLN 21 HE21 GLN 21 23.711 26.087 -0.101 161 HE22 GLN 21 HE22 GLN 21 23.195 24.513 -0.473 162 H ARG 22 HN ARG 22 29.061 26.791 1.663 163 HA ARG 22 HA ARG 22 27.332 28.983 2.198 164 HB2 ARG 22 HB2 ARG 22 27.965 28.769 4.394 165 HB3 ARG 22 HB1 ARG 22 28.415 27.176 3.798 166 HG2 ARG 22 HG2 ARG 22 30.387 27.710 4.839 167 HG3 ARG 22 HG1 ARG 22 30.723 28.473 3.292 168 HD2 ARG 22 HD2 ARG 22 31.158 30.266 4.670 169 HD3 ARG 22 HD1 ARG 22 29.429 30.507 4.450 170 HE ARG 22 HE ARG 22 29.102 29.904 6.669 171 HH11 ARG 22 HH11 ARG 22 32.328 29.056 5.644 172 HH12 ARG 22 HH12 ARG 22 32.856 28.658 7.242 173 HH21 ARG 22 HH21 ARG 22 29.821 29.376 8.742 174 HH22 ARG 22 HH22 ARG 22 31.449 28.836 8.985 175 H LEU 23 HN LEU 23 30.559 28.778 0.976 176 HA LEU 23 HA LEU 23 31.445 31.382 1.730 177 HB2 LEU 23 HB2 LEU 23 33.000 29.604 0.993 178 HB3 LEU 23 HB1 LEU 23 32.301 29.675 -0.623 179 HG LEU 23 HG LEU 23 32.946 32.090 -0.747 180 HD11 LEU 23 HD11 LEU 23 33.058 32.708 1.564 181 HD12 LEU 23 HD12 LEU 23 34.710 32.797 0.955 182 HD13 LEU 23 HD13 LEU 23 34.201 31.413 1.923 183 HD21 LEU 23 HD21 LEU 23 35.399 31.647 -0.978 184 HD22 LEU 23 HD22 LEU 23 34.405 30.408 -1.744 185 HD23 LEU 23 HD23 LEU 23 35.159 30.092 -0.181 186 H ALA 24 HN ALA 24 29.779 30.067 -1.094 187 HA ALA 24 HA ALA 24 29.810 32.354 -2.720 188 HB1 ALA 24 HB1 ALA 24 27.395 30.590 -2.663 189 HB2 ALA 24 HB2 ALA 24 28.941 29.894 -3.148 190 HB3 ALA 24 HB3 ALA 24 28.266 31.254 -4.046 191 H ASN 25 HN ASN 25 27.721 31.412 -0.049 192 HA ASN 25 HA ASN 25 25.711 33.364 -0.363 193 HB2 ASN 25 HB2 ASN 25 25.658 31.367 1.187 194 HB3 ASN 25 HB1 ASN 25 26.727 32.266 2.262 195 HD21 ASN 25 HD21 ASN 25 25.252 32.716 3.970 196 HD22 ASN 25 HD22 ASN 25 23.833 33.622 3.756 197 H PHE 26 HN PHE 26 28.913 33.477 1.072 198 HA PHE 26 HA PHE 26 28.653 35.922 2.464 199 HB2 PHE 26 HB2 PHE 26 30.521 34.342 2.815 200 HB3 PHE 26 HB1 PHE 26 31.135 34.726 1.207 201 HD1 PHE 26 HD1 PHE 26 30.334 36.196 4.535 202 HD2 PHE 26 HD2 PHE 26 32.420 36.687 0.813 203 HE1 PHE 26 HE1 PHE 26 31.509 38.177 5.455 204 HE2 PHE 26 HE2 PHE 26 33.595 38.668 1.732 205 HZ PHE 26 HZ PHE 26 33.139 39.413 4.053 206 H LEU 27 HN LEU 27 29.536 35.181 -0.887 207 HA LEU 27 HA LEU 27 30.383 37.752 -1.643 208 HB2 LEU 27 HB2 LEU 27 30.268 35.353 -2.897 209 HB3 LEU 27 HB1 LEU 27 28.901 36.165 -3.659 210 HG LEU 27 HG LEU 27 30.821 36.655 -5.003 211 HD11 LEU 27 HD11 LEU 27 30.542 39.092 -3.237 212 HD12 LEU 27 HD12 LEU 27 29.253 38.572 -4.322 213 HD13 LEU 27 HD13 LEU 27 30.825 39.030 -4.976 214 HD21 LEU 27 HD21 LEU 27 32.436 36.073 -3.085 215 HD22 LEU 27 HD22 LEU 27 32.249 37.750 -2.570 216 HD23 LEU 27 HD23 LEU 27 32.923 37.385 -4.157 217 H VAL 28 HN VAL 28 27.162 36.245 -1.815 218 HA VAL 28 HA VAL 28 25.906 38.627 -2.838 219 HB VAL 28 HB VAL 28 23.798 37.422 -2.422 220 HG11 VAL 28 HG11 VAL 28 24.934 36.945 -4.498 221 HG12 VAL 28 HG12 VAL 28 24.332 35.416 -3.857 222 HG13 VAL 28 HG13 VAL 28 26.039 35.830 -3.695 223 HG21 VAL 28 HG21 VAL 28 25.581 35.267 -1.245 224 HG22 VAL 28 HG22 VAL 28 23.836 35.170 -1.466 225 HG23 VAL 28 HG23 VAL 28 24.514 36.311 -0.306 226 H HIS 29 HN HIS 29 26.552 37.279 0.320 227 HA HIS 29 HA HIS 29 24.748 38.984 1.750 228 HB2 HIS 29 HB2 HIS 29 25.534 36.859 2.701 229 HB3 HIS 29 HB1 HIS 29 27.187 37.475 2.721 230 HD1 HIS 29 HD1 HIS 29 23.768 38.404 4.140 231 HD2 HIS 29 HD2 HIS 29 27.814 38.847 5.041 232 HE1 HIS 29 HE1 HIS 29 23.878 39.517 6.412 233 HE2 HIS 29 HE2 HIS 29 26.338 39.794 6.976 234 H SER 30 HN SER 30 27.933 39.320 0.465 235 HA SER 30 HA SER 30 28.176 41.932 1.821 236 HB2 SER 30 HB2 SER 30 29.936 40.347 2.537 237 HB3 SER 30 HB1 SER 30 30.438 40.159 0.859 238 HG SER 30 HG SER 30 31.723 41.732 1.695 239 H SER 31 HN SER 31 26.999 40.991 -0.853 240 HA SER 31 HA SER 31 28.593 41.915 -2.976 241 HB2 SER 31 HB2 SER 31 26.592 40.556 -3.333 242 HB3 SER 31 HB1 SER 31 25.579 41.859 -2.718 243 HG SER 31 HG SER 31 27.245 41.887 -5.020 244 H ASN 32 HN ASN 32 26.204 43.626 -0.962 245 HA ASN 32 HA ASN 32 26.333 46.072 -2.382 246 HB2 ASN 32 HB2 ASN 32 25.325 47.036 -0.322 247 HB3 ASN 32 HB1 ASN 32 24.481 45.599 -0.894 248 HD21 ASN 32 HD21 ASN 32 25.523 46.985 1.916 249 HD22 ASN 32 HD22 ASN 32 25.807 45.589 2.839 250 H ASN 33 HN ASN 33 28.115 44.802 0.389 251 HA ASN 33 HA ASN 33 29.532 47.236 0.884 252 HB2 ASN 33 HB2 ASN 33 30.052 44.387 1.760 253 HB3 ASN 33 HB1 ASN 33 31.019 45.761 2.292 254 HD21 ASN 33 HD21 ASN 33 29.406 47.709 3.051 255 HD22 ASN 33 HD22 ASN 33 28.195 47.203 4.127 256 H PHE 34 HN PHE 34 30.039 44.417 -1.101 257 HA PHE 34 HA PHE 34 32.735 44.511 -1.658 258 HB2 PHE 34 HB2 PHE 34 31.221 42.798 -2.569 259 HB3 PHE 34 HB1 PHE 34 30.502 44.002 -3.638 260 HD1 PHE 34 HD1 PHE 34 33.785 42.447 -2.738 261 HD2 PHE 34 HD2 PHE 34 31.450 44.433 -5.748 262 HE1 PHE 34 HE1 PHE 34 35.586 42.053 -4.396 263 HE2 PHE 34 HE2 PHE 34 33.252 44.038 -7.405 264 HZ PHE 34 HZ PHE 34 35.320 42.848 -6.729 265 H GLY 35 HN GLY 35 30.135 46.392 -3.187 266 HA2 GLY 35 HA2 GLY 35 31.745 47.817 -5.021 267 HA3 GLY 35 HA1 GLY 35 30.168 48.332 -4.416 268 H ALA 36 HN ALA 36 30.643 48.652 -1.727 269 HA ALA 36 HA ALA 36 31.841 51.197 -1.654 270 HB1 ALA 36 HB1 ALA 36 31.794 50.745 0.909 271 HB2 ALA 36 HB2 ALA 36 30.961 49.255 0.467 272 HB3 ALA 36 HB3 ALA 36 30.263 50.816 0.036 273 H ILE 37 HN ILE 37 33.137 47.992 -1.032 274 HA ILE 37 HA ILE 37 35.505 48.742 0.292 275 HB ILE 37 HB ILE 37 34.822 46.371 -1.443 276 HG12 ILE 37 HG12 ILE 37 35.392 46.603 1.528 277 HG13 ILE 37 HG11 ILE 37 33.770 46.687 0.842 278 HG21 ILE 37 HG21 ILE 37 36.963 45.401 -0.453 279 HG22 ILE 37 HG22 ILE 37 37.393 47.048 0.007 280 HG23 ILE 37 HG23 ILE 37 37.195 46.631 -1.694 281 HD11 ILE 37 HD11 ILE 37 35.687 44.353 0.814 282 HD12 ILE 37 HD12 ILE 37 34.306 44.434 -0.278 283 HD13 ILE 37 HD13 ILE 37 34.050 44.411 1.466 284 H LEU 38 HN LEU 38 34.681 48.476 -3.126 285 HA LEU 38 HA LEU 38 37.227 48.807 -4.249 286 HB2 LEU 38 HB2 LEU 38 35.247 48.150 -5.556 287 HB3 LEU 38 HB1 LEU 38 34.554 49.753 -5.316 288 HG LEU 38 HG LEU 38 36.539 50.743 -6.463 289 HD11 LEU 38 HD11 LEU 38 38.227 49.085 -6.076 290 HD12 LEU 38 HD12 LEU 38 37.928 49.089 -7.814 291 HD13 LEU 38 HD13 LEU 38 37.239 47.818 -6.804 292 HD21 LEU 38 HD21 LEU 38 35.875 50.068 -8.715 293 HD22 LEU 38 HD22 LEU 38 34.441 50.170 -7.693 294 HD23 LEU 38 HD23 LEU 38 35.135 48.597 -8.084 295 H SER 39 HN SER 39 34.903 51.165 -3.035 296 HA SER 39 HA SER 39 36.137 53.496 -4.031 297 HB2 SER 39 HB2 SER 39 34.468 53.060 -1.546 298 HB3 SER 39 HB1 SER 39 34.933 54.643 -2.163 299 HG SER 39 HG SER 39 32.918 53.082 -2.927 300 H SER 40 HN SER 40 37.004 51.354 -1.454 301 HA SER 40 HA SER 40 38.810 53.302 -0.230 302 HB2 SER 40 HB2 SER 40 38.174 50.426 0.457 303 HB3 SER 40 HB1 SER 40 39.298 51.440 1.357 304 HG SER 40 HG SER 40 37.485 52.932 1.572 305 H THR 41 HN THR 41 39.321 52.537 -2.956 306 HA THR 41 HA THR 41 41.234 50.537 -3.292 307 HB THR 41 HB THR 41 40.139 51.818 -5.133 308 HG1 THR 41 HG1 THR 41 42.964 51.984 -5.212 309 HG21 THR 41 HG21 THR 41 40.906 54.016 -5.711 310 HG22 THR 41 HG22 THR 41 42.189 53.952 -4.503 311 HG23 THR 41 HG23 THR 41 40.503 54.056 -3.995 312 H ASN 42 HN ASN 42 41.494 53.587 -1.690 313 HA ASN 42 HA ASN 42 44.406 53.637 -1.840 314 HB2 ASN 42 HB2 ASN 42 44.259 55.728 -0.664 315 HB3 ASN 42 HB1 ASN 42 43.019 55.729 -1.917 316 HD21 ASN 42 HD21 ASN 42 43.159 57.094 0.850 317 HD22 ASN 42 HD22 ASN 42 41.697 56.653 1.590 318 H VAL 43 HN VAL 43 42.704 51.519 -0.367 319 HA VAL 43 HA VAL 43 43.594 51.895 2.387 320 HB VAL 43 HB VAL 43 41.321 50.925 1.668 321 HG11 VAL 43 HG11 VAL 43 42.927 48.374 1.418 322 HG12 VAL 43 HG12 VAL 43 42.472 49.336 0.012 323 HG13 VAL 43 HG13 VAL 43 41.224 48.633 1.041 324 HG21 VAL 43 HG21 VAL 43 42.918 49.173 3.549 325 HG22 VAL 43 HG22 VAL 43 41.212 49.602 3.647 326 HG23 VAL 43 HG23 VAL 43 42.446 50.818 3.976 327 H GLY 44 HN GLY 44 45.409 51.340 -0.039 328 HA2 GLY 44 HA2 GLY 44 47.620 50.444 0.239 329 HA3 GLY 44 HA1 GLY 44 46.943 49.190 1.272 330 H SER 45 HN SER 45 44.669 49.031 -0.834 331 HA SER 45 HA SER 45 46.038 47.045 -2.499 332 HB2 SER 45 HB2 SER 45 43.768 46.286 -3.065 333 HB3 SER 45 HB1 SER 45 44.000 46.347 -1.320 334 HG SER 45 HG SER 45 42.238 47.515 -1.435 335 H ASN 46 HN ASN 46 46.232 50.007 -2.905 336 HA ASN 46 HA ASN 46 44.705 50.801 -5.140 337 HB2 ASN 46 HB2 ASN 46 46.372 52.562 -5.418 338 HB3 ASN 46 HB1 ASN 46 45.972 52.369 -3.712 339 HD21 ASN 46 HD21 ASN 46 48.555 53.278 -5.164 340 HD22 ASN 46 HD22 ASN 46 49.764 52.317 -4.459 341 H THR 47 HN THR 47 47.297 48.567 -4.879 342 HA THR 47 HA THR 47 48.080 48.843 -7.681 343 HB THR 47 HB THR 47 49.065 46.654 -5.889 344 HG1 THR 47 HG1 THR 47 50.320 48.024 -4.802 345 HG21 THR 47 HG21 THR 47 49.768 46.801 -8.263 346 HG22 THR 47 HG22 THR 47 51.124 47.036 -7.160 347 HG23 THR 47 HG23 THR 47 50.390 48.424 -7.962 348 H TYR 48 HN TYR 48 45.352 47.964 -6.912 349 HA TYR 48 HA TYR 48 45.311 45.151 -7.710 350 HB2 TYR 48 HB2 TYR 48 43.098 45.095 -6.967 351 HB3 TYR 48 HB1 TYR 48 43.841 46.254 -5.865 352 HD1 TYR 48 HD1 TYR 48 41.179 45.711 -8.155 353 HD2 TYR 48 HD2 TYR 48 43.780 48.770 -6.631 354 HE1 TYR 48 HE1 TYR 48 39.575 47.447 -8.902 355 HE2 TYR 48 HE2 TYR 48 42.177 50.507 -7.379 356 HH TYR 48 HH TYR 48 39.562 49.810 -9.478 357 H GLY 49 HN GLY 49 45.942 47.613 -9.501 358 HA2 GLY 49 HA2 GLY 49 43.957 48.081 -11.368 359 HA3 GLY 49 HA1 GLY 49 45.677 48.068 -11.744 360 H LYS 50 HN LYS 50 42.693 46.441 -12.091 361 HA LYS 50 HA LYS 50 43.655 43.839 -12.746 362 HB2 LYS 50 HB2 LYS 50 41.079 45.282 -13.390 363 HB3 LYS 50 HB1 LYS 50 41.384 43.601 -13.829 364 HG2 LYS 50 HG2 LYS 50 41.889 43.142 -11.401 365 HG3 LYS 50 HG1 LYS 50 41.338 44.777 -11.038 366 HD2 LYS 50 HD2 LYS 50 39.644 42.745 -12.511 367 HD3 LYS 50 HD1 LYS 50 39.571 42.981 -10.765 368 HE2 LYS 50 HE2 LYS 50 39.056 45.119 -12.854 369 HE3 LYS 50 HE1 LYS 50 37.822 44.298 -11.900 370 HZ1 LYS 50 HZ1 LYS 50 39.293 45.120 -9.931 371 HZ2 LYS 50 HZ2 LYS 50 38.167 46.165 -10.657 372 HZ3 LYS 50 HZ3 LYS 50 39.815 46.278 -11.055 373 H ARG 51 HN ARG 51 43.013 46.762 -14.611 374 HA ARG 51 HA ARG 51 43.135 45.767 -17.197 375 HB2 ARG 51 HB2 ARG 51 43.723 47.989 -17.898 376 HB3 ARG 51 HB1 ARG 51 42.625 48.137 -16.527 377 HG2 ARG 51 HG2 ARG 51 44.621 48.376 -15.026 378 HG3 ARG 51 HG1 ARG 51 45.645 48.392 -16.462 379 HD2 ARG 51 HD2 ARG 51 44.388 50.357 -17.310 380 HD3 ARG 51 HD1 ARG 51 43.430 50.362 -15.833 381 HE ARG 51 HE ARG 51 46.159 51.281 -16.128 382 HH11 ARG 51 HH11 ARG 51 43.726 50.087 -13.932 383 HH12 ARG 51 HH12 ARG 51 44.457 50.811 -12.543 384 HH21 ARG 51 HH21 ARG 51 47.088 52.218 -14.295 385 HH22 ARG 51 HH22 ARG 51 46.347 52.009 -12.744 386 H ASN 52 HN ASN 52 45.666 46.045 -14.852 387 HA ASN 52 HA ASN 52 47.948 46.238 -16.413 388 HB2 ASN 52 HB2 ASN 52 47.542 45.926 -13.787 389 HB3 ASN 52 HB1 ASN 52 47.984 44.267 -14.184 390 HD21 ASN 52 HD21 ASN 52 49.949 44.531 -16.097 391 HD22 ASN 52 HD22 ASN 52 51.255 45.432 -15.494 392 H ALA 53 HN ALA 53 45.707 43.606 -16.113 393 HA ALA 53 HA ALA 53 47.381 41.504 -17.038 394 HB1 ALA 53 HB1 ALA 53 45.421 40.218 -17.192 395 HB2 ALA 53 HB2 ALA 53 44.412 41.629 -17.515 396 HB3 ALA 53 HB3 ALA 53 45.066 41.363 -15.898 397 H VAL 54 HN VAL 54 45.216 43.781 -18.695 398 HA VAL 54 HA VAL 54 45.640 42.615 -21.282 399 HB VAL 54 HB VAL 54 43.730 44.231 -20.298 400 HG11 VAL 54 HG11 VAL 54 45.418 46.102 -21.974 401 HG12 VAL 54 HG12 VAL 54 45.476 46.106 -20.211 402 HG13 VAL 54 HG13 VAL 54 43.968 46.482 -21.044 403 HG21 VAL 54 HG21 VAL 54 43.183 44.717 -22.735 404 HG22 VAL 54 HG22 VAL 54 43.474 43.019 -22.356 405 HG23 VAL 54 HG23 VAL 54 44.729 43.974 -23.146 406 H GLU 55 HN GLU 55 47.291 44.964 -19.332 407 HA GLU 55 HA GLU 55 48.681 46.251 -21.485 408 HB2 GLU 55 HB2 GLU 55 48.260 47.137 -19.093 409 HB3 GLU 55 HB1 GLU 55 49.652 46.155 -18.636 410 HG2 GLU 55 HG2 GLU 55 49.798 48.063 -20.965 411 HG3 GLU 55 HG1 GLU 55 50.077 48.622 -19.317 412 H VAL 56 HN VAL 56 49.770 43.989 -18.940 413 HA VAL 56 HA VAL 56 52.337 43.521 -19.849 414 HB VAL 56 HB VAL 56 51.512 42.627 -17.727 415 HG11 VAL 56 HG11 VAL 56 49.922 40.715 -19.466 416 HG12 VAL 56 HG12 VAL 56 49.242 42.021 -18.495 417 HG13 VAL 56 HG13 VAL 56 50.033 40.656 -17.707 418 HG21 VAL 56 HG21 VAL 56 52.637 40.505 -17.815 419 HG22 VAL 56 HG22 VAL 56 53.441 41.548 -18.989 420 HG23 VAL 56 HG23 VAL 56 52.293 40.325 -19.536 421 H LEU 57 HN LEU 57 49.306 42.270 -21.093 422 HA LEU 57 HA LEU 57 50.472 40.262 -22.768 423 HB2 LEU 57 HB2 LEU 57 47.811 41.313 -22.223 424 HB3 LEU 57 HB1 LEU 57 48.055 40.998 -23.941 425 HG LEU 57 HG LEU 57 49.034 38.732 -23.210 426 HD11 LEU 57 HD11 LEU 57 49.331 39.239 -20.842 427 HD12 LEU 57 HD12 LEU 57 48.157 37.934 -21.012 428 HD13 LEU 57 HD13 LEU 57 47.609 39.575 -20.669 429 HD21 LEU 57 HD21 LEU 57 46.756 39.130 -24.233 430 HD22 LEU 57 HD22 LEU 57 46.103 39.212 -22.597 431 HD23 LEU 57 HD23 LEU 57 46.839 37.718 -23.180 432 H LYS 58 HN LYS 58 49.469 43.624 -23.228 433 HA LYS 58 HA LYS 58 49.961 43.753 -26.025 434 HB2 LYS 58 HB2 LYS 58 49.857 45.864 -23.866 435 HB3 LYS 58 HB1 LYS 58 50.095 46.244 -25.571 436 HG2 LYS 58 HG2 LYS 58 47.783 44.536 -24.645 437 HG3 LYS 58 HG1 LYS 58 47.673 46.295 -24.687 438 HD2 LYS 58 HD2 LYS 58 48.374 46.210 -27.104 439 HD3 LYS 58 HD1 LYS 58 48.250 44.452 -27.022 440 HE2 LYS 58 HE2 LYS 58 45.980 46.347 -26.355 441 HE3 LYS 58 HE1 LYS 58 46.180 45.551 -27.916 442 HZ1 LYS 58 HZ1 LYS 58 46.273 43.415 -26.562 443 HZ2 LYS 58 HZ2 LYS 58 44.758 44.164 -26.734 444 HZ3 LYS 58 HZ3 LYS 58 45.630 44.327 -25.285 445 H ARG 59 HN ARG 59 51.969 44.435 -23.181 446 HA ARG 59 HA ARG 59 54.205 45.431 -24.617 447 HB2 ARG 59 HB2 ARG 59 53.765 45.720 -22.146 448 HB3 ARG 59 HB1 ARG 59 54.264 44.041 -21.934 449 HG2 ARG 59 HG2 ARG 59 56.110 45.694 -23.548 450 HG3 ARG 59 HG1 ARG 59 55.984 46.159 -21.851 451 HD2 ARG 59 HD2 ARG 59 56.428 43.808 -21.193 452 HD3 ARG 59 HD1 ARG 59 56.609 43.381 -22.892 453 HE ARG 59 HE ARG 59 58.358 45.512 -22.314 454 HH11 ARG 59 HH11 ARG 59 57.884 42.142 -21.553 455 HH12 ARG 59 HH12 ARG 59 59.568 41.840 -21.302 456 HH21 ARG 59 HH21 ARG 59 60.552 45.088 -21.982 457 HH22 ARG 59 HH22 ARG 59 61.071 43.495 -21.543 458 H GLU 60 HN GLU 60 53.229 42.193 -23.604 459 HA GLU 60 HA GLU 60 55.540 41.107 -25.101 460 HB2 GLU 60 HB2 GLU 60 55.558 40.682 -22.623 461 HB3 GLU 60 HB1 GLU 60 54.072 39.755 -22.831 462 HG2 GLU 60 HG2 GLU 60 55.222 38.263 -24.423 463 HG3 GLU 60 HG1 GLU 60 56.708 39.188 -24.219 464 HA PRO 61 HA PRO 61 51.618 39.766 -27.200 465 HB2 PRO 61 HB2 PRO 61 52.468 40.324 -29.738 466 HB3 PRO 61 HB1 PRO 61 51.681 41.520 -28.690 467 HG2 PRO 61 HG2 PRO 61 54.566 41.156 -29.313 468 HG3 PRO 61 HG1 PRO 61 53.633 42.648 -29.107 469 HD2 PRO 61 HD2 PRO 61 55.269 41.614 -27.157 470 HD3 PRO 61 HD1 PRO 61 53.848 42.623 -26.809 471 H LEU 62 HN LEU 62 54.843 38.801 -27.081 472 HA LEU 62 HA LEU 62 55.087 36.893 -29.105 473 HB2 LEU 62 HB2 LEU 62 56.940 37.632 -27.623 474 HB3 LEU 62 HB1 LEU 62 56.203 36.739 -26.294 475 HG LEU 62 HG LEU 62 56.339 34.662 -27.719 476 HD11 LEU 62 HD11 LEU 62 56.488 35.564 -29.926 477 HD12 LEU 62 HD12 LEU 62 58.063 34.842 -29.600 478 HD13 LEU 62 HD13 LEU 62 57.855 36.590 -29.491 479 HD21 LEU 62 HD21 LEU 62 58.869 34.481 -27.481 480 HD22 LEU 62 HD22 LEU 62 58.008 34.964 -26.019 481 HD23 LEU 62 HD23 LEU 62 58.858 36.173 -26.981 482 H ASN 63 HN ASN 63 53.665 36.652 -25.867 483 HA ASN 63 HA ASN 63 53.178 33.888 -25.843 484 HB2 ASN 63 HB2 ASN 63 51.701 34.314 -24.030 485 HB3 ASN 63 HB1 ASN 63 52.964 35.539 -23.914 486 HD21 ASN 63 HD21 ASN 63 49.893 35.462 -23.228 487 HD22 ASN 63 HD22 ASN 63 49.328 36.916 -23.898 488 H TYR 64 HN TYR 64 51.502 36.525 -27.402 489 HA TYR 64 HA TYR 64 49.089 35.067 -27.948 490 HB2 TYR 64 HB2 TYR 64 49.200 37.554 -27.866 491 HB3 TYR 64 HB1 TYR 64 50.180 37.529 -29.331 492 HD1 TYR 64 HD1 TYR 64 46.867 36.552 -27.933 493 HD2 TYR 64 HD2 TYR 64 49.186 37.282 -31.474 494 HE1 TYR 64 HE1 TYR 64 44.809 36.412 -29.309 495 HE2 TYR 64 HE2 TYR 64 47.128 37.142 -32.851 496 HH TYR 64 HH TYR 64 44.422 35.769 -31.974 497 H LEU 65 HN LEU 65 52.077 35.760 -29.684 498 HA LEU 65 HA LEU 65 51.261 34.585 -32.155 499 HB2 LEU 65 HB2 LEU 65 54.018 35.172 -31.047 500 HB3 LEU 65 HB1 LEU 65 53.686 34.692 -32.710 501 HG LEU 65 HG LEU 65 52.425 37.110 -31.394 502 HD11 LEU 65 HD11 LEU 65 54.062 38.387 -32.842 503 HD12 LEU 65 HD12 LEU 65 54.904 36.863 -33.119 504 HD13 LEU 65 HD13 LEU 65 54.798 37.528 -31.489 505 HD21 LEU 65 HD21 LEU 65 52.104 37.701 -33.863 506 HD22 LEU 65 HD22 LEU 65 51.129 36.361 -33.265 507 HD23 LEU 65 HD23 LEU 65 52.573 36.040 -34.224 508 HA PRO 66 HA PRO 66 51.769 30.252 -31.570 509 HB2 PRO 66 HB2 PRO 66 53.806 30.238 -33.751 510 HB3 PRO 66 HB1 PRO 66 52.317 29.287 -33.590 511 HG2 PRO 66 HG2 PRO 66 52.478 31.332 -35.282 512 HG3 PRO 66 HG1 PRO 66 50.988 30.979 -34.390 513 HD2 PRO 66 HD2 PRO 66 52.980 33.160 -33.940 514 HD3 PRO 66 HD1 PRO 66 51.222 33.160 -33.673 515 H LEU 67 HN LEU 67 52.997 28.937 -30.292 516 HA LEU 67 HA LEU 67 55.881 29.270 -30.122 517 HB2 LEU 67 HB2 LEU 67 54.064 30.455 -28.175 518 HB3 LEU 67 HB1 LEU 67 55.191 29.319 -27.432 519 HG LEU 67 HG LEU 67 56.104 31.439 -29.382 520 HD11 LEU 67 HD11 LEU 67 55.765 31.590 -26.378 521 HD12 LEU 67 HD12 LEU 67 55.101 32.682 -27.593 522 HD13 LEU 67 HD13 LEU 67 56.835 32.667 -27.274 523 HD21 LEU 67 HD21 LEU 67 57.553 29.436 -28.852 524 HD22 LEU 67 HD22 LEU 67 57.571 29.971 -27.171 525 HD23 LEU 67 HD23 LEU 67 58.280 30.986 -28.427 Start of MODEL 7 1 H1 THR 1 HT1 THR 1 -3.159 -6.099 -0.703 2 H2 THR 1 HT2 THR 1 -3.524 -4.440 -0.668 3 H3 THR 1 HT3 THR 1 -3.296 -5.294 0.784 4 HA THR 1 HA THR 1 -0.975 -5.734 0.110 5 HB THR 1 HB THR 1 -1.945 -4.834 -2.354 6 HG1 THR 1 HG1 THR 1 0.336 -5.037 -2.887 7 HG21 THR 1 HG21 THR 1 -0.627 -2.874 -2.905 8 HG22 THR 1 HG22 THR 1 0.078 -2.841 -1.291 9 HG23 THR 1 HG23 THR 1 -1.639 -2.492 -1.514 10 HA PRO 2 HA PRO 2 -0.303 -2.305 2.799 11 HB2 PRO 2 HB2 PRO 2 2.369 -1.839 2.530 12 HB3 PRO 2 HB1 PRO 2 1.717 -3.271 3.349 13 HG2 PRO 2 HG2 PRO 2 2.831 -3.003 0.606 14 HG3 PRO 2 HG1 PRO 2 2.994 -4.329 1.769 15 HD2 PRO 2 HD2 PRO 2 1.251 -4.372 -0.367 16 HD3 PRO 2 HD1 PRO 2 1.015 -5.313 1.121 17 H ILE 3 HN ILE 3 0.048 -0.031 2.923 18 HA ILE 3 HA ILE 3 -0.646 1.456 0.651 19 HB ILE 3 HB ILE 3 -0.928 2.193 3.028 20 HG12 ILE 3 HG12 ILE 3 -0.193 4.593 2.550 21 HG13 ILE 3 HG11 ILE 3 0.503 3.982 1.048 22 HG21 ILE 3 HG21 ILE 3 1.408 1.506 3.702 23 HG22 ILE 3 HG22 ILE 3 0.952 3.129 4.219 24 HG23 ILE 3 HG23 ILE 3 2.008 2.912 2.823 25 HD11 ILE 3 HD11 ILE 3 -2.381 3.492 1.817 26 HD12 ILE 3 HD12 ILE 3 -1.629 3.268 0.238 27 HD13 ILE 3 HD13 ILE 3 -1.875 4.894 0.875 28 H GLU 4 HN GLU 4 0.494 2.437 -0.929 29 HA GLU 4 HA GLU 4 3.217 1.681 -1.361 30 HB2 GLU 4 HB2 GLU 4 3.060 3.022 -3.385 31 HB3 GLU 4 HB1 GLU 4 1.588 2.068 -3.200 32 HG2 GLU 4 HG2 GLU 4 0.475 4.035 -2.161 33 HG3 GLU 4 HG1 GLU 4 1.933 4.984 -2.447 34 H SER 5 HN SER 5 4.992 3.201 -1.712 35 HA SER 5 HA SER 5 5.406 4.902 0.505 36 HB2 SER 5 HB2 SER 5 6.874 4.746 -2.136 37 HB3 SER 5 HB1 SER 5 7.442 5.629 -0.722 38 HG SER 5 HG SER 5 7.441 2.938 -1.256 39 H HIS 6 HN HIS 6 5.415 7.135 0.698 40 HA HIS 6 HA HIS 6 3.668 8.535 -1.182 41 HB2 HIS 6 HB2 HIS 6 3.404 10.178 0.500 42 HB3 HIS 6 HB1 HIS 6 3.434 8.641 1.365 43 HD1 HIS 6 HD1 HIS 6 5.372 11.788 0.855 44 HD2 HIS 6 HD2 HIS 6 5.863 8.152 2.834 45 HE1 HIS 6 HE1 HIS 6 7.356 12.077 2.403 46 HE2 HIS 6 HE2 HIS 6 7.668 9.869 3.617 47 H GLN 7 HN GLN 7 6.610 7.806 -1.667 48 HA GLN 7 HA GLN 7 8.133 10.190 -1.674 49 HB2 GLN 7 HB2 GLN 7 9.153 7.966 -1.899 50 HB3 GLN 7 HB1 GLN 7 8.363 7.756 -3.462 51 HG2 GLN 7 HG2 GLN 7 9.568 9.715 -4.344 52 HG3 GLN 7 HG1 GLN 7 10.348 9.945 -2.780 53 HE21 GLN 7 HE21 GLN 7 12.456 9.172 -2.856 54 HE22 GLN 7 HE22 GLN 7 12.951 7.773 -3.680 55 H VAL 8 HN VAL 8 8.219 11.865 -3.057 56 HA VAL 8 HA VAL 8 6.784 11.650 -5.625 57 HB VAL 8 HB VAL 8 5.300 12.777 -4.013 58 HG11 VAL 8 HG11 VAL 8 7.235 13.651 -2.612 59 HG12 VAL 8 HG12 VAL 8 5.945 14.815 -2.919 60 HG13 VAL 8 HG13 VAL 8 7.449 14.904 -3.836 61 HG21 VAL 8 HG21 VAL 8 5.357 13.461 -6.420 62 HG22 VAL 8 HG22 VAL 8 6.524 14.715 -6.003 63 HG23 VAL 8 HG23 VAL 8 4.888 14.781 -5.348 64 H GLU 9 HN GLU 9 7.655 12.829 -7.308 65 HA GLU 9 HA GLU 9 10.001 14.510 -6.754 66 HB2 GLU 9 HB2 GLU 9 10.981 13.272 -8.889 67 HB3 GLU 9 HB1 GLU 9 11.234 12.634 -7.265 68 HG2 GLU 9 HG2 GLU 9 10.454 10.906 -8.910 69 HG3 GLU 9 HG1 GLU 9 9.386 11.086 -7.521 70 H LYS 10 HN LYS 10 10.757 15.566 -8.865 71 HA LYS 10 HA LYS 10 8.509 16.060 -10.702 72 HB2 LYS 10 HB2 LYS 10 9.205 18.536 -10.596 73 HB3 LYS 10 HB1 LYS 10 8.267 17.900 -9.245 74 HG2 LYS 10 HG2 LYS 10 11.201 17.598 -8.995 75 HG3 LYS 10 HG1 LYS 10 10.607 19.258 -8.943 76 HD2 LYS 10 HD2 LYS 10 8.975 18.588 -7.185 77 HD3 LYS 10 HD1 LYS 10 9.669 16.966 -7.194 78 HE2 LYS 10 HE2 LYS 10 11.863 17.891 -6.563 79 HE3 LYS 10 HE1 LYS 10 11.182 19.518 -6.565 80 HZ1 LYS 10 HZ1 LYS 10 10.078 17.340 -4.892 81 HZ2 LYS 10 HZ2 LYS 10 9.806 19.012 -4.754 82 HZ3 LYS 10 HZ3 LYS 10 11.320 18.358 -4.346 83 H ARG 11 HN ARG 11 9.233 17.279 -12.660 84 HA ARG 11 HA ARG 11 12.086 17.017 -13.247 85 HB2 ARG 11 HB2 ARG 11 11.235 16.057 -15.580 86 HB3 ARG 11 HB1 ARG 11 11.616 15.001 -14.228 87 HG2 ARG 11 HG2 ARG 11 9.521 14.238 -15.042 88 HG3 ARG 11 HG1 ARG 11 9.114 15.157 -13.603 89 HD2 ARG 11 HD2 ARG 11 9.180 16.527 -16.276 90 HD3 ARG 11 HD1 ARG 11 7.784 15.554 -15.833 91 HE ARG 11 HE ARG 11 8.521 18.118 -14.718 92 HH11 ARG 11 HH11 ARG 11 6.789 15.132 -14.217 93 HH12 ARG 11 HH12 ARG 11 5.698 15.821 -13.066 94 HH21 ARG 11 HH21 ARG 11 7.082 18.990 -13.210 95 HH22 ARG 11 HH22 ARG 11 5.860 17.990 -12.497 96 H LYS 12 HN LYS 12 11.388 19.396 -12.869 97 HA LYS 12 HA LYS 12 10.060 20.687 -15.081 98 HB2 LYS 12 HB2 LYS 12 10.606 22.762 -13.920 99 HB3 LYS 12 HB1 LYS 12 9.965 21.587 -12.770 100 HG2 LYS 12 HG2 LYS 12 12.283 20.973 -12.130 101 HG3 LYS 12 HG1 LYS 12 12.899 22.198 -13.239 102 HD2 LYS 12 HD2 LYS 12 11.743 23.956 -11.983 103 HD3 LYS 12 HD1 LYS 12 11.050 22.749 -10.899 104 HE2 LYS 12 HE2 LYS 12 13.015 23.771 -9.852 105 HE3 LYS 12 HE1 LYS 12 13.343 22.077 -10.217 106 HZ1 LYS 12 HZ1 LYS 12 15.133 23.674 -10.864 107 HZ2 LYS 12 HZ2 LYS 12 14.074 24.301 -12.036 108 HZ3 LYS 12 HZ3 LYS 12 14.578 22.680 -12.122 109 H CYS 13 HN CYS 13 11.028 22.142 -16.562 110 HA CYS 13 HA CYS 13 13.447 21.235 -17.706 111 HB2 CYS 13 HB2 CYS 13 11.514 22.553 -18.807 112 HB3 CYS 13 HB1 CYS 13 12.331 23.988 -18.185 113 H ASN 14 HN ASN 14 15.270 21.331 -16.537 114 HA ASN 14 HA ASN 14 15.989 23.912 -15.281 115 HB2 ASN 14 HB2 ASN 14 17.541 22.584 -13.881 116 HB3 ASN 14 HB1 ASN 14 15.862 22.093 -13.673 117 HD21 ASN 14 HD21 ASN 14 15.922 19.852 -13.369 118 HD22 ASN 14 HD22 ASN 14 16.773 18.769 -14.362 119 H THR 15 HN THR 15 16.484 22.457 -18.118 120 HA THR 15 HA THR 15 19.339 22.434 -18.307 121 HB THR 15 HB THR 15 17.738 21.156 -19.799 122 HG1 THR 15 HG1 THR 15 19.766 21.232 -20.534 123 HG21 THR 15 HG21 THR 15 17.507 23.777 -21.278 124 HG22 THR 15 HG22 THR 15 16.273 23.232 -20.144 125 HG23 THR 15 HG23 THR 15 16.633 22.277 -21.581 126 H ALA 16 HN ALA 16 20.451 23.837 -19.977 127 HA ALA 16 HA ALA 16 20.254 26.556 -19.179 128 HB1 ALA 16 HB1 ALA 16 22.404 25.937 -19.840 129 HB2 ALA 16 HB2 ALA 16 21.833 26.847 -21.239 130 HB3 ALA 16 HB3 ALA 16 21.826 25.083 -21.270 131 H THR 17 HN THR 17 19.155 24.789 -22.029 132 HA THR 17 HA THR 17 18.445 26.868 -23.709 133 HB THR 17 HB THR 17 16.943 24.280 -23.242 134 HG1 THR 17 HG1 THR 17 19.007 25.049 -25.025 135 HG21 THR 17 HG21 THR 17 16.844 26.346 -25.447 136 HG22 THR 17 HG22 THR 17 15.508 25.757 -24.458 137 HG23 THR 17 HG23 THR 17 16.253 24.697 -25.656 138 H CYS 18 HN CYS 18 16.427 25.385 -21.160 139 HA CYS 18 HA CYS 18 14.246 27.176 -21.514 140 HB2 CYS 18 HB2 CYS 18 15.060 25.331 -19.272 141 HB3 CYS 18 HB1 CYS 18 13.624 26.350 -19.173 142 H ALA 19 HN ALA 19 17.116 27.197 -19.464 143 HA ALA 19 HA ALA 19 16.426 29.295 -17.739 144 HB1 ALA 19 HB1 ALA 19 19.028 28.217 -18.771 145 HB2 ALA 19 HB2 ALA 19 18.376 28.177 -17.133 146 HB3 ALA 19 HB3 ALA 19 19.010 29.685 -17.793 147 H THR 20 HN THR 20 18.062 29.392 -20.906 148 HA THR 20 HA THR 20 18.518 32.138 -21.038 149 HB THR 20 HB THR 20 17.824 30.248 -23.300 150 HG1 THR 20 HG1 THR 20 19.660 29.461 -22.623 151 HG21 THR 20 HG21 THR 20 19.058 33.008 -23.222 152 HG22 THR 20 HG22 THR 20 17.611 32.498 -24.092 153 HG23 THR 20 HG23 THR 20 19.198 31.935 -24.614 154 H GLN 21 HN GLN 21 15.574 30.303 -21.588 155 HA GLN 21 HA GLN 21 14.100 32.336 -22.892 156 HB2 GLN 21 HB2 GLN 21 12.460 30.795 -22.926 157 HB3 GLN 21 HB1 GLN 21 13.639 29.703 -22.205 158 HG2 GLN 21 HG2 GLN 21 12.880 30.524 -19.936 159 HG3 GLN 21 HG1 GLN 21 11.582 31.392 -20.755 160 HE21 GLN 21 HE21 GLN 21 11.254 29.139 -18.862 161 HE22 GLN 21 HE22 GLN 21 10.476 27.904 -19.729 162 H ARG 22 HN ARG 22 14.865 31.762 -19.526 163 HA ARG 22 HA ARG 22 12.849 33.517 -18.484 164 HB2 ARG 22 HB2 ARG 22 13.645 32.970 -16.403 165 HB3 ARG 22 HB1 ARG 22 14.264 31.600 -17.315 166 HG2 ARG 22 HG2 ARG 22 16.203 32.214 -16.243 167 HG3 ARG 22 HG1 ARG 22 16.351 33.262 -17.646 168 HD2 ARG 22 HD2 ARG 22 16.408 35.018 -16.238 169 HD3 ARG 22 HD1 ARG 22 14.730 34.675 -15.831 170 HE ARG 22 HE ARG 22 15.451 33.764 -13.818 171 HH11 ARG 22 HH11 ARG 22 18.141 34.157 -16.004 172 HH12 ARG 22 HH12 ARG 22 19.325 33.780 -14.803 173 HH21 ARG 22 HH21 ARG 22 17.021 33.277 -12.269 174 HH22 ARG 22 HH22 ARG 22 18.699 33.284 -12.701 175 H LEU 23 HN LEU 23 15.993 33.949 -19.854 176 HA LEU 23 HA LEU 23 16.556 36.493 -18.663 177 HB2 LEU 23 HB2 LEU 23 18.301 35.000 -19.636 178 HB3 LEU 23 HB1 LEU 23 17.635 35.320 -21.237 179 HG LEU 23 HG LEU 23 17.994 37.781 -20.802 180 HD11 LEU 23 HD11 LEU 23 18.112 37.876 -18.419 181 HD12 LEU 23 HD12 LEU 23 19.744 38.228 -18.984 182 HD13 LEU 23 HD13 LEU 23 19.354 36.626 -18.358 183 HD21 LEU 23 HD21 LEU 23 20.391 37.690 -21.279 184 HD22 LEU 23 HD22 LEU 23 19.580 36.369 -22.120 185 HD23 LEU 23 HD23 LEU 23 20.482 36.049 -20.639 186 H ALA 24 HN ALA 24 14.922 35.383 -21.574 187 HA ALA 24 HA ALA 24 14.748 37.856 -22.921 188 HB1 ALA 24 HB1 ALA 24 13.207 35.287 -23.009 189 HB2 ALA 24 HB2 ALA 24 14.179 36.052 -24.267 190 HB3 ALA 24 HB3 ALA 24 12.587 36.697 -23.868 191 H ASN 25 HN ASN 25 12.697 36.331 -20.470 192 HA ASN 25 HA ASN 25 10.607 38.260 -20.564 193 HB2 ASN 25 HB2 ASN 25 10.527 35.932 -19.522 194 HB3 ASN 25 HB1 ASN 25 11.390 36.626 -18.151 195 HD21 ASN 25 HD21 ASN 25 9.692 36.634 -16.599 196 HD22 ASN 25 HD22 ASN 25 8.246 37.498 -16.807 197 H PHE 26 HN PHE 26 13.690 38.097 -18.923 198 HA PHE 26 HA PHE 26 13.216 40.173 -17.028 199 HB2 PHE 26 HB2 PHE 26 15.036 38.507 -16.806 200 HB3 PHE 26 HB1 PHE 26 15.842 39.228 -18.199 201 HD1 PHE 26 HD1 PHE 26 14.606 39.940 -14.757 202 HD2 PHE 26 HD2 PHE 26 17.149 41.202 -17.981 203 HE1 PHE 26 HE1 PHE 26 15.632 41.647 -13.279 204 HE2 PHE 26 HE2 PHE 26 18.175 42.909 -16.503 205 HZ PHE 26 HZ PHE 26 17.416 43.132 -14.152 206 H LEU 27 HN LEU 27 14.458 40.118 -20.334 207 HA LEU 27 HA LEU 27 15.405 42.759 -20.436 208 HB2 LEU 27 HB2 LEU 27 15.908 41.025 -22.140 209 HB3 LEU 27 HB1 LEU 27 14.230 41.047 -22.655 210 HG LEU 27 HG LEU 27 15.981 42.379 -24.030 211 HD11 LEU 27 HD11 LEU 27 13.612 44.056 -23.242 212 HD12 LEU 27 HD12 LEU 27 13.377 42.511 -24.059 213 HD13 LEU 27 HD13 LEU 27 14.310 43.788 -24.837 214 HD21 LEU 27 HD21 LEU 27 16.819 43.518 -21.845 215 HD22 LEU 27 HD22 LEU 27 15.421 44.571 -22.040 216 HD23 LEU 27 HD23 LEU 27 16.653 44.503 -23.296 217 H VAL 28 HN VAL 28 12.183 41.409 -20.981 218 HA VAL 28 HA VAL 28 11.099 44.041 -21.636 219 HB VAL 28 HB VAL 28 8.971 42.882 -21.910 220 HG11 VAL 28 HG11 VAL 28 10.796 42.776 -23.687 221 HG12 VAL 28 HG12 VAL 28 9.562 41.521 -23.787 222 HG13 VAL 28 HG13 VAL 28 11.144 41.148 -23.104 223 HG21 VAL 28 HG21 VAL 28 10.464 40.427 -20.930 224 HG22 VAL 28 HG22 VAL 28 8.798 40.461 -21.506 225 HG23 VAL 28 HG23 VAL 28 9.232 41.299 -20.017 226 H HIS 29 HN HIS 29 11.308 41.865 -18.908 227 HA HIS 29 HA HIS 29 9.307 43.027 -17.293 228 HB2 HIS 29 HB2 HIS 29 10.365 40.842 -16.820 229 HB3 HIS 29 HB1 HIS 29 11.871 41.672 -16.428 230 HD1 HIS 29 HD1 HIS 29 8.219 41.710 -15.315 231 HD2 HIS 29 HD2 HIS 29 12.024 42.443 -13.778 232 HE1 HIS 29 HE1 HIS 29 7.914 42.192 -12.848 233 HE2 HIS 29 HE2 HIS 29 10.225 42.641 -11.896 234 H SER 30 HN SER 30 12.523 44.006 -18.112 235 HA SER 30 HA SER 30 12.316 46.226 -16.173 236 HB2 SER 30 HB2 SER 30 14.196 44.649 -15.716 237 HB3 SER 30 HB1 SER 30 14.875 45.058 -17.289 238 HG SER 30 HG SER 30 14.848 47.276 -16.545 239 H SER 31 HN SER 31 11.758 45.709 -19.283 240 HA SER 31 HA SER 31 13.387 47.567 -20.662 241 HB2 SER 31 HB2 SER 31 12.068 45.889 -21.856 242 HB3 SER 31 HB1 SER 31 10.575 46.620 -21.274 243 HG SER 31 HG SER 31 12.529 47.735 -23.003 244 H ASN 32 HN ASN 32 10.310 47.939 -18.932 245 HA ASN 32 HA ASN 32 9.697 50.542 -19.748 246 HB2 ASN 32 HB2 ASN 32 8.470 50.695 -17.575 247 HB3 ASN 32 HB1 ASN 32 8.099 49.235 -18.490 248 HD21 ASN 32 HD21 ASN 32 8.749 50.233 -15.396 249 HD22 ASN 32 HD22 ASN 32 9.439 48.809 -14.780 250 H ASN 33 HN ASN 33 11.785 49.363 -17.167 251 HA ASN 33 HA ASN 33 12.375 51.863 -15.997 252 HB2 ASN 33 HB2 ASN 33 13.923 49.271 -16.096 253 HB3 ASN 33 HB1 ASN 33 14.489 50.680 -15.202 254 HD21 ASN 33 HD21 ASN 33 13.784 48.220 -13.881 255 HD22 ASN 33 HD22 ASN 33 12.407 48.513 -12.932 256 H PHE 34 HN PHE 34 13.953 50.005 -18.544 257 HA PHE 34 HA PHE 34 16.178 51.601 -19.044 258 HB2 PHE 34 HB2 PHE 34 15.811 49.429 -20.139 259 HB3 PHE 34 HB1 PHE 34 14.482 50.121 -21.070 260 HD1 PHE 34 HD1 PHE 34 18.142 50.402 -20.421 261 HD2 PHE 34 HD2 PHE 34 14.885 51.369 -23.049 262 HE1 PHE 34 HE1 PHE 34 19.754 51.225 -22.116 263 HE2 PHE 34 HE2 PHE 34 16.497 52.192 -24.744 264 HZ PHE 34 HZ PHE 34 18.931 52.120 -24.278 265 H GLY 35 HN GLY 35 12.836 52.029 -20.077 266 HA2 GLY 35 HA2 GLY 35 13.254 54.139 -21.918 267 HA3 GLY 35 HA1 GLY 35 11.751 53.807 -21.054 268 H ALA 36 HN ALA 36 12.127 54.330 -18.516 269 HA ALA 36 HA ALA 36 12.275 57.117 -18.302 270 HB1 ALA 36 HB1 ALA 36 11.918 56.820 -16.024 271 HB2 ALA 36 HB2 ALA 36 12.899 55.356 -15.958 272 HB3 ALA 36 HB3 ALA 36 11.292 55.308 -16.681 273 H ILE 37 HN ILE 37 14.727 54.632 -17.877 274 HA ILE 37 HA ILE 37 16.733 56.180 -16.664 275 HB ILE 37 HB ILE 37 16.828 53.747 -18.440 276 HG12 ILE 37 HG12 ILE 37 17.553 54.112 -15.521 277 HG13 ILE 37 HG11 ILE 37 15.930 53.675 -16.053 278 HG21 ILE 37 HG21 ILE 37 19.244 53.607 -17.625 279 HG22 ILE 37 HG22 ILE 37 19.090 55.303 -17.167 280 HG23 ILE 37 HG23 ILE 37 18.922 54.827 -18.857 281 HD11 ILE 37 HD11 ILE 37 18.379 52.108 -16.885 282 HD12 ILE 37 HD12 ILE 37 16.688 51.622 -17.006 283 HD13 ILE 37 HD13 ILE 37 17.464 51.728 -15.426 284 H LEU 38 HN LEU 38 15.739 55.817 -20.009 285 HA LEU 38 HA LEU 38 17.995 57.159 -21.160 286 HB2 LEU 38 HB2 LEU 38 16.582 55.582 -22.444 287 HB3 LEU 38 HB1 LEU 38 15.227 56.701 -22.302 288 HG LEU 38 HG LEU 38 16.613 58.444 -23.455 289 HD11 LEU 38 HD11 LEU 38 18.844 57.715 -22.999 290 HD12 LEU 38 HD12 LEU 38 18.615 57.504 -24.734 291 HD13 LEU 38 HD13 LEU 38 18.528 56.110 -23.657 292 HD21 LEU 38 HD21 LEU 38 15.039 57.209 -24.795 293 HD22 LEU 38 HD22 LEU 38 16.108 55.807 -24.860 294 HD23 LEU 38 HD23 LEU 38 16.543 57.288 -25.714 295 H SER 39 HN SER 39 14.850 58.180 -19.947 296 HA SER 39 HA SER 39 14.914 60.798 -21.064 297 HB2 SER 39 HB2 SER 39 12.833 59.779 -20.250 298 HB3 SER 39 HB1 SER 39 13.474 59.759 -18.610 299 HG SER 39 HG SER 39 12.778 61.960 -20.240 300 H SER 40 HN SER 40 15.965 59.431 -17.971 301 HA SER 40 HA SER 40 17.066 62.045 -17.188 302 HB2 SER 40 HB2 SER 40 16.599 59.486 -15.650 303 HB3 SER 40 HB1 SER 40 17.462 60.870 -14.986 304 HG SER 40 HG SER 40 14.778 60.498 -15.455 305 H THR 41 HN THR 41 18.294 60.568 -19.324 306 HA THR 41 HA THR 41 20.499 59.022 -18.558 307 HB THR 41 HB THR 41 19.736 59.231 -20.889 308 HG1 THR 41 HG1 THR 41 21.737 58.585 -21.033 309 HG21 THR 41 HG21 THR 41 20.296 61.274 -22.162 310 HG22 THR 41 HG22 THR 41 20.881 62.030 -20.680 311 HG23 THR 41 HG23 THR 41 19.173 61.625 -20.848 312 H ASN 42 HN ASN 42 19.956 62.443 -18.353 313 HA ASN 42 HA ASN 42 22.642 63.328 -18.267 314 HB2 ASN 42 HB2 ASN 42 21.754 65.359 -17.283 315 HB3 ASN 42 HB1 ASN 42 20.676 64.818 -18.569 316 HD21 ASN 42 HD21 ASN 42 19.694 66.506 -16.504 317 HD22 ASN 42 HD22 ASN 42 18.614 65.618 -15.542 318 H VAL 43 HN VAL 43 20.843 61.459 -16.047 319 HA VAL 43 HA VAL 43 21.744 62.281 -13.560 320 HB VAL 43 HB VAL 43 20.096 60.436 -14.035 321 HG11 VAL 43 HG11 VAL 43 22.587 58.739 -14.335 322 HG12 VAL 43 HG12 VAL 43 21.631 59.300 -15.707 323 HG13 VAL 43 HG13 VAL 43 20.910 58.223 -14.511 324 HG21 VAL 43 HG21 VAL 43 22.375 59.672 -12.185 325 HG22 VAL 43 HG22 VAL 43 20.689 59.175 -12.043 326 HG23 VAL 43 HG23 VAL 43 21.135 60.861 -11.787 327 H GLY 44 HN GLY 44 23.505 60.772 -16.141 328 HA2 GLY 44 HA2 GLY 44 25.982 61.245 -15.897 329 HA3 GLY 44 HA1 GLY 44 25.835 60.409 -14.355 330 H SER 45 HN SER 45 23.732 58.705 -16.054 331 HA SER 45 HA SER 45 25.718 56.682 -16.774 332 HB2 SER 45 HB2 SER 45 23.807 55.161 -16.903 333 HB3 SER 45 HB1 SER 45 23.787 56.035 -15.374 334 HG SER 45 HG SER 45 22.142 56.288 -17.629 335 H ASN 46 HN ASN 46 25.413 59.062 -18.428 336 HA ASN 46 HA ASN 46 24.097 58.068 -20.850 337 HB2 ASN 46 HB2 ASN 46 24.418 60.292 -21.732 338 HB3 ASN 46 HB1 ASN 46 23.775 60.434 -20.097 339 HD21 ASN 46 HD21 ASN 46 25.177 62.622 -21.154 340 HD22 ASN 46 HD22 ASN 46 26.679 62.764 -20.377 341 H THR 47 HN THR 47 26.603 56.889 -19.747 342 HA THR 47 HA THR 47 28.644 57.662 -21.681 343 HB THR 47 HB THR 47 28.945 55.296 -19.886 344 HG1 THR 47 HG1 THR 47 28.853 58.012 -19.099 345 HG21 THR 47 HG21 THR 47 30.789 55.900 -21.337 346 HG22 THR 47 HG22 THR 47 31.228 56.317 -19.681 347 HG23 THR 47 HG23 THR 47 30.713 57.578 -20.800 348 H TYR 48 HN TYR 48 26.025 56.259 -22.414 349 HA TYR 48 HA TYR 48 27.282 54.068 -23.945 350 HB2 TYR 48 HB2 TYR 48 25.309 52.716 -23.680 351 HB3 TYR 48 HB1 TYR 48 25.822 53.234 -22.075 352 HD1 TYR 48 HD1 TYR 48 23.161 53.271 -24.509 353 HD2 TYR 48 HD2 TYR 48 24.697 55.280 -21.036 354 HE1 TYR 48 HE1 TYR 48 20.946 54.324 -24.139 355 HE2 TYR 48 HE2 TYR 48 22.482 56.333 -20.667 356 HH TYR 48 HH TYR 48 20.173 55.998 -21.227 357 H GLY 49 HN GLY 49 26.624 56.946 -24.541 358 HA2 GLY 49 HA2 GLY 49 24.387 57.158 -26.225 359 HA3 GLY 49 HA1 GLY 49 25.826 58.168 -26.318 360 H LYS 50 HN LYS 50 24.158 57.024 -28.468 361 HA LYS 50 HA LYS 50 25.462 54.867 -29.742 362 HB2 LYS 50 HB2 LYS 50 23.744 57.106 -30.820 363 HB3 LYS 50 HB1 LYS 50 24.324 55.768 -31.812 364 HG2 LYS 50 HG2 LYS 50 23.272 54.181 -30.171 365 HG3 LYS 50 HG1 LYS 50 22.564 55.574 -29.354 366 HD2 LYS 50 HD2 LYS 50 22.166 55.099 -32.310 367 HD3 LYS 50 HD1 LYS 50 21.096 54.384 -31.104 368 HE2 LYS 50 HE2 LYS 50 21.697 57.348 -31.199 369 HE3 LYS 50 HE1 LYS 50 20.335 56.623 -32.052 370 HZ1 LYS 50 HZ1 LYS 50 20.659 55.936 -29.234 371 HZ2 LYS 50 HZ2 LYS 50 19.242 56.186 -30.138 372 HZ3 LYS 50 HZ3 LYS 50 20.145 57.514 -29.584 373 H ARG 51 HN ARG 51 25.979 58.355 -29.841 374 HA ARG 51 HA ARG 51 27.635 58.632 -32.025 375 HB2 ARG 51 HB2 ARG 51 28.592 60.566 -30.923 376 HB3 ARG 51 HB1 ARG 51 26.870 60.489 -30.559 377 HG2 ARG 51 HG2 ARG 51 27.368 59.437 -28.384 378 HG3 ARG 51 HG1 ARG 51 29.093 59.504 -28.745 379 HD2 ARG 51 HD2 ARG 51 28.628 61.400 -27.373 380 HD3 ARG 51 HD1 ARG 51 28.828 62.016 -29.006 381 HE ARG 51 HE ARG 51 26.324 61.853 -27.489 382 HH11 ARG 51 HH11 ARG 51 27.917 62.534 -30.527 383 HH12 ARG 51 HH12 ARG 51 26.597 63.466 -31.136 384 HH21 ARG 51 HH21 ARG 51 24.633 63.086 -28.316 385 HH22 ARG 51 HH22 ARG 51 24.752 63.775 -29.901 386 H ASN 52 HN ASN 52 28.361 57.186 -28.919 387 HA ASN 52 HA ASN 52 31.175 57.151 -29.118 388 HB2 ASN 52 HB2 ASN 52 29.840 56.657 -27.053 389 HB3 ASN 52 HB1 ASN 52 29.433 55.092 -27.754 390 HD21 ASN 52 HD21 ASN 52 30.971 53.424 -27.539 391 HD22 ASN 52 HD22 ASN 52 32.532 53.650 -26.913 392 H ALA 53 HN ALA 53 28.695 54.828 -30.115 393 HA ALA 53 HA ALA 53 30.448 52.805 -31.022 394 HB1 ALA 53 HB1 ALA 53 28.344 52.210 -32.458 395 HB2 ALA 53 HB2 ALA 53 27.565 53.471 -31.501 396 HB3 ALA 53 HB3 ALA 53 28.269 52.065 -30.702 397 H VAL 54 HN VAL 54 28.858 55.496 -32.726 398 HA VAL 54 HA VAL 54 29.760 54.800 -35.313 399 HB VAL 54 HB VAL 54 28.048 56.672 -34.315 400 HG11 VAL 54 HG11 VAL 54 30.360 58.243 -35.477 401 HG12 VAL 54 HG12 VAL 54 30.097 58.083 -33.740 402 HG13 VAL 54 HG13 VAL 54 28.883 58.870 -34.746 403 HG21 VAL 54 HG21 VAL 54 27.705 57.292 -36.610 404 HG22 VAL 54 HG22 VAL 54 28.210 55.602 -36.615 405 HG23 VAL 54 HG23 VAL 54 29.364 56.868 -37.035 406 H GLU 55 HN GLU 55 31.383 56.256 -32.629 407 HA GLU 55 HA GLU 55 33.400 57.617 -34.134 408 HB2 GLU 55 HB2 GLU 55 32.698 57.917 -31.634 409 HB3 GLU 55 HB1 GLU 55 33.835 56.601 -31.341 410 HG2 GLU 55 HG2 GLU 55 34.610 59.014 -32.978 411 HG3 GLU 55 HG1 GLU 55 34.758 59.010 -31.222 412 H VAL 56 HN VAL 56 33.490 54.598 -32.214 413 HA VAL 56 HA VAL 56 36.047 53.787 -32.993 414 HB VAL 56 HB VAL 56 34.911 52.688 -31.160 415 HG11 VAL 56 HG11 VAL 56 32.946 51.843 -33.303 416 HG12 VAL 56 HG12 VAL 56 32.614 52.800 -31.859 417 HG13 VAL 56 HG13 VAL 56 33.019 51.091 -31.710 418 HG21 VAL 56 HG21 VAL 56 35.457 50.408 -31.685 419 HG22 VAL 56 HG22 VAL 56 36.569 51.415 -32.611 420 HG23 VAL 56 HG23 VAL 56 35.181 50.674 -33.406 421 H LEU 57 HN LEU 57 33.016 53.674 -34.684 422 HA LEU 57 HA LEU 57 33.517 51.683 -36.583 423 HB2 LEU 57 HB2 LEU 57 31.683 53.931 -36.298 424 HB3 LEU 57 HB1 LEU 57 32.139 53.652 -37.979 425 HG LEU 57 HG LEU 57 31.661 51.164 -37.510 426 HD11 LEU 57 HD11 LEU 57 31.589 51.570 -34.996 427 HD12 LEU 57 HD12 LEU 57 30.240 50.642 -35.652 428 HD13 LEU 57 HD13 LEU 57 30.026 52.346 -35.253 429 HD21 LEU 57 HD21 LEU 57 30.206 52.800 -38.808 430 HD22 LEU 57 HD22 LEU 57 29.283 53.031 -37.323 431 HD23 LEU 57 HD23 LEU 57 29.344 51.442 -38.085 432 H LYS 58 HN LYS 58 34.278 55.143 -36.625 433 HA LYS 58 HA LYS 58 35.476 55.264 -39.172 434 HB2 LYS 58 HB2 LYS 58 35.864 56.910 -36.671 435 HB3 LYS 58 HB1 LYS 58 36.672 57.282 -38.194 436 HG2 LYS 58 HG2 LYS 58 33.683 56.891 -38.073 437 HG3 LYS 58 HG1 LYS 58 34.414 58.456 -37.718 438 HD2 LYS 58 HD2 LYS 58 35.577 58.366 -39.929 439 HD3 LYS 58 HD1 LYS 58 34.711 56.872 -40.286 440 HE2 LYS 58 HE2 LYS 58 33.346 59.487 -39.593 441 HE3 LYS 58 HE1 LYS 58 33.620 58.927 -41.243 442 HZ1 LYS 58 HZ1 LYS 58 32.460 56.806 -40.445 443 HZ2 LYS 58 HZ2 LYS 58 31.501 58.174 -40.756 444 HZ3 LYS 58 HZ3 LYS 58 31.895 57.754 -39.157 445 H ARG 59 HN ARG 59 36.780 54.466 -35.988 446 HA ARG 59 HA ARG 59 39.512 54.430 -36.649 447 HB2 ARG 59 HB2 ARG 59 38.341 54.232 -34.338 448 HB3 ARG 59 HB1 ARG 59 38.301 52.503 -34.685 449 HG2 ARG 59 HG2 ARG 59 40.906 53.767 -35.225 450 HG3 ARG 59 HG1 ARG 59 40.424 53.813 -33.528 451 HD2 ARG 59 HD2 ARG 59 39.990 51.372 -33.604 452 HD3 ARG 59 HD1 ARG 59 40.534 51.341 -35.279 453 HE ARG 59 HE ARG 59 42.555 52.513 -33.706 454 HH11 ARG 59 HH11 ARG 59 40.970 49.445 -34.192 455 HH12 ARG 59 HH12 ARG 59 42.356 48.522 -33.726 456 HH21 ARG 59 HH21 ARG 59 44.350 51.281 -33.103 457 HH22 ARG 59 HH22 ARG 59 44.259 49.552 -33.114 458 H GLU 60 HN GLU 60 36.946 52.196 -37.349 459 HA GLU 60 HA GLU 60 38.924 50.295 -38.459 460 HB2 GLU 60 HB2 GLU 60 36.135 49.757 -37.414 461 HB3 GLU 60 HB1 GLU 60 37.186 48.557 -38.168 462 HG2 GLU 60 HG2 GLU 60 37.992 50.164 -35.733 463 HG3 GLU 60 HG1 GLU 60 37.234 48.576 -35.632 464 HA PRO 61 HA PRO 61 36.476 52.163 -41.949 465 HB2 PRO 61 HB2 PRO 61 38.642 52.339 -43.643 466 HB3 PRO 61 HB1 PRO 61 38.138 53.629 -42.535 467 HG2 PRO 61 HG2 PRO 61 40.315 51.626 -42.244 468 HG3 PRO 61 HG1 PRO 61 40.274 53.332 -41.765 469 HD2 PRO 61 HD2 PRO 61 39.951 51.293 -39.979 470 HD3 PRO 61 HD1 PRO 61 39.193 52.887 -39.767 471 H LEU 62 HN LEU 62 38.381 49.363 -41.435 472 HA LEU 62 HA LEU 62 38.353 48.104 -43.923 473 HB2 LEU 62 HB2 LEU 62 39.611 47.248 -41.999 474 HB3 LEU 62 HB1 LEU 62 38.104 46.869 -41.168 475 HG LEU 62 HG LEU 62 37.503 45.322 -43.027 476 HD11 LEU 62 HD11 LEU 62 38.708 46.261 -44.875 477 HD12 LEU 62 HD12 LEU 62 39.429 44.681 -44.565 478 HD13 LEU 62 HD13 LEU 62 40.243 46.146 -44.014 479 HD21 LEU 62 HD21 LEU 62 39.050 43.559 -42.394 480 HD22 LEU 62 HD22 LEU 62 38.734 44.556 -40.973 481 HD23 LEU 62 HD23 LEU 62 40.244 44.745 -41.865 482 H ASN 63 HN ASN 63 35.910 48.194 -41.357 483 HA ASN 63 HA ASN 63 34.084 46.452 -42.743 484 HB2 ASN 63 HB2 ASN 63 32.474 47.305 -40.959 485 HB3 ASN 63 HB1 ASN 63 33.903 46.452 -40.379 486 HD21 ASN 63 HD21 ASN 63 32.922 49.839 -41.183 487 HD22 ASN 63 HD22 ASN 63 33.761 50.535 -39.881 488 H TYR 64 HN TYR 64 34.793 49.836 -42.785 489 HA TYR 64 HA TYR 64 32.238 50.707 -43.762 490 HB2 TYR 64 HB2 TYR 64 33.779 52.245 -42.607 491 HB3 TYR 64 HB1 TYR 64 34.945 52.057 -43.917 492 HD1 TYR 64 HD1 TYR 64 31.484 53.200 -43.134 493 HD2 TYR 64 HD2 TYR 64 34.742 53.295 -45.933 494 HE1 TYR 64 HE1 TYR 64 30.323 54.970 -44.426 495 HE2 TYR 64 HE2 TYR 64 33.580 55.065 -47.224 496 HH TYR 64 HH TYR 64 31.283 55.888 -47.558 497 H LEU 65 HN LEU 65 35.321 49.786 -45.229 498 HA LEU 65 HA LEU 65 34.533 50.478 -47.895 499 HB2 LEU 65 HB2 LEU 65 36.760 48.716 -46.845 500 HB3 LEU 65 HB1 LEU 65 36.568 49.172 -48.537 501 HG LEU 65 HG LEU 65 36.784 51.189 -46.290 502 HD11 LEU 65 HD11 LEU 65 39.126 51.504 -47.098 503 HD12 LEU 65 HD12 LEU 65 38.924 50.096 -48.142 504 HD13 LEU 65 HD13 LEU 65 38.862 49.911 -46.389 505 HD21 LEU 65 HD21 LEU 65 37.444 52.641 -48.294 506 HD22 LEU 65 HD22 LEU 65 35.753 52.149 -48.226 507 HD23 LEU 65 HD23 LEU 65 36.868 51.324 -49.315 508 HA PRO 66 HA PRO 66 32.172 47.012 -49.236 509 HB2 PRO 66 HB2 PRO 66 34.173 46.519 -51.391 510 HB3 PRO 66 HB1 PRO 66 32.424 46.784 -51.514 511 HG2 PRO 66 HG2 PRO 66 34.167 48.676 -52.194 512 HG3 PRO 66 HG1 PRO 66 32.625 49.067 -51.412 513 HD2 PRO 66 HD2 PRO 66 35.379 49.070 -50.251 514 HD3 PRO 66 HD1 PRO 66 33.988 50.107 -49.866 515 H LEU 67 HN LEU 67 32.051 44.855 -48.763 516 HA LEU 67 HA LEU 67 34.590 43.448 -48.190 517 HB2 LEU 67 HB2 LEU 67 32.155 43.809 -46.582 518 HB3 LEU 67 HB1 LEU 67 32.719 42.140 -46.676 519 HG LEU 67 HG LEU 67 34.613 44.410 -46.067 520 HD11 LEU 67 HD11 LEU 67 32.864 42.821 -44.174 521 HD12 LEU 67 HD12 LEU 67 32.965 44.575 -44.331 522 HD13 LEU 67 HD13 LEU 67 34.317 43.671 -43.649 523 HD21 LEU 67 HD21 LEU 67 35.917 42.564 -45.055 524 HD22 LEU 67 HD22 LEU 67 35.570 42.242 -46.754 525 HD23 LEU 67 HD23 LEU 67 34.641 41.428 -45.495 Start of MODEL 8 1 H1 THR 1 HT1 THR 1 -4.123 -4.447 -1.040 2 H2 THR 1 HT2 THR 1 -2.991 -3.407 -1.764 3 H3 THR 1 HT3 THR 1 -3.945 -2.860 -0.469 4 HA THR 1 HA THR 1 -2.873 -4.749 0.854 5 HB THR 1 HB THR 1 -1.726 -5.183 -1.659 6 HG1 THR 1 HG1 THR 1 -0.251 -6.471 -0.089 7 HG21 THR 1 HG21 THR 1 0.649 -4.794 -1.382 8 HG22 THR 1 HG22 THR 1 0.397 -4.132 0.231 9 HG23 THR 1 HG23 THR 1 -0.191 -3.257 -1.185 10 HA PRO 2 HA PRO 2 -1.096 -1.165 2.708 11 HB2 PRO 2 HB2 PRO 2 0.800 -2.211 4.362 12 HB3 PRO 2 HB1 PRO 2 -0.941 -2.388 4.656 13 HG2 PRO 2 HG2 PRO 2 0.998 -4.340 3.533 14 HG3 PRO 2 HG1 PRO 2 -0.378 -4.606 4.618 15 HD2 PRO 2 HD2 PRO 2 -0.433 -5.115 1.903 16 HD3 PRO 2 HD1 PRO 2 -1.877 -4.780 2.881 17 H ILE 3 HN ILE 3 1.177 -0.171 3.329 18 HA ILE 3 HA ILE 3 2.614 0.194 0.901 19 HB ILE 3 HB ILE 3 2.379 1.919 2.699 20 HG12 ILE 3 HG12 ILE 3 4.830 2.612 2.605 21 HG13 ILE 3 HG11 ILE 3 5.144 1.085 1.780 22 HG21 ILE 3 HG21 ILE 3 2.783 0.306 4.583 23 HG22 ILE 3 HG22 ILE 3 3.773 1.763 4.680 24 HG23 ILE 3 HG23 ILE 3 4.482 0.252 4.111 25 HD11 ILE 3 HD11 ILE 3 3.057 3.050 0.811 26 HD12 ILE 3 HD12 ILE 3 3.748 1.683 -0.064 27 HD13 ILE 3 HD13 ILE 3 4.734 3.106 0.269 28 H GLU 4 HN GLU 4 4.488 -0.681 0.179 29 HA GLU 4 HA GLU 4 6.094 -2.360 1.956 30 HB2 GLU 4 HB2 GLU 4 6.016 -4.288 0.481 31 HB3 GLU 4 HB1 GLU 4 4.374 -3.868 0.971 32 HG2 GLU 4 HG2 GLU 4 4.111 -2.584 -1.154 33 HG3 GLU 4 HG1 GLU 4 5.709 -3.138 -1.651 34 H SER 5 HN SER 5 8.117 -3.084 0.866 35 HA SER 5 HA SER 5 9.484 -0.933 -0.296 36 HB2 SER 5 HB2 SER 5 10.147 -3.884 -0.390 37 HB3 SER 5 HB1 SER 5 11.263 -2.581 -0.788 38 HG SER 5 HG SER 5 11.077 -3.546 1.503 39 H HIS 6 HN HIS 6 10.252 -0.580 -2.412 40 HA HIS 6 HA HIS 6 8.407 -1.489 -4.481 41 HB2 HIS 6 HB2 HIS 6 9.524 0.201 -5.885 42 HB3 HIS 6 HB1 HIS 6 8.966 0.894 -4.362 43 HD1 HIS 6 HD1 HIS 6 12.115 -0.249 -6.110 44 HD2 HIS 6 HD2 HIS 6 11.014 1.820 -2.662 45 HE1 HIS 6 HE1 HIS 6 14.247 0.719 -5.144 46 HE2 HIS 6 HE2 HIS 6 13.593 1.983 -3.041 47 H GLN 7 HN GLN 7 10.652 -3.188 -3.232 48 HA GLN 7 HA GLN 7 12.297 -3.712 -5.599 49 HB2 GLN 7 HB2 GLN 7 13.219 -3.609 -3.205 50 HB3 GLN 7 HB1 GLN 7 12.436 -5.172 -2.965 51 HG2 GLN 7 HG2 GLN 7 13.677 -6.075 -4.914 52 HG3 GLN 7 HG1 GLN 7 14.492 -4.523 -5.097 53 HE21 GLN 7 HE21 GLN 7 16.032 -3.883 -3.390 54 HE22 GLN 7 HE22 GLN 7 16.679 -5.045 -2.336 55 H VAL 8 HN VAL 8 10.761 -4.633 -6.991 56 HA VAL 8 HA VAL 8 10.050 -7.405 -6.305 57 HB VAL 8 HB VAL 8 8.082 -5.865 -5.915 58 HG11 VAL 8 HG11 VAL 8 8.691 -4.379 -7.885 59 HG12 VAL 8 HG12 VAL 8 6.996 -4.861 -7.809 60 HG13 VAL 8 HG13 VAL 8 8.090 -5.661 -8.937 61 HG21 VAL 8 HG21 VAL 8 7.674 -7.808 -8.203 62 HG22 VAL 8 HG22 VAL 8 6.525 -7.382 -6.935 63 HG23 VAL 8 HG23 VAL 8 7.958 -8.333 -6.543 64 H GLU 9 HN GLU 9 9.612 -8.738 -8.177 65 HA GLU 9 HA GLU 9 10.462 -7.633 -10.760 66 HB2 GLU 9 HB2 GLU 9 11.804 -9.916 -10.942 67 HB3 GLU 9 HB1 GLU 9 12.543 -8.475 -10.243 68 HG2 GLU 9 HG2 GLU 9 12.863 -10.540 -8.852 69 HG3 GLU 9 HG1 GLU 9 12.044 -9.237 -7.995 70 H LYS 10 HN LYS 10 9.992 -9.104 -12.565 71 HA LYS 10 HA LYS 10 7.969 -11.154 -11.958 72 HB2 LYS 10 HB2 LYS 10 6.692 -10.210 -13.999 73 HB3 LYS 10 HB1 LYS 10 6.545 -9.353 -12.464 74 HG2 LYS 10 HG2 LYS 10 8.820 -8.524 -14.171 75 HG3 LYS 10 HG1 LYS 10 7.218 -8.134 -14.798 76 HD2 LYS 10 HD2 LYS 10 6.675 -7.141 -12.535 77 HD3 LYS 10 HD1 LYS 10 8.375 -7.345 -12.112 78 HE2 LYS 10 HE2 LYS 10 9.040 -5.929 -14.001 79 HE3 LYS 10 HE1 LYS 10 7.352 -5.758 -14.485 80 HZ1 LYS 10 HZ1 LYS 10 8.127 -5.050 -11.744 81 HZ2 LYS 10 HZ2 LYS 10 6.876 -4.424 -12.709 82 HZ3 LYS 10 HZ3 LYS 10 8.486 -3.966 -12.999 83 H ARG 11 HN ARG 11 7.382 -12.347 -14.060 84 HA ARG 11 HA ARG 11 9.612 -12.465 -15.949 85 HB2 ARG 11 HB2 ARG 11 9.333 -15.099 -15.688 86 HB3 ARG 11 HB1 ARG 11 10.470 -14.187 -14.706 87 HG2 ARG 11 HG2 ARG 11 9.314 -15.588 -13.178 88 HG3 ARG 11 HG1 ARG 11 8.577 -14.011 -12.957 89 HD2 ARG 11 HD2 ARG 11 7.412 -15.932 -14.951 90 HD3 ARG 11 HD1 ARG 11 7.063 -16.138 -13.241 91 HE ARG 11 HE ARG 11 6.060 -14.044 -14.963 92 HH11 ARG 11 HH11 ARG 11 6.786 -15.002 -11.689 93 HH12 ARG 11 HH12 ARG 11 5.657 -13.895 -10.990 94 HH21 ARG 11 HH21 ARG 11 4.594 -12.607 -14.021 95 HH22 ARG 11 HH22 ARG 11 4.423 -12.547 -12.298 96 H LYS 12 HN LYS 12 7.576 -11.368 -16.915 97 HA LYS 12 HA LYS 12 5.849 -13.442 -18.123 98 HB2 LYS 12 HB2 LYS 12 4.207 -11.678 -18.496 99 HB3 LYS 12 HB1 LYS 12 4.658 -11.718 -16.791 100 HG2 LYS 12 HG2 LYS 12 6.275 -9.879 -17.193 101 HG3 LYS 12 HG1 LYS 12 5.762 -9.816 -18.879 102 HD2 LYS 12 HD2 LYS 12 3.469 -9.274 -18.182 103 HD3 LYS 12 HD1 LYS 12 3.949 -9.378 -16.487 104 HE2 LYS 12 HE2 LYS 12 3.931 -7.035 -17.184 105 HE3 LYS 12 HE1 LYS 12 5.590 -7.544 -16.870 106 HZ1 LYS 12 HZ1 LYS 12 6.149 -7.314 -19.009 107 HZ2 LYS 12 HZ2 LYS 12 4.760 -6.343 -19.125 108 HZ3 LYS 12 HZ3 LYS 12 4.698 -7.978 -19.581 109 H CYS 13 HN CYS 13 5.284 -13.177 -20.369 110 HA CYS 13 HA CYS 13 7.377 -12.914 -22.117 111 HB2 CYS 13 HB2 CYS 13 5.369 -13.901 -22.913 112 HB3 CYS 13 HB1 CYS 13 4.422 -12.464 -22.528 113 H ASN 14 HN ASN 14 8.566 -11.296 -22.868 114 HA ASN 14 HA ASN 14 7.494 -8.543 -22.682 115 HB2 ASN 14 HB2 ASN 14 9.809 -7.793 -22.258 116 HB3 ASN 14 HB1 ASN 14 9.222 -8.878 -20.998 117 HD21 ASN 14 HD21 ASN 14 10.924 -10.217 -20.382 118 HD22 ASN 14 HD22 ASN 14 12.007 -10.965 -21.454 119 H THR 15 HN THR 15 7.881 -10.753 -24.902 120 HA THR 15 HA THR 15 9.734 -9.854 -26.778 121 HB THR 15 HB THR 15 8.333 -11.986 -26.835 122 HG1 THR 15 HG1 THR 15 8.237 -11.846 -29.187 123 HG21 THR 15 HG21 THR 15 6.366 -10.281 -28.354 124 HG22 THR 15 HG22 THR 15 6.158 -10.601 -26.634 125 HG23 THR 15 HG23 THR 15 6.171 -11.936 -27.785 126 H ALA 16 HN ALA 16 8.623 -9.175 -29.098 127 HA ALA 16 HA ALA 16 8.150 -6.401 -28.848 128 HB1 ALA 16 HB1 ALA 16 7.969 -8.376 -31.093 129 HB2 ALA 16 HB2 ALA 16 9.041 -6.988 -30.908 130 HB3 ALA 16 HB3 ALA 16 7.344 -6.743 -31.321 131 H THR 17 HN THR 17 5.925 -9.030 -29.775 132 HA THR 17 HA THR 17 3.605 -7.483 -29.999 133 HB THR 17 HB THR 17 3.852 -10.370 -29.119 134 HG1 THR 17 HG1 THR 17 3.351 -10.641 -31.406 135 HG21 THR 17 HG21 THR 17 1.541 -10.554 -29.968 136 HG22 THR 17 HG22 THR 17 1.526 -8.821 -30.293 137 HG23 THR 17 HG23 THR 17 1.641 -9.406 -28.633 138 H CYS 18 HN CYS 18 4.905 -9.218 -27.177 139 HA CYS 18 HA CYS 18 2.810 -8.562 -25.398 140 HB2 CYS 18 HB2 CYS 18 5.713 -9.258 -24.915 141 HB3 CYS 18 HB1 CYS 18 4.529 -9.064 -23.622 142 H ALA 19 HN ALA 19 5.870 -6.968 -26.174 143 HA ALA 19 HA ALA 19 5.613 -4.896 -24.226 144 HB1 ALA 19 HB1 ALA 19 7.734 -5.699 -25.458 145 HB2 ALA 19 HB2 ALA 19 7.545 -3.966 -25.187 146 HB3 ALA 19 HB3 ALA 19 7.196 -4.654 -26.773 147 H THR 20 HN THR 20 4.227 -5.414 -27.343 148 HA THR 20 HA THR 20 3.718 -2.622 -27.893 149 HB THR 20 HB THR 20 2.595 -5.118 -29.186 150 HG1 THR 20 HG1 THR 20 4.477 -5.166 -30.076 151 HG21 THR 20 HG21 THR 20 2.543 -2.201 -30.003 152 HG22 THR 20 HG22 THR 20 1.152 -3.200 -29.582 153 HG23 THR 20 HG23 THR 20 2.070 -3.539 -31.050 154 H GLN 21 HN GLN 21 1.717 -5.422 -26.924 155 HA GLN 21 HA GLN 21 -0.695 -3.955 -26.727 156 HB2 GLN 21 HB2 GLN 21 -1.644 -5.893 -25.838 157 HB3 GLN 21 HB1 GLN 21 -0.313 -6.523 -26.808 158 HG2 GLN 21 HG2 GLN 21 1.101 -6.435 -24.687 159 HG3 GLN 21 HG1 GLN 21 -0.399 -6.144 -23.810 160 HE21 GLN 21 HE21 GLN 21 -1.738 -7.947 -23.375 161 HE22 GLN 21 HE22 GLN 21 -1.411 -9.516 -23.935 162 H ARG 22 HN ARG 22 1.950 -4.472 -24.471 163 HA ARG 22 HA ARG 22 0.491 -3.487 -22.192 164 HB2 ARG 22 HB2 ARG 22 2.461 -3.798 -20.961 165 HB3 ARG 22 HB1 ARG 22 2.545 -5.055 -22.192 166 HG2 ARG 22 HG2 ARG 22 4.645 -4.201 -22.495 167 HG3 ARG 22 HG1 ARG 22 3.786 -3.054 -23.516 168 HD2 ARG 22 HD2 ARG 22 4.642 -1.433 -22.200 169 HD3 ARG 22 HD1 ARG 22 3.516 -1.983 -20.963 170 HE ARG 22 HE ARG 22 5.302 -2.949 -19.834 171 HH11 ARG 22 HH11 ARG 22 6.230 -2.131 -23.095 172 HH12 ARG 22 HH12 ARG 22 7.904 -2.474 -22.831 173 HH21 ARG 22 HH21 ARG 22 7.495 -3.390 -19.518 174 HH22 ARG 22 HH22 ARG 22 8.619 -3.182 -20.820 175 H LEU 23 HN LEU 23 2.276 -2.065 -24.794 176 HA LEU 23 HA LEU 23 2.705 0.459 -23.428 177 HB2 LEU 23 HB2 LEU 23 4.314 -0.351 -25.123 178 HB3 LEU 23 HB1 LEU 23 3.046 -0.281 -26.346 179 HG LEU 23 HG LEU 23 2.789 2.166 -25.867 180 HD11 LEU 23 HD11 LEU 23 3.613 2.341 -23.628 181 HD12 LEU 23 HD12 LEU 23 4.774 3.203 -24.638 182 HD13 LEU 23 HD13 LEU 23 5.144 1.579 -24.060 183 HD21 LEU 23 HD21 LEU 23 4.719 2.825 -27.134 184 HD22 LEU 23 HD22 LEU 23 4.303 1.198 -27.671 185 HD23 LEU 23 HD23 LEU 23 5.648 1.442 -26.557 186 H ALA 24 HN ALA 24 0.341 -1.039 -25.484 187 HA ALA 24 HA ALA 24 -0.934 1.269 -26.497 188 HB1 ALA 24 HB1 ALA 24 -2.696 -0.165 -27.136 189 HB2 ALA 24 HB2 ALA 24 -2.371 -1.291 -25.818 190 HB3 ALA 24 HB3 ALA 24 -1.262 -1.190 -27.185 191 H ASN 25 HN ASN 25 -1.464 -0.642 -23.549 192 HA ASN 25 HA ASN 25 -3.709 0.831 -22.632 193 HB2 ASN 25 HB2 ASN 25 -1.679 -0.886 -21.195 194 HB3 ASN 25 HB1 ASN 25 -3.078 -0.171 -20.396 195 HD21 ASN 25 HD21 ASN 25 -5.215 -0.578 -21.916 196 HD22 ASN 25 HD22 ASN 25 -5.398 -2.198 -22.388 197 H PHE 26 HN PHE 26 -0.225 1.166 -22.143 198 HA PHE 26 HA PHE 26 -0.392 3.238 -20.190 199 HB2 PHE 26 HB2 PHE 26 1.622 1.831 -20.520 200 HB3 PHE 26 HB1 PHE 26 1.877 2.595 -22.089 201 HD1 PHE 26 HD1 PHE 26 1.574 3.313 -18.439 202 HD2 PHE 26 HD2 PHE 26 2.962 4.692 -22.263 203 HE1 PHE 26 HE1 PHE 26 2.748 5.197 -17.333 204 HE2 PHE 26 HE2 PHE 26 4.136 6.576 -21.157 205 HZ PHE 26 HZ PHE 26 4.029 6.828 -18.692 206 H LEU 27 HN LEU 27 -0.184 3.198 -23.716 207 HA LEU 27 HA LEU 27 0.286 5.958 -24.070 208 HB2 LEU 27 HB2 LEU 27 0.638 4.263 -25.842 209 HB3 LEU 27 HB1 LEU 27 -1.091 3.967 -25.906 210 HG LEU 27 HG LEU 27 -0.016 5.519 -27.689 211 HD11 LEU 27 HD11 LEU 27 -2.376 6.786 -26.315 212 HD12 LEU 27 HD12 LEU 27 -2.522 5.189 -27.049 213 HD13 LEU 27 HD13 LEU 27 -2.066 6.575 -28.037 214 HD21 LEU 27 HD21 LEU 27 1.134 6.891 -25.814 215 HD22 LEU 27 HD22 LEU 27 -0.441 7.654 -25.600 216 HD23 LEU 27 HD23 LEU 27 0.393 7.773 -27.148 217 H VAL 28 HN VAL 28 -2.711 4.052 -23.936 218 HA VAL 28 HA VAL 28 -4.398 6.363 -24.322 219 HB VAL 28 HB VAL 28 -6.245 4.831 -23.845 220 HG11 VAL 28 HG11 VAL 28 -5.418 4.761 -26.100 221 HG12 VAL 28 HG12 VAL 28 -5.688 3.090 -25.603 222 HG13 VAL 28 HG13 VAL 28 -4.052 3.749 -25.629 223 HG21 VAL 28 HG21 VAL 28 -4.039 2.860 -23.164 224 HG22 VAL 28 HG22 VAL 28 -5.750 2.459 -23.300 225 HG23 VAL 28 HG23 VAL 28 -5.200 3.548 -22.028 226 H HIS 29 HN HIS 29 -3.119 4.570 -21.587 227 HA HIS 29 HA HIS 29 -4.798 5.746 -19.613 228 HB2 HIS 29 HB2 HIS 29 -3.541 3.659 -19.222 229 HB3 HIS 29 HB1 HIS 29 -2.028 4.559 -19.319 230 HD1 HIS 29 HD1 HIS 29 -5.234 4.518 -17.260 231 HD2 HIS 29 HD2 HIS 29 -1.250 5.696 -16.911 232 HE1 HIS 29 HE1 HIS 29 -4.914 5.260 -14.860 233 HE2 HIS 29 HE2 HIS 29 -2.490 5.980 -14.630 234 H SER 30 HN SER 30 -1.903 6.754 -21.236 235 HA SER 30 HA SER 30 -1.846 9.171 -19.537 236 HB2 SER 30 HB2 SER 30 0.195 7.878 -19.215 237 HB3 SER 30 HB1 SER 30 0.468 7.827 -20.954 238 HG SER 30 HG SER 30 1.226 9.683 -19.238 239 H SER 31 HN SER 31 -3.221 8.441 -22.193 240 HA SER 31 HA SER 31 -2.021 9.941 -24.265 241 HB2 SER 31 HB2 SER 31 -3.771 8.316 -24.737 242 HB3 SER 31 HB1 SER 31 -4.929 9.247 -23.792 243 HG SER 31 HG SER 31 -4.427 9.500 -26.326 244 H ASN 32 HN ASN 32 -4.470 10.828 -21.835 245 HA ASN 32 HA ASN 32 -4.927 13.440 -22.800 246 HB2 ASN 32 HB2 ASN 32 -5.854 13.870 -20.548 247 HB3 ASN 32 HB1 ASN 32 -6.452 12.360 -21.233 248 HD21 ASN 32 HD21 ASN 32 -5.480 13.552 -18.350 249 HD22 ASN 32 HD22 ASN 32 -4.755 12.172 -17.678 250 H ASN 33 HN ASN 33 -2.572 12.117 -20.535 251 HA ASN 33 HA ASN 33 -1.572 14.665 -19.711 252 HB2 ASN 33 HB2 ASN 33 -0.479 11.859 -19.476 253 HB3 ASN 33 HB1 ASN 33 0.376 13.268 -18.849 254 HD21 ASN 33 HD21 ASN 33 -0.634 11.170 -17.134 255 HD22 ASN 33 HD22 ASN 33 -1.857 11.840 -16.166 256 H PHE 34 HN PHE 34 -0.793 12.353 -22.211 257 HA PHE 34 HA PHE 34 1.716 13.134 -23.035 258 HB2 PHE 34 HB2 PHE 34 0.484 11.272 -24.066 259 HB3 PHE 34 HB1 PHE 34 -0.623 12.418 -24.822 260 HD1 PHE 34 HD1 PHE 34 3.034 11.645 -24.543 261 HD2 PHE 34 HD2 PHE 34 -0.134 13.267 -26.948 262 HE1 PHE 34 HE1 PHE 34 4.612 11.924 -26.435 263 HE2 PHE 34 HE2 PHE 34 1.444 13.546 -28.840 264 HZ PHE 34 HZ PHE 34 3.818 12.874 -28.584 265 H GLY 35 HN GLY 35 -1.399 14.619 -23.891 266 HA2 GLY 35 HA2 GLY 35 -0.341 16.615 -25.614 267 HA3 GLY 35 HA1 GLY 35 -1.914 16.667 -24.803 268 H ALA 36 HN ALA 36 -1.134 16.616 -22.142 269 HA ALA 36 HA ALA 36 -0.620 19.306 -21.632 270 HB1 ALA 36 HB1 ALA 36 -0.716 18.756 -19.385 271 HB2 ALA 36 HB2 ALA 36 0.160 17.242 -19.611 272 HB3 ALA 36 HB3 ALA 36 -1.530 17.363 -20.098 273 H ILE 37 HN ILE 37 1.561 16.548 -21.847 274 HA ILE 37 HA ILE 37 3.892 17.723 -20.821 275 HB ILE 37 HB ILE 37 3.469 15.553 -22.877 276 HG12 ILE 37 HG12 ILE 37 4.532 15.428 -20.041 277 HG13 ILE 37 HG11 ILE 37 2.825 15.225 -20.434 278 HG21 ILE 37 HG21 ILE 37 5.923 15.050 -22.400 279 HG22 ILE 37 HG22 ILE 37 6.024 16.660 -21.688 280 HG23 ILE 37 HG23 ILE 37 5.621 16.474 -23.395 281 HD11 ILE 37 HD11 ILE 37 5.145 13.489 -21.297 282 HD12 ILE 37 HD12 ILE 37 3.560 13.399 -22.065 283 HD13 ILE 37 HD13 ILE 37 3.733 13.019 -20.351 284 H LEU 38 HN LEU 38 2.469 17.785 -24.054 285 HA LEU 38 HA LEU 38 4.584 18.909 -25.486 286 HB2 LEU 38 HB2 LEU 38 2.448 18.038 -26.464 287 HB3 LEU 38 HB1 LEU 38 1.641 19.495 -25.885 288 HG LEU 38 HG LEU 38 3.497 20.777 -27.177 289 HD11 LEU 38 HD11 LEU 38 4.837 18.655 -27.546 290 HD12 LEU 38 HD12 LEU 38 4.530 19.597 -29.005 291 HD13 LEU 38 HD13 LEU 38 3.583 18.146 -28.677 292 HD21 LEU 38 HD21 LEU 38 2.188 20.472 -29.334 293 HD22 LEU 38 HD22 LEU 38 1.210 20.856 -27.918 294 HD23 LEU 38 HD23 LEU 38 1.284 19.198 -28.515 295 H SER 39 HN SER 39 2.142 20.437 -23.436 296 HA SER 39 HA SER 39 2.697 23.120 -24.094 297 HB2 SER 39 HB2 SER 39 1.675 21.890 -21.527 298 HB3 SER 39 HB1 SER 39 1.706 23.621 -21.852 299 HG SER 39 HG SER 39 0.062 21.637 -22.845 300 H SER 40 HN SER 40 4.155 20.913 -21.749 301 HA SER 40 HA SER 40 5.997 22.994 -20.835 302 HB2 SER 40 HB2 SER 40 6.081 20.120 -19.966 303 HB3 SER 40 HB1 SER 40 6.551 21.562 -19.072 304 HG SER 40 HG SER 40 4.544 20.799 -18.354 305 H THR 41 HN THR 41 6.183 22.163 -23.581 306 HA THR 41 HA THR 41 8.117 20.249 -24.143 307 HB THR 41 HB THR 41 6.852 21.347 -25.906 308 HG1 THR 41 HG1 THR 41 9.573 22.074 -26.169 309 HG21 THR 41 HG21 THR 41 7.539 23.714 -26.534 310 HG22 THR 41 HG22 THR 41 8.348 23.802 -24.969 311 HG23 THR 41 HG23 THR 41 6.602 23.567 -25.047 312 H ASN 42 HN ASN 42 8.471 23.340 -22.625 313 HA ASN 42 HA ASN 42 11.352 23.433 -23.090 314 HB2 ASN 42 HB2 ASN 42 11.287 25.570 -21.985 315 HB3 ASN 42 HB1 ASN 42 9.938 25.503 -23.118 316 HD21 ASN 42 HD21 ASN 42 10.059 27.180 -20.692 317 HD22 ASN 42 HD22 ASN 42 8.784 26.672 -19.694 318 H VAL 43 HN VAL 43 9.885 21.337 -21.389 319 HA VAL 43 HA VAL 43 11.021 21.850 -18.746 320 HB VAL 43 HB VAL 43 8.714 20.809 -19.188 321 HG11 VAL 43 HG11 VAL 43 10.336 18.279 -19.524 322 HG12 VAL 43 HG12 VAL 43 9.720 19.186 -20.905 323 HG13 VAL 43 HG13 VAL 43 8.599 18.498 -19.731 324 HG21 VAL 43 HG21 VAL 43 10.530 19.145 -17.429 325 HG22 VAL 43 HG22 VAL 43 8.837 19.556 -17.167 326 HG23 VAL 43 HG23 VAL 43 10.078 20.797 -17.007 327 H GLY 44 HN GLY 44 12.620 21.263 -21.294 328 HA2 GLY 44 HA2 GLY 44 14.850 20.417 -21.261 329 HA3 GLY 44 HA1 GLY 44 14.353 19.233 -20.058 330 H SER 45 HN SER 45 11.844 18.842 -21.841 331 HA SER 45 HA SER 45 13.060 16.751 -23.491 332 HB2 SER 45 HB2 SER 45 10.883 15.787 -23.612 333 HB3 SER 45 HB1 SER 45 11.088 16.322 -21.947 334 HG SER 45 HG SER 45 9.108 16.923 -23.385 335 H ASN 46 HN ASN 46 13.144 19.675 -24.159 336 HA ASN 46 HA ASN 46 11.365 20.201 -26.304 337 HB2 ASN 46 HB2 ASN 46 12.896 22.030 -26.857 338 HB3 ASN 46 HB1 ASN 46 12.596 21.972 -25.121 339 HD21 ASN 46 HD21 ASN 46 14.863 23.279 -25.586 340 HD22 ASN 46 HD22 ASN 46 16.242 22.311 -25.376 341 H THR 47 HN THR 47 13.966 18.036 -26.086 342 HA THR 47 HA THR 47 14.660 18.208 -28.920 343 HB THR 47 HB THR 47 15.680 16.097 -27.046 344 HG1 THR 47 HG1 THR 47 16.555 18.788 -27.231 345 HG21 THR 47 HG21 THR 47 16.209 16.188 -29.531 346 HG22 THR 47 HG22 THR 47 17.610 16.187 -28.460 347 HG23 THR 47 HG23 THR 47 17.071 17.692 -29.206 348 H TYR 48 HN TYR 48 11.952 17.385 -28.028 349 HA TYR 48 HA TYR 48 11.840 14.543 -28.677 350 HB2 TYR 48 HB2 TYR 48 9.576 14.622 -28.006 351 HB3 TYR 48 HB1 TYR 48 10.409 15.705 -26.892 352 HD1 TYR 48 HD1 TYR 48 7.796 15.410 -29.336 353 HD2 TYR 48 HD2 TYR 48 10.462 18.218 -27.476 354 HE1 TYR 48 HE1 TYR 48 6.333 17.278 -30.058 355 HE2 TYR 48 HE2 TYR 48 9.000 20.085 -28.198 356 HH TYR 48 HH TYR 48 7.316 20.597 -29.772 357 H GLY 49 HN GLY 49 12.537 16.853 -30.626 358 HA2 GLY 49 HA2 GLY 49 10.479 17.111 -32.525 359 HA3 GLY 49 HA1 GLY 49 12.198 17.312 -32.853 360 H LYS 50 HN LYS 50 9.462 15.300 -33.229 361 HA LYS 50 HA LYS 50 10.726 12.812 -33.738 362 HB2 LYS 50 HB2 LYS 50 8.082 13.965 -34.638 363 HB3 LYS 50 HB1 LYS 50 8.585 12.311 -34.987 364 HG2 LYS 50 HG2 LYS 50 8.988 12.066 -32.465 365 HG3 LYS 50 HG1 LYS 50 8.090 13.574 -32.287 366 HD2 LYS 50 HD2 LYS 50 6.984 11.210 -33.815 367 HD3 LYS 50 HD1 LYS 50 6.722 11.419 -32.084 368 HE2 LYS 50 HE2 LYS 50 6.116 13.685 -33.965 369 HE3 LYS 50 HE1 LYS 50 4.955 12.373 -33.771 370 HZ1 LYS 50 HZ1 LYS 50 6.076 13.548 -31.343 371 HZ2 LYS 50 HZ2 LYS 50 4.517 12.941 -31.638 372 HZ3 LYS 50 HZ3 LYS 50 4.954 14.480 -32.208 373 H ARG 51 HN ARG 51 9.935 15.585 -35.769 374 HA ARG 51 HA ARG 51 10.370 14.529 -38.295 375 HB2 ARG 51 HB2 ARG 51 10.782 16.779 -39.034 376 HB3 ARG 51 HB1 ARG 51 9.564 16.849 -37.761 377 HG2 ARG 51 HG2 ARG 51 11.401 17.335 -36.117 378 HG3 ARG 51 HG1 ARG 51 12.524 17.432 -37.473 379 HD2 ARG 51 HD2 ARG 51 11.135 19.229 -38.470 380 HD3 ARG 51 HD1 ARG 51 10.063 19.157 -37.074 381 HE ARG 51 HE ARG 51 12.688 20.372 -37.181 382 HH11 ARG 51 HH11 ARG 51 10.236 18.947 -35.149 383 HH12 ARG 51 HH12 ARG 51 10.769 19.771 -33.726 384 HH21 ARG 51 HH21 ARG 51 13.360 21.437 -35.304 385 HH22 ARG 51 HH22 ARG 51 12.525 21.171 -33.810 386 H ASN 52 HN ASN 52 12.657 15.158 -35.774 387 HA ASN 52 HA ASN 52 15.032 15.564 -37.125 388 HB2 ASN 52 HB2 ASN 52 14.838 15.551 -34.669 389 HB3 ASN 52 HB1 ASN 52 14.607 13.803 -34.700 390 HD21 ASN 52 HD21 ASN 52 16.475 12.480 -34.908 391 HD22 ASN 52 HD22 ASN 52 18.047 13.105 -35.048 392 H ALA 53 HN ALA 53 13.094 12.685 -36.914 393 HA ALA 53 HA ALA 53 15.032 10.770 -37.691 394 HB1 ALA 53 HB1 ALA 53 13.010 9.448 -38.440 395 HB2 ALA 53 HB2 ALA 53 12.025 10.842 -37.996 396 HB3 ALA 53 HB3 ALA 53 12.962 9.997 -36.764 397 H VAL 54 HN VAL 54 12.816 12.818 -39.550 398 HA VAL 54 HA VAL 54 13.561 11.705 -42.087 399 HB VAL 54 HB VAL 54 11.450 13.168 -41.266 400 HG11 VAL 54 HG11 VAL 54 13.105 15.144 -42.851 401 HG12 VAL 54 HG12 VAL 54 13.033 15.177 -41.089 402 HG13 VAL 54 HG13 VAL 54 11.566 15.420 -42.035 403 HG21 VAL 54 HG21 VAL 54 10.914 13.426 -43.656 404 HG22 VAL 54 HG22 VAL 54 11.655 11.853 -43.357 405 HG23 VAL 54 HG23 VAL 54 12.607 13.155 -44.073 406 H GLU 55 HN GLU 55 14.852 14.162 -40.012 407 HA GLU 55 HA GLU 55 16.315 15.554 -42.061 408 HB2 GLU 55 HB2 GLU 55 15.587 16.254 -39.575 409 HB3 GLU 55 HB1 GLU 55 17.218 15.677 -39.231 410 HG2 GLU 55 HG2 GLU 55 16.705 17.562 -41.524 411 HG3 GLU 55 HG1 GLU 55 16.912 18.175 -39.885 412 H VAL 56 HN VAL 56 17.334 13.441 -39.365 413 HA VAL 56 HA VAL 56 20.011 13.197 -39.989 414 HB VAL 56 HB VAL 56 19.079 12.243 -37.953 415 HG11 VAL 56 HG11 VAL 56 17.808 10.171 -39.767 416 HG12 VAL 56 HG12 VAL 56 16.934 11.475 -38.963 417 HG13 VAL 56 HG13 VAL 56 17.715 10.216 -38.007 418 HG21 VAL 56 HG21 VAL 56 20.290 10.128 -37.953 419 HG22 VAL 56 HG22 VAL 56 21.188 11.297 -38.921 420 HG23 VAL 56 HG23 VAL 56 20.222 10.053 -39.714 421 H LEU 57 HN LEU 57 17.260 11.580 -41.472 422 HA LEU 57 HA LEU 57 18.714 9.662 -42.963 423 HB2 LEU 57 HB2 LEU 57 15.979 10.611 -42.815 424 HB3 LEU 57 HB1 LEU 57 16.464 10.339 -44.489 425 HG LEU 57 HG LEU 57 17.450 8.100 -43.596 426 HD11 LEU 57 HD11 LEU 57 17.089 8.804 -41.189 427 HD12 LEU 57 HD12 LEU 57 16.424 7.224 -41.602 428 HD13 LEU 57 HD13 LEU 57 15.357 8.622 -41.469 429 HD21 LEU 57 HD21 LEU 57 15.578 8.106 -45.108 430 HD22 LEU 57 HD22 LEU 57 14.487 8.681 -43.847 431 HD23 LEU 57 HD23 LEU 57 15.144 7.047 -43.766 432 H LYS 58 HN LYS 58 17.761 12.999 -43.632 433 HA LYS 58 HA LYS 58 18.628 13.070 -46.341 434 HB2 LYS 58 HB2 LYS 58 18.206 15.223 -44.265 435 HB3 LYS 58 HB1 LYS 58 18.686 15.573 -45.926 436 HG2 LYS 58 HG2 LYS 58 16.290 13.836 -45.349 437 HG3 LYS 58 HG1 LYS 58 16.150 15.594 -45.360 438 HD2 LYS 58 HD2 LYS 58 17.083 15.651 -47.650 439 HD3 LYS 58 HD1 LYS 58 17.193 13.890 -47.642 440 HE2 LYS 58 HE2 LYS 58 14.577 15.285 -47.091 441 HE3 LYS 58 HE1 LYS 58 15.105 14.957 -48.742 442 HZ1 LYS 58 HZ1 LYS 58 15.488 12.589 -47.847 443 HZ2 LYS 58 HZ2 LYS 58 13.903 13.083 -48.208 444 HZ3 LYS 58 HZ3 LYS 58 14.440 13.052 -46.597 445 H ARG 59 HN ARG 59 20.194 14.057 -43.294 446 HA ARG 59 HA ARG 59 22.616 14.919 -44.467 447 HB2 ARG 59 HB2 ARG 59 21.749 15.375 -42.104 448 HB3 ARG 59 HB1 ARG 59 22.358 13.772 -41.690 449 HG2 ARG 59 HG2 ARG 59 24.280 15.413 -43.195 450 HG3 ARG 59 HG1 ARG 59 23.852 16.084 -41.621 451 HD2 ARG 59 HD2 ARG 59 24.404 13.950 -40.541 452 HD3 ARG 59 HD1 ARG 59 24.788 13.242 -42.107 453 HE ARG 59 HE ARG 59 26.379 15.507 -41.872 454 HH11 ARG 59 HH11 ARG 59 25.897 12.506 -40.160 455 HH12 ARG 59 HH12 ARG 59 27.532 12.427 -39.600 456 HH21 ARG 59 HH21 ARG 59 28.507 15.377 -41.125 457 HH22 ARG 59 HH22 ARG 59 29.001 14.040 -40.141 458 H GLU 60 HN GLU 60 21.378 11.758 -43.742 459 HA GLU 60 HA GLU 60 24.032 10.598 -44.349 460 HB2 GLU 60 HB2 GLU 60 21.750 9.455 -42.722 461 HB3 GLU 60 HB1 GLU 60 23.221 8.578 -43.143 462 HG2 GLU 60 HG2 GLU 60 23.243 11.227 -41.679 463 HG3 GLU 60 HG1 GLU 60 23.242 9.671 -40.851 464 HA PRO 61 HA PRO 61 21.117 9.589 -47.838 465 HB2 PRO 61 HB2 PRO 61 22.975 10.058 -49.810 466 HB3 PRO 61 HB1 PRO 61 21.883 11.298 -49.165 467 HG2 PRO 61 HG2 PRO 61 24.746 10.788 -48.544 468 HG3 PRO 61 HG1 PRO 61 23.881 12.325 -48.714 469 HD2 PRO 61 HD2 PRO 61 24.519 11.251 -46.283 470 HD3 PRO 61 HD1 PRO 61 23.091 12.278 -46.539 471 H LEU 62 HN LEU 62 24.102 8.442 -46.631 472 HA LEU 62 HA LEU 62 24.740 6.418 -48.480 473 HB2 LEU 62 HB2 LEU 62 26.165 7.275 -46.554 474 HB3 LEU 62 HB1 LEU 62 25.188 6.253 -45.499 475 HG LEU 62 HG LEU 62 26.197 4.911 -47.928 476 HD11 LEU 62 HD11 LEU 62 28.092 6.450 -47.204 477 HD12 LEU 62 HD12 LEU 62 28.476 4.728 -47.204 478 HD13 LEU 62 HD13 LEU 62 28.126 5.554 -45.685 479 HD21 LEU 62 HD21 LEU 62 26.497 3.087 -46.379 480 HD22 LEU 62 HD22 LEU 62 24.966 3.861 -45.974 481 HD23 LEU 62 HD23 LEU 62 26.399 4.175 -44.995 482 H ASN 63 HN ASN 63 22.654 6.423 -45.606 483 HA ASN 63 HA ASN 63 22.014 3.643 -45.768 484 HB2 ASN 63 HB2 ASN 63 20.118 4.334 -44.206 485 HB3 ASN 63 HB1 ASN 63 21.757 4.648 -43.640 486 HD21 ASN 63 HD21 ASN 63 19.267 6.363 -45.631 487 HD22 ASN 63 HD22 ASN 63 19.534 7.874 -44.906 488 H TYR 64 HN TYR 64 20.930 6.415 -47.483 489 HA TYR 64 HA TYR 64 18.292 5.475 -48.097 490 HB2 TYR 64 HB2 TYR 64 18.948 7.872 -48.198 491 HB3 TYR 64 HB1 TYR 64 19.983 7.502 -49.577 492 HD1 TYR 64 HD1 TYR 64 16.449 7.074 -48.398 493 HD2 TYR 64 HD2 TYR 64 19.096 7.607 -51.738 494 HE1 TYR 64 HE1 TYR 64 14.497 7.257 -49.916 495 HE2 TYR 64 HE2 TYR 64 17.144 7.791 -53.256 496 HH TYR 64 HH TYR 64 14.387 6.756 -52.836 497 H LEU 65 HN LEU 65 21.455 5.324 -49.650 498 HA LEU 65 HA LEU 65 20.515 4.129 -52.074 499 HB2 LEU 65 HB2 LEU 65 23.276 4.265 -50.839 500 HB3 LEU 65 HB1 LEU 65 22.942 3.655 -52.459 501 HG LEU 65 HG LEU 65 22.125 6.418 -51.529 502 HD11 LEU 65 HD11 LEU 65 24.085 7.288 -52.611 503 HD12 LEU 65 HD12 LEU 65 24.505 5.703 -53.260 504 HD13 LEU 65 HD13 LEU 65 24.636 6.008 -51.528 505 HD21 LEU 65 HD21 LEU 65 22.097 6.746 -54.069 506 HD22 LEU 65 HD22 LEU 65 20.829 5.711 -53.414 507 HD23 LEU 65 HD23 LEU 65 22.235 4.993 -54.200 508 HA PRO 66 HA PRO 66 20.074 -0.139 -51.089 509 HB2 PRO 66 HB2 PRO 66 22.147 -0.791 -53.132 510 HB3 PRO 66 HB1 PRO 66 20.482 -1.384 -52.984 511 HG2 PRO 66 HG2 PRO 66 21.157 0.408 -54.831 512 HG3 PRO 66 HG1 PRO 66 19.588 0.464 -54.010 513 HD2 PRO 66 HD2 PRO 66 21.980 2.210 -53.618 514 HD3 PRO 66 HD1 PRO 66 20.254 2.605 -53.469 515 H LEU 67 HN LEU 67 20.952 -1.565 -49.644 516 HA LEU 67 HA LEU 67 23.686 -1.018 -48.728 517 HB2 LEU 67 HB2 LEU 67 21.235 -1.699 -47.435 518 HB3 LEU 67 HB1 LEU 67 22.397 -2.990 -47.126 519 HG LEU 67 HG LEU 67 23.073 -0.060 -46.787 520 HD11 LEU 67 HD11 LEU 67 22.320 -2.017 -44.602 521 HD12 LEU 67 HD12 LEU 67 21.186 -0.850 -45.283 522 HD13 LEU 67 HD13 LEU 67 22.627 -0.288 -44.436 523 HD21 LEU 67 HD21 LEU 67 24.900 -1.797 -47.100 524 HD22 LEU 67 HD22 LEU 67 24.347 -2.540 -45.599 525 HD23 LEU 67 HD23 LEU 67 24.986 -0.896 -45.586 Start of MODEL 9 1 H1 THR 1 HT1 THR 1 -3.140 -4.888 -2.194 2 H2 THR 1 HT2 THR 1 -3.334 -3.315 -1.580 3 H3 THR 1 HT3 THR 1 -3.907 -4.651 -0.700 4 HA THR 1 HA THR 1 -1.775 -5.378 -0.150 5 HB THR 1 HB THR 1 -1.143 -4.339 -2.669 6 HG1 THR 1 HG1 THR 1 0.984 -5.177 -2.024 7 HG21 THR 1 HG21 THR 1 0.745 -2.858 -2.317 8 HG22 THR 1 HG22 THR 1 0.555 -2.962 -0.569 9 HG23 THR 1 HG23 THR 1 -0.672 -2.150 -1.545 10 HA PRO 2 HA PRO 2 -1.610 -2.174 2.875 11 HB2 PRO 2 HB2 PRO 2 0.866 -2.499 3.966 12 HB3 PRO 2 HB1 PRO 2 -0.458 -3.654 4.216 13 HG2 PRO 2 HG2 PRO 2 1.877 -3.818 2.381 14 HG3 PRO 2 HG1 PRO 2 1.098 -5.089 3.338 15 HD2 PRO 2 HD2 PRO 2 0.668 -4.730 0.639 16 HD3 PRO 2 HD1 PRO 2 -0.504 -5.499 1.732 17 H ILE 3 HN ILE 3 -0.863 -0.066 3.308 18 HA ILE 3 HA ILE 3 0.027 1.494 1.214 19 HB ILE 3 HB ILE 3 -0.985 2.304 3.374 20 HG12 ILE 3 HG12 ILE 3 0.593 4.352 3.475 21 HG13 ILE 3 HG11 ILE 3 1.510 3.543 2.205 22 HG21 ILE 3 HG21 ILE 3 0.657 0.954 4.782 23 HG22 ILE 3 HG22 ILE 3 0.414 2.624 5.292 24 HG23 ILE 3 HG23 ILE 3 1.863 2.179 4.391 25 HD11 ILE 3 HD11 ILE 3 -1.468 4.022 1.994 26 HD12 ILE 3 HD12 ILE 3 -0.350 3.574 0.707 27 HD13 ILE 3 HD13 ILE 3 -0.280 5.188 1.413 28 H GLU 4 HN GLU 4 1.968 2.128 0.407 29 HA GLU 4 HA GLU 4 4.212 0.515 0.598 30 HB2 GLU 4 HB2 GLU 4 5.436 2.322 -0.491 31 HB3 GLU 4 HB1 GLU 4 3.824 2.185 -1.194 32 HG2 GLU 4 HG2 GLU 4 3.043 4.010 0.303 33 HG3 GLU 4 HG1 GLU 4 4.685 4.178 0.922 34 H SER 5 HN SER 5 6.345 0.986 1.492 35 HA SER 5 HA SER 5 6.195 1.630 4.276 36 HB2 SER 5 HB2 SER 5 8.595 1.176 4.290 37 HB3 SER 5 HB1 SER 5 7.752 -0.066 3.370 38 HG SER 5 HG SER 5 8.952 2.250 2.245 39 H HIS 6 HN HIS 6 7.601 3.233 5.332 40 HA HIS 6 HA HIS 6 7.158 5.838 4.316 41 HB2 HIS 6 HB2 HIS 6 8.295 6.618 6.259 42 HB3 HIS 6 HB1 HIS 6 7.435 5.158 6.749 43 HD1 HIS 6 HD1 HIS 6 10.497 6.601 7.427 44 HD2 HIS 6 HD2 HIS 6 9.490 2.814 6.006 45 HE1 HIS 6 HE1 HIS 6 12.470 5.097 7.936 46 HE2 HIS 6 HE2 HIS 6 11.872 2.784 7.075 47 H GLN 7 HN GLN 7 9.723 3.561 3.833 48 HA GLN 7 HA GLN 7 11.788 5.410 3.166 49 HB2 GLN 7 HB2 GLN 7 12.231 3.057 3.783 50 HB3 GLN 7 HB1 GLN 7 11.436 2.530 2.300 51 HG2 GLN 7 HG2 GLN 7 13.082 3.786 0.964 52 HG3 GLN 7 HG1 GLN 7 13.880 4.318 2.443 53 HE21 GLN 7 HE21 GLN 7 15.607 3.024 3.080 54 HE22 GLN 7 HE22 GLN 7 15.813 1.396 2.645 55 H VAL 8 HN VAL 8 12.157 6.499 1.333 56 HA VAL 8 HA VAL 8 10.675 5.715 -1.100 57 HB VAL 8 HB VAL 8 9.544 7.642 -0.085 58 HG11 VAL 8 HG11 VAL 8 11.436 8.553 1.181 59 HG12 VAL 8 HG12 VAL 8 10.781 9.791 0.110 60 HG13 VAL 8 HG13 VAL 8 12.271 8.952 -0.321 61 HG21 VAL 8 HG21 VAL 8 9.722 7.457 -2.564 62 HG22 VAL 8 HG22 VAL 8 11.196 8.425 -2.509 63 HG23 VAL 8 HG23 VAL 8 9.655 9.135 -2.027 64 H GLU 9 HN GLU 9 11.768 5.958 -3.026 65 HA GLU 9 HA GLU 9 14.518 7.020 -2.880 66 HB2 GLU 9 HB2 GLU 9 14.937 5.098 -4.659 67 HB3 GLU 9 HB1 GLU 9 15.065 4.783 -2.930 68 HG2 GLU 9 HG2 GLU 9 13.704 3.069 -4.137 69 HG3 GLU 9 HG1 GLU 9 12.801 3.896 -2.871 70 H LYS 10 HN LYS 10 12.905 8.794 -3.739 71 HA LYS 10 HA LYS 10 11.947 8.654 -6.389 72 HB2 LYS 10 HB2 LYS 10 11.790 11.086 -6.265 73 HB3 LYS 10 HB1 LYS 10 11.241 10.372 -4.748 74 HG2 LYS 10 HG2 LYS 10 13.472 10.781 -3.755 75 HG3 LYS 10 HG1 LYS 10 14.000 11.525 -5.266 76 HD2 LYS 10 HD2 LYS 10 12.233 13.233 -5.048 77 HD3 LYS 10 HD1 LYS 10 11.705 12.494 -3.536 78 HE2 LYS 10 HE2 LYS 10 13.917 12.928 -2.540 79 HE3 LYS 10 HE1 LYS 10 14.459 13.656 -4.052 80 HZ1 LYS 10 HZ1 LYS 10 12.132 14.622 -2.486 81 HZ2 LYS 10 HZ2 LYS 10 12.841 15.371 -3.836 82 HZ3 LYS 10 HZ3 LYS 10 13.691 15.279 -2.368 83 H ARG 11 HN ARG 11 12.787 10.052 -8.192 84 HA ARG 11 HA ARG 11 15.691 10.357 -8.223 85 HB2 ARG 11 HB2 ARG 11 15.523 9.244 -10.636 86 HB3 ARG 11 HB1 ARG 11 15.843 8.289 -9.196 87 HG2 ARG 11 HG2 ARG 11 14.147 7.108 -10.366 88 HG3 ARG 11 HG1 ARG 11 13.291 7.915 -9.063 89 HD2 ARG 11 HD2 ARG 11 13.586 9.277 -11.726 90 HD3 ARG 11 HD1 ARG 11 12.359 8.036 -11.514 91 HE ARG 11 HE ARG 11 12.330 10.696 -10.384 92 HH11 ARG 11 HH11 ARG 11 11.186 7.414 -10.087 93 HH12 ARG 11 HH12 ARG 11 9.782 7.861 -9.183 94 HH21 ARG 11 HH21 ARG 11 10.489 11.249 -9.199 95 HH22 ARG 11 HH22 ARG 11 9.388 10.017 -8.681 96 H LYS 12 HN LYS 12 14.460 12.540 -8.078 97 HA LYS 12 HA LYS 12 13.129 13.624 -10.291 98 HB2 LYS 12 HB2 LYS 12 13.698 15.805 -9.362 99 HB3 LYS 12 HB1 LYS 12 13.243 14.705 -8.062 100 HG2 LYS 12 HG2 LYS 12 15.636 14.245 -7.625 101 HG3 LYS 12 HG1 LYS 12 16.077 15.380 -8.901 102 HD2 LYS 12 HD2 LYS 12 14.974 17.207 -7.690 103 HD3 LYS 12 HD1 LYS 12 14.464 16.082 -6.430 104 HE2 LYS 12 HE2 LYS 12 16.474 17.280 -5.707 105 HE3 LYS 12 HE1 LYS 12 16.848 15.574 -5.948 106 HZ1 LYS 12 HZ1 LYS 12 18.026 16.001 -7.845 107 HZ2 LYS 12 HZ2 LYS 12 18.367 17.409 -6.958 108 HZ3 LYS 12 HZ3 LYS 12 17.196 17.439 -8.189 109 H CYS 13 HN CYS 13 13.839 14.921 -12.012 110 HA CYS 13 HA CYS 13 16.210 14.040 -13.285 111 HB2 CYS 13 HB2 CYS 13 14.158 14.925 -14.443 112 HB3 CYS 13 HB1 CYS 13 14.644 16.543 -13.935 113 H ASN 14 HN ASN 14 18.172 14.499 -12.483 114 HA ASN 14 HA ASN 14 18.718 17.297 -11.689 115 HB2 ASN 14 HB2 ASN 14 20.443 16.376 -10.160 116 HB3 ASN 14 HB1 ASN 14 18.813 15.851 -9.741 117 HD21 ASN 14 HD21 ASN 14 18.991 13.717 -9.029 118 HD22 ASN 14 HD22 ASN 14 19.870 12.503 -9.827 119 H THR 15 HN THR 15 19.093 15.510 -14.255 120 HA THR 15 HA THR 15 21.965 15.592 -14.612 121 HB THR 15 HB THR 15 20.721 13.797 -15.673 122 HG1 THR 15 HG1 THR 15 22.348 14.194 -16.975 123 HG21 THR 15 HG21 THR 15 19.149 16.086 -16.842 124 HG22 THR 15 HG22 THR 15 18.556 14.633 -16.037 125 HG23 THR 15 HG23 THR 15 19.219 14.529 -17.666 126 H ALA 16 HN ALA 16 22.782 16.617 -16.704 127 HA ALA 16 HA ALA 16 22.357 19.428 -16.537 128 HB1 ALA 16 HB1 ALA 16 24.447 18.049 -17.346 129 HB2 ALA 16 HB2 ALA 16 24.107 19.632 -18.047 130 HB3 ALA 16 HB3 ALA 16 23.661 18.166 -18.921 131 H THR 17 HN THR 17 20.963 16.897 -18.463 132 HA THR 17 HA THR 17 20.041 18.332 -20.675 133 HB THR 17 HB THR 17 18.717 16.028 -19.223 134 HG1 THR 17 HG1 THR 17 20.287 16.032 -21.574 135 HG21 THR 17 HG21 THR 17 17.706 15.664 -21.537 136 HG22 THR 17 HG22 THR 17 18.231 17.304 -21.919 137 HG23 THR 17 HG23 THR 17 17.065 17.030 -20.624 138 H CYS 18 HN CYS 18 18.424 17.767 -17.541 139 HA CYS 18 HA CYS 18 16.156 19.380 -18.189 140 HB2 CYS 18 HB2 CYS 18 17.238 18.272 -15.601 141 HB3 CYS 18 HB1 CYS 18 15.799 19.291 -15.658 142 H ALA 19 HN ALA 19 19.222 19.961 -16.536 143 HA ALA 19 HA ALA 19 18.698 22.470 -15.436 144 HB1 ALA 19 HB1 ALA 19 20.812 20.984 -15.251 145 HB2 ALA 19 HB2 ALA 19 21.026 22.734 -15.250 146 HB3 ALA 19 HB3 ALA 19 21.340 21.808 -16.718 147 H THR 20 HN THR 20 19.924 21.639 -18.675 148 HA THR 20 HA THR 20 20.196 24.251 -19.651 149 HB THR 20 HB THR 20 19.477 21.727 -21.160 150 HG1 THR 20 HG1 THR 20 21.816 21.913 -21.585 151 HG21 THR 20 HG21 THR 20 20.465 24.446 -22.037 152 HG22 THR 20 HG22 THR 20 19.018 23.595 -22.577 153 HG23 THR 20 HG23 THR 20 20.613 23.008 -23.048 154 H GLN 21 HN GLN 21 17.377 22.162 -19.379 155 HA GLN 21 HA GLN 21 15.619 23.485 -21.087 156 HB2 GLN 21 HB2 GLN 21 14.097 22.046 -20.262 157 HB3 GLN 21 HB1 GLN 21 15.429 21.374 -19.327 158 HG2 GLN 21 HG2 GLN 21 14.882 23.042 -17.509 159 HG3 GLN 21 HG1 GLN 21 13.440 23.474 -18.425 160 HE21 GLN 21 HE21 GLN 21 12.813 22.494 -16.001 161 HE22 GLN 21 HE22 GLN 21 12.317 20.872 -16.074 162 H ARG 22 HN ARG 22 16.743 24.376 -17.884 163 HA ARG 22 HA ARG 22 14.755 26.467 -17.604 164 HB2 ARG 22 HB2 ARG 22 15.528 26.756 -15.453 165 HB3 ARG 22 HB1 ARG 22 16.010 25.086 -15.728 166 HG2 ARG 22 HG2 ARG 22 18.016 25.895 -14.959 167 HG3 ARG 22 HG1 ARG 22 18.225 26.302 -16.656 168 HD2 ARG 22 HD2 ARG 22 18.459 28.453 -16.032 169 HD3 ARG 22 HD1 ARG 22 16.761 28.438 -15.562 170 HE ARG 22 HE ARG 22 17.427 28.328 -13.339 171 HH11 ARG 22 HH11 ARG 22 20.107 27.591 -15.446 172 HH12 ARG 22 HH12 ARG 22 21.269 27.597 -14.166 173 HH21 ARG 22 HH21 ARG 22 18.969 28.327 -11.685 174 HH22 ARG 22 HH22 ARG 22 20.632 28.010 -12.050 175 H LEU 23 HN LEU 23 17.905 26.134 -18.966 176 HA LEU 23 HA LEU 23 18.791 28.814 -18.800 177 HB2 LEU 23 HB2 LEU 23 20.268 26.942 -19.446 178 HB3 LEU 23 HB1 LEU 23 19.362 26.751 -20.946 179 HG LEU 23 HG LEU 23 19.947 29.108 -21.547 180 HD11 LEU 23 HD11 LEU 23 20.335 30.104 -19.408 181 HD12 LEU 23 HD12 LEU 23 21.902 30.078 -20.217 182 HD13 LEU 23 HD13 LEU 23 21.529 28.880 -18.978 183 HD21 LEU 23 HD21 LEU 23 22.424 28.617 -21.904 184 HD22 LEU 23 HD22 LEU 23 21.314 27.383 -22.501 185 HD23 LEU 23 HD23 LEU 23 22.173 27.135 -20.981 186 H ALA 24 HN ALA 24 16.960 27.074 -21.303 187 HA ALA 24 HA ALA 24 16.682 29.245 -23.089 188 HB1 ALA 24 HB1 ALA 24 14.524 27.189 -22.837 189 HB2 ALA 24 HB2 ALA 24 16.132 26.670 -23.343 190 HB3 ALA 24 HB3 ALA 24 15.256 27.875 -24.288 191 H ASN 25 HN ASN 25 14.751 28.147 -20.343 192 HA ASN 25 HA ASN 25 12.607 29.995 -20.730 193 HB2 ASN 25 HB2 ASN 25 12.574 27.845 -19.350 194 HB3 ASN 25 HB1 ASN 25 13.424 28.756 -18.104 195 HD21 ASN 25 HD21 ASN 25 11.609 28.741 -16.618 196 HD22 ASN 25 HD22 ASN 25 10.196 29.629 -16.927 197 H PHE 26 HN PHE 26 15.712 30.126 -19.134 198 HA PHE 26 HA PHE 26 15.240 32.413 -17.522 199 HB2 PHE 26 HB2 PHE 26 17.142 30.863 -17.184 200 HB3 PHE 26 HB1 PHE 26 17.855 31.436 -18.692 201 HD1 PHE 26 HD1 PHE 26 16.653 32.593 -15.349 202 HD2 PHE 26 HD2 PHE 26 19.162 33.402 -18.741 203 HE1 PHE 26 HE1 PHE 26 17.660 34.513 -14.146 204 HE2 PHE 26 HE2 PHE 26 20.169 35.323 -17.537 205 HZ PHE 26 HZ PHE 26 19.418 35.878 -15.240 206 H LEU 27 HN LEU 27 16.311 31.998 -20.861 207 HA LEU 27 HA LEU 27 17.171 34.621 -21.337 208 HB2 LEU 27 HB2 LEU 27 17.590 32.707 -22.865 209 HB3 LEU 27 HB1 LEU 27 15.881 32.653 -23.261 210 HG LEU 27 HG LEU 27 17.507 33.840 -24.898 211 HD11 LEU 27 HD11 LEU 27 15.173 35.574 -24.124 212 HD12 LEU 27 HD12 LEU 27 14.908 33.950 -24.757 213 HD13 LEU 27 HD13 LEU 27 15.763 35.146 -25.728 214 HD21 LEU 27 HD21 LEU 27 18.498 35.215 -22.944 215 HD22 LEU 27 HD22 LEU 27 17.052 36.212 -23.093 216 HD23 LEU 27 HD23 LEU 27 18.161 36.059 -24.455 217 H VAL 28 HN VAL 28 13.952 33.155 -21.548 218 HA VAL 28 HA VAL 28 12.760 35.686 -22.382 219 HB VAL 28 HB VAL 28 10.648 34.447 -22.389 220 HG11 VAL 28 HG11 VAL 28 12.339 34.262 -24.285 221 HG12 VAL 28 HG12 VAL 28 11.160 32.954 -24.190 222 HG13 VAL 28 HG13 VAL 28 12.804 32.704 -23.602 223 HG21 VAL 28 HG21 VAL 28 12.306 32.127 -21.345 224 HG22 VAL 28 HG22 VAL 28 10.598 32.069 -21.776 225 HG23 VAL 28 HG23 VAL 28 11.126 33.034 -20.399 226 H HIS 29 HN HIS 29 13.256 33.847 -19.464 227 HA HIS 29 HA HIS 29 11.289 35.133 -17.866 228 HB2 HIS 29 HB2 HIS 29 12.452 32.993 -17.273 229 HB3 HIS 29 HB1 HIS 29 13.909 33.933 -16.948 230 HD1 HIS 29 HD1 HIS 29 10.277 33.753 -15.813 231 HD2 HIS 29 HD2 HIS 29 13.984 35.038 -14.404 232 HE1 HIS 29 HE1 HIS 29 9.924 34.451 -13.405 233 HE2 HIS 29 HE2 HIS 29 12.175 35.237 -12.531 234 H SER 30 HN SER 30 14.431 36.039 -18.974 235 HA SER 30 HA SER 30 14.315 38.439 -17.255 236 HB2 SER 30 HB2 SER 30 16.244 37.019 -16.706 237 HB3 SER 30 HB1 SER 30 16.781 37.090 -18.382 238 HG SER 30 HG SER 30 17.056 38.906 -16.369 239 H SER 31 HN SER 31 13.542 37.607 -20.234 240 HA SER 31 HA SER 31 15.036 39.320 -21.922 241 HB2 SER 31 HB2 SER 31 13.675 37.515 -22.836 242 HB3 SER 31 HB1 SER 31 12.212 38.267 -22.208 243 HG SER 31 HG SER 31 12.257 39.662 -23.794 244 H ASN 32 HN ASN 32 12.121 39.826 -19.981 245 HA ASN 32 HA ASN 32 11.343 42.305 -21.021 246 HB2 ASN 32 HB2 ASN 32 10.334 42.657 -18.731 247 HB3 ASN 32 HB1 ASN 32 9.868 41.156 -19.529 248 HD21 ASN 32 HD21 ASN 32 10.958 42.368 -16.591 249 HD22 ASN 32 HD22 ASN 32 11.624 40.943 -15.954 250 H ASN 33 HN ASN 33 13.703 41.479 -18.530 251 HA ASN 33 HA ASN 33 14.255 44.141 -17.720 252 HB2 ASN 33 HB2 ASN 33 15.872 41.594 -17.540 253 HB3 ASN 33 HB1 ASN 33 16.413 43.125 -16.855 254 HD21 ASN 33 HD21 ASN 33 14.667 44.202 -15.350 255 HD22 ASN 33 HD22 ASN 33 13.809 43.145 -14.335 256 H PHE 34 HN PHE 34 15.672 41.984 -20.110 257 HA PHE 34 HA PHE 34 17.883 43.466 -20.906 258 HB2 PHE 34 HB2 PHE 34 17.394 41.192 -21.740 259 HB3 PHE 34 HB1 PHE 34 16.055 41.836 -22.691 260 HD1 PHE 34 HD1 PHE 34 19.739 41.858 -22.265 261 HD2 PHE 34 HD2 PHE 34 16.432 43.040 -24.738 262 HE1 PHE 34 HE1 PHE 34 21.313 42.440 -24.091 263 HE2 PHE 34 HE2 PHE 34 18.006 43.622 -26.564 264 HZ PHE 34 HZ PHE 34 20.446 43.322 -26.241 265 H GLY 35 HN GLY 35 14.493 43.927 -21.700 266 HA2 GLY 35 HA2 GLY 35 14.817 45.786 -23.817 267 HA3 GLY 35 HA1 GLY 35 13.391 45.634 -22.782 268 H ALA 36 HN ALA 36 13.936 46.451 -20.409 269 HA ALA 36 HA ALA 36 14.295 49.226 -20.551 270 HB1 ALA 36 HB1 ALA 36 14.728 48.910 -17.987 271 HB2 ALA 36 HB2 ALA 36 14.290 47.232 -18.311 272 HB3 ALA 36 HB3 ALA 36 13.142 48.526 -18.656 273 H ILE 37 HN ILE 37 16.573 46.622 -20.031 274 HA ILE 37 HA ILE 37 18.747 48.104 -19.030 275 HB ILE 37 HB ILE 37 18.541 45.514 -20.548 276 HG12 ILE 37 HG12 ILE 37 19.545 46.123 -17.754 277 HG13 ILE 37 HG11 ILE 37 17.853 45.774 -18.102 278 HG21 ILE 37 HG21 ILE 37 21.006 45.269 -19.904 279 HG22 ILE 37 HG22 ILE 37 21.010 47.014 -19.649 280 HG23 ILE 37 HG23 ILE 37 20.664 46.357 -21.248 281 HD11 ILE 37 HD11 ILE 37 20.083 43.916 -18.952 282 HD12 ILE 37 HD12 ILE 37 18.356 43.571 -18.860 283 HD13 ILE 37 HD13 ILE 37 19.293 43.782 -17.382 284 H LEU 38 HN LEU 38 17.600 47.493 -22.301 285 HA LEU 38 HA LEU 38 19.886 48.523 -23.654 286 HB2 LEU 38 HB2 LEU 38 18.235 47.036 -24.744 287 HB3 LEU 38 HB1 LEU 38 17.021 48.309 -24.618 288 HG LEU 38 HG LEU 38 18.514 49.799 -25.970 289 HD11 LEU 38 HD11 LEU 38 20.679 48.862 -25.570 290 HD12 LEU 38 HD12 LEU 38 20.330 48.557 -27.271 291 HD13 LEU 38 HD13 LEU 38 20.156 47.260 -26.090 292 HD21 LEU 38 HD21 LEU 38 17.939 48.806 -28.075 293 HD22 LEU 38 HD22 LEU 38 16.686 48.306 -26.939 294 HD23 LEU 38 HD23 LEU 38 17.967 47.181 -27.390 295 H SER 39 HN SER 39 17.090 49.976 -22.177 296 HA SER 39 HA SER 39 17.518 52.542 -23.490 297 HB2 SER 39 HB2 SER 39 15.586 51.696 -21.320 298 HB3 SER 39 HB1 SER 39 15.619 53.285 -22.079 299 HG SER 39 HG SER 39 14.276 52.297 -23.397 300 H SER 40 HN SER 40 18.523 50.891 -20.637 301 HA SER 40 HA SER 40 19.231 53.367 -19.248 302 HB2 SER 40 HB2 SER 40 19.594 50.474 -18.437 303 HB3 SER 40 HB1 SER 40 19.934 51.872 -17.422 304 HG SER 40 HG SER 40 17.499 50.796 -18.267 305 H THR 41 HN THR 41 20.517 52.680 -21.782 306 HA THR 41 HA THR 41 23.044 51.547 -21.538 307 HB THR 41 HB THR 41 22.200 52.104 -23.713 308 HG1 THR 41 HG1 THR 41 24.037 52.885 -24.496 309 HG21 THR 41 HG21 THR 41 22.083 54.604 -24.324 310 HG22 THR 41 HG22 THR 41 22.079 54.899 -22.585 311 HG23 THR 41 HG23 THR 41 20.782 53.958 -23.323 312 H ASN 42 HN ASN 42 21.864 54.555 -20.299 313 HA ASN 42 HA ASN 42 24.523 55.684 -19.934 314 HB2 ASN 42 HB2 ASN 42 23.304 57.552 -18.862 315 HB3 ASN 42 HB1 ASN 42 22.692 57.194 -20.476 316 HD21 ASN 42 HD21 ASN 42 20.698 58.370 -19.469 317 HD22 ASN 42 HD22 ASN 42 19.582 57.394 -18.642 318 H VAL 43 HN VAL 43 23.403 53.140 -18.528 319 HA VAL 43 HA VAL 43 23.649 53.972 -15.731 320 HB VAL 43 HB VAL 43 21.891 52.310 -16.666 321 HG11 VAL 43 HG11 VAL 43 24.186 50.375 -16.271 322 HG12 VAL 43 HG12 VAL 43 23.703 50.966 -17.861 323 HG13 VAL 43 HG13 VAL 43 22.571 50.029 -16.887 324 HG21 VAL 43 HG21 VAL 43 23.614 51.818 -14.226 325 HG22 VAL 43 HG22 VAL 43 22.136 50.909 -14.540 326 HG23 VAL 43 HG23 VAL 43 22.065 52.655 -14.307 327 H GLY 44 HN GLY 44 25.553 52.612 -18.259 328 HA2 GLY 44 HA2 GLY 44 28.006 52.747 -17.651 329 HA3 GLY 44 HA1 GLY 44 27.573 51.704 -16.300 330 H SER 45 HN SER 45 25.574 50.662 -18.632 331 HA SER 45 HA SER 45 27.405 48.504 -19.408 332 HB2 SER 45 HB2 SER 45 25.326 47.339 -20.112 333 HB3 SER 45 HB1 SER 45 25.299 47.802 -18.413 334 HG SER 45 HG SER 45 23.419 48.578 -19.101 335 H ASN 46 HN ASN 46 27.634 51.119 -20.625 336 HA ASN 46 HA ASN 46 26.495 50.825 -23.295 337 HB2 ASN 46 HB2 ASN 46 27.420 53.029 -23.718 338 HB3 ASN 46 HB1 ASN 46 26.562 53.041 -22.178 339 HD21 ASN 46 HD21 ASN 46 29.267 54.298 -23.486 340 HD22 ASN 46 HD22 ASN 46 30.306 54.263 -22.145 341 H THR 47 HN THR 47 28.691 49.027 -22.132 342 HA THR 47 HA THR 47 30.922 49.618 -23.923 343 HB THR 47 HB THR 47 31.950 47.611 -22.827 344 HG1 THR 47 HG1 THR 47 30.842 46.770 -21.042 345 HG21 THR 47 HG21 THR 47 32.136 50.006 -21.980 346 HG22 THR 47 HG22 THR 47 32.433 48.747 -20.781 347 HG23 THR 47 HG23 THR 47 30.885 49.592 -20.808 348 H TYR 48 HN TYR 48 28.153 48.706 -24.808 349 HA TYR 48 HA TYR 48 29.015 46.307 -26.310 350 HB2 TYR 48 HB2 TYR 48 26.773 45.535 -26.331 351 HB3 TYR 48 HB1 TYR 48 27.064 46.066 -24.674 352 HD1 TYR 48 HD1 TYR 48 24.971 46.425 -27.549 353 HD2 TYR 48 HD2 TYR 48 26.431 48.523 -24.096 354 HE1 TYR 48 HE1 TYR 48 23.093 48.034 -27.732 355 HE2 TYR 48 HE2 TYR 48 24.553 50.132 -24.280 356 HH TYR 48 HH TYR 48 22.027 49.731 -26.755 357 H GLY 49 HN GLY 49 29.252 49.299 -26.876 358 HA2 GLY 49 HA2 GLY 49 27.520 50.204 -28.820 359 HA3 GLY 49 HA1 GLY 49 29.241 50.577 -28.794 360 H LYS 50 HN LYS 50 26.908 49.437 -30.732 361 HA LYS 50 HA LYS 50 27.981 47.106 -31.905 362 HB2 LYS 50 HB2 LYS 50 26.181 49.270 -33.003 363 HB3 LYS 50 HB1 LYS 50 26.592 47.808 -33.900 364 HG2 LYS 50 HG2 LYS 50 25.753 46.470 -31.924 365 HG3 LYS 50 HG1 LYS 50 25.150 47.981 -31.243 366 HD2 LYS 50 HD2 LYS 50 24.407 47.015 -34.014 367 HD3 LYS 50 HD1 LYS 50 23.448 46.648 -32.580 368 HE2 LYS 50 HE2 LYS 50 24.155 49.440 -33.533 369 HE3 LYS 50 HE1 LYS 50 22.594 48.654 -33.765 370 HZ1 LYS 50 HZ1 LYS 50 22.820 48.334 -31.179 371 HZ2 LYS 50 HZ2 LYS 50 22.185 49.762 -31.844 372 HZ3 LYS 50 HZ3 LYS 50 23.800 49.711 -31.320 373 H ARG 51 HN ARG 51 28.527 50.538 -32.513 374 HA ARG 51 HA ARG 51 29.890 50.489 -34.905 375 HB2 ARG 51 HB2 ARG 51 30.973 52.529 -34.220 376 HB3 ARG 51 HB1 ARG 51 29.341 52.532 -33.552 377 HG2 ARG 51 HG2 ARG 51 30.272 51.645 -31.403 378 HG3 ARG 51 HG1 ARG 51 31.893 51.812 -32.080 379 HD2 ARG 51 HD2 ARG 51 31.483 54.232 -32.422 380 HD3 ARG 51 HD1 ARG 51 29.889 54.054 -31.695 381 HE ARG 51 HE ARG 51 32.426 54.122 -30.304 382 HH11 ARG 51 HH11 ARG 51 29.096 53.089 -30.206 383 HH12 ARG 51 HH12 ARG 51 29.037 53.048 -28.478 384 HH21 ARG 51 HH21 ARG 51 32.319 54.062 -28.050 385 HH22 ARG 51 HH22 ARG 51 30.848 53.594 -27.263 386 H ASN 52 HN ASN 52 31.005 49.444 -31.749 387 HA ASN 52 HA ASN 52 33.767 49.301 -32.299 388 HB2 ASN 52 HB2 ASN 52 32.593 49.058 -30.043 389 HB3 ASN 52 HB1 ASN 52 32.273 47.388 -30.507 390 HD21 ASN 52 HD21 ASN 52 34.202 45.984 -30.914 391 HD22 ASN 52 HD22 ASN 52 35.685 46.373 -30.186 392 H ALA 53 HN ALA 53 31.141 46.971 -32.727 393 HA ALA 53 HA ALA 53 32.731 44.796 -33.590 394 HB1 ALA 53 HB1 ALA 53 30.739 43.706 -34.011 395 HB2 ALA 53 HB2 ALA 53 29.948 45.161 -34.617 396 HB3 ALA 53 HB3 ALA 53 30.191 44.947 -32.884 397 H VAL 54 HN VAL 54 30.972 47.303 -35.416 398 HA VAL 54 HA VAL 54 31.720 46.304 -37.975 399 HB VAL 54 HB VAL 54 29.899 48.121 -37.111 400 HG11 VAL 54 HG11 VAL 54 31.993 49.765 -38.551 401 HG12 VAL 54 HG12 VAL 54 31.836 49.759 -36.795 402 HG13 VAL 54 HG13 VAL 54 30.503 50.327 -37.796 403 HG21 VAL 54 HG21 VAL 54 29.701 48.704 -39.588 404 HG22 VAL 54 HG22 VAL 54 29.692 46.982 -39.208 405 HG23 VAL 54 HG23 VAL 54 31.155 47.738 -39.839 406 H GLU 55 HN GLU 55 33.352 48.211 -35.608 407 HA GLU 55 HA GLU 55 35.155 49.538 -37.400 408 HB2 GLU 55 HB2 GLU 55 34.888 49.222 -34.456 409 HB3 GLU 55 HB1 GLU 55 36.494 49.610 -35.075 410 HG2 GLU 55 HG2 GLU 55 33.989 51.146 -35.814 411 HG3 GLU 55 HG1 GLU 55 35.094 51.632 -34.529 412 H VAL 56 HN VAL 56 35.638 46.871 -35.065 413 HA VAL 56 HA VAL 56 38.219 46.182 -35.889 414 HB VAL 56 HB VAL 56 37.190 45.339 -33.816 415 HG11 VAL 56 HG11 VAL 56 35.532 43.639 -35.704 416 HG12 VAL 56 HG12 VAL 56 34.923 44.948 -34.692 417 HG13 VAL 56 HG13 VAL 56 35.562 43.484 -33.948 418 HG21 VAL 56 HG21 VAL 56 38.084 43.086 -33.943 419 HG22 VAL 56 HG22 VAL 56 39.096 44.136 -34.934 420 HG23 VAL 56 HG23 VAL 56 37.914 43.073 -35.698 421 H LEU 57 HN LEU 57 35.092 45.411 -37.242 422 HA LEU 57 HA LEU 57 35.699 43.217 -38.834 423 HB2 LEU 57 HB2 LEU 57 33.613 45.210 -38.712 424 HB3 LEU 57 HB1 LEU 57 34.017 44.852 -40.392 425 HG LEU 57 HG LEU 57 33.935 42.364 -39.654 426 HD11 LEU 57 HD11 LEU 57 33.823 43.040 -37.198 427 HD12 LEU 57 HD12 LEU 57 32.620 41.859 -37.717 428 HD13 LEU 57 HD13 LEU 57 32.163 43.549 -37.506 429 HD21 LEU 57 HD21 LEU 57 32.279 43.445 -41.140 430 HD22 LEU 57 HD22 LEU 57 31.401 44.036 -39.729 431 HD23 LEU 57 HD23 LEU 57 31.497 42.304 -40.047 432 H LYS 58 HN LYS 58 36.056 46.677 -39.541 433 HA LYS 58 HA LYS 58 37.068 46.437 -42.165 434 HB2 LYS 58 HB2 LYS 58 37.391 48.557 -40.040 435 HB3 LYS 58 HB1 LYS 58 38.077 48.719 -41.657 436 HG2 LYS 58 HG2 LYS 58 35.180 47.988 -41.356 437 HG3 LYS 58 HG1 LYS 58 35.674 49.671 -41.166 438 HD2 LYS 58 HD2 LYS 58 36.851 49.496 -43.388 439 HD3 LYS 58 HD1 LYS 58 36.122 47.902 -43.584 440 HE2 LYS 58 HE2 LYS 58 34.504 50.405 -43.056 441 HE3 LYS 58 HE1 LYS 58 34.840 49.797 -44.677 442 HZ1 LYS 58 HZ1 LYS 58 33.511 47.998 -44.384 443 HZ2 LYS 58 HZ2 LYS 58 32.705 49.076 -43.347 444 HZ3 LYS 58 HZ3 LYS 58 33.772 47.917 -42.711 445 H ARG 59 HN ARG 59 38.645 46.416 -39.004 446 HA ARG 59 HA ARG 59 41.317 46.471 -39.959 447 HB2 ARG 59 HB2 ARG 59 40.387 46.883 -37.566 448 HB3 ARG 59 HB1 ARG 59 40.518 45.132 -37.392 449 HG2 ARG 59 HG2 ARG 59 42.912 46.242 -38.611 450 HG3 ARG 59 HG1 ARG 59 42.582 46.999 -37.052 451 HD2 ARG 59 HD2 ARG 59 42.338 44.729 -36.047 452 HD3 ARG 59 HD1 ARG 59 42.790 44.024 -37.597 453 HE ARG 59 HE ARG 59 44.709 45.938 -36.592 454 HH11 ARG 59 HH11 ARG 59 43.643 42.617 -36.542 455 HH12 ARG 59 HH12 ARG 59 45.195 42.002 -36.089 456 HH21 ARG 59 HH21 ARG 59 46.725 45.106 -36.003 457 HH22 ARG 59 HH22 ARG 59 46.930 43.400 -35.785 458 H GLU 60 HN GLU 60 38.961 44.065 -40.211 459 HA GLU 60 HA GLU 60 41.041 41.991 -40.553 460 HB2 GLU 60 HB2 GLU 60 38.167 41.643 -39.672 461 HB3 GLU 60 HB1 GLU 60 39.312 40.333 -39.961 462 HG2 GLU 60 HG2 GLU 60 39.672 42.554 -37.928 463 HG3 GLU 60 HG1 GLU 60 39.178 40.904 -37.555 464 HA PRO 61 HA PRO 61 38.881 42.834 -44.609 465 HB2 PRO 61 HB2 PRO 61 41.210 42.721 -46.085 466 HB3 PRO 61 HB1 PRO 61 40.529 44.210 -45.405 467 HG2 PRO 61 HG2 PRO 61 42.752 42.512 -44.400 468 HG3 PRO 61 HG1 PRO 61 42.577 44.275 -44.385 469 HD2 PRO 61 HD2 PRO 61 42.161 42.741 -42.168 470 HD3 PRO 61 HD1 PRO 61 41.298 44.269 -42.454 471 H LEU 62 HN LEU 62 40.959 40.406 -43.309 472 HA LEU 62 HA LEU 62 41.117 38.576 -45.419 473 HB2 LEU 62 HB2 LEU 62 42.414 38.346 -43.348 474 HB3 LEU 62 HB1 LEU 62 40.933 38.042 -42.442 475 HG LEU 62 HG LEU 62 40.513 36.033 -43.854 476 HD11 LEU 62 HD11 LEU 62 41.658 36.597 -45.885 477 HD12 LEU 62 HD12 LEU 62 42.518 35.219 -45.199 478 HD13 LEU 62 HD13 LEU 62 43.182 36.845 -45.032 479 HD21 LEU 62 HD21 LEU 62 43.295 35.955 -42.662 480 HD22 LEU 62 HD22 LEU 62 42.128 34.637 -42.762 481 HD23 LEU 62 HD23 LEU 62 41.835 35.994 -41.674 482 H ASN 63 HN ASN 63 38.595 39.144 -43.011 483 HA ASN 63 HA ASN 63 36.971 36.940 -43.989 484 HB2 ASN 63 HB2 ASN 63 35.705 37.231 -42.109 485 HB3 ASN 63 HB1 ASN 63 37.174 38.028 -41.548 486 HD21 ASN 63 HD21 ASN 63 33.839 38.552 -42.510 487 HD22 ASN 63 HD22 ASN 63 33.808 40.216 -42.174 488 H TYR 64 HN TYR 64 37.377 40.299 -44.636 489 HA TYR 64 HA TYR 64 34.732 40.807 -45.620 490 HB2 TYR 64 HB2 TYR 64 36.299 42.584 -44.813 491 HB3 TYR 64 HB1 TYR 64 37.288 42.301 -46.245 492 HD1 TYR 64 HD1 TYR 64 33.994 43.477 -45.032 493 HD2 TYR 64 HD2 TYR 64 36.580 43.033 -48.433 494 HE1 TYR 64 HE1 TYR 64 32.509 44.958 -46.354 495 HE2 TYR 64 HE2 TYR 64 35.094 44.514 -49.755 496 HH TYR 64 HH TYR 64 31.976 45.355 -48.754 497 H LEU 65 HN LEU 65 37.787 39.757 -47.030 498 HA LEU 65 HA LEU 65 36.528 39.653 -49.687 499 HB2 LEU 65 HB2 LEU 65 39.430 39.390 -48.862 500 HB3 LEU 65 HB1 LEU 65 38.840 39.326 -50.522 501 HG LEU 65 HG LEU 65 38.374 41.673 -48.663 502 HD11 LEU 65 HD11 LEU 65 40.101 42.777 -50.181 503 HD12 LEU 65 HD12 LEU 65 40.512 41.157 -50.743 504 HD13 LEU 65 HD13 LEU 65 40.737 41.585 -49.047 505 HD21 LEU 65 HD21 LEU 65 37.934 42.784 -50.927 506 HD22 LEU 65 HD22 LEU 65 36.724 41.615 -50.401 507 HD23 LEU 65 HD23 LEU 65 37.919 41.160 -51.615 508 HA PRO 66 HA PRO 66 36.028 35.279 -49.795 509 HB2 PRO 66 HB2 PRO 66 37.808 35.180 -52.187 510 HB3 PRO 66 HB1 PRO 66 36.154 34.572 -51.985 511 HG2 PRO 66 HG2 PRO 66 36.659 36.785 -53.371 512 HG3 PRO 66 HG1 PRO 66 35.207 36.626 -52.368 513 HD2 PRO 66 HD2 PRO 66 37.688 38.206 -51.851 514 HD3 PRO 66 HD1 PRO 66 36.011 38.546 -51.374 515 H LEU 67 HN LEU 67 37.009 33.554 -48.841 516 HA LEU 67 HA LEU 67 39.955 33.632 -48.578 517 HB2 LEU 67 HB2 LEU 67 38.080 33.788 -46.544 518 HB3 LEU 67 HB1 LEU 67 38.546 32.086 -46.540 519 HG LEU 67 HG LEU 67 40.493 34.411 -46.494 520 HD11 LEU 67 HD11 LEU 67 39.443 32.584 -44.319 521 HD12 LEU 67 HD12 LEU 67 39.368 34.345 -44.374 522 HD13 LEU 67 HD13 LEU 67 40.918 33.535 -44.144 523 HD21 LEU 67 HD21 LEU 67 41.439 32.431 -47.552 524 HD22 LEU 67 HD22 LEU 67 40.843 31.406 -46.247 525 HD23 LEU 67 HD23 LEU 67 42.119 32.582 -45.931 Start of MODEL 10 1 H1 THR 1 HT1 THR 1 -3.668 -5.272 -0.885 2 H2 THR 1 HT2 THR 1 -3.731 -3.972 0.207 3 H3 THR 1 HT3 THR 1 -3.780 -5.571 0.781 4 HA THR 1 HA THR 1 -1.579 -5.884 0.595 5 HB THR 1 HB THR 1 -2.107 -4.725 -1.970 6 HG1 THR 1 HG1 THR 1 0.280 -5.944 -1.084 7 HG21 THR 1 HG21 THR 1 0.023 -3.534 -2.352 8 HG22 THR 1 HG22 THR 1 0.407 -3.667 -0.639 9 HG23 THR 1 HG23 THR 1 -0.971 -2.697 -1.163 10 HA PRO 2 HA PRO 2 -0.552 -2.508 3.275 11 HB2 PRO 2 HB2 PRO 2 2.153 -2.776 3.509 12 HB3 PRO 2 HB1 PRO 2 1.001 -3.893 4.266 13 HG2 PRO 2 HG2 PRO 2 2.595 -4.218 1.775 14 HG3 PRO 2 HG1 PRO 2 2.202 -5.406 3.030 15 HD2 PRO 2 HD2 PRO 2 0.891 -5.267 0.619 16 HD3 PRO 2 HD1 PRO 2 0.150 -5.905 2.102 17 H ILE 3 HN ILE 3 0.368 -0.399 3.344 18 HA ILE 3 HA ILE 3 0.444 1.045 0.990 19 HB ILE 3 HB ILE 3 0.317 1.921 3.384 20 HG12 ILE 3 HG12 ILE 3 1.635 4.029 2.732 21 HG13 ILE 3 HG11 ILE 3 2.064 3.170 1.253 22 HG21 ILE 3 HG21 ILE 3 2.464 0.716 4.040 23 HG22 ILE 3 HG22 ILE 3 2.369 2.410 4.523 24 HG23 ILE 3 HG23 ILE 3 3.333 1.945 3.120 25 HD11 ILE 3 HD11 ILE 3 -0.802 3.487 2.167 26 HD12 ILE 3 HD12 ILE 3 -0.220 2.994 0.576 27 HD13 ILE 3 HD13 ILE 3 -0.009 4.660 1.115 28 H GLU 4 HN GLU 4 2.030 1.739 -0.411 29 HA GLU 4 HA GLU 4 4.169 0.031 -0.978 30 HB2 GLU 4 HB2 GLU 4 4.931 1.760 -2.522 31 HB3 GLU 4 HB1 GLU 4 3.175 1.618 -2.603 32 HG2 GLU 4 HG2 GLU 4 2.966 3.531 -1.036 33 HG3 GLU 4 HG1 GLU 4 4.721 3.694 -1.024 34 H SER 5 HN SER 5 6.453 0.361 -0.810 35 HA SER 5 HA SER 5 7.281 1.241 1.775 36 HB2 SER 5 HB2 SER 5 9.494 0.573 1.090 37 HB3 SER 5 HB1 SER 5 8.352 -0.617 0.471 38 HG SER 5 HG SER 5 9.891 0.104 -1.101 39 H HIS 6 HN HIS 6 8.967 2.847 2.179 40 HA HIS 6 HA HIS 6 8.537 5.242 0.525 41 HB2 HIS 6 HB2 HIS 6 9.428 6.476 2.470 42 HB3 HIS 6 HB1 HIS 6 8.042 5.479 2.911 43 HD1 HIS 6 HD1 HIS 6 11.819 5.551 3.159 44 HD2 HIS 6 HD2 HIS 6 8.601 3.438 4.759 45 HE1 HIS 6 HE1 HIS 6 12.760 4.112 5.018 46 HE2 HIS 6 HE2 HIS 6 10.811 2.817 6.004 47 H GLN 7 HN GLN 7 10.421 2.947 -0.061 48 HA GLN 7 HA GLN 7 13.085 3.857 0.354 49 HB2 GLN 7 HB2 GLN 7 12.446 1.495 -0.172 50 HB3 GLN 7 HB1 GLN 7 12.072 2.009 -1.817 51 HG2 GLN 7 HG2 GLN 7 14.395 2.827 -2.078 52 HG3 GLN 7 HG1 GLN 7 14.765 2.267 -0.448 53 HE21 GLN 7 HE21 GLN 7 15.890 0.325 -0.553 54 HE22 GLN 7 HE22 GLN 7 15.574 -0.926 -1.656 55 H VAL 8 HN VAL 8 14.307 5.255 -0.772 56 HA VAL 8 HA VAL 8 13.324 6.191 -3.393 57 HB VAL 8 HB VAL 8 12.695 7.853 -1.689 58 HG11 VAL 8 HG11 VAL 8 14.490 7.271 -0.064 59 HG12 VAL 8 HG12 VAL 8 14.431 9.002 -0.398 60 HG13 VAL 8 HG13 VAL 8 15.677 8.002 -1.145 61 HG21 VAL 8 HG21 VAL 8 13.509 8.495 -4.016 62 HG22 VAL 8 HG22 VAL 8 15.072 8.853 -3.280 63 HG23 VAL 8 HG23 VAL 8 13.640 9.763 -2.797 64 H GLU 9 HN GLU 9 14.890 6.623 -4.901 65 HA GLU 9 HA GLU 9 17.704 6.373 -4.057 66 HB2 GLU 9 HB2 GLU 9 17.908 5.125 -6.387 67 HB3 GLU 9 HB1 GLU 9 17.487 4.246 -4.919 68 HG2 GLU 9 HG2 GLU 9 15.992 3.704 -6.851 69 HG3 GLU 9 HG1 GLU 9 15.122 4.355 -5.466 70 H LYS 10 HN LYS 10 16.989 8.813 -4.326 71 HA LYS 10 HA LYS 10 16.753 9.906 -6.923 72 HB2 LYS 10 HB2 LYS 10 17.300 12.039 -5.870 73 HB3 LYS 10 HB1 LYS 10 16.185 11.135 -4.845 74 HG2 LYS 10 HG2 LYS 10 18.102 10.326 -3.496 75 HG3 LYS 10 HG1 LYS 10 19.195 11.281 -4.499 76 HD2 LYS 10 HD2 LYS 10 17.942 13.336 -3.851 77 HD3 LYS 10 HD1 LYS 10 16.943 12.357 -2.776 78 HE2 LYS 10 HE2 LYS 10 19.959 12.621 -2.595 79 HE3 LYS 10 HE1 LYS 10 18.802 13.442 -1.548 80 HZ1 LYS 10 HZ1 LYS 10 19.491 10.591 -1.682 81 HZ2 LYS 10 HZ2 LYS 10 17.930 11.038 -1.180 82 HZ3 LYS 10 HZ3 LYS 10 19.291 11.587 -0.324 83 H ARG 11 HN ARG 11 18.310 11.000 -8.202 84 HA ARG 11 HA ARG 11 21.121 10.375 -7.601 85 HB2 ARG 11 HB2 ARG 11 21.259 10.063 -10.237 86 HB3 ARG 11 HB1 ARG 11 20.895 8.717 -9.168 87 HG2 ARG 11 HG2 ARG 11 19.288 8.568 -10.902 88 HG3 ARG 11 HG1 ARG 11 18.402 9.291 -9.570 89 HD2 ARG 11 HD2 ARG 11 19.794 11.059 -11.559 90 HD3 ARG 11 HD1 ARG 11 18.247 10.337 -11.976 91 HE ARG 11 HE ARG 11 18.699 12.453 -10.056 92 HH11 ARG 11 HH11 ARG 11 16.596 9.861 -11.072 93 HH12 ARG 11 HH12 ARG 11 15.193 10.553 -10.336 94 HH21 ARG 11 HH21 ARG 11 16.848 13.333 -9.107 95 HH22 ARG 11 HH22 ARG 11 15.332 12.505 -9.230 96 H LYS 12 HN LYS 12 20.589 12.733 -6.930 97 HA LYS 12 HA LYS 12 20.182 14.795 -8.732 98 HB2 LYS 12 HB2 LYS 12 21.389 16.229 -7.136 99 HB3 LYS 12 HB1 LYS 12 20.293 15.129 -6.300 100 HG2 LYS 12 HG2 LYS 12 22.197 13.580 -5.894 101 HG3 LYS 12 HG1 LYS 12 23.280 14.747 -6.655 102 HD2 LYS 12 HD2 LYS 12 22.738 16.417 -4.962 103 HD3 LYS 12 HD1 LYS 12 21.552 15.334 -4.233 104 HE2 LYS 12 HE2 LYS 12 23.635 15.242 -2.954 105 HE3 LYS 12 HE1 LYS 12 23.372 13.700 -3.768 106 HZ1 LYS 12 HZ1 LYS 12 25.667 14.603 -3.965 107 HZ2 LYS 12 HZ2 LYS 12 25.038 15.883 -4.888 108 HZ3 LYS 12 HZ3 LYS 12 24.915 14.285 -5.452 109 H CYS 13 HN CYS 13 21.690 16.294 -9.711 110 HA CYS 13 HA CYS 13 23.917 14.877 -10.961 111 HB2 CYS 13 HB2 CYS 13 22.141 16.449 -12.111 112 HB3 CYS 13 HB1 CYS 13 23.239 17.724 -11.581 113 H ASN 14 HN ASN 14 25.529 14.774 -9.440 114 HA ASN 14 HA ASN 14 26.549 17.353 -8.414 115 HB2 ASN 14 HB2 ASN 14 27.652 16.026 -6.652 116 HB3 ASN 14 HB1 ASN 14 25.903 15.803 -6.642 117 HD21 ASN 14 HD21 ASN 14 26.778 13.717 -5.437 118 HD22 ASN 14 HD22 ASN 14 27.064 12.368 -6.428 119 H THR 15 HN THR 15 27.092 15.345 -10.912 120 HA THR 15 HA THR 15 29.936 14.962 -10.705 121 HB THR 15 HB THR 15 28.483 13.463 -12.047 122 HG1 THR 15 HG1 THR 15 30.372 14.914 -13.584 123 HG21 THR 15 HG21 THR 15 28.227 15.883 -13.854 124 HG22 THR 15 HG22 THR 15 26.928 15.184 -12.888 125 HG23 THR 15 HG23 THR 15 27.633 14.263 -14.215 126 H ALA 16 HN ALA 16 31.509 15.948 -12.114 127 HA ALA 16 HA ALA 16 31.436 18.749 -12.108 128 HB1 ALA 16 HB1 ALA 16 33.151 17.302 -14.086 129 HB2 ALA 16 HB2 ALA 16 33.430 17.039 -12.364 130 HB3 ALA 16 HB3 ALA 16 33.552 18.664 -13.039 131 H THR 17 HN THR 17 30.472 16.425 -14.549 132 HA THR 17 HA THR 17 30.378 17.989 -16.830 133 HB THR 17 HB THR 17 28.343 15.925 -15.952 134 HG1 THR 17 HG1 THR 17 30.144 14.807 -16.077 135 HG21 THR 17 HG21 THR 17 28.091 15.663 -18.459 136 HG22 THR 17 HG22 THR 17 29.019 17.152 -18.633 137 HG23 THR 17 HG23 THR 17 27.463 17.175 -17.805 138 H CYS 18 HN CYS 18 28.001 17.780 -14.200 139 HA CYS 18 HA CYS 18 26.163 19.614 -15.421 140 HB2 CYS 18 HB2 CYS 18 26.380 18.173 -12.839 141 HB3 CYS 18 HB1 CYS 18 25.463 19.679 -12.815 142 H ALA 19 HN ALA 19 28.765 19.857 -13.045 143 HA ALA 19 HA ALA 19 28.304 22.472 -12.152 144 HB1 ALA 19 HB1 ALA 19 30.735 20.730 -12.362 145 HB2 ALA 19 HB2 ALA 19 29.926 21.351 -10.923 146 HB3 ALA 19 HB3 ALA 19 30.919 22.425 -11.910 147 H THR 20 HN THR 20 30.209 21.287 -14.911 148 HA THR 20 HA THR 20 31.170 23.792 -15.768 149 HB THR 20 HB THR 20 30.590 21.305 -17.394 150 HG1 THR 20 HG1 THR 20 32.206 20.608 -16.269 151 HG21 THR 20 HG21 THR 20 32.274 23.760 -17.958 152 HG22 THR 20 HG22 THR 20 30.840 23.237 -18.843 153 HG23 THR 20 HG23 THR 20 32.320 22.281 -18.918 154 H GLN 21 HN GLN 21 28.182 22.040 -16.506 155 HA GLN 21 HA GLN 21 27.238 23.530 -18.632 156 HB2 GLN 21 HB2 GLN 21 25.345 22.345 -18.343 157 HB3 GLN 21 HB1 GLN 21 26.219 21.529 -17.051 158 HG2 GLN 21 HG2 GLN 21 25.363 23.303 -15.468 159 HG3 GLN 21 HG1 GLN 21 24.347 23.896 -16.780 160 HE21 GLN 21 HE21 GLN 21 22.900 23.059 -14.657 161 HE22 GLN 21 HE22 GLN 21 22.229 21.522 -14.917 162 H ARG 22 HN ARG 22 27.353 24.413 -15.226 163 HA ARG 22 HA ARG 22 25.680 26.741 -15.635 164 HB2 ARG 22 HB2 ARG 22 25.706 27.019 -13.355 165 HB3 ARG 22 HB1 ARG 22 26.067 25.300 -13.445 166 HG2 ARG 22 HG2 ARG 22 27.762 25.943 -12.031 167 HG3 ARG 22 HG1 ARG 22 28.584 26.229 -13.558 168 HD2 ARG 22 HD2 ARG 22 28.833 28.383 -12.956 169 HD3 ARG 22 HD1 ARG 22 27.084 28.564 -13.042 170 HE ARG 22 HE ARG 22 27.011 28.500 -10.721 171 HH11 ARG 22 HH11 ARG 22 30.108 27.382 -11.868 172 HH12 ARG 22 HH12 ARG 22 30.811 27.339 -10.288 173 HH21 ARG 22 HH21 ARG 22 27.956 28.439 -8.669 174 HH22 ARG 22 HH22 ARG 22 29.602 27.933 -8.487 175 H LEU 23 HN LEU 23 29.044 25.973 -15.812 176 HA LEU 23 HA LEU 23 30.159 28.527 -15.388 177 HB2 LEU 23 HB2 LEU 23 31.522 26.474 -15.517 178 HB3 LEU 23 HB1 LEU 23 31.128 26.321 -17.229 179 HG LEU 23 HG LEU 23 32.168 28.558 -17.628 180 HD11 LEU 23 HD11 LEU 23 31.960 29.611 -15.489 181 HD12 LEU 23 HD12 LEU 23 33.688 29.370 -15.744 182 HD13 LEU 23 HD13 LEU 23 32.793 28.284 -14.680 183 HD21 LEU 23 HD21 LEU 23 34.494 27.784 -17.368 184 HD22 LEU 23 HD22 LEU 23 33.463 26.470 -17.934 185 HD23 LEU 23 HD23 LEU 23 33.959 26.536 -16.242 186 H ALA 24 HN ALA 24 28.908 26.948 -18.303 187 HA ALA 24 HA ALA 24 29.550 29.026 -20.118 188 HB1 ALA 24 HB1 ALA 24 28.129 27.907 -21.661 189 HB2 ALA 24 HB2 ALA 24 27.182 27.169 -20.369 190 HB3 ALA 24 HB3 ALA 24 28.836 26.633 -20.667 191 H ASN 25 HN ASN 25 26.690 28.344 -18.146 192 HA ASN 25 HA ASN 25 25.076 30.446 -19.149 193 HB2 ASN 25 HB2 ASN 25 25.070 28.952 -16.523 194 HB3 ASN 25 HB1 ASN 25 23.864 30.170 -16.934 195 HD21 ASN 25 HD21 ASN 25 23.192 27.386 -16.531 196 HD22 ASN 25 HD22 ASN 25 22.650 26.767 -18.016 197 H PHE 26 HN PHE 26 27.439 30.266 -16.535 198 HA PHE 26 HA PHE 26 26.936 32.864 -15.475 199 HB2 PHE 26 HB2 PHE 26 28.097 31.063 -14.218 200 HB3 PHE 26 HB1 PHE 26 29.468 31.214 -15.317 201 HD1 PHE 26 HD1 PHE 26 27.406 33.059 -12.824 202 HD2 PHE 26 HD2 PHE 26 31.068 32.959 -15.067 203 HE1 PHE 26 HE1 PHE 26 28.286 34.942 -11.471 204 HE2 PHE 26 HE2 PHE 26 31.948 34.842 -13.713 205 HZ PHE 26 HZ PHE 26 30.557 35.833 -11.916 206 H LEU 27 HN LEU 27 28.874 31.645 -18.105 207 HA LEU 27 HA LEU 27 30.621 33.821 -18.425 208 HB2 LEU 27 HB2 LEU 27 30.901 31.619 -19.536 209 HB3 LEU 27 HB1 LEU 27 29.482 31.937 -20.518 210 HG LEU 27 HG LEU 27 31.832 32.338 -21.541 211 HD11 LEU 27 HD11 LEU 27 30.014 34.716 -21.833 212 HD12 LEU 27 HD12 LEU 27 29.489 33.121 -22.368 213 HD13 LEU 27 HD13 LEU 27 30.932 33.854 -23.064 214 HD21 LEU 27 HD21 LEU 27 32.483 33.774 -19.474 215 HD22 LEU 27 HD22 LEU 27 31.574 35.058 -20.267 216 HD23 LEU 27 HD23 LEU 27 32.966 34.340 -21.072 217 H VAL 28 HN VAL 28 27.328 33.256 -19.579 218 HA VAL 28 HA VAL 28 27.331 35.846 -20.961 219 HB VAL 28 HB VAL 28 25.152 35.193 -21.824 220 HG11 VAL 28 HG11 VAL 28 27.304 34.267 -22.818 221 HG12 VAL 28 HG12 VAL 28 25.846 33.344 -23.180 222 HG13 VAL 28 HG13 VAL 28 26.965 32.774 -21.943 223 HG21 VAL 28 HG21 VAL 28 25.468 32.744 -20.057 224 HG22 VAL 28 HG22 VAL 28 24.162 33.014 -21.210 225 HG23 VAL 28 HG23 VAL 28 24.317 34.054 -19.795 226 H HIS 29 HN HIS 29 26.081 34.312 -18.075 227 HA HIS 29 HA HIS 29 24.103 36.223 -17.408 228 HB2 HIS 29 HB2 HIS 29 24.377 33.987 -16.314 229 HB3 HIS 29 HB1 HIS 29 25.807 34.615 -15.496 230 HD1 HIS 29 HD1 HIS 29 22.127 35.552 -15.897 231 HD2 HIS 29 HD2 HIS 29 25.213 35.878 -13.113 232 HE1 HIS 29 HE1 HIS 29 21.115 36.598 -13.825 233 HE2 HIS 29 HE2 HIS 29 22.984 36.804 -12.118 234 H SER 30 HN SER 30 27.548 35.995 -16.632 235 HA SER 30 HA SER 30 27.538 38.439 -15.113 236 HB2 SER 30 HB2 SER 30 29.132 36.638 -14.598 237 HB3 SER 30 HB1 SER 30 29.864 36.826 -16.189 238 HG SER 30 HG SER 30 30.207 39.080 -15.532 239 H SER 31 HN SER 31 27.743 37.649 -18.435 240 HA SER 31 HA SER 31 29.438 39.496 -19.558 241 HB2 SER 31 HB2 SER 31 28.119 37.812 -20.823 242 HB3 SER 31 HB1 SER 31 26.679 38.798 -20.584 243 HG SER 31 HG SER 31 29.083 39.697 -21.801 244 H ASN 32 HN ASN 32 26.385 40.112 -17.961 245 HA ASN 32 HA ASN 32 25.798 42.636 -19.032 246 HB2 ASN 32 HB2 ASN 32 24.508 43.010 -16.987 247 HB3 ASN 32 HB1 ASN 32 24.254 41.370 -17.578 248 HD21 ASN 32 HD21 ASN 32 24.270 42.658 -14.729 249 HD22 ASN 32 HD22 ASN 32 25.260 41.603 -13.840 250 H ASN 33 HN ASN 33 27.929 41.672 -16.393 251 HA ASN 33 HA ASN 33 28.570 44.293 -15.521 252 HB2 ASN 33 HB2 ASN 33 30.027 41.659 -15.255 253 HB3 ASN 33 HB1 ASN 33 30.603 43.153 -14.518 254 HD21 ASN 33 HD21 ASN 33 28.572 44.355 -13.324 255 HD22 ASN 33 HD22 ASN 33 27.691 43.327 -12.300 256 H PHE 34 HN PHE 34 29.976 42.099 -17.876 257 HA PHE 34 HA PHE 34 32.348 43.412 -18.503 258 HB2 PHE 34 HB2 PHE 34 31.716 41.209 -19.420 259 HB3 PHE 34 HB1 PHE 34 30.497 41.987 -20.428 260 HD1 PHE 34 HD1 PHE 34 34.151 41.819 -19.737 261 HD2 PHE 34 HD2 PHE 34 31.078 43.065 -22.468 262 HE1 PHE 34 HE1 PHE 34 35.873 42.304 -21.453 263 HE2 PHE 34 HE2 PHE 34 32.801 43.551 -24.184 264 HZ PHE 34 HZ PHE 34 35.198 43.170 -23.677 265 H GLY 35 HN GLY 35 29.055 44.103 -19.577 266 HA2 GLY 35 HA2 GLY 35 29.664 45.985 -21.586 267 HA3 GLY 35 HA1 GLY 35 28.158 45.916 -20.673 268 H ALA 36 HN ALA 36 28.703 46.581 -18.184 269 HA ALA 36 HA ALA 36 29.171 49.351 -18.233 270 HB1 ALA 36 HB1 ALA 36 28.989 49.278 -15.860 271 HB2 ALA 36 HB2 ALA 36 29.504 47.593 -15.801 272 HB3 ALA 36 HB3 ALA 36 27.923 48.009 -16.463 273 H ILE 37 HN ILE 37 31.297 46.624 -17.592 274 HA ILE 37 HA ILE 37 33.501 48.012 -16.540 275 HB ILE 37 HB ILE 37 33.269 45.433 -18.084 276 HG12 ILE 37 HG12 ILE 37 34.055 45.967 -15.206 277 HG13 ILE 37 HG11 ILE 37 32.387 45.684 -15.703 278 HG21 ILE 37 HG21 ILE 37 35.656 45.066 -17.252 279 HG22 ILE 37 HG22 ILE 37 35.718 46.803 -16.949 280 HG23 ILE 37 HG23 ILE 37 35.477 46.201 -18.590 281 HD11 ILE 37 HD11 ILE 37 34.628 43.764 -16.372 282 HD12 ILE 37 HD12 ILE 37 32.890 43.478 -16.474 283 HD13 ILE 37 HD13 ILE 37 33.668 43.627 -14.899 284 H LEU 38 HN LEU 38 32.416 47.464 -19.831 285 HA LEU 38 HA LEU 38 34.784 48.297 -21.158 286 HB2 LEU 38 HB2 LEU 38 32.902 46.995 -22.202 287 HB3 LEU 38 HB1 LEU 38 31.947 48.477 -22.193 288 HG LEU 38 HG LEU 38 33.809 49.580 -23.500 289 HD11 LEU 38 HD11 LEU 38 35.686 48.185 -23.047 290 HD12 LEU 38 HD12 LEU 38 35.287 47.876 -24.736 291 HD13 LEU 38 HD13 LEU 38 34.805 46.723 -23.491 292 HD21 LEU 38 HD21 LEU 38 31.858 48.886 -24.709 293 HD22 LEU 38 HD22 LEU 38 32.331 47.189 -24.629 294 HD23 LEU 38 HD23 LEU 38 33.240 48.312 -25.641 295 H SER 39 HN SER 39 32.065 50.030 -19.786 296 HA SER 39 HA SER 39 32.516 52.510 -21.103 297 HB2 SER 39 HB2 SER 39 31.183 51.864 -18.465 298 HB3 SER 39 HB1 SER 39 31.173 53.458 -19.214 299 HG SER 39 HG SER 39 29.497 51.537 -19.658 300 H SER 40 HN SER 40 33.721 51.083 -18.106 301 HA SER 40 HA SER 40 35.385 53.462 -17.629 302 HB2 SER 40 HB2 SER 40 34.823 51.058 -15.878 303 HB3 SER 40 HB1 SER 40 35.829 52.430 -15.424 304 HG SER 40 HG SER 40 33.987 53.218 -14.764 305 H THR 41 HN THR 41 35.841 51.398 -19.756 306 HA THR 41 HA THR 41 37.899 49.632 -19.162 307 HB THR 41 HB THR 41 36.679 49.825 -21.352 308 HG1 THR 41 HG1 THR 41 38.368 48.548 -21.567 309 HG21 THR 41 HG21 THR 41 37.414 51.451 -22.974 310 HG22 THR 41 HG22 THR 41 38.679 52.032 -21.891 311 HG23 THR 41 HG23 THR 41 36.984 52.323 -21.502 312 H ASN 42 HN ASN 42 37.962 53.091 -19.336 313 HA ASN 42 HA ASN 42 40.872 53.199 -19.547 314 HB2 ASN 42 HB2 ASN 42 40.596 55.597 -19.629 315 HB3 ASN 42 HB1 ASN 42 39.418 54.862 -20.714 316 HD21 ASN 42 HD21 ASN 42 38.871 57.436 -19.773 317 HD22 ASN 42 HD22 ASN 42 37.606 57.377 -18.642 318 H VAL 43 HN VAL 43 39.311 52.068 -17.162 319 HA VAL 43 HA VAL 43 40.109 53.903 -15.032 320 HB VAL 43 HB VAL 43 37.911 52.576 -15.087 321 HG11 VAL 43 HG11 VAL 43 39.661 50.358 -14.010 322 HG12 VAL 43 HG12 VAL 43 39.164 50.422 -15.700 323 HG13 VAL 43 HG13 VAL 43 37.950 50.291 -14.428 324 HG21 VAL 43 HG21 VAL 43 39.576 52.139 -12.598 325 HG22 VAL 43 HG22 VAL 43 37.850 52.477 -12.710 326 HG23 VAL 43 HG23 VAL 43 39.021 53.742 -13.080 327 H GLY 44 HN GLY 44 42.014 52.299 -16.820 328 HA2 GLY 44 HA2 GLY 44 44.261 51.800 -16.166 329 HA3 GLY 44 HA1 GLY 44 43.654 51.269 -14.601 330 H SER 45 HN SER 45 41.426 49.886 -16.335 331 HA SER 45 HA SER 45 42.897 47.368 -16.570 332 HB2 SER 45 HB2 SER 45 40.663 46.353 -16.776 333 HB3 SER 45 HB1 SER 45 40.775 47.364 -15.338 334 HG SER 45 HG SER 45 39.182 48.459 -16.137 335 H ASN 46 HN ASN 46 43.281 49.531 -18.526 336 HA ASN 46 HA ASN 46 41.989 48.505 -20.945 337 HB2 ASN 46 HB2 ASN 46 42.881 50.451 -22.046 338 HB3 ASN 46 HB1 ASN 46 42.182 50.969 -20.512 339 HD21 ASN 46 HD21 ASN 46 44.248 52.472 -21.870 340 HD22 ASN 46 HD22 ASN 46 45.636 52.436 -20.894 341 H THR 47 HN THR 47 44.088 47.007 -19.401 342 HA THR 47 HA THR 47 46.351 46.988 -21.252 343 HB THR 47 HB THR 47 46.017 45.069 -18.970 344 HG1 THR 47 HG1 THR 47 46.999 47.711 -18.732 345 HG21 THR 47 HG21 THR 47 47.950 44.830 -20.454 346 HG22 THR 47 HG22 THR 47 48.475 45.391 -18.867 347 HG23 THR 47 HG23 THR 47 48.366 46.526 -20.212 348 H TYR 48 HN TYR 48 43.567 46.057 -21.978 349 HA TYR 48 HA TYR 48 44.405 43.481 -23.111 350 HB2 TYR 48 HB2 TYR 48 42.465 42.323 -22.428 351 HB3 TYR 48 HB1 TYR 48 42.995 43.181 -20.981 352 HD1 TYR 48 HD1 TYR 48 40.247 42.552 -23.126 353 HD2 TYR 48 HD2 TYR 48 42.009 45.616 -20.685 354 HE1 TYR 48 HE1 TYR 48 38.063 43.721 -23.017 355 HE2 TYR 48 HE2 TYR 48 39.825 46.785 -20.575 356 HH TYR 48 HH TYR 48 37.735 46.904 -21.937 357 H GLY 49 HN GLY 49 43.939 46.316 -24.044 358 HA2 GLY 49 HA2 GLY 49 41.592 46.540 -25.553 359 HA3 GLY 49 HA1 GLY 49 43.111 47.350 -25.924 360 H LYS 50 HN LYS 50 41.039 45.987 -27.636 361 HA LYS 50 HA LYS 50 42.082 43.589 -28.700 362 HB2 LYS 50 HB2 LYS 50 40.303 45.720 -29.892 363 HB3 LYS 50 HB1 LYS 50 40.696 44.215 -30.724 364 HG2 LYS 50 HG2 LYS 50 39.839 42.966 -28.710 365 HG3 LYS 50 HG1 LYS 50 39.281 44.509 -28.061 366 HD2 LYS 50 HD2 LYS 50 38.472 43.471 -30.788 367 HD3 LYS 50 HD1 LYS 50 37.523 43.192 -29.327 368 HE2 LYS 50 HE2 LYS 50 38.286 45.909 -30.440 369 HE3 LYS 50 HE1 LYS 50 36.690 45.167 -30.545 370 HZ1 LYS 50 HZ1 LYS 50 36.793 45.033 -28.041 371 HZ2 LYS 50 HZ2 LYS 50 36.608 46.587 -28.702 372 HZ3 LYS 50 HZ3 LYS 50 38.123 46.081 -28.123 373 H ARG 51 HN ARG 51 42.691 46.981 -29.444 374 HA ARG 51 HA ARG 51 44.040 46.813 -31.841 375 HB2 ARG 51 HB2 ARG 51 45.169 48.853 -31.234 376 HB3 ARG 51 HB1 ARG 51 43.535 48.917 -30.576 377 HG2 ARG 51 HG2 ARG 51 44.432 48.104 -28.387 378 HG3 ARG 51 HG1 ARG 51 46.060 48.195 -29.060 379 HD2 ARG 51 HD2 ARG 51 45.724 50.608 -29.507 380 HD3 ARG 51 HD1 ARG 51 44.120 50.508 -28.785 381 HE ARG 51 HE ARG 51 46.650 50.562 -27.380 382 HH11 ARG 51 HH11 ARG 51 43.289 49.635 -27.261 383 HH12 ARG 51 HH12 ARG 51 43.219 49.671 -25.534 384 HH21 ARG 51 HH21 ARG 51 46.527 50.602 -25.126 385 HH22 ARG 51 HH22 ARG 51 45.038 50.214 -24.331 386 H ASN 52 HN ASN 52 45.162 45.902 -28.639 387 HA ASN 52 HA ASN 52 47.912 45.669 -29.212 388 HB2 ASN 52 HB2 ASN 52 46.996 45.636 -26.926 389 HB3 ASN 52 HB1 ASN 52 46.244 44.075 -27.254 390 HD21 ASN 52 HD21 ASN 52 47.489 42.299 -26.657 391 HD22 ASN 52 HD22 ASN 52 49.177 42.311 -26.480 392 H ALA 53 HN ALA 53 45.254 43.333 -29.414 393 HA ALA 53 HA ALA 53 46.807 41.103 -30.187 394 HB1 ALA 53 HB1 ALA 53 43.894 41.769 -30.644 395 HB2 ALA 53 HB2 ALA 53 44.575 40.748 -29.377 396 HB3 ALA 53 HB3 ALA 53 44.614 40.214 -31.058 397 H VAL 54 HN VAL 54 45.013 43.498 -32.123 398 HA VAL 54 HA VAL 54 45.685 42.336 -34.633 399 HB VAL 54 HB VAL 54 43.909 44.228 -33.832 400 HG11 VAL 54 HG11 VAL 54 45.975 45.743 -35.444 401 HG12 VAL 54 HG12 VAL 54 45.868 45.863 -33.688 402 HG13 VAL 54 HG13 VAL 54 44.512 46.375 -34.690 403 HG21 VAL 54 HG21 VAL 54 43.356 44.426 -36.170 404 HG22 VAL 54 HG22 VAL 54 43.974 42.793 -35.920 405 HG23 VAL 54 HG23 VAL 54 45.005 44.024 -36.649 406 H GLU 55 HN GLU 55 47.390 44.398 -32.440 407 HA GLU 55 HA GLU 55 49.145 45.613 -34.334 408 HB2 GLU 55 HB2 GLU 55 48.691 46.373 -31.935 409 HB3 GLU 55 HB1 GLU 55 49.787 45.087 -31.431 410 HG2 GLU 55 HG2 GLU 55 50.611 47.078 -33.537 411 HG3 GLU 55 HG1 GLU 55 50.780 47.455 -31.824 412 H VAL 56 HN VAL 56 49.685 42.979 -31.974 413 HA VAL 56 HA VAL 56 52.210 42.224 -32.921 414 HB VAL 56 HB VAL 56 51.328 41.455 -30.768 415 HG11 VAL 56 HG11 VAL 56 49.425 39.840 -32.491 416 HG12 VAL 56 HG12 VAL 56 48.988 41.138 -31.380 417 HG13 VAL 56 HG13 VAL 56 49.634 39.621 -30.755 418 HG21 VAL 56 HG21 VAL 56 52.090 39.144 -30.913 419 HG22 VAL 56 HG22 VAL 56 53.087 40.140 -31.974 420 HG23 VAL 56 HG23 VAL 56 51.813 39.128 -32.654 421 H LEU 57 HN LEU 57 49.007 41.533 -34.103 422 HA LEU 57 HA LEU 57 49.390 39.256 -35.618 423 HB2 LEU 57 HB2 LEU 57 47.505 41.439 -35.570 424 HB3 LEU 57 HB1 LEU 57 47.857 40.984 -37.237 425 HG LEU 57 HG LEU 57 47.526 38.552 -36.456 426 HD11 LEU 57 HD11 LEU 57 47.611 39.245 -34.005 427 HD12 LEU 57 HD12 LEU 57 46.266 38.194 -34.449 428 HD13 LEU 57 HD13 LEU 57 45.999 39.923 -34.232 429 HD21 LEU 57 HD21 LEU 57 45.910 39.981 -37.814 430 HD22 LEU 57 HD22 LEU 57 45.079 40.330 -36.298 431 HD23 LEU 57 HD23 LEU 57 45.168 38.672 -36.893 432 H LYS 58 HN LYS 58 49.975 42.634 -36.545 433 HA LYS 58 HA LYS 58 50.997 42.155 -39.135 434 HB2 LYS 58 HB2 LYS 58 51.429 44.407 -37.168 435 HB3 LYS 58 HB1 LYS 58 52.081 44.419 -38.807 436 HG2 LYS 58 HG2 LYS 58 49.149 43.929 -38.277 437 HG3 LYS 58 HG1 LYS 58 49.797 45.559 -38.450 438 HD2 LYS 58 HD2 LYS 58 50.782 44.852 -40.659 439 HD3 LYS 58 HD1 LYS 58 49.910 43.327 -40.496 440 HE2 LYS 58 HE2 LYS 58 48.553 46.031 -40.382 441 HE3 LYS 58 HE1 LYS 58 48.710 45.088 -41.864 442 HZ1 LYS 58 HZ1 LYS 58 47.633 43.757 -39.491 443 HZ2 LYS 58 HZ2 LYS 58 47.268 43.512 -41.132 444 HZ3 LYS 58 HZ3 LYS 58 46.628 44.852 -40.308 445 H ARG 59 HN ARG 59 52.555 42.328 -35.963 446 HA ARG 59 HA ARG 59 55.231 42.249 -36.822 447 HB2 ARG 59 HB2 ARG 59 54.244 42.664 -34.457 448 HB3 ARG 59 HB1 ARG 59 54.303 40.909 -34.295 449 HG2 ARG 59 HG2 ARG 59 56.769 42.057 -35.403 450 HG3 ARG 59 HG1 ARG 59 56.406 42.620 -33.771 451 HD2 ARG 59 HD2 ARG 59 56.160 40.289 -33.014 452 HD3 ARG 59 HD1 ARG 59 56.510 39.718 -34.643 453 HE ARG 59 HE ARG 59 58.621 41.387 -33.805 454 HH11 ARG 59 HH11 ARG 59 57.185 38.293 -33.076 455 HH12 ARG 59 HH12 ARG 59 58.670 37.602 -32.521 456 HH21 ARG 59 HH21 ARG 59 60.546 40.458 -33.074 457 HH22 ARG 59 HH22 ARG 59 60.562 38.818 -32.519 458 H GLU 60 HN GLU 60 52.797 39.796 -36.769 459 HA GLU 60 HA GLU 60 54.854 37.751 -37.350 460 HB2 GLU 60 HB2 GLU 60 52.092 37.407 -36.162 461 HB3 GLU 60 HB1 GLU 60 53.187 36.088 -36.578 462 HG2 GLU 60 HG2 GLU 60 53.837 38.316 -34.627 463 HG3 GLU 60 HG1 GLU 60 53.306 36.700 -34.164 464 HA PRO 61 HA PRO 61 52.315 38.482 -41.180 465 HB2 PRO 61 HB2 PRO 61 54.467 38.417 -42.887 466 HB3 PRO 61 HB1 PRO 61 53.865 39.894 -42.111 467 HG2 PRO 61 HG2 PRO 61 56.184 38.182 -41.380 468 HG3 PRO 61 HG1 PRO 61 56.019 39.945 -41.331 469 HD2 PRO 61 HD2 PRO 61 55.835 38.377 -39.097 470 HD3 PRO 61 HD1 PRO 61 54.979 39.926 -39.264 471 H LEU 62 HN LEU 62 54.321 36.044 -39.924 472 HA LEU 62 HA LEU 62 54.510 34.213 -42.032 473 HB2 LEU 62 HB2 LEU 62 55.676 34.059 -39.810 474 HB3 LEU 62 HB1 LEU 62 54.147 33.527 -39.111 475 HG LEU 62 HG LEU 62 54.986 32.101 -41.567 476 HD11 LEU 62 HD11 LEU 62 57.123 32.457 -40.235 477 HD12 LEU 62 HD12 LEU 62 56.676 30.771 -40.500 478 HD13 LEU 62 HD13 LEU 62 56.372 31.529 -38.937 479 HD21 LEU 62 HD21 LEU 62 53.838 31.376 -38.860 480 HD22 LEU 62 HD22 LEU 62 54.259 30.166 -40.072 481 HD23 LEU 62 HD23 LEU 62 53.012 31.365 -40.418 482 H ASN 63 HN ASN 63 51.946 34.749 -39.642 483 HA ASN 63 HA ASN 63 50.335 32.548 -40.510 484 HB2 ASN 63 HB2 ASN 63 48.526 33.820 -39.210 485 HB3 ASN 63 HB1 ASN 63 49.930 33.265 -38.303 486 HD21 ASN 63 HD21 ASN 63 48.891 36.189 -40.159 487 HD22 ASN 63 HD22 ASN 63 49.606 37.291 -39.085 488 H TYR 64 HN TYR 64 50.780 35.815 -41.582 489 HA TYR 64 HA TYR 64 48.275 36.046 -42.961 490 HB2 TYR 64 HB2 TYR 64 49.582 38.020 -42.228 491 HB3 TYR 64 HB1 TYR 64 50.846 37.589 -43.381 492 HD1 TYR 64 HD1 TYR 64 47.254 38.533 -43.089 493 HD2 TYR 64 HD2 TYR 64 50.651 38.131 -45.687 494 HE1 TYR 64 HE1 TYR 64 46.015 39.704 -44.891 495 HE2 TYR 64 HE2 TYR 64 49.413 39.302 -47.489 496 HH TYR 64 HH TYR 64 46.045 39.895 -47.315 497 H LEU 65 HN LEU 65 51.526 34.995 -43.780 498 HA LEU 65 HA LEU 65 51.087 34.812 -46.598 499 HB2 LEU 65 HB2 LEU 65 53.165 33.547 -44.798 500 HB3 LEU 65 HB1 LEU 65 53.194 33.457 -46.558 501 HG LEU 65 HG LEU 65 53.094 36.074 -45.041 502 HD11 LEU 65 HD11 LEU 65 55.477 36.252 -45.334 503 HD12 LEU 65 HD12 LEU 65 55.527 34.773 -46.294 504 HD13 LEU 65 HD13 LEU 65 55.169 34.693 -44.569 505 HD21 LEU 65 HD21 LEU 65 54.026 36.864 -47.291 506 HD22 LEU 65 HD22 LEU 65 52.345 36.335 -47.301 507 HD23 LEU 65 HD23 LEU 65 53.608 35.269 -47.915 508 HA PRO 66 HA PRO 66 48.939 31.008 -47.141 509 HB2 PRO 66 HB2 PRO 66 51.221 29.990 -48.771 510 HB3 PRO 66 HB1 PRO 66 49.503 30.125 -49.193 511 HG2 PRO 66 HG2 PRO 66 51.311 31.811 -50.176 512 HG3 PRO 66 HG1 PRO 66 49.675 32.344 -49.752 513 HD2 PRO 66 HD2 PRO 66 52.244 32.818 -48.302 514 HD3 PRO 66 HD1 PRO 66 50.806 33.855 -48.424 515 H LEU 67 HN LEU 67 48.760 29.076 -46.076 516 HA LEU 67 HA LEU 67 51.194 27.789 -45.042 517 HB2 LEU 67 HB2 LEU 67 48.905 28.870 -43.425 518 HB3 LEU 67 HB1 LEU 67 49.810 27.466 -42.856 519 HG LEU 67 HG LEU 67 51.258 29.946 -43.763 520 HD11 LEU 67 HD11 LEU 67 50.126 29.393 -41.003 521 HD12 LEU 67 HD12 LEU 67 49.648 30.706 -42.079 522 HD13 LEU 67 HD13 LEU 67 51.269 30.680 -41.386 523 HD21 LEU 67 HD21 LEU 67 52.400 27.708 -43.327 524 HD22 LEU 67 HD22 LEU 67 51.942 27.901 -41.635 525 HD23 LEU 67 HD23 LEU 67 53.025 29.067 -42.394 Start of MODEL 11 1 H1 THR 1 HT1 THR 1 -3.765 -3.750 -0.871 2 H2 THR 1 HT2 THR 1 -4.011 -3.291 0.747 3 H3 THR 1 HT3 THR 1 -4.259 -4.903 0.271 4 HA THR 1 HA THR 1 -2.217 -5.188 1.117 5 HB THR 1 HB THR 1 -2.239 -4.674 -1.702 6 HG1 THR 1 HG1 THR 1 -0.662 -6.208 0.067 7 HG21 THR 1 HG21 THR 1 0.145 -4.136 -2.057 8 HG22 THR 1 HG22 THR 1 0.349 -3.884 -0.327 9 HG23 THR 1 HG23 THR 1 -0.696 -2.810 -1.260 10 HA PRO 2 HA PRO 2 -0.594 -1.519 3.002 11 HB2 PRO 2 HB2 PRO 2 1.923 -2.309 3.696 12 HB3 PRO 2 HB1 PRO 2 0.465 -2.890 4.523 13 HG2 PRO 2 HG2 PRO 2 2.133 -4.232 2.458 14 HG3 PRO 2 HG1 PRO 2 1.339 -4.912 3.889 15 HD2 PRO 2 HD2 PRO 2 0.328 -5.143 1.341 16 HD3 PRO 2 HD1 PRO 2 -0.677 -5.183 2.805 17 H ILE 3 HN ILE 3 0.846 0.258 2.698 18 HA ILE 3 HA ILE 3 2.549 0.144 0.293 19 HB ILE 3 HB ILE 3 0.351 1.175 -0.275 20 HG12 ILE 3 HG12 ILE 3 1.347 3.325 -1.171 21 HG13 ILE 3 HG11 ILE 3 2.809 2.952 -0.258 22 HG21 ILE 3 HG21 ILE 3 -0.033 2.126 2.018 23 HG22 ILE 3 HG22 ILE 3 -0.272 3.298 0.722 24 HG23 ILE 3 HG23 ILE 3 1.210 3.330 1.677 25 HD11 ILE 3 HD11 ILE 3 1.595 0.998 -2.222 26 HD12 ILE 3 HD12 ILE 3 3.213 0.970 -1.521 27 HD13 ILE 3 HD13 ILE 3 2.788 2.203 -2.707 28 H GLU 4 HN GLU 4 4.418 1.328 0.401 29 HA GLU 4 HA GLU 4 5.592 1.871 2.853 30 HB2 GLU 4 HB2 GLU 4 7.300 3.089 1.612 31 HB3 GLU 4 HB1 GLU 4 6.826 1.651 0.708 32 HG2 GLU 4 HG2 GLU 4 5.272 3.040 -0.644 33 HG3 GLU 4 HG1 GLU 4 5.825 4.471 0.223 34 H SER 5 HN SER 5 6.147 3.863 3.899 35 HA SER 5 HA SER 5 3.940 5.662 4.130 36 HB2 SER 5 HB2 SER 5 5.268 6.782 5.801 37 HB3 SER 5 HB1 SER 5 5.497 5.047 5.999 38 HG SER 5 HG SER 5 7.395 6.672 5.836 39 H HIS 6 HN HIS 6 4.100 8.013 3.885 40 HA HIS 6 HA HIS 6 5.738 8.737 1.530 41 HB2 HIS 6 HB2 HIS 6 3.966 10.487 1.144 42 HB3 HIS 6 HB1 HIS 6 3.403 8.825 0.965 43 HD1 HIS 6 HD1 HIS 6 2.079 7.809 3.064 44 HD2 HIS 6 HD2 HIS 6 2.665 11.936 3.148 45 HE1 HIS 6 HE1 HIS 6 0.482 8.724 4.804 46 HE2 HIS 6 HE2 HIS 6 0.827 11.239 4.867 47 H GLN 7 HN GLN 7 6.713 8.859 4.223 48 HA GLN 7 HA GLN 7 6.498 11.417 5.386 49 HB2 GLN 7 HB2 GLN 7 7.486 9.322 6.430 50 HB3 GLN 7 HB1 GLN 7 8.945 9.649 5.494 51 HG2 GLN 7 HG2 GLN 7 9.137 11.867 6.539 52 HG3 GLN 7 HG1 GLN 7 7.663 11.569 7.460 53 HE21 GLN 7 HE21 GLN 7 7.973 10.667 9.504 54 HE22 GLN 7 HE22 GLN 7 9.376 9.849 9.998 55 H VAL 8 HN VAL 8 7.558 13.313 5.061 56 HA VAL 8 HA VAL 8 9.691 13.392 3.027 57 HB VAL 8 HB VAL 8 7.564 14.006 1.930 58 HG11 VAL 8 HG11 VAL 8 6.535 14.889 4.082 59 HG12 VAL 8 HG12 VAL 8 6.281 15.899 2.659 60 HG13 VAL 8 HG13 VAL 8 7.502 16.346 3.851 61 HG21 VAL 8 HG21 VAL 8 9.765 15.096 1.336 62 HG22 VAL 8 HG22 VAL 8 9.319 16.437 2.392 63 HG23 VAL 8 HG23 VAL 8 8.350 16.080 0.962 64 H GLU 9 HN GLU 9 11.196 15.056 3.283 65 HA GLU 9 HA GLU 9 10.932 16.681 5.736 66 HB2 GLU 9 HB2 GLU 9 13.562 16.339 5.760 67 HB3 GLU 9 HB1 GLU 9 12.485 15.174 6.527 68 HG2 GLU 9 HG2 GLU 9 14.214 14.106 5.062 69 HG3 GLU 9 HG1 GLU 9 12.564 13.731 4.577 70 H LYS 10 HN LYS 10 12.872 18.353 5.713 71 HA LYS 10 HA LYS 10 13.135 19.452 2.985 72 HB2 LYS 10 HB2 LYS 10 12.933 21.743 4.179 73 HB3 LYS 10 HB1 LYS 10 11.455 20.832 3.865 74 HG2 LYS 10 HG2 LYS 10 12.804 20.212 6.429 75 HG3 LYS 10 HG1 LYS 10 12.110 21.830 6.309 76 HD2 LYS 10 HD2 LYS 10 9.948 20.843 5.614 77 HD3 LYS 10 HD1 LYS 10 10.641 19.230 5.779 78 HE2 LYS 10 HE2 LYS 10 11.073 19.653 8.169 79 HE3 LYS 10 HE1 LYS 10 10.389 21.271 8.009 80 HZ1 LYS 10 HZ1 LYS 10 8.776 18.995 7.121 81 HZ2 LYS 10 HZ2 LYS 10 8.286 20.470 7.808 82 HZ3 LYS 10 HZ3 LYS 10 8.939 19.247 8.791 83 H ARG 11 HN ARG 11 14.858 21.140 2.862 84 HA ARG 11 HA ARG 11 17.081 20.468 4.684 85 HB2 ARG 11 HB2 ARG 11 18.459 21.351 2.589 86 HB3 ARG 11 HB1 ARG 11 17.955 19.673 2.720 87 HG2 ARG 11 HG2 ARG 11 17.378 20.309 0.514 88 HG3 ARG 11 HG1 ARG 11 15.853 20.379 1.378 89 HD2 ARG 11 HD2 ARG 11 17.579 22.831 1.207 90 HD3 ARG 11 HD1 ARG 11 16.583 22.375 -0.168 91 HE ARG 11 HE ARG 11 15.653 23.430 2.363 92 HH11 ARG 11 HH11 ARG 11 14.844 21.585 -0.486 93 HH12 ARG 11 HH12 ARG 11 13.150 21.904 -0.355 94 HH21 ARG 11 HH21 ARG 11 13.435 23.828 2.508 95 HH22 ARG 11 HH22 ARG 11 12.355 23.165 1.328 96 H LYS 12 HN LYS 12 15.825 22.284 5.854 97 HA LYS 12 HA LYS 12 15.784 24.928 5.089 98 HB2 LYS 12 HB2 LYS 12 15.592 25.477 7.366 99 HB3 LYS 12 HB1 LYS 12 14.987 23.823 7.286 100 HG2 LYS 12 HG2 LYS 12 17.363 23.067 7.833 101 HG3 LYS 12 HG1 LYS 12 17.711 24.753 8.214 102 HD2 LYS 12 HD2 LYS 12 17.088 23.875 10.300 103 HD3 LYS 12 HD1 LYS 12 15.589 24.604 9.722 104 HE2 LYS 12 HE2 LYS 12 15.062 22.393 10.547 105 HE3 LYS 12 HE1 LYS 12 14.947 22.352 8.788 106 HZ1 LYS 12 HZ1 LYS 12 16.276 20.534 10.064 107 HZ2 LYS 12 HZ2 LYS 12 17.510 21.702 10.061 108 HZ3 LYS 12 HZ3 LYS 12 16.860 21.143 8.593 109 H CYS 13 HN CYS 13 17.199 26.725 5.785 110 HA CYS 13 HA CYS 13 20.027 26.032 5.320 111 HB2 CYS 13 HB2 CYS 13 18.563 27.780 3.947 112 HB3 CYS 13 HB1 CYS 13 19.047 28.852 5.258 113 H ASN 14 HN ASN 14 19.930 25.314 7.673 114 HA ASN 14 HA ASN 14 20.433 27.636 9.438 115 HB2 ASN 14 HB2 ASN 14 18.404 26.117 9.931 116 HB3 ASN 14 HB1 ASN 14 19.599 24.924 10.440 117 HD21 ASN 14 HD21 ASN 14 19.207 25.033 12.717 118 HD22 ASN 14 HD22 ASN 14 19.477 26.439 13.629 119 H THR 15 HN THR 15 22.352 26.234 7.705 120 HA THR 15 HA THR 15 24.060 24.912 9.714 121 HB THR 15 HB THR 15 23.542 23.694 7.573 122 HG1 THR 15 HG1 THR 15 25.530 22.897 7.555 123 HG21 THR 15 HG21 THR 15 24.436 24.450 5.504 124 HG22 THR 15 HG22 THR 15 25.399 25.699 6.290 125 HG23 THR 15 HG23 THR 15 23.646 25.862 6.205 126 H ALA 16 HN ALA 16 26.488 25.317 9.266 127 HA ALA 16 HA ALA 16 27.024 28.049 9.760 128 HB1 ALA 16 HB1 ALA 16 28.716 25.638 9.193 129 HB2 ALA 16 HB2 ALA 16 28.625 26.618 10.657 130 HB3 ALA 16 HB3 ALA 16 29.457 27.238 9.231 131 H THR 17 HN THR 17 27.423 26.035 6.872 132 HA THR 17 HA THR 17 28.736 27.827 5.206 133 HB THR 17 HB THR 17 26.573 25.844 4.457 134 HG1 THR 17 HG1 THR 17 29.398 25.621 4.463 135 HG21 THR 17 HG21 THR 17 27.705 25.891 2.239 136 HG22 THR 17 HG22 THR 17 28.719 27.214 2.814 137 HG23 THR 17 HG23 THR 17 26.978 27.442 2.658 138 H CYS 18 HN CYS 18 25.309 27.616 6.017 139 HA CYS 18 HA CYS 18 24.329 29.465 4.128 140 HB2 CYS 18 HB2 CYS 18 23.080 27.853 5.776 141 HB3 CYS 18 HB1 CYS 18 23.139 29.234 6.871 142 H ALA 19 HN ALA 19 25.630 29.871 7.392 143 HA ALA 19 HA ALA 19 25.029 32.540 7.844 144 HB1 ALA 19 HB1 ALA 19 26.161 30.920 9.434 145 HB2 ALA 19 HB2 ALA 19 26.824 32.555 9.423 146 HB3 ALA 19 HB3 ALA 19 27.665 31.256 8.576 147 H THR 20 HN THR 20 27.622 31.109 5.918 148 HA THR 20 HA THR 20 29.105 33.446 5.424 149 HB THR 20 HB THR 20 28.709 31.018 3.660 150 HG1 THR 20 HG1 THR 20 29.578 30.654 5.770 151 HG21 THR 20 HG21 THR 20 30.712 33.283 3.613 152 HG22 THR 20 HG22 THR 20 29.615 32.791 2.322 153 HG23 THR 20 HG23 THR 20 30.969 31.754 2.773 154 H GLN 21 HN GLN 21 26.324 32.032 3.733 155 HA GLN 21 HA GLN 21 26.242 33.680 1.506 156 HB2 GLN 21 HB2 GLN 21 24.222 32.735 1.106 157 HB3 GLN 21 HB1 GLN 21 24.648 31.700 2.467 158 HG2 GLN 21 HG2 GLN 21 23.534 33.422 3.974 159 HG3 GLN 21 HG1 GLN 21 22.917 34.183 2.509 160 HE21 GLN 21 HE21 GLN 21 20.813 33.445 3.813 161 HE22 GLN 21 HE22 GLN 21 20.207 31.919 3.382 162 H ARG 22 HN ARG 22 25.405 34.423 4.829 163 HA ARG 22 HA ARG 22 23.994 36.840 4.154 164 HB2 ARG 22 HB2 ARG 22 23.535 37.043 6.385 165 HB3 ARG 22 HB1 ARG 22 23.922 35.328 6.351 166 HG2 ARG 22 HG2 ARG 22 25.260 35.976 8.108 167 HG3 ARG 22 HG1 ARG 22 26.395 36.259 6.798 168 HD2 ARG 22 HD2 ARG 22 26.530 38.324 7.794 169 HD3 ARG 22 HD1 ARG 22 25.129 38.633 6.773 170 HE ARG 22 HE ARG 22 23.806 38.683 8.680 171 HH11 ARG 22 HH11 ARG 22 26.924 37.296 9.404 172 HH12 ARG 22 HH12 ARG 22 26.650 37.277 11.112 173 HH21 ARG 22 HH21 ARG 22 23.476 38.644 10.915 174 HH22 ARG 22 HH22 ARG 22 24.712 38.034 11.964 175 H LEU 23 HN LEU 23 27.296 35.946 4.721 176 HA LEU 23 HA LEU 23 28.399 38.438 5.387 177 HB2 LEU 23 HB2 LEU 23 29.662 36.313 5.474 178 HB3 LEU 23 HB1 LEU 23 29.645 36.241 3.713 179 HG LEU 23 HG LEU 23 30.825 38.450 3.660 180 HD11 LEU 23 HD11 LEU 23 30.222 39.407 5.769 181 HD12 LEU 23 HD12 LEU 23 31.953 39.084 5.864 182 HD13 LEU 23 HD13 LEU 23 30.809 37.998 6.653 183 HD21 LEU 23 HD21 LEU 23 33.018 37.541 4.424 184 HD22 LEU 23 HD22 LEU 23 32.107 36.372 3.467 185 HD23 LEU 23 HD23 LEU 23 32.166 36.220 5.223 186 H ALA 24 HN ALA 24 27.582 37.019 2.256 187 HA ALA 24 HA ALA 24 28.732 39.059 0.647 188 HB1 ALA 24 HB1 ALA 24 26.673 36.923 0.220 189 HB2 ALA 24 HB2 ALA 24 28.229 37.151 -0.578 190 HB3 ALA 24 HB3 ALA 24 26.865 38.188 -0.994 191 H ASN 25 HN ASN 25 25.494 38.557 1.984 192 HA ASN 25 HA ASN 25 24.268 40.819 0.816 193 HB2 ASN 25 HB2 ASN 25 23.662 39.255 3.329 194 HB3 ASN 25 HB1 ASN 25 22.649 40.580 2.759 195 HD21 ASN 25 HD21 ASN 25 21.698 37.855 2.906 196 HD22 ASN 25 HD22 ASN 25 21.402 37.325 1.321 197 H PHE 26 HN PHE 26 26.093 40.369 3.801 198 HA PHE 26 HA PHE 26 25.588 42.950 4.884 199 HB2 PHE 26 HB2 PHE 26 26.392 41.012 6.220 200 HB3 PHE 26 HB1 PHE 26 27.948 41.126 5.396 201 HD1 PHE 26 HD1 PHE 26 25.569 42.980 7.579 202 HD2 PHE 26 HD2 PHE 26 29.569 42.750 6.029 203 HE1 PHE 26 HE1 PHE 26 26.288 44.738 9.173 204 HE2 PHE 26 HE2 PHE 26 30.288 44.508 7.624 205 HZ PHE 26 HZ PHE 26 28.647 45.502 9.196 206 H LEU 27 HN LEU 27 27.930 41.685 2.612 207 HA LEU 27 HA LEU 27 29.846 43.715 2.706 208 HB2 LEU 27 HB2 LEU 27 30.120 41.564 1.494 209 HB3 LEU 27 HB1 LEU 27 28.923 42.079 0.319 210 HG LEU 27 HG LEU 27 31.440 42.310 -0.268 211 HD11 LEU 27 HD11 LEU 27 29.906 44.866 -0.673 212 HD12 LEU 27 HD12 LEU 27 29.351 43.365 -1.411 213 HD13 LEU 27 HD13 LEU 27 30.949 44.000 -1.797 214 HD21 LEU 27 HD21 LEU 27 31.852 43.545 1.979 215 HD22 LEU 27 HD22 LEU 27 31.198 44.958 1.152 216 HD23 LEU 27 HD23 LEU 27 32.642 44.163 0.530 217 H VAL 28 HN VAL 28 26.757 43.539 1.000 218 HA VAL 28 HA VAL 28 27.215 46.190 -0.172 219 HB VAL 28 HB VAL 28 25.108 45.809 -1.368 220 HG11 VAL 28 HG11 VAL 28 27.206 44.889 -2.301 221 HG12 VAL 28 HG12 VAL 28 25.824 43.872 -2.707 222 HG13 VAL 28 HG13 VAL 28 26.931 43.385 -1.423 223 HG21 VAL 28 HG21 VAL 28 25.033 43.166 0.124 224 HG22 VAL 28 HG22 VAL 28 23.876 43.712 -1.090 225 HG23 VAL 28 HG23 VAL 28 23.981 44.541 0.463 226 H HIS 29 HN HIS 29 25.554 44.669 2.461 227 HA HIS 29 HA HIS 29 23.607 46.675 2.969 228 HB2 HIS 29 HB2 HIS 29 23.672 44.360 3.987 229 HB3 HIS 29 HB1 HIS 29 24.970 44.939 5.031 230 HD1 HIS 29 HD1 HIS 29 21.431 46.021 4.078 231 HD2 HIS 29 HD2 HIS 29 24.019 46.095 7.346 232 HE1 HIS 29 HE1 HIS 29 20.125 47.021 6.004 233 HE2 HIS 29 HE2 HIS 29 21.689 47.073 8.004 234 H SER 30 HN SER 30 26.951 46.229 3.993 235 HA SER 30 HA SER 30 26.889 48.694 5.547 236 HB2 SER 30 HB2 SER 30 28.130 46.609 6.284 237 HB3 SER 30 HB1 SER 30 29.288 46.941 4.999 238 HG SER 30 HG SER 30 28.543 48.783 7.029 239 H SER 31 HN SER 31 26.809 48.385 2.427 240 HA SER 31 HA SER 31 29.202 49.699 1.529 241 HB2 SER 31 HB2 SER 31 27.872 48.188 0.078 242 HB3 SER 31 HB1 SER 31 26.551 49.352 0.112 243 HG SER 31 HG SER 31 28.893 49.375 -1.301 244 H ASN 32 HN ASN 32 26.217 50.762 2.887 245 HA ASN 32 HA ASN 32 25.965 53.290 1.682 246 HB2 ASN 32 HB2 ASN 32 24.702 53.899 3.734 247 HB3 ASN 32 HB1 ASN 32 24.183 52.361 3.048 248 HD21 ASN 32 HD21 ASN 32 24.795 53.743 5.975 249 HD22 ASN 32 HD22 ASN 32 25.327 52.381 6.836 250 H ASN 33 HN ASN 33 27.777 52.228 4.531 251 HA ASN 33 HA ASN 33 28.711 54.808 5.257 252 HB2 ASN 33 HB2 ASN 33 29.743 52.033 5.861 253 HB3 ASN 33 HB1 ASN 33 30.480 53.492 6.520 254 HD21 ASN 33 HD21 ASN 33 28.729 55.042 7.592 255 HD22 ASN 33 HD22 ASN 33 27.565 54.262 8.551 256 H PHE 34 HN PHE 34 29.974 52.233 3.221 257 HA PHE 34 HA PHE 34 32.543 53.131 2.709 258 HB2 PHE 34 HB2 PHE 34 31.673 50.987 1.879 259 HB3 PHE 34 HB1 PHE 34 30.627 51.846 0.748 260 HD1 PHE 34 HD1 PHE 34 34.201 51.345 1.703 261 HD2 PHE 34 HD2 PHE 34 31.440 52.570 -1.350 262 HE1 PHE 34 HE1 PHE 34 36.061 51.460 0.068 263 HE2 PHE 34 HE2 PHE 34 33.300 52.686 -2.986 264 HZ PHE 34 HZ PHE 34 35.611 52.131 -2.277 265 H GLY 35 HN GLY 35 29.493 54.216 1.285 266 HA2 GLY 35 HA2 GLY 35 30.552 55.834 -0.763 267 HA3 GLY 35 HA1 GLY 35 28.983 56.063 0.009 268 H ALA 36 HN ALA 36 29.443 56.793 2.506 269 HA ALA 36 HA ALA 36 30.324 59.458 2.336 270 HB1 ALA 36 HB1 ALA 36 29.852 59.617 4.625 271 HB2 ALA 36 HB2 ALA 36 30.299 57.939 4.931 272 HB3 ALA 36 HB3 ALA 36 28.790 58.311 4.097 273 H ILE 37 HN ILE 37 31.971 56.498 3.264 274 HA ILE 37 HA ILE 37 34.283 57.620 4.414 275 HB ILE 37 HB ILE 37 33.764 55.008 3.003 276 HG12 ILE 37 HG12 ILE 37 34.458 55.623 5.890 277 HG13 ILE 37 HG11 ILE 37 32.799 55.537 5.301 278 HG21 ILE 37 HG21 ILE 37 36.023 54.358 4.004 279 HG22 ILE 37 HG22 ILE 37 36.324 56.084 4.209 280 HG23 ILE 37 HG23 ILE 37 36.087 55.415 2.594 281 HD11 ILE 37 HD11 ILE 37 34.756 53.275 4.866 282 HD12 ILE 37 HD12 ILE 37 32.997 53.235 4.752 283 HD13 ILE 37 HD13 ILE 37 33.774 53.390 6.326 284 H LEU 38 HN LEU 38 33.380 56.955 1.077 285 HA LEU 38 HA LEU 38 35.900 57.373 -0.122 286 HB2 LEU 38 HB2 LEU 38 33.981 56.324 -1.284 287 HB3 LEU 38 HB1 LEU 38 33.153 57.881 -1.294 288 HG LEU 38 HG LEU 38 35.092 58.842 -2.564 289 HD11 LEU 38 HD11 LEU 38 36.879 57.363 -1.979 290 HD12 LEU 38 HD12 LEU 38 36.567 57.084 -3.692 291 HD13 LEU 38 HD13 LEU 38 35.963 55.945 -2.488 292 HD21 LEU 38 HD21 LEU 38 34.563 57.577 -4.704 293 HD22 LEU 38 HD22 LEU 38 33.156 58.182 -3.830 294 HD23 LEU 38 HD23 LEU 38 33.594 56.477 -3.723 295 H SER 39 HN SER 39 33.427 59.580 0.998 296 HA SER 39 HA SER 39 34.242 61.901 -0.388 297 HB2 SER 39 HB2 SER 39 32.111 61.755 0.841 298 HB3 SER 39 HB1 SER 39 32.995 61.666 2.362 299 HG SER 39 HG SER 39 33.956 63.724 1.681 300 H SER 40 HN SER 40 35.302 60.475 2.671 301 HA SER 40 HA SER 40 37.293 62.603 3.009 302 HB2 SER 40 HB2 SER 40 36.501 60.294 4.797 303 HB3 SER 40 HB1 SER 40 37.730 61.492 5.193 304 HG SER 40 HG SER 40 36.153 63.079 5.125 305 H THR 41 HN THR 41 37.466 60.615 0.838 306 HA THR 41 HA THR 41 39.577 58.782 1.565 307 HB THR 41 HB THR 41 37.803 58.418 -0.243 308 HG1 THR 41 HG1 THR 41 39.441 57.430 -1.616 309 HG21 THR 41 HG21 THR 41 38.186 59.375 -2.403 310 HG22 THR 41 HG22 THR 41 39.732 60.057 -1.898 311 HG23 THR 41 HG23 THR 41 38.226 60.713 -1.256 312 H ASN 42 HN ASN 42 39.702 62.012 1.340 313 HA ASN 42 HA ASN 42 42.078 62.226 -0.335 314 HB2 ASN 42 HB2 ASN 42 41.912 64.605 0.057 315 HB3 ASN 42 HB1 ASN 42 40.310 63.989 -0.344 316 HD21 ASN 42 HD21 ASN 42 40.419 66.389 1.065 317 HD22 ASN 42 HD22 ASN 42 39.934 66.140 2.673 318 H VAL 43 HN VAL 43 41.884 60.786 2.404 319 HA VAL 43 HA VAL 43 43.480 62.246 4.239 320 HB VAL 43 HB VAL 43 42.038 60.258 4.792 321 HG11 VAL 43 HG11 VAL 43 44.385 58.669 3.725 322 HG12 VAL 43 HG12 VAL 43 42.897 58.916 2.812 323 HG13 VAL 43 HG13 VAL 43 42.857 58.044 4.344 324 HG21 VAL 43 HG21 VAL 43 44.960 60.032 5.583 325 HG22 VAL 43 HG22 VAL 43 43.584 59.397 6.485 326 HG23 VAL 43 HG23 VAL 43 43.803 61.139 6.320 327 H GLY 44 HN GLY 44 44.232 60.425 1.393 328 HA2 GLY 44 HA2 GLY 44 46.675 61.244 0.790 329 HA3 GLY 44 HA1 GLY 44 47.053 60.146 2.114 330 H SER 45 HN SER 45 44.605 58.512 1.199 331 HA SER 45 HA SER 45 46.101 56.881 -0.718 332 HB2 SER 45 HB2 SER 45 44.407 55.164 -0.224 333 HB3 SER 45 HB1 SER 45 45.149 55.771 1.253 334 HG SER 45 HG SER 45 42.580 55.784 0.544 335 H ASN 46 HN ASN 46 44.893 59.409 -1.553 336 HA ASN 46 HA ASN 46 42.639 58.570 -3.228 337 HB2 ASN 46 HB2 ASN 46 42.387 60.937 -3.741 338 HB3 ASN 46 HB1 ASN 46 42.497 60.714 -1.996 339 HD21 ASN 46 HD21 ASN 46 43.135 63.234 -2.798 340 HD22 ASN 46 HD22 ASN 46 44.813 63.484 -2.789 341 H THR 47 HN THR 47 45.482 57.696 -3.646 342 HA THR 47 HA THR 47 46.112 58.968 -6.215 343 HB THR 47 HB THR 47 47.897 56.823 -5.470 344 HG1 THR 47 HG1 THR 47 47.411 58.864 -3.562 345 HG21 THR 47 HG21 THR 47 48.492 58.660 -6.959 346 HG22 THR 47 HG22 THR 47 49.528 58.707 -5.532 347 HG23 THR 47 HG23 THR 47 48.179 59.833 -5.680 348 H TYR 48 HN TYR 48 43.786 57.168 -5.826 349 HA TYR 48 HA TYR 48 44.577 54.874 -7.500 350 HB2 TYR 48 HB2 TYR 48 42.442 53.879 -6.848 351 HB3 TYR 48 HB1 TYR 48 43.348 54.363 -5.415 352 HD1 TYR 48 HD1 TYR 48 40.438 55.091 -7.548 353 HD2 TYR 48 HD2 TYR 48 42.657 56.291 -4.071 354 HE1 TYR 48 HE1 TYR 48 38.546 56.527 -6.836 355 HE2 TYR 48 HE2 TYR 48 40.765 57.728 -3.360 356 HH TYR 48 HH TYR 48 38.815 58.911 -4.531 357 H GLY 49 HN GLY 49 44.113 57.744 -8.367 358 HA2 GLY 49 HA2 GLY 49 41.700 57.986 -9.781 359 HA3 GLY 49 HA1 GLY 49 43.196 58.828 -10.176 360 H LYS 50 HN LYS 50 41.019 57.311 -11.751 361 HA LYS 50 HA LYS 50 42.209 55.046 -12.955 362 HB2 LYS 50 HB2 LYS 50 40.085 56.966 -13.921 363 HB3 LYS 50 HB1 LYS 50 40.556 55.517 -14.810 364 HG2 LYS 50 HG2 LYS 50 40.055 54.173 -12.742 365 HG3 LYS 50 HG1 LYS 50 39.408 55.640 -12.008 366 HD2 LYS 50 HD2 LYS 50 38.425 54.544 -14.654 367 HD3 LYS 50 HD1 LYS 50 37.676 54.146 -13.107 368 HE2 LYS 50 HE2 LYS 50 38.012 56.942 -14.236 369 HE3 LYS 50 HE1 LYS 50 36.505 56.029 -14.183 370 HZ1 LYS 50 HZ1 LYS 50 36.969 55.872 -11.691 371 HZ2 LYS 50 HZ2 LYS 50 36.421 57.359 -12.302 372 HZ3 LYS 50 HZ3 LYS 50 38.066 57.141 -11.939 373 H ARG 51 HN ARG 51 42.325 58.491 -13.704 374 HA ARG 51 HA ARG 51 43.429 58.498 -16.226 375 HB2 ARG 51 HB2 ARG 51 44.354 60.660 -15.713 376 HB3 ARG 51 HB1 ARG 51 42.814 60.519 -14.866 377 HG2 ARG 51 HG2 ARG 51 44.062 59.808 -12.815 378 HG3 ARG 51 HG1 ARG 51 45.573 60.115 -13.674 379 HD2 ARG 51 HD2 ARG 51 44.864 62.468 -14.031 380 HD3 ARG 51 HD1 ARG 51 43.400 62.151 -13.105 381 HE ARG 51 HE ARG 51 46.067 62.534 -12.048 382 HH11 ARG 51 HH11 ARG 51 42.906 61.163 -11.506 383 HH12 ARG 51 HH12 ARG 51 43.065 61.179 -9.784 384 HH21 ARG 51 HH21 ARG 51 46.245 62.546 -9.796 385 HH22 ARG 51 HH22 ARG 51 44.941 61.956 -8.820 386 H ASN 52 HN ASN 52 44.942 57.605 -13.207 387 HA ASN 52 HA ASN 52 47.644 57.747 -14.042 388 HB2 ASN 52 HB2 ASN 52 46.521 57.335 -11.668 389 HB3 ASN 52 HB1 ASN 52 46.780 55.648 -12.107 390 HD21 ASN 52 HD21 ASN 52 49.233 56.186 -13.683 391 HD22 ASN 52 HD22 ASN 52 50.443 56.571 -12.557 392 H ALA 53 HN ALA 53 45.211 55.194 -14.189 393 HA ALA 53 HA ALA 53 46.892 53.119 -15.109 394 HB1 ALA 53 HB1 ALA 53 44.705 52.164 -16.014 395 HB2 ALA 53 HB2 ALA 53 43.927 53.612 -15.375 396 HB3 ALA 53 HB3 ALA 53 44.753 52.501 -14.283 397 H VAL 54 HN VAL 54 44.891 55.476 -16.879 398 HA VAL 54 HA VAL 54 45.638 54.475 -19.457 399 HB VAL 54 HB VAL 54 43.623 56.054 -18.575 400 HG11 VAL 54 HG11 VAL 54 45.446 57.943 -20.083 401 HG12 VAL 54 HG12 VAL 54 45.342 57.934 -18.322 402 HG13 VAL 54 HG13 VAL 54 43.917 58.313 -19.287 403 HG21 VAL 54 HG21 VAL 54 43.108 56.400 -20.945 404 HG22 VAL 54 HG22 VAL 54 43.778 54.786 -20.713 405 HG23 VAL 54 HG23 VAL 54 44.785 56.072 -21.379 406 H GLU 55 HN GLU 55 47.095 56.622 -17.185 407 HA GLU 55 HA GLU 55 48.660 58.112 -19.080 408 HB2 GLU 55 HB2 GLU 55 48.046 58.855 -16.721 409 HB3 GLU 55 HB1 GLU 55 49.283 57.736 -16.149 410 HG2 GLU 55 HG2 GLU 55 49.919 59.762 -18.284 411 HG3 GLU 55 HG1 GLU 55 49.958 60.214 -16.581 412 H VAL 56 HN VAL 56 49.532 55.625 -16.659 413 HA VAL 56 HA VAL 56 52.167 55.251 -17.490 414 HB VAL 56 HB VAL 56 51.196 54.343 -15.389 415 HG11 VAL 56 HG11 VAL 56 50.016 52.224 -17.208 416 HG12 VAL 56 HG12 VAL 56 49.082 53.513 -16.447 417 HG13 VAL 56 HG13 VAL 56 49.883 52.298 -15.451 418 HG21 VAL 56 HG21 VAL 56 52.430 52.202 -15.465 419 HG22 VAL 56 HG22 VAL 56 53.337 53.483 -16.268 420 HG23 VAL 56 HG23 VAL 56 52.465 52.287 -17.226 421 H LEU 57 HN LEU 57 49.169 53.888 -18.733 422 HA LEU 57 HA LEU 57 50.172 51.821 -20.299 423 HB2 LEU 57 HB2 LEU 57 47.716 53.355 -20.167 424 HB3 LEU 57 HB1 LEU 57 48.134 52.978 -21.838 425 HG LEU 57 HG LEU 57 48.597 50.579 -20.936 426 HD11 LEU 57 HD11 LEU 57 48.357 51.410 -18.525 427 HD12 LEU 57 HD12 LEU 57 47.459 49.949 -18.935 428 HD13 LEU 57 HD13 LEU 57 46.623 51.498 -18.835 429 HD21 LEU 57 HD21 LEU 57 46.690 51.347 -22.422 430 HD22 LEU 57 HD22 LEU 57 45.727 51.555 -20.959 431 HD23 LEU 57 HD23 LEU 57 46.316 49.954 -21.407 432 H LYS 58 HN LYS 58 49.837 55.268 -21.044 433 HA LYS 58 HA LYS 58 50.775 55.181 -23.717 434 HB2 LYS 58 HB2 LYS 58 50.740 57.369 -21.636 435 HB3 LYS 58 HB1 LYS 58 51.283 57.624 -23.295 436 HG2 LYS 58 HG2 LYS 58 48.595 56.388 -22.689 437 HG3 LYS 58 HG1 LYS 58 48.808 58.137 -22.781 438 HD2 LYS 58 HD2 LYS 58 49.815 57.825 -25.065 439 HD3 LYS 58 HD1 LYS 58 49.380 56.118 -24.969 440 HE2 LYS 58 HE2 LYS 58 47.391 58.384 -24.667 441 HE3 LYS 58 HE1 LYS 58 47.683 57.526 -26.180 442 HZ1 LYS 58 HZ1 LYS 58 46.535 56.492 -23.665 443 HZ2 LYS 58 HZ2 LYS 58 47.231 55.439 -24.803 444 HZ3 LYS 58 HZ3 LYS 58 45.902 56.406 -25.236 445 H ARG 59 HN ARG 59 52.429 55.617 -20.614 446 HA ARG 59 HA ARG 59 54.992 56.153 -21.712 447 HB2 ARG 59 HB2 ARG 59 54.078 56.511 -19.292 448 HB3 ARG 59 HB1 ARG 59 54.620 54.853 -19.035 449 HG2 ARG 59 HG2 ARG 59 56.637 56.398 -20.445 450 HG3 ARG 59 HG1 ARG 59 56.205 57.164 -18.916 451 HD2 ARG 59 HD2 ARG 59 56.579 55.029 -17.740 452 HD3 ARG 59 HD1 ARG 59 57.012 54.263 -19.265 453 HE ARG 59 HE ARG 59 58.623 56.571 -18.788 454 HH11 ARG 59 HH11 ARG 59 58.157 53.248 -17.840 455 HH12 ARG 59 HH12 ARG 59 59.812 53.019 -17.394 456 HH21 ARG 59 HH21 ARG 59 60.779 56.244 -18.200 457 HH22 ARG 59 HH22 ARG 59 61.289 54.703 -17.596 458 H GLU 60 HN GLU 60 53.188 53.312 -21.764 459 HA GLU 60 HA GLU 60 55.641 51.674 -21.982 460 HB2 GLU 60 HB2 GLU 60 52.844 50.810 -21.207 461 HB3 GLU 60 HB1 GLU 60 54.236 49.740 -21.382 462 HG2 GLU 60 HG2 GLU 60 54.036 52.059 -19.437 463 HG3 GLU 60 HG1 GLU 60 53.878 50.354 -19.016 464 HA PRO 61 HA PRO 61 53.579 51.935 -26.151 465 HB2 PRO 61 HB2 PRO 61 55.943 52.211 -27.533 466 HB3 PRO 61 HB1 PRO 61 54.991 53.573 -26.913 467 HG2 PRO 61 HG2 PRO 61 57.431 52.302 -25.787 468 HG3 PRO 61 HG1 PRO 61 56.963 54.010 -25.832 469 HD2 PRO 61 HD2 PRO 61 56.721 52.475 -23.587 470 HD3 PRO 61 HD1 PRO 61 55.637 53.838 -23.943 471 H LEU 62 HN LEU 62 55.939 49.954 -24.629 472 HA LEU 62 HA LEU 62 56.571 48.124 -26.653 473 HB2 LEU 62 HB2 LEU 62 57.747 48.201 -24.501 474 HB3 LEU 62 HB1 LEU 62 56.289 47.658 -23.673 475 HG LEU 62 HG LEU 62 56.338 45.565 -25.025 476 HD11 LEU 62 HD11 LEU 62 57.499 46.266 -27.002 477 HD12 LEU 62 HD12 LEU 62 58.547 45.094 -26.204 478 HD13 LEU 62 HD13 LEU 62 58.888 46.819 -26.067 479 HD21 LEU 62 HD21 LEU 62 58.202 44.542 -23.834 480 HD22 LEU 62 HD22 LEU 62 57.434 45.729 -22.779 481 HD23 LEU 62 HD23 LEU 62 58.951 46.120 -23.589 482 H ASN 63 HN ASN 63 53.874 48.207 -24.348 483 HA ASN 63 HA ASN 63 52.754 45.717 -25.233 484 HB2 ASN 63 HB2 ASN 63 50.728 46.559 -23.932 485 HB3 ASN 63 HB1 ASN 63 52.219 46.353 -23.015 486 HD21 ASN 63 HD21 ASN 63 50.550 48.935 -24.919 487 HD22 ASN 63 HD22 ASN 63 50.984 50.187 -23.859 488 H TYR 64 HN TYR 64 52.575 49.006 -26.299 489 HA TYR 64 HA TYR 64 50.074 48.775 -27.686 490 HB2 TYR 64 HB2 TYR 64 51.080 50.944 -26.927 491 HB3 TYR 64 HB1 TYR 64 52.304 50.758 -28.183 492 HD1 TYR 64 HD1 TYR 64 48.650 51.094 -27.572 493 HD2 TYR 64 HD2 TYR 64 51.814 51.219 -30.475 494 HE1 TYR 64 HE1 TYR 64 47.080 52.038 -29.243 495 HE2 TYR 64 HE2 TYR 64 50.244 52.163 -32.146 496 HH TYR 64 HH TYR 64 46.985 52.047 -31.874 497 H LEU 65 HN LEU 65 53.418 48.120 -28.413 498 HA LEU 65 HA LEU 65 53.140 48.000 -31.255 499 HB2 LEU 65 HB2 LEU 65 55.221 46.873 -29.371 500 HB3 LEU 65 HB1 LEU 65 55.347 46.796 -31.127 501 HG LEU 65 HG LEU 65 54.948 49.392 -29.623 502 HD11 LEU 65 HD11 LEU 65 57.316 49.763 -29.742 503 HD12 LEU 65 HD12 LEU 65 57.556 48.317 -30.722 504 HD13 LEU 65 HD13 LEU 65 57.097 48.166 -29.026 505 HD21 LEU 65 HD21 LEU 65 55.954 50.258 -31.812 506 HD22 LEU 65 HD22 LEU 65 54.325 49.592 -31.927 507 HD23 LEU 65 HD23 LEU 65 55.708 48.634 -32.455 508 HA PRO 66 HA PRO 66 51.356 44.051 -32.027 509 HB2 PRO 66 HB2 PRO 66 53.787 43.282 -33.572 510 HB3 PRO 66 HB1 PRO 66 52.087 43.299 -34.078 511 HG2 PRO 66 HG2 PRO 66 53.804 45.156 -34.907 512 HG3 PRO 66 HG1 PRO 66 52.110 45.543 -34.555 513 HD2 PRO 66 HD2 PRO 66 54.555 46.164 -32.952 514 HD3 PRO 66 HD1 PRO 66 53.046 47.089 -33.120 515 H LEU 67 HN LEU 67 51.299 42.060 -31.054 516 HA LEU 67 HA LEU 67 53.781 41.070 -29.794 517 HB2 LEU 67 HB2 LEU 67 51.636 42.163 -28.407 518 HB3 LEU 67 HB1 LEU 67 51.369 40.423 -28.294 519 HG LEU 67 HG LEU 67 54.094 41.601 -27.777 520 HD11 LEU 67 HD11 LEU 67 51.954 41.127 -25.684 521 HD12 LEU 67 HD12 LEU 67 52.365 42.721 -26.318 522 HD13 LEU 67 HD13 LEU 67 53.568 41.790 -25.426 523 HD21 LEU 67 HD21 LEU 67 54.065 39.213 -28.032 524 HD22 LEU 67 HD22 LEU 67 52.627 39.061 -27.022 525 HD23 LEU 67 HD23 LEU 67 54.167 39.526 -26.300 Start of MODEL 12 1 H1 THR 1 HT1 THR 1 -3.433 -5.421 -0.419 2 H2 THR 1 HT2 THR 1 -3.362 -3.727 -0.527 3 H3 THR 1 HT3 THR 1 -4.005 -4.467 0.861 4 HA THR 1 HA THR 1 -1.846 -5.424 1.373 5 HB THR 1 HB THR 1 -1.208 -5.330 -1.136 6 HG1 THR 1 HG1 THR 1 0.754 -4.358 0.649 7 HG21 THR 1 HG21 THR 1 -0.130 -3.350 -1.926 8 HG22 THR 1 HG22 THR 1 -0.156 -2.616 -0.322 9 HG23 THR 1 HG23 THR 1 -1.659 -2.824 -1.221 10 HA PRO 2 HA PRO 2 -1.703 -1.631 3.711 11 HB2 PRO 2 HB2 PRO 2 0.551 -2.015 5.194 12 HB3 PRO 2 HB1 PRO 2 -0.963 -2.889 5.497 13 HG2 PRO 2 HG2 PRO 2 1.497 -3.795 4.093 14 HG3 PRO 2 HG1 PRO 2 0.428 -4.686 5.190 15 HD2 PRO 2 HD2 PRO 2 0.344 -4.943 2.454 16 HD3 PRO 2 HD1 PRO 2 -1.050 -5.242 3.511 17 H ILE 3 HN ILE 3 -0.501 0.355 3.974 18 HA ILE 3 HA ILE 3 0.716 1.363 1.715 19 HB ILE 3 HB ILE 3 -0.135 2.708 3.643 20 HG12 ILE 3 HG12 ILE 3 1.758 4.395 3.556 21 HG13 ILE 3 HG11 ILE 3 2.686 3.202 2.648 22 HG21 ILE 3 HG21 ILE 3 1.054 1.265 5.361 23 HG22 ILE 3 HG22 ILE 3 1.223 3.003 5.604 24 HG23 ILE 3 HG23 ILE 3 2.548 2.079 4.898 25 HD11 ILE 3 HD11 ILE 3 -0.075 4.085 1.787 26 HD12 ILE 3 HD12 ILE 3 1.135 3.223 0.837 27 HD13 ILE 3 HD13 ILE 3 1.387 4.916 1.257 28 H GLU 4 HN GLU 4 2.787 1.560 0.956 29 HA GLU 4 HA GLU 4 4.843 -0.029 2.371 30 HB2 GLU 4 HB2 GLU 4 5.835 -0.479 0.186 31 HB3 GLU 4 HB1 GLU 4 4.143 -0.979 0.192 32 HG2 GLU 4 HG2 GLU 4 3.523 1.182 -0.865 33 HG3 GLU 4 HG1 GLU 4 5.230 1.620 -0.928 34 H SER 5 HN SER 5 7.085 0.691 2.013 35 HA SER 5 HA SER 5 7.357 3.482 2.557 36 HB2 SER 5 HB2 SER 5 9.719 3.028 2.723 37 HB3 SER 5 HB1 SER 5 8.855 1.685 3.465 38 HG SER 5 HG SER 5 10.165 1.829 0.972 39 H HIS 6 HN HIS 6 8.804 4.930 1.333 40 HA HIS 6 HA HIS 6 7.982 5.209 -1.349 41 HB2 HIS 6 HB2 HIS 6 9.485 7.065 -1.457 42 HB3 HIS 6 HB1 HIS 6 8.836 7.037 0.183 43 HD1 HIS 6 HD1 HIS 6 11.944 7.411 -1.486 44 HD2 HIS 6 HD2 HIS 6 10.750 5.310 1.911 45 HE1 HIS 6 HE1 HIS 6 14.048 6.949 -0.153 46 HE2 HIS 6 HE2 HIS 6 13.336 5.668 1.921 47 H GLN 7 HN GLN 7 10.559 3.404 0.096 48 HA GLN 7 HA GLN 7 12.409 3.251 -1.985 49 HB2 GLN 7 HB2 GLN 7 12.650 2.290 0.339 50 HB3 GLN 7 HB1 GLN 7 11.630 0.950 -0.187 51 HG2 GLN 7 HG2 GLN 7 13.227 0.464 -2.015 52 HG3 GLN 7 HG1 GLN 7 14.257 1.779 -1.453 53 HE21 GLN 7 HE21 GLN 7 15.133 1.540 0.833 54 HE22 GLN 7 HE22 GLN 7 15.404 -0.026 1.431 55 H VAL 8 HN VAL 8 12.472 2.237 -3.909 56 HA VAL 8 HA VAL 8 10.406 0.234 -4.533 57 HB VAL 8 HB VAL 8 9.586 2.400 -5.374 58 HG11 VAL 8 HG11 VAL 8 11.938 3.346 -5.638 59 HG12 VAL 8 HG12 VAL 8 10.832 3.686 -6.969 60 HG13 VAL 8 HG13 VAL 8 12.049 2.421 -7.135 61 HG21 VAL 8 HG21 VAL 8 9.144 0.301 -6.639 62 HG22 VAL 8 HG22 VAL 8 10.609 0.582 -7.581 63 HG23 VAL 8 HG23 VAL 8 9.252 1.702 -7.705 64 H GLU 9 HN GLU 9 11.033 -1.332 -5.991 65 HA GLU 9 HA GLU 9 13.833 -1.189 -6.932 66 HB2 GLU 9 HB2 GLU 9 13.561 -3.819 -6.754 67 HB3 GLU 9 HB1 GLU 9 14.027 -2.858 -5.352 68 HG2 GLU 9 HG2 GLU 9 12.200 -4.486 -4.850 69 HG3 GLU 9 HG1 GLU 9 11.728 -2.815 -4.553 70 H LYS 10 HN LYS 10 12.304 -0.175 -8.713 71 HA LYS 10 HA LYS 10 11.414 -2.336 -10.521 72 HB2 LYS 10 HB2 LYS 10 10.031 -0.657 -11.623 73 HB3 LYS 10 HB1 LYS 10 9.682 -0.676 -9.894 74 HG2 LYS 10 HG2 LYS 10 11.217 1.245 -9.575 75 HG3 LYS 10 HG1 LYS 10 11.512 1.282 -11.314 76 HD2 LYS 10 HD2 LYS 10 9.071 1.630 -11.687 77 HD3 LYS 10 HD1 LYS 10 8.842 1.699 -9.939 78 HE2 LYS 10 HE2 LYS 10 10.635 3.554 -11.534 79 HE3 LYS 10 HE1 LYS 10 9.031 3.967 -10.929 80 HZ1 LYS 10 HZ1 LYS 10 11.515 3.489 -9.426 81 HZ2 LYS 10 HZ2 LYS 10 10.013 3.219 -8.677 82 HZ3 LYS 10 HZ3 LYS 10 10.401 4.760 -9.280 83 H ARG 11 HN ARG 11 11.648 -1.698 -12.901 84 HA ARG 11 HA ARG 11 14.299 -0.463 -13.309 85 HB2 ARG 11 HB2 ARG 11 14.205 -2.025 -15.455 86 HB3 ARG 11 HB1 ARG 11 14.808 -2.616 -13.914 87 HG2 ARG 11 HG2 ARG 11 13.325 -4.300 -14.666 88 HG3 ARG 11 HG1 ARG 11 12.386 -3.424 -13.470 89 HD2 ARG 11 HD2 ARG 11 12.266 -2.587 -16.351 90 HD3 ARG 11 HD1 ARG 11 11.341 -3.982 -15.817 91 HE ARG 11 HE ARG 11 10.807 -1.211 -15.176 92 HH11 ARG 11 HH11 ARG 11 10.368 -4.542 -14.235 93 HH12 ARG 11 HH12 ARG 11 8.934 -4.218 -13.325 94 HH21 ARG 11 HH21 ARG 11 8.931 -0.820 -13.981 95 HH22 ARG 11 HH22 ARG 11 8.124 -2.127 -13.180 96 H LYS 12 HN LYS 12 12.644 1.424 -13.406 97 HA LYS 12 HA LYS 12 10.969 1.770 -15.637 98 HB2 LYS 12 HB2 LYS 12 11.055 4.145 -15.125 99 HB3 LYS 12 HB1 LYS 12 10.964 3.230 -13.620 100 HG2 LYS 12 HG2 LYS 12 13.445 3.390 -13.414 101 HG3 LYS 12 HG1 LYS 12 13.472 4.400 -14.860 102 HD2 LYS 12 HD2 LYS 12 12.070 6.073 -13.762 103 HD3 LYS 12 HD1 LYS 12 11.926 5.049 -12.333 104 HE2 LYS 12 HE2 LYS 12 13.635 6.687 -11.872 105 HE3 LYS 12 HE1 LYS 12 14.442 5.139 -12.122 106 HZ1 LYS 12 HZ1 LYS 12 14.183 7.369 -14.061 107 HZ2 LYS 12 HZ2 LYS 12 14.749 5.823 -14.481 108 HZ3 LYS 12 HZ3 LYS 12 15.608 6.770 -13.363 109 H CYS 13 HN CYS 13 11.288 2.989 -17.566 110 HA CYS 13 HA CYS 13 13.447 2.295 -19.123 111 HB2 CYS 13 HB2 CYS 13 11.233 3.405 -19.815 112 HB3 CYS 13 HB1 CYS 13 12.044 4.936 -19.484 113 H ASN 14 HN ASN 14 15.518 2.613 -18.597 114 HA ASN 14 HA ASN 14 16.335 5.273 -17.598 115 HB2 ASN 14 HB2 ASN 14 18.360 4.110 -16.764 116 HB3 ASN 14 HB1 ASN 14 16.874 3.478 -16.058 117 HD21 ASN 14 HD21 ASN 14 17.260 1.259 -15.802 118 HD22 ASN 14 HD22 ASN 14 17.837 0.239 -17.030 119 H THR 15 HN THR 15 16.365 3.388 -20.399 120 HA THR 15 HA THR 15 18.918 3.767 -21.445 121 HB THR 15 HB THR 15 17.024 2.397 -22.435 122 HG1 THR 15 HG1 THR 15 18.315 2.406 -24.066 123 HG21 THR 15 HG21 THR 15 16.250 4.979 -23.785 124 HG22 THR 15 HG22 THR 15 15.431 4.422 -22.327 125 HG23 THR 15 HG23 THR 15 15.390 3.441 -23.792 126 H ALA 16 HN ALA 16 19.334 5.227 -23.410 127 HA ALA 16 HA ALA 16 19.219 7.940 -22.509 128 HB1 ALA 16 HB1 ALA 16 20.074 6.846 -25.200 129 HB2 ALA 16 HB2 ALA 16 21.128 7.050 -23.801 130 HB3 ALA 16 HB3 ALA 16 20.415 8.462 -24.581 131 H THR 17 HN THR 17 17.521 6.071 -24.968 132 HA THR 17 HA THR 17 16.254 8.084 -26.389 133 HB THR 17 HB THR 17 15.121 5.399 -25.567 134 HG1 THR 17 HG1 THR 17 16.205 4.644 -27.224 135 HG21 THR 17 HG21 THR 17 13.780 5.745 -27.702 136 HG22 THR 17 HG22 THR 17 14.285 7.434 -27.641 137 HG23 THR 17 HG23 THR 17 13.309 6.757 -26.337 138 H CYS 18 HN CYS 18 15.151 6.518 -23.381 139 HA CYS 18 HA CYS 18 12.811 8.133 -23.131 140 HB2 CYS 18 HB2 CYS 18 14.323 6.394 -21.178 141 HB3 CYS 18 HB1 CYS 18 12.844 7.255 -20.751 142 H ALA 19 HN ALA 19 16.126 8.386 -21.983 143 HA ALA 19 HA ALA 19 15.812 10.388 -20.053 144 HB1 ALA 19 HB1 ALA 19 17.921 9.013 -20.832 145 HB2 ALA 19 HB2 ALA 19 18.114 10.614 -20.119 146 HB3 ALA 19 HB3 ALA 19 18.189 10.413 -21.870 147 H THR 20 HN THR 20 16.326 10.660 -23.563 148 HA THR 20 HA THR 20 16.484 13.465 -23.678 149 HB THR 20 HB THR 20 15.459 11.520 -25.760 150 HG1 THR 20 HG1 THR 20 17.496 11.208 -26.209 151 HG21 THR 20 HG21 THR 20 16.419 14.387 -25.974 152 HG22 THR 20 HG22 THR 20 14.778 13.810 -26.266 153 HG23 THR 20 HG23 THR 20 16.086 13.332 -27.347 154 H GLN 21 HN GLN 21 13.719 11.279 -23.619 155 HA GLN 21 HA GLN 21 11.726 13.074 -24.422 156 HB2 GLN 21 HB2 GLN 21 10.329 11.365 -23.982 157 HB3 GLN 21 HB1 GLN 21 11.786 10.443 -23.622 158 HG2 GLN 21 HG2 GLN 21 11.596 11.256 -21.232 159 HG3 GLN 21 HG1 GLN 21 10.020 11.922 -21.654 160 HE21 GLN 21 HE21 GLN 21 11.825 8.897 -21.222 161 HE22 GLN 21 HE22 GLN 21 10.459 7.890 -21.206 162 H ARG 22 HN ARG 22 13.394 12.743 -21.354 163 HA ARG 22 HA ARG 22 11.502 14.388 -19.924 164 HB2 ARG 22 HB2 ARG 22 12.727 13.934 -18.037 165 HB3 ARG 22 HB1 ARG 22 13.215 12.568 -19.031 166 HG2 ARG 22 HG2 ARG 22 15.297 13.296 -18.383 167 HG3 ARG 22 HG1 ARG 22 15.109 14.307 -19.808 168 HD2 ARG 22 HD2 ARG 22 15.351 16.111 -18.484 169 HD3 ARG 22 HD1 ARG 22 13.822 15.693 -17.716 170 HE ARG 22 HE ARG 22 15.021 14.963 -15.877 171 HH11 ARG 22 HH11 ARG 22 17.115 15.131 -18.661 172 HH12 ARG 22 HH12 ARG 22 18.544 14.775 -17.755 173 HH21 ARG 22 HH21 ARG 22 16.905 14.499 -14.719 174 HH22 ARG 22 HH22 ARG 22 18.429 14.419 -15.538 175 H LEU 23 HN LEU 23 14.290 14.913 -21.901 176 HA LEU 23 HA LEU 23 14.953 17.515 -20.913 177 HB2 LEU 23 HB2 LEU 23 16.566 16.128 -22.163 178 HB3 LEU 23 HB1 LEU 23 15.544 16.235 -23.595 179 HG LEU 23 HG LEU 23 15.788 18.723 -23.532 180 HD11 LEU 23 HD11 LEU 23 16.258 19.135 -21.222 181 HD12 LEU 23 HD12 LEU 23 17.730 19.556 -22.097 182 HD13 LEU 23 HD13 LEU 23 17.627 18.023 -21.232 183 HD21 LEU 23 HD21 LEU 23 17.997 18.746 -24.475 184 HD22 LEU 23 HD22 LEU 23 17.314 17.163 -24.844 185 HD23 LEU 23 HD23 LEU 23 18.480 17.335 -23.533 186 H ALA 24 HN ALA 24 12.843 16.248 -23.435 187 HA ALA 24 HA ALA 24 12.257 18.693 -24.724 188 HB1 ALA 24 HB1 ALA 24 10.491 16.250 -24.435 189 HB2 ALA 24 HB2 ALA 24 11.729 16.465 -25.673 190 HB3 ALA 24 HB3 ALA 24 10.320 17.525 -25.641 191 H ASN 25 HN ASN 25 10.816 17.052 -21.937 192 HA ASN 25 HA ASN 25 8.608 18.820 -21.635 193 HB2 ASN 25 HB2 ASN 25 8.856 16.517 -20.606 194 HB3 ASN 25 HB1 ASN 25 9.964 17.244 -19.443 195 HD21 ASN 25 HD21 ASN 25 8.579 17.048 -17.588 196 HD22 ASN 25 HD22 ASN 25 7.112 17.891 -17.453 197 H PHE 26 HN PHE 26 11.924 18.828 -20.464 198 HA PHE 26 HA PHE 26 11.655 20.905 -18.558 199 HB2 PHE 26 HB2 PHE 26 13.597 19.390 -18.631 200 HB3 PHE 26 HB1 PHE 26 14.089 20.100 -20.169 201 HD1 PHE 26 HD1 PHE 26 13.462 20.877 -16.579 202 HD2 PHE 26 HD2 PHE 26 15.286 22.150 -20.254 203 HE1 PHE 26 HE1 PHE 26 14.632 22.697 -15.368 204 HE2 PHE 26 HE2 PHE 26 16.457 23.970 -19.042 205 HZ PHE 26 HZ PHE 26 16.129 24.244 -16.599 206 H LEU 27 HN LEU 27 12.319 20.911 -22.031 207 HA LEU 27 HA LEU 27 13.048 23.609 -22.277 208 HB2 LEU 27 HB2 LEU 27 13.371 21.912 -24.059 209 HB3 LEU 27 HB1 LEU 27 11.632 21.810 -24.276 210 HG LEU 27 HG LEU 27 13.017 23.263 -25.921 211 HD11 LEU 27 HD11 LEU 27 10.707 24.767 -24.714 212 HD12 LEU 27 HD12 LEU 27 10.445 23.209 -25.497 213 HD13 LEU 27 HD13 LEU 27 11.135 24.549 -26.409 214 HD21 LEU 27 HD21 LEU 27 14.147 24.462 -23.916 215 HD22 LEU 27 HD22 LEU 27 12.659 25.402 -23.826 216 HD23 LEU 27 HD23 LEU 27 13.638 25.441 -25.291 217 H VAL 28 HN VAL 28 9.866 22.036 -22.358 218 HA VAL 28 HA VAL 28 8.505 24.569 -22.793 219 HB VAL 28 HB VAL 28 6.446 23.239 -22.595 220 HG11 VAL 28 HG11 VAL 28 7.845 23.317 -24.723 221 HG12 VAL 28 HG12 VAL 28 6.745 21.946 -24.588 222 HG13 VAL 28 HG13 VAL 28 8.466 21.730 -24.269 223 HG21 VAL 28 HG21 VAL 28 8.305 20.897 -22.075 224 HG22 VAL 28 HG22 VAL 28 6.546 20.841 -22.178 225 HG23 VAL 28 HG23 VAL 28 7.323 21.680 -20.837 226 H HIS 29 HN HIS 29 9.429 22.541 -20.118 227 HA HIS 29 HA HIS 29 7.666 23.724 -18.195 228 HB2 HIS 29 HB2 HIS 29 8.702 21.478 -17.915 229 HB3 HIS 29 HB1 HIS 29 10.273 22.258 -17.731 230 HD1 HIS 29 HD1 HIS 29 6.805 22.525 -16.144 231 HD2 HIS 29 HD2 HIS 29 10.827 22.866 -15.100 232 HE1 HIS 29 HE1 HIS 29 6.863 22.956 -13.649 233 HE2 HIS 29 HE2 HIS 29 9.308 23.165 -12.997 234 H SER 30 HN SER 30 10.702 24.586 -19.592 235 HA SER 30 HA SER 30 10.977 26.784 -17.632 236 HB2 SER 30 HB2 SER 30 12.827 24.906 -17.930 237 HB3 SER 30 HB1 SER 30 13.304 25.919 -19.289 238 HG SER 30 HG SER 30 14.358 26.618 -17.434 239 H SER 31 HN SER 31 9.654 26.405 -20.470 240 HA SER 31 HA SER 31 11.056 28.191 -22.191 241 HB2 SER 31 HB2 SER 31 9.431 26.582 -23.076 242 HB3 SER 31 HB1 SER 31 8.139 27.373 -22.179 243 HG SER 31 HG SER 31 9.539 28.201 -24.450 244 H ASN 32 HN ASN 32 8.395 28.624 -19.882 245 HA ASN 32 HA ASN 32 7.722 31.258 -20.482 246 HB2 ASN 32 HB2 ASN 32 6.925 31.390 -18.145 247 HB3 ASN 32 HB1 ASN 32 6.425 29.893 -18.929 248 HD21 ASN 32 HD21 ASN 32 7.519 30.936 -16.022 249 HD22 ASN 32 HD22 ASN 32 8.409 29.578 -15.530 250 H ASN 33 HN ASN 33 10.508 29.965 -18.863 251 HA ASN 33 HA ASN 33 11.306 32.402 -17.594 252 HB2 ASN 33 HB2 ASN 33 12.804 29.859 -18.247 253 HB3 ASN 33 HB1 ASN 33 13.533 31.213 -17.384 254 HD21 ASN 33 HD21 ASN 33 12.264 31.927 -15.343 255 HD22 ASN 33 HD22 ASN 33 11.520 30.702 -14.433 256 H PHE 34 HN PHE 34 11.651 31.030 -20.741 257 HA PHE 34 HA PHE 34 13.920 32.362 -21.707 258 HB2 PHE 34 HB2 PHE 34 12.744 30.575 -22.954 259 HB3 PHE 34 HB1 PHE 34 11.395 31.675 -23.235 260 HD1 PHE 34 HD1 PHE 34 15.069 31.284 -23.785 261 HD2 PHE 34 HD2 PHE 34 11.434 33.201 -25.037 262 HE1 PHE 34 HE1 PHE 34 16.244 32.224 -25.756 263 HE2 PHE 34 HE2 PHE 34 12.609 34.141 -27.008 264 HZ PHE 34 HZ PHE 34 15.014 33.653 -27.368 265 H GLY 35 HN GLY 35 10.526 33.388 -21.592 266 HA2 GLY 35 HA2 GLY 35 10.910 35.898 -22.885 267 HA3 GLY 35 HA1 GLY 35 9.544 35.452 -21.846 268 H ALA 36 HN ALA 36 10.782 34.979 -19.429 269 HA ALA 36 HA ALA 36 11.071 37.527 -18.351 270 HB1 ALA 36 HB1 ALA 36 12.292 36.192 -16.462 271 HB2 ALA 36 HB2 ALA 36 11.822 34.780 -17.408 272 HB3 ALA 36 HB3 ALA 36 10.588 35.875 -16.785 273 H ILE 37 HN ILE 37 13.490 35.261 -19.558 274 HA ILE 37 HA ILE 37 15.813 36.592 -18.687 275 HB ILE 37 HB ILE 37 15.275 34.761 -21.023 276 HG12 ILE 37 HG12 ILE 37 16.914 34.325 -18.515 277 HG13 ILE 37 HG11 ILE 37 15.192 33.955 -18.595 278 HG21 ILE 37 HG21 ILE 37 17.820 34.587 -21.079 279 HG22 ILE 37 HG22 ILE 37 17.851 36.060 -20.110 280 HG23 ILE 37 HG23 ILE 37 17.144 36.081 -21.726 281 HD11 ILE 37 HD11 ILE 37 16.717 31.995 -19.095 282 HD12 ILE 37 HD12 ILE 37 17.217 32.849 -20.555 283 HD13 ILE 37 HD13 ILE 37 15.537 32.351 -20.356 284 H LEU 38 HN LEU 38 13.854 36.959 -21.615 285 HA LEU 38 HA LEU 38 15.558 38.702 -23.014 286 HB2 LEU 38 HB2 LEU 38 13.606 37.596 -24.043 287 HB3 LEU 38 HB1 LEU 38 12.530 38.581 -23.054 288 HG LEU 38 HG LEU 38 13.518 40.631 -24.091 289 HD11 LEU 38 HD11 LEU 38 15.690 39.872 -24.756 290 HD12 LEU 38 HD12 LEU 38 14.813 40.204 -26.250 291 HD13 LEU 38 HD13 LEU 38 15.011 38.542 -25.694 292 HD21 LEU 38 HD21 LEU 38 11.453 39.516 -24.982 293 HD22 LEU 38 HD22 LEU 38 12.470 38.640 -26.126 294 HD23 LEU 38 HD23 LEU 38 12.355 40.398 -26.214 295 H SER 39 HN SER 39 13.077 39.357 -20.555 296 HA SER 39 HA SER 39 13.241 42.196 -20.806 297 HB2 SER 39 HB2 SER 39 12.233 40.428 -18.568 298 HB3 SER 39 HB1 SER 39 12.073 42.182 -18.590 299 HG SER 39 HG SER 39 11.151 40.458 -20.649 300 H SER 40 HN SER 40 14.847 39.784 -18.792 301 HA SER 40 HA SER 40 16.362 41.863 -17.393 302 HB2 SER 40 HB2 SER 40 16.310 38.854 -17.075 303 HB3 SER 40 HB1 SER 40 17.278 39.949 -16.092 304 HG SER 40 HG SER 40 15.213 39.405 -15.170 305 H THR 41 HN THR 41 16.733 41.387 -20.269 306 HA THR 41 HA THR 41 18.992 39.888 -20.899 307 HB THR 41 HB THR 41 17.538 40.955 -22.580 308 HG1 THR 41 HG1 THR 41 20.192 41.925 -22.758 309 HG21 THR 41 HG21 THR 41 17.657 43.327 -23.008 310 HG22 THR 41 HG22 THR 41 18.931 43.529 -21.805 311 HG23 THR 41 HG23 THR 41 17.296 43.109 -21.295 312 H ASN 42 HN ASN 42 18.745 42.813 -19.080 313 HA ASN 42 HA ASN 42 21.534 43.547 -19.460 314 HB2 ASN 42 HB2 ASN 42 21.047 45.419 -18.024 315 HB3 ASN 42 HB1 ASN 42 19.724 45.251 -19.177 316 HD21 ASN 42 HD21 ASN 42 19.217 46.604 -16.769 317 HD22 ASN 42 HD22 ASN 42 18.225 45.647 -15.779 318 H VAL 43 HN VAL 43 20.440 40.984 -18.015 319 HA VAL 43 HA VAL 43 21.682 41.338 -15.391 320 HB VAL 43 HB VAL 43 19.475 40.090 -15.819 321 HG11 VAL 43 HG11 VAL 43 21.348 37.828 -16.540 322 HG12 VAL 43 HG12 VAL 43 20.523 38.791 -17.765 323 HG13 VAL 43 HG13 VAL 43 19.587 37.846 -16.607 324 HG21 VAL 43 HG21 VAL 43 21.583 38.473 -14.370 325 HG22 VAL 43 HG22 VAL 43 19.877 38.649 -13.966 326 HG23 VAL 43 HG23 VAL 43 20.980 40.004 -13.736 327 H GLY 44 HN GLY 44 23.126 41.194 -18.110 328 HA2 GLY 44 HA2 GLY 44 25.554 40.513 -17.805 329 HA3 GLY 44 HA1 GLY 44 24.899 38.909 -17.494 330 H SER 45 HN SER 45 22.742 39.539 -19.570 331 HA SER 45 HA SER 45 24.350 38.711 -21.888 332 HB2 SER 45 HB2 SER 45 22.208 37.954 -22.833 333 HB3 SER 45 HB1 SER 45 22.487 37.246 -21.244 334 HG SER 45 HG SER 45 21.001 39.623 -21.690 335 H ASN 46 HN ASN 46 24.058 41.524 -20.888 336 HA ASN 46 HA ASN 46 22.355 42.983 -22.616 337 HB2 ASN 46 HB2 ASN 46 23.656 44.933 -21.936 338 HB3 ASN 46 HB1 ASN 46 23.319 43.912 -20.539 339 HD21 ASN 46 HD21 ASN 46 25.684 45.813 -21.317 340 HD22 ASN 46 HD22 ASN 46 27.054 44.864 -20.991 341 H THR 47 HN THR 47 25.359 41.398 -23.168 342 HA THR 47 HA THR 47 26.010 43.037 -25.499 343 HB THR 47 HB THR 47 27.463 40.527 -24.730 344 HG1 THR 47 HG1 THR 47 27.867 41.393 -22.878 345 HG21 THR 47 HG21 THR 47 27.970 41.906 -26.807 346 HG22 THR 47 HG22 THR 47 29.331 41.654 -25.715 347 HG23 THR 47 HG23 THR 47 28.479 43.198 -25.719 348 H TYR 48 HN TYR 48 23.548 41.383 -25.401 349 HA TYR 48 HA TYR 48 24.085 39.254 -27.328 350 HB2 TYR 48 HB2 TYR 48 21.935 38.468 -26.876 351 HB3 TYR 48 HB1 TYR 48 22.424 39.151 -25.326 352 HD1 TYR 48 HD1 TYR 48 19.921 39.156 -27.844 353 HD2 TYR 48 HD2 TYR 48 21.845 41.697 -24.963 354 HE1 TYR 48 HE1 TYR 48 17.987 40.706 -27.919 355 HE2 TYR 48 HE2 TYR 48 19.911 43.247 -25.040 356 HH TYR 48 HH TYR 48 17.584 43.252 -25.634 357 H GLY 49 HN GLY 49 24.202 42.308 -27.854 358 HA2 GLY 49 HA2 GLY 49 22.140 43.122 -29.532 359 HA3 GLY 49 HA1 GLY 49 23.811 43.658 -29.676 360 H LYS 50 HN LYS 50 21.489 42.580 -31.525 361 HA LYS 50 HA LYS 50 22.504 40.293 -32.848 362 HB2 LYS 50 HB2 LYS 50 20.637 42.493 -33.744 363 HB3 LYS 50 HB1 LYS 50 21.017 41.087 -34.740 364 HG2 LYS 50 HG2 LYS 50 20.287 39.632 -32.805 365 HG3 LYS 50 HG1 LYS 50 19.707 41.095 -32.009 366 HD2 LYS 50 HD2 LYS 50 18.833 40.268 -34.787 367 HD3 LYS 50 HD1 LYS 50 17.946 39.830 -33.327 368 HE2 LYS 50 HE2 LYS 50 18.593 42.663 -34.198 369 HE3 LYS 50 HE1 LYS 50 17.021 41.881 -34.357 370 HZ1 LYS 50 HZ1 LYS 50 17.153 41.510 -31.883 371 HZ2 LYS 50 HZ2 LYS 50 16.928 43.118 -32.383 372 HZ3 LYS 50 HZ3 LYS 50 18.459 42.592 -31.870 373 H ARG 51 HN ARG 51 23.007 43.754 -33.321 374 HA ARG 51 HA ARG 51 24.251 43.807 -35.778 375 HB2 ARG 51 HB2 ARG 51 25.396 45.823 -35.035 376 HB3 ARG 51 HB1 ARG 51 23.751 45.810 -34.399 377 HG2 ARG 51 HG2 ARG 51 24.572 44.974 -32.238 378 HG3 ARG 51 HG1 ARG 51 26.220 44.935 -32.866 379 HD2 ARG 51 HD2 ARG 51 26.029 46.972 -31.641 380 HD3 ARG 51 HD1 ARG 51 25.975 47.420 -33.339 381 HE ARG 51 HE ARG 51 23.752 47.508 -31.433 382 HH11 ARG 51 HH11 ARG 51 24.835 47.807 -34.745 383 HH12 ARG 51 HH12 ARG 51 23.451 48.718 -35.231 384 HH21 ARG 51 HH21 ARG 51 21.970 48.706 -32.107 385 HH22 ARG 51 HH22 ARG 51 21.840 49.221 -33.756 386 H ASN 52 HN ASN 52 25.461 42.525 -32.778 387 HA ASN 52 HA ASN 52 28.217 42.504 -33.329 388 HB2 ASN 52 HB2 ASN 52 27.286 41.988 -31.114 389 HB3 ASN 52 HB1 ASN 52 26.586 40.501 -31.752 390 HD21 ASN 52 HD21 ASN 52 27.886 38.670 -31.564 391 HD22 ASN 52 HD22 ASN 52 29.567 38.697 -31.328 392 H ALA 53 HN ALA 53 25.644 40.219 -34.123 393 HA ALA 53 HA ALA 53 27.314 38.223 -35.266 394 HB1 ALA 53 HB1 ALA 53 25.073 37.596 -36.433 395 HB2 ALA 53 HB2 ALA 53 24.379 38.843 -35.397 396 HB3 ALA 53 HB3 ALA 53 25.191 37.452 -34.679 397 H VAL 54 HN VAL 54 25.470 40.921 -36.676 398 HA VAL 54 HA VAL 54 26.189 40.308 -39.370 399 HB VAL 54 HB VAL 54 24.317 41.915 -38.227 400 HG11 VAL 54 HG11 VAL 54 26.313 43.814 -39.482 401 HG12 VAL 54 HG12 VAL 54 26.191 43.580 -37.738 402 HG13 VAL 54 HG13 VAL 54 24.818 44.215 -38.640 403 HG21 VAL 54 HG21 VAL 54 23.787 42.584 -40.498 404 HG22 VAL 54 HG22 VAL 54 24.412 40.935 -40.543 405 HG23 VAL 54 HG23 VAL 54 25.446 42.282 -41.018 406 H GLU 55 HN GLU 55 27.796 41.925 -36.780 407 HA GLU 55 HA GLU 55 29.540 43.505 -38.452 408 HB2 GLU 55 HB2 GLU 55 28.868 43.991 -36.015 409 HB3 GLU 55 HB1 GLU 55 30.064 42.771 -35.577 410 HG2 GLU 55 HG2 GLU 55 30.759 45.039 -37.438 411 HG3 GLU 55 HG1 GLU 55 30.850 45.235 -35.689 412 H VAL 56 HN VAL 56 30.090 40.706 -36.293 413 HA VAL 56 HA VAL 56 32.718 40.188 -37.053 414 HB VAL 56 HB VAL 56 31.605 39.108 -35.132 415 HG11 VAL 56 HG11 VAL 56 30.236 37.384 -37.214 416 HG12 VAL 56 HG12 VAL 56 29.438 38.697 -36.349 417 HG13 VAL 56 HG13 VAL 56 30.038 37.295 -35.464 418 HG21 VAL 56 HG21 VAL 56 32.551 36.841 -35.500 419 HG22 VAL 56 HG22 VAL 56 33.646 38.103 -36.065 420 HG23 VAL 56 HG23 VAL 56 32.680 37.189 -37.224 421 H LEU 57 HN LEU 57 29.687 39.222 -38.569 422 HA LEU 57 HA LEU 57 30.674 37.336 -40.382 423 HB2 LEU 57 HB2 LEU 57 28.244 38.911 -40.080 424 HB3 LEU 57 HB1 LEU 57 28.672 38.690 -41.777 425 HG LEU 57 HG LEU 57 29.064 36.199 -41.105 426 HD11 LEU 57 HD11 LEU 57 28.805 36.786 -38.634 427 HD12 LEU 57 HD12 LEU 57 27.847 35.417 -39.198 428 HD13 LEU 57 HD13 LEU 57 27.083 36.988 -38.956 429 HD21 LEU 57 HD21 LEU 57 27.201 37.179 -42.536 430 HD22 LEU 57 HD22 LEU 57 26.217 37.235 -41.073 431 HD23 LEU 57 HD23 LEU 57 26.790 35.686 -41.692 432 H LYS 58 HN LYS 58 30.467 40.860 -40.596 433 HA LYS 58 HA LYS 58 31.380 41.137 -43.264 434 HB2 LYS 58 HB2 LYS 58 31.439 42.994 -40.884 435 HB3 LYS 58 HB1 LYS 58 31.997 43.471 -42.487 436 HG2 LYS 58 HG2 LYS 58 29.261 42.265 -42.077 437 HG3 LYS 58 HG1 LYS 58 29.540 43.996 -41.884 438 HD2 LYS 58 HD2 LYS 58 30.542 44.028 -44.187 439 HD3 LYS 58 HD1 LYS 58 30.058 42.342 -44.370 440 HE2 LYS 58 HE2 LYS 58 28.134 44.586 -43.707 441 HE3 LYS 58 HE1 LYS 58 28.408 43.974 -45.338 442 HZ1 LYS 58 HZ1 LYS 58 27.657 41.824 -44.680 443 HZ2 LYS 58 HZ2 LYS 58 26.486 42.954 -44.191 444 HZ3 LYS 58 HZ3 LYS 58 27.555 42.287 -43.051 445 H ARG 59 HN ARG 59 33.033 40.780 -40.186 446 HA ARG 59 HA ARG 59 35.614 41.574 -40.958 447 HB2 ARG 59 HB2 ARG 59 34.818 41.094 -38.610 448 HB3 ARG 59 HB1 ARG 59 34.966 39.377 -38.987 449 HG2 ARG 59 HG2 ARG 59 37.385 40.163 -39.821 450 HG3 ARG 59 HG1 ARG 59 37.102 41.429 -38.626 451 HD2 ARG 59 HD2 ARG 59 36.552 39.645 -36.953 452 HD3 ARG 59 HD1 ARG 59 37.012 38.438 -38.150 453 HE ARG 59 HE ARG 59 39.061 40.416 -37.674 454 HH11 ARG 59 HH11 ARG 59 37.657 37.408 -36.604 455 HH12 ARG 59 HH12 ARG 59 39.110 36.866 -35.840 456 HH21 ARG 59 HH21 ARG 59 40.945 39.682 -36.666 457 HH22 ARG 59 HH22 ARG 59 40.961 38.143 -35.873 458 H GLU 60 HN GLU 60 33.878 38.552 -41.424 459 HA GLU 60 HA GLU 60 36.245 37.463 -42.826 460 HB2 GLU 60 HB2 GLU 60 33.947 36.002 -41.504 461 HB3 GLU 60 HB1 GLU 60 35.257 35.233 -42.400 462 HG2 GLU 60 HG2 GLU 60 35.710 37.038 -40.012 463 HG3 GLU 60 HG1 GLU 60 35.587 35.283 -39.892 464 HA PRO 61 HA PRO 61 32.946 38.259 -46.001 465 HB2 PRO 61 HB2 PRO 61 34.646 39.308 -47.874 466 HB3 PRO 61 HB1 PRO 61 33.861 40.278 -46.613 467 HG2 PRO 61 HG2 PRO 61 36.638 39.220 -46.734 468 HG3 PRO 61 HG1 PRO 61 36.047 40.778 -46.131 469 HD2 PRO 61 HD2 PRO 61 36.722 38.694 -44.481 470 HD3 PRO 61 HD1 PRO 61 35.513 39.923 -44.053 471 H LEU 62 HN LEU 62 35.848 36.449 -45.810 472 HA LEU 62 HA LEU 62 36.063 35.305 -48.346 473 HB2 LEU 62 HB2 LEU 62 37.696 35.064 -46.453 474 HB3 LEU 62 HB1 LEU 62 36.586 33.908 -45.716 475 HG LEU 62 HG LEU 62 36.671 32.693 -48.009 476 HD11 LEU 62 HD11 LEU 62 37.819 34.535 -49.203 477 HD12 LEU 62 HD12 LEU 62 38.767 33.048 -49.251 478 HD13 LEU 62 HD13 LEU 62 39.214 34.343 -48.141 479 HD21 LEU 62 HD21 LEU 62 38.526 31.365 -47.257 480 HD22 LEU 62 HD22 LEU 62 37.730 31.974 -45.806 481 HD23 LEU 62 HD23 LEU 62 39.222 32.724 -46.374 482 H ASN 63 HN ASN 63 34.027 34.436 -45.590 483 HA ASN 63 HA ASN 63 32.980 32.070 -46.852 484 HB2 ASN 63 HB2 ASN 63 31.802 31.720 -44.890 485 HB3 ASN 63 HB1 ASN 63 33.140 32.704 -44.298 486 HD21 ASN 63 HD21 ASN 63 29.911 32.421 -43.890 487 HD22 ASN 63 HD22 ASN 63 29.491 34.045 -43.633 488 H TYR 64 HN TYR 64 32.133 35.446 -46.716 489 HA TYR 64 HA TYR 64 29.432 35.101 -47.645 490 HB2 TYR 64 HB2 TYR 64 30.190 37.077 -46.318 491 HB3 TYR 64 HB1 TYR 64 31.150 37.593 -47.705 492 HD1 TYR 64 HD1 TYR 64 27.671 36.768 -46.631 493 HD2 TYR 64 HD2 TYR 64 30.159 38.776 -49.499 494 HE1 TYR 64 HE1 TYR 64 25.665 37.833 -47.625 495 HE2 TYR 64 HE2 TYR 64 28.153 39.842 -50.493 496 HH TYR 64 HH TYR 64 25.894 40.397 -49.923 497 H LEU 65 HN LEU 65 32.572 35.503 -49.103 498 HA LEU 65 HA LEU 65 31.628 36.235 -51.705 499 HB2 LEU 65 HB2 LEU 65 34.268 35.175 -50.690 500 HB3 LEU 65 HB1 LEU 65 33.986 35.564 -52.386 501 HG LEU 65 HG LEU 65 33.460 37.543 -50.159 502 HD11 LEU 65 HD11 LEU 65 35.664 38.555 -50.910 503 HD12 LEU 65 HD12 LEU 65 35.977 37.048 -51.771 504 HD13 LEU 65 HD13 LEU 65 35.809 37.042 -50.015 505 HD21 LEU 65 HD21 LEU 65 33.806 39.124 -52.144 506 HD22 LEU 65 HD22 LEU 65 32.342 38.143 -52.191 507 HD23 LEU 65 HD23 LEU 65 33.737 37.693 -53.172 508 HA PRO 66 HA PRO 66 30.410 32.425 -53.536 509 HB2 PRO 66 HB2 PRO 66 32.510 32.791 -55.623 510 HB3 PRO 66 HB1 PRO 66 30.763 32.545 -55.810 511 HG2 PRO 66 HG2 PRO 66 31.878 34.932 -56.189 512 HG3 PRO 66 HG1 PRO 66 30.276 34.759 -55.452 513 HD2 PRO 66 HD2 PRO 66 32.881 35.435 -54.155 514 HD3 PRO 66 HD1 PRO 66 31.236 35.959 -53.731 515 H LEU 67 HN LEU 67 30.914 30.286 -53.298 516 HA LEU 67 HA LEU 67 33.731 29.625 -52.683 517 HB2 LEU 67 HB2 LEU 67 31.141 28.677 -51.495 518 HB3 LEU 67 HB1 LEU 67 32.575 27.653 -51.428 519 HG LEU 67 HG LEU 67 32.719 30.537 -50.574 520 HD11 LEU 67 HD11 LEU 67 32.060 28.216 -48.742 521 HD12 LEU 67 HD12 LEU 67 30.845 29.338 -49.354 522 HD13 LEU 67 HD13 LEU 67 32.145 29.926 -48.317 523 HD21 LEU 67 HD21 LEU 67 34.788 29.159 -50.931 524 HD22 LEU 67 HD22 LEU 67 34.214 28.050 -49.685 525 HD23 LEU 67 HD23 LEU 67 34.605 29.718 -49.269 Start of MODEL 13 1 H1 THR 1 HT1 THR 1 -3.138 -5.163 -1.768 2 H2 THR 1 HT2 THR 1 -3.585 -3.735 -0.962 3 H3 THR 1 HT3 THR 1 -4.208 -5.232 -0.454 4 HA THR 1 HA THR 1 -2.315 -5.857 0.598 5 HB THR 1 HB THR 1 -1.155 -4.952 -1.779 6 HG1 THR 1 HG1 THR 1 0.572 -6.111 -1.018 7 HG21 THR 1 HG21 THR 1 0.723 -3.568 -1.118 8 HG22 THR 1 HG22 THR 1 0.206 -3.596 0.566 9 HG23 THR 1 HG23 THR 1 -0.765 -2.751 -0.643 10 HA PRO 2 HA PRO 2 -2.500 -2.558 3.520 11 HB2 PRO 2 HB2 PRO 2 -0.315 -3.013 5.081 12 HB3 PRO 2 HB1 PRO 2 -1.741 -4.068 5.090 13 HG2 PRO 2 HG2 PRO 2 0.889 -4.452 3.758 14 HG3 PRO 2 HG1 PRO 2 -0.157 -5.635 4.561 15 HD2 PRO 2 HD2 PRO 2 -0.012 -5.321 1.822 16 HD3 PRO 2 HD1 PRO 2 -1.421 -5.993 2.670 17 H ILE 3 HN ILE 3 -1.644 -0.510 4.107 18 HA ILE 3 HA ILE 3 -0.069 0.772 2.126 19 HB ILE 3 HB ILE 3 -1.786 1.911 3.536 20 HG12 ILE 3 HG12 ILE 3 -0.346 3.951 4.000 21 HG13 ILE 3 HG11 ILE 3 1.053 2.976 3.551 22 HG21 ILE 3 HG21 ILE 3 -1.029 0.738 5.660 23 HG22 ILE 3 HG22 ILE 3 -1.305 2.472 5.821 24 HG23 ILE 3 HG23 ILE 3 0.340 1.849 5.692 25 HD11 ILE 3 HD11 ILE 3 -1.345 3.288 1.735 26 HD12 ILE 3 HD12 ILE 3 0.259 2.683 1.320 27 HD13 ILE 3 HD13 ILE 3 0.028 4.393 1.684 28 H GLU 4 HN GLU 4 2.067 1.150 1.992 29 HA GLU 4 HA GLU 4 3.843 -0.234 3.792 30 HB2 GLU 4 HB2 GLU 4 5.615 0.563 2.315 31 HB3 GLU 4 HB1 GLU 4 4.280 -0.077 1.355 32 HG2 GLU 4 HG2 GLU 4 3.409 2.230 1.066 33 HG3 GLU 4 HG1 GLU 4 4.793 2.848 1.966 34 H SER 5 HN SER 5 5.570 0.754 4.981 35 HA SER 5 HA SER 5 4.763 2.956 6.559 36 HB2 SER 5 HB2 SER 5 7.495 1.706 6.196 37 HB3 SER 5 HB1 SER 5 7.085 2.872 7.450 38 HG SER 5 HG SER 5 5.779 1.416 8.392 39 H HIS 6 HN HIS 6 5.247 5.102 6.485 40 HA HIS 6 HA HIS 6 5.951 6.253 3.981 41 HB2 HIS 6 HB2 HIS 6 5.748 8.377 5.098 42 HB3 HIS 6 HB1 HIS 6 4.478 7.320 5.716 43 HD1 HIS 6 HD1 HIS 6 7.906 8.645 6.662 44 HD2 HIS 6 HD2 HIS 6 4.620 6.817 8.462 45 HE1 HIS 6 HE1 HIS 6 8.337 8.695 9.157 46 HE2 HIS 6 HE2 HIS 6 6.342 7.585 10.269 47 H GLN 7 HN GLN 7 7.771 5.314 6.789 48 HA GLN 7 HA GLN 7 10.083 6.923 6.215 49 HB2 GLN 7 HB2 GLN 7 9.527 6.068 8.494 50 HB3 GLN 7 HB1 GLN 7 9.885 4.436 7.928 51 HG2 GLN 7 HG2 GLN 7 12.179 5.126 7.358 52 HG3 GLN 7 HG1 GLN 7 11.827 6.765 7.904 53 HE21 GLN 7 HE21 GLN 7 12.694 7.103 9.947 54 HE22 GLN 7 HE22 GLN 7 12.739 5.950 11.191 55 H VAL 8 HN VAL 8 11.650 6.528 4.790 56 HA VAL 8 HA VAL 8 12.127 3.763 3.903 57 HB VAL 8 HB VAL 8 10.627 4.798 2.241 58 HG11 VAL 8 HG11 VAL 8 11.455 7.153 2.752 59 HG12 VAL 8 HG12 VAL 8 11.254 6.777 1.040 60 HG13 VAL 8 HG13 VAL 8 12.865 6.781 1.760 61 HG21 VAL 8 HG21 VAL 8 12.353 3.186 1.507 62 HG22 VAL 8 HG22 VAL 8 13.498 4.510 1.295 63 HG23 VAL 8 HG23 VAL 8 12.066 4.411 0.271 64 H GLU 9 HN GLU 9 14.239 3.308 3.391 65 HA GLU 9 HA GLU 9 16.172 5.524 3.427 66 HB2 GLU 9 HB2 GLU 9 17.586 3.642 4.767 67 HB3 GLU 9 HB1 GLU 9 16.678 4.926 5.559 68 HG2 GLU 9 HG2 GLU 9 16.177 2.705 6.537 69 HG3 GLU 9 HG1 GLU 9 14.745 3.435 5.820 70 H LYS 10 HN LYS 10 17.763 5.326 1.959 71 HA LYS 10 HA LYS 10 18.272 2.690 0.753 72 HB2 LYS 10 HB2 LYS 10 18.191 3.644 -1.500 73 HB3 LYS 10 HB1 LYS 10 16.637 3.849 -0.692 74 HG2 LYS 10 HG2 LYS 10 17.275 6.160 -0.070 75 HG3 LYS 10 HG1 LYS 10 18.806 5.955 -0.921 76 HD2 LYS 10 HD2 LYS 10 17.560 5.514 -3.022 77 HD3 LYS 10 HD1 LYS 10 16.044 5.789 -2.163 78 HE2 LYS 10 HE2 LYS 10 18.281 7.820 -2.428 79 HE3 LYS 10 HE1 LYS 10 16.798 7.819 -3.382 80 HZ1 LYS 10 HZ1 LYS 10 17.037 8.141 -0.443 81 HZ2 LYS 10 HZ2 LYS 10 15.559 7.928 -1.253 82 HZ3 LYS 10 HZ3 LYS 10 16.510 9.302 -1.562 83 H ARG 11 HN ARG 11 20.276 2.673 -0.549 84 HA ARG 11 HA ARG 11 22.154 4.834 0.025 85 HB2 ARG 11 HB2 ARG 11 23.845 2.862 0.609 86 HB3 ARG 11 HB1 ARG 11 22.877 3.649 1.846 87 HG2 ARG 11 HG2 ARG 11 22.638 1.321 2.249 88 HG3 ARG 11 HG1 ARG 11 21.139 1.780 1.459 89 HD2 ARG 11 HD2 ARG 11 23.461 0.822 -0.189 90 HD3 ARG 11 HD1 ARG 11 22.448 -0.346 0.647 91 HE ARG 11 HE ARG 11 21.713 1.229 -1.663 92 HH11 ARG 11 HH11 ARG 11 20.571 -0.531 1.124 93 HH12 ARG 11 HH12 ARG 11 19.012 -0.833 0.441 94 HH21 ARG 11 HH21 ARG 11 19.667 0.821 -2.528 95 HH22 ARG 11 HH22 ARG 11 18.500 -0.073 -1.613 96 H LYS 12 HN LYS 12 21.399 4.782 -2.368 97 HA LYS 12 HA LYS 12 22.619 2.809 -4.067 98 HB2 LYS 12 HB2 LYS 12 21.575 3.896 -5.812 99 HB3 LYS 12 HB1 LYS 12 20.560 4.435 -4.474 100 HG2 LYS 12 HG2 LYS 12 22.182 6.422 -4.266 101 HG3 LYS 12 HG1 LYS 12 22.779 5.945 -5.856 102 HD2 LYS 12 HD2 LYS 12 21.109 7.471 -6.429 103 HD3 LYS 12 HD1 LYS 12 20.231 5.943 -6.502 104 HE2 LYS 12 HE2 LYS 12 18.855 7.435 -5.233 105 HE3 LYS 12 HE1 LYS 12 19.592 6.338 -4.066 106 HZ1 LYS 12 HZ1 LYS 12 20.108 9.176 -4.537 107 HZ2 LYS 12 HZ2 LYS 12 21.426 8.208 -4.076 108 HZ3 LYS 12 HZ3 LYS 12 20.055 8.313 -3.079 109 H CYS 13 HN CYS 13 24.294 3.202 -5.596 110 HA CYS 13 HA CYS 13 26.579 3.614 -5.845 111 HB2 CYS 13 HB2 CYS 13 25.078 5.334 -7.140 112 HB3 CYS 13 HB1 CYS 13 25.760 6.490 -5.998 113 H ASN 14 HN ASN 14 26.888 3.122 -3.437 114 HA ASN 14 HA ASN 14 27.951 5.532 -2.083 115 HB2 ASN 14 HB2 ASN 14 25.956 4.263 -1.029 116 HB3 ASN 14 HB1 ASN 14 27.144 3.020 -0.638 117 HD21 ASN 14 HD21 ASN 14 27.391 3.348 1.614 118 HD22 ASN 14 HD22 ASN 14 27.885 4.821 2.298 119 H THR 15 HN THR 15 29.327 3.779 -4.014 120 HA THR 15 HA THR 15 31.253 2.353 -2.324 121 HB THR 15 HB THR 15 30.343 1.261 -4.380 122 HG1 THR 15 HG1 THR 15 33.093 1.779 -4.727 123 HG21 THR 15 HG21 THR 15 32.042 3.219 -5.926 124 HG22 THR 15 HG22 THR 15 30.319 3.487 -5.667 125 HG23 THR 15 HG23 THR 15 30.868 2.063 -6.550 126 H ALA 16 HN ALA 16 33.625 2.599 -3.241 127 HA ALA 16 HA ALA 16 34.436 5.250 -2.654 128 HB1 ALA 16 HB1 ALA 16 36.216 3.342 -4.130 129 HB2 ALA 16 HB2 ALA 16 35.733 2.977 -2.473 130 HB3 ALA 16 HB3 ALA 16 36.615 4.463 -2.828 131 H THR 17 HN THR 17 34.086 3.458 -5.681 132 HA THR 17 HA THR 17 35.268 5.286 -7.432 133 HB THR 17 HB THR 17 32.908 3.453 -7.917 134 HG1 THR 17 HG1 THR 17 35.698 3.167 -8.335 135 HG21 THR 17 HG21 THR 17 33.743 3.617 -10.307 136 HG22 THR 17 HG22 THR 17 34.734 4.979 -9.785 137 HG23 THR 17 HG23 THR 17 32.976 5.076 -9.682 138 H CYS 18 HN CYS 18 31.935 5.132 -6.218 139 HA CYS 18 HA CYS 18 30.842 7.193 -7.776 140 HB2 CYS 18 HB2 CYS 18 29.823 5.504 -5.944 141 HB3 CYS 18 HB1 CYS 18 29.933 6.961 -4.959 142 H ALA 19 HN ALA 19 32.657 7.262 -4.755 143 HA ALA 19 HA ALA 19 32.268 9.934 -4.032 144 HB1 ALA 19 HB1 ALA 19 33.426 8.171 -2.661 145 HB2 ALA 19 HB2 ALA 19 34.269 9.720 -2.711 146 HB3 ALA 19 HB3 ALA 19 34.837 8.374 -3.699 147 H THR 20 HN THR 20 34.495 8.485 -6.364 148 HA THR 20 HA THR 20 36.064 10.779 -6.852 149 HB THR 20 HB THR 20 35.374 8.488 -8.708 150 HG1 THR 20 HG1 THR 20 37.046 7.496 -7.806 151 HG21 THR 20 HG21 THR 20 37.523 10.618 -8.806 152 HG22 THR 20 HG22 THR 20 36.241 10.346 -9.986 153 HG23 THR 20 HG23 THR 20 37.536 9.163 -9.802 154 H GLN 21 HN GLN 21 33.054 9.606 -8.322 155 HA GLN 21 HA GLN 21 32.850 11.400 -10.431 156 HB2 GLN 21 HB2 GLN 21 30.777 10.540 -10.708 157 HB3 GLN 21 HB1 GLN 21 31.261 9.422 -9.435 158 HG2 GLN 21 HG2 GLN 21 30.347 11.108 -7.765 159 HG3 GLN 21 HG1 GLN 21 29.654 11.970 -9.137 160 HE21 GLN 21 HE21 GLN 21 27.736 11.115 -7.470 161 HE22 GLN 21 HE22 GLN 21 26.982 9.699 -8.025 162 H ARG 22 HN ARG 22 32.357 11.945 -7.005 163 HA ARG 22 HA ARG 22 31.008 14.463 -7.399 164 HB2 ARG 22 HB2 ARG 22 30.707 14.506 -5.134 165 HB3 ARG 22 HB1 ARG 22 31.024 12.786 -5.317 166 HG2 ARG 22 HG2 ARG 22 32.507 13.262 -3.620 167 HG3 ARG 22 HG1 ARG 22 33.557 13.597 -4.988 168 HD2 ARG 22 HD2 ARG 22 33.805 15.692 -4.200 169 HD3 ARG 22 HD1 ARG 22 32.103 15.971 -4.552 170 HE ARG 22 HE ARG 22 31.647 15.771 -2.283 171 HH11 ARG 22 HH11 ARG 22 34.849 14.579 -2.986 172 HH12 ARG 22 HH12 ARG 22 35.281 14.412 -1.320 173 HH21 ARG 22 HH21 ARG 22 32.240 15.544 -0.115 174 HH22 ARG 22 HH22 ARG 22 33.815 14.954 0.297 175 H LEU 23 HN LEU 23 34.286 13.382 -7.216 176 HA LEU 23 HA LEU 23 35.571 15.746 -6.405 177 HB2 LEU 23 HB2 LEU 23 36.727 13.570 -6.634 178 HB3 LEU 23 HB1 LEU 23 36.551 13.671 -8.385 179 HG LEU 23 HG LEU 23 37.836 15.820 -8.344 180 HD11 LEU 23 HD11 LEU 23 37.469 16.595 -6.110 181 HD12 LEU 23 HD12 LEU 23 39.183 16.191 -6.205 182 HD13 LEU 23 HD13 LEU 23 38.059 15.084 -5.417 183 HD21 LEU 23 HD21 LEU 23 39.987 14.768 -8.122 184 HD22 LEU 23 HD22 LEU 23 38.877 13.529 -8.707 185 HD23 LEU 23 HD23 LEU 23 39.348 13.560 -7.007 186 H ALA 24 HN ALA 24 34.514 14.640 -9.600 187 HA ALA 24 HA ALA 24 35.577 16.823 -11.072 188 HB1 ALA 24 HB1 ALA 24 33.174 15.096 -11.723 189 HB2 ALA 24 HB2 ALA 24 34.846 14.690 -12.109 190 HB3 ALA 24 HB3 ALA 24 34.084 16.091 -12.861 191 H ASN 25 HN ASN 25 32.456 16.227 -9.526 192 HA ASN 25 HA ASN 25 31.119 18.530 -10.456 193 HB2 ASN 25 HB2 ASN 25 30.070 16.554 -9.284 194 HB3 ASN 25 HB1 ASN 25 30.702 17.203 -7.772 195 HD21 ASN 25 HD21 ASN 25 28.622 17.760 -6.875 196 HD22 ASN 25 HD22 ASN 25 27.651 18.984 -7.539 197 H PHE 26 HN PHE 26 33.234 17.988 -7.682 198 HA PHE 26 HA PHE 26 32.833 20.508 -6.442 199 HB2 PHE 26 HB2 PHE 26 33.831 18.557 -5.291 200 HB3 PHE 26 HB1 PHE 26 35.260 18.705 -6.315 201 HD1 PHE 26 HD1 PHE 26 33.212 20.446 -3.743 202 HD2 PHE 26 HD2 PHE 26 36.936 20.349 -5.881 203 HE1 PHE 26 HE1 PHE 26 34.139 22.156 -2.205 204 HE2 PHE 26 HE2 PHE 26 37.864 22.059 -4.343 205 HZ PHE 26 HZ PHE 26 36.465 22.962 -2.505 206 H LEU 27 HN LEU 27 34.918 19.415 -9.036 207 HA LEU 27 HA LEU 27 36.768 21.511 -9.069 208 HB2 LEU 27 HB2 LEU 27 36.975 19.415 -10.388 209 HB3 LEU 27 HB1 LEU 27 35.642 19.932 -11.405 210 HG LEU 27 HG LEU 27 38.072 20.274 -12.249 211 HD11 LEU 27 HD11 LEU 27 36.421 22.785 -12.385 212 HD12 LEU 27 HD12 LEU 27 35.836 21.292 -13.115 213 HD13 LEU 27 HD13 LEU 27 37.360 21.996 -13.648 214 HD21 LEU 27 HD21 LEU 27 38.680 21.445 -10.008 215 HD22 LEU 27 HD22 LEU 27 37.901 22.861 -10.711 216 HD23 LEU 27 HD23 LEU 27 39.295 22.136 -11.508 217 H VAL 28 HN VAL 28 33.518 21.276 -10.442 218 HA VAL 28 HA VAL 28 33.760 23.995 -11.526 219 HB VAL 28 HB VAL 28 31.615 23.569 -12.604 220 HG11 VAL 28 HG11 VAL 28 33.795 22.661 -13.558 221 HG12 VAL 28 HG12 VAL 28 32.329 21.863 -14.128 222 HG13 VAL 28 HG13 VAL 28 33.330 21.093 -12.897 223 HG21 VAL 28 HG21 VAL 28 31.701 20.907 -11.147 224 HG22 VAL 28 HG22 VAL 28 30.485 21.396 -12.326 225 HG23 VAL 28 HG23 VAL 28 30.601 22.235 -10.779 226 H HIS 29 HN HIS 29 32.289 22.243 -8.895 227 HA HIS 29 HA HIS 29 30.332 24.164 -8.156 228 HB2 HIS 29 HB2 HIS 29 30.497 21.785 -7.308 229 HB3 HIS 29 HB1 HIS 29 31.826 22.326 -6.283 230 HD1 HIS 29 HD1 HIS 29 28.243 23.435 -7.023 231 HD2 HIS 29 HD2 HIS 29 30.935 23.246 -3.845 232 HE1 HIS 29 HE1 HIS 29 26.997 24.262 -4.979 233 HE2 HIS 29 HE2 HIS 29 28.625 24.153 -3.033 234 H SER 30 HN SER 30 33.724 23.717 -7.277 235 HA SER 30 HA SER 30 33.685 26.053 -5.546 236 HB2 SER 30 HB2 SER 30 35.034 24.025 -4.996 237 HB3 SER 30 HB1 SER 30 36.047 24.364 -6.397 238 HG SER 30 HG SER 30 36.774 25.229 -4.311 239 H SER 31 HN SER 31 33.412 26.020 -8.669 240 HA SER 31 HA SER 31 35.694 27.515 -9.573 241 HB2 SER 31 HB2 SER 31 34.388 26.107 -11.113 242 HB3 SER 31 HB1 SER 31 32.976 27.126 -10.849 243 HG SER 31 HG SER 31 34.331 28.892 -11.605 244 H ASN 32 HN ASN 32 32.696 28.295 -8.027 245 HA ASN 32 HA ASN 32 32.295 30.914 -8.932 246 HB2 ASN 32 HB2 ASN 32 31.097 31.262 -6.796 247 HB3 ASN 32 HB1 ASN 32 30.642 29.744 -7.568 248 HD21 ASN 32 HD21 ASN 32 31.292 30.947 -4.578 249 HD22 ASN 32 HD22 ASN 32 31.961 29.570 -3.845 250 H ASN 33 HN ASN 33 34.247 29.692 -6.237 251 HA ASN 33 HA ASN 33 35.124 32.226 -5.332 252 HB2 ASN 33 HB2 ASN 33 36.317 29.463 -5.039 253 HB3 ASN 33 HB1 ASN 33 36.993 30.892 -4.259 254 HD21 ASN 33 HD21 ASN 33 35.069 32.253 -3.098 255 HD22 ASN 33 HD22 ASN 33 34.040 31.301 -2.140 256 H PHE 34 HN PHE 34 36.392 29.909 -7.649 257 HA PHE 34 HA PHE 34 38.895 31.011 -8.184 258 HB2 PHE 34 HB2 PHE 34 38.121 28.845 -9.082 259 HB3 PHE 34 HB1 PHE 34 37.011 29.698 -10.155 260 HD1 PHE 34 HD1 PHE 34 40.621 29.356 -9.268 261 HD2 PHE 34 HD2 PHE 34 37.753 30.576 -12.223 262 HE1 PHE 34 HE1 PHE 34 42.449 29.665 -10.914 263 HE2 PHE 34 HE2 PHE 34 39.581 30.885 -13.870 264 HZ PHE 34 HZ PHE 34 41.930 30.430 -13.215 265 H GLY 35 HN GLY 35 35.706 31.960 -9.372 266 HA2 GLY 35 HA2 GLY 35 36.518 33.705 -11.418 267 HA3 GLY 35 HA1 GLY 35 35.010 33.830 -10.519 268 H ALA 36 HN ALA 36 35.546 34.542 -8.075 269 HA ALA 36 HA ALA 36 36.340 37.231 -8.192 270 HB1 ALA 36 HB1 ALA 36 36.294 37.156 -5.731 271 HB2 ALA 36 HB2 ALA 36 36.238 35.394 -5.785 272 HB3 ALA 36 HB3 ALA 36 34.890 36.340 -6.418 273 H ILE 37 HN ILE 37 38.136 34.301 -7.424 274 HA ILE 37 HA ILE 37 40.453 35.450 -6.342 275 HB ILE 37 HB ILE 37 39.921 32.901 -7.843 276 HG12 ILE 37 HG12 ILE 37 40.959 33.407 -5.041 277 HG13 ILE 37 HG11 ILE 37 39.240 33.296 -5.419 278 HG21 ILE 37 HG21 ILE 37 42.314 32.297 -7.149 279 HG22 ILE 37 HG22 ILE 37 42.578 34.027 -6.928 280 HG23 ILE 37 HG23 ILE 37 42.159 33.394 -8.520 281 HD11 ILE 37 HD11 ILE 37 40.344 31.131 -4.640 282 HD12 ILE 37 HD12 ILE 37 41.213 31.131 -6.175 283 HD13 ILE 37 HD13 ILE 37 39.452 31.032 -6.157 284 H LEU 38 HN LEU 38 39.360 35.092 -9.652 285 HA LEU 38 HA LEU 38 41.834 35.688 -10.927 286 HB2 LEU 38 HB2 LEU 38 39.945 34.589 -12.089 287 HB3 LEU 38 HB1 LEU 38 39.008 36.076 -11.950 288 HG LEU 38 HG LEU 38 40.809 37.268 -13.226 289 HD11 LEU 38 HD11 LEU 38 42.725 35.896 -12.817 290 HD12 LEU 38 HD12 LEU 38 42.361 35.713 -14.533 291 HD13 LEU 38 HD13 LEU 38 41.898 34.449 -13.393 292 HD21 LEU 38 HD21 LEU 38 40.150 36.386 -15.394 293 HD22 LEU 38 HD22 LEU 38 38.760 36.304 -14.313 294 HD23 LEU 38 HD23 LEU 38 39.686 34.847 -14.669 295 H SER 39 HN SER 39 39.230 37.645 -9.623 296 HA SER 39 HA SER 39 39.934 40.102 -10.850 297 HB2 SER 39 HB2 SER 39 38.509 39.514 -8.248 298 HB3 SER 39 HB1 SER 39 38.649 41.120 -8.959 299 HG SER 39 HG SER 39 36.992 40.576 -10.118 300 H SER 40 HN SER 40 41.026 38.466 -7.929 301 HA SER 40 HA SER 40 42.730 40.726 -7.194 302 HB2 SER 40 HB2 SER 40 42.382 38.029 -5.865 303 HB3 SER 40 HB1 SER 40 43.259 39.406 -5.204 304 HG SER 40 HG SER 40 41.418 40.375 -4.764 305 H THR 41 HN THR 41 43.147 39.053 -9.664 306 HA THR 41 HA THR 41 45.302 37.306 -9.428 307 HB THR 41 HB THR 41 44.033 37.600 -11.509 308 HG1 THR 41 HG1 THR 41 46.799 38.197 -11.653 309 HG21 THR 41 HG21 THR 41 44.316 39.567 -12.889 310 HG22 THR 41 HG22 THR 41 45.507 40.233 -11.771 311 HG23 THR 41 HG23 THR 41 43.819 40.094 -11.281 312 H ASN 42 HN ASN 42 45.209 40.747 -9.087 313 HA ASN 42 HA ASN 42 48.077 41.065 -9.487 314 HB2 ASN 42 HB2 ASN 42 47.682 43.417 -9.086 315 HB3 ASN 42 HB1 ASN 42 46.455 42.819 -10.200 316 HD21 ASN 42 HD21 ASN 42 45.829 45.128 -8.783 317 HD22 ASN 42 HD22 ASN 42 44.682 44.782 -7.581 318 H VAL 43 HN VAL 43 46.687 39.491 -7.181 319 HA VAL 43 HA VAL 43 47.697 40.945 -4.859 320 HB VAL 43 HB VAL 43 45.494 39.623 -4.946 321 HG11 VAL 43 HG11 VAL 43 47.327 37.280 -4.403 322 HG12 VAL 43 HG12 VAL 43 46.681 37.614 -6.009 323 HG13 VAL 43 HG13 VAL 43 45.585 37.261 -4.675 324 HG21 VAL 43 HG21 VAL 43 47.369 38.806 -2.715 325 HG22 VAL 43 HG22 VAL 43 45.640 39.134 -2.620 326 HG23 VAL 43 HG23 VAL 43 46.775 40.458 -2.877 327 H GLY 44 HN GLY 44 49.412 39.651 -7.062 328 HA2 GLY 44 HA2 GLY 44 51.601 38.872 -6.988 329 HA3 GLY 44 HA1 GLY 44 51.417 38.601 -5.258 330 H SER 45 HN SER 45 48.979 37.311 -7.338 331 HA SER 45 HA SER 45 50.168 34.615 -7.062 332 HB2 SER 45 HB2 SER 45 47.890 33.738 -6.801 333 HB3 SER 45 HB1 SER 45 48.255 34.914 -5.541 334 HG SER 45 HG SER 45 46.355 35.607 -6.287 335 H ASN 46 HN ASN 46 50.283 36.584 -9.290 336 HA ASN 46 HA ASN 46 48.632 35.319 -11.352 337 HB2 ASN 46 HB2 ASN 46 49.427 37.116 -12.803 338 HB3 ASN 46 HB1 ASN 46 48.802 37.783 -11.296 339 HD21 ASN 46 HD21 ASN 46 50.482 39.496 -12.512 340 HD22 ASN 46 HD22 ASN 46 52.028 39.486 -11.811 341 H THR 47 HN THR 47 50.947 33.970 -10.001 342 HA THR 47 HA THR 47 52.900 33.728 -12.161 343 HB THR 47 HB THR 47 52.963 32.016 -9.712 344 HG1 THR 47 HG1 THR 47 53.873 33.750 -8.583 345 HG21 THR 47 HG21 THR 47 54.652 31.951 -11.614 346 HG22 THR 47 HG22 THR 47 55.328 32.214 -10.006 347 HG23 THR 47 HG23 THR 47 55.142 33.571 -11.117 348 H TYR 48 HN TYR 48 50.029 32.754 -12.325 349 HA TYR 48 HA TYR 48 50.691 30.104 -13.383 350 HB2 TYR 48 HB2 TYR 48 49.023 28.944 -12.202 351 HB3 TYR 48 HB1 TYR 48 49.777 29.958 -10.971 352 HD1 TYR 48 HD1 TYR 48 46.700 29.012 -12.456 353 HD2 TYR 48 HD2 TYR 48 48.720 32.361 -10.679 354 HE1 TYR 48 HE1 TYR 48 44.514 30.090 -12.002 355 HE2 TYR 48 HE2 TYR 48 46.533 33.438 -10.225 356 HH TYR 48 HH TYR 48 43.922 32.947 -11.605 357 H GLY 49 HN GLY 49 49.860 32.884 -14.334 358 HA2 GLY 49 HA2 GLY 49 47.226 32.756 -15.360 359 HA3 GLY 49 HA1 GLY 49 48.514 33.796 -15.961 360 H LYS 50 HN LYS 50 46.474 32.260 -17.436 361 HA LYS 50 HA LYS 50 47.589 29.975 -18.663 362 HB2 LYS 50 HB2 LYS 50 45.499 31.955 -19.578 363 HB3 LYS 50 HB1 LYS 50 45.936 30.523 -20.511 364 HG2 LYS 50 HG2 LYS 50 45.370 29.090 -18.582 365 HG3 LYS 50 HG1 LYS 50 44.922 30.522 -17.653 366 HD2 LYS 50 HD2 LYS 50 43.647 30.121 -20.329 367 HD3 LYS 50 HD1 LYS 50 43.087 29.129 -18.983 368 HE2 LYS 50 HE2 LYS 50 43.343 32.134 -18.771 369 HE3 LYS 50 HE1 LYS 50 41.863 31.352 -19.328 370 HZ1 LYS 50 HZ1 LYS 50 43.170 30.576 -16.793 371 HZ2 LYS 50 HZ2 LYS 50 41.572 30.287 -17.291 372 HZ3 LYS 50 HZ3 LYS 50 42.061 31.857 -16.862 373 H ARG 51 HN ARG 51 47.831 33.416 -19.375 374 HA ARG 51 HA ARG 51 48.886 33.418 -21.917 375 HB2 ARG 51 HB2 ARG 51 49.918 35.527 -21.384 376 HB3 ARG 51 HB1 ARG 51 48.389 35.440 -20.511 377 HG2 ARG 51 HG2 ARG 51 49.640 34.637 -18.496 378 HG3 ARG 51 HG1 ARG 51 51.147 34.891 -19.377 379 HD2 ARG 51 HD2 ARG 51 50.544 37.278 -19.680 380 HD3 ARG 51 HD1 ARG 51 49.080 37.013 -18.738 381 HE ARG 51 HE ARG 51 51.777 37.253 -17.715 382 HH11 ARG 51 HH11 ARG 51 48.561 36.028 -17.146 383 HH12 ARG 51 HH12 ARG 51 48.745 36.009 -15.427 384 HH21 ARG 51 HH21 ARG 51 51.988 37.218 -15.466 385 HH22 ARG 51 HH22 ARG 51 50.671 36.677 -14.480 386 H ASN 52 HN ASN 52 50.419 32.410 -18.938 387 HA ASN 52 HA ASN 52 53.107 32.469 -19.756 388 HB2 ASN 52 HB2 ASN 52 52.133 32.024 -17.420 389 HB3 ASN 52 HB1 ASN 52 51.955 30.352 -17.949 390 HD21 ASN 52 HD21 ASN 52 54.134 29.504 -19.077 391 HD22 ASN 52 HD22 ASN 52 55.559 29.888 -18.239 392 H ALA 53 HN ALA 53 50.604 29.991 -20.092 393 HA ALA 53 HA ALA 53 52.254 27.973 -21.197 394 HB1 ALA 53 HB1 ALA 53 49.972 27.182 -22.164 395 HB2 ALA 53 HB2 ALA 53 49.296 28.500 -21.206 396 HB3 ALA 53 HB3 ALA 53 50.190 27.202 -20.414 397 H VAL 54 HN VAL 54 50.252 30.496 -22.709 398 HA VAL 54 HA VAL 54 50.849 29.676 -25.383 399 HB VAL 54 HB VAL 54 48.982 31.318 -24.257 400 HG11 VAL 54 HG11 VAL 54 50.819 33.138 -25.832 401 HG12 VAL 54 HG12 VAL 54 50.801 33.093 -24.069 402 HG13 VAL 54 HG13 VAL 54 49.356 33.578 -24.952 403 HG21 VAL 54 HG21 VAL 54 48.479 31.934 -26.670 404 HG22 VAL 54 HG22 VAL 54 48.668 30.208 -26.364 405 HG23 VAL 54 HG23 VAL 54 49.980 31.121 -27.109 406 H GLU 55 HN GLU 55 52.517 31.553 -23.019 407 HA GLU 55 HA GLU 55 54.080 33.117 -24.852 408 HB2 GLU 55 HB2 GLU 55 53.619 33.666 -22.407 409 HB3 GLU 55 HB1 GLU 55 54.814 32.434 -22.004 410 HG2 GLU 55 HG2 GLU 55 55.466 34.617 -23.973 411 HG3 GLU 55 HG1 GLU 55 55.613 34.900 -22.240 412 H VAL 56 HN VAL 56 54.925 30.384 -22.701 413 HA VAL 56 HA VAL 56 57.487 29.931 -23.684 414 HB VAL 56 HB VAL 56 56.633 28.853 -21.655 415 HG11 VAL 56 HG11 VAL 56 54.990 27.157 -23.559 416 HG12 VAL 56 HG12 VAL 56 54.337 28.418 -22.513 417 HG13 VAL 56 HG13 VAL 56 55.069 26.978 -21.807 418 HG21 VAL 56 HG21 VAL 56 57.661 26.696 -21.995 419 HG22 VAL 56 HG22 VAL 56 58.523 27.852 -23.012 420 HG23 VAL 56 HG23 VAL 56 57.340 26.758 -23.728 421 H LEU 57 HN LEU 57 54.373 28.913 -24.962 422 HA LEU 57 HA LEU 57 55.190 26.958 -26.762 423 HB2 LEU 57 HB2 LEU 57 52.864 28.675 -26.433 424 HB3 LEU 57 HB1 LEU 57 53.223 28.390 -28.136 425 HG LEU 57 HG LEU 57 53.495 25.900 -27.423 426 HD11 LEU 57 HD11 LEU 57 53.375 26.555 -24.955 427 HD12 LEU 57 HD12 LEU 57 52.333 25.221 -25.448 428 HD13 LEU 57 HD13 LEU 57 51.651 26.830 -25.211 429 HD21 LEU 57 HD21 LEU 57 51.638 26.915 -28.808 430 HD22 LEU 57 HD22 LEU 57 50.724 27.127 -27.315 431 HD23 LEU 57 HD23 LEU 57 51.151 25.507 -27.865 432 H LYS 58 HN LYS 58 55.026 30.475 -27.168 433 HA LYS 58 HA LYS 58 55.974 30.601 -29.836 434 HB2 LYS 58 HB2 LYS 58 56.026 32.586 -27.559 435 HB3 LYS 58 HB1 LYS 58 56.571 32.971 -29.192 436 HG2 LYS 58 HG2 LYS 58 53.838 31.792 -28.676 437 HG3 LYS 58 HG1 LYS 58 54.122 33.532 -28.616 438 HD2 LYS 58 HD2 LYS 58 55.105 33.382 -30.927 439 HD3 LYS 58 HD1 LYS 58 54.596 31.694 -30.978 440 HE2 LYS 58 HE2 LYS 58 52.720 34.020 -30.478 441 HE3 LYS 58 HE1 LYS 58 52.949 33.250 -32.048 442 HZ1 LYS 58 HZ1 LYS 58 52.234 31.157 -31.098 443 HZ2 LYS 58 HZ2 LYS 58 51.039 32.343 -30.869 444 HZ3 LYS 58 HZ3 LYS 58 52.039 31.878 -29.576 445 H ARG 59 HN ARG 59 57.620 30.601 -26.705 446 HA ARG 59 HA ARG 59 60.201 31.255 -27.592 447 HB2 ARG 59 HB2 ARG 59 59.301 31.027 -25.183 448 HB3 ARG 59 HB1 ARG 59 59.685 29.313 -25.351 449 HG2 ARG 59 HG2 ARG 59 61.943 30.652 -26.339 450 HG3 ARG 59 HG1 ARG 59 61.477 31.553 -24.896 451 HD2 ARG 59 HD2 ARG 59 61.488 29.514 -23.566 452 HD3 ARG 59 HD1 ARG 59 61.814 28.543 -24.999 453 HE ARG 59 HE ARG 59 63.804 30.573 -24.584 454 HH11 ARG 59 HH11 ARG 59 62.735 27.400 -23.607 455 HH12 ARG 59 HH12 ARG 59 64.315 26.887 -23.125 456 HH21 ARG 59 HH21 ARG 59 65.856 29.875 -23.947 457 HH22 ARG 59 HH22 ARG 59 66.072 28.277 -23.315 458 H GLU 60 HN GLU 60 58.402 28.264 -27.748 459 HA GLU 60 HA GLU 60 60.778 26.935 -28.910 460 HB2 GLU 60 HB2 GLU 60 59.936 25.910 -26.802 461 HB3 GLU 60 HB1 GLU 60 58.386 25.630 -27.595 462 HG2 GLU 60 HG2 GLU 60 59.439 24.208 -29.263 463 HG3 GLU 60 HG1 GLU 60 61.037 24.573 -28.615 464 HA PRO 61 HA PRO 61 57.584 27.402 -32.244 465 HB2 PRO 61 HB2 PRO 61 59.317 28.261 -34.174 466 HB3 PRO 61 HB1 PRO 61 58.523 29.354 -33.023 467 HG2 PRO 61 HG2 PRO 61 61.293 28.269 -33.002 468 HG3 PRO 61 HG1 PRO 61 60.706 29.882 -32.563 469 HD2 PRO 61 HD2 PRO 61 61.336 27.951 -30.711 470 HD3 PRO 61 HD1 PRO 61 60.153 29.243 -30.417 471 H LEU 62 HN LEU 62 60.314 25.501 -31.662 472 HA LEU 62 HA LEU 62 60.732 24.154 -34.078 473 HB2 LEU 62 HB2 LEU 62 62.224 23.938 -32.135 474 HB3 LEU 62 HB1 LEU 62 60.955 23.095 -31.249 475 HG LEU 62 HG LEU 62 60.944 21.328 -33.010 476 HD11 LEU 62 HD11 LEU 62 61.744 22.520 -34.930 477 HD12 LEU 62 HD12 LEU 62 62.984 21.328 -34.540 478 HD13 LEU 62 HD13 LEU 62 63.213 23.018 -34.089 479 HD21 LEU 62 HD21 LEU 62 62.962 20.248 -32.267 480 HD22 LEU 62 HD22 LEU 62 62.388 21.234 -30.922 481 HD23 LEU 62 HD23 LEU 62 63.731 21.796 -31.918 482 H ASN 63 HN ASN 63 58.408 23.571 -31.463 483 HA ASN 63 HA ASN 63 57.373 21.136 -32.422 484 HB2 ASN 63 HB2 ASN 63 55.528 21.516 -30.931 485 HB3 ASN 63 HB1 ASN 63 56.980 22.130 -30.143 486 HD21 ASN 63 HD21 ASN 63 54.038 22.981 -29.911 487 HD22 ASN 63 HD22 ASN 63 54.071 24.655 -30.192 488 H TYR 64 HN TYR 64 56.799 24.449 -33.357 489 HA TYR 64 HA TYR 64 54.367 23.937 -34.794 490 HB2 TYR 64 HB2 TYR 64 54.998 26.181 -33.909 491 HB3 TYR 64 HB1 TYR 64 56.297 26.248 -35.099 492 HD1 TYR 64 HD1 TYR 64 52.607 26.005 -34.694 493 HD2 TYR 64 HD2 TYR 64 55.865 26.787 -37.382 494 HE1 TYR 64 HE1 TYR 64 51.002 26.816 -36.403 495 HE2 TYR 64 HE2 TYR 64 54.260 27.598 -39.091 496 HH TYR 64 HH TYR 64 51.652 27.097 -39.546 497 H LEU 65 HN LEU 65 57.790 24.097 -35.586 498 HA LEU 65 HA LEU 65 57.471 23.933 -38.415 499 HB2 LEU 65 HB2 LEU 65 59.822 23.291 -36.619 500 HB3 LEU 65 HB1 LEU 65 59.902 23.326 -38.380 501 HG LEU 65 HG LEU 65 58.947 25.671 -36.721 502 HD11 LEU 65 HD11 LEU 65 61.230 26.622 -37.293 503 HD12 LEU 65 HD12 LEU 65 61.702 24.995 -37.783 504 HD13 LEU 65 HD13 LEU 65 61.246 25.314 -36.110 505 HD21 LEU 65 HD21 LEU 65 59.595 26.860 -38.896 506 HD22 LEU 65 HD22 LEU 65 58.171 25.824 -38.981 507 HD23 LEU 65 HD23 LEU 65 59.713 25.257 -39.622 508 HA PRO 66 HA PRO 66 56.669 19.684 -39.238 509 HB2 PRO 66 HB2 PRO 66 59.180 19.556 -40.844 510 HB3 PRO 66 HB1 PRO 66 57.517 19.158 -41.315 511 HG2 PRO 66 HG2 PRO 66 58.696 21.394 -42.143 512 HG3 PRO 66 HG1 PRO 66 56.970 21.344 -41.745 513 HD2 PRO 66 HD2 PRO 66 59.227 22.530 -40.188 514 HD3 PRO 66 HD1 PRO 66 57.532 23.053 -40.299 515 H LEU 67 HN LEU 67 57.099 17.742 -38.274 516 HA LEU 67 HA LEU 67 59.754 17.404 -37.012 517 HB2 LEU 67 HB2 LEU 67 57.327 17.725 -35.693 518 HB3 LEU 67 HB1 LEU 67 57.593 15.981 -35.676 519 HG LEU 67 HG LEU 67 59.743 17.963 -34.902 520 HD11 LEU 67 HD11 LEU 67 57.641 16.597 -33.204 521 HD12 LEU 67 HD12 LEU 67 57.975 18.324 -33.321 522 HD13 LEU 67 HD13 LEU 67 59.135 17.254 -32.535 523 HD21 LEU 67 HD21 LEU 67 60.460 15.681 -35.545 524 HD22 LEU 67 HD22 LEU 67 59.349 15.002 -34.355 525 HD23 LEU 67 HD23 LEU 67 60.724 15.972 -33.826 Start of MODEL 14 1 H1 THR 1 HT1 THR 1 -3.488 -5.578 0.417 2 H2 THR 1 HT2 THR 1 -3.348 -4.020 -0.247 3 H3 THR 1 HT3 THR 1 -3.228 -4.245 1.433 4 HA THR 1 HA THR 1 -1.238 -5.693 0.969 5 HB THR 1 HB THR 1 -2.114 -5.273 -1.654 6 HG1 THR 1 HG1 THR 1 -0.911 -6.972 -1.596 7 HG21 THR 1 HG21 THR 1 -0.319 -4.084 -2.767 8 HG22 THR 1 HG22 THR 1 0.514 -3.822 -1.237 9 HG23 THR 1 HG23 THR 1 -1.025 -3.017 -1.555 10 HA PRO 2 HA PRO 2 0.701 -2.042 2.504 11 HB2 PRO 2 HB2 PRO 2 3.349 -2.556 2.123 12 HB3 PRO 2 HB1 PRO 2 2.364 -3.411 3.326 13 HG2 PRO 2 HG2 PRO 2 3.253 -4.299 0.632 14 HG3 PRO 2 HG1 PRO 2 3.107 -5.222 2.136 15 HD2 PRO 2 HD2 PRO 2 1.246 -5.304 0.101 16 HD3 PRO 2 HD1 PRO 2 0.871 -5.663 1.800 17 H ILE 3 HN ILE 3 1.869 -0.096 1.957 18 HA ILE 3 HA ILE 3 2.074 0.341 -0.960 19 HB ILE 3 HB ILE 3 0.313 1.657 0.220 20 HG12 ILE 3 HG12 ILE 3 1.126 3.903 -0.627 21 HG13 ILE 3 HG11 ILE 3 2.686 3.144 -0.946 22 HG21 ILE 3 HG21 ILE 3 1.676 1.817 2.363 23 HG22 ILE 3 HG22 ILE 3 0.916 3.320 1.841 24 HG23 ILE 3 HG23 ILE 3 2.637 3.059 1.561 25 HD11 ILE 3 HD11 ILE 3 0.101 2.034 -2.056 26 HD12 ILE 3 HD12 ILE 3 1.749 1.662 -2.561 27 HD13 ILE 3 HD13 ILE 3 1.054 3.242 -2.917 28 H GLU 4 HN GLU 4 3.891 1.277 -1.803 29 HA GLU 4 HA GLU 4 6.359 0.893 -0.628 30 HB2 GLU 4 HB2 GLU 4 7.261 2.392 -2.330 31 HB3 GLU 4 HB1 GLU 4 6.003 1.375 -3.034 32 HG2 GLU 4 HG2 GLU 4 4.369 3.259 -2.577 33 HG3 GLU 4 HG1 GLU 4 5.758 4.264 -2.167 34 H SER 5 HN SER 5 7.974 2.562 0.011 35 HA SER 5 HA SER 5 6.996 4.090 2.207 36 HB2 SER 5 HB2 SER 5 9.289 4.771 2.517 37 HB3 SER 5 HB1 SER 5 9.282 3.070 2.062 38 HG SER 5 HG SER 5 10.585 3.723 0.543 39 H HIS 6 HN HIS 6 7.290 6.416 2.494 40 HA HIS 6 HA HIS 6 6.443 7.861 0.097 41 HB2 HIS 6 HB2 HIS 6 5.665 9.551 1.551 42 HB3 HIS 6 HB1 HIS 6 5.310 8.044 2.396 43 HD1 HIS 6 HD1 HIS 6 7.444 11.099 2.565 44 HD2 HIS 6 HD2 HIS 6 7.028 7.511 4.649 45 HE1 HIS 6 HE1 HIS 6 8.752 11.365 4.717 46 HE2 HIS 6 HE2 HIS 6 8.509 9.185 5.998 47 H GLN 7 HN GLN 7 9.301 6.949 0.720 48 HA GLN 7 HA GLN 7 10.770 9.402 1.109 49 HB2 GLN 7 HB2 GLN 7 11.667 7.234 1.866 50 HB3 GLN 7 HB1 GLN 7 11.721 6.677 0.193 51 HG2 GLN 7 HG2 GLN 7 13.270 8.509 -0.373 52 HG3 GLN 7 HG1 GLN 7 13.214 9.075 1.295 53 HE21 GLN 7 HE21 GLN 7 15.122 8.466 2.320 54 HE22 GLN 7 HE22 GLN 7 15.877 6.956 2.148 55 H VAL 8 HN VAL 8 11.563 10.747 -0.397 56 HA VAL 8 HA VAL 8 11.519 9.906 -3.222 57 HB VAL 8 HB VAL 8 9.473 11.213 -2.797 58 HG11 VAL 8 HG11 VAL 8 10.515 12.511 -0.876 59 HG12 VAL 8 HG12 VAL 8 9.569 13.480 -2.006 60 HG13 VAL 8 HG13 VAL 8 11.331 13.498 -2.089 61 HG21 VAL 8 HG21 VAL 8 10.827 11.396 -4.952 62 HG22 VAL 8 HG22 VAL 8 11.483 12.901 -4.309 63 HG23 VAL 8 HG23 VAL 8 9.753 12.754 -4.616 64 H GLU 9 HN GLU 9 13.063 10.908 -4.539 65 HA GLU 9 HA GLU 9 15.091 12.508 -3.097 66 HB2 GLU 9 HB2 GLU 9 16.630 11.404 -4.947 67 HB3 GLU 9 HB1 GLU 9 16.279 10.561 -3.439 68 HG2 GLU 9 HG2 GLU 9 15.979 9.117 -5.458 69 HG3 GLU 9 HG1 GLU 9 14.505 9.284 -4.508 70 H LYS 10 HN LYS 10 16.397 13.914 -4.487 71 HA LYS 10 HA LYS 10 15.101 14.669 -7.019 72 HB2 LYS 10 HB2 LYS 10 15.217 17.054 -6.389 73 HB3 LYS 10 HB1 LYS 10 14.150 16.149 -5.316 74 HG2 LYS 10 HG2 LYS 10 16.065 15.911 -3.710 75 HG3 LYS 10 HG1 LYS 10 17.011 16.976 -4.751 76 HD2 LYS 10 HD2 LYS 10 15.334 18.758 -4.473 77 HD3 LYS 10 HD1 LYS 10 14.368 17.696 -3.448 78 HE2 LYS 10 HE2 LYS 10 16.305 17.523 -1.877 79 HE3 LYS 10 HE1 LYS 10 17.172 18.694 -2.870 80 HZ1 LYS 10 HZ1 LYS 10 15.944 19.624 -0.907 81 HZ2 LYS 10 HZ2 LYS 10 14.499 19.236 -1.712 82 HZ3 LYS 10 HZ3 LYS 10 15.584 20.349 -2.398 83 H ARG 11 HN ARG 11 16.468 16.130 -8.323 84 HA ARG 11 HA ARG 11 19.334 15.659 -7.787 85 HB2 ARG 11 HB2 ARG 11 19.419 16.005 -10.419 86 HB3 ARG 11 HB1 ARG 11 19.104 14.430 -9.709 87 HG2 ARG 11 HG2 ARG 11 17.463 14.672 -11.399 88 HG3 ARG 11 HG1 ARG 11 16.591 15.026 -9.918 89 HD2 ARG 11 HD2 ARG 11 17.908 17.258 -11.436 90 HD3 ARG 11 HD1 ARG 11 16.367 16.625 -11.993 91 HE ARG 11 HE ARG 11 16.820 18.215 -9.618 92 HH11 ARG 11 HH11 ARG 11 14.736 15.921 -11.220 93 HH12 ARG 11 HH12 ARG 11 13.336 16.388 -10.321 94 HH21 ARG 11 HH21 ARG 11 14.973 18.803 -8.459 95 HH22 ARG 11 HH22 ARG 11 13.466 18.008 -8.768 96 H LYS 12 HN LYS 12 18.775 17.764 -6.546 97 HA LYS 12 HA LYS 12 18.267 20.199 -7.738 98 HB2 LYS 12 HB2 LYS 12 19.263 21.217 -5.852 99 HB3 LYS 12 HB1 LYS 12 18.675 19.664 -5.259 100 HG2 LYS 12 HG2 LYS 12 20.991 18.731 -5.735 101 HG3 LYS 12 HG1 LYS 12 21.516 20.392 -6.011 102 HD2 LYS 12 HD2 LYS 12 22.010 20.061 -3.737 103 HD3 LYS 12 HD1 LYS 12 20.445 20.874 -3.687 104 HE2 LYS 12 HE2 LYS 12 20.389 18.966 -2.175 105 HE3 LYS 12 HE1 LYS 12 19.338 18.635 -3.551 106 HZ1 LYS 12 HZ1 LYS 12 20.968 16.830 -2.823 107 HZ2 LYS 12 HZ2 LYS 12 22.165 17.788 -3.555 108 HZ3 LYS 12 HZ3 LYS 12 20.872 17.186 -4.479 109 H CYS 13 HN CYS 13 19.625 21.897 -8.500 110 HA CYS 13 HA CYS 13 21.949 20.878 -9.981 111 HB2 CYS 13 HB2 CYS 13 20.096 22.123 -11.167 112 HB3 CYS 13 HB1 CYS 13 20.607 23.567 -10.292 113 H ASN 14 HN ASN 14 23.592 20.886 -8.483 114 HA ASN 14 HA ASN 14 24.230 23.472 -7.205 115 HB2 ASN 14 HB2 ASN 14 25.639 22.151 -5.669 116 HB3 ASN 14 HB1 ASN 14 23.957 21.626 -5.629 117 HD21 ASN 14 HD21 ASN 14 25.213 19.588 -4.741 118 HD22 ASN 14 HD22 ASN 14 25.678 18.444 -5.906 119 H THR 15 HN THR 15 24.988 21.871 -9.949 120 HA THR 15 HA THR 15 27.840 21.918 -9.918 121 HB THR 15 HB THR 15 26.654 20.507 -11.506 122 HG1 THR 15 HG1 THR 15 27.821 21.098 -13.307 123 HG21 THR 15 HG21 THR 15 25.498 23.141 -12.431 124 HG22 THR 15 HG22 THR 15 24.636 21.689 -11.923 125 HG23 THR 15 HG23 THR 15 25.501 21.709 -13.459 126 H ALA 16 HN ALA 16 29.174 23.328 -11.245 127 HA ALA 16 HA ALA 16 28.770 26.055 -10.661 128 HB1 ALA 16 HB1 ALA 16 30.677 24.549 -12.420 129 HB2 ALA 16 HB2 ALA 16 31.010 25.516 -10.983 130 HB3 ALA 16 HB3 ALA 16 30.618 26.310 -12.508 131 H THR 17 HN THR 17 27.811 24.082 -13.354 132 HA THR 17 HA THR 17 27.432 25.954 -15.368 133 HB THR 17 HB THR 17 25.688 23.579 -14.670 134 HG1 THR 17 HG1 THR 17 27.828 23.897 -16.502 135 HG21 THR 17 HG21 THR 17 25.167 23.708 -17.155 136 HG22 THR 17 HG22 THR 17 25.887 25.318 -17.135 137 HG23 THR 17 HG23 THR 17 24.452 24.981 -16.165 138 H CYS 18 HN CYS 18 25.153 25.029 -12.780 139 HA CYS 18 HA CYS 18 23.169 26.934 -13.549 140 HB2 CYS 18 HB2 CYS 18 23.631 25.233 -11.116 141 HB3 CYS 18 HB1 CYS 18 22.382 26.477 -11.109 142 H ALA 19 HN ALA 19 25.921 26.968 -11.364 143 HA ALA 19 HA ALA 19 25.347 29.266 -9.882 144 HB1 ALA 19 HB1 ALA 19 27.360 27.569 -9.773 145 HB2 ALA 19 HB2 ALA 19 27.572 29.233 -9.229 146 HB3 ALA 19 HB3 ALA 19 28.142 28.748 -10.826 147 H THR 20 HN THR 20 27.055 28.954 -12.996 148 HA THR 20 HA THR 20 27.634 31.654 -13.400 149 HB THR 20 HB THR 20 26.947 29.552 -15.468 150 HG1 THR 20 HG1 THR 20 29.207 29.312 -15.516 151 HG21 THR 20 HG21 THR 20 28.385 32.211 -15.669 152 HG22 THR 20 HG22 THR 20 26.850 31.786 -16.426 153 HG23 THR 20 HG23 THR 20 28.340 31.002 -16.952 154 H GLN 21 HN GLN 21 24.671 29.829 -13.996 155 HA GLN 21 HA GLN 21 23.286 31.674 -15.557 156 HB2 GLN 21 HB2 GLN 21 21.579 30.228 -15.324 157 HB3 GLN 21 HB1 GLN 21 22.694 29.247 -14.377 158 HG2 GLN 21 HG2 GLN 21 21.951 30.519 -12.329 159 HG3 GLN 21 HG1 GLN 21 20.716 31.290 -13.325 160 HE21 GLN 21 HE21 GLN 21 20.735 29.075 -11.055 161 HE22 GLN 21 HE22 GLN 21 19.680 27.908 -11.691 162 H ARG 22 HN ARG 22 23.976 31.697 -12.121 163 HA ARG 22 HA ARG 22 22.076 33.774 -11.518 164 HB2 ARG 22 HB2 ARG 22 22.722 33.549 -9.329 165 HB3 ARG 22 HB1 ARG 22 23.235 31.982 -9.942 166 HG2 ARG 22 HG2 ARG 22 25.171 32.603 -8.866 167 HG3 ARG 22 HG1 ARG 22 25.497 33.340 -10.427 168 HD2 ARG 22 HD2 ARG 22 25.683 35.318 -9.366 169 HD3 ARG 22 HD1 ARG 22 23.956 35.231 -9.036 170 HE ARG 22 HE ARG 22 24.450 34.665 -6.838 171 HH11 ARG 22 HH11 ARG 22 27.288 34.342 -8.840 172 HH12 ARG 22 HH12 ARG 22 28.349 34.083 -7.499 173 HH21 ARG 22 HH21 ARG 22 25.860 34.324 -5.106 174 HH22 ARG 22 HH22 ARG 22 27.548 34.072 -5.398 175 H LEU 23 HN LEU 23 25.346 33.635 -12.663 176 HA LEU 23 HA LEU 23 26.147 36.265 -11.950 177 HB2 LEU 23 HB2 LEU 23 27.751 34.513 -12.626 178 HB3 LEU 23 HB1 LEU 23 27.082 34.536 -14.257 179 HG LEU 23 HG LEU 23 27.686 36.959 -14.424 180 HD11 LEU 23 HD11 LEU 23 27.727 37.640 -12.131 181 HD12 LEU 23 HD12 LEU 23 29.396 37.738 -12.692 182 HD13 LEU 23 HD13 LEU 23 28.876 36.373 -11.704 183 HD21 LEU 23 HD21 LEU 23 30.177 36.552 -14.525 184 HD22 LEU 23 HD22 LEU 23 29.214 35.340 -15.369 185 HD23 LEU 23 HD23 LEU 23 29.891 34.979 -13.781 186 H ALA 24 HN ALA 24 24.540 34.899 -14.793 187 HA ALA 24 HA ALA 24 24.590 37.196 -16.417 188 HB1 ALA 24 HB1 ALA 24 23.825 34.725 -16.910 189 HB2 ALA 24 HB2 ALA 24 23.110 36.069 -17.800 190 HB3 ALA 24 HB3 ALA 24 22.238 35.343 -16.450 191 H ASN 25 HN ASN 25 22.313 36.121 -13.922 192 HA ASN 25 HA ASN 25 20.465 38.273 -14.337 193 HB2 ASN 25 HB2 ASN 25 20.875 36.346 -12.041 194 HB3 ASN 25 HB1 ASN 25 19.569 37.527 -12.107 195 HD21 ASN 25 HD21 ASN 25 19.750 34.387 -12.397 196 HD22 ASN 25 HD22 ASN 25 18.778 34.091 -13.757 197 H PHE 26 HN PHE 26 23.392 37.827 -12.522 198 HA PHE 26 HA PHE 26 23.055 39.936 -10.641 199 HB2 PHE 26 HB2 PHE 26 24.712 38.115 -10.376 200 HB3 PHE 26 HB1 PHE 26 25.615 38.759 -11.747 201 HD1 PHE 26 HD1 PHE 26 24.346 39.606 -8.344 202 HD2 PHE 26 HD2 PHE 26 27.111 40.580 -11.484 203 HE1 PHE 26 HE1 PHE 26 25.490 41.211 -6.839 204 HE2 PHE 26 HE2 PHE 26 28.254 42.186 -9.979 205 HZ PHE 26 HZ PHE 26 27.443 42.501 -7.657 206 H LEU 27 HN LEU 27 24.433 39.783 -13.901 207 HA LEU 27 HA LEU 27 25.572 42.349 -13.938 208 HB2 LEU 27 HB2 LEU 27 26.032 40.593 -15.632 209 HB3 LEU 27 HB1 LEU 27 24.388 40.742 -16.230 210 HG LEU 27 HG LEU 27 26.298 41.955 -17.503 211 HD11 LEU 27 HD11 LEU 27 24.023 43.796 -16.799 212 HD12 LEU 27 HD12 LEU 27 23.717 42.285 -17.655 213 HD13 LEU 27 HD13 LEU 27 24.778 43.500 -18.364 214 HD21 LEU 27 HD21 LEU 27 27.130 43.000 -15.284 215 HD22 LEU 27 HD22 LEU 27 25.802 44.142 -15.485 216 HD23 LEU 27 HD23 LEU 27 27.065 44.035 -16.709 217 H VAL 28 HN VAL 28 22.306 41.226 -14.724 218 HA VAL 28 HA VAL 28 21.422 43.912 -15.410 219 HB VAL 28 HB VAL 28 19.226 42.884 -15.727 220 HG11 VAL 28 HG11 VAL 28 21.085 42.661 -17.454 221 HG12 VAL 28 HG12 VAL 28 19.790 41.469 -17.576 222 HG13 VAL 28 HG13 VAL 28 21.333 41.023 -16.847 223 HG21 VAL 28 HG21 VAL 28 20.547 40.352 -14.697 224 HG22 VAL 28 HG22 VAL 28 18.898 40.485 -15.305 225 HG23 VAL 28 HG23 VAL 28 19.356 41.305 -13.813 226 H HIS 29 HN HIS 29 21.427 41.803 -12.632 227 HA HIS 29 HA HIS 29 19.427 43.073 -11.111 228 HB2 HIS 29 HB2 HIS 29 20.363 40.895 -10.495 229 HB3 HIS 29 HB1 HIS 29 21.927 41.646 -10.177 230 HD1 HIS 29 HD1 HIS 29 18.326 41.827 -8.952 231 HD2 HIS 29 HD2 HIS 29 22.180 42.682 -7.614 232 HE1 HIS 29 HE1 HIS 29 18.108 42.488 -6.517 233 HE2 HIS 29 HE2 HIS 29 20.450 43.012 -5.687 234 H SER 30 HN SER 30 22.591 44.072 -11.990 235 HA SER 30 HA SER 30 22.439 46.270 -10.023 236 HB2 SER 30 HB2 SER 30 24.368 44.798 -9.613 237 HB3 SER 30 HB1 SER 30 24.931 45.073 -11.259 238 HG SER 30 HG SER 30 25.853 46.442 -9.544 239 H SER 31 HN SER 31 21.776 45.730 -13.127 240 HA SER 31 HA SER 31 23.267 47.665 -14.554 241 HB2 SER 31 HB2 SER 31 21.976 45.922 -15.695 242 HB3 SER 31 HB1 SER 31 20.478 46.601 -15.067 243 HG SER 31 HG SER 31 22.347 48.038 -16.649 244 H ASN 32 HN ASN 32 20.256 47.880 -12.696 245 HA ASN 32 HA ASN 32 19.451 50.436 -13.474 246 HB2 ASN 32 HB2 ASN 32 18.331 50.536 -11.255 247 HB3 ASN 32 HB1 ASN 32 18.032 49.020 -12.103 248 HD21 ASN 32 HD21 ASN 32 18.692 50.131 -9.074 249 HD22 ASN 32 HD22 ASN 32 19.558 48.807 -8.459 250 H ASN 33 HN ASN 33 21.793 49.410 -11.047 251 HA ASN 33 HA ASN 33 22.286 51.980 -9.954 252 HB2 ASN 33 HB2 ASN 33 23.962 49.466 -10.028 253 HB3 ASN 33 HB1 ASN 33 24.449 50.924 -9.165 254 HD21 ASN 33 HD21 ASN 33 22.361 51.813 -7.783 255 HD22 ASN 33 HD22 ASN 33 21.638 50.612 -6.825 256 H PHE 34 HN PHE 34 23.744 50.143 -12.575 257 HA PHE 34 HA PHE 34 25.954 51.723 -13.173 258 HB2 PHE 34 HB2 PHE 34 25.454 49.577 -14.301 259 HB3 PHE 34 HB1 PHE 34 24.127 50.354 -15.164 260 HD1 PHE 34 HD1 PHE 34 27.813 50.428 -14.644 261 HD2 PHE 34 HD2 PHE 34 24.518 51.690 -17.094 262 HE1 PHE 34 HE1 PHE 34 29.404 51.244 -16.363 263 HE2 PHE 34 HE2 PHE 34 26.108 52.506 -18.813 264 HZ PHE 34 HZ PHE 34 28.551 52.283 -18.448 265 H GLY 35 HN GLY 35 22.563 52.216 -13.999 266 HA2 GLY 35 HA2 GLY 35 22.904 54.388 -15.786 267 HA3 GLY 35 HA1 GLY 35 21.445 54.035 -14.852 268 H ALA 36 HN ALA 36 22.157 54.379 -12.282 269 HA ALA 36 HA ALA 36 22.229 57.168 -11.950 270 HB1 ALA 36 HB1 ALA 36 22.123 56.752 -9.667 271 HB2 ALA 36 HB2 ALA 36 23.149 55.322 -9.776 272 HB3 ALA 36 HB3 ALA 36 21.475 55.250 -10.326 273 H ILE 37 HN ILE 37 24.778 54.724 -11.795 274 HA ILE 37 HA ILE 37 26.861 56.240 -10.751 275 HB ILE 37 HB ILE 37 26.626 53.824 -12.434 276 HG12 ILE 37 HG12 ILE 37 28.466 53.184 -10.723 277 HG13 ILE 37 HG11 ILE 37 28.084 54.723 -9.950 278 HG21 ILE 37 HG21 ILE 37 29.156 53.835 -12.758 279 HG22 ILE 37 HG22 ILE 37 29.109 55.561 -12.407 280 HG23 ILE 37 HG23 ILE 37 28.255 54.921 -13.813 281 HD11 ILE 37 HD11 ILE 37 26.749 52.986 -8.903 282 HD12 ILE 37 HD12 ILE 37 26.167 52.436 -10.474 283 HD13 ILE 37 HD13 ILE 37 25.681 54.015 -9.857 284 H LEU 38 HN LEU 38 25.520 56.152 -13.999 285 HA LEU 38 HA LEU 38 27.610 57.726 -15.191 286 HB2 LEU 38 HB2 LEU 38 26.233 56.146 -16.506 287 HB3 LEU 38 HB1 LEU 38 24.810 57.136 -16.186 288 HG LEU 38 HG LEU 38 25.971 59.068 -17.280 289 HD11 LEU 38 HD11 LEU 38 28.280 58.498 -17.027 290 HD12 LEU 38 HD12 LEU 38 27.949 58.397 -18.756 291 HD13 LEU 38 HD13 LEU 38 28.046 56.925 -17.789 292 HD21 LEU 38 HD21 LEU 38 24.420 57.441 -18.480 293 HD22 LEU 38 HD22 LEU 38 25.869 56.643 -19.091 294 HD23 LEU 38 HD23 LEU 38 25.539 58.321 -19.520 295 H SER 39 HN SER 39 24.630 58.399 -13.509 296 HA SER 39 HA SER 39 24.537 61.155 -14.430 297 HB2 SER 39 HB2 SER 39 22.895 59.670 -12.369 298 HB3 SER 39 HB1 SER 39 22.602 61.328 -12.886 299 HG SER 39 HG SER 39 22.691 59.069 -14.607 300 H SER 40 HN SER 40 26.730 59.826 -12.596 301 HA SER 40 HA SER 40 26.595 61.772 -10.388 302 HB2 SER 40 HB2 SER 40 28.344 59.327 -10.739 303 HB3 SER 40 HB1 SER 40 28.348 60.392 -9.336 304 HG SER 40 HG SER 40 26.412 58.569 -10.221 305 H THR 41 HN THR 41 27.246 62.614 -13.054 306 HA THR 41 HA THR 41 29.966 62.812 -13.622 307 HB THR 41 HB THR 41 28.099 63.530 -15.126 308 HG1 THR 41 HG1 THR 41 29.986 65.577 -14.603 309 HG21 THR 41 HG21 THR 41 27.070 65.688 -14.813 310 HG22 THR 41 HG22 THR 41 28.112 66.041 -13.434 311 HG23 THR 41 HG23 THR 41 26.879 64.786 -13.309 312 H ASN 42 HN ASN 42 28.149 64.296 -11.092 313 HA ASN 42 HA ASN 42 30.024 66.466 -10.666 314 HB2 ASN 42 HB2 ASN 42 28.625 67.062 -8.799 315 HB3 ASN 42 HB1 ASN 42 27.580 66.649 -10.157 316 HD21 ASN 42 HD21 ASN 42 26.535 66.482 -7.544 317 HD22 ASN 42 HD22 ASN 42 26.308 64.850 -7.136 318 H VAL 43 HN VAL 43 30.540 63.335 -10.317 319 HA VAL 43 HA VAL 43 31.556 63.350 -7.577 320 HB VAL 43 HB VAL 43 30.357 61.365 -8.673 321 HG11 VAL 43 HG11 VAL 43 33.096 60.907 -9.876 322 HG12 VAL 43 HG12 VAL 43 31.754 61.588 -10.795 323 HG13 VAL 43 HG13 VAL 43 31.632 59.958 -10.132 324 HG21 VAL 43 HG21 VAL 43 33.125 60.822 -7.562 325 HG22 VAL 43 HG22 VAL 43 31.703 59.787 -7.436 326 HG23 VAL 43 HG23 VAL 43 31.759 61.318 -6.563 327 H GLY 44 HN GLY 44 32.666 63.703 -10.847 328 HA2 GLY 44 HA2 GLY 44 34.875 64.941 -10.897 329 HA3 GLY 44 HA1 GLY 44 35.474 63.603 -9.923 330 H SER 45 HN SER 45 33.421 61.991 -11.755 331 HA SER 45 HA SER 45 35.473 61.270 -13.707 332 HB2 SER 45 HB2 SER 45 34.026 59.330 -14.161 333 HB3 SER 45 HB1 SER 45 34.379 59.473 -12.441 334 HG SER 45 HG SER 45 32.156 59.116 -12.829 335 H ASN 46 HN ASN 46 34.107 63.805 -14.012 336 HA ASN 46 HA ASN 46 32.201 63.444 -16.178 337 HB2 ASN 46 HB2 ASN 46 32.008 65.861 -16.146 338 HB3 ASN 46 HB1 ASN 46 31.935 65.253 -14.493 339 HD21 ASN 46 HD21 ASN 46 32.924 67.935 -15.629 340 HD22 ASN 46 HD22 ASN 46 34.482 68.106 -14.976 341 H THR 47 HN THR 47 35.279 62.825 -16.276 342 HA THR 47 HA THR 47 36.052 64.548 -18.509 343 HB THR 47 HB THR 47 37.706 62.270 -17.468 344 HG1 THR 47 HG1 THR 47 37.313 64.819 -16.296 345 HG21 THR 47 HG21 THR 47 38.322 63.698 -19.483 346 HG22 THR 47 HG22 THR 47 39.527 63.638 -18.197 347 HG23 THR 47 HG23 THR 47 38.485 65.051 -18.363 348 H TYR 48 HN TYR 48 33.860 62.569 -18.732 349 HA TYR 48 HA TYR 48 35.010 60.655 -20.650 350 HB2 TYR 48 HB2 TYR 48 32.969 59.402 -20.427 351 HB3 TYR 48 HB1 TYR 48 33.522 59.816 -18.805 352 HD1 TYR 48 HD1 TYR 48 30.920 60.291 -21.319 353 HD2 TYR 48 HD2 TYR 48 32.435 61.683 -17.548 354 HE1 TYR 48 HE1 TYR 48 28.766 61.437 -20.876 355 HE2 TYR 48 HE2 TYR 48 30.281 62.829 -17.106 356 HH TYR 48 HH TYR 48 28.350 63.790 -18.704 357 H GLY 49 HN GLY 49 34.370 63.641 -21.030 358 HA2 GLY 49 HA2 GLY 49 32.184 64.045 -22.686 359 HA3 GLY 49 HA1 GLY 49 33.696 64.940 -22.807 360 H LYS 50 HN LYS 50 31.766 63.789 -24.845 361 HA LYS 50 HA LYS 50 32.988 61.651 -26.220 362 HB2 LYS 50 HB2 LYS 50 31.168 63.874 -27.156 363 HB3 LYS 50 HB1 LYS 50 31.683 62.546 -28.197 364 HG2 LYS 50 HG2 LYS 50 30.784 60.946 -26.469 365 HG3 LYS 50 HG1 LYS 50 30.113 62.335 -25.614 366 HD2 LYS 50 HD2 LYS 50 29.509 61.745 -28.521 367 HD3 LYS 50 HD1 LYS 50 28.504 61.162 -27.194 368 HE2 LYS 50 HE2 LYS 50 29.164 64.072 -27.743 369 HE3 LYS 50 HE1 LYS 50 27.630 63.286 -28.115 370 HZ1 LYS 50 HZ1 LYS 50 27.602 62.675 -25.662 371 HZ2 LYS 50 HZ2 LYS 50 27.291 64.296 -26.062 372 HZ3 LYS 50 HZ3 LYS 50 28.816 63.843 -25.466 373 H ARG 51 HN ARG 51 33.463 65.140 -26.360 374 HA ARG 51 HA ARG 51 34.933 65.436 -28.667 375 HB2 ARG 51 HB2 ARG 51 35.942 67.384 -27.661 376 HB3 ARG 51 HB1 ARG 51 34.274 67.275 -27.099 377 HG2 ARG 51 HG2 ARG 51 35.087 66.141 -25.028 378 HG3 ARG 51 HG1 ARG 51 36.744 66.390 -25.579 379 HD2 ARG 51 HD2 ARG 51 36.358 68.828 -25.628 380 HD3 ARG 51 HD1 ARG 51 34.710 68.576 -25.059 381 HE ARG 51 HE ARG 51 37.129 68.444 -23.473 382 HH11 ARG 51 HH11 ARG 51 33.800 67.444 -23.769 383 HH12 ARG 51 HH12 ARG 51 33.602 67.190 -22.071 384 HH21 ARG 51 HH21 ARG 51 36.840 68.104 -21.259 385 HH22 ARG 51 HH22 ARG 51 35.310 67.559 -20.657 386 H ASN 52 HN ASN 52 35.941 64.019 -25.616 387 HA ASN 52 HA ASN 52 38.730 63.989 -26.107 388 HB2 ASN 52 HB2 ASN 52 37.479 63.537 -23.907 389 HB3 ASN 52 HB1 ASN 52 37.263 61.896 -24.513 390 HD21 ASN 52 HD21 ASN 52 39.347 60.714 -25.122 391 HD22 ASN 52 HD22 ASN 52 40.756 61.084 -24.250 392 H ALA 53 HN ALA 53 36.145 61.667 -26.761 393 HA ALA 53 HA ALA 53 37.749 59.569 -27.747 394 HB1 ALA 53 HB1 ALA 53 34.880 60.324 -28.326 395 HB2 ALA 53 HB2 ALA 53 35.459 59.136 -27.159 396 HB3 ALA 53 HB3 ALA 53 35.631 58.831 -28.888 397 H VAL 54 HN VAL 54 35.984 62.136 -29.489 398 HA VAL 54 HA VAL 54 36.876 61.390 -32.069 399 HB VAL 54 HB VAL 54 35.011 63.116 -31.144 400 HG11 VAL 54 HG11 VAL 54 37.162 64.907 -32.295 401 HG12 VAL 54 HG12 VAL 54 36.927 64.712 -30.558 402 HG13 VAL 54 HG13 VAL 54 35.634 65.381 -31.551 403 HG21 VAL 54 HG21 VAL 54 34.934 63.942 -33.551 404 HG22 VAL 54 HG22 VAL 54 34.944 62.189 -33.357 405 HG23 VAL 54 HG23 VAL 54 36.421 63.033 -33.823 406 H GLU 55 HN GLU 55 38.431 63.088 -29.491 407 HA GLU 55 HA GLU 55 40.252 64.610 -31.062 408 HB2 GLU 55 HB2 GLU 55 39.646 64.420 -28.362 409 HB3 GLU 55 HB1 GLU 55 41.284 63.772 -28.462 410 HG2 GLU 55 HG2 GLU 55 40.475 66.367 -29.788 411 HG3 GLU 55 HG1 GLU 55 41.114 66.297 -28.147 412 H VAL 56 HN VAL 56 40.735 61.598 -29.186 413 HA VAL 56 HA VAL 56 43.311 61.064 -30.173 414 HB VAL 56 HB VAL 56 42.424 59.954 -28.182 415 HG11 VAL 56 HG11 VAL 56 40.541 58.646 -30.165 416 HG12 VAL 56 HG12 VAL 56 40.102 59.682 -28.808 417 HG13 VAL 56 HG13 VAL 56 40.776 58.080 -28.512 418 HG21 VAL 56 HG21 VAL 56 43.222 57.702 -28.676 419 HG22 VAL 56 HG22 VAL 56 44.217 58.867 -29.548 420 HG23 VAL 56 HG23 VAL 56 42.970 57.959 -30.402 421 H LEU 57 HN LEU 57 40.155 60.549 -31.531 422 HA LEU 57 HA LEU 57 40.594 58.525 -33.371 423 HB2 LEU 57 HB2 LEU 57 38.701 60.697 -33.047 424 HB3 LEU 57 HB1 LEU 57 39.069 60.426 -34.751 425 HG LEU 57 HG LEU 57 38.752 57.906 -34.183 426 HD11 LEU 57 HD11 LEU 57 38.682 58.374 -31.699 427 HD12 LEU 57 HD12 LEU 57 37.321 57.428 -32.301 428 HD13 LEU 57 HD13 LEU 57 37.117 59.146 -31.954 429 HD21 LEU 57 HD21 LEU 57 37.223 59.402 -35.550 430 HD22 LEU 57 HD22 LEU 57 36.306 59.692 -34.071 431 HD23 LEU 57 HD23 LEU 57 36.412 58.063 -34.738 432 H LYS 58 HN LYS 58 41.191 62.006 -33.721 433 HA LYS 58 HA LYS 58 42.242 61.961 -36.339 434 HB2 LYS 58 HB2 LYS 58 42.659 63.845 -34.017 435 HB3 LYS 58 HB1 LYS 58 43.343 64.127 -35.618 436 HG2 LYS 58 HG2 LYS 58 40.396 63.599 -35.204 437 HG3 LYS 58 HG1 LYS 58 41.074 65.225 -35.142 438 HD2 LYS 58 HD2 LYS 58 42.091 64.767 -37.426 439 HD3 LYS 58 HD1 LYS 58 41.108 63.304 -37.481 440 HE2 LYS 58 HE2 LYS 58 39.969 66.072 -37.014 441 HE3 LYS 58 HE1 LYS 58 40.042 65.298 -38.597 442 HZ1 LYS 58 HZ1 LYS 58 38.823 63.887 -36.319 443 HZ2 LYS 58 HZ2 LYS 58 38.537 63.688 -37.981 444 HZ3 LYS 58 HZ3 LYS 58 37.927 65.049 -37.169 445 H ARG 59 HN ARG 59 43.750 61.553 -33.170 446 HA ARG 59 HA ARG 59 46.443 61.602 -34.005 447 HB2 ARG 59 HB2 ARG 59 45.437 61.659 -31.615 448 HB3 ARG 59 HB1 ARG 59 45.470 59.899 -31.726 449 HG2 ARG 59 HG2 ARG 59 47.962 61.188 -32.612 450 HG3 ARG 59 HG1 ARG 59 47.588 61.455 -30.909 451 HD2 ARG 59 HD2 ARG 59 47.255 58.999 -30.637 452 HD3 ARG 59 HD1 ARG 59 47.750 58.774 -32.312 453 HE ARG 59 HE ARG 59 49.775 60.230 -31.072 454 HH11 ARG 59 HH11 ARG 59 48.250 57.110 -30.753 455 HH12 ARG 59 HH12 ARG 59 49.675 56.345 -30.141 456 HH21 ARG 59 HH21 ARG 59 51.621 59.204 -30.272 457 HH22 ARG 59 HH22 ARG 59 51.573 57.520 -29.869 458 H GLU 60 HN GLU 60 43.985 59.162 -34.241 459 HA GLU 60 HA GLU 60 46.010 57.247 -35.241 460 HB2 GLU 60 HB2 GLU 60 43.352 56.676 -33.908 461 HB3 GLU 60 HB1 GLU 60 44.436 55.457 -34.580 462 HG2 GLU 60 HG2 GLU 60 45.168 57.408 -32.378 463 HG3 GLU 60 HG1 GLU 60 44.739 55.717 -32.129 464 HA PRO 61 HA PRO 61 43.160 58.466 -38.711 465 HB2 PRO 61 HB2 PRO 61 45.164 58.662 -40.584 466 HB3 PRO 61 HB1 PRO 61 44.626 60.010 -39.565 467 HG2 PRO 61 HG2 PRO 61 47.000 58.244 -39.272 468 HG3 PRO 61 HG1 PRO 61 46.837 59.981 -38.963 469 HD2 PRO 61 HD2 PRO 61 46.842 58.113 -36.964 470 HD3 PRO 61 HD1 PRO 61 45.975 59.659 -36.840 471 H LEU 62 HN LEU 62 45.321 55.917 -38.023 472 HA LEU 62 HA LEU 62 45.321 54.388 -40.351 473 HB2 LEU 62 HB2 LEU 62 46.607 53.942 -38.216 474 HB3 LEU 62 HB1 LEU 62 45.119 53.264 -37.554 475 HG LEU 62 HG LEU 62 45.837 52.265 -40.238 476 HD11 LEU 62 HD11 LEU 62 48.076 52.471 -39.150 477 HD12 LEU 62 HD12 LEU 62 47.613 50.793 -39.435 478 HD13 LEU 62 HD13 LEU 62 47.487 51.480 -37.815 479 HD21 LEU 62 HD21 LEU 62 45.113 50.159 -39.244 480 HD22 LEU 62 HD22 LEU 62 43.964 51.422 -38.800 481 HD23 LEU 62 HD23 LEU 62 45.161 50.868 -37.629 482 H ASN 63 HN ASN 63 42.896 54.666 -37.794 483 HA ASN 63 HA ASN 63 41.208 52.591 -38.848 484 HB2 ASN 63 HB2 ASN 63 39.742 53.104 -37.091 485 HB3 ASN 63 HB1 ASN 63 41.332 53.468 -36.425 486 HD21 ASN 63 HD21 ASN 63 38.481 54.671 -35.987 487 HD22 ASN 63 HD22 ASN 63 38.750 56.343 -36.111 488 H TYR 64 HN TYR 64 41.647 55.975 -39.447 489 HA TYR 64 HA TYR 64 39.054 56.456 -40.578 490 HB2 TYR 64 HB2 TYR 64 40.530 58.245 -39.634 491 HB3 TYR 64 HB1 TYR 64 41.608 58.019 -41.012 492 HD1 TYR 64 HD1 TYR 64 38.129 58.930 -40.044 493 HD2 TYR 64 HD2 TYR 64 41.103 58.950 -43.144 494 HE1 TYR 64 HE1 TYR 64 36.688 60.409 -41.417 495 HE2 TYR 64 HE2 TYR 64 39.662 60.429 -44.517 496 HH TYR 64 HH TYR 64 37.824 62.054 -44.155 497 H LEU 65 HN LEU 65 42.210 55.497 -41.827 498 HA LEU 65 HA LEU 65 41.536 55.797 -44.581 499 HB2 LEU 65 HB2 LEU 65 43.679 54.150 -43.216 500 HB3 LEU 65 HB1 LEU 65 43.574 54.404 -44.957 501 HG LEU 65 HG LEU 65 43.735 56.667 -42.951 502 HD11 LEU 65 HD11 LEU 65 46.083 56.820 -43.424 503 HD12 LEU 65 HD12 LEU 65 45.971 55.599 -44.691 504 HD13 LEU 65 HD13 LEU 65 45.769 55.136 -43.002 505 HD21 LEU 65 HD21 LEU 65 44.493 57.871 -45.082 506 HD22 LEU 65 HD22 LEU 65 42.791 57.416 -45.019 507 HD23 LEU 65 HD23 LEU 65 43.925 56.455 -45.967 508 HA PRO 66 HA PRO 66 39.171 52.221 -45.573 509 HB2 PRO 66 HB2 PRO 66 41.263 51.421 -47.543 510 HB3 PRO 66 HB1 PRO 66 39.527 51.689 -47.786 511 HG2 PRO 66 HG2 PRO 66 41.334 53.454 -48.621 512 HG3 PRO 66 HG1 PRO 66 39.766 53.963 -47.973 513 HD2 PRO 66 HD2 PRO 66 42.461 54.085 -46.690 514 HD3 PRO 66 HD1 PRO 66 41.073 55.180 -46.512 515 H LEU 67 HN LEU 67 38.984 50.145 -44.832 516 HA LEU 67 HA LEU 67 41.214 48.361 -44.568 517 HB2 LEU 67 HB2 LEU 67 40.638 50.148 -42.377 518 HB3 LEU 67 HB1 LEU 67 40.353 48.477 -41.891 519 HG LEU 67 HG LEU 67 42.862 49.349 -43.337 520 HD11 LEU 67 HD11 LEU 67 42.541 48.916 -40.357 521 HD12 LEU 67 HD12 LEU 67 42.536 50.512 -41.107 522 HD13 LEU 67 HD13 LEU 67 43.973 49.495 -41.207 523 HD21 LEU 67 HD21 LEU 67 42.136 46.918 -43.327 524 HD22 LEU 67 HD22 LEU 67 42.316 46.946 -41.573 525 HD23 LEU 67 HD23 LEU 67 43.718 47.216 -42.607 Start of MODEL 15 1 H1 THR 1 HT1 THR 1 -3.024 -3.603 -1.386 2 H2 THR 1 HT2 THR 1 -3.595 -2.659 -0.094 3 H3 THR 1 HT3 THR 1 -4.041 -4.294 -0.217 4 HA THR 1 HA THR 1 -2.405 -4.613 1.255 5 HB THR 1 HB THR 1 -1.599 -5.026 -1.390 6 HG1 THR 1 HG1 THR 1 -0.547 -6.646 -0.467 7 HG21 THR 1 HG21 THR 1 0.764 -4.489 -1.456 8 HG22 THR 1 HG22 THR 1 0.700 -3.808 0.167 9 HG23 THR 1 HG23 THR 1 -0.136 -3.003 -1.164 10 HA PRO 2 HA PRO 2 -0.600 -0.895 2.798 11 HB2 PRO 2 HB2 PRO 2 1.549 -1.805 4.200 12 HB3 PRO 2 HB1 PRO 2 -0.124 -2.073 4.724 13 HG2 PRO 2 HG2 PRO 2 1.756 -3.935 3.371 14 HG3 PRO 2 HG1 PRO 2 0.564 -4.256 4.642 15 HD2 PRO 2 HD2 PRO 2 0.156 -4.825 1.970 16 HD3 PRO 2 HD1 PRO 2 -1.154 -4.540 3.136 17 H ILE 3 HN ILE 3 1.080 0.640 2.511 18 HA ILE 3 HA ILE 3 2.478 0.509 0.061 19 HB ILE 3 HB ILE 3 1.765 2.575 1.456 20 HG12 ILE 3 HG12 ILE 3 3.828 3.833 0.557 21 HG13 ILE 3 HG11 ILE 3 4.389 2.261 -0.012 22 HG21 ILE 3 HG21 ILE 3 3.111 1.742 3.463 23 HG22 ILE 3 HG22 ILE 3 3.364 3.428 3.013 24 HG23 ILE 3 HG23 ILE 3 4.556 2.209 2.567 25 HD11 ILE 3 HD11 ILE 3 1.641 3.336 -0.676 26 HD12 ILE 3 HD12 ILE 3 2.490 1.988 -1.434 27 HD13 ILE 3 HD13 ILE 3 3.048 3.640 -1.694 28 H GLU 4 HN GLU 4 4.593 0.078 -0.439 29 HA GLU 4 HA GLU 4 6.010 -1.697 1.317 30 HB2 GLU 4 HB2 GLU 4 7.658 -1.818 -0.471 31 HB3 GLU 4 HB1 GLU 4 6.036 -1.929 -1.156 32 HG2 GLU 4 HG2 GLU 4 6.108 0.508 -1.652 33 HG3 GLU 4 HG1 GLU 4 7.761 0.562 -1.042 34 H SER 5 HN SER 5 8.140 -1.387 2.147 35 HA SER 5 HA SER 5 8.532 1.148 3.382 36 HB2 SER 5 HB2 SER 5 10.376 -1.239 3.139 37 HB3 SER 5 HB1 SER 5 10.669 0.155 4.176 38 HG SER 5 HG SER 5 8.893 -0.368 5.369 39 H HIS 6 HN HIS 6 10.051 2.739 2.985 40 HA HIS 6 HA HIS 6 10.761 3.201 0.279 41 HB2 HIS 6 HB2 HIS 6 11.917 5.169 1.113 42 HB3 HIS 6 HB1 HIS 6 10.378 4.998 1.958 43 HD1 HIS 6 HD1 HIS 6 14.091 4.498 2.452 44 HD2 HIS 6 HD2 HIS 6 10.594 4.505 4.722 45 HE1 HIS 6 HE1 HIS 6 14.812 4.420 4.879 46 HE2 HIS 6 HE2 HIS 6 12.692 4.423 6.276 47 H GLN 7 HN GLN 7 12.349 1.564 2.889 48 HA GLN 7 HA GLN 7 14.979 1.682 1.656 49 HB2 GLN 7 HB2 GLN 7 14.750 1.665 4.113 50 HB3 GLN 7 HB1 GLN 7 13.992 0.075 4.026 51 HG2 GLN 7 HG2 GLN 7 16.011 -0.878 3.041 52 HG3 GLN 7 HG1 GLN 7 16.772 0.712 2.999 53 HE21 GLN 7 HE21 GLN 7 18.498 0.049 4.467 54 HE22 GLN 7 HE22 GLN 7 18.195 -0.226 6.114 55 H VAL 8 HN VAL 8 15.725 0.285 0.198 56 HA VAL 8 HA VAL 8 14.569 -2.417 0.064 57 HB VAL 8 HB VAL 8 13.375 -1.056 -1.607 58 HG11 VAL 8 HG11 VAL 8 15.135 0.639 -1.962 59 HG12 VAL 8 HG12 VAL 8 14.641 -0.085 -3.493 60 HG13 VAL 8 HG13 VAL 8 16.153 -0.579 -2.731 61 HG21 VAL 8 HG21 VAL 8 14.054 -3.476 -2.017 62 HG22 VAL 8 HG22 VAL 8 15.395 -2.851 -2.976 63 HG23 VAL 8 HG23 VAL 8 13.733 -2.531 -3.470 64 H GLU 9 HN GLU 9 15.969 -3.997 -0.707 65 HA GLU 9 HA GLU 9 18.689 -3.151 -1.449 66 HB2 GLU 9 HB2 GLU 9 19.370 -5.227 0.058 67 HB3 GLU 9 HB1 GLU 9 19.196 -3.614 0.749 68 HG2 GLU 9 HG2 GLU 9 18.019 -5.404 2.062 69 HG3 GLU 9 HG1 GLU 9 16.952 -4.114 1.512 70 H LYS 10 HN LYS 10 19.961 -4.926 -2.402 71 HA LYS 10 HA LYS 10 18.335 -7.126 -3.488 72 HB2 LYS 10 HB2 LYS 10 19.416 -6.715 -5.732 73 HB3 LYS 10 HB1 LYS 10 18.243 -5.492 -5.242 74 HG2 LYS 10 HG2 LYS 10 20.888 -4.839 -4.243 75 HG3 LYS 10 HG1 LYS 10 20.912 -5.048 -5.994 76 HD2 LYS 10 HD2 LYS 10 19.368 -3.331 -6.356 77 HD3 LYS 10 HD1 LYS 10 18.722 -3.433 -4.717 78 HE2 LYS 10 HE2 LYS 10 21.595 -2.660 -5.115 79 HE3 LYS 10 HE1 LYS 10 20.334 -1.453 -5.363 80 HZ1 LYS 10 HZ1 LYS 10 20.405 -3.121 -2.927 81 HZ2 LYS 10 HZ2 LYS 10 19.619 -1.636 -3.174 82 HZ3 LYS 10 HZ3 LYS 10 21.311 -1.692 -3.037 83 H ARG 11 HN ARG 11 19.797 -8.712 -4.693 84 HA ARG 11 HA ARG 11 22.493 -8.803 -3.529 85 HB2 ARG 11 HB2 ARG 11 21.974 -11.405 -3.359 86 HB3 ARG 11 HB1 ARG 11 21.619 -10.306 -2.035 87 HG2 ARG 11 HG2 ARG 11 19.663 -11.620 -2.278 88 HG3 ARG 11 HG1 ARG 11 19.249 -10.104 -3.058 89 HD2 ARG 11 HD2 ARG 11 20.455 -12.329 -4.677 90 HD3 ARG 11 HD1 ARG 11 18.747 -12.383 -4.265 91 HE ARG 11 HE ARG 11 20.010 -10.584 -6.146 92 HH11 ARG 11 HH11 ARG 11 17.288 -11.123 -4.031 93 HH12 ARG 11 HH12 ARG 11 16.244 -10.062 -4.912 94 HH21 ARG 11 HH21 ARG 11 18.623 -9.205 -7.275 95 HH22 ARG 11 HH22 ARG 11 16.993 -8.982 -6.736 96 H LYS 12 HN LYS 12 22.578 -7.984 -5.897 97 HA LYS 12 HA LYS 12 23.000 -10.343 -7.634 98 HB2 LYS 12 HB2 LYS 12 22.366 -8.988 -9.555 99 HB3 LYS 12 HB1 LYS 12 21.061 -8.968 -8.368 100 HG2 LYS 12 HG2 LYS 12 21.930 -6.803 -7.494 101 HG3 LYS 12 HG1 LYS 12 23.157 -6.812 -8.761 102 HD2 LYS 12 HD2 LYS 12 21.417 -6.805 -10.485 103 HD3 LYS 12 HD1 LYS 12 20.164 -6.873 -9.246 104 HE2 LYS 12 HE2 LYS 12 20.384 -4.568 -9.939 105 HE3 LYS 12 HE1 LYS 12 21.071 -4.710 -8.320 106 HZ1 LYS 12 HZ1 LYS 12 22.562 -4.660 -10.886 107 HZ2 LYS 12 HZ2 LYS 12 23.271 -4.966 -9.373 108 HZ3 LYS 12 HZ3 LYS 12 22.556 -3.458 -9.691 109 H CYS 13 HN CYS 13 24.750 -10.234 -9.081 110 HA CYS 13 HA CYS 13 27.062 -10.012 -9.292 111 HB2 CYS 13 HB2 CYS 13 25.749 -8.360 -10.828 112 HB3 CYS 13 HB1 CYS 13 26.429 -7.122 -9.774 113 H ASN 14 HN ASN 14 27.277 -10.259 -6.837 114 HA ASN 14 HA ASN 14 28.399 -7.782 -5.673 115 HB2 ASN 14 HB2 ASN 14 27.992 -8.861 -3.472 116 HB3 ASN 14 HB1 ASN 14 26.509 -8.605 -4.391 117 HD21 ASN 14 HD21 ASN 14 25.193 -10.388 -3.944 118 HD22 ASN 14 HD22 ASN 14 25.706 -12.005 -4.012 119 H THR 15 HN THR 15 29.736 -9.771 -7.465 120 HA THR 15 HA THR 15 31.638 -11.084 -5.680 121 HB THR 15 HB THR 15 30.761 -12.227 -7.730 122 HG1 THR 15 HG1 THR 15 32.580 -13.237 -7.656 123 HG21 THR 15 HG21 THR 15 32.565 -10.348 -9.256 124 HG22 THR 15 HG22 THR 15 30.833 -10.057 -9.095 125 HG23 THR 15 HG23 THR 15 31.412 -11.514 -9.903 126 H ALA 16 HN ALA 16 34.019 -10.939 -6.770 127 HA ALA 16 HA ALA 16 34.881 -8.267 -6.203 128 HB1 ALA 16 HB1 ALA 16 36.230 -10.818 -7.011 129 HB2 ALA 16 HB2 ALA 16 36.463 -9.840 -5.562 130 HB3 ALA 16 HB3 ALA 16 37.123 -9.300 -7.106 131 H THR 17 HN THR 17 34.588 -10.225 -9.133 132 HA THR 17 HA THR 17 35.841 -8.535 -10.960 133 HB THR 17 HB THR 17 33.422 -10.302 -11.394 134 HG1 THR 17 HG1 THR 17 35.175 -11.461 -10.656 135 HG21 THR 17 HG21 THR 17 34.303 -10.314 -13.765 136 HG22 THR 17 HG22 THR 17 35.366 -8.985 -13.303 137 HG23 THR 17 HG23 THR 17 33.616 -8.776 -13.243 138 H CYS 18 HN CYS 18 32.516 -8.470 -9.735 139 HA CYS 18 HA CYS 18 31.523 -6.467 -11.451 140 HB2 CYS 18 HB2 CYS 18 30.463 -8.017 -9.452 141 HB3 CYS 18 HB1 CYS 18 30.472 -6.419 -8.707 142 H ALA 19 HN ALA 19 33.125 -6.286 -8.293 143 HA ALA 19 HA ALA 19 32.856 -3.574 -7.768 144 HB1 ALA 19 HB1 ALA 19 33.860 -5.162 -6.181 145 HB2 ALA 19 HB2 ALA 19 34.926 -3.783 -6.450 146 HB3 ALA 19 HB3 ALA 19 35.267 -5.327 -7.231 147 H THR 20 HN THR 20 35.153 -5.239 -9.878 148 HA THR 20 HA THR 20 36.825 -3.059 -10.464 149 HB THR 20 HB THR 20 36.055 -5.395 -12.231 150 HG1 THR 20 HG1 THR 20 37.075 -6.343 -10.641 151 HG21 THR 20 HG21 THR 20 38.381 -3.456 -12.336 152 HG22 THR 20 HG22 THR 20 37.082 -3.597 -13.521 153 HG23 THR 20 HG23 THR 20 38.241 -4.911 -13.322 154 H GLN 21 HN GLN 21 33.743 -4.089 -11.859 155 HA GLN 21 HA GLN 21 33.686 -2.435 -14.103 156 HB2 GLN 21 HB2 GLN 21 31.550 -3.150 -14.345 157 HB3 GLN 21 HB1 GLN 21 31.966 -4.243 -13.028 158 HG2 GLN 21 HG2 GLN 21 31.168 -2.433 -11.428 159 HG3 GLN 21 HG1 GLN 21 30.526 -1.588 -12.835 160 HE21 GLN 21 HE21 GLN 21 28.730 -2.469 -10.855 161 HE22 GLN 21 HE22 GLN 21 27.815 -3.763 -11.465 162 H ARG 22 HN ARG 22 33.186 -1.657 -10.722 163 HA ARG 22 HA ARG 22 32.023 0.923 -11.276 164 HB2 ARG 22 HB2 ARG 22 31.731 1.132 -9.014 165 HB3 ARG 22 HB1 ARG 22 31.889 -0.617 -9.107 166 HG2 ARG 22 HG2 ARG 22 33.412 -0.203 -7.431 167 HG3 ARG 22 HG1 ARG 22 34.487 -0.020 -8.808 168 HD2 ARG 22 HD2 ARG 22 34.911 2.086 -8.143 169 HD3 ARG 22 HD1 ARG 22 33.225 2.488 -8.451 170 HE ARG 22 HE ARG 22 32.837 2.409 -6.162 171 HH11 ARG 22 HH11 ARG 22 35.901 0.927 -6.923 172 HH12 ARG 22 HH12 ARG 22 36.376 0.780 -5.267 173 HH21 ARG 22 HH21 ARG 22 33.483 2.205 -4.006 174 HH22 ARG 22 HH22 ARG 22 35.018 1.498 -3.624 175 H LEU 23 HN LEU 23 35.217 -0.363 -11.002 176 HA LEU 23 HA LEU 23 36.640 1.974 -10.322 177 HB2 LEU 23 HB2 LEU 23 37.644 -0.289 -10.327 178 HB3 LEU 23 HB1 LEU 23 37.533 -0.322 -12.087 179 HG LEU 23 HG LEU 23 38.959 1.738 -12.163 180 HD11 LEU 23 HD11 LEU 23 38.582 2.708 -10.009 181 HD12 LEU 23 HD12 LEU 23 40.265 2.180 -10.010 182 HD13 LEU 23 HD13 LEU 23 39.039 1.218 -9.183 183 HD21 LEU 23 HD21 LEU 23 41.067 0.558 -11.508 184 HD22 LEU 23 HD22 LEU 23 39.991 -0.450 -12.477 185 HD23 LEU 23 HD23 LEU 23 40.089 -0.687 -10.732 186 H ALA 24 HN ALA 24 35.479 0.721 -13.410 187 HA ALA 24 HA ALA 24 36.779 2.669 -15.041 188 HB1 ALA 24 HB1 ALA 24 34.217 1.248 -15.753 189 HB2 ALA 24 HB2 ALA 24 35.772 0.415 -15.761 190 HB3 ALA 24 HB3 ALA 24 35.504 1.794 -16.828 191 H ASN 25 HN ASN 25 33.611 2.445 -13.500 192 HA ASN 25 HA ASN 25 32.473 4.756 -14.682 193 HB2 ASN 25 HB2 ASN 25 31.898 3.293 -12.103 194 HB3 ASN 25 HB1 ASN 25 30.954 4.678 -12.647 195 HD21 ASN 25 HD21 ASN 25 29.829 2.023 -12.381 196 HD22 ASN 25 HD22 ASN 25 29.399 1.491 -13.935 197 H PHE 26 HN PHE 26 34.412 4.243 -11.779 198 HA PHE 26 HA PHE 26 34.151 6.850 -10.701 199 HB2 PHE 26 HB2 PHE 26 34.996 4.891 -9.428 200 HB3 PHE 26 HB1 PHE 26 36.466 4.924 -10.401 201 HD1 PHE 26 HD1 PHE 26 34.413 6.879 -7.993 202 HD2 PHE 26 HD2 PHE 26 38.207 6.499 -9.971 203 HE1 PHE 26 HE1 PHE 26 35.367 8.610 -6.495 204 HE2 PHE 26 HE2 PHE 26 39.161 8.230 -8.473 205 HZ PHE 26 HZ PHE 26 37.741 9.286 -6.735 206 H LEU 27 HN LEU 27 36.213 5.491 -13.182 207 HA LEU 27 HA LEU 27 38.176 7.496 -13.261 208 HB2 LEU 27 HB2 LEU 27 38.358 5.310 -14.426 209 HB3 LEU 27 HB1 LEU 27 37.077 5.792 -15.524 210 HG LEU 27 HG LEU 27 39.543 6.001 -16.306 211 HD11 LEU 27 HD11 LEU 27 37.992 8.554 -16.662 212 HD12 LEU 27 HD12 LEU 27 37.376 7.037 -17.316 213 HD13 LEU 27 HD13 LEU 27 38.942 7.652 -17.839 214 HD21 LEU 27 HD21 LEU 27 40.123 7.295 -14.128 215 HD22 LEU 27 HD22 LEU 27 39.413 8.687 -14.943 216 HD23 LEU 27 HD23 LEU 27 40.805 7.870 -15.648 217 H VAL 28 HN VAL 28 35.003 7.262 -14.822 218 HA VAL 28 HA VAL 28 35.379 9.871 -16.090 219 HB VAL 28 HB VAL 28 33.184 9.469 -17.104 220 HG11 VAL 28 HG11 VAL 28 35.321 8.417 -18.009 221 HG12 VAL 28 HG12 VAL 28 33.820 7.635 -18.506 222 HG13 VAL 28 HG13 VAL 28 34.809 6.919 -17.233 223 HG21 VAL 28 HG21 VAL 28 33.193 6.887 -15.508 224 HG22 VAL 28 HG22 VAL 28 31.950 7.410 -16.643 225 HG23 VAL 28 HG23 VAL 28 32.192 8.290 -15.135 226 H HIS 29 HN HIS 29 33.844 8.470 -13.301 227 HA HIS 29 HA HIS 29 31.990 10.549 -12.749 228 HB2 HIS 29 HB2 HIS 29 32.019 8.267 -11.677 229 HB3 HIS 29 HB1 HIS 29 33.403 8.804 -10.726 230 HD1 HIS 29 HD1 HIS 29 29.822 9.908 -11.439 231 HD2 HIS 29 HD2 HIS 29 32.690 10.162 -8.424 232 HE1 HIS 29 HE1 HIS 29 28.694 11.032 -9.470 233 HE2 HIS 29 HE2 HIS 29 30.430 11.195 -7.624 234 H SER 30 HN SER 30 35.362 10.018 -11.882 235 HA SER 30 HA SER 30 35.488 12.461 -10.321 236 HB2 SER 30 HB2 SER 30 36.799 10.449 -9.685 237 HB3 SER 30 HB1 SER 30 37.730 10.613 -11.171 238 HG SER 30 HG SER 30 38.222 12.786 -10.402 239 H SER 31 HN SER 31 35.915 11.542 -13.595 240 HA SER 31 HA SER 31 37.902 13.200 -14.554 241 HB2 SER 31 HB2 SER 31 36.687 11.557 -15.934 242 HB3 SER 31 HB1 SER 31 35.255 12.581 -15.883 243 HG SER 31 HG SER 31 36.497 12.943 -17.766 244 H ASN 32 HN ASN 32 34.796 14.109 -13.286 245 HA ASN 32 HA ASN 32 34.426 16.574 -14.565 246 HB2 ASN 32 HB2 ASN 32 33.078 17.185 -12.598 247 HB3 ASN 32 HB1 ASN 32 32.714 15.548 -13.140 248 HD21 ASN 32 HD21 ASN 32 33.085 17.207 -10.347 249 HD22 ASN 32 HD22 ASN 32 33.766 16.001 -9.365 250 H ASN 33 HN ASN 33 36.304 15.715 -11.700 251 HA ASN 33 HA ASN 33 37.062 18.352 -11.007 252 HB2 ASN 33 HB2 ASN 33 38.329 15.670 -10.432 253 HB3 ASN 33 HB1 ASN 33 38.960 17.184 -9.785 254 HD21 ASN 33 HD21 ASN 33 36.997 18.604 -8.781 255 HD22 ASN 33 HD22 ASN 33 35.970 17.726 -7.753 256 H PHE 34 HN PHE 34 38.504 15.886 -13.065 257 HA PHE 34 HA PHE 34 40.971 17.026 -13.635 258 HB2 PHE 34 HB2 PHE 34 40.275 14.792 -14.426 259 HB3 PHE 34 HB1 PHE 34 39.167 15.551 -15.568 260 HD1 PHE 34 HD1 PHE 34 42.758 15.268 -14.618 261 HD2 PHE 34 HD2 PHE 34 39.932 16.417 -17.643 262 HE1 PHE 34 HE1 PHE 34 44.609 15.530 -16.248 263 HE2 PHE 34 HE2 PHE 34 41.783 16.679 -19.273 264 HZ PHE 34 HZ PHE 34 44.121 16.235 -18.575 265 H GLY 35 HN GLY 35 37.788 17.873 -14.855 266 HA2 GLY 35 HA2 GLY 35 38.607 19.529 -16.998 267 HA3 GLY 35 HA1 GLY 35 37.063 19.627 -16.157 268 H ALA 36 HN ALA 36 37.490 20.471 -13.724 269 HA ALA 36 HA ALA 36 38.252 23.181 -13.984 270 HB1 ALA 36 HB1 ALA 36 37.706 23.398 -11.706 271 HB2 ALA 36 HB2 ALA 36 38.136 21.725 -11.352 272 HB3 ALA 36 HB3 ALA 36 36.670 22.085 -12.264 273 H ILE 37 HN ILE 37 40.057 20.318 -13.260 274 HA ILE 37 HA ILE 37 42.212 21.494 -11.842 275 HB ILE 37 HB ILE 37 41.825 18.932 -13.345 276 HG12 ILE 37 HG12 ILE 37 42.701 19.507 -10.499 277 HG13 ILE 37 HG11 ILE 37 41.010 19.359 -10.972 278 HG21 ILE 37 HG21 ILE 37 44.183 18.360 -12.510 279 HG22 ILE 37 HG22 ILE 37 44.424 20.096 -12.321 280 HG23 ILE 37 HG23 ILE 37 44.091 19.420 -13.915 281 HD11 ILE 37 HD11 ILE 37 43.013 17.192 -11.621 282 HD12 ILE 37 HD12 ILE 37 41.253 17.081 -11.563 283 HD13 ILE 37 HD13 ILE 37 42.176 17.239 -10.070 284 H LEU 38 HN LEU 38 41.501 21.152 -15.272 285 HA LEU 38 HA LEU 38 44.164 21.965 -16.078 286 HB2 LEU 38 HB2 LEU 38 43.489 21.577 -18.270 287 HB3 LEU 38 HB1 LEU 38 42.505 20.429 -17.368 288 HG LEU 38 HG LEU 38 40.877 22.617 -17.322 289 HD11 LEU 38 HD11 LEU 38 42.227 24.020 -18.721 290 HD12 LEU 38 HD12 LEU 38 40.912 23.433 -19.738 291 HD13 LEU 38 HD13 LEU 38 42.516 22.709 -19.864 292 HD21 LEU 38 HD21 LEU 38 39.562 21.448 -18.952 293 HD22 LEU 38 HD22 LEU 38 40.438 20.215 -18.043 294 HD23 LEU 38 HD23 LEU 38 40.993 20.687 -19.650 295 H SER 39 HN SER 39 41.226 23.536 -15.216 296 HA SER 39 HA SER 39 41.681 25.959 -16.698 297 HB2 SER 39 HB2 SER 39 39.894 25.334 -14.339 298 HB3 SER 39 HB1 SER 39 39.908 26.877 -15.188 299 HG SER 39 HG SER 39 38.846 24.452 -15.918 300 H SER 40 HN SER 40 42.742 24.657 -13.661 301 HA SER 40 HA SER 40 43.689 27.267 -12.725 302 HB2 SER 40 HB2 SER 40 43.784 24.527 -11.443 303 HB3 SER 40 HB1 SER 40 44.357 26.014 -10.691 304 HG SER 40 HG SER 40 41.737 25.233 -11.379 305 H THR 41 HN THR 41 44.799 25.852 -15.114 306 HA THR 41 HA THR 41 47.268 24.661 -14.645 307 HB THR 41 HB THR 41 46.168 24.812 -16.865 308 HG1 THR 41 HG1 THR 41 48.731 26.012 -16.878 309 HG21 THR 41 HG21 THR 41 46.276 26.858 -18.148 310 HG22 THR 41 HG22 THR 41 47.198 27.660 -16.876 311 HG23 THR 41 HG23 THR 41 45.510 27.226 -16.602 312 H ASN 42 HN ASN 42 46.312 27.951 -14.198 313 HA ASN 42 HA ASN 42 49.029 28.987 -14.269 314 HB2 ASN 42 HB2 ASN 42 48.029 31.127 -13.787 315 HB3 ASN 42 HB1 ASN 42 47.058 30.329 -15.023 316 HD21 ASN 42 HD21 ASN 42 45.835 32.326 -13.484 317 HD22 ASN 42 HD22 ASN 42 44.722 31.620 -12.414 318 H VAL 43 HN VAL 43 47.852 26.949 -12.189 319 HA VAL 43 HA VAL 43 48.303 28.412 -9.708 320 HB VAL 43 HB VAL 43 46.511 26.602 -10.085 321 HG11 VAL 43 HG11 VAL 43 48.825 24.752 -9.477 322 HG12 VAL 43 HG12 VAL 43 48.248 25.026 -11.120 323 HG13 VAL 43 HG13 VAL 43 47.173 24.321 -9.914 324 HG21 VAL 43 HG21 VAL 43 48.342 26.123 -7.722 325 HG22 VAL 43 HG22 VAL 43 46.585 25.993 -7.781 326 HG23 VAL 43 HG23 VAL 43 47.354 27.577 -7.862 327 H GLY 44 HN GLY 44 50.449 27.702 -11.823 328 HA2 GLY 44 HA2 GLY 44 52.781 27.653 -11.321 329 HA3 GLY 44 HA1 GLY 44 52.417 26.748 -9.856 330 H SER 45 HN SER 45 50.476 25.154 -11.742 331 HA SER 45 HA SER 45 52.479 23.139 -12.433 332 HB2 SER 45 HB2 SER 45 50.511 21.678 -12.796 333 HB3 SER 45 HB1 SER 45 50.520 22.394 -11.187 334 HG SER 45 HG SER 45 48.786 22.754 -13.290 335 H ASN 46 HN ASN 46 52.346 25.562 -14.017 336 HA ASN 46 HA ASN 46 51.080 24.762 -16.524 337 HB2 ASN 46 HB2 ASN 46 51.727 26.967 -17.322 338 HB3 ASN 46 HB1 ASN 46 50.950 27.114 -15.747 339 HD21 ASN 46 HD21 ASN 46 52.537 29.238 -16.389 340 HD22 ASN 46 HD22 ASN 46 54.012 29.180 -15.551 341 H THR 47 HN THR 47 53.508 23.385 -15.304 342 HA THR 47 HA THR 47 55.562 23.938 -17.313 343 HB THR 47 HB THR 47 56.175 21.688 -15.634 344 HG1 THR 47 HG1 THR 47 55.443 24.065 -14.276 345 HG21 THR 47 HG21 THR 47 57.711 23.346 -16.781 346 HG22 THR 47 HG22 THR 47 58.093 23.026 -15.090 347 HG23 THR 47 HG23 THR 47 57.256 24.512 -15.539 348 H TYR 48 HN TYR 48 52.913 22.680 -17.948 349 HA TYR 48 HA TYR 48 53.989 20.260 -19.256 350 HB2 TYR 48 HB2 TYR 48 52.051 19.005 -18.759 351 HB3 TYR 48 HB1 TYR 48 52.459 19.806 -17.242 352 HD1 TYR 48 HD1 TYR 48 49.870 19.191 -19.577 353 HD2 TYR 48 HD2 TYR 48 51.375 22.196 -16.902 354 HE1 TYR 48 HE1 TYR 48 47.644 20.284 -19.552 355 HE2 TYR 48 HE2 TYR 48 49.149 23.289 -16.876 356 HH TYR 48 HH TYR 48 46.609 22.293 -17.345 357 H GLY 49 HN GLY 49 53.477 23.111 -20.101 358 HA2 GLY 49 HA2 GLY 49 51.221 23.311 -21.751 359 HA3 GLY 49 HA1 GLY 49 52.723 24.199 -21.982 360 H LYS 50 HN LYS 50 50.819 22.810 -23.876 361 HA LYS 50 HA LYS 50 52.101 20.533 -24.976 362 HB2 LYS 50 HB2 LYS 50 50.166 22.535 -26.153 363 HB3 LYS 50 HB1 LYS 50 50.717 21.096 -27.013 364 HG2 LYS 50 HG2 LYS 50 49.921 19.721 -25.052 365 HG3 LYS 50 HG1 LYS 50 49.198 21.188 -24.394 366 HD2 LYS 50 HD2 LYS 50 48.584 20.134 -27.166 367 HD3 LYS 50 HD1 LYS 50 47.613 19.747 -25.745 368 HE2 LYS 50 HE2 LYS 50 48.168 22.539 -26.793 369 HE3 LYS 50 HE1 LYS 50 46.650 21.660 -26.968 370 HZ1 LYS 50 HZ1 LYS 50 46.678 21.493 -24.462 371 HZ2 LYS 50 HZ2 LYS 50 46.369 23.032 -25.112 372 HZ3 LYS 50 HZ3 LYS 50 47.904 22.664 -24.484 373 H ARG 51 HN ARG 51 52.499 23.981 -25.443 374 HA ARG 51 HA ARG 51 53.840 24.147 -27.837 375 HB2 ARG 51 HB2 ARG 51 54.896 26.148 -27.004 376 HB3 ARG 51 HB1 ARG 51 53.265 26.069 -26.338 377 HG2 ARG 51 HG2 ARG 51 54.202 25.064 -24.255 378 HG3 ARG 51 HG1 ARG 51 55.824 25.270 -24.919 379 HD2 ARG 51 HD2 ARG 51 55.417 27.709 -25.109 380 HD3 ARG 51 HD1 ARG 51 53.827 27.487 -24.386 381 HE ARG 51 HE ARG 51 56.375 27.457 -23.010 382 HH11 ARG 51 HH11 ARG 51 53.035 26.449 -22.952 383 HH12 ARG 51 HH12 ARG 51 52.987 26.306 -21.229 384 HH21 ARG 51 HH21 ARG 51 56.279 27.264 -20.762 385 HH22 ARG 51 HH22 ARG 51 54.809 26.762 -19.995 386 H ASN 52 HN ASN 52 54.992 22.824 -24.813 387 HA ASN 52 HA ASN 52 57.762 22.789 -25.450 388 HB2 ASN 52 HB2 ASN 52 56.935 22.531 -23.151 389 HB3 ASN 52 HB1 ASN 52 56.184 20.997 -23.590 390 HD21 ASN 52 HD21 ASN 52 57.465 19.178 -23.245 391 HD22 ASN 52 HD22 ASN 52 59.156 19.195 -23.103 392 H ALA 53 HN ALA 53 55.139 20.449 -25.856 393 HA ALA 53 HA ALA 53 56.690 18.293 -26.796 394 HB1 ALA 53 HB1 ALA 53 54.620 17.339 -27.557 395 HB2 ALA 53 HB2 ALA 53 53.841 18.920 -27.588 396 HB3 ALA 53 HB3 ALA 53 54.288 18.187 -26.048 397 H VAL 54 HN VAL 54 54.983 20.874 -28.563 398 HA VAL 54 HA VAL 54 55.752 19.933 -31.144 399 HB VAL 54 HB VAL 54 53.896 21.689 -30.282 400 HG11 VAL 54 HG11 VAL 54 56.007 23.449 -31.547 401 HG12 VAL 54 HG12 VAL 54 55.810 23.325 -29.799 402 HG13 VAL 54 HG13 VAL 54 54.490 23.939 -30.792 403 HG21 VAL 54 HG21 VAL 54 53.515 22.182 -32.618 404 HG22 VAL 54 HG22 VAL 54 54.134 20.533 -32.517 405 HG23 VAL 54 HG23 VAL 54 55.201 21.847 -33.014 406 H GLU 55 HN GLU 55 57.357 21.786 -28.709 407 HA GLU 55 HA GLU 55 59.148 23.200 -30.428 408 HB2 GLU 55 HB2 GLU 55 58.589 23.740 -27.990 409 HB3 GLU 55 HB1 GLU 55 59.698 22.437 -27.560 410 HG2 GLU 55 HG2 GLU 55 60.544 24.621 -29.455 411 HG3 GLU 55 HG1 GLU 55 60.648 24.850 -27.711 412 H VAL 56 HN VAL 56 59.648 20.374 -28.291 413 HA VAL 56 HA VAL 56 62.224 19.759 -29.218 414 HB VAL 56 HB VAL 56 61.249 18.836 -27.140 415 HG11 VAL 56 HG11 VAL 56 59.622 17.131 -29.053 416 HG12 VAL 56 HG12 VAL 56 58.979 18.403 -28.014 417 HG13 VAL 56 HG13 VAL 56 59.672 16.947 -27.300 418 HG21 VAL 56 HG21 VAL 56 62.226 16.631 -27.353 419 HG22 VAL 56 HG22 VAL 56 63.170 17.737 -28.352 420 HG23 VAL 56 HG23 VAL 56 62.001 16.650 -29.102 421 H LEU 57 HN LEU 57 59.051 19.002 -30.479 422 HA LEU 57 HA LEU 57 59.545 16.868 -32.147 423 HB2 LEU 57 HB2 LEU 57 57.558 18.935 -31.954 424 HB3 LEU 57 HB1 LEU 57 57.953 18.661 -33.651 425 HG LEU 57 HG LEU 57 57.776 16.131 -33.025 426 HD11 LEU 57 HD11 LEU 57 57.606 16.684 -30.555 427 HD12 LEU 57 HD12 LEU 57 56.338 15.620 -31.166 428 HD13 LEU 57 HD13 LEU 57 55.998 17.328 -30.886 429 HD21 LEU 57 HD21 LEU 57 56.220 17.189 -34.550 430 HD22 LEU 57 HD22 LEU 57 55.393 17.998 -33.218 431 HD23 LEU 57 HD23 LEU 57 55.282 16.246 -33.393 432 H LYS 58 HN LYS 58 60.023 20.319 -32.830 433 HA LYS 58 HA LYS 58 61.034 20.087 -35.447 434 HB2 LYS 58 HB2 LYS 58 61.483 22.147 -33.285 435 HB3 LYS 58 HB1 LYS 58 62.121 22.313 -34.921 436 HG2 LYS 58 HG2 LYS 58 59.191 21.792 -34.384 437 HG3 LYS 58 HG1 LYS 58 59.855 23.424 -34.473 438 HD2 LYS 58 HD2 LYS 58 60.816 22.781 -36.740 439 HD3 LYS 58 HD1 LYS 58 59.835 21.319 -36.648 440 HE2 LYS 58 HE2 LYS 58 58.720 24.126 -36.403 441 HE3 LYS 58 HE1 LYS 58 58.716 23.186 -37.895 442 HZ1 LYS 58 HZ1 LYS 58 57.555 22.136 -35.388 443 HZ2 LYS 58 HZ2 LYS 58 57.289 21.604 -36.980 444 HZ3 LYS 58 HZ3 LYS 58 56.647 23.088 -36.458 445 H ARG 59 HN ARG 59 62.617 19.927 -32.294 446 HA ARG 59 HA ARG 59 65.288 19.923 -33.226 447 HB2 ARG 59 HB2 ARG 59 64.561 20.327 -30.859 448 HB3 ARG 59 HB1 ARG 59 64.235 18.599 -30.721 449 HG2 ARG 59 HG2 ARG 59 66.548 18.056 -31.157 450 HG3 ARG 59 HG1 ARG 59 66.919 19.735 -31.550 451 HD2 ARG 59 HD2 ARG 59 66.351 20.394 -29.236 452 HD3 ARG 59 HD1 ARG 59 66.007 18.712 -28.845 453 HE ARG 59 HE ARG 59 68.586 18.736 -29.857 454 HH11 ARG 59 HH11 ARG 59 66.861 20.227 -27.218 455 HH12 ARG 59 HH12 ARG 59 68.256 20.313 -26.199 456 HH21 ARG 59 HH21 ARG 59 70.392 18.861 -28.504 457 HH22 ARG 59 HH22 ARG 59 70.243 19.545 -26.920 458 H GLU 60 HN GLU 60 62.834 17.516 -33.335 459 HA GLU 60 HA GLU 60 64.864 15.458 -33.966 460 HB2 GLU 60 HB2 GLU 60 62.058 15.095 -32.888 461 HB3 GLU 60 HB1 GLU 60 63.169 13.791 -33.307 462 HG2 GLU 60 HG2 GLU 60 63.679 15.930 -31.219 463 HG3 GLU 60 HG1 GLU 60 63.222 14.261 -30.883 464 HA PRO 61 HA PRO 61 62.441 16.439 -37.823 465 HB2 PRO 61 HB2 PRO 61 64.643 16.363 -39.474 466 HB3 PRO 61 HB1 PRO 61 64.057 17.829 -38.666 467 HG2 PRO 61 HG2 PRO 61 66.305 16.029 -37.925 468 HG3 PRO 61 HG1 PRO 61 66.185 17.794 -37.818 469 HD2 PRO 61 HD2 PRO 61 65.894 16.163 -35.647 470 HD3 PRO 61 HD1 PRO 61 65.072 17.732 -35.790 471 H LEU 62 HN LEU 62 64.479 13.923 -36.702 472 HA LEU 62 HA LEU 62 64.547 12.161 -38.876 473 HB2 LEU 62 HB2 LEU 62 65.863 11.830 -36.823 474 HB3 LEU 62 HB1 LEU 62 64.382 11.516 -35.920 475 HG LEU 62 HG LEU 62 63.913 9.584 -37.431 476 HD11 LEU 62 HD11 LEU 62 65.084 10.204 -39.428 477 HD12 LEU 62 HD12 LEU 62 65.915 8.784 -38.793 478 HD13 LEU 62 HD13 LEU 62 66.605 10.389 -38.555 479 HD21 LEU 62 HD21 LEU 62 65.689 8.121 -36.510 480 HD22 LEU 62 HD22 LEU 62 65.073 9.232 -35.287 481 HD23 LEU 62 HD23 LEU 62 66.623 9.549 -36.065 482 H ASN 63 HN ASN 63 62.078 12.709 -36.407 483 HA ASN 63 HA ASN 63 60.380 10.586 -37.424 484 HB2 ASN 63 HB2 ASN 63 59.092 10.912 -35.554 485 HB3 ASN 63 HB1 ASN 63 60.611 11.587 -34.967 486 HD21 ASN 63 HD21 ASN 63 57.301 12.320 -35.634 487 HD22 ASN 63 HD22 ASN 63 57.396 13.993 -35.364 488 H TYR 64 HN TYR 64 60.901 13.924 -38.069 489 HA TYR 64 HA TYR 64 58.264 14.533 -39.012 490 HB2 TYR 64 HB2 TYR 64 59.937 16.238 -38.231 491 HB3 TYR 64 HB1 TYR 64 60.855 15.931 -39.706 492 HD1 TYR 64 HD1 TYR 64 57.657 17.213 -38.348 493 HD2 TYR 64 HD2 TYR 64 60.088 16.715 -41.855 494 HE1 TYR 64 HE1 TYR 64 56.174 18.761 -39.596 495 HE2 TYR 64 HE2 TYR 64 58.605 18.263 -43.102 496 HH TYR 64 HH TYR 64 55.834 18.945 -42.613 497 H LEU 65 HN LEU 65 61.197 13.231 -40.414 498 HA LEU 65 HA LEU 65 59.914 13.193 -43.070 499 HB2 LEU 65 HB2 LEU 65 62.826 12.870 -42.304 500 HB3 LEU 65 HB1 LEU 65 62.198 12.807 -43.950 501 HG LEU 65 HG LEU 65 61.824 15.179 -42.102 502 HD11 LEU 65 HD11 LEU 65 63.629 16.257 -43.280 503 HD12 LEU 65 HD12 LEU 65 63.773 14.908 -44.407 504 HD13 LEU 65 HD13 LEU 65 64.234 14.698 -42.717 505 HD21 LEU 65 HD21 LEU 65 61.369 16.280 -44.367 506 HD22 LEU 65 HD22 LEU 65 60.142 15.145 -43.808 507 HD23 LEU 65 HD23 LEU 65 61.303 14.651 -45.040 508 HA PRO 66 HA PRO 66 59.347 8.825 -43.093 509 HB2 PRO 66 HB2 PRO 66 60.996 8.637 -45.566 510 HB3 PRO 66 HB1 PRO 66 59.327 8.109 -45.279 511 HG2 PRO 66 HG2 PRO 66 59.877 10.279 -46.723 512 HG3 PRO 66 HG1 PRO 66 58.458 10.195 -45.665 513 HD2 PRO 66 HD2 PRO 66 61.028 11.665 -45.254 514 HD3 PRO 66 HD1 PRO 66 59.382 12.097 -44.741 515 H LEU 67 HN LEU 67 60.355 6.992 -42.326 516 HA LEU 67 HA LEU 67 63.249 7.213 -41.823 517 HB2 LEU 67 HB2 LEU 67 61.172 6.609 -40.116 518 HB3 LEU 67 HB1 LEU 67 61.816 5.017 -40.518 519 HG LEU 67 HG LEU 67 63.660 7.277 -39.760 520 HD11 LEU 67 HD11 LEU 67 62.122 5.412 -37.937 521 HD12 LEU 67 HD12 LEU 67 62.166 7.174 -37.888 522 HD13 LEU 67 HD13 LEU 67 63.593 6.244 -37.433 523 HD21 LEU 67 HD21 LEU 67 64.752 5.359 -40.712 524 HD22 LEU 67 HD22 LEU 67 63.784 4.249 -39.742 525 HD23 LEU 67 HD23 LEU 67 65.003 5.262 -38.969 Start of MODEL 16 1 H1 THR 1 HT1 THR 1 -2.842 -5.596 -0.851 2 H2 THR 1 HT2 THR 1 -2.882 -3.924 -0.556 3 H3 THR 1 HT3 THR 1 -3.680 -4.994 0.495 4 HA THR 1 HA THR 1 -1.742 -5.767 1.437 5 HB THR 1 HB THR 1 -0.805 -5.581 -1.191 6 HG1 THR 1 HG1 THR 1 0.062 -7.212 -0.220 7 HG21 THR 1 HG21 THR 1 1.293 -4.371 -1.061 8 HG22 THR 1 HG22 THR 1 0.998 -3.953 0.624 9 HG23 THR 1 HG23 THR 1 -0.015 -3.264 -0.647 10 HA PRO 2 HA PRO 2 -1.167 -1.915 3.506 11 HB2 PRO 2 HB2 PRO 2 1.143 -2.314 4.894 12 HB3 PRO 2 HB1 PRO 2 -0.379 -3.130 5.301 13 HG2 PRO 2 HG2 PRO 2 1.989 -4.163 3.830 14 HG3 PRO 2 HG1 PRO 2 0.935 -4.981 4.995 15 HD2 PRO 2 HD2 PRO 2 0.744 -5.307 2.262 16 HD3 PRO 2 HD1 PRO 2 -0.607 -5.564 3.387 17 H ILE 3 HN ILE 3 0.004 0.068 3.532 18 HA ILE 3 HA ILE 3 1.244 0.848 1.179 19 HB ILE 3 HB ILE 3 0.306 2.332 3.019 20 HG12 ILE 3 HG12 ILE 3 2.226 4.061 2.650 21 HG13 ILE 3 HG11 ILE 3 2.930 2.817 1.617 22 HG21 ILE 3 HG21 ILE 3 1.710 1.199 4.809 23 HG22 ILE 3 HG22 ILE 3 1.751 2.962 4.831 24 HG23 ILE 3 HG23 ILE 3 3.102 2.056 4.148 25 HD11 ILE 3 HD11 ILE 3 0.169 4.035 1.324 26 HD12 ILE 3 HD12 ILE 3 0.797 2.719 0.333 27 HD13 ILE 3 HD13 ILE 3 1.550 4.313 0.263 28 H GLU 4 HN GLU 4 3.326 0.969 0.448 29 HA GLU 4 HA GLU 4 5.206 -0.918 1.305 30 HB2 GLU 4 HB2 GLU 4 6.774 0.206 -0.184 31 HB3 GLU 4 HB1 GLU 4 5.186 0.126 -0.947 32 HG2 GLU 4 HG2 GLU 4 4.723 2.441 -0.176 33 HG3 GLU 4 HG1 GLU 4 6.343 2.518 0.514 34 H SER 5 HN SER 5 7.498 -0.327 1.979 35 HA SER 5 HA SER 5 7.440 0.831 4.554 36 HB2 SER 5 HB2 SER 5 9.788 0.228 2.743 37 HB3 SER 5 HB1 SER 5 9.913 0.638 4.451 38 HG SER 5 HG SER 5 9.301 -1.718 3.280 39 H HIS 6 HN HIS 6 8.087 2.806 5.324 40 HA HIS 6 HA HIS 6 8.389 4.930 3.298 41 HB2 HIS 6 HB2 HIS 6 7.685 6.465 5.103 42 HB3 HIS 6 HB1 HIS 6 6.484 5.206 4.812 43 HD1 HIS 6 HD1 HIS 6 9.210 6.174 7.251 44 HD2 HIS 6 HD2 HIS 6 6.050 3.468 6.978 45 HE1 HIS 6 HE1 HIS 6 8.974 5.115 9.540 46 HE2 HIS 6 HE2 HIS 6 7.051 3.463 9.390 47 H GLN 7 HN GLN 7 10.555 3.156 4.241 48 HA GLN 7 HA GLN 7 12.230 4.387 6.117 49 HB2 GLN 7 HB2 GLN 7 12.505 2.087 5.097 50 HB3 GLN 7 HB1 GLN 7 13.169 2.883 3.670 51 HG2 GLN 7 HG2 GLN 7 14.916 3.930 5.054 52 HG3 GLN 7 HG1 GLN 7 14.248 3.156 6.491 53 HE21 GLN 7 HE21 GLN 7 15.266 1.228 7.033 54 HE22 GLN 7 HE22 GLN 7 16.073 0.211 5.939 55 H VAL 8 HN VAL 8 13.654 6.044 6.038 56 HA VAL 8 HA VAL 8 14.152 7.341 3.435 57 HB VAL 8 HB VAL 8 12.360 8.584 4.585 58 HG11 VAL 8 HG11 VAL 8 12.962 7.952 6.895 59 HG12 VAL 8 HG12 VAL 8 12.860 9.705 6.727 60 HG13 VAL 8 HG13 VAL 8 14.435 8.913 6.774 61 HG21 VAL 8 HG21 VAL 8 14.057 9.778 3.204 62 HG22 VAL 8 HG22 VAL 8 15.031 10.026 4.653 63 HG23 VAL 8 HG23 VAL 8 13.444 10.783 4.518 64 H GLU 9 HN GLU 9 16.139 8.398 3.252 65 HA GLU 9 HA GLU 9 18.000 8.063 5.521 66 HB2 GLU 9 HB2 GLU 9 19.719 7.708 3.533 67 HB3 GLU 9 HB1 GLU 9 18.805 6.356 4.200 68 HG2 GLU 9 HG2 GLU 9 18.765 6.440 1.696 69 HG3 GLU 9 HG1 GLU 9 17.161 6.516 2.420 70 H LYS 10 HN LYS 10 20.095 9.341 5.044 71 HA LYS 10 HA LYS 10 19.520 11.843 3.604 72 HB2 LYS 10 HB2 LYS 10 20.578 13.066 5.581 73 HB3 LYS 10 HB1 LYS 10 18.942 12.454 5.826 74 HG2 LYS 10 HG2 LYS 10 21.021 10.490 6.488 75 HG3 LYS 10 HG1 LYS 10 21.094 11.944 7.483 76 HD2 LYS 10 HD2 LYS 10 19.068 11.536 8.475 77 HD3 LYS 10 HD1 LYS 10 18.390 10.800 7.022 78 HE2 LYS 10 HE2 LYS 10 19.659 8.756 7.411 79 HE3 LYS 10 HE1 LYS 10 20.469 9.488 8.796 80 HZ1 LYS 10 HZ1 LYS 10 18.764 8.294 9.760 81 HZ2 LYS 10 HZ2 LYS 10 17.656 8.655 8.523 82 HZ3 LYS 10 HZ3 LYS 10 18.090 9.847 9.654 83 H ARG 11 HN ARG 11 21.494 13.172 3.311 84 HA ARG 11 HA ARG 11 23.983 11.619 3.440 85 HB2 ARG 11 HB2 ARG 11 24.433 12.758 1.079 86 HB3 ARG 11 HB1 ARG 11 23.648 11.192 1.212 87 HG2 ARG 11 HG2 ARG 11 22.312 12.417 -0.313 88 HG3 ARG 11 HG1 ARG 11 21.412 12.496 1.191 89 HD2 ARG 11 HD2 ARG 11 23.409 14.643 0.538 90 HD3 ARG 11 HD1 ARG 11 21.820 14.679 -0.214 91 HE ARG 11 HE ARG 11 22.426 15.223 2.562 92 HH11 ARG 11 HH11 ARG 11 19.995 14.221 0.269 93 HH12 ARG 11 HH12 ARG 11 18.677 14.728 1.266 94 HH21 ARG 11 HH21 ARG 11 20.683 15.876 3.842 95 HH22 ARG 11 HH22 ARG 11 19.061 15.659 3.276 96 H LYS 12 HN LYS 12 23.862 13.286 5.312 97 HA LYS 12 HA LYS 12 24.250 16.030 4.830 98 HB2 LYS 12 HB2 LYS 12 25.097 16.139 7.101 99 HB3 LYS 12 HB1 LYS 12 23.726 15.030 7.053 100 HG2 LYS 12 HG2 LYS 12 25.351 13.129 6.821 101 HG3 LYS 12 HG1 LYS 12 26.663 14.283 7.066 102 HD2 LYS 12 HD2 LYS 12 25.721 14.900 9.259 103 HD3 LYS 12 HD1 LYS 12 24.400 13.756 9.017 104 HE2 LYS 12 HE2 LYS 12 26.025 12.628 10.371 105 HE3 LYS 12 HE1 LYS 12 26.170 11.948 8.751 106 HZ1 LYS 12 HZ1 LYS 12 28.336 12.408 9.137 107 HZ2 LYS 12 HZ2 LYS 12 28.006 13.677 10.217 108 HZ3 LYS 12 HZ3 LYS 12 27.887 13.931 8.542 109 H CYS 13 HN CYS 13 26.149 17.293 4.822 110 HA CYS 13 HA CYS 13 28.248 16.329 3.213 111 HB2 CYS 13 HB2 CYS 13 27.592 18.811 4.625 112 HB3 CYS 13 HB1 CYS 13 29.325 18.511 4.500 113 H ASN 14 HN ASN 14 29.082 14.428 4.155 114 HA ASN 14 HA ASN 14 30.808 14.912 6.508 115 HB2 ASN 14 HB2 ASN 14 28.720 13.416 6.856 116 HB3 ASN 14 HB1 ASN 14 29.605 12.221 5.909 117 HD21 ASN 14 HD21 ASN 14 30.081 10.767 7.651 118 HD22 ASN 14 HD22 ASN 14 31.080 11.199 8.954 119 H THR 15 HN THR 15 31.396 15.100 3.626 120 HA THR 15 HA THR 15 33.548 13.083 3.548 121 HB THR 15 HB THR 15 31.634 12.469 2.019 122 HG1 THR 15 HG1 THR 15 34.012 13.174 0.658 123 HG21 THR 15 HG21 THR 15 32.583 14.819 0.378 124 HG22 THR 15 HG22 THR 15 31.180 14.919 1.440 125 HG23 THR 15 HG23 THR 15 31.184 13.788 0.087 126 H ALA 16 HN ALA 16 35.389 13.706 2.259 127 HA ALA 16 HA ALA 16 36.240 16.344 2.719 128 HB1 ALA 16 HB1 ALA 16 37.273 14.073 1.054 129 HB2 ALA 16 HB2 ALA 16 37.982 14.817 2.487 130 HB3 ALA 16 HB3 ALA 16 38.029 15.662 0.940 131 H THR 17 HN THR 17 34.856 14.813 -0.154 132 HA THR 17 HA THR 17 35.338 16.734 -2.077 133 HB THR 17 HB THR 17 32.782 15.158 -1.683 134 HG1 THR 17 HG1 THR 17 33.866 13.792 -3.233 135 HG21 THR 17 HG21 THR 17 32.664 15.444 -4.198 136 HG22 THR 17 HG22 THR 17 33.948 16.644 -4.047 137 HG23 THR 17 HG23 THR 17 32.388 16.918 -3.269 138 H CYS 18 HN CYS 18 32.870 16.734 0.456 139 HA CYS 18 HA CYS 18 31.432 18.998 -0.419 140 HB2 CYS 18 HB2 CYS 18 30.605 17.420 1.301 141 HB3 CYS 18 HB1 CYS 18 31.833 18.019 2.417 142 H ALA 19 HN ALA 19 34.302 18.649 1.613 143 HA ALA 19 HA ALA 19 34.537 21.176 2.690 144 HB1 ALA 19 HB1 ALA 19 36.104 19.062 2.814 145 HB2 ALA 19 HB2 ALA 19 36.764 20.676 3.080 146 HB3 ALA 19 HB3 ALA 19 36.969 19.886 1.517 147 H THR 20 HN THR 20 35.595 20.103 -0.540 148 HA THR 20 HA THR 20 36.697 22.558 -1.361 149 HB THR 20 HB THR 20 35.367 20.411 -3.037 150 HG1 THR 20 HG1 THR 20 37.134 19.365 -2.689 151 HG21 THR 20 HG21 THR 20 37.169 22.739 -3.738 152 HG22 THR 20 HG22 THR 20 35.544 22.418 -4.344 153 HG23 THR 20 HG23 THR 20 36.884 21.376 -4.821 154 H GLN 21 HN GLN 21 33.396 21.305 -1.494 155 HA GLN 21 HA GLN 21 32.247 23.302 -3.084 156 HB2 GLN 21 HB2 GLN 21 30.355 22.158 -2.686 157 HB3 GLN 21 HB1 GLN 21 31.335 21.064 -1.714 158 HG2 GLN 21 HG2 GLN 21 30.922 22.575 0.266 159 HG3 GLN 21 HG1 GLN 21 29.791 23.484 -0.737 160 HE21 GLN 21 HE21 GLN 21 28.019 22.801 0.728 161 HE22 GLN 21 HE22 GLN 21 27.392 21.227 0.624 162 H ARG 22 HN ARG 22 33.234 23.344 0.272 163 HA ARG 22 HA ARG 22 31.720 25.668 0.982 164 HB2 ARG 22 HB2 ARG 22 32.588 25.416 3.077 165 HB3 ARG 22 HB1 ARG 22 32.929 23.803 2.468 166 HG2 ARG 22 HG2 ARG 22 35.008 24.338 3.304 167 HG3 ARG 22 HG1 ARG 22 35.203 24.977 1.679 168 HD2 ARG 22 HD2 ARG 22 35.606 26.999 2.582 169 HD3 ARG 22 HD1 ARG 22 33.946 27.021 3.169 170 HE ARG 22 HE ARG 22 34.749 26.558 5.294 171 HH11 ARG 22 HH11 ARG 22 37.196 25.853 2.911 172 HH12 ARG 22 HH12 ARG 22 38.426 25.557 4.089 173 HH21 ARG 22 HH21 ARG 22 36.376 26.167 6.811 174 HH22 ARG 22 HH22 ARG 22 37.968 25.732 6.284 175 H LEU 23 HN LEU 23 34.740 25.109 -0.615 176 HA LEU 23 HA LEU 23 35.944 27.643 -0.151 177 HB2 LEU 23 HB2 LEU 23 37.207 25.692 -0.982 178 HB3 LEU 23 HB1 LEU 23 36.290 25.742 -2.486 179 HG LEU 23 HG LEU 23 37.133 28.066 -2.872 180 HD11 LEU 23 HD11 LEU 23 37.621 28.809 -0.649 181 HD12 LEU 23 HD12 LEU 23 39.176 28.691 -1.473 182 HD13 LEU 23 HD13 LEU 23 38.676 27.428 -0.347 183 HD21 LEU 23 HD21 LEU 23 39.525 27.350 -3.317 184 HD22 LEU 23 HD22 LEU 23 38.298 26.267 -3.973 185 HD23 LEU 23 HD23 LEU 23 39.151 25.837 -2.490 186 H ALA 24 HN ALA 24 33.743 26.392 -2.605 187 HA ALA 24 HA ALA 24 33.775 28.634 -4.331 188 HB1 ALA 24 HB1 ALA 24 31.841 27.689 -5.345 189 HB2 ALA 24 HB2 ALA 24 31.403 26.823 -3.872 190 HB3 ALA 24 HB3 ALA 24 32.813 26.320 -4.805 191 H ASN 25 HN ASN 25 31.981 27.881 -1.406 192 HA ASN 25 HA ASN 25 30.057 29.952 -1.568 193 HB2 ASN 25 HB2 ASN 25 31.232 28.431 0.761 194 HB3 ASN 25 HB1 ASN 25 29.948 29.624 0.946 195 HD21 ASN 25 HD21 ASN 25 29.605 26.793 1.524 196 HD22 ASN 25 HD22 ASN 25 28.462 26.188 0.423 197 H PHE 26 HN PHE 26 33.378 29.841 -0.449 198 HA PHE 26 HA PHE 26 33.420 32.263 0.997 199 HB2 PHE 26 HB2 PHE 26 35.208 30.569 1.130 200 HB3 PHE 26 HB1 PHE 26 35.674 30.939 -0.530 201 HD1 PHE 26 HD1 PHE 26 35.302 32.422 2.870 202 HD2 PHE 26 HD2 PHE 26 37.062 32.798 -1.030 203 HE1 PHE 26 HE1 PHE 26 36.696 34.306 3.681 204 HE2 PHE 26 HE2 PHE 26 38.455 34.682 -0.220 205 HZ PHE 26 HZ PHE 26 38.272 35.436 2.136 206 H LEU 27 HN LEU 27 33.945 31.559 -2.440 207 HA LEU 27 HA LEU 27 34.864 34.094 -3.204 208 HB2 LEU 27 HB2 LEU 27 34.993 32.096 -4.653 209 HB3 LEU 27 HB1 LEU 27 33.242 32.072 -4.788 210 HG LEU 27 HG LEU 27 34.655 33.110 -6.716 211 HD11 LEU 27 HD11 LEU 27 32.447 34.919 -5.761 212 HD12 LEU 27 HD12 LEU 27 32.096 33.257 -6.234 213 HD13 LEU 27 HD13 LEU 27 32.815 34.370 -7.395 214 HD21 LEU 27 HD21 LEU 27 35.884 34.610 -4.979 215 HD22 LEU 27 HD22 LEU 27 34.444 35.622 -5.062 216 HD23 LEU 27 HD23 LEU 27 35.398 35.327 -6.514 217 H VAL 28 HN VAL 28 31.558 32.772 -3.122 218 HA VAL 28 HA VAL 28 30.347 35.254 -3.943 219 HB VAL 28 HB VAL 28 28.226 34.144 -3.385 220 HG11 VAL 28 HG11 VAL 28 29.525 33.671 -5.527 221 HG12 VAL 28 HG12 VAL 28 28.350 32.441 -5.061 222 HG13 VAL 28 HG13 VAL 28 30.068 32.178 -4.762 223 HG21 VAL 28 HG21 VAL 28 29.982 31.866 -2.421 224 HG22 VAL 28 HG22 VAL 28 28.220 31.876 -2.475 225 HG23 VAL 28 HG23 VAL 28 29.074 32.946 -1.363 226 H HIS 29 HN HIS 29 31.266 33.799 -0.914 227 HA HIS 29 HA HIS 29 29.638 35.436 0.763 228 HB2 HIS 29 HB2 HIS 29 30.604 33.297 1.525 229 HB3 HIS 29 HB1 HIS 29 32.220 33.994 1.407 230 HD1 HIS 29 HD1 HIS 29 28.924 34.685 3.198 231 HD2 HIS 29 HD2 HIS 29 33.013 35.321 3.704 232 HE1 HIS 29 HE1 HIS 29 29.209 35.720 5.492 233 HE2 HIS 29 HE2 HIS 29 31.697 36.114 5.815 234 H SER 30 HN SER 30 32.788 35.791 -0.699 235 HA SER 30 HA SER 30 33.006 38.452 0.566 236 HB2 SER 30 HB2 SER 30 35.189 36.513 -0.201 237 HB3 SER 30 HB1 SER 30 35.506 38.209 0.155 238 HG SER 30 HG SER 30 35.125 37.849 2.207 239 H SER 31 HN SER 31 31.818 37.430 -2.077 240 HA SER 31 HA SER 31 33.391 38.305 -4.231 241 HB2 SER 31 HB2 SER 31 31.388 36.961 -4.567 242 HB3 SER 31 HB1 SER 31 30.380 38.261 -3.940 243 HG SER 31 HG SER 31 30.467 38.267 -6.226 244 H ASN 32 HN ASN 32 31.050 40.067 -2.215 245 HA ASN 32 HA ASN 32 31.175 42.491 -3.686 246 HB2 ASN 32 HB2 ASN 32 30.207 43.482 -1.586 247 HB3 ASN 32 HB1 ASN 32 29.306 42.114 -2.235 248 HD21 ASN 32 HD21 ASN 32 30.507 43.339 0.635 249 HD22 ASN 32 HD22 ASN 32 30.635 41.891 1.511 250 H ASN 33 HN ASN 33 32.938 41.269 -0.878 251 HA ASN 33 HA ASN 33 34.351 43.698 -0.391 252 HB2 ASN 33 HB2 ASN 33 34.843 40.842 0.464 253 HB3 ASN 33 HB1 ASN 33 35.890 42.174 0.951 254 HD21 ASN 33 HD21 ASN 33 34.595 44.120 1.961 255 HD22 ASN 33 HD22 ASN 33 33.322 43.701 3.003 256 H PHE 34 HN PHE 34 34.886 40.883 -2.375 257 HA PHE 34 HA PHE 34 37.565 40.998 -2.964 258 HB2 PHE 34 HB2 PHE 34 36.035 39.291 -3.872 259 HB3 PHE 34 HB1 PHE 34 35.326 40.502 -4.941 260 HD1 PHE 34 HD1 PHE 34 38.577 38.885 -4.046 261 HD2 PHE 34 HD2 PHE 34 36.300 40.964 -7.037 262 HE1 PHE 34 HE1 PHE 34 40.378 38.477 -5.701 263 HE2 PHE 34 HE2 PHE 34 38.101 40.556 -8.692 264 HZ PHE 34 HZ PHE 34 40.140 39.313 -8.024 265 H GLY 35 HN GLY 35 34.957 42.920 -4.420 266 HA2 GLY 35 HA2 GLY 35 36.576 44.355 -6.259 267 HA3 GLY 35 HA1 GLY 35 34.990 44.853 -5.664 268 H ALA 36 HN ALA 36 35.434 45.149 -2.970 269 HA ALA 36 HA ALA 36 36.577 47.701 -2.830 270 HB1 ALA 36 HB1 ALA 36 36.617 47.115 -0.271 271 HB2 ALA 36 HB2 ALA 36 35.743 45.673 -0.786 272 HB3 ALA 36 HB3 ALA 36 35.074 47.272 -1.109 273 H ILE 37 HN ILE 37 37.968 44.516 -2.284 274 HA ILE 37 HA ILE 37 40.338 45.285 -0.988 275 HB ILE 37 HB ILE 37 39.708 42.968 -2.818 276 HG12 ILE 37 HG12 ILE 37 40.291 43.083 0.158 277 HG13 ILE 37 HG11 ILE 37 38.662 43.152 -0.512 278 HG21 ILE 37 HG21 ILE 37 41.885 42.026 -1.876 279 HG22 ILE 37 HG22 ILE 37 42.265 43.666 -1.353 280 HG23 ILE 37 HG23 ILE 37 42.068 43.311 -3.069 281 HD11 ILE 37 HD11 ILE 37 39.000 40.859 -0.005 282 HD12 ILE 37 HD12 ILE 37 40.642 40.876 -0.649 283 HD13 ILE 37 HD13 ILE 37 39.265 40.969 -1.745 284 H LEU 38 HN LEU 38 39.481 45.116 -4.409 285 HA LEU 38 HA LEU 38 41.997 45.570 -5.545 286 HB2 LEU 38 HB2 LEU 38 40.011 44.924 -6.852 287 HB3 LEU 38 HB1 LEU 38 39.291 46.502 -6.537 288 HG LEU 38 HG LEU 38 41.242 47.579 -7.665 289 HD11 LEU 38 HD11 LEU 38 42.968 45.944 -7.371 290 HD12 LEU 38 HD12 LEU 38 42.643 46.004 -9.103 291 HD13 LEU 38 HD13 LEU 38 41.995 44.684 -8.130 292 HD21 LEU 38 HD21 LEU 38 39.096 46.908 -8.858 293 HD22 LEU 38 HD22 LEU 38 39.958 45.480 -9.432 294 HD23 LEU 38 HD23 LEU 38 40.508 47.089 -9.899 295 H SER 39 HN SER 39 39.643 47.820 -4.184 296 HA SER 39 HA SER 39 40.801 50.220 -5.100 297 HB2 SER 39 HB2 SER 39 38.569 50.139 -4.089 298 HB3 SER 39 HB1 SER 39 39.273 49.680 -2.542 299 HG SER 39 HG SER 39 39.180 52.130 -3.817 300 H SER 40 HN SER 40 41.394 48.280 -2.191 301 HA SER 40 HA SER 40 43.566 50.085 -1.396 302 HB2 SER 40 HB2 SER 40 42.349 47.684 -0.014 303 HB3 SER 40 HB1 SER 40 43.647 48.673 0.647 304 HG SER 40 HG SER 40 42.177 50.480 0.388 305 H THR 41 HN THR 41 43.646 48.239 -3.773 306 HA THR 41 HA THR 41 45.364 46.057 -3.218 307 HB THR 41 HB THR 41 44.011 46.386 -5.318 308 HG1 THR 41 HG1 THR 41 45.834 44.935 -5.106 309 HG21 THR 41 HG21 THR 41 44.864 47.821 -7.054 310 HG22 THR 41 HG22 THR 41 46.299 48.205 -6.104 311 HG23 THR 41 HG23 THR 41 44.719 48.796 -5.591 312 H ASN 42 HN ASN 42 45.935 49.455 -3.453 313 HA ASN 42 HA ASN 42 48.789 49.141 -3.962 314 HB2 ASN 42 HB2 ASN 42 48.866 51.545 -4.013 315 HB3 ASN 42 HB1 ASN 42 47.456 51.029 -4.936 316 HD21 ASN 42 HD21 ASN 42 47.503 53.641 -3.871 317 HD22 ASN 42 HD22 ASN 42 46.379 53.747 -2.604 318 H VAL 43 HN VAL 43 47.330 48.202 -1.424 319 HA VAL 43 HA VAL 43 48.551 49.854 0.636 320 HB VAL 43 HB VAL 43 46.255 48.621 0.722 321 HG11 VAL 43 HG11 VAL 43 47.997 46.407 1.818 322 HG12 VAL 43 HG12 VAL 43 47.434 46.401 0.147 323 HG13 VAL 43 HG13 VAL 43 46.269 46.373 1.469 324 HG21 VAL 43 HG21 VAL 43 48.311 48.678 2.942 325 HG22 VAL 43 HG22 VAL 43 46.625 48.246 3.224 326 HG23 VAL 43 HG23 VAL 43 47.035 49.850 2.618 327 H GLY 44 HN GLY 44 50.029 47.994 -1.417 328 HA2 GLY 44 HA2 GLY 44 52.310 47.332 -1.029 329 HA3 GLY 44 HA1 GLY 44 51.853 46.861 0.605 330 H SER 45 HN SER 45 49.312 45.678 -0.790 331 HA SER 45 HA SER 45 50.515 43.043 -1.203 332 HB2 SER 45 HB2 SER 45 48.252 42.190 -1.004 333 HB3 SER 45 HB1 SER 45 48.560 43.313 0.318 334 HG SER 45 HG SER 45 47.581 44.932 -1.124 335 H ASN 46 HN ASN 46 50.888 45.085 -3.227 336 HA ASN 46 HA ASN 46 49.153 44.206 -5.426 337 HB2 ASN 46 HB2 ASN 46 50.061 46.064 -6.669 338 HB3 ASN 46 HB1 ASN 46 49.607 46.643 -5.067 339 HD21 ASN 46 HD21 ASN 46 51.524 48.102 -6.509 340 HD22 ASN 46 HD22 ASN 46 53.049 47.896 -5.793 341 H THR 47 HN THR 47 51.343 42.558 -4.152 342 HA THR 47 HA THR 47 53.268 42.317 -6.344 343 HB THR 47 HB THR 47 53.537 40.301 -4.297 344 HG1 THR 47 HG1 THR 47 53.588 42.981 -3.394 345 HG21 THR 47 HG21 THR 47 55.401 40.978 -5.636 346 HG22 THR 47 HG22 THR 47 55.727 41.562 -4.004 347 HG23 THR 47 HG23 THR 47 55.149 42.678 -5.241 348 H TYR 48 HN TYR 48 50.395 41.603 -6.645 349 HA TYR 48 HA TYR 48 50.800 38.800 -7.488 350 HB2 TYR 48 HB2 TYR 48 48.606 38.197 -6.774 351 HB3 TYR 48 HB1 TYR 48 49.350 39.041 -5.416 352 HD1 TYR 48 HD1 TYR 48 46.569 38.960 -7.676 353 HD2 TYR 48 HD2 TYR 48 48.914 41.583 -5.211 354 HE1 TYR 48 HE1 TYR 48 44.734 40.628 -7.706 355 HE2 TYR 48 HE2 TYR 48 47.078 43.251 -5.241 356 HH TYR 48 HH TYR 48 44.935 43.588 -7.212 357 H GLY 49 HN GLY 49 50.885 41.518 -8.846 358 HA2 GLY 49 HA2 GLY 49 48.648 41.919 -10.477 359 HA3 GLY 49 HA1 GLY 49 50.296 42.377 -10.897 360 H LYS 50 HN LYS 50 47.818 40.846 -12.159 361 HA LYS 50 HA LYS 50 48.775 38.296 -12.932 362 HB2 LYS 50 HB2 LYS 50 46.751 40.165 -14.172 363 HB3 LYS 50 HB1 LYS 50 47.077 38.546 -14.794 364 HG2 LYS 50 HG2 LYS 50 46.588 37.646 -12.492 365 HG3 LYS 50 HG1 LYS 50 46.069 39.267 -12.029 366 HD2 LYS 50 HD2 LYS 50 44.902 37.760 -14.383 367 HD3 LYS 50 HD1 LYS 50 44.196 37.730 -12.767 368 HE2 LYS 50 HE2 LYS 50 44.671 40.216 -14.441 369 HE3 LYS 50 HE1 LYS 50 43.108 39.449 -14.156 370 HZ1 LYS 50 HZ1 LYS 50 43.831 39.739 -11.675 371 HZ2 LYS 50 HZ2 LYS 50 43.107 41.019 -12.525 372 HZ3 LYS 50 HZ3 LYS 50 44.792 40.982 -12.312 373 H ARG 51 HN ARG 51 49.100 41.512 -14.352 374 HA ARG 51 HA ARG 51 50.103 40.910 -16.852 375 HB2 ARG 51 HB2 ARG 51 51.163 43.073 -16.834 376 HB3 ARG 51 HB1 ARG 51 49.643 43.210 -15.951 377 HG2 ARG 51 HG2 ARG 51 50.911 42.879 -13.817 378 HG3 ARG 51 HG1 ARG 51 52.410 42.905 -14.747 379 HD2 ARG 51 HD2 ARG 51 51.831 45.165 -15.583 380 HD3 ARG 51 HD1 ARG 51 50.369 45.142 -14.602 381 HE ARG 51 HE ARG 51 53.072 45.583 -13.667 382 HH11 ARG 51 HH11 ARG 51 49.851 44.543 -12.825 383 HH12 ARG 51 HH12 ARG 51 50.044 44.912 -11.146 384 HH21 ARG 51 HH21 ARG 51 53.294 46.056 -11.471 385 HH22 ARG 51 HH22 ARG 51 51.979 45.763 -10.382 386 H ASN 52 HN ASN 52 51.631 40.519 -13.749 387 HA ASN 52 HA ASN 52 54.325 40.412 -14.521 388 HB2 ASN 52 HB2 ASN 52 53.122 40.242 -12.156 389 HB3 ASN 52 HB1 ASN 52 53.327 38.516 -12.447 390 HD21 ASN 52 HD21 ASN 52 55.843 38.836 -13.986 391 HD22 ASN 52 HD22 ASN 52 57.034 39.267 -12.857 392 H ALA 53 HN ALA 53 51.794 37.945 -14.557 393 HA ALA 53 HA ALA 53 53.432 35.746 -15.252 394 HB1 ALA 53 HB1 ALA 53 51.164 34.898 -16.233 395 HB2 ALA 53 HB2 ALA 53 50.502 36.348 -15.479 396 HB3 ALA 53 HB3 ALA 53 51.317 35.135 -14.492 397 H VAL 54 HN VAL 54 51.571 38.036 -17.248 398 HA VAL 54 HA VAL 54 52.348 36.796 -19.718 399 HB VAL 54 HB VAL 54 50.353 38.505 -19.014 400 HG11 VAL 54 HG11 VAL 54 52.253 40.170 -20.682 401 HG12 VAL 54 HG12 VAL 54 52.108 40.360 -18.935 402 HG13 VAL 54 HG13 VAL 54 50.717 40.664 -19.973 403 HG21 VAL 54 HG21 VAL 54 49.987 38.719 -21.490 404 HG22 VAL 54 HG22 VAL 54 50.330 37.068 -20.972 405 HG23 VAL 54 HG23 VAL 54 51.592 38.031 -21.741 406 H GLU 55 HN GLU 55 53.785 39.108 -17.594 407 HA GLU 55 HA GLU 55 55.449 40.366 -19.577 408 HB2 GLU 55 HB2 GLU 55 54.734 41.344 -17.314 409 HB3 GLU 55 HB1 GLU 55 55.980 40.315 -16.608 410 HG2 GLU 55 HG2 GLU 55 56.600 42.142 -18.925 411 HG3 GLU 55 HG1 GLU 55 56.643 42.732 -17.265 412 H VAL 56 HN VAL 56 56.155 38.153 -16.859 413 HA VAL 56 HA VAL 56 58.814 37.642 -17.407 414 HB VAL 56 HB VAL 56 57.693 36.805 -15.396 415 HG11 VAL 56 HG11 VAL 56 56.367 34.837 -17.286 416 HG12 VAL 56 HG12 VAL 56 55.554 36.173 -16.472 417 HG13 VAL 56 HG13 VAL 56 56.220 34.841 -15.529 418 HG21 VAL 56 HG21 VAL 56 58.729 34.580 -15.344 419 HG22 VAL 56 HG22 VAL 56 59.780 35.713 -16.195 420 HG23 VAL 56 HG23 VAL 56 58.807 34.558 -17.106 421 H LEU 57 HN LEU 57 55.958 36.371 -19.004 422 HA LEU 57 HA LEU 57 57.221 34.273 -20.428 423 HB2 LEU 57 HB2 LEU 57 54.628 35.594 -20.430 424 HB3 LEU 57 HB1 LEU 57 55.157 35.194 -22.064 425 HG LEU 57 HG LEU 57 55.680 32.868 -21.237 426 HD11 LEU 57 HD11 LEU 57 55.843 33.506 -18.829 427 HD12 LEU 57 HD12 LEU 57 54.728 32.167 -19.100 428 HD13 LEU 57 HD13 LEU 57 54.102 33.792 -18.816 429 HD21 LEU 57 HD21 LEU 57 53.519 33.576 -22.386 430 HD22 LEU 57 HD22 LEU 57 52.793 33.663 -20.781 431 HD23 LEU 57 HD23 LEU 57 53.402 32.125 -21.391 432 H LYS 58 HN LYS 58 56.740 37.702 -21.104 433 HA LYS 58 HA LYS 58 57.750 37.669 -23.774 434 HB2 LYS 58 HB2 LYS 58 57.447 39.862 -21.718 435 HB3 LYS 58 HB1 LYS 58 58.043 40.149 -23.352 436 HG2 LYS 58 HG2 LYS 58 55.435 38.710 -22.854 437 HG3 LYS 58 HG1 LYS 58 55.516 40.469 -22.957 438 HD2 LYS 58 HD2 LYS 58 56.656 40.213 -25.189 439 HD3 LYS 58 HD1 LYS 58 56.333 38.482 -25.093 440 HE2 LYS 58 HE2 LYS 58 54.193 40.622 -24.928 441 HE3 LYS 58 HE1 LYS 58 54.599 39.735 -26.397 442 HZ1 LYS 58 HZ1 LYS 58 53.331 38.763 -23.931 443 HZ2 LYS 58 HZ2 LYS 58 54.241 37.684 -24.877 444 HZ3 LYS 58 HZ3 LYS 58 52.898 38.480 -25.546 445 H ARG 59 HN ARG 59 59.221 38.302 -20.606 446 HA ARG 59 HA ARG 59 61.776 39.033 -21.566 447 HB2 ARG 59 HB2 ARG 59 60.872 39.382 -19.226 448 HB3 ARG 59 HB1 ARG 59 61.196 37.673 -18.931 449 HG2 ARG 59 HG2 ARG 59 63.431 39.193 -20.139 450 HG3 ARG 59 HG1 ARG 59 63.017 39.645 -18.485 451 HD2 ARG 59 HD2 ARG 59 63.131 37.228 -17.849 452 HD3 ARG 59 HD1 ARG 59 63.684 36.861 -19.480 453 HE ARG 59 HE ARG 59 65.346 38.862 -18.388 454 HH11 ARG 59 HH11 ARG 59 64.559 35.488 -17.983 455 HH12 ARG 59 HH12 ARG 59 66.125 35.074 -17.377 456 HH21 ARG 59 HH21 ARG 59 67.383 38.292 -17.594 457 HH22 ARG 59 HH22 ARG 59 67.715 36.649 -17.157 458 H GLU 60 HN GLU 60 60.338 35.904 -20.774 459 HA GLU 60 HA GLU 60 62.806 34.601 -21.758 460 HB2 GLU 60 HB2 GLU 60 62.272 34.170 -19.360 461 HB3 GLU 60 HB1 GLU 60 60.745 33.449 -19.867 462 HG2 GLU 60 HG2 GLU 60 61.978 31.798 -21.230 463 HG3 GLU 60 HG1 GLU 60 63.503 32.510 -20.705 464 HA PRO 61 HA PRO 61 59.360 33.593 -24.700 465 HB2 PRO 61 HB2 PRO 61 60.776 34.087 -26.980 466 HB3 PRO 61 HB1 PRO 61 59.897 35.348 -26.094 467 HG2 PRO 61 HG2 PRO 61 62.804 34.715 -26.102 468 HG3 PRO 61 HG1 PRO 61 61.989 36.288 -26.065 469 HD2 PRO 61 HD2 PRO 61 63.069 35.087 -23.836 470 HD3 PRO 61 HD1 PRO 61 61.721 36.242 -23.775 471 H LEU 62 HN LEU 62 62.439 32.397 -23.957 472 HA LEU 62 HA LEU 62 62.900 30.456 -25.915 473 HB2 LEU 62 HB2 LEU 62 64.558 31.061 -24.211 474 HB3 LEU 62 HB1 LEU 62 63.538 30.361 -22.956 475 HG LEU 62 HG LEU 62 63.699 28.152 -24.097 476 HD11 LEU 62 HD11 LEU 62 64.099 28.788 -26.375 477 HD12 LEU 62 HD12 LEU 62 65.560 27.965 -25.827 478 HD13 LEU 62 HD13 LEU 62 65.525 29.725 -25.929 479 HD21 LEU 62 HD21 LEU 62 65.945 27.668 -23.367 480 HD22 LEU 62 HD22 LEU 62 65.307 28.913 -22.293 481 HD23 LEU 62 HD23 LEU 62 66.433 29.350 -23.578 482 H ASN 63 HN ASN 63 60.941 30.347 -22.962 483 HA ASN 63 HA ASN 63 60.280 27.598 -23.099 484 HB2 ASN 63 HB2 ASN 63 58.668 28.059 -21.423 485 HB3 ASN 63 HB1 ASN 63 59.989 29.186 -21.120 486 HD21 ASN 63 HD21 ASN 63 56.863 29.295 -20.758 487 HD22 ASN 63 HD22 ASN 63 56.470 30.813 -21.407 488 H TYR 64 HN TYR 64 59.024 30.432 -24.700 489 HA TYR 64 HA TYR 64 56.565 29.226 -25.561 490 HB2 TYR 64 HB2 TYR 64 56.835 31.675 -25.366 491 HB3 TYR 64 HB1 TYR 64 58.030 31.637 -26.663 492 HD1 TYR 64 HD1 TYR 64 54.478 30.814 -25.859 493 HD2 TYR 64 HD2 TYR 64 57.363 31.636 -28.934 494 HE1 TYR 64 HE1 TYR 64 52.658 30.912 -27.541 495 HE2 TYR 64 HE2 TYR 64 55.543 31.734 -30.616 496 HH TYR 64 HH TYR 64 52.941 30.539 -30.577 497 H LEU 65 HN LEU 65 59.731 29.822 -27.035 498 HA LEU 65 HA LEU 65 59.047 28.692 -29.569 499 HB2 LEU 65 HB2 LEU 65 61.732 29.232 -28.279 500 HB3 LEU 65 HB1 LEU 65 61.514 28.741 -29.958 501 HG LEU 65 HG LEU 65 60.193 31.188 -28.759 502 HD11 LEU 65 HD11 LEU 65 61.954 32.438 -30.069 503 HD12 LEU 65 HD12 LEU 65 62.791 30.902 -30.294 504 HD13 LEU 65 HD13 LEU 65 62.579 31.561 -28.672 505 HD21 LEU 65 HD21 LEU 65 60.077 31.763 -31.252 506 HD22 LEU 65 HD22 LEU 65 59.036 30.444 -30.719 507 HD23 LEU 65 HD23 LEU 65 60.545 30.091 -31.560 508 HA PRO 66 HA PRO 66 59.443 24.347 -28.984 509 HB2 PRO 66 HB2 PRO 66 61.592 24.292 -31.051 510 HB3 PRO 66 HB1 PRO 66 60.069 23.386 -30.981 511 HG2 PRO 66 HG2 PRO 66 60.391 25.437 -32.645 512 HG3 PRO 66 HG1 PRO 66 58.840 25.117 -31.849 513 HD2 PRO 66 HD2 PRO 66 60.857 27.242 -31.257 514 HD3 PRO 66 HD1 PRO 66 59.087 27.287 -31.102 515 H LEU 67 HN LEU 67 60.592 22.979 -27.676 516 HA LEU 67 HA LEU 67 63.325 23.825 -26.924 517 HB2 LEU 67 HB2 LEU 67 61.070 22.641 -25.322 518 HB3 LEU 67 HB1 LEU 67 62.742 22.484 -24.783 519 HG LEU 67 HG LEU 67 61.568 25.158 -25.553 520 HD11 LEU 67 HD11 LEU 67 61.505 23.728 -22.885 521 HD12 LEU 67 HD12 LEU 67 60.142 24.401 -23.780 522 HD13 LEU 67 HD13 LEU 67 61.327 25.476 -23.037 523 HD21 LEU 67 HD21 LEU 67 63.963 25.168 -25.441 524 HD22 LEU 67 HD22 LEU 67 63.964 24.206 -23.963 525 HD23 LEU 67 HD23 LEU 67 63.404 25.878 -23.926 Start of MODEL 17 1 H1 THR 1 HT1 THR 1 -4.062 -5.188 -0.343 2 H2 THR 1 HT2 THR 1 -3.325 -4.204 -1.516 3 H3 THR 1 HT3 THR 1 -3.842 -3.533 -0.042 4 HA THR 1 HA THR 1 -2.194 -5.471 0.810 5 HB THR 1 HB THR 1 -1.683 -5.228 -1.929 6 HG1 THR 1 HG1 THR 1 0.182 -6.478 -1.321 7 HG21 THR 1 HG21 THR 1 0.527 -4.244 -2.104 8 HG22 THR 1 HG22 THR 1 0.556 -3.897 -0.377 9 HG23 THR 1 HG23 THR 1 -0.569 -3.038 -1.433 10 HA PRO 2 HA PRO 2 -0.878 -1.822 2.907 11 HB2 PRO 2 HB2 PRO 2 1.582 -2.522 3.853 12 HB3 PRO 2 HB1 PRO 2 0.072 -3.202 4.491 13 HG2 PRO 2 HG2 PRO 2 2.030 -4.387 2.594 14 HG3 PRO 2 HG1 PRO 2 1.104 -5.157 3.893 15 HD2 PRO 2 HD2 PRO 2 0.422 -5.313 1.225 16 HD3 PRO 2 HD1 PRO 2 -0.742 -5.491 2.555 17 H ILE 3 HN ILE 3 0.447 0.045 2.780 18 HA ILE 3 HA ILE 3 1.518 0.618 0.216 19 HB ILE 3 HB ILE 3 0.541 2.314 1.772 20 HG12 ILE 3 HG12 ILE 3 2.375 4.027 1.359 21 HG13 ILE 3 HG11 ILE 3 3.365 2.704 0.743 22 HG21 ILE 3 HG21 ILE 3 1.684 1.390 3.815 23 HG22 ILE 3 HG22 ILE 3 1.868 3.134 3.627 24 HG23 ILE 3 HG23 ILE 3 3.200 2.056 3.206 25 HD11 ILE 3 HD11 ILE 3 0.592 3.275 -0.322 26 HD12 ILE 3 HD12 ILE 3 1.845 2.266 -1.044 27 HD13 ILE 3 HD13 ILE 3 2.038 4.018 -1.006 28 H GLU 4 HN GLU 4 3.569 0.593 -0.553 29 HA GLU 4 HA GLU 4 5.523 -1.004 0.770 30 HB2 GLU 4 HB2 GLU 4 6.954 -0.474 -1.128 31 HB3 GLU 4 HB1 GLU 4 5.325 -0.834 -1.700 32 HG2 GLU 4 HG2 GLU 4 4.837 1.604 -1.760 33 HG3 GLU 4 HG1 GLU 4 6.501 1.928 -1.277 34 H SER 5 HN SER 5 7.706 -0.309 1.327 35 HA SER 5 HA SER 5 7.709 1.907 3.096 36 HB2 SER 5 HB2 SER 5 10.007 0.295 1.967 37 HB3 SER 5 HB1 SER 5 10.143 1.447 3.292 38 HG SER 5 HG SER 5 9.400 -0.042 4.561 39 H HIS 6 HN HIS 6 8.758 3.900 2.952 40 HA HIS 6 HA HIS 6 9.021 4.921 0.222 41 HB2 HIS 6 HB2 HIS 6 9.036 7.130 1.277 42 HB3 HIS 6 HB1 HIS 6 7.664 6.184 1.853 43 HD1 HIS 6 HD1 HIS 6 11.087 7.376 2.932 44 HD2 HIS 6 HD2 HIS 6 7.711 5.589 4.602 45 HE1 HIS 6 HE1 HIS 6 11.432 7.398 5.441 46 HE2 HIS 6 HE2 HIS 6 9.382 6.312 6.474 47 H GLN 7 HN GLN 7 11.060 3.158 1.620 48 HA GLN 7 HA GLN 7 13.343 4.691 2.264 49 HB2 GLN 7 HB2 GLN 7 13.103 2.310 2.858 50 HB3 GLN 7 HB1 GLN 7 13.197 1.880 1.150 51 HG2 GLN 7 HG2 GLN 7 15.444 2.890 1.016 52 HG3 GLN 7 HG1 GLN 7 15.354 3.317 2.724 53 HE21 GLN 7 HE21 GLN 7 16.550 1.859 3.944 54 HE22 GLN 7 HE22 GLN 7 16.649 0.190 3.648 55 H VAL 8 HN VAL 8 14.914 5.589 1.046 56 HA VAL 8 HA VAL 8 14.866 5.098 -1.867 57 HB VAL 8 HB VAL 8 13.760 7.253 -1.365 58 HG11 VAL 8 HG11 VAL 8 15.090 7.634 0.759 59 HG12 VAL 8 HG12 VAL 8 14.959 9.045 -0.291 60 HG13 VAL 8 HG13 VAL 8 16.450 8.103 -0.261 61 HG21 VAL 8 HG21 VAL 8 15.040 7.003 -3.451 62 HG22 VAL 8 HG22 VAL 8 16.516 7.489 -2.618 63 HG23 VAL 8 HG23 VAL 8 15.201 8.646 -2.831 64 H GLU 9 HN GLU 9 16.843 5.041 -2.877 65 HA GLU 9 HA GLU 9 19.243 5.682 -1.320 66 HB2 GLU 9 HB2 GLU 9 20.138 3.387 -2.313 67 HB3 GLU 9 HB1 GLU 9 19.293 3.446 -0.767 68 HG2 GLU 9 HG2 GLU 9 18.447 1.650 -2.303 69 HG3 GLU 9 HG1 GLU 9 17.205 2.799 -1.812 70 H LYS 10 HN LYS 10 18.694 7.371 -3.145 71 HA LYS 10 HA LYS 10 19.696 6.530 -5.760 72 HB2 LYS 10 HB2 LYS 10 19.035 8.749 -6.510 73 HB3 LYS 10 HB1 LYS 10 17.711 8.017 -5.604 74 HG2 LYS 10 HG2 LYS 10 18.431 9.255 -3.579 75 HG3 LYS 10 HG1 LYS 10 19.713 10.020 -4.518 76 HD2 LYS 10 HD2 LYS 10 17.991 10.958 -6.052 77 HD3 LYS 10 HD1 LYS 10 16.734 10.260 -5.030 78 HE2 LYS 10 HE2 LYS 10 18.818 12.260 -4.104 79 HE3 LYS 10 HE1 LYS 10 17.140 12.647 -4.485 80 HZ1 LYS 10 HZ1 LYS 10 18.238 11.159 -2.216 81 HZ2 LYS 10 HZ2 LYS 10 16.705 10.711 -2.795 82 HZ3 LYS 10 HZ3 LYS 10 16.983 12.298 -2.255 83 H ARG 11 HN ARG 11 21.177 8.293 -6.820 84 HA ARG 11 HA ARG 11 23.307 8.987 -4.894 85 HB2 ARG 11 HB2 ARG 11 24.852 8.626 -6.964 86 HB3 ARG 11 HB1 ARG 11 24.313 7.229 -6.039 87 HG2 ARG 11 HG2 ARG 11 24.037 6.711 -8.379 88 HG3 ARG 11 HG1 ARG 11 22.428 6.951 -7.710 89 HD2 ARG 11 HD2 ARG 11 23.723 9.396 -8.752 90 HD3 ARG 11 HD1 ARG 11 23.351 8.178 -9.967 91 HE ARG 11 HE ARG 11 21.450 9.773 -8.490 92 HH11 ARG 11 HH11 ARG 11 21.991 6.791 -10.214 93 HH12 ARG 11 HH12 ARG 11 20.320 6.574 -10.602 94 HH21 ARG 11 HH21 ARG 11 19.274 9.465 -9.011 95 HH22 ARG 11 HH22 ARG 11 18.789 8.077 -9.927 96 H LYS 12 HN LYS 12 24.941 10.535 -6.102 97 HA LYS 12 HA LYS 12 23.357 12.596 -7.512 98 HB2 LYS 12 HB2 LYS 12 24.411 14.321 -6.253 99 HB3 LYS 12 HB1 LYS 12 23.883 13.119 -5.076 100 HG2 LYS 12 HG2 LYS 12 26.200 12.103 -5.223 101 HG3 LYS 12 HG1 LYS 12 26.679 13.514 -6.168 102 HD2 LYS 12 HD2 LYS 12 27.255 14.146 -3.983 103 HD3 LYS 12 HD1 LYS 12 25.666 14.882 -4.191 104 HE2 LYS 12 HE2 LYS 12 25.605 13.786 -2.067 105 HE3 LYS 12 HE1 LYS 12 24.692 12.756 -3.169 106 HZ1 LYS 12 HZ1 LYS 12 26.059 11.216 -2.248 107 HZ2 LYS 12 HZ2 LYS 12 27.316 12.321 -1.955 108 HZ3 LYS 12 HZ3 LYS 12 27.065 11.711 -3.521 109 H CYS 13 HN CYS 13 24.606 14.011 -8.895 110 HA CYS 13 HA CYS 13 26.743 12.556 -10.236 111 HB2 CYS 13 HB2 CYS 13 24.934 13.645 -11.543 112 HB3 CYS 13 HB1 CYS 13 25.479 15.213 -10.947 113 H ASN 14 HN ASN 14 28.591 12.705 -9.052 114 HA ASN 14 HA ASN 14 29.515 15.388 -8.247 115 HB2 ASN 14 HB2 ASN 14 31.167 14.136 -6.863 116 HB3 ASN 14 HB1 ASN 14 29.493 13.790 -6.433 117 HD21 ASN 14 HD21 ASN 14 29.876 11.632 -5.653 118 HD22 ASN 14 HD22 ASN 14 30.377 10.372 -6.674 119 H THR 15 HN THR 15 29.679 13.794 -10.978 120 HA THR 15 HA THR 15 32.524 13.590 -11.399 121 HB THR 15 HB THR 15 31.885 13.164 -13.754 122 HG1 THR 15 HG1 THR 15 29.592 13.045 -14.138 123 HG21 THR 15 HG21 THR 15 30.382 11.699 -11.578 124 HG22 THR 15 HG22 THR 15 31.915 11.249 -12.324 125 HG23 THR 15 HG23 THR 15 30.419 11.144 -13.252 126 H ALA 16 HN ALA 16 33.472 14.752 -13.349 127 HA ALA 16 HA ALA 16 33.290 17.583 -12.871 128 HB1 ALA 16 HB1 ALA 16 34.875 15.917 -14.830 129 HB2 ALA 16 HB2 ALA 16 35.459 16.728 -13.378 130 HB3 ALA 16 HB3 ALA 16 34.966 17.677 -14.780 131 H THR 17 HN THR 17 31.945 15.348 -15.161 132 HA THR 17 HA THR 17 31.364 17.046 -17.306 133 HB THR 17 HB THR 17 29.756 14.712 -16.241 134 HG1 THR 17 HG1 THR 17 31.631 14.867 -18.359 135 HG21 THR 17 HG21 THR 17 28.963 14.627 -18.647 136 HG22 THR 17 HG22 THR 17 29.670 16.229 -18.857 137 HG23 THR 17 HG23 THR 17 28.352 15.990 -17.710 138 H CYS 18 HN CYS 18 29.418 16.322 -14.408 139 HA CYS 18 HA CYS 18 27.261 18.035 -15.094 140 HB2 CYS 18 HB2 CYS 18 28.199 16.868 -12.473 141 HB3 CYS 18 HB1 CYS 18 26.766 17.889 -12.598 142 H ALA 19 HN ALA 19 30.254 18.517 -13.282 143 HA ALA 19 HA ALA 19 29.699 21.032 -12.178 144 HB1 ALA 19 HB1 ALA 19 31.660 19.840 -11.470 145 HB2 ALA 19 HB2 ALA 19 32.203 21.335 -12.232 146 HB3 ALA 19 HB3 ALA 19 32.302 19.810 -13.112 147 H THR 20 HN THR 20 31.151 20.180 -15.317 148 HA THR 20 HA THR 20 31.658 22.763 -16.245 149 HB THR 20 HB THR 20 30.842 20.317 -17.830 150 HG1 THR 20 HG1 THR 20 32.717 19.684 -17.163 151 HG21 THR 20 HG21 THR 20 30.629 22.357 -19.155 152 HG22 THR 20 HG22 THR 20 32.060 21.465 -19.673 153 HG23 THR 20 HG23 THR 20 32.231 22.886 -18.641 154 H GLN 21 HN GLN 21 28.664 20.914 -16.170 155 HA GLN 21 HA GLN 21 27.137 22.389 -17.979 156 HB2 GLN 21 HB2 GLN 21 26.429 20.260 -16.884 157 HB3 GLN 21 HB1 GLN 21 26.145 21.165 -15.398 158 HG2 GLN 21 HG2 GLN 21 24.476 22.545 -16.487 159 HG3 GLN 21 HG1 GLN 21 24.837 21.815 -18.050 160 HE21 GLN 21 HE21 GLN 21 22.484 21.742 -15.802 161 HE22 GLN 21 HE22 GLN 21 22.007 20.116 -15.901 162 H ARG 22 HN ARG 22 27.748 22.995 -14.522 163 HA ARG 22 HA ARG 22 26.005 25.249 -14.385 164 HB2 ARG 22 HB2 ARG 22 26.682 25.475 -12.188 165 HB3 ARG 22 HB1 ARG 22 27.037 23.774 -12.469 166 HG2 ARG 22 HG2 ARG 22 29.061 24.385 -11.585 167 HG3 ARG 22 HG1 ARG 22 29.392 24.829 -13.254 168 HD2 ARG 22 HD2 ARG 22 29.847 26.892 -12.439 169 HD3 ARG 22 HD1 ARG 22 28.101 27.070 -12.285 170 HE ARG 22 HE ARG 22 28.331 26.865 -9.983 171 HH11 ARG 22 HH11 ARG 22 31.247 25.822 -11.588 172 HH12 ARG 22 HH12 ARG 22 32.145 25.677 -10.117 173 HH21 ARG 22 HH21 ARG 22 29.529 26.666 -8.078 174 HH22 ARG 22 HH22 ARG 22 31.181 26.151 -8.141 175 H LEU 23 HN LEU 23 29.220 24.798 -15.551 176 HA LEU 23 HA LEU 23 30.173 27.460 -15.267 177 HB2 LEU 23 HB2 LEU 23 31.583 25.429 -15.769 178 HB3 LEU 23 HB1 LEU 23 30.952 25.480 -17.415 179 HG LEU 23 HG LEU 23 31.736 27.915 -17.486 180 HD11 LEU 23 HD11 LEU 23 32.064 28.376 -15.160 181 HD12 LEU 23 HD12 LEU 23 33.674 28.327 -15.876 182 HD13 LEU 23 HD13 LEU 23 33.078 26.949 -14.951 183 HD21 LEU 23 HD21 LEU 23 34.163 27.190 -17.807 184 HD22 LEU 23 HD22 LEU 23 32.968 26.269 -18.721 185 HD23 LEU 23 HD23 LEU 23 33.665 25.592 -17.249 186 H ALA 24 HN ALA 24 28.343 25.780 -17.776 187 HA ALA 24 HA ALA 24 28.448 27.804 -19.745 188 HB1 ALA 24 HB1 ALA 24 26.490 25.578 -19.186 189 HB2 ALA 24 HB2 ALA 24 27.714 25.665 -20.453 190 HB3 ALA 24 HB3 ALA 24 26.281 26.690 -20.539 191 H ASN 25 HN ASN 25 26.228 27.200 -17.056 192 HA ASN 25 HA ASN 25 24.433 29.330 -17.723 193 HB2 ASN 25 HB2 ASN 25 24.884 27.716 -15.209 194 HB3 ASN 25 HB1 ASN 25 23.660 28.979 -15.328 195 HD21 ASN 25 HD21 ASN 25 22.996 26.190 -14.925 196 HD22 ASN 25 HD22 ASN 25 22.161 25.657 -16.303 197 H PHE 26 HN PHE 26 27.405 29.053 -15.936 198 HA PHE 26 HA PHE 26 27.219 31.428 -14.399 199 HB2 PHE 26 HB2 PHE 26 28.859 29.637 -13.945 200 HB3 PHE 26 HB1 PHE 26 29.692 30.032 -15.448 201 HD1 PHE 26 HD1 PHE 26 28.659 31.419 -12.147 202 HD2 PHE 26 HD2 PHE 26 31.220 31.847 -15.569 203 HE1 PHE 26 HE1 PHE 26 29.918 33.209 -10.980 204 HE2 PHE 26 HE2 PHE 26 32.479 33.637 -14.402 205 HZ PHE 26 HZ PHE 26 31.828 34.317 -12.108 206 H LEU 27 HN LEU 27 28.368 30.769 -17.676 207 HA LEU 27 HA LEU 27 29.586 33.246 -18.167 208 HB2 LEU 27 HB2 LEU 27 29.842 31.248 -19.619 209 HB3 LEU 27 HB1 LEU 27 28.160 31.388 -20.105 210 HG LEU 27 HG LEU 27 30.000 32.312 -21.684 211 HD11 LEU 27 HD11 LEU 27 27.860 34.343 -21.092 212 HD12 LEU 27 HD12 LEU 27 27.427 32.739 -21.683 213 HD13 LEU 27 HD13 LEU 27 28.470 33.783 -22.647 214 HD21 LEU 27 HD21 LEU 27 31.044 33.627 -19.706 215 HD22 LEU 27 HD22 LEU 27 29.753 34.793 -19.987 216 HD23 LEU 27 HD23 LEU 27 30.913 34.439 -21.266 217 H VAL 28 HN VAL 28 26.220 32.193 -18.480 218 HA VAL 28 HA VAL 28 25.394 34.815 -19.465 219 HB VAL 28 HB VAL 28 23.140 33.842 -19.506 220 HG11 VAL 28 HG11 VAL 28 24.855 33.413 -21.340 221 HG12 VAL 28 HG12 VAL 28 23.530 32.252 -21.255 222 HG13 VAL 28 HG13 VAL 28 25.115 31.831 -20.607 223 HG21 VAL 28 HG21 VAL 28 24.463 31.347 -18.394 224 HG22 VAL 28 HG22 VAL 28 22.762 31.534 -18.816 225 HG23 VAL 28 HG23 VAL 28 23.435 32.431 -17.457 226 H HIS 29 HN HIS 29 25.608 33.083 -16.466 227 HA HIS 29 HA HIS 29 23.728 34.653 -15.002 228 HB2 HIS 29 HB2 HIS 29 24.564 32.391 -14.308 229 HB3 HIS 29 HB1 HIS 29 26.112 33.142 -13.919 230 HD1 HIS 29 HD1 HIS 29 22.429 33.721 -13.072 231 HD2 HIS 29 HD2 HIS 29 26.197 34.042 -11.316 232 HE1 HIS 29 HE1 HIS 29 22.044 34.452 -10.678 233 HE2 HIS 29 HE2 HIS 29 24.331 34.652 -9.594 234 H SER 30 HN SER 30 27.017 35.081 -15.982 235 HA SER 30 HA SER 30 27.193 37.530 -14.330 236 HB2 SER 30 HB2 SER 30 28.864 35.855 -13.674 237 HB3 SER 30 HB1 SER 30 29.450 35.780 -15.333 238 HG SER 30 HG SER 30 29.544 37.938 -13.503 239 H SER 31 HN SER 31 26.322 36.793 -17.281 240 HA SER 31 HA SER 31 28.146 38.195 -18.957 241 HB2 SER 31 HB2 SER 31 26.548 36.558 -19.858 242 HB3 SER 31 HB1 SER 31 25.206 37.586 -19.363 243 HG SER 31 HG SER 31 25.488 38.394 -21.295 244 H ASN 32 HN ASN 32 25.274 39.142 -17.140 245 HA ASN 32 HA ASN 32 24.854 41.676 -18.239 246 HB2 ASN 32 HB2 ASN 32 23.802 42.217 -16.046 247 HB3 ASN 32 HB1 ASN 32 23.250 40.684 -16.721 248 HD21 ASN 32 HD21 ASN 32 24.192 42.027 -13.842 249 HD22 ASN 32 HD22 ASN 32 24.812 40.646 -13.075 250 H ASN 33 HN ASN 33 27.289 40.522 -16.048 251 HA ASN 33 HA ASN 33 28.081 43.035 -14.988 252 HB2 ASN 33 HB2 ASN 33 29.546 40.406 -15.261 253 HB3 ASN 33 HB1 ASN 33 30.234 41.812 -14.452 254 HD21 ASN 33 HD21 ASN 33 28.626 42.797 -12.710 255 HD22 ASN 33 HD22 ASN 33 27.826 41.660 -11.737 256 H PHE 34 HN PHE 34 28.601 41.471 -18.002 257 HA PHE 34 HA PHE 34 31.034 42.663 -18.808 258 HB2 PHE 34 HB2 PHE 34 29.979 40.775 -20.015 259 HB3 PHE 34 HB1 PHE 34 28.681 41.850 -20.536 260 HD1 PHE 34 HD1 PHE 34 32.385 41.384 -20.656 261 HD2 PHE 34 HD2 PHE 34 28.940 43.228 -22.439 262 HE1 PHE 34 HE1 PHE 34 33.778 42.142 -22.563 263 HE2 PHE 34 HE2 PHE 34 30.333 43.986 -24.346 264 HZ PHE 34 HZ PHE 34 32.751 43.443 -24.408 265 H GLY 35 HN GLY 35 27.666 43.719 -19.092 266 HA2 GLY 35 HA2 GLY 35 28.200 46.096 -20.575 267 HA3 GLY 35 HA1 GLY 35 26.739 45.753 -19.629 268 H ALA 36 HN ALA 36 27.816 45.476 -17.075 269 HA ALA 36 HA ALA 36 28.031 48.130 -16.222 270 HB1 ALA 36 HB1 ALA 36 28.930 47.065 -14.082 271 HB2 ALA 36 HB2 ALA 36 28.778 45.516 -14.913 272 HB3 ALA 36 HB3 ALA 36 27.348 46.508 -14.629 273 H ILE 37 HN ILE 37 30.501 45.728 -16.984 274 HA ILE 37 HA ILE 37 32.763 47.106 -16.039 275 HB ILE 37 HB ILE 37 32.388 45.071 -18.231 276 HG12 ILE 37 HG12 ILE 37 33.836 44.856 -15.582 277 HG13 ILE 37 HG11 ILE 37 32.112 44.521 -15.738 278 HG21 ILE 37 HG21 ILE 37 34.929 44.873 -18.067 279 HG22 ILE 37 HG22 ILE 37 34.905 46.437 -17.250 280 HG23 ILE 37 HG23 ILE 37 34.326 46.300 -18.911 281 HD11 ILE 37 HD11 ILE 37 34.239 43.174 -17.423 282 HD12 ILE 37 HD12 ILE 37 32.529 42.753 -17.330 283 HD13 ILE 37 HD13 ILE 37 33.580 42.480 -15.941 284 H LEU 38 HN LEU 38 31.114 47.182 -19.177 285 HA LEU 38 HA LEU 38 32.982 48.862 -20.488 286 HB2 LEU 38 HB2 LEU 38 31.319 47.505 -21.704 287 HB3 LEU 38 HB1 LEU 38 30.024 48.491 -21.029 288 HG LEU 38 HG LEU 38 31.041 50.501 -22.109 289 HD11 LEU 38 HD11 LEU 38 33.344 49.870 -22.299 290 HD12 LEU 38 HD12 LEU 38 32.731 49.977 -23.949 291 HD13 LEU 38 HD13 LEU 38 32.937 48.401 -23.185 292 HD21 LEU 38 HD21 LEU 38 30.238 49.998 -24.318 293 HD22 LEU 38 HD22 LEU 38 29.265 49.044 -23.198 294 HD23 LEU 38 HD23 LEU 38 30.566 48.277 -24.110 295 H SER 39 HN SER 39 30.084 49.562 -18.559 296 HA SER 39 HA SER 39 30.033 52.345 -19.116 297 HB2 SER 39 HB2 SER 39 28.098 51.169 -18.167 298 HB3 SER 39 HB1 SER 39 29.013 50.825 -16.702 299 HG SER 39 HG SER 39 28.433 52.725 -16.046 300 H SER 40 HN SER 40 31.572 50.402 -16.589 301 HA SER 40 HA SER 40 32.870 52.821 -15.524 302 HB2 SER 40 HB2 SER 40 32.729 50.008 -14.414 303 HB3 SER 40 HB1 SER 40 33.516 51.374 -13.629 304 HG SER 40 HG SER 40 31.623 52.150 -13.093 305 H THR 41 HN THR 41 33.596 51.553 -18.087 306 HA THR 41 HA THR 41 35.869 49.961 -17.982 307 HB THR 41 HB THR 41 34.715 50.505 -20.075 308 HG1 THR 41 HG1 THR 41 37.353 51.523 -20.156 309 HG21 THR 41 HG21 THR 41 35.117 52.741 -21.111 310 HG22 THR 41 HG22 THR 41 35.865 53.269 -19.604 311 HG23 THR 41 HG23 THR 41 34.156 52.833 -19.635 312 H ASN 42 HN ASN 42 35.489 53.282 -17.089 313 HA ASN 42 HA ASN 42 38.349 53.839 -17.218 314 HB2 ASN 42 HB2 ASN 42 37.765 56.072 -16.527 315 HB3 ASN 42 HB1 ASN 42 36.633 55.573 -17.783 316 HD21 ASN 42 HD21 ASN 42 35.843 57.615 -16.028 317 HD22 ASN 42 HD22 ASN 42 34.645 57.029 -14.978 318 H VAL 43 HN VAL 43 36.982 51.816 -15.323 319 HA VAL 43 HA VAL 43 37.695 52.948 -12.722 320 HB VAL 43 HB VAL 43 35.601 51.537 -13.174 321 HG11 VAL 43 HG11 VAL 43 37.528 49.225 -12.889 322 HG12 VAL 43 HG12 VAL 43 36.992 49.802 -14.467 323 HG13 VAL 43 HG13 VAL 43 35.817 49.178 -13.310 324 HG21 VAL 43 HG21 VAL 43 37.379 50.446 -10.982 325 HG22 VAL 43 HG22 VAL 43 35.632 50.676 -10.957 326 HG23 VAL 43 HG23 VAL 43 36.704 52.074 -10.909 327 H GLY 44 HN GLY 44 39.666 52.209 -14.917 328 HA2 GLY 44 HA2 GLY 44 41.920 51.616 -14.705 329 HA3 GLY 44 HA1 GLY 44 41.552 50.849 -13.164 330 H SER 45 HN SER 45 39.510 50.096 -15.847 331 HA SER 45 HA SER 45 40.933 47.537 -16.250 332 HB2 SER 45 HB2 SER 45 38.731 46.428 -16.418 333 HB3 SER 45 HB1 SER 45 38.981 47.144 -14.829 334 HG SER 45 HG SER 45 36.952 47.726 -15.562 335 H ASN 46 HN ASN 46 40.970 50.039 -17.798 336 HA ASN 46 HA ASN 46 39.443 49.399 -20.207 337 HB2 ASN 46 HB2 ASN 46 40.277 51.546 -21.042 338 HB3 ASN 46 HB1 ASN 46 39.556 51.737 -19.445 339 HD21 ASN 46 HD21 ASN 46 41.209 53.761 -19.914 340 HD22 ASN 46 HD22 ASN 46 42.734 53.554 -19.199 341 H THR 47 HN THR 47 41.820 47.796 -19.172 342 HA THR 47 HA THR 47 43.660 48.125 -21.447 343 HB THR 47 HB THR 47 44.088 46.235 -19.149 344 HG1 THR 47 HG1 THR 47 44.657 49.011 -19.246 345 HG21 THR 47 HG21 THR 47 45.665 46.004 -20.929 346 HG22 THR 47 HG22 THR 47 46.480 46.938 -19.674 347 HG23 THR 47 HG23 THR 47 45.832 47.752 -21.097 348 H TYR 48 HN TYR 48 40.924 46.889 -21.535 349 HA TYR 48 HA TYR 48 41.724 44.199 -22.474 350 HB2 TYR 48 HB2 TYR 48 39.632 43.342 -21.818 351 HB3 TYR 48 HB1 TYR 48 40.099 44.394 -20.481 352 HD1 TYR 48 HD1 TYR 48 37.541 43.638 -22.828 353 HD2 TYR 48 HD2 TYR 48 39.318 46.899 -20.668 354 HE1 TYR 48 HE1 TYR 48 35.483 44.981 -23.163 355 HE2 TYR 48 HE2 TYR 48 37.260 48.241 -21.003 356 HH TYR 48 HH TYR 48 34.343 46.848 -22.275 357 H GLY 49 HN GLY 49 41.559 46.938 -23.838 358 HA2 GLY 49 HA2 GLY 49 39.384 46.942 -25.642 359 HA3 GLY 49 HA1 GLY 49 40.917 47.776 -25.882 360 H LYS 50 HN LYS 50 39.134 46.114 -27.685 361 HA LYS 50 HA LYS 50 40.497 43.705 -28.322 362 HB2 LYS 50 HB2 LYS 50 38.616 45.458 -29.909 363 HB3 LYS 50 HB1 LYS 50 39.243 43.922 -30.509 364 HG2 LYS 50 HG2 LYS 50 38.350 42.838 -28.408 365 HG3 LYS 50 HG1 LYS 50 37.555 44.366 -28.034 366 HD2 LYS 50 HD2 LYS 50 37.150 42.872 -30.637 367 HD3 LYS 50 HD1 LYS 50 36.090 42.693 -29.239 368 HE2 LYS 50 HE2 LYS 50 36.673 45.293 -30.688 369 HE3 LYS 50 HE1 LYS 50 35.183 44.360 -30.812 370 HZ1 LYS 50 HZ1 LYS 50 35.046 44.601 -28.317 371 HZ2 LYS 50 HZ2 LYS 50 34.764 46.009 -29.225 372 HZ3 LYS 50 HZ3 LYS 50 36.258 45.779 -28.449 373 H ARG 51 HN ARG 51 40.953 47.047 -29.233 374 HA ARG 51 HA ARG 51 42.428 46.854 -31.557 375 HB2 ARG 51 HB2 ARG 51 43.428 48.967 -30.982 376 HB3 ARG 51 HB1 ARG 51 41.766 48.979 -30.395 377 HG2 ARG 51 HG2 ARG 51 42.602 48.295 -28.140 378 HG3 ARG 51 HG1 ARG 51 44.253 48.434 -28.748 379 HD2 ARG 51 HD2 ARG 51 43.819 50.811 -29.317 380 HD3 ARG 51 HD1 ARG 51 42.202 50.664 -28.636 381 HE ARG 51 HE ARG 51 44.687 50.889 -27.166 382 HH11 ARG 51 HH11 ARG 51 41.363 49.831 -27.098 383 HH12 ARG 51 HH12 ARG 51 41.241 49.942 -25.377 384 HH21 ARG 51 HH21 ARG 51 44.495 51.027 -24.921 385 HH22 ARG 51 HH22 ARG 51 43.000 50.613 -24.150 386 H ASN 52 HN ASN 52 43.341 45.953 -28.321 387 HA ASN 52 HA ASN 52 46.143 45.893 -28.617 388 HB2 ASN 52 HB2 ASN 52 45.065 45.693 -26.435 389 HB3 ASN 52 HB1 ASN 52 44.341 44.159 -26.913 390 HD21 ASN 52 HD21 ASN 52 45.527 42.337 -26.334 391 HD22 ASN 52 HD22 ASN 52 47.191 42.329 -25.995 392 H ALA 53 HN ALA 53 43.630 43.528 -29.349 393 HA ALA 53 HA ALA 53 45.368 41.383 -30.022 394 HB1 ALA 53 HB1 ALA 53 42.680 41.676 -31.303 395 HB2 ALA 53 HB2 ALA 53 42.774 41.438 -29.558 396 HB3 ALA 53 HB3 ALA 53 43.459 40.235 -30.650 397 H VAL 54 HN VAL 54 43.793 43.912 -31.957 398 HA VAL 54 HA VAL 54 44.760 42.944 -34.465 399 HB VAL 54 HB VAL 54 42.869 44.765 -33.710 400 HG11 VAL 54 HG11 VAL 54 45.069 46.370 -35.036 401 HG12 VAL 54 HG12 VAL 54 44.768 46.415 -33.299 402 HG13 VAL 54 HG13 VAL 54 43.524 46.956 -34.423 403 HG21 VAL 54 HG21 VAL 54 42.781 45.284 -36.187 404 HG22 VAL 54 HG22 VAL 54 42.827 43.564 -35.800 405 HG23 VAL 54 HG23 VAL 54 44.286 44.381 -36.361 406 H GLU 55 HN GLU 55 46.142 44.856 -31.934 407 HA GLU 55 HA GLU 55 48.118 46.166 -33.561 408 HB2 GLU 55 HB2 GLU 55 47.243 46.915 -31.261 409 HB3 GLU 55 HB1 GLU 55 48.329 45.697 -30.591 410 HG2 GLU 55 HG2 GLU 55 49.331 47.719 -32.586 411 HG3 GLU 55 HG1 GLU 55 49.225 48.122 -30.874 412 H VAL 56 HN VAL 56 48.336 43.567 -31.111 413 HA VAL 56 HA VAL 56 51.005 42.893 -31.592 414 HB VAL 56 HB VAL 56 49.727 42.088 -29.642 415 HG11 VAL 56 HG11 VAL 56 48.408 40.185 -31.599 416 HG12 VAL 56 HG12 VAL 56 47.622 41.621 -30.942 417 HG13 VAL 56 HG13 VAL 56 48.102 40.309 -29.867 418 HG21 VAL 56 HG21 VAL 56 50.728 39.908 -29.550 419 HG22 VAL 56 HG22 VAL 56 51.786 40.896 -30.556 420 HG23 VAL 56 HG23 VAL 56 50.682 39.744 -31.305 421 H LEU 57 HN LEU 57 48.043 41.858 -33.193 422 HA LEU 57 HA LEU 57 48.967 39.709 -34.674 423 HB2 LEU 57 HB2 LEU 57 46.730 41.540 -34.816 424 HB3 LEU 57 HB1 LEU 57 47.310 41.143 -36.433 425 HG LEU 57 HG LEU 57 47.353 38.687 -35.551 426 HD11 LEU 57 HD11 LEU 57 46.893 39.495 -33.173 427 HD12 LEU 57 HD12 LEU 57 45.862 38.185 -33.749 428 HD13 LEU 57 HD13 LEU 57 45.247 39.837 -33.707 429 HD21 LEU 57 HD21 LEU 57 45.775 39.730 -37.253 430 HD22 LEU 57 HD22 LEU 57 44.650 40.004 -35.923 431 HD23 LEU 57 HD23 LEU 57 45.113 38.360 -36.362 432 H LYS 58 HN LYS 58 49.174 43.169 -35.387 433 HA LYS 58 HA LYS 58 50.417 42.977 -37.923 434 HB2 LYS 58 HB2 LYS 58 50.427 45.140 -35.815 435 HB3 LYS 58 HB1 LYS 58 51.185 45.329 -37.396 436 HG2 LYS 58 HG2 LYS 58 48.307 44.458 -37.125 437 HG3 LYS 58 HG1 LYS 58 48.756 46.163 -37.152 438 HD2 LYS 58 HD2 LYS 58 49.962 45.749 -39.315 439 HD3 LYS 58 HD1 LYS 58 49.318 44.107 -39.306 440 HE2 LYS 58 HE2 LYS 58 47.599 46.600 -39.189 441 HE3 LYS 58 HE1 LYS 58 47.947 45.708 -40.670 442 HZ1 LYS 58 HZ1 LYS 58 47.122 43.709 -39.225 443 HZ2 LYS 58 HZ2 LYS 58 46.015 44.717 -40.027 444 HZ3 LYS 58 HZ3 LYS 58 46.311 44.927 -38.368 445 H ARG 59 HN ARG 59 51.710 43.182 -34.634 446 HA ARG 59 HA ARG 59 54.438 43.411 -35.330 447 HB2 ARG 59 HB2 ARG 59 53.305 43.769 -33.042 448 HB3 ARG 59 HB1 ARG 59 53.454 42.023 -32.846 449 HG2 ARG 59 HG2 ARG 59 55.913 43.322 -33.807 450 HG3 ARG 59 HG1 ARG 59 55.413 43.843 -32.197 451 HD2 ARG 59 HD2 ARG 59 55.225 41.455 -31.518 452 HD3 ARG 59 HD1 ARG 59 55.821 40.980 -33.105 453 HE ARG 59 HE ARG 59 57.683 42.766 -32.042 454 HH11 ARG 59 HH11 ARG 59 56.346 39.632 -31.297 455 HH12 ARG 59 HH12 ARG 59 57.782 39.075 -30.510 456 HH21 ARG 59 HH21 ARG 59 59.545 42.012 -31.009 457 HH22 ARG 59 HH22 ARG 59 59.583 40.412 -30.347 458 H GLU 60 HN GLU 60 52.261 40.707 -35.260 459 HA GLU 60 HA GLU 60 54.522 38.848 -35.658 460 HB2 GLU 60 HB2 GLU 60 51.671 38.329 -34.790 461 HB3 GLU 60 HB1 GLU 60 52.869 37.071 -35.097 462 HG2 GLU 60 HG2 GLU 60 53.181 39.306 -33.072 463 HG3 GLU 60 HG1 GLU 60 52.722 37.649 -32.684 464 HA PRO 61 HA PRO 61 52.478 39.387 -39.804 465 HB2 PRO 61 HB2 PRO 61 54.849 39.181 -41.206 466 HB3 PRO 61 HB1 PRO 61 54.150 40.708 -40.637 467 HG2 PRO 61 HG2 PRO 61 56.341 39.077 -39.468 468 HG3 PRO 61 HG1 PRO 61 56.165 40.837 -39.560 469 HD2 PRO 61 HD2 PRO 61 55.686 39.433 -37.274 470 HD3 PRO 61 HD1 PRO 61 54.830 40.939 -37.669 471 H LEU 62 HN LEU 62 54.462 37.024 -38.287 472 HA LEU 62 HA LEU 62 54.734 35.074 -40.260 473 HB2 LEU 62 HB2 LEU 62 55.844 34.934 -38.075 474 HB3 LEU 62 HB1 LEU 62 54.284 34.704 -37.287 475 HG LEU 62 HG LEU 62 53.945 32.629 -38.622 476 HD11 LEU 62 HD11 LEU 62 55.271 33.062 -40.573 477 HD12 LEU 62 HD12 LEU 62 56.041 31.711 -39.742 478 HD13 LEU 62 HD13 LEU 62 56.720 33.333 -39.606 479 HD21 LEU 62 HD21 LEU 62 55.444 31.266 -37.331 480 HD22 LEU 62 HD22 LEU 62 55.064 32.673 -36.338 481 HD23 LEU 62 HD23 LEU 62 56.610 32.582 -37.183 482 H ASN 63 HN ASN 63 52.051 35.768 -38.062 483 HA ASN 63 HA ASN 63 50.452 33.556 -39.013 484 HB2 ASN 63 HB2 ASN 63 48.659 34.704 -37.629 485 HB3 ASN 63 HB1 ASN 63 50.096 34.192 -36.747 486 HD21 ASN 63 HD21 ASN 63 48.945 37.108 -38.551 487 HD22 ASN 63 HD22 ASN 63 49.605 38.218 -37.450 488 H TYR 64 HN TYR 64 51.016 36.824 -39.964 489 HA TYR 64 HA TYR 64 48.502 37.255 -41.276 490 HB2 TYR 64 HB2 TYR 64 49.929 39.124 -40.524 491 HB3 TYR 64 HB1 TYR 64 51.165 38.637 -41.684 492 HD1 TYR 64 HD1 TYR 64 47.638 39.799 -41.377 493 HD2 TYR 64 HD2 TYR 64 51.012 39.244 -43.977 494 HE1 TYR 64 HE1 TYR 64 46.481 41.087 -43.154 495 HE2 TYR 64 HE2 TYR 64 49.856 40.531 -45.753 496 HH TYR 64 HH TYR 64 47.079 42.398 -45.157 497 H LEU 65 HN LEU 65 51.688 36.084 -42.244 498 HA LEU 65 HA LEU 65 51.075 35.970 -45.041 499 HB2 LEU 65 HB2 LEU 65 53.253 34.649 -43.404 500 HB3 LEU 65 HB1 LEU 65 53.171 34.615 -45.165 501 HG LEU 65 HG LEU 65 53.201 37.178 -43.552 502 HD11 LEU 65 HD11 LEU 65 55.573 37.353 -44.161 503 HD12 LEU 65 HD12 LEU 65 55.496 35.789 -44.973 504 HD13 LEU 65 HD13 LEU 65 55.297 35.886 -43.223 505 HD21 LEU 65 HD21 LEU 65 53.966 38.048 -45.837 506 HD22 LEU 65 HD22 LEU 65 52.283 37.535 -45.735 507 HD23 LEU 65 HD23 LEU 65 53.480 36.483 -46.487 508 HA PRO 66 HA PRO 66 48.863 32.191 -45.492 509 HB2 PRO 66 HB2 PRO 66 51.033 31.177 -47.271 510 HB3 PRO 66 HB1 PRO 66 49.293 31.321 -47.583 511 HG2 PRO 66 HG2 PRO 66 51.038 33.012 -48.663 512 HG3 PRO 66 HG1 PRO 66 49.436 33.547 -48.125 513 HD2 PRO 66 HD2 PRO 66 52.098 33.993 -46.843 514 HD3 PRO 66 HD1 PRO 66 50.661 35.038 -46.858 515 H LEU 67 HN LEU 67 48.729 30.279 -44.397 516 HA LEU 67 HA LEU 67 51.020 28.646 -43.813 517 HB2 LEU 67 HB2 LEU 67 50.682 30.763 -42.081 518 HB3 LEU 67 HB1 LEU 67 49.825 29.457 -41.264 519 HG LEU 67 HG LEU 67 52.564 28.997 -42.431 520 HD11 LEU 67 HD11 LEU 67 52.029 29.896 -39.590 521 HD12 LEU 67 HD12 LEU 67 52.556 31.000 -40.860 522 HD13 LEU 67 HD13 LEU 67 53.594 29.661 -40.369 523 HD21 LEU 67 HD21 LEU 67 51.395 27.005 -41.765 524 HD22 LEU 67 HD22 LEU 67 50.870 27.745 -40.253 525 HD23 LEU 67 HD23 LEU 67 52.570 27.343 -40.494 Start of MODEL 18 1 H1 THR 1 HT1 THR 1 -3.246 -4.277 -1.260 2 H2 THR 1 HT2 THR 1 -3.969 -4.265 0.277 3 H3 THR 1 HT3 THR 1 -3.465 -5.732 -0.417 4 HA THR 1 HA THR 1 -1.609 -5.497 0.750 5 HB THR 1 HB THR 1 -1.354 -4.249 -1.743 6 HG1 THR 1 HG1 THR 1 0.192 -5.619 -1.448 7 HG21 THR 1 HG21 THR 1 0.191 -2.411 -1.399 8 HG22 THR 1 HG22 THR 1 0.118 -2.622 0.348 9 HG23 THR 1 HG23 THR 1 -1.302 -2.055 -0.534 10 HA PRO 2 HA PRO 2 -1.994 -2.456 3.918 11 HB2 PRO 2 HB2 PRO 2 0.555 -2.236 4.863 12 HB3 PRO 2 HB1 PRO 2 -0.456 -3.668 5.132 13 HG2 PRO 2 HG2 PRO 2 1.738 -3.241 3.172 14 HG3 PRO 2 HG1 PRO 2 1.324 -4.686 4.110 15 HD2 PRO 2 HD2 PRO 2 0.664 -4.352 1.457 16 HD3 PRO 2 HD1 PRO 2 -0.242 -5.394 2.574 17 H ILE 3 HN ILE 3 -1.522 -0.262 4.556 18 HA ILE 3 HA ILE 3 -0.266 1.327 2.401 19 HB ILE 3 HB ILE 3 -2.720 1.668 2.707 20 HG12 ILE 3 HG12 ILE 3 -2.544 4.184 2.984 21 HG13 ILE 3 HG11 ILE 3 -0.841 3.951 3.379 22 HG21 ILE 3 HG21 ILE 3 -2.707 1.244 5.173 23 HG22 ILE 3 HG22 ILE 3 -3.523 2.746 4.739 24 HG23 ILE 3 HG23 ILE 3 -1.888 2.790 5.400 25 HD11 ILE 3 HD11 ILE 3 -2.070 2.863 0.838 26 HD12 ILE 3 HD12 ILE 3 -0.359 3.061 1.219 27 HD13 ILE 3 HD13 ILE 3 -1.366 4.478 0.929 28 H GLU 4 HN GLU 4 1.226 2.875 2.923 29 HA GLU 4 HA GLU 4 2.799 2.565 5.209 30 HB2 GLU 4 HB2 GLU 4 3.897 4.629 4.551 31 HB3 GLU 4 HB1 GLU 4 3.530 3.685 3.106 32 HG2 GLU 4 HG2 GLU 4 1.450 5.028 2.803 33 HG3 GLU 4 HG1 GLU 4 1.921 6.018 4.183 34 H SER 5 HN SER 5 3.225 4.239 6.885 35 HA SER 5 HA SER 5 0.897 4.759 8.401 36 HB2 SER 5 HB2 SER 5 3.688 5.900 8.648 37 HB3 SER 5 HB1 SER 5 2.420 6.083 9.856 38 HG SER 5 HG SER 5 2.330 3.747 9.886 39 H HIS 6 HN HIS 6 -0.173 6.687 8.873 40 HA HIS 6 HA HIS 6 -0.024 8.698 6.743 41 HB2 HIS 6 HB2 HIS 6 -2.187 9.468 7.615 42 HB3 HIS 6 HB1 HIS 6 -2.227 7.737 7.278 43 HD1 HIS 6 HD1 HIS 6 -2.007 10.181 10.155 44 HD2 HIS 6 HD2 HIS 6 -2.611 6.102 9.537 45 HE1 HIS 6 HE1 HIS 6 -2.692 9.211 12.392 46 HE2 HIS 6 HE2 HIS 6 -3.064 6.725 12.032 47 H GLN 7 HN GLN 7 1.938 8.462 9.008 48 HA GLN 7 HA GLN 7 1.488 10.602 10.829 49 HB2 GLN 7 HB2 GLN 7 4.030 9.214 9.953 50 HB3 GLN 7 HB1 GLN 7 3.948 10.395 11.261 51 HG2 GLN 7 HG2 GLN 7 2.300 8.979 12.435 52 HG3 GLN 7 HG1 GLN 7 2.393 7.795 11.133 53 HE21 GLN 7 HE21 GLN 7 3.454 6.056 12.168 54 HE22 GLN 7 HE22 GLN 7 4.971 6.190 12.918 55 H VAL 8 HN VAL 8 2.385 12.685 10.861 56 HA VAL 8 HA VAL 8 3.523 13.659 8.320 57 HB VAL 8 HB VAL 8 1.155 14.233 8.278 58 HG11 VAL 8 HG11 VAL 8 0.613 14.126 10.629 59 HG12 VAL 8 HG12 VAL 8 0.282 15.770 10.084 60 HG13 VAL 8 HG13 VAL 8 1.748 15.424 11.001 61 HG21 VAL 8 HG21 VAL 8 2.947 15.887 7.533 62 HG22 VAL 8 HG22 VAL 8 2.721 16.698 9.083 63 HG23 VAL 8 HG23 VAL 8 1.384 16.599 7.936 64 H GLU 9 HN GLU 9 4.973 15.363 8.507 65 HA GLU 9 HA GLU 9 5.576 16.333 11.221 66 HB2 GLU 9 HB2 GLU 9 8.076 16.125 10.352 67 HB3 GLU 9 HB1 GLU 9 7.272 14.777 11.155 68 HG2 GLU 9 HG2 GLU 9 8.433 14.127 9.026 69 HG3 GLU 9 HG1 GLU 9 6.709 13.764 9.027 70 H LYS 10 HN LYS 10 7.274 18.147 11.071 71 HA LYS 10 HA LYS 10 6.979 19.708 8.593 72 HB2 LYS 10 HB2 LYS 10 6.605 21.748 10.088 73 HB3 LYS 10 HB1 LYS 10 5.244 20.639 9.917 74 HG2 LYS 10 HG2 LYS 10 7.084 19.950 12.112 75 HG3 LYS 10 HG1 LYS 10 6.256 21.494 12.322 76 HD2 LYS 10 HD2 LYS 10 4.095 20.456 12.082 77 HD3 LYS 10 HD1 LYS 10 4.825 18.925 11.595 78 HE2 LYS 10 HE2 LYS 10 6.064 19.190 13.943 79 HE3 LYS 10 HE1 LYS 10 4.636 20.156 14.311 80 HZ1 LYS 10 HZ1 LYS 10 4.442 17.458 13.114 81 HZ2 LYS 10 HZ2 LYS 10 3.226 18.356 13.888 82 HZ3 LYS 10 HZ3 LYS 10 4.502 17.692 14.792 83 H ARG 11 HN ARG 11 8.464 21.627 8.598 84 HA ARG 11 HA ARG 11 10.871 21.148 10.225 85 HB2 ARG 11 HB2 ARG 11 12.085 21.990 8.016 86 HB3 ARG 11 HB1 ARG 11 11.737 20.289 8.282 87 HG2 ARG 11 HG2 ARG 11 11.023 20.712 6.065 88 HG3 ARG 11 HG1 ARG 11 9.531 20.712 6.990 89 HD2 ARG 11 HD2 ARG 11 11.022 23.287 6.576 90 HD3 ARG 11 HD1 ARG 11 10.022 22.648 5.280 91 HE ARG 11 HE ARG 11 9.092 23.799 7.765 92 HH11 ARG 11 HH11 ARG 11 8.355 21.669 5.103 93 HH12 ARG 11 HH12 ARG 11 6.645 21.837 5.288 94 HH21 ARG 11 HH21 ARG 11 6.852 23.999 7.982 95 HH22 ARG 11 HH22 ARG 11 5.797 23.146 6.907 96 H LYS 12 HN LYS 12 9.478 22.935 11.308 97 HA LYS 12 HA LYS 12 9.207 25.501 10.321 98 HB2 LYS 12 HB2 LYS 12 8.935 26.206 12.531 99 HB3 LYS 12 HB1 LYS 12 8.531 24.491 12.623 100 HG2 LYS 12 HG2 LYS 12 10.989 24.086 13.203 101 HG3 LYS 12 HG1 LYS 12 11.122 25.832 13.423 102 HD2 LYS 12 HD2 LYS 12 10.613 25.083 15.588 103 HD3 LYS 12 HD1 LYS 12 9.033 25.555 14.961 104 HE2 LYS 12 HE2 LYS 12 8.785 23.385 15.988 105 HE3 LYS 12 HE1 LYS 12 8.696 23.158 14.242 106 HZ1 LYS 12 HZ1 LYS 12 10.243 21.674 15.711 107 HZ2 LYS 12 HZ2 LYS 12 11.314 22.982 15.547 108 HZ3 LYS 12 HZ3 LYS 12 10.736 22.176 14.168 109 H CYS 13 HN CYS 13 10.483 27.401 10.486 110 HA CYS 13 HA CYS 13 13.302 26.939 9.997 111 HB2 CYS 13 HB2 CYS 13 11.669 28.650 8.856 112 HB3 CYS 13 HB1 CYS 13 12.074 29.662 10.241 113 H ASN 14 HN ASN 14 13.897 26.155 12.117 114 HA ASN 14 HA ASN 14 14.229 28.354 14.067 115 HB2 ASN 14 HB2 ASN 14 13.973 26.739 15.876 116 HB3 ASN 14 HB1 ASN 14 12.545 26.715 14.843 117 HD21 ASN 14 HD21 ASN 14 12.849 24.435 16.287 118 HD22 ASN 14 HD22 ASN 14 13.461 23.170 15.337 119 H THR 15 HN THR 15 16.048 27.399 11.942 120 HA THR 15 HA THR 15 18.212 26.224 13.564 121 HB THR 15 HB THR 15 17.642 24.986 11.524 122 HG1 THR 15 HG1 THR 15 19.845 25.187 12.230 123 HG21 THR 15 HG21 THR 15 18.227 27.633 10.183 124 HG22 THR 15 HG22 THR 15 16.726 26.710 10.128 125 HG23 THR 15 HG23 THR 15 18.166 26.103 9.312 126 H ALA 16 HN ALA 16 20.460 26.992 12.543 127 HA ALA 16 HA ALA 16 20.710 29.750 13.258 128 HB1 ALA 16 HB1 ALA 16 22.701 27.859 11.982 129 HB2 ALA 16 HB2 ALA 16 22.511 28.162 13.709 130 HB3 ALA 16 HB3 ALA 16 23.089 29.446 12.648 131 H THR 17 HN THR 17 20.342 28.022 10.267 132 HA THR 17 HA THR 17 21.333 29.953 8.465 133 HB THR 17 HB THR 17 19.094 27.949 8.083 134 HG1 THR 17 HG1 THR 17 21.202 27.142 8.662 135 HG21 THR 17 HG21 THR 17 19.766 28.201 5.657 136 HG22 THR 17 HG22 THR 17 20.710 29.611 6.139 137 HG23 THR 17 HG23 THR 17 18.959 29.608 6.349 138 H CYS 18 HN CYS 18 18.205 29.566 10.033 139 HA CYS 18 HA CYS 18 16.767 31.499 8.571 140 HB2 CYS 18 HB2 CYS 18 16.183 29.733 10.598 141 HB3 CYS 18 HB1 CYS 18 16.051 31.296 11.405 142 H ALA 19 HN ALA 19 18.802 31.755 11.460 143 HA ALA 19 HA ALA 19 18.204 34.373 12.209 144 HB1 ALA 19 HB1 ALA 19 20.640 32.648 12.472 145 HB2 ALA 19 HB2 ALA 19 19.577 33.280 13.729 146 HB3 ALA 19 HB3 ALA 19 20.730 34.349 12.931 147 H THR 20 HN THR 20 20.364 33.166 9.690 148 HA THR 20 HA THR 20 21.643 35.591 9.057 149 HB THR 20 HB THR 20 20.924 33.281 7.232 150 HG1 THR 20 HG1 THR 20 22.508 32.324 8.189 151 HG21 THR 20 HG21 THR 20 22.940 35.525 6.941 152 HG22 THR 20 HG22 THR 20 21.487 35.300 5.968 153 HG23 THR 20 HG23 THR 20 22.808 34.137 5.861 154 H GLN 21 HN GLN 21 18.572 34.199 7.992 155 HA GLN 21 HA GLN 21 17.954 36.046 5.975 156 HB2 GLN 21 HB2 GLN 21 15.989 34.937 5.856 157 HB3 GLN 21 HB1 GLN 21 16.720 33.839 7.025 158 HG2 GLN 21 HG2 GLN 21 15.790 35.350 8.850 159 HG3 GLN 21 HG1 GLN 21 14.873 36.171 7.589 160 HE21 GLN 21 HE21 GLN 21 13.039 35.218 9.081 161 HE22 GLN 21 HE22 GLN 21 12.482 33.669 8.667 162 H ARG 22 HN ARG 22 17.860 36.346 9.450 163 HA ARG 22 HA ARG 22 16.121 38.622 9.494 164 HB2 ARG 22 HB2 ARG 22 16.315 38.545 11.766 165 HB3 ARG 22 HB1 ARG 22 16.887 36.920 11.414 166 HG2 ARG 22 HG2 ARG 22 18.584 37.633 12.801 167 HG3 ARG 22 HG1 ARG 22 19.248 38.171 11.267 168 HD2 ARG 22 HD2 ARG 22 19.274 40.275 12.066 169 HD3 ARG 22 HD1 ARG 22 17.515 40.229 12.146 170 HE ARG 22 HE ARG 22 17.694 40.005 14.441 171 HH11 ARG 22 HH11 ARG 22 20.713 39.129 12.932 172 HH12 ARG 22 HH12 ARG 22 21.547 38.942 14.436 173 HH21 ARG 22 HH21 ARG 22 18.807 39.752 16.391 174 HH22 ARG 22 HH22 ARG 22 20.477 39.292 16.383 175 H LEU 23 HN LEU 23 19.511 38.122 8.960 176 HA LEU 23 HA LEU 23 20.453 40.719 9.566 177 HB2 LEU 23 HB2 LEU 23 21.955 38.794 9.218 178 HB3 LEU 23 HB1 LEU 23 21.489 38.738 7.519 179 HG LEU 23 HG LEU 23 22.341 41.073 7.249 180 HD11 LEU 23 HD11 LEU 23 22.159 41.947 9.470 181 HD12 LEU 23 HD12 LEU 23 23.886 41.859 9.125 182 HD13 LEU 23 HD13 LEU 23 23.126 40.632 10.139 183 HD21 LEU 23 HD21 LEU 23 24.788 40.444 7.557 184 HD22 LEU 23 HD22 LEU 23 23.831 39.298 6.618 185 HD23 LEU 23 HD23 LEU 23 24.225 38.947 8.300 186 H ALA 24 HN ALA 24 19.097 39.279 6.636 187 HA ALA 24 HA ALA 24 19.537 41.466 4.902 188 HB1 ALA 24 HB1 ALA 24 17.624 39.152 4.927 189 HB2 ALA 24 HB2 ALA 24 18.927 39.507 3.793 190 HB3 ALA 24 HB3 ALA 24 17.431 40.438 3.736 191 H ASN 25 HN ASN 25 16.981 40.710 7.198 192 HA ASN 25 HA ASN 25 15.174 42.759 6.425 193 HB2 ASN 25 HB2 ASN 25 15.560 41.232 9.001 194 HB3 ASN 25 HB1 ASN 25 14.279 42.422 8.778 195 HD21 ASN 25 HD21 ASN 25 13.739 39.614 9.215 196 HD22 ASN 25 HD22 ASN 25 13.021 39.003 7.804 197 H PHE 26 HN PHE 26 18.080 42.736 8.326 198 HA PHE 26 HA PHE 26 17.633 45.114 9.814 199 HB2 PHE 26 HB2 PHE 26 19.384 43.435 10.361 200 HB3 PHE 26 HB1 PHE 26 20.273 43.934 8.921 201 HD1 PHE 26 HD1 PHE 26 18.953 45.108 12.194 202 HD2 PHE 26 HD2 PHE 26 21.574 45.934 8.893 203 HE1 PHE 26 HE1 PHE 26 19.959 46.986 13.463 204 HE2 PHE 26 HE2 PHE 26 22.580 47.813 10.162 205 HZ PHE 26 HZ PHE 26 21.773 48.339 12.447 206 H LEU 27 HN LEU 27 19.023 44.486 6.619 207 HA LEU 27 HA LEU 27 20.050 47.055 6.150 208 HB2 LEU 27 HB2 LEU 27 20.587 45.072 4.762 209 HB3 LEU 27 HB1 LEU 27 18.935 45.037 4.170 210 HG LEU 27 HG LEU 27 20.776 46.113 2.688 211 HD11 LEU 27 HD11 LEU 27 18.407 47.924 3.093 212 HD12 LEU 27 HD12 LEU 27 18.180 46.275 2.511 213 HD13 LEU 27 HD13 LEU 27 19.173 47.404 1.594 214 HD21 LEU 27 HD21 LEU 27 21.552 47.563 4.691 215 HD22 LEU 27 HD22 LEU 27 20.165 48.581 4.311 216 HD23 LEU 27 HD23 LEU 27 21.431 48.335 3.111 217 H VAL 28 HN VAL 28 16.841 45.673 5.521 218 HA VAL 28 HA VAL 28 15.829 48.164 4.425 219 HB VAL 28 HB VAL 28 13.677 47.001 4.340 220 HG11 VAL 28 HG11 VAL 28 15.517 46.584 2.630 221 HG12 VAL 28 HG12 VAL 28 14.286 45.326 2.739 222 HG13 VAL 28 HG13 VAL 28 15.862 45.086 3.493 223 HG21 VAL 28 HG21 VAL 28 15.141 44.740 5.737 224 HG22 VAL 28 HG22 VAL 28 13.476 44.696 5.160 225 HG23 VAL 28 HG23 VAL 28 13.921 45.770 6.486 226 H HIS 29 HN HIS 29 15.957 46.576 7.525 227 HA HIS 29 HA HIS 29 13.932 48.149 8.784 228 HB2 HIS 29 HB2 HIS 29 14.714 45.960 9.668 229 HB3 HIS 29 HB1 HIS 29 16.269 46.699 10.050 230 HD1 HIS 29 HD1 HIS 29 12.576 47.289 10.821 231 HD2 HIS 29 HD2 HIS 29 16.322 47.850 12.562 232 HE1 HIS 29 HE1 HIS 29 12.155 48.188 13.151 233 HE2 HIS 29 HE2 HIS 29 14.430 48.536 14.225 234 H SER 30 HN SER 30 17.282 48.616 8.052 235 HA SER 30 HA SER 30 17.222 51.155 9.562 236 HB2 SER 30 HB2 SER 30 19.006 49.112 9.946 237 HB3 SER 30 HB1 SER 30 19.884 50.146 8.822 238 HG SER 30 HG SER 30 19.577 50.490 11.399 239 H SER 31 HN SER 31 16.563 50.327 6.653 240 HA SER 31 HA SER 31 18.492 51.561 4.970 241 HB2 SER 31 HB2 SER 31 16.870 49.959 4.092 242 HB3 SER 31 HB1 SER 31 15.545 51.039 4.518 243 HG SER 31 HG SER 31 16.021 51.418 2.394 244 H ASN 32 HN ASN 32 15.636 52.754 6.662 245 HA ASN 32 HA ASN 32 15.441 55.252 5.362 246 HB2 ASN 32 HB2 ASN 32 14.229 55.940 7.460 247 HB3 ASN 32 HB1 ASN 32 13.601 54.485 6.690 248 HD21 ASN 32 HD21 ASN 32 14.469 55.711 9.682 249 HD22 ASN 32 HD22 ASN 32 14.794 54.251 10.483 250 H ASN 33 HN ASN 33 17.324 54.150 8.130 251 HA ASN 33 HA ASN 33 18.228 56.723 8.921 252 HB2 ASN 33 HB2 ASN 33 19.321 53.949 9.418 253 HB3 ASN 33 HB1 ASN 33 20.045 55.401 10.108 254 HD21 ASN 33 HD21 ASN 33 18.157 56.915 11.138 255 HD22 ASN 33 HD22 ASN 33 17.082 56.073 12.146 256 H PHE 34 HN PHE 34 19.437 54.266 6.732 257 HA PHE 34 HA PHE 34 22.002 55.101 6.206 258 HB2 PHE 34 HB2 PHE 34 20.997 53.111 5.169 259 HB3 PHE 34 HB1 PHE 34 19.978 54.145 4.167 260 HD1 PHE 34 HD1 PHE 34 23.550 53.407 4.988 261 HD2 PHE 34 HD2 PHE 34 20.777 54.998 2.119 262 HE1 PHE 34 HE1 PHE 34 25.381 53.606 3.328 263 HE2 PHE 34 HE2 PHE 34 22.609 55.197 0.459 264 HZ PHE 34 HZ PHE 34 24.911 54.501 1.064 265 H GLY 35 HN GLY 35 18.995 56.421 4.873 266 HA2 GLY 35 HA2 GLY 35 20.173 58.278 3.086 267 HA3 GLY 35 HA1 GLY 35 18.546 58.383 3.765 268 H ALA 36 HN ALA 36 18.961 58.703 6.426 269 HA ALA 36 HA ALA 36 19.617 61.419 6.643 270 HB1 ALA 36 HB1 ALA 36 19.167 61.210 8.931 271 HB2 ALA 36 HB2 ALA 36 19.776 59.557 8.997 272 HB3 ALA 36 HB3 ALA 36 18.226 59.895 8.228 273 H ILE 37 HN ILE 37 21.551 58.520 7.162 274 HA ILE 37 HA ILE 37 23.755 59.689 8.452 275 HB ILE 37 HB ILE 37 23.509 57.282 6.653 276 HG12 ILE 37 HG12 ILE 37 24.102 57.534 9.617 277 HG13 ILE 37 HG11 ILE 37 22.475 57.325 8.971 278 HG21 ILE 37 HG21 ILE 37 25.824 56.728 7.577 279 HG22 ILE 37 HG22 ILE 37 25.933 58.418 8.069 280 HG23 ILE 37 HG23 ILE 37 25.776 58.004 6.362 281 HD11 ILE 37 HD11 ILE 37 23.217 55.129 9.516 282 HD12 ILE 37 HD12 ILE 37 24.805 55.407 8.801 283 HD13 ILE 37 HD13 ILE 37 23.387 55.252 7.766 284 H LEU 38 HN LEU 38 22.927 59.374 5.037 285 HA LEU 38 HA LEU 38 25.344 60.228 3.903 286 HB2 LEU 38 HB2 LEU 38 23.496 59.228 2.605 287 HB3 LEU 38 HB1 LEU 38 22.530 60.678 2.876 288 HG LEU 38 HG LEU 38 24.318 62.021 1.747 289 HD11 LEU 38 HD11 LEU 38 26.261 60.658 2.063 290 HD12 LEU 38 HD12 LEU 38 25.933 60.638 0.331 291 HD13 LEU 38 HD13 LEU 38 25.480 59.257 1.330 292 HD21 LEU 38 HD21 LEU 38 22.411 61.354 0.427 293 HD22 LEU 38 HD22 LEU 38 23.056 59.725 0.223 294 HD23 LEU 38 HD23 LEU 38 23.848 61.091 -0.561 295 H SER 39 HN SER 39 22.676 62.039 5.306 296 HA SER 39 HA SER 39 23.377 64.599 4.331 297 HB2 SER 39 HB2 SER 39 21.199 64.131 5.363 298 HB3 SER 39 HB1 SER 39 21.987 63.835 6.911 299 HG SER 39 HG SER 39 21.279 65.956 6.858 300 H SER 40 HN SER 40 24.354 62.800 7.221 301 HA SER 40 HA SER 40 26.130 64.983 8.034 302 HB2 SER 40 HB2 SER 40 25.576 62.323 9.368 303 HB3 SER 40 HB1 SER 40 26.496 63.658 10.056 304 HG SER 40 HG SER 40 24.623 64.315 10.740 305 H THR 41 HN THR 41 26.664 63.508 5.576 306 HA THR 41 HA THR 41 28.631 61.535 5.850 307 HB THR 41 HB THR 41 27.530 62.116 3.710 308 HG1 THR 41 HG1 THR 41 30.351 62.285 3.847 309 HG21 THR 41 HG21 THR 41 28.133 64.098 2.497 310 HG22 THR 41 HG22 THR 41 29.382 64.508 3.673 311 HG23 THR 41 HG23 THR 41 27.680 64.613 4.122 312 H ASN 42 HN ASN 42 28.784 64.933 6.457 313 HA ASN 42 HA ASN 42 31.697 65.019 6.289 314 HB2 ASN 42 HB2 ASN 42 31.486 67.368 6.736 315 HB3 ASN 42 HB1 ASN 42 30.249 66.940 5.556 316 HD21 ASN 42 HD21 ASN 42 30.030 69.238 7.310 317 HD22 ASN 42 HD22 ASN 42 28.713 68.965 8.346 318 H VAL 43 HN VAL 43 30.110 63.383 8.328 319 HA VAL 43 HA VAL 43 30.887 64.644 10.842 320 HB VAL 43 HB VAL 43 28.710 63.335 10.435 321 HG11 VAL 43 HG11 VAL 43 30.495 60.957 10.989 322 HG12 VAL 43 HG12 VAL 43 30.013 61.407 9.354 323 HG13 VAL 43 HG13 VAL 43 28.790 60.959 10.542 324 HG21 VAL 43 HG21 VAL 43 30.364 62.362 12.776 325 HG22 VAL 43 HG22 VAL 43 28.630 62.673 12.723 326 HG23 VAL 43 HG23 VAL 43 29.768 64.019 12.675 327 H GLY 44 HN GLY 44 32.814 63.511 8.720 328 HA2 GLY 44 HA2 GLY 44 35.067 62.900 9.255 329 HA3 GLY 44 HA1 GLY 44 34.460 62.013 10.649 330 H SER 45 HN SER 45 32.244 61.019 8.697 331 HA SER 45 HA SER 45 33.755 58.668 7.832 332 HB2 SER 45 HB2 SER 45 31.531 57.672 7.456 333 HB3 SER 45 HB1 SER 45 31.682 58.308 9.092 334 HG SER 45 HG SER 45 29.718 58.866 7.843 335 H ASN 46 HN ASN 46 34.121 61.169 6.413 336 HA ASN 46 HA ASN 46 32.709 60.771 3.878 337 HB2 ASN 46 HB2 ASN 46 33.629 62.903 3.227 338 HB3 ASN 46 HB1 ASN 46 32.975 63.059 4.856 339 HD21 ASN 46 HD21 ASN 46 34.935 64.894 4.049 340 HD22 ASN 46 HD22 ASN 46 36.389 64.568 4.863 341 H THR 47 HN THR 47 34.888 58.961 4.990 342 HA THR 47 HA THR 47 36.933 59.283 2.900 343 HB THR 47 HB THR 47 37.026 57.193 5.052 344 HG1 THR 47 HG1 THR 47 36.841 58.837 6.375 345 HG21 THR 47 HG21 THR 47 38.698 57.247 3.201 346 HG22 THR 47 HG22 THR 47 39.426 57.509 4.786 347 HG23 THR 47 HG23 THR 47 39.155 58.874 3.703 348 H TYR 48 HN TYR 48 34.167 58.327 2.407 349 HA TYR 48 HA TYR 48 34.846 55.657 1.328 350 HB2 TYR 48 HB2 TYR 48 32.650 54.885 1.766 351 HB3 TYR 48 HB1 TYR 48 33.146 55.715 3.241 352 HD1 TYR 48 HD1 TYR 48 30.637 55.486 0.730 353 HD2 TYR 48 HD2 TYR 48 32.561 58.270 3.376 354 HE1 TYR 48 HE1 TYR 48 28.704 57.025 0.517 355 HE2 TYR 48 HE2 TYR 48 30.627 59.809 3.163 356 HH TYR 48 HH TYR 48 28.788 60.212 1.375 357 H GLY 49 HN GLY 49 34.953 58.471 0.194 358 HA2 GLY 49 HA2 GLY 49 32.907 58.953 -1.633 359 HA3 GLY 49 HA1 GLY 49 34.584 59.440 -1.861 360 H LYS 50 HN LYS 50 32.201 57.886 -3.365 361 HA LYS 50 HA LYS 50 33.337 55.446 -4.239 362 HB2 LYS 50 HB2 LYS 50 31.268 57.273 -5.466 363 HB3 LYS 50 HB1 LYS 50 31.713 55.715 -6.163 364 HG2 LYS 50 HG2 LYS 50 31.162 54.643 -3.958 365 HG3 LYS 50 HG1 LYS 50 30.557 56.205 -3.404 366 HD2 LYS 50 HD2 LYS 50 29.546 54.865 -5.922 367 HD3 LYS 50 HD1 LYS 50 28.798 54.615 -4.344 368 HE2 LYS 50 HE2 LYS 50 29.182 57.307 -5.689 369 HE3 LYS 50 HE1 LYS 50 27.662 56.416 -5.608 370 HZ1 LYS 50 HZ1 LYS 50 28.089 56.430 -3.095 371 HZ2 LYS 50 HZ2 LYS 50 27.533 57.860 -3.825 372 HZ3 LYS 50 HZ3 LYS 50 29.175 57.691 -3.422 373 H ARG 51 HN ARG 51 33.518 58.753 -5.469 374 HA ARG 51 HA ARG 51 34.698 58.329 -7.936 375 HB2 ARG 51 HB2 ARG 51 35.560 60.574 -7.786 376 HB3 ARG 51 HB1 ARG 51 33.986 60.546 -6.992 377 HG2 ARG 51 HG2 ARG 51 35.160 60.233 -4.798 378 HG3 ARG 51 HG1 ARG 51 36.696 60.444 -5.639 379 HD2 ARG 51 HD2 ARG 51 35.949 62.675 -6.413 380 HD3 ARG 51 HD1 ARG 51 34.440 62.467 -5.529 381 HE ARG 51 HE ARG 51 37.027 63.119 -4.406 382 HH11 ARG 51 HH11 ARG 51 33.875 61.745 -3.815 383 HH12 ARG 51 HH12 ARG 51 33.929 62.054 -2.115 384 HH21 ARG 51 HH21 ARG 51 37.068 63.511 -2.182 385 HH22 ARG 51 HH22 ARG 51 35.724 63.047 -1.194 386 H ASN 52 HN ASN 52 36.051 57.893 -4.772 387 HA ASN 52 HA ASN 52 38.794 58.070 -5.369 388 HB2 ASN 52 HB2 ASN 52 37.925 57.931 -3.071 389 HB3 ASN 52 HB1 ASN 52 37.408 56.271 -3.367 390 HD21 ASN 52 HD21 ASN 52 38.919 54.683 -2.844 391 HD22 ASN 52 HD22 ASN 52 40.584 54.956 -2.653 392 H ALA 53 HN ALA 53 36.512 55.376 -5.620 393 HA ALA 53 HA ALA 53 38.391 53.383 -6.329 394 HB1 ALA 53 HB1 ALA 53 36.244 52.371 -7.449 395 HB2 ALA 53 HB2 ALA 53 35.426 53.696 -6.621 396 HB3 ALA 53 HB3 ALA 53 36.339 52.506 -5.693 397 H VAL 54 HN VAL 54 36.411 55.587 -8.292 398 HA VAL 54 HA VAL 54 37.383 54.530 -10.783 399 HB VAL 54 HB VAL 54 35.198 55.994 -10.085 400 HG11 VAL 54 HG11 VAL 54 36.968 57.910 -11.623 401 HG12 VAL 54 HG12 VAL 54 36.747 58.014 -9.876 402 HG13 VAL 54 HG13 VAL 54 35.366 58.216 -10.952 403 HG21 VAL 54 HG21 VAL 54 34.717 56.037 -12.438 404 HG22 VAL 54 HG22 VAL 54 35.693 54.596 -12.151 405 HG23 VAL 54 HG23 VAL 54 36.432 56.037 -12.850 406 H GLU 55 HN GLU 55 38.517 56.872 -8.515 407 HA GLU 55 HA GLU 55 40.105 58.365 -10.403 408 HB2 GLU 55 HB2 GLU 55 39.204 59.229 -8.175 409 HB3 GLU 55 HB1 GLU 55 40.486 58.290 -7.410 410 HG2 GLU 55 HG2 GLU 55 41.107 60.200 -9.656 411 HG3 GLU 55 HG1 GLU 55 40.968 60.777 -7.997 412 H VAL 56 HN VAL 56 40.939 56.171 -7.705 413 HA VAL 56 HA VAL 56 43.656 55.966 -8.145 414 HB VAL 56 HB VAL 56 42.461 54.949 -6.224 415 HG11 VAL 56 HG11 VAL 56 41.728 52.774 -8.204 416 HG12 VAL 56 HG12 VAL 56 40.599 53.984 -7.596 417 HG13 VAL 56 HG13 VAL 56 41.323 52.819 -6.489 418 HG21 VAL 56 HG21 VAL 56 43.813 52.835 -6.184 419 HG22 VAL 56 HG22 VAL 56 44.749 54.247 -6.675 420 HG23 VAL 56 HG23 VAL 56 44.193 53.093 -7.887 421 H LEU 57 HN LEU 57 41.031 54.357 -9.852 422 HA LEU 57 HA LEU 57 42.653 52.530 -11.309 423 HB2 LEU 57 HB2 LEU 57 39.854 53.414 -11.344 424 HB3 LEU 57 HB1 LEU 57 40.481 52.995 -12.938 425 HG LEU 57 HG LEU 57 41.232 50.818 -12.100 426 HD11 LEU 57 HD11 LEU 57 41.801 51.304 -9.827 427 HD12 LEU 57 HD12 LEU 57 40.452 50.171 -9.755 428 HD13 LEU 57 HD13 LEU 57 40.176 51.890 -9.474 429 HD21 LEU 57 HD21 LEU 57 38.951 50.938 -12.956 430 HD22 LEU 57 HD22 LEU 57 38.360 51.497 -11.391 431 HD23 LEU 57 HD23 LEU 57 38.982 49.855 -11.563 432 H LYS 58 HN LYS 58 41.533 55.821 -11.910 433 HA LYS 58 HA LYS 58 42.473 56.054 -14.583 434 HB2 LYS 58 HB2 LYS 58 41.878 58.088 -12.431 435 HB3 LYS 58 HB1 LYS 58 42.385 58.535 -14.060 436 HG2 LYS 58 HG2 LYS 58 40.060 56.666 -13.603 437 HG3 LYS 58 HG1 LYS 58 39.844 58.417 -13.600 438 HD2 LYS 58 HD2 LYS 58 40.940 58.494 -15.858 439 HD3 LYS 58 HD1 LYS 58 40.951 56.730 -15.862 440 HE2 LYS 58 HE2 LYS 58 38.431 58.364 -15.482 441 HE3 LYS 58 HE1 LYS 58 38.978 57.786 -17.056 442 HZ1 LYS 58 HZ1 LYS 58 38.805 55.861 -14.858 443 HZ2 LYS 58 HZ2 LYS 58 38.557 55.631 -16.523 444 HZ3 LYS 58 HZ3 LYS 58 37.359 56.376 -15.578 445 H ARG 59 HN ARG 59 43.955 56.687 -11.431 446 HA ARG 59 HA ARG 59 46.301 57.934 -12.390 447 HB2 ARG 59 HB2 ARG 59 45.519 57.967 -10.017 448 HB3 ARG 59 HB1 ARG 59 45.999 56.275 -9.878 449 HG2 ARG 59 HG2 ARG 59 48.070 58.049 -11.010 450 HG3 ARG 59 HG1 ARG 59 47.651 58.386 -9.330 451 HD2 ARG 59 HD2 ARG 59 47.982 55.971 -8.804 452 HD3 ARG 59 HD1 ARG 59 48.504 55.707 -10.465 453 HE ARG 59 HE ARG 59 50.050 57.785 -9.344 454 HH11 ARG 59 HH11 ARG 59 49.532 54.348 -9.059 455 HH12 ARG 59 HH12 ARG 59 51.145 54.030 -8.520 456 HH21 ARG 59 HH21 ARG 59 52.150 57.341 -8.639 457 HH22 ARG 59 HH22 ARG 59 52.619 55.712 -8.283 458 H GLU 60 HN GLU 60 45.490 54.536 -11.793 459 HA GLU 60 HA GLU 60 47.996 53.789 -13.178 460 HB2 GLU 60 HB2 GLU 60 48.079 53.290 -10.741 461 HB3 GLU 60 HB1 GLU 60 46.663 52.257 -10.936 462 HG2 GLU 60 HG2 GLU 60 47.868 50.818 -12.487 463 HG3 GLU 60 HG1 GLU 60 49.266 51.892 -12.446 464 HA PRO 61 HA PRO 61 44.350 51.981 -15.397 465 HB2 PRO 61 HB2 PRO 61 45.138 52.699 -17.905 466 HB3 PRO 61 HB1 PRO 61 44.219 53.776 -16.837 467 HG2 PRO 61 HG2 PRO 61 47.127 53.756 -17.457 468 HG3 PRO 61 HG1 PRO 61 46.031 55.127 -17.218 469 HD2 PRO 61 HD2 PRO 61 47.776 54.210 -15.288 470 HD3 PRO 61 HD1 PRO 61 46.276 55.088 -14.928 471 H LEU 62 HN LEU 62 47.684 51.458 -15.271 472 HA LEU 62 HA LEU 62 48.123 49.592 -17.326 473 HB2 LEU 62 HB2 LEU 62 49.950 50.602 -16.028 474 HB3 LEU 62 HB1 LEU 62 49.401 49.756 -14.583 475 HG LEU 62 HG LEU 62 49.771 47.585 -15.751 476 HD11 LEU 62 HD11 LEU 62 49.525 48.201 -18.055 477 HD12 LEU 62 HD12 LEU 62 51.211 47.726 -17.850 478 HD13 LEU 62 HD13 LEU 62 50.779 49.434 -17.926 479 HD21 LEU 62 HD21 LEU 62 52.304 47.795 -15.826 480 HD22 LEU 62 HD22 LEU 62 51.551 48.363 -14.337 481 HD23 LEU 62 HD23 LEU 62 52.090 49.523 -15.551 482 H ASN 63 HN ASN 63 46.938 49.178 -14.001 483 HA ASN 63 HA ASN 63 46.852 46.351 -14.044 484 HB2 ASN 63 HB2 ASN 63 45.650 46.508 -12.031 485 HB3 ASN 63 HB1 ASN 63 46.636 47.969 -12.039 486 HD21 ASN 63 HD21 ASN 63 43.639 47.082 -11.180 487 HD22 ASN 63 HD22 ASN 63 42.757 48.461 -11.629 488 H TYR 64 HN TYR 64 44.761 48.802 -15.344 489 HA TYR 64 HA TYR 64 42.446 47.131 -15.649 490 HB2 TYR 64 HB2 TYR 64 42.319 49.608 -15.549 491 HB3 TYR 64 HB1 TYR 64 43.168 49.692 -17.093 492 HD1 TYR 64 HD1 TYR 64 40.116 48.302 -15.449 493 HD2 TYR 64 HD2 TYR 64 42.000 49.458 -19.133 494 HE1 TYR 64 HE1 TYR 64 37.970 47.977 -16.649 495 HE2 TYR 64 HE2 TYR 64 39.853 49.133 -20.332 496 HH TYR 64 HH TYR 64 37.179 47.543 -18.912 497 H LEU 65 HN LEU 65 45.195 48.035 -17.652 498 HA LEU 65 HA LEU 65 44.207 46.811 -20.044 499 HB2 LEU 65 HB2 LEU 65 46.973 47.699 -19.201 500 HB3 LEU 65 HB1 LEU 65 46.600 47.067 -20.804 501 HG LEU 65 HG LEU 65 45.011 49.348 -19.640 502 HD11 LEU 65 HD11 LEU 65 46.575 50.830 -20.994 503 HD12 LEU 65 HD12 LEU 65 47.672 49.451 -21.082 504 HD13 LEU 65 HD13 LEU 65 47.268 50.158 -19.518 505 HD21 LEU 65 HD21 LEU 65 44.586 49.819 -22.003 506 HD22 LEU 65 HD22 LEU 65 44.205 48.130 -21.670 507 HD23 LEU 65 HD23 LEU 65 45.711 48.550 -22.484 508 HA PRO 66 HA PRO 66 45.134 42.537 -19.544 509 HB2 PRO 66 HB2 PRO 66 46.925 42.683 -21.926 510 HB3 PRO 66 HB1 PRO 66 45.541 41.617 -21.618 511 HG2 PRO 66 HG2 PRO 66 45.367 43.667 -23.305 512 HG3 PRO 66 HG1 PRO 66 44.008 43.195 -22.270 513 HD2 PRO 66 HD2 PRO 66 45.850 45.532 -22.007 514 HD3 PRO 66 HD1 PRO 66 44.135 45.388 -21.564 515 H LEU 67 HN LEU 67 46.594 41.342 -18.399 516 HA LEU 67 HA LEU 67 49.440 41.972 -18.513 517 HB2 LEU 67 HB2 LEU 67 47.896 43.217 -16.584 518 HB3 LEU 67 HB1 LEU 67 48.538 41.808 -15.738 519 HG LEU 67 HG LEU 67 50.318 43.570 -17.420 520 HD11 LEU 67 HD11 LEU 67 49.489 43.912 -14.528 521 HD12 LEU 67 HD12 LEU 67 49.370 45.097 -15.829 522 HD13 LEU 67 HD13 LEU 67 50.951 44.635 -15.198 523 HD21 LEU 67 HD21 LEU 67 51.296 41.457 -16.831 524 HD22 LEU 67 HD22 LEU 67 50.714 41.581 -15.170 525 HD23 LEU 67 HD23 LEU 67 51.996 42.651 -15.738 Start of MODEL 19 1 H1 THR 1 HT1 THR 1 -2.642 -4.987 -1.197 2 H2 THR 1 HT2 THR 1 -2.646 -3.426 -0.526 3 H3 THR 1 HT3 THR 1 -3.556 -4.666 0.195 4 HA THR 1 HA THR 1 -1.797 -5.593 1.219 5 HB THR 1 HB THR 1 -0.743 -5.439 -1.367 6 HG1 THR 1 HG1 THR 1 0.173 -7.156 -0.613 7 HG21 THR 1 HG21 THR 1 1.521 -4.609 -1.110 8 HG22 THR 1 HG22 THR 1 1.236 -4.231 0.587 9 HG23 THR 1 HG23 THR 1 0.401 -3.319 -0.674 10 HA PRO 2 HA PRO 2 -0.667 -1.999 3.510 11 HB2 PRO 2 HB2 PRO 2 1.498 -2.845 4.933 12 HB3 PRO 2 HB1 PRO 2 -0.151 -3.411 5.259 13 HG2 PRO 2 HG2 PRO 2 2.058 -4.758 3.796 14 HG3 PRO 2 HG1 PRO 2 0.843 -5.441 4.889 15 HD2 PRO 2 HD2 PRO 2 0.692 -5.602 2.140 16 HD3 PRO 2 HD1 PRO 2 -0.720 -5.677 3.215 17 H ILE 3 HN ILE 3 0.800 -0.236 3.656 18 HA ILE 3 HA ILE 3 2.298 0.339 1.359 19 HB ILE 3 HB ILE 3 1.385 2.031 2.954 20 HG12 ILE 3 HG12 ILE 3 3.461 3.494 2.900 21 HG13 ILE 3 HG11 ILE 3 4.340 2.095 2.284 22 HG21 ILE 3 HG21 ILE 3 2.179 0.760 5.000 23 HG22 ILE 3 HG22 ILE 3 2.531 2.488 5.020 24 HG23 ILE 3 HG23 ILE 3 3.806 1.333 4.634 25 HD11 ILE 3 HD11 ILE 3 1.819 3.121 0.966 26 HD12 ILE 3 HD12 ILE 3 3.014 2.007 0.303 27 HD13 ILE 3 HD13 ILE 3 3.421 3.708 0.522 28 H GLU 4 HN GLU 4 4.373 0.015 0.780 29 HA GLU 4 HA GLU 4 5.952 -1.884 2.219 30 HB2 GLU 4 HB2 GLU 4 7.593 -1.557 0.451 31 HB3 GLU 4 HB1 GLU 4 5.982 -1.672 -0.257 32 HG2 GLU 4 HG2 GLU 4 5.858 0.813 -0.310 33 HG3 GLU 4 HG1 GLU 4 7.507 0.887 0.310 34 H SER 5 HN SER 5 8.193 -1.495 2.910 35 HA SER 5 HA SER 5 8.377 0.586 4.796 36 HB2 SER 5 HB2 SER 5 10.552 -1.116 3.560 37 HB3 SER 5 HB1 SER 5 10.769 -0.079 4.967 38 HG SER 5 HG SER 5 9.911 -1.603 6.115 39 H HIS 6 HN HIS 6 9.320 2.576 4.766 40 HA HIS 6 HA HIS 6 9.556 3.932 2.284 41 HB2 HIS 6 HB2 HIS 6 10.213 5.847 3.589 42 HB3 HIS 6 HB1 HIS 6 8.952 4.994 4.480 43 HD1 HIS 6 HD1 HIS 6 12.675 5.608 4.479 44 HD2 HIS 6 HD2 HIS 6 9.792 3.845 6.921 45 HE1 HIS 6 HE1 HIS 6 13.810 5.119 6.690 46 HE2 HIS 6 HE2 HIS 6 12.066 4.044 8.189 47 H GLN 7 HN GLN 7 11.806 2.165 4.246 48 HA GLN 7 HA GLN 7 14.176 3.339 3.090 49 HB2 GLN 7 HB2 GLN 7 14.168 2.363 5.367 50 HB3 GLN 7 HB1 GLN 7 13.856 0.774 4.666 51 HG2 GLN 7 HG2 GLN 7 15.957 0.929 3.378 52 HG3 GLN 7 HG1 GLN 7 16.274 2.510 4.090 53 HE21 GLN 7 HE21 GLN 7 17.592 2.443 5.910 54 HE22 GLN 7 HE22 GLN 7 17.765 1.103 6.938 55 H VAL 8 HN VAL 8 15.107 2.805 1.222 56 HA VAL 8 HA VAL 8 14.625 0.136 0.081 57 HB VAL 8 HB VAL 8 12.994 1.644 -0.974 58 HG11 VAL 8 HG11 VAL 8 14.257 3.747 -0.630 59 HG12 VAL 8 HG12 VAL 8 13.787 3.547 -2.318 60 HG13 VAL 8 HG13 VAL 8 15.446 3.218 -1.820 61 HG21 VAL 8 HG21 VAL 8 14.082 -0.171 -2.294 62 HG22 VAL 8 HG22 VAL 8 15.314 0.978 -2.815 63 HG23 VAL 8 HG23 VAL 8 13.634 1.207 -3.298 64 H GLU 9 HN GLU 9 16.331 -0.694 -1.067 65 HA GLU 9 HA GLU 9 18.596 1.018 -1.740 66 HB2 GLU 9 HB2 GLU 9 20.053 -0.865 -0.566 67 HB3 GLU 9 HB1 GLU 9 19.469 0.534 0.335 68 HG2 GLU 9 HG2 GLU 9 19.059 -1.652 1.500 69 HG3 GLU 9 HG1 GLU 9 17.589 -0.730 1.197 70 H LYS 10 HN LYS 10 20.235 -0.143 -3.011 71 HA LYS 10 HA LYS 10 19.274 -2.640 -4.235 72 HB2 LYS 10 HB2 LYS 10 20.045 -1.593 -6.476 73 HB3 LYS 10 HB1 LYS 10 18.471 -1.122 -5.834 74 HG2 LYS 10 HG2 LYS 10 20.769 0.502 -4.901 75 HG3 LYS 10 HG1 LYS 10 20.361 0.668 -6.609 76 HD2 LYS 10 HD2 LYS 10 17.953 1.020 -5.893 77 HD3 LYS 10 HD1 LYS 10 18.541 1.122 -4.233 78 HE2 LYS 10 HE2 LYS 10 20.003 3.000 -4.849 79 HE3 LYS 10 HE1 LYS 10 19.455 2.890 -6.522 80 HZ1 LYS 10 HZ1 LYS 10 17.547 3.259 -4.297 81 HZ2 LYS 10 HZ2 LYS 10 17.324 3.580 -5.950 82 HZ3 LYS 10 HZ3 LYS 10 18.327 4.583 -5.015 83 H ARG 11 HN ARG 11 20.969 -3.705 -5.543 84 HA ARG 11 HA ARG 11 23.693 -2.931 -4.739 85 HB2 ARG 11 HB2 ARG 11 24.042 -5.565 -4.684 86 HB3 ARG 11 HB1 ARG 11 23.526 -4.674 -3.259 87 HG2 ARG 11 HG2 ARG 11 22.067 -6.537 -3.371 88 HG3 ARG 11 HG1 ARG 11 21.105 -5.214 -4.006 89 HD2 ARG 11 HD2 ARG 11 22.743 -6.892 -5.883 90 HD3 ARG 11 HD1 ARG 11 21.206 -7.505 -5.292 91 HE ARG 11 HE ARG 11 21.590 -5.346 -7.179 92 HH11 ARG 11 HH11 ARG 11 19.461 -6.795 -4.826 93 HH12 ARG 11 HH12 ARG 11 18.034 -6.109 -5.521 94 HH21 ARG 11 HH21 ARG 11 19.709 -4.463 -8.064 95 HH22 ARG 11 HH22 ARG 11 18.171 -4.796 -7.341 96 H LYS 12 HN LYS 12 23.211 -2.064 -7.045 97 HA LYS 12 HA LYS 12 23.754 -4.142 -9.062 98 HB2 LYS 12 HB2 LYS 12 22.799 -2.757 -10.650 99 HB3 LYS 12 HB1 LYS 12 21.877 -2.292 -9.220 100 HG2 LYS 12 HG2 LYS 12 23.667 -0.491 -8.843 101 HG3 LYS 12 HG1 LYS 12 24.202 -0.837 -10.489 102 HD2 LYS 12 HD2 LYS 12 22.669 0.910 -10.808 103 HD3 LYS 12 HD1 LYS 12 21.689 -0.524 -11.115 104 HE2 LYS 12 HE2 LYS 12 20.435 0.929 -9.640 105 HE3 LYS 12 HE1 LYS 12 20.975 -0.464 -8.701 106 HZ1 LYS 12 HZ1 LYS 12 21.317 1.930 -7.796 107 HZ2 LYS 12 HZ2 LYS 12 22.670 1.932 -8.823 108 HZ3 LYS 12 HZ3 LYS 12 22.535 0.768 -7.593 109 H CYS 13 HN CYS 13 25.479 -3.975 -10.476 110 HA CYS 13 HA CYS 13 27.792 -3.800 -10.737 111 HB2 CYS 13 HB2 CYS 13 26.421 -1.937 -12.030 112 HB3 CYS 13 HB1 CYS 13 27.327 -0.861 -10.970 113 H ASN 14 HN ASN 14 28.063 -4.263 -8.320 114 HA ASN 14 HA ASN 14 29.346 -1.941 -7.010 115 HB2 ASN 14 HB2 ASN 14 28.872 -3.111 -4.869 116 HB3 ASN 14 HB1 ASN 14 27.408 -2.682 -5.751 117 HD21 ASN 14 HD21 ASN 14 25.958 -4.376 -5.369 118 HD22 ASN 14 HD22 ASN 14 26.334 -6.022 -5.546 119 H THR 15 HN THR 15 30.563 -3.820 -8.928 120 HA THR 15 HA THR 15 32.334 -5.457 -7.276 121 HB THR 15 HB THR 15 33.319 -5.947 -9.641 122 HG1 THR 15 HG1 THR 15 32.383 -4.455 -10.887 123 HG21 THR 15 HG21 THR 15 30.487 -6.765 -8.936 124 HG22 THR 15 HG22 THR 15 31.950 -7.512 -8.293 125 HG23 THR 15 HG23 THR 15 31.580 -7.635 -10.012 126 H ALA 16 HN ALA 16 34.730 -5.369 -7.909 127 HA ALA 16 HA ALA 16 35.721 -2.776 -7.299 128 HB1 ALA 16 HB1 ALA 16 36.970 -5.397 -8.056 129 HB2 ALA 16 HB2 ALA 16 37.119 -4.484 -6.555 130 HB3 ALA 16 HB3 ALA 16 37.960 -3.938 -8.006 131 H THR 17 HN THR 17 35.506 -4.670 -10.272 132 HA THR 17 HA THR 17 36.989 -2.919 -11.932 133 HB THR 17 HB THR 17 34.749 -4.826 -12.654 134 HG1 THR 17 HG1 THR 17 37.569 -5.114 -12.729 135 HG21 THR 17 HG21 THR 17 35.945 -4.767 -14.898 136 HG22 THR 17 HG22 THR 17 36.812 -3.352 -14.302 137 HG23 THR 17 HG23 THR 17 35.057 -3.304 -14.475 138 H CYS 18 HN CYS 18 33.568 -3.087 -11.066 139 HA CYS 18 HA CYS 18 32.587 -1.160 -12.864 140 HB2 CYS 18 HB2 CYS 18 31.260 -2.745 -11.362 141 HB3 CYS 18 HB1 CYS 18 31.540 -1.582 -10.065 142 H ALA 19 HN ALA 19 33.940 -0.852 -9.602 143 HA ALA 19 HA ALA 19 33.440 1.827 -9.102 144 HB1 ALA 19 HB1 ALA 19 35.976 0.313 -8.433 145 HB2 ALA 19 HB2 ALA 19 34.491 0.272 -7.483 146 HB3 ALA 19 HB3 ALA 19 35.396 1.777 -7.639 147 H THR 20 HN THR 20 35.969 0.358 -11.090 148 HA THR 20 HA THR 20 37.502 2.661 -11.572 149 HB THR 20 HB THR 20 36.987 0.314 -13.416 150 HG1 THR 20 HG1 THR 20 38.052 -0.641 -11.885 151 HG21 THR 20 HG21 THR 20 39.080 2.497 -13.389 152 HG22 THR 20 HG22 THR 20 37.951 2.106 -14.686 153 HG23 THR 20 HG23 THR 20 39.266 0.997 -14.297 154 H GLN 21 HN GLN 21 34.614 1.395 -13.191 155 HA GLN 21 HA GLN 21 34.520 3.124 -15.369 156 HB2 GLN 21 HB2 GLN 21 32.471 2.236 -15.747 157 HB3 GLN 21 HB1 GLN 21 32.906 1.142 -14.436 158 HG2 GLN 21 HG2 GLN 21 31.882 2.844 -12.840 159 HG3 GLN 21 HG1 GLN 21 31.237 3.661 -14.262 160 HE21 GLN 21 HE21 GLN 21 29.212 2.859 -12.777 161 HE22 GLN 21 HE22 GLN 21 28.537 1.388 -13.291 162 H ARG 22 HN ARG 22 33.843 3.743 -11.996 163 HA ARG 22 HA ARG 22 32.444 6.210 -12.494 164 HB2 ARG 22 HB2 ARG 22 32.087 6.303 -10.240 165 HB3 ARG 22 HB1 ARG 22 32.478 4.593 -10.360 166 HG2 ARG 22 HG2 ARG 22 33.895 5.188 -8.642 167 HG3 ARG 22 HG1 ARG 22 34.967 5.507 -9.996 168 HD2 ARG 22 HD2 ARG 22 35.112 7.651 -9.331 169 HD3 ARG 22 HD1 ARG 22 33.391 7.838 -9.651 170 HE ARG 22 HE ARG 22 32.996 7.697 -7.366 171 HH11 ARG 22 HH11 ARG 22 36.233 6.628 -8.106 172 HH12 ARG 22 HH12 ARG 22 36.709 6.537 -6.447 173 HH21 ARG 22 HH21 ARG 22 33.647 7.569 -5.206 174 HH22 ARG 22 HH22 ARG 22 35.257 7.065 -4.813 175 H LEU 23 HN LEU 23 35.747 5.232 -12.185 176 HA LEU 23 HA LEU 23 36.939 7.672 -11.453 177 HB2 LEU 23 HB2 LEU 23 38.159 5.517 -11.532 178 HB3 LEU 23 HB1 LEU 23 38.046 5.532 -13.291 179 HG LEU 23 HG LEU 23 39.264 7.722 -13.300 180 HD11 LEU 23 HD11 LEU 23 38.802 8.578 -11.114 181 HD12 LEU 23 HD12 LEU 23 40.528 8.219 -11.134 182 HD13 LEU 23 HD13 LEU 23 39.407 7.114 -10.339 183 HD21 LEU 23 HD21 LEU 23 41.483 6.721 -12.624 184 HD22 LEU 23 HD22 LEU 23 40.534 5.705 -13.710 185 HD23 LEU 23 HD23 LEU 23 40.596 5.336 -11.986 186 H ALA 24 HN ALA 24 35.932 6.387 -14.583 187 HA ALA 24 HA ALA 24 37.012 8.471 -16.182 188 HB1 ALA 24 HB1 ALA 24 34.719 6.551 -16.632 189 HB2 ALA 24 HB2 ALA 24 36.363 6.428 -17.260 190 HB3 ALA 24 HB3 ALA 24 35.282 7.688 -17.856 191 H ASN 25 HN ASN 25 33.867 7.977 -14.642 192 HA ASN 25 HA ASN 25 32.579 10.266 -15.678 193 HB2 ASN 25 HB2 ASN 25 32.161 8.695 -13.131 194 HB3 ASN 25 HB1 ASN 25 31.113 10.022 -13.626 195 HD21 ASN 25 HD21 ASN 25 30.190 9.762 -15.958 196 HD22 ASN 25 HD22 ASN 25 29.763 8.190 -16.434 197 H PHE 26 HN PHE 26 34.624 9.765 -12.847 198 HA PHE 26 HA PHE 26 34.236 12.312 -11.667 199 HB2 PHE 26 HB2 PHE 26 35.202 10.347 -10.487 200 HB3 PHE 26 HB1 PHE 26 36.659 10.512 -11.466 201 HD1 PHE 26 HD1 PHE 26 34.541 12.169 -8.909 202 HD2 PHE 26 HD2 PHE 26 38.277 12.231 -11.028 203 HE1 PHE 26 HE1 PHE 26 35.403 13.885 -7.340 204 HE2 PHE 26 HE2 PHE 26 39.139 13.947 -9.458 205 HZ PHE 26 HZ PHE 26 37.702 14.774 -7.614 206 H LEU 27 HN LEU 27 36.301 11.166 -14.242 207 HA LEU 27 HA LEU 27 38.185 13.247 -14.268 208 HB2 LEU 27 HB2 LEU 27 38.422 11.119 -15.526 209 HB3 LEU 27 HB1 LEU 27 37.109 11.604 -16.584 210 HG LEU 27 HG LEU 27 39.553 11.926 -17.390 211 HD11 LEU 27 HD11 LEU 27 37.913 14.436 -17.625 212 HD12 LEU 27 HD12 LEU 27 37.333 12.926 -18.323 213 HD13 LEU 27 HD13 LEU 27 38.870 13.607 -18.850 214 HD21 LEU 27 HD21 LEU 27 39.358 14.554 -15.925 215 HD22 LEU 27 HD22 LEU 27 40.765 13.803 -16.673 216 HD23 LEU 27 HD23 LEU 27 40.117 13.155 -15.167 217 H VAL 28 HN VAL 28 34.962 12.989 -15.706 218 HA VAL 28 HA VAL 28 35.241 15.680 -16.851 219 HB VAL 28 HB VAL 28 33.113 15.235 -17.959 220 HG11 VAL 28 HG11 VAL 28 35.311 14.299 -18.849 221 HG12 VAL 28 HG12 VAL 28 33.851 13.499 -19.433 222 HG13 VAL 28 HG13 VAL 28 34.824 12.747 -18.168 223 HG21 VAL 28 HG21 VAL 28 33.168 12.607 -16.439 224 HG22 VAL 28 HG22 VAL 28 31.974 13.070 -17.651 225 HG23 VAL 28 HG23 VAL 28 32.064 13.945 -16.123 226 H HIS 29 HN HIS 29 33.790 14.027 -14.169 227 HA HIS 29 HA HIS 29 31.822 16.001 -13.534 228 HB2 HIS 29 HB2 HIS 29 31.870 13.630 -12.660 229 HB3 HIS 29 HB1 HIS 29 33.200 14.120 -11.611 230 HD1 HIS 29 HD1 HIS 29 29.622 15.196 -12.381 231 HD2 HIS 29 HD2 HIS 29 32.358 15.258 -9.237 232 HE1 HIS 29 HE1 HIS 29 28.385 16.121 -10.373 233 HE2 HIS 29 HE2 HIS 29 30.040 16.165 -8.448 234 H SER 30 HN SER 30 35.171 15.449 -12.601 235 HA SER 30 HA SER 30 35.187 17.823 -10.907 236 HB2 SER 30 HB2 SER 30 36.371 15.820 -10.134 237 HB3 SER 30 HB1 SER 30 37.396 15.863 -11.566 238 HG SER 30 HG SER 30 37.189 17.823 -9.519 239 H SER 31 HN SER 31 35.688 17.125 -14.173 240 HA SER 31 HA SER 31 37.897 18.610 -14.927 241 HB2 SER 31 HB2 SER 31 36.631 17.222 -16.493 242 HB3 SER 31 HB1 SER 31 35.260 18.323 -16.385 243 HG SER 31 HG SER 31 37.671 18.574 -17.721 244 H ASN 32 HN ASN 32 34.927 19.762 -13.602 245 HA ASN 32 HA ASN 32 34.821 22.338 -14.734 246 HB2 ASN 32 HB2 ASN 32 33.541 22.929 -12.672 247 HB3 ASN 32 HB1 ASN 32 32.951 21.469 -13.464 248 HD21 ASN 32 HD21 ASN 32 33.612 22.654 -10.444 249 HD22 ASN 32 HD22 ASN 32 34.008 21.206 -9.652 250 H ASN 33 HN ASN 33 36.383 21.147 -11.776 251 HA ASN 33 HA ASN 33 37.469 23.650 -11.008 252 HB2 ASN 33 HB2 ASN 33 38.253 20.812 -10.324 253 HB3 ASN 33 HB1 ASN 33 39.042 22.222 -9.619 254 HD21 ASN 33 HD21 ASN 33 37.189 23.940 -8.840 255 HD22 ASN 33 HD22 ASN 33 35.972 23.232 -7.892 256 H PHE 34 HN PHE 34 38.684 20.942 -12.905 257 HA PHE 34 HA PHE 34 41.333 21.623 -13.259 258 HB2 PHE 34 HB2 PHE 34 40.339 19.558 -14.147 259 HB3 PHE 34 HB1 PHE 34 39.451 20.498 -15.347 260 HD1 PHE 34 HD1 PHE 34 42.881 19.635 -14.166 261 HD2 PHE 34 HD2 PHE 34 40.482 21.200 -17.368 262 HE1 PHE 34 HE1 PHE 34 44.853 19.583 -15.669 263 HE2 PHE 34 HE2 PHE 34 42.454 21.149 -18.870 264 HZ PHE 34 HZ PHE 34 44.639 20.340 -18.021 265 H GLY 35 HN GLY 35 38.495 22.952 -14.902 266 HA2 GLY 35 HA2 GLY 35 39.837 24.454 -16.865 267 HA3 GLY 35 HA1 GLY 35 38.241 24.824 -16.218 268 H ALA 36 HN ALA 36 38.608 25.502 -13.667 269 HA ALA 36 HA ALA 36 39.811 28.078 -13.833 270 HB1 ALA 36 HB1 ALA 36 38.932 28.455 -11.722 271 HB2 ALA 36 HB2 ALA 36 39.196 26.791 -11.200 272 HB3 ALA 36 HB3 ALA 36 37.871 27.171 -12.300 273 H ILE 37 HN ILE 37 41.010 24.956 -12.963 274 HA ILE 37 HA ILE 37 43.139 25.774 -11.268 275 HB ILE 37 HB ILE 37 42.537 23.289 -12.837 276 HG12 ILE 37 HG12 ILE 37 43.072 23.748 -9.887 277 HG13 ILE 37 HG11 ILE 37 41.465 23.867 -10.602 278 HG21 ILE 37 HG21 ILE 37 44.625 22.351 -11.679 279 HG22 ILE 37 HG22 ILE 37 45.113 24.027 -11.429 280 HG23 ILE 37 HG23 ILE 37 44.911 23.401 -13.066 281 HD11 ILE 37 HD11 ILE 37 43.166 21.399 -10.984 282 HD12 ILE 37 HD12 ILE 37 41.421 21.572 -11.172 283 HD13 ILE 37 HD13 ILE 37 42.140 21.598 -9.564 284 H LEU 38 HN LEU 38 42.849 25.331 -14.767 285 HA LEU 38 HA LEU 38 45.654 25.717 -15.265 286 HB2 LEU 38 HB2 LEU 38 45.159 25.474 -17.529 287 HB3 LEU 38 HB1 LEU 38 43.905 24.511 -16.755 288 HG LEU 38 HG LEU 38 42.683 26.946 -16.825 289 HD11 LEU 38 HD11 LEU 38 44.386 28.102 -18.052 290 HD12 LEU 38 HD12 LEU 38 43.104 27.752 -19.210 291 HD13 LEU 38 HD13 LEU 38 44.565 26.764 -19.187 292 HD21 LEU 38 HD21 LEU 38 41.407 26.048 -18.691 293 HD22 LEU 38 HD22 LEU 38 41.835 24.721 -17.610 294 HD23 LEU 38 HD23 LEU 38 42.728 24.958 -19.112 295 H SER 39 HN SER 39 42.970 27.807 -14.725 296 HA SER 39 HA SER 39 43.799 30.105 -16.136 297 HB2 SER 39 HB2 SER 39 41.565 29.897 -15.135 298 HB3 SER 39 HB1 SER 39 42.278 29.905 -13.524 299 HG SER 39 HG SER 39 42.111 31.968 -15.436 300 H SER 40 HN SER 40 44.629 28.881 -12.922 301 HA SER 40 HA SER 40 46.393 31.167 -12.445 302 HB2 SER 40 HB2 SER 40 45.695 28.783 -10.717 303 HB3 SER 40 HB1 SER 40 46.733 30.118 -10.223 304 HG SER 40 HG SER 40 44.951 31.513 -10.604 305 H THR 41 HN THR 41 46.926 29.146 -14.562 306 HA THR 41 HA THR 41 48.980 27.378 -13.801 307 HB THR 41 HB THR 41 47.832 27.191 -15.950 308 HG1 THR 41 HG1 THR 41 50.562 27.845 -16.331 309 HG21 THR 41 HG21 THR 41 48.265 28.806 -17.741 310 HG22 THR 41 HG22 THR 41 49.288 29.753 -16.660 311 HG23 THR 41 HG23 THR 41 47.557 29.624 -16.348 312 H ASN 42 HN ASN 42 48.988 30.784 -13.933 313 HA ASN 42 HA ASN 42 51.835 31.014 -14.499 314 HB2 ASN 42 HB2 ASN 42 51.489 33.392 -14.356 315 HB3 ASN 42 HB1 ASN 42 50.166 32.705 -15.297 316 HD21 ASN 42 HD21 ASN 42 49.781 35.195 -14.032 317 HD22 ASN 42 HD22 ASN 42 48.691 35.005 -12.744 318 H VAL 43 HN VAL 43 50.617 29.659 -12.004 319 HA VAL 43 HA VAL 43 51.647 31.339 -9.859 320 HB VAL 43 HB VAL 43 49.544 29.849 -9.750 321 HG11 VAL 43 HG11 VAL 43 51.598 27.732 -9.079 322 HG12 VAL 43 HG12 VAL 43 50.847 27.849 -10.670 323 HG13 VAL 43 HG13 VAL 43 49.854 27.538 -9.247 324 HG21 VAL 43 HG21 VAL 43 51.569 29.420 -7.540 325 HG22 VAL 43 HG22 VAL 43 49.820 29.580 -7.393 326 HG23 VAL 43 HG23 VAL 43 50.800 30.982 -7.822 327 H GLY 44 HN GLY 44 53.320 29.886 -12.056 328 HA2 GLY 44 HA2 GLY 44 55.545 29.224 -12.054 329 HA3 GLY 44 HA1 GLY 44 55.512 29.230 -10.294 330 H SER 45 HN SER 45 53.035 27.487 -11.972 331 HA SER 45 HA SER 45 54.436 24.939 -11.434 332 HB2 SER 45 HB2 SER 45 52.356 23.973 -10.638 333 HB3 SER 45 HB1 SER 45 52.716 25.417 -9.696 334 HG SER 45 HG SER 45 50.620 25.623 -10.302 335 H ASN 46 HN ASN 46 54.226 26.423 -13.917 336 HA ASN 46 HA ASN 46 52.315 24.848 -15.496 337 HB2 ASN 46 HB2 ASN 46 52.756 26.410 -17.285 338 HB3 ASN 46 HB1 ASN 46 52.452 27.324 -15.809 339 HD21 ASN 46 HD21 ASN 46 53.895 28.599 -17.830 340 HD22 ASN 46 HD22 ASN 46 55.524 28.737 -17.376 341 H THR 47 HN THR 47 54.844 23.768 -14.299 342 HA THR 47 HA THR 47 56.475 23.209 -16.662 343 HB THR 47 HB THR 47 57.205 21.750 -14.260 344 HG1 THR 47 HG1 THR 47 57.077 23.284 -12.849 345 HG21 THR 47 HG21 THR 47 58.800 22.115 -16.003 346 HG22 THR 47 HG22 THR 47 59.311 23.128 -14.653 347 HG23 THR 47 HG23 THR 47 58.475 23.848 -16.029 348 H TYR 48 HN TYR 48 53.700 22.187 -16.388 349 HA TYR 48 HA TYR 48 54.334 19.335 -16.765 350 HB2 TYR 48 HB2 TYR 48 52.456 18.622 -15.485 351 HB3 TYR 48 HB1 TYR 48 53.313 19.792 -14.482 352 HD1 TYR 48 HD1 TYR 48 50.191 18.961 -16.049 353 HD2 TYR 48 HD2 TYR 48 52.523 22.245 -14.557 354 HE1 TYR 48 HE1 TYR 48 48.145 20.358 -15.928 355 HE2 TYR 48 HE2 TYR 48 50.477 23.642 -14.436 356 HH TYR 48 HH TYR 48 47.557 22.756 -15.929 357 H GLY 49 HN GLY 49 53.697 21.767 -18.500 358 HA2 GLY 49 HA2 GLY 49 51.149 21.576 -19.628 359 HA3 GLY 49 HA1 GLY 49 52.582 22.148 -20.475 360 H LYS 50 HN LYS 50 50.175 19.975 -20.678 361 HA LYS 50 HA LYS 50 51.497 17.568 -21.417 362 HB2 LYS 50 HB2 LYS 50 48.749 18.654 -22.054 363 HB3 LYS 50 HB1 LYS 50 49.292 17.046 -22.533 364 HG2 LYS 50 HG2 LYS 50 49.821 16.579 -20.119 365 HG3 LYS 50 HG1 LYS 50 49.074 18.123 -19.709 366 HD2 LYS 50 HD2 LYS 50 47.639 15.959 -21.266 367 HD3 LYS 50 HD1 LYS 50 47.543 16.106 -19.511 368 HE2 LYS 50 HE2 LYS 50 46.766 18.256 -21.504 369 HE3 LYS 50 HE1 LYS 50 45.644 17.250 -20.589 370 HZ1 LYS 50 HZ1 LYS 50 47.472 19.343 -19.598 371 HZ2 LYS 50 HZ2 LYS 50 46.884 18.136 -18.558 372 HZ3 LYS 50 HZ3 LYS 50 45.803 19.184 -19.345 373 H ARG 51 HN ARG 51 50.503 20.446 -23.186 374 HA ARG 51 HA ARG 51 50.745 19.588 -25.809 375 HB2 ARG 51 HB2 ARG 51 51.089 21.884 -26.409 376 HB3 ARG 51 HB1 ARG 51 49.991 21.861 -25.029 377 HG2 ARG 51 HG2 ARG 51 51.970 22.233 -23.526 378 HG3 ARG 51 HG1 ARG 51 52.968 22.429 -24.968 379 HD2 ARG 51 HD2 ARG 51 51.496 24.286 -25.708 380 HD3 ARG 51 HD1 ARG 51 50.562 24.116 -24.225 381 HE ARG 51 HE ARG 51 53.168 25.344 -24.496 382 HH11 ARG 51 HH11 ARG 51 50.918 23.771 -22.344 383 HH12 ARG 51 HH12 ARG 51 51.587 24.497 -20.924 384 HH21 ARG 51 HH21 ARG 51 54.017 26.280 -22.624 385 HH22 ARG 51 HH22 ARG 51 53.330 25.908 -21.079 386 H ASN 52 HN ASN 52 53.230 20.062 -23.437 387 HA ASN 52 HA ASN 52 55.451 20.441 -25.132 388 HB2 ASN 52 HB2 ASN 52 55.562 20.794 -22.707 389 HB3 ASN 52 HB1 ASN 52 55.310 19.070 -22.437 390 HD21 ASN 52 HD21 ASN 52 57.182 17.818 -22.309 391 HD22 ASN 52 HD22 ASN 52 58.712 18.307 -22.860 392 H ALA 53 HN ALA 53 53.822 17.529 -23.979 393 HA ALA 53 HA ALA 53 55.686 15.631 -24.900 394 HB1 ALA 53 HB1 ALA 53 53.800 14.034 -24.799 395 HB2 ALA 53 HB2 ALA 53 52.683 15.385 -24.600 396 HB3 ALA 53 HB3 ALA 53 53.885 15.044 -23.355 397 H VAL 54 HN VAL 54 52.780 16.971 -26.465 398 HA VAL 54 HA VAL 54 53.182 15.519 -28.913 399 HB VAL 54 HB VAL 54 51.043 16.756 -27.801 400 HG11 VAL 54 HG11 VAL 54 51.842 18.558 -30.098 401 HG12 VAL 54 HG12 VAL 54 52.140 18.986 -28.413 402 HG13 VAL 54 HG13 VAL 54 50.489 18.753 -28.984 403 HG21 VAL 54 HG21 VAL 54 50.013 16.504 -30.108 404 HG22 VAL 54 HG22 VAL 54 50.858 15.075 -29.512 405 HG23 VAL 54 HG23 VAL 54 51.628 16.122 -30.705 406 H GLU 55 HN GLU 55 54.364 18.488 -27.604 407 HA GLU 55 HA GLU 55 54.939 19.805 -30.069 408 HB2 GLU 55 HB2 GLU 55 54.801 20.896 -27.783 409 HB3 GLU 55 HB1 GLU 55 56.387 20.205 -27.446 410 HG2 GLU 55 HG2 GLU 55 55.930 21.805 -29.953 411 HG3 GLU 55 HG1 GLU 55 56.252 22.622 -28.426 412 H VAL 56 HN VAL 56 56.970 17.949 -27.799 413 HA VAL 56 HA VAL 56 59.276 18.041 -29.487 414 HB VAL 56 HB VAL 56 59.317 17.708 -26.994 415 HG11 VAL 56 HG11 VAL 56 58.595 14.850 -27.687 416 HG12 VAL 56 HG12 VAL 56 57.433 16.007 -27.040 417 HG13 VAL 56 HG13 VAL 56 58.836 15.537 -26.081 418 HG21 VAL 56 HG21 VAL 56 61.227 16.227 -27.062 419 HG22 VAL 56 HG22 VAL 56 61.226 17.160 -28.559 420 HG23 VAL 56 HG23 VAL 56 60.663 15.488 -28.561 421 H LEU 57 HN LEU 57 56.595 15.809 -29.086 422 HA LEU 57 HA LEU 57 57.716 13.615 -30.474 423 HB2 LEU 57 HB2 LEU 57 55.083 14.375 -29.466 424 HB3 LEU 57 HB1 LEU 57 54.988 13.483 -30.983 425 HG LEU 57 HG LEU 57 56.719 11.877 -29.861 426 HD11 LEU 57 HD11 LEU 57 57.000 13.501 -27.908 427 HD12 LEU 57 HD12 LEU 57 56.704 11.818 -27.472 428 HD13 LEU 57 HD13 LEU 57 55.395 12.996 -27.381 429 HD21 LEU 57 HD21 LEU 57 54.481 11.151 -30.409 430 HD22 LEU 57 HD22 LEU 57 53.800 12.067 -29.064 431 HD23 LEU 57 HD23 LEU 57 54.806 10.653 -28.749 432 H LYS 58 HN LYS 58 55.796 16.387 -31.577 433 HA LYS 58 HA LYS 58 55.490 15.578 -34.259 434 HB2 LYS 58 HB2 LYS 58 55.535 18.287 -32.932 435 HB3 LYS 58 HB1 LYS 58 55.260 18.091 -34.663 436 HG2 LYS 58 HG2 LYS 58 53.645 16.523 -32.659 437 HG3 LYS 58 HG1 LYS 58 53.184 18.166 -33.105 438 HD2 LYS 58 HD2 LYS 58 53.239 17.448 -35.518 439 HD3 LYS 58 HD1 LYS 58 53.488 15.792 -34.964 440 HE2 LYS 58 HE2 LYS 58 51.155 17.495 -34.060 441 HE3 LYS 58 HE1 LYS 58 51.072 16.412 -35.449 442 HZ1 LYS 58 HZ1 LYS 58 52.045 14.730 -33.707 443 HZ2 LYS 58 HZ2 LYS 58 50.374 15.019 -33.813 444 HZ3 LYS 58 HZ3 LYS 58 51.295 15.774 -32.602 445 H ARG 59 HN ARG 59 58.004 17.473 -32.636 446 HA ARG 59 HA ARG 59 59.512 18.011 -35.005 447 HB2 ARG 59 HB2 ARG 59 59.611 19.324 -32.842 448 HB3 ARG 59 HB1 ARG 59 60.545 17.989 -32.166 449 HG2 ARG 59 HG2 ARG 59 61.475 18.965 -34.801 450 HG3 ARG 59 HG1 ARG 59 61.664 20.105 -33.468 451 HD2 ARG 59 HD2 ARG 59 62.788 18.307 -32.149 452 HD3 ARG 59 HD1 ARG 59 62.691 17.255 -33.558 453 HE ARG 59 HE ARG 59 63.936 19.627 -34.369 454 HH11 ARG 59 HH11 ARG 59 64.504 16.964 -32.190 455 HH12 ARG 59 HH12 ARG 59 66.225 17.067 -32.324 456 HH21 ARG 59 HH21 ARG 59 66.187 19.738 -34.525 457 HH22 ARG 59 HH22 ARG 59 67.174 18.627 -33.637 458 H GLU 60 HN GLU 60 59.545 15.476 -32.565 459 HA GLU 60 HA GLU 60 62.010 14.301 -33.384 460 HB2 GLU 60 HB2 GLU 60 59.691 13.379 -31.702 461 HB3 GLU 60 HB1 GLU 60 61.003 12.276 -32.113 462 HG2 GLU 60 HG2 GLU 60 61.406 14.984 -30.813 463 HG3 GLU 60 HG1 GLU 60 61.343 13.462 -29.927 464 HA PRO 61 HA PRO 61 60.680 11.975 -36.896 465 HB2 PRO 61 HB2 PRO 61 62.245 9.752 -36.743 466 HB3 PRO 61 HB1 PRO 61 62.877 11.352 -37.174 467 HG2 PRO 61 HG2 PRO 61 63.003 9.903 -34.579 468 HG3 PRO 61 HG1 PRO 61 64.226 10.910 -35.373 469 HD2 PRO 61 HD2 PRO 61 62.642 11.799 -33.309 470 HD3 PRO 61 HD1 PRO 61 63.346 12.870 -34.539 471 H LEU 62 HN LEU 62 60.018 10.885 -33.772 472 HA LEU 62 HA LEU 62 59.098 8.273 -34.155 473 HB2 LEU 62 HB2 LEU 62 59.386 9.276 -31.930 474 HB3 LEU 62 HB1 LEU 62 58.053 10.384 -32.250 475 HG LEU 62 HG LEU 62 56.535 8.427 -32.535 476 HD11 LEU 62 HD11 LEU 62 58.055 6.704 -33.218 477 HD12 LEU 62 HD12 LEU 62 57.442 6.222 -31.636 478 HD13 LEU 62 HD13 LEU 62 59.053 6.926 -31.781 479 HD21 LEU 62 HD21 LEU 62 56.318 7.954 -30.189 480 HD22 LEU 62 HD22 LEU 62 56.922 9.606 -30.317 481 HD23 LEU 62 HD23 LEU 62 58.025 8.294 -29.902 482 H ASN 63 HN ASN 63 57.477 11.387 -34.613 483 HA ASN 63 HA ASN 63 54.929 10.224 -35.251 484 HB2 ASN 63 HB2 ASN 63 54.251 12.467 -35.809 485 HB3 ASN 63 HB1 ASN 63 55.239 12.543 -34.352 486 HD21 ASN 63 HD21 ASN 63 54.885 14.768 -36.217 487 HD22 ASN 63 HD22 ASN 63 56.412 15.109 -36.877 488 H TYR 64 HN TYR 64 57.848 10.742 -36.994 489 HA TYR 64 HA TYR 64 56.686 10.971 -39.607 490 HB2 TYR 64 HB2 TYR 64 58.960 11.798 -39.077 491 HB3 TYR 64 HB1 TYR 64 59.485 10.135 -38.811 492 HD1 TYR 64 HD1 TYR 64 58.077 12.460 -41.360 493 HD2 TYR 64 HD2 TYR 64 60.044 8.712 -40.631 494 HE1 TYR 64 HE1 TYR 64 58.465 12.190 -43.795 495 HE2 TYR 64 HE2 TYR 64 60.432 8.442 -43.065 496 HH TYR 64 HH TYR 64 60.428 10.709 -45.189 497 H LEU 65 HN LEU 65 57.886 8.334 -37.600 498 HA LEU 65 HA LEU 65 57.713 6.344 -39.655 499 HB2 LEU 65 HB2 LEU 65 57.875 6.114 -36.641 500 HB3 LEU 65 HB1 LEU 65 57.979 4.747 -37.749 501 HG LEU 65 HG LEU 65 59.818 7.148 -37.895 502 HD11 LEU 65 HD11 LEU 65 61.469 5.852 -36.715 503 HD12 LEU 65 HD12 LEU 65 60.431 4.426 -36.715 504 HD13 LEU 65 HD13 LEU 65 60.001 5.830 -35.737 505 HD21 LEU 65 HD21 LEU 65 61.204 5.411 -39.172 506 HD22 LEU 65 HD22 LEU 65 59.749 5.984 -39.985 507 HD23 LEU 65 HD23 LEU 65 59.752 4.410 -39.189 508 HA PRO 66 HA PRO 66 53.455 5.228 -39.697 509 HB2 PRO 66 HB2 PRO 66 54.204 2.443 -38.941 510 HB3 PRO 66 HB1 PRO 66 53.277 3.024 -40.337 511 HG2 PRO 66 HG2 PRO 66 55.791 2.187 -40.588 512 HG3 PRO 66 HG1 PRO 66 55.157 3.536 -41.546 513 HD2 PRO 66 HD2 PRO 66 57.011 3.597 -39.203 514 HD3 PRO 66 HD1 PRO 66 56.937 4.674 -40.615 515 H LEU 67 HN LEU 67 51.766 5.231 -38.270 516 HA LEU 67 HA LEU 67 51.851 3.946 -35.713 517 HB2 LEU 67 HB2 LEU 67 53.011 6.533 -35.856 518 HB3 LEU 67 HB1 LEU 67 51.464 6.698 -35.023 519 HG LEU 67 HG LEU 67 53.548 4.612 -34.324 520 HD11 LEU 67 HD11 LEU 67 52.963 7.342 -33.154 521 HD12 LEU 67 HD12 LEU 67 54.501 6.742 -33.775 522 HD13 LEU 67 HD13 LEU 67 53.844 6.093 -32.273 523 HD21 LEU 67 HD21 LEU 67 51.347 3.913 -33.652 524 HD22 LEU 67 HD22 LEU 67 50.951 5.526 -33.059 525 HD23 LEU 67 HD23 LEU 67 52.139 4.540 -32.207 Start of MODEL 20 1 H1 THR 1 HT1 THR 1 -2.719 -5.410 -1.756 2 H2 THR 1 HT2 THR 1 -3.300 -4.387 -0.529 3 H3 THR 1 HT3 THR 1 -2.764 -5.955 -0.151 4 HA THR 1 HA THR 1 -0.560 -5.435 -0.370 5 HB THR 1 HB THR 1 -1.493 -4.019 -2.595 6 HG1 THR 1 HG1 THR 1 0.466 -5.281 -2.214 7 HG21 THR 1 HG21 THR 1 -0.482 -1.819 -2.445 8 HG22 THR 1 HG22 THR 1 0.088 -2.146 -0.811 9 HG23 THR 1 HG23 THR 1 -1.641 -1.993 -1.130 10 HA PRO 2 HA PRO 2 -0.666 -2.862 3.207 11 HB2 PRO 2 HB2 PRO 2 1.893 -1.924 3.358 12 HB3 PRO 2 HB1 PRO 2 1.457 -3.609 3.699 13 HG2 PRO 2 HG2 PRO 2 2.672 -2.424 1.258 14 HG3 PRO 2 HG1 PRO 2 2.992 -3.981 2.041 15 HD2 PRO 2 HD2 PRO 2 1.424 -3.697 -0.206 16 HD3 PRO 2 HD1 PRO 2 1.257 -5.034 0.952 17 H ILE 3 HN ILE 3 -0.777 -0.702 3.971 18 HA ILE 3 HA ILE 3 -1.483 1.250 2.047 19 HB ILE 3 HB ILE 3 -2.352 1.174 4.385 20 HG12 ILE 3 HG12 ILE 3 -2.128 3.669 4.773 21 HG13 ILE 3 HG11 ILE 3 -0.977 3.705 3.437 22 HG21 ILE 3 HG21 ILE 3 -0.148 0.653 5.443 23 HG22 ILE 3 HG22 ILE 3 -0.959 2.026 6.196 24 HG23 ILE 3 HG23 ILE 3 0.379 2.297 5.079 25 HD11 ILE 3 HD11 ILE 3 -3.751 2.536 3.139 26 HD12 ILE 3 HD12 ILE 3 -2.625 3.003 1.864 27 HD13 ILE 3 HD13 ILE 3 -3.410 4.241 2.844 28 H GLU 4 HN GLU 4 -0.400 2.996 1.233 29 HA GLU 4 HA GLU 4 2.431 2.847 1.040 30 HB2 GLU 4 HB2 GLU 4 2.255 4.936 -0.214 31 HB3 GLU 4 HB1 GLU 4 0.988 3.819 -0.724 32 HG2 GLU 4 HG2 GLU 4 -0.604 4.952 0.803 33 HG3 GLU 4 HG1 GLU 4 0.661 6.094 1.254 34 H SER 5 HN SER 5 3.987 4.412 1.749 35 HA SER 5 HA SER 5 3.647 5.169 4.488 36 HB2 SER 5 HB2 SER 5 5.909 5.989 4.348 37 HB3 SER 5 HB1 SER 5 5.824 4.477 3.448 38 HG SER 5 HG SER 5 6.149 5.535 1.642 39 H HIS 6 HN HIS 6 4.007 7.381 5.297 40 HA HIS 6 HA HIS 6 2.172 9.215 4.174 41 HB2 HIS 6 HB2 HIS 6 2.933 10.756 5.877 42 HB3 HIS 6 HB1 HIS 6 2.842 9.142 6.582 43 HD1 HIS 6 HD1 HIS 6 5.336 11.682 5.324 44 HD2 HIS 6 HD2 HIS 6 5.321 8.056 7.379 45 HE1 HIS 6 HE1 HIS 6 7.696 11.331 6.174 46 HE2 HIS 6 HE2 HIS 6 7.703 9.124 7.430 47 H GLN 7 HN GLN 7 5.551 8.648 3.626 48 HA GLN 7 HA GLN 7 6.378 11.137 2.655 49 HB2 GLN 7 HB2 GLN 7 7.872 9.181 3.078 50 HB3 GLN 7 HB1 GLN 7 7.233 8.426 1.618 51 HG2 GLN 7 HG2 GLN 7 8.049 10.249 0.246 52 HG3 GLN 7 HG1 GLN 7 8.540 11.159 1.673 53 HE21 GLN 7 HE21 GLN 7 10.676 10.927 0.213 54 HE22 GLN 7 HE22 GLN 7 11.669 9.613 0.622 55 H VAL 8 HN VAL 8 6.161 12.189 0.745 56 HA VAL 8 HA VAL 8 4.752 10.824 -1.455 57 HB VAL 8 HB VAL 8 3.070 12.110 -0.217 58 HG11 VAL 8 HG11 VAL 8 4.625 13.751 0.795 59 HG12 VAL 8 HG12 VAL 8 3.287 14.554 -0.027 60 HG13 VAL 8 HG13 VAL 8 4.874 14.481 -0.792 61 HG21 VAL 8 HG21 VAL 8 3.103 11.989 -2.765 62 HG22 VAL 8 HG22 VAL 8 3.806 13.606 -2.745 63 HG23 VAL 8 HG23 VAL 8 2.193 13.337 -2.083 64 H GLU 9 HN GLU 9 5.273 11.549 -3.517 65 HA GLU 9 HA GLU 9 7.137 13.778 -3.812 66 HB2 GLU 9 HB2 GLU 9 8.514 12.093 -5.333 67 HB3 GLU 9 HB1 GLU 9 8.848 12.251 -3.609 68 HG2 GLU 9 HG2 GLU 9 8.638 9.869 -4.376 69 HG3 GLU 9 HG1 GLU 9 7.497 10.304 -3.106 70 H LYS 10 HN LYS 10 7.679 14.064 -6.214 71 HA LYS 10 HA LYS 10 5.487 13.149 -7.952 72 HB2 LYS 10 HB2 LYS 10 5.399 15.533 -8.866 73 HB3 LYS 10 HB1 LYS 10 4.672 15.276 -7.280 74 HG2 LYS 10 HG2 LYS 10 7.540 15.900 -7.160 75 HG3 LYS 10 HG1 LYS 10 6.567 17.197 -7.855 76 HD2 LYS 10 HD2 LYS 10 5.031 17.040 -5.890 77 HD3 LYS 10 HD1 LYS 10 6.117 15.846 -5.178 78 HE2 LYS 10 HE2 LYS 10 7.972 17.572 -5.403 79 HE3 LYS 10 HE1 LYS 10 6.718 18.746 -5.803 80 HZ1 LYS 10 HZ1 LYS 10 7.083 17.244 -3.282 81 HZ2 LYS 10 HZ2 LYS 10 5.610 17.995 -3.673 82 HZ3 LYS 10 HZ3 LYS 10 7.023 18.924 -3.506 83 H ARG 11 HN ARG 11 5.952 13.427 -10.241 84 HA ARG 11 HA ARG 11 8.828 13.718 -10.820 85 HB2 ARG 11 HB2 ARG 11 8.239 11.930 -12.696 86 HB3 ARG 11 HB1 ARG 11 8.745 11.441 -11.086 87 HG2 ARG 11 HG2 ARG 11 6.848 10.106 -11.552 88 HG3 ARG 11 HG1 ARG 11 6.221 11.366 -10.503 89 HD2 ARG 11 HD2 ARG 11 6.182 11.761 -13.480 90 HD3 ARG 11 HD1 ARG 11 4.958 10.749 -12.727 91 HE ARG 11 HE ARG 11 5.174 13.627 -12.532 92 HH11 ARG 11 HH11 ARG 11 3.956 10.704 -11.068 93 HH12 ARG 11 HH12 ARG 11 2.699 11.520 -10.206 94 HH21 ARG 11 HH21 ARG 11 3.526 14.666 -11.391 95 HH22 ARG 11 HH22 ARG 11 2.454 13.749 -10.386 96 H LYS 12 HN LYS 12 7.705 15.929 -11.196 97 HA LYS 12 HA LYS 12 6.167 16.242 -13.590 98 HB2 LYS 12 HB2 LYS 12 6.504 18.635 -13.245 99 HB3 LYS 12 HB1 LYS 12 6.090 17.861 -11.715 100 HG2 LYS 12 HG2 LYS 12 8.495 17.752 -11.130 101 HG3 LYS 12 HG1 LYS 12 8.890 18.567 -12.644 102 HD2 LYS 12 HD2 LYS 12 7.587 20.528 -11.957 103 HD3 LYS 12 HD1 LYS 12 7.122 19.714 -10.463 104 HE2 LYS 12 HE2 LYS 12 8.996 21.234 -10.033 105 HE3 LYS 12 HE1 LYS 12 9.518 19.562 -9.824 106 HZ1 LYS 12 HZ1 LYS 12 11.090 20.892 -11.131 107 HZ2 LYS 12 HZ2 LYS 12 9.888 21.158 -12.301 108 HZ3 LYS 12 HZ3 LYS 12 10.467 19.587 -12.017 109 H CYS 13 HN CYS 13 6.819 17.104 -15.580 110 HA CYS 13 HA CYS 13 9.124 16.113 -16.729 111 HB2 CYS 13 HB2 CYS 13 7.087 17.157 -17.876 112 HB3 CYS 13 HB1 CYS 13 7.876 18.712 -17.612 113 H ASN 14 HN ASN 14 11.177 16.492 -16.270 114 HA ASN 14 HA ASN 14 11.961 19.218 -15.426 115 HB2 ASN 14 HB2 ASN 14 13.842 18.123 -14.224 116 HB3 ASN 14 HB1 ASN 14 12.260 17.650 -13.608 117 HD21 ASN 14 HD21 ASN 14 13.306 15.624 -12.802 118 HD22 ASN 14 HD22 ASN 14 13.621 14.357 -13.887 119 H THR 15 HN THR 15 12.299 16.859 -17.852 120 HA THR 15 HA THR 15 14.918 17.033 -18.694 121 HB THR 15 HB THR 15 13.067 15.633 -19.703 122 HG1 THR 15 HG1 THR 15 15.020 15.714 -20.741 123 HG21 THR 15 HG21 THR 15 12.548 18.027 -21.455 124 HG22 THR 15 HG22 THR 15 11.592 17.749 -20.001 125 HG23 THR 15 HG23 THR 15 11.596 16.553 -21.297 126 H ALA 16 HN ALA 16 15.600 18.188 -20.794 127 HA ALA 16 HA ALA 16 15.577 21.003 -20.263 128 HB1 ALA 16 HB1 ALA 16 16.605 19.566 -22.720 129 HB2 ALA 16 HB2 ALA 16 17.529 19.784 -21.233 130 HB3 ALA 16 HB3 ALA 16 17.043 21.188 -22.184 131 H THR 17 HN THR 17 13.979 18.894 -22.585 132 HA THR 17 HA THR 17 13.003 20.764 -24.395 133 HB THR 17 HB THR 17 11.635 18.264 -23.369 134 HG1 THR 17 HG1 THR 17 13.414 18.819 -25.498 135 HG21 THR 17 HG21 THR 17 10.471 18.370 -25.589 136 HG22 THR 17 HG22 THR 17 11.156 19.979 -25.819 137 HG23 THR 17 HG23 THR 17 10.027 19.682 -24.497 138 H CYS 18 HN CYS 18 11.510 19.660 -21.347 139 HA CYS 18 HA CYS 18 9.254 21.390 -21.551 140 HB2 CYS 18 HB2 CYS 18 10.488 19.902 -19.230 141 HB3 CYS 18 HB1 CYS 18 9.022 20.870 -19.079 142 H ALA 19 HN ALA 19 12.437 21.665 -20.047 143 HA ALA 19 HA ALA 19 12.021 23.980 -18.528 144 HB1 ALA 19 HB1 ALA 19 14.067 22.720 -18.290 145 HB2 ALA 19 HB2 ALA 19 14.486 24.345 -18.830 146 HB3 ALA 19 HB3 ALA 19 14.493 23.006 -19.977 147 H THR 20 HN THR 20 12.961 23.598 -21.933 148 HA THR 20 HA THR 20 13.342 26.313 -22.531 149 HB THR 20 HB THR 20 12.361 24.084 -24.330 150 HG1 THR 20 HG1 THR 20 14.413 23.594 -24.541 151 HG21 THR 20 HG21 THR 20 13.447 26.852 -24.877 152 HG22 THR 20 HG22 THR 20 11.913 26.167 -25.413 153 HG23 THR 20 HG23 THR 20 13.429 25.578 -26.096 154 H GLN 21 HN GLN 21 10.425 24.364 -22.303 155 HA GLN 21 HA GLN 21 8.651 26.075 -23.648 156 HB2 GLN 21 HB2 GLN 21 7.089 24.575 -23.026 157 HB3 GLN 21 HB1 GLN 21 8.436 23.653 -22.364 158 HG2 GLN 21 HG2 GLN 21 8.119 24.922 -20.197 159 HG3 GLN 21 HG1 GLN 21 6.641 25.594 -20.883 160 HE21 GLN 21 HE21 GLN 21 5.996 24.211 -18.737 161 HE22 GLN 21 HE22 GLN 21 5.468 22.634 -19.080 162 H ARG 22 HN ARG 22 10.019 26.237 -20.425 163 HA ARG 22 HA ARG 22 8.161 28.252 -19.519 164 HB2 ARG 22 HB2 ARG 22 9.189 28.100 -17.472 165 HB3 ARG 22 HB1 ARG 22 9.633 26.533 -18.137 166 HG2 ARG 22 HG2 ARG 22 11.714 27.225 -17.450 167 HG3 ARG 22 HG1 ARG 22 11.725 27.954 -19.049 168 HD2 ARG 22 HD2 ARG 22 12.035 29.949 -18.052 169 HD3 ARG 22 HD1 ARG 22 10.402 29.810 -17.406 170 HE ARG 22 HE ARG 22 11.341 29.409 -15.335 171 HH11 ARG 22 HH11 ARG 22 13.672 28.699 -17.830 172 HH12 ARG 22 HH12 ARG 22 14.949 28.375 -16.709 173 HH21 ARG 22 HH21 ARG 22 13.029 28.980 -13.894 174 HH22 ARG 22 HH22 ARG 22 14.590 28.532 -14.496 175 H LEU 23 HN LEU 23 11.125 28.198 -21.287 176 HA LEU 23 HA LEU 23 11.940 30.885 -20.743 177 HB2 LEU 23 HB2 LEU 23 13.515 29.184 -21.583 178 HB3 LEU 23 HB1 LEU 23 12.606 29.085 -23.089 179 HG LEU 23 HG LEU 23 13.052 31.514 -23.473 180 HD11 LEU 23 HD11 LEU 23 13.383 32.330 -21.246 181 HD12 LEU 23 HD12 LEU 23 14.941 32.483 -22.059 182 HD13 LEU 23 HD13 LEU 23 14.660 31.154 -20.934 183 HD21 LEU 23 HD21 LEU 23 15.401 29.643 -23.077 184 HD22 LEU 23 HD22 LEU 23 15.550 31.212 -23.869 185 HD23 LEU 23 HD23 LEU 23 14.520 29.965 -24.572 186 H ALA 24 HN ALA 24 9.982 29.323 -23.233 187 HA ALA 24 HA ALA 24 9.674 31.545 -24.942 188 HB1 ALA 24 HB1 ALA 24 8.145 29.015 -24.463 189 HB2 ALA 24 HB2 ALA 24 8.970 29.566 -25.921 190 HB3 ALA 24 HB3 ALA 24 7.423 30.277 -25.462 191 H ASN 25 HN ASN 25 7.915 30.498 -22.064 192 HA ASN 25 HA ASN 25 5.826 32.439 -22.278 193 HB2 ASN 25 HB2 ASN 25 6.843 30.741 -19.998 194 HB3 ASN 25 HB1 ASN 25 5.478 31.844 -19.838 195 HD21 ASN 25 HD21 ASN 25 5.366 28.890 -19.652 196 HD22 ASN 25 HD22 ASN 25 4.332 28.376 -20.896 197 H PHE 26 HN PHE 26 9.059 32.439 -20.983 198 HA PHE 26 HA PHE 26 8.795 34.683 -19.258 199 HB2 PHE 26 HB2 PHE 26 10.675 33.087 -19.115 200 HB3 PHE 26 HB1 PHE 26 11.263 33.654 -20.678 201 HD1 PHE 26 HD1 PHE 26 10.479 34.759 -17.203 202 HD2 PHE 26 HD2 PHE 26 12.560 35.632 -20.859 203 HE1 PHE 26 HE1 PHE 26 11.656 36.634 -16.086 204 HE2 PHE 26 HE2 PHE 26 13.737 37.507 -19.741 205 HZ PHE 26 HZ PHE 26 13.285 38.008 -17.354 206 H LEU 27 HN LEU 27 9.643 34.338 -22.680 207 HA LEU 27 HA LEU 27 10.460 36.987 -23.126 208 HB2 LEU 27 HB2 LEU 27 10.856 35.135 -24.721 209 HB3 LEU 27 HB1 LEU 27 9.131 35.030 -25.033 210 HG LEU 27 HG LEU 27 10.639 36.312 -26.717 211 HD11 LEU 27 HD11 LEU 27 8.273 37.935 -25.809 212 HD12 LEU 27 HD12 LEU 27 8.042 36.309 -26.451 213 HD13 LEU 27 HD13 LEU 27 8.803 37.549 -27.444 214 HD21 LEU 27 HD21 LEU 27 10.167 38.640 -24.858 215 HD22 LEU 27 HD22 LEU 27 11.241 38.536 -26.251 216 HD23 LEU 27 HD23 LEU 27 11.649 37.690 -24.760 217 H VAL 28 HN VAL 28 7.259 35.458 -23.371 218 HA VAL 28 HA VAL 28 5.966 37.943 -24.104 219 HB VAL 28 HB VAL 28 3.892 36.666 -23.941 220 HG11 VAL 28 HG11 VAL 28 5.414 36.416 -25.936 221 HG12 VAL 28 HG12 VAL 28 4.353 35.034 -25.663 222 HG13 VAL 28 HG13 VAL 28 6.051 34.948 -25.194 223 HG21 VAL 28 HG21 VAL 28 5.657 34.454 -22.843 224 HG22 VAL 28 HG22 VAL 28 3.945 34.300 -23.231 225 HG23 VAL 28 HG23 VAL 28 4.459 35.362 -21.921 226 H HIS 29 HN HIS 29 6.652 36.189 -21.164 227 HA HIS 29 HA HIS 29 4.786 37.579 -19.509 228 HB2 HIS 29 HB2 HIS 29 5.760 35.412 -18.854 229 HB3 HIS 29 HB1 HIS 29 7.354 36.161 -18.756 230 HD1 HIS 29 HD1 HIS 29 3.894 36.521 -17.199 231 HD2 HIS 29 HD2 HIS 29 7.881 37.346 -16.304 232 HE1 HIS 29 HE1 HIS 29 3.933 37.358 -14.809 233 HE2 HIS 29 HE2 HIS 29 6.357 37.866 -14.249 234 H SER 30 HN SER 30 7.919 38.293 -20.763 235 HA SER 30 HA SER 30 8.000 40.731 -19.097 236 HB2 SER 30 HB2 SER 30 9.877 39.137 -18.657 237 HB3 SER 30 HB1 SER 30 10.385 39.333 -20.331 238 HG SER 30 HG SER 30 10.431 41.651 -19.821 239 H SER 31 HN SER 31 6.961 39.941 -21.952 240 HA SER 31 HA SER 31 8.481 41.461 -23.803 241 HB2 SER 31 HB2 SER 31 6.903 39.758 -24.559 242 HB3 SER 31 HB1 SER 31 5.562 40.656 -23.856 243 HG SER 31 HG SER 31 6.833 40.996 -26.227 244 H ASN 32 HN ASN 32 5.734 42.243 -21.715 245 HA ASN 32 HA ASN 32 5.185 44.800 -22.771 246 HB2 ASN 32 HB2 ASN 32 4.044 45.211 -20.631 247 HB3 ASN 32 HB1 ASN 32 3.634 43.626 -21.283 248 HD21 ASN 32 HD21 ASN 32 4.133 44.943 -18.387 249 HD22 ASN 32 HD22 ASN 32 4.976 43.698 -17.598 250 H ASN 33 HN ASN 33 7.516 43.658 -20.410 251 HA ASN 33 HA ASN 33 8.255 46.243 -19.456 252 HB2 ASN 33 HB2 ASN 33 9.642 43.560 -19.346 253 HB3 ASN 33 HB1 ASN 33 10.294 45.013 -18.590 254 HD21 ASN 33 HD21 ASN 33 8.219 46.229 -17.356 255 HD22 ASN 33 HD22 ASN 33 7.421 45.186 -16.281 256 H PHE 34 HN PHE 34 9.200 44.214 -22.108 257 HA PHE 34 HA PHE 34 11.677 45.292 -22.811 258 HB2 PHE 34 HB2 PHE 34 10.630 43.292 -23.873 259 HB3 PHE 34 HB1 PHE 34 9.524 44.367 -24.728 260 HD1 PHE 34 HD1 PHE 34 13.182 43.814 -24.129 261 HD2 PHE 34 HD2 PHE 34 10.147 45.267 -26.799 262 HE1 PHE 34 HE1 PHE 34 14.901 44.197 -25.875 263 HE2 PHE 34 HE2 PHE 34 11.866 45.650 -28.545 264 HZ PHE 34 HZ PHE 34 14.243 45.115 -28.083 265 H GLY 35 HN GLY 35 8.411 46.411 -23.597 266 HA2 GLY 35 HA2 GLY 35 9.159 48.523 -25.339 267 HA3 GLY 35 HA1 GLY 35 7.640 48.405 -24.442 268 H ALA 36 HN ALA 36 8.385 48.537 -21.846 269 HA ALA 36 HA ALA 36 8.852 51.266 -21.430 270 HB1 ALA 36 HB1 ALA 36 9.406 50.445 -19.022 271 HB2 ALA 36 HB2 ALA 36 8.951 48.855 -19.636 272 HB3 ALA 36 HB3 ALA 36 7.782 50.177 -19.656 273 H ILE 37 HN ILE 37 11.060 48.513 -21.431 274 HA ILE 37 HA ILE 37 13.344 49.805 -20.410 275 HB ILE 37 HB ILE 37 13.009 47.455 -22.272 276 HG12 ILE 37 HG12 ILE 37 14.004 47.607 -19.413 277 HG13 ILE 37 HG11 ILE 37 12.310 47.343 -19.824 278 HG21 ILE 37 HG21 ILE 37 15.460 47.041 -21.692 279 HG22 ILE 37 HG22 ILE 37 15.517 48.713 -21.135 280 HG23 ILE 37 HG23 ILE 37 15.159 48.358 -22.825 281 HD11 ILE 37 HD11 ILE 37 14.672 45.569 -20.467 282 HD12 ILE 37 HD12 ILE 37 13.107 45.383 -21.259 283 HD13 ILE 37 HD13 ILE 37 13.243 45.168 -19.515 284 H LEU 38 HN LEU 38 12.029 49.561 -23.676 285 HA LEU 38 HA LEU 38 14.170 50.586 -25.138 286 HB2 LEU 38 HB2 LEU 38 12.147 49.619 -26.167 287 HB3 LEU 38 HB1 LEU 38 11.210 51.012 -25.628 288 HG LEU 38 HG LEU 38 12.727 52.493 -26.952 289 HD11 LEU 38 HD11 LEU 38 14.739 51.202 -27.066 290 HD12 LEU 38 HD12 LEU 38 14.118 51.274 -28.715 291 HD13 LEU 38 HD13 LEU 38 13.890 49.815 -27.749 292 HD21 LEU 38 HD21 LEU 38 10.562 51.487 -27.841 293 HD22 LEU 38 HD22 LEU 38 11.557 50.285 -28.662 294 HD23 LEU 38 HD23 LEU 38 11.720 51.992 -29.072 295 H SER 39 HN SER 39 11.706 52.237 -23.240 296 HA SER 39 HA SER 39 12.318 54.876 -24.123 297 HB2 SER 39 HB2 SER 39 11.007 53.872 -21.590 298 HB3 SER 39 HB1 SER 39 11.104 55.569 -22.051 299 HG SER 39 HG SER 39 10.011 53.537 -23.703 300 H SER 40 HN SER 40 13.482 52.856 -21.456 301 HA SER 40 HA SER 40 15.268 54.991 -20.549 302 HB2 SER 40 HB2 SER 40 14.583 52.262 -19.458 303 HB3 SER 40 HB1 SER 40 15.871 53.259 -18.787 304 HG SER 40 HG SER 40 13.948 53.671 -17.694 305 H THR 41 HN THR 41 15.554 53.491 -23.154 306 HA THR 41 HA THR 41 17.649 51.661 -23.117 307 HB THR 41 HB THR 41 16.335 52.172 -25.129 308 HG1 THR 41 HG1 THR 41 18.039 51.401 -26.047 309 HG21 THR 41 HG21 THR 41 16.697 54.228 -26.369 310 HG22 THR 41 HG22 THR 41 17.917 54.754 -25.210 311 HG23 THR 41 HG23 THR 41 16.227 54.640 -24.720 312 H ASN 42 HN ASN 42 17.711 55.063 -22.490 313 HA ASN 42 HA ASN 42 20.614 55.209 -22.873 314 HB2 ASN 42 HB2 ASN 42 20.364 57.594 -22.515 315 HB3 ASN 42 HB1 ASN 42 19.169 57.058 -23.695 316 HD21 ASN 42 HD21 ASN 42 19.081 59.391 -21.740 317 HD22 ASN 42 HD22 ASN 42 17.645 59.159 -20.865 318 H VAL 43 HN VAL 43 19.302 53.618 -20.694 319 HA VAL 43 HA VAL 43 20.097 55.093 -18.292 320 HB VAL 43 HB VAL 43 17.955 53.687 -18.499 321 HG11 VAL 43 HG11 VAL 43 19.849 51.406 -17.905 322 HG12 VAL 43 HG12 VAL 43 19.272 51.743 -19.537 323 HG13 VAL 43 HG13 VAL 43 18.125 51.327 -18.264 324 HG21 VAL 43 HG21 VAL 43 19.756 52.904 -16.197 325 HG22 VAL 43 HG22 VAL 43 18.014 53.166 -16.177 326 HG23 VAL 43 HG23 VAL 43 19.108 54.536 -16.361 327 H GLY 44 HN GLY 44 21.973 53.918 -20.421 328 HA2 GLY 44 HA2 GLY 44 24.267 53.419 -19.963 329 HA3 GLY 44 HA1 GLY 44 23.761 52.595 -18.492 330 H SER 45 HN SER 45 21.498 51.415 -20.283 331 HA SER 45 HA SER 45 23.051 49.064 -21.073 332 HB2 SER 45 HB2 SER 45 20.886 47.952 -21.255 333 HB3 SER 45 HB1 SER 45 21.008 48.777 -19.703 334 HG SER 45 HG SER 45 19.032 49.269 -20.636 335 H ASN 46 HN ASN 46 23.064 51.631 -22.609 336 HA ASN 46 HA ASN 46 21.622 51.039 -25.055 337 HB2 ASN 46 HB2 ASN 46 22.522 53.127 -25.865 338 HB3 ASN 46 HB1 ASN 46 21.960 53.367 -24.212 339 HD21 ASN 46 HD21 ASN 46 24.468 54.213 -26.160 340 HD22 ASN 46 HD22 ASN 46 25.716 54.307 -25.013 341 H THR 47 HN THR 47 24.156 49.519 -23.839 342 HA THR 47 HA THR 47 25.904 49.637 -26.179 343 HB THR 47 HB THR 47 26.286 47.761 -23.868 344 HG1 THR 47 HG1 THR 47 27.474 49.592 -22.946 345 HG21 THR 47 HG21 THR 47 27.748 47.807 -25.953 346 HG22 THR 47 HG22 THR 47 28.598 48.008 -24.421 347 HG23 THR 47 HG23 THR 47 28.273 49.411 -25.439 348 H TYR 48 HN TYR 48 23.149 48.526 -26.325 349 HA TYR 48 HA TYR 48 23.832 45.758 -27.114 350 HB2 TYR 48 HB2 TYR 48 21.675 45.050 -26.517 351 HB3 TYR 48 HB1 TYR 48 22.115 46.164 -25.223 352 HD1 TYR 48 HD1 TYR 48 19.659 45.368 -27.655 353 HD2 TYR 48 HD2 TYR 48 21.473 48.691 -25.626 354 HE1 TYR 48 HE1 TYR 48 17.690 46.776 -28.198 355 HE2 TYR 48 HE2 TYR 48 19.505 50.097 -26.168 356 HH TYR 48 HH TYR 48 16.596 48.886 -27.151 357 H GLY 49 HN GLY 49 23.883 48.449 -28.613 358 HA2 GLY 49 HA2 GLY 49 21.805 48.436 -30.535 359 HA3 GLY 49 HA1 GLY 49 23.368 49.228 -30.715 360 H LYS 50 HN LYS 50 21.703 47.596 -32.604 361 HA LYS 50 HA LYS 50 23.133 45.141 -33.051 362 HB2 LYS 50 HB2 LYS 50 21.190 46.688 -34.780 363 HB3 LYS 50 HB1 LYS 50 21.829 45.093 -35.180 364 HG2 LYS 50 HG2 LYS 50 20.917 44.232 -33.019 365 HG3 LYS 50 HG1 LYS 50 20.186 45.812 -32.735 366 HD2 LYS 50 HD2 LYS 50 19.651 44.286 -35.281 367 HD3 LYS 50 HD1 LYS 50 18.707 43.985 -33.822 368 HE2 LYS 50 HE2 LYS 50 19.093 46.799 -34.815 369 HE3 LYS 50 HE1 LYS 50 17.850 45.770 -35.526 370 HZ1 LYS 50 HZ1 LYS 50 17.319 45.330 -33.010 371 HZ2 LYS 50 HZ2 LYS 50 16.684 46.681 -33.820 372 HZ3 LYS 50 HZ3 LYS 50 18.043 46.851 -32.814 373 H ARG 51 HN ARG 51 23.446 48.449 -34.077 374 HA ARG 51 HA ARG 51 24.852 48.265 -36.439 375 HB2 ARG 51 HB2 ARG 51 25.820 50.409 -35.916 376 HB3 ARG 51 HB1 ARG 51 24.174 50.386 -35.282 377 HG2 ARG 51 HG2 ARG 51 25.092 49.744 -33.046 378 HG3 ARG 51 HG1 ARG 51 26.720 49.919 -33.702 379 HD2 ARG 51 HD2 ARG 51 26.221 52.278 -34.271 380 HD3 ARG 51 HD1 ARG 51 24.619 52.100 -33.562 381 HE ARG 51 HE ARG 51 27.123 52.389 -32.134 382 HH11 ARG 51 HH11 ARG 51 23.822 51.268 -32.007 383 HH12 ARG 51 HH12 ARG 51 23.724 51.389 -30.285 384 HH21 ARG 51 HH21 ARG 51 26.963 52.541 -29.888 385 HH22 ARG 51 HH22 ARG 51 25.489 52.104 -29.090 386 H ASN 52 HN ASN 52 25.915 47.458 -33.216 387 HA ASN 52 HA ASN 52 28.702 47.466 -33.634 388 HB2 ASN 52 HB2 ASN 52 27.662 47.278 -31.404 389 HB3 ASN 52 HB1 ASN 52 27.075 45.669 -31.822 390 HD21 ASN 52 HD21 ASN 52 28.475 43.953 -31.366 391 HD22 ASN 52 HD22 ASN 52 30.129 44.125 -31.024 392 H ALA 53 HN ALA 53 26.241 44.984 -34.154 393 HA ALA 53 HA ALA 53 28.017 42.891 -34.878 394 HB1 ALA 53 HB1 ALA 53 25.909 41.969 -36.022 395 HB2 ALA 53 HB2 ALA 53 25.089 43.393 -35.381 396 HB3 ALA 53 HB3 ALA 53 25.830 42.233 -34.279 397 H VAL 54 HN VAL 54 26.215 45.280 -36.803 398 HA VAL 54 HA VAL 54 27.169 44.287 -39.314 399 HB VAL 54 HB VAL 54 25.119 45.915 -38.589 400 HG11 VAL 54 HG11 VAL 54 27.106 47.740 -39.962 401 HG12 VAL 54 HG12 VAL 54 26.852 47.756 -38.217 402 HG13 VAL 54 HG13 VAL 54 25.525 48.158 -39.304 403 HG21 VAL 54 HG21 VAL 54 24.712 46.135 -40.943 404 HG22 VAL 54 HG22 VAL 54 25.553 44.600 -40.728 405 HG23 VAL 54 HG23 VAL 54 26.431 46.012 -41.316 406 H GLU 55 HN GLU 55 28.462 46.389 -36.904 407 HA GLU 55 HA GLU 55 30.249 47.802 -38.683 408 HB2 GLU 55 HB2 GLU 55 29.373 48.692 -36.468 409 HB3 GLU 55 HB1 GLU 55 30.482 47.571 -35.679 410 HG2 GLU 55 HG2 GLU 55 31.478 49.445 -37.813 411 HG3 GLU 55 HG1 GLU 55 31.292 50.006 -36.153 412 H VAL 56 HN VAL 56 30.766 45.437 -36.049 413 HA VAL 56 HA VAL 56 33.462 44.971 -36.436 414 HB VAL 56 HB VAL 56 32.202 44.039 -34.550 415 HG11 VAL 56 HG11 VAL 56 31.061 42.117 -36.601 416 HG12 VAL 56 HG12 VAL 56 30.165 43.438 -35.853 417 HG13 VAL 56 HG13 VAL 56 30.747 42.098 -34.866 418 HG21 VAL 56 HG21 VAL 56 33.350 41.934 -34.436 419 HG22 VAL 56 HG22 VAL 56 34.368 43.000 -35.404 420 HG23 VAL 56 HG23 VAL 56 33.371 41.778 -36.192 421 H LEU 57 HN LEU 57 30.728 43.733 -38.262 422 HA LEU 57 HA LEU 57 32.122 41.724 -39.694 423 HB2 LEU 57 HB2 LEU 57 29.493 42.928 -39.749 424 HB3 LEU 57 HB1 LEU 57 30.111 42.724 -41.389 425 HG LEU 57 HG LEU 57 30.798 40.342 -40.577 426 HD11 LEU 57 HD11 LEU 57 30.386 40.583 -38.220 427 HD12 LEU 57 HD12 LEU 57 29.140 39.505 -38.847 428 HD13 LEU 57 HD13 LEU 57 28.756 41.192 -38.508 429 HD21 LEU 57 HD21 LEU 57 29.111 40.612 -42.263 430 HD22 LEU 57 HD22 LEU 57 27.952 41.242 -41.091 431 HD23 LEU 57 HD23 LEU 57 28.422 39.543 -41.041 432 H LYS 58 HN LYS 58 31.577 45.163 -40.262 433 HA LYS 58 HA LYS 58 32.732 45.282 -42.866 434 HB2 LYS 58 HB2 LYS 58 32.273 47.369 -40.729 435 HB3 LYS 58 HB1 LYS 58 32.925 47.742 -42.325 436 HG2 LYS 58 HG2 LYS 58 30.331 46.232 -41.966 437 HG3 LYS 58 HG1 LYS 58 30.387 47.993 -42.048 438 HD2 LYS 58 HD2 LYS 58 31.662 47.738 -44.232 439 HD3 LYS 58 HD1 LYS 58 31.263 46.021 -44.171 440 HE2 LYS 58 HE2 LYS 58 29.139 48.156 -43.948 441 HE3 LYS 58 HE1 LYS 58 29.666 47.527 -45.509 442 HZ1 LYS 58 HZ1 LYS 58 28.424 46.031 -43.274 443 HZ2 LYS 58 HZ2 LYS 58 29.195 45.262 -44.579 444 HZ3 LYS 58 HZ3 LYS 58 27.828 46.235 -44.849 445 H ARG 59 HN ARG 59 34.022 45.653 -39.595 446 HA ARG 59 HA ARG 59 36.592 46.574 -40.345 447 HB2 ARG 59 HB2 ARG 59 35.455 46.562 -38.017 448 HB3 ARG 59 HB1 ARG 59 36.078 44.917 -37.888 449 HG2 ARG 59 HG2 ARG 59 38.036 46.908 -38.853 450 HG3 ARG 59 HG1 ARG 59 37.499 47.144 -37.189 451 HD2 ARG 59 HD2 ARG 59 38.109 44.858 -36.620 452 HD3 ARG 59 HD1 ARG 59 38.522 44.516 -38.298 453 HE ARG 59 HE ARG 59 40.103 46.662 -37.610 454 HH11 ARG 59 HH11 ARG 59 39.558 43.450 -36.366 455 HH12 ARG 59 HH12 ARG 59 41.166 43.287 -35.753 456 HH21 ARG 59 HH21 ARG 59 42.198 46.421 -36.798 457 HH22 ARG 59 HH22 ARG 59 42.653 44.955 -35.994 458 H GLU 60 HN GLU 60 35.210 43.351 -39.995 459 HA GLU 60 HA GLU 60 37.766 42.225 -40.975 460 HB2 GLU 60 HB2 GLU 60 35.726 40.966 -39.126 461 HB3 GLU 60 HB1 GLU 60 37.134 40.137 -39.789 462 HG2 GLU 60 HG2 GLU 60 37.420 42.722 -38.263 463 HG3 GLU 60 HG1 GLU 60 37.360 41.170 -37.429 464 HA PRO 61 HA PRO 61 34.410 41.317 -44.038 465 HB2 PRO 61 HB2 PRO 61 35.755 42.184 -46.243 466 HB3 PRO 61 HB1 PRO 61 34.801 43.265 -45.208 467 HG2 PRO 61 HG2 PRO 61 37.744 42.864 -45.323 468 HG3 PRO 61 HG1 PRO 61 36.812 44.348 -45.061 469 HD2 PRO 61 HD2 PRO 61 38.036 42.910 -43.037 470 HD3 PRO 61 HD1 PRO 61 36.652 43.997 -42.793 471 H LEU 62 HN LEU 62 37.636 40.352 -43.504 472 HA LEU 62 HA LEU 62 38.194 38.664 -45.654 473 HB2 LEU 62 HB2 LEU 62 39.692 39.352 -43.677 474 HB3 LEU 62 HB1 LEU 62 38.946 38.007 -42.814 475 HG LEU 62 HG LEU 62 39.919 37.420 -45.557 476 HD11 LEU 62 HD11 LEU 62 41.791 38.739 -44.845 477 HD12 LEU 62 HD12 LEU 62 42.248 37.054 -44.593 478 HD13 LEU 62 HD13 LEU 62 41.744 38.046 -43.224 479 HD21 LEU 62 HD21 LEU 62 40.616 35.329 -44.403 480 HD22 LEU 62 HD22 LEU 62 38.913 35.692 -44.128 481 HD23 LEU 62 HD23 LEU 62 40.100 36.024 -42.867 482 H ASN 63 HN ASN 63 36.289 38.101 -42.722 483 HA ASN 63 HA ASN 63 35.942 35.322 -43.038 484 HB2 ASN 63 HB2 ASN 63 34.342 35.477 -41.341 485 HB3 ASN 63 HB1 ASN 63 35.377 36.868 -41.024 486 HD21 ASN 63 HD21 ASN 63 32.171 36.034 -41.187 487 HD22 ASN 63 HD22 ASN 63 31.514 37.534 -41.634 488 H TYR 64 HN TYR 64 34.309 38.090 -44.443 489 HA TYR 64 HA TYR 64 32.098 36.601 -45.507 490 HB2 TYR 64 HB2 TYR 64 31.958 39.026 -45.068 491 HB3 TYR 64 HB1 TYR 64 33.175 39.314 -46.313 492 HD1 TYR 64 HD1 TYR 64 29.823 37.742 -45.770 493 HD2 TYR 64 HD2 TYR 64 32.540 39.545 -48.567 494 HE1 TYR 64 HE1 TYR 64 28.055 37.710 -47.508 495 HE2 TYR 64 HE2 TYR 64 30.771 39.512 -50.305 496 HH TYR 64 HH TYR 64 27.728 37.854 -49.798 497 H LEU 65 HN LEU 65 35.186 37.779 -46.756 498 HA LEU 65 HA LEU 65 34.831 37.054 -49.450 499 HB2 LEU 65 HB2 LEU 65 37.335 37.290 -47.769 500 HB3 LEU 65 HB1 LEU 65 37.348 37.061 -49.517 501 HG LEU 65 HG LEU 65 35.861 39.326 -48.168 502 HD11 LEU 65 HD11 LEU 65 37.822 40.711 -49.019 503 HD12 LEU 65 HD12 LEU 65 38.687 39.191 -49.247 504 HD13 LEU 65 HD13 LEU 65 38.172 39.680 -47.632 505 HD21 LEU 65 HD21 LEU 65 36.151 40.279 -50.528 506 HD22 LEU 65 HD22 LEU 65 35.041 38.918 -50.380 507 HD23 LEU 65 HD23 LEU 65 36.668 38.664 -51.012 508 HA PRO 66 HA PRO 66 35.105 32.673 -49.724 509 HB2 PRO 66 HB2 PRO 66 37.516 32.985 -51.458 510 HB3 PRO 66 HB1 PRO 66 36.009 32.104 -51.770 511 HG2 PRO 66 HG2 PRO 66 36.508 34.438 -52.937 512 HG3 PRO 66 HG1 PRO 66 34.875 33.998 -52.408 513 HD2 PRO 66 HD2 PRO 66 36.799 35.922 -51.173 514 HD3 PRO 66 HD1 PRO 66 35.023 35.972 -51.218 515 H LEU 67 HN LEU 67 36.126 30.960 -48.707 516 HA LEU 67 HA LEU 67 38.899 31.056 -47.934 517 HB2 LEU 67 HB2 LEU 67 37.014 32.254 -46.188 518 HB3 LEU 67 HB1 LEU 67 37.495 30.723 -45.457 519 HG LEU 67 HG LEU 67 39.490 32.713 -46.559 520 HD11 LEU 67 HD11 LEU 67 38.475 32.367 -43.721 521 HD12 LEU 67 HD12 LEU 67 38.255 33.789 -44.741 522 HD13 LEU 67 HD13 LEU 67 39.868 33.348 -44.179 523 HD21 LEU 67 HD21 LEU 67 40.099 30.259 -46.246 524 HD22 LEU 67 HD22 LEU 67 39.836 30.501 -44.519 525 HD23 LEU 67 HD23 LEU 67 41.102 31.403 -45.353
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