NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26310 | 2khr | 16253 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 1.266 1.443 -0.192 2 H2 GLY 1 HT2 GLY 1 -0.375 1.238 -0.562 3 H3 GLY 1 HT3 GLY 1 0.498 2.516 -1.257 4 HA2 GLY 1 HA1 GLY 1 0.957 -0.377 -1.742 5 HA3 GLY 1 HA2 GLY 1 0.157 0.730 -2.850 6 H SER 2 HN SER 2 1.366 1.711 -4.334 7 HA SER 2 HA SER 2 4.289 1.547 -4.009 8 HB2 SER 2 HB2 SER 2 2.713 1.817 -6.580 9 HB3 SER 2 HB1 SER 2 4.442 1.506 -6.423 10 HG SER 2 HG SER 2 2.285 -0.217 -6.158 11 H HIS 3 HN HIS 3 5.427 3.389 -3.897 12 HA HIS 3 HA HIS 3 4.037 5.898 -4.555 13 HB2 HIS 3 HB2 HIS 3 4.843 5.678 -2.225 14 HB3 HIS 3 HB1 HIS 3 6.483 5.464 -2.820 15 HD1 HIS 3 HD1 HIS 3 3.766 8.120 -3.303 16 HD2 HIS 3 HD2 HIS 3 7.856 7.756 -2.622 17 HE1 HIS 3 HE1 HIS 3 4.644 10.470 -3.150 18 HE2 HIS 3 HE2 HIS 3 7.066 10.214 -2.497 19 H MET 4 HN MET 4 5.836 3.783 -6.055 20 HA MET 4 HA MET 4 8.069 5.113 -7.091 21 HB2 MET 4 HB2 MET 4 7.772 2.720 -7.378 22 HB3 MET 4 HB1 MET 4 6.314 2.983 -8.323 23 HG2 MET 4 HG2 MET 4 8.057 2.440 -9.834 24 HG3 MET 4 HG1 MET 4 7.704 4.157 -10.020 25 HE1 MET 4 HE1 MET 4 11.379 2.486 -7.798 26 HE2 MET 4 HE2 MET 4 10.175 1.486 -8.609 27 HE3 MET 4 HE3 MET 4 9.741 2.384 -7.156 28 H SER 5 HN SER 5 7.943 7.085 -7.946 29 HA SER 5 HA SER 5 5.691 7.753 -9.683 30 HB2 SER 5 HB2 SER 5 7.918 9.539 -8.674 31 HB3 SER 5 HB1 SER 5 6.420 10.054 -9.454 32 HG SER 5 HG SER 5 6.236 8.457 -7.164 33 H THR 6 HN THR 6 6.240 6.554 -11.512 34 HA THR 6 HA THR 6 8.821 6.908 -12.740 35 HB THR 6 HB THR 6 7.431 5.591 -14.628 36 HG1 THR 6 HG1 THR 6 5.461 5.361 -13.715 37 HG21 THR 6 HG21 THR 6 8.239 3.513 -13.564 38 HG22 THR 6 HG22 THR 6 8.564 4.417 -12.085 39 HG23 THR 6 HG23 THR 6 9.459 4.789 -13.560 40 H ASN 7 HN ASN 7 5.544 8.114 -13.219 41 HA ASN 7 HA ASN 7 6.667 9.897 -15.289 42 HB2 ASN 7 HB2 ASN 7 3.862 8.821 -14.992 43 HB3 ASN 7 HB1 ASN 7 4.237 10.207 -16.008 44 HD21 ASN 7 HD21 ASN 7 5.369 9.892 -17.920 45 HD22 ASN 7 HD22 ASN 7 5.605 8.328 -18.617 46 HA PRO 8 HA PRO 8 5.408 12.943 -12.204 47 HB2 PRO 8 HB2 PRO 8 7.771 14.369 -12.425 48 HB3 PRO 8 HB1 PRO 8 7.463 13.097 -11.244 49 HG2 PRO 8 HG2 PRO 8 9.303 13.061 -13.435 50 HG3 PRO 8 HG1 PRO 8 8.982 11.776 -12.263 51 HD2 PRO 8 HD2 PRO 8 7.978 12.103 -15.020 52 HD3 PRO 8 HD1 PRO 8 8.140 10.630 -14.041 53 H PHE 9 HN PHE 9 6.395 13.034 -15.472 54 HA PHE 9 HA PHE 9 5.532 15.827 -15.769 55 HB2 PHE 9 HB2 PHE 9 7.196 14.200 -17.704 56 HB3 PHE 9 HB1 PHE 9 6.868 15.926 -17.781 57 HD1 PHE 9 HD1 PHE 9 7.590 17.230 -15.572 58 HD2 PHE 9 HD2 PHE 9 9.229 13.540 -16.912 59 HE1 PHE 9 HE1 PHE 9 9.639 17.678 -14.284 60 HE2 PHE 9 HE2 PHE 9 11.278 13.976 -15.623 61 HZ PHE 9 HZ PHE 9 11.487 16.047 -14.309 62 H ASP 10 HN ASP 10 3.367 15.616 -16.072 63 HA ASP 10 HA ASP 10 2.233 13.617 -17.776 64 HB2 ASP 10 HB2 ASP 10 1.092 14.836 -15.827 65 HB3 ASP 10 HB1 ASP 10 0.893 16.189 -16.936 66 H ASP 11 HN ASP 11 2.640 17.135 -18.055 67 HA ASP 11 HA ASP 11 3.251 16.930 -20.861 68 HB2 ASP 11 HB2 ASP 11 0.720 16.959 -20.753 69 HB3 ASP 11 HB1 ASP 11 0.838 18.563 -20.037 70 H ASP 12 HN ASP 12 4.338 18.785 -21.606 71 HA ASP 12 HA ASP 12 5.457 20.395 -19.466 72 HB2 ASP 12 HB2 ASP 12 7.006 19.483 -21.079 73 HB3 ASP 12 HB1 ASP 12 6.104 20.189 -22.413 74 H ASN 13 HN ASN 13 4.736 22.349 -18.924 75 HA ASN 13 HA ASN 13 2.740 23.567 -20.688 76 HB2 ASN 13 HB2 ASN 13 1.954 23.030 -18.443 77 HB3 ASN 13 HB1 ASN 13 3.234 24.015 -17.740 78 HD21 ASN 13 HD21 ASN 13 0.214 24.028 -19.462 79 HD22 ASN 13 HD22 ASN 13 -0.144 25.713 -19.233 80 H GLY 14 HN GLY 14 5.193 24.817 -18.376 81 HA2 GLY 14 HA2 GLY 14 5.495 27.098 -20.225 82 HA3 GLY 14 HA1 GLY 14 5.334 27.328 -18.495 83 H ALA 15 HN ALA 15 7.232 28.179 -17.919 84 HA ALA 15 HA ALA 15 9.706 27.600 -19.137 85 HB1 ALA 15 HB1 ALA 15 9.208 28.819 -16.424 86 HB2 ALA 15 HB2 ALA 15 9.228 29.701 -17.951 87 HB3 ALA 15 HB3 ALA 15 10.700 28.923 -17.360 88 H PHE 16 HN PHE 16 11.636 26.860 -17.827 89 HA PHE 16 HA PHE 16 11.146 24.717 -15.950 90 HB2 PHE 16 HB2 PHE 16 12.558 23.207 -17.640 91 HB3 PHE 16 HB1 PHE 16 10.801 23.272 -17.720 92 HD1 PHE 16 HD1 PHE 16 13.827 24.922 -19.094 93 HD2 PHE 16 HD2 PHE 16 9.770 23.804 -19.713 94 HE1 PHE 16 HE1 PHE 16 13.957 25.723 -21.397 95 HE2 PHE 16 HE2 PHE 16 9.897 24.609 -22.032 96 HZ PHE 16 HZ PHE 16 11.992 25.577 -22.878 97 H PHE 17 HN PHE 17 12.995 24.114 -14.844 98 HA PHE 17 HA PHE 17 15.455 25.592 -15.529 99 HB2 PHE 17 HB2 PHE 17 14.037 25.233 -12.940 100 HB3 PHE 17 HB1 PHE 17 15.786 25.104 -12.886 101 HD1 PHE 17 HD2 PHE 17 13.482 27.366 -14.767 102 HD2 PHE 17 HD1 PHE 17 16.657 26.990 -11.967 103 HE1 PHE 17 HE2 PHE 17 13.646 29.811 -14.637 104 HE2 PHE 17 HE1 PHE 17 16.832 29.441 -11.830 105 HZ PHE 17 HZ PHE 17 15.324 30.854 -13.166 106 H VAL 18 HN VAL 18 17.451 24.521 -14.979 107 HA VAL 18 HA VAL 18 17.265 21.611 -15.019 108 HB VAL 18 HB VAL 18 19.714 23.390 -15.098 109 HG11 VAL 18 HG11 VAL 18 20.920 21.377 -15.774 110 HG12 VAL 18 HG12 VAL 18 19.443 20.428 -15.613 111 HG13 VAL 18 HG13 VAL 18 20.179 21.163 -14.189 112 HG21 VAL 18 HG21 VAL 18 18.342 23.686 -17.078 113 HG22 VAL 18 HG22 VAL 18 18.275 21.940 -17.318 114 HG23 VAL 18 HG23 VAL 18 19.809 22.794 -17.480 115 H LEU 19 HN LEU 19 16.752 20.853 -13.061 116 HA LEU 19 HA LEU 19 18.083 22.030 -10.712 117 HB2 LEU 19 HB2 LEU 19 15.596 22.354 -10.912 118 HB3 LEU 19 HB1 LEU 19 15.419 20.613 -10.808 119 HG LEU 19 HG LEU 19 16.527 20.716 -8.559 120 HD11 LEU 19 HD11 LEU 19 16.583 22.886 -7.425 121 HD12 LEU 19 HD12 LEU 19 16.137 23.679 -8.938 122 HD13 LEU 19 HD13 LEU 19 17.681 22.833 -8.803 123 HD21 LEU 19 HD21 LEU 19 14.539 21.511 -7.399 124 HD22 LEU 19 HD22 LEU 19 14.107 20.534 -8.803 125 HD23 LEU 19 HD23 LEU 19 13.981 22.291 -8.878 126 H VAL 20 HN VAL 20 19.357 20.736 -9.576 127 HA VAL 20 HA VAL 20 18.886 17.832 -9.707 128 HB VAL 20 HB VAL 20 21.610 19.159 -9.600 129 HG11 VAL 20 HG11 VAL 20 22.465 16.878 -9.940 130 HG12 VAL 20 HG12 VAL 20 20.817 16.261 -9.837 131 HG13 VAL 20 HG13 VAL 20 21.556 17.033 -8.435 132 HG21 VAL 20 HG21 VAL 20 20.175 17.816 -11.882 133 HG22 VAL 20 HG22 VAL 20 21.902 18.165 -11.877 134 HG23 VAL 20 HG23 VAL 20 20.736 19.485 -11.800 135 H ASN 21 HN ASN 21 18.702 16.904 -7.731 136 HA ASN 21 HA ASN 21 19.524 18.527 -5.426 137 HB2 ASN 21 HB2 ASN 21 17.949 17.315 -4.062 138 HB3 ASN 21 HB1 ASN 21 17.113 17.894 -5.495 139 HD21 ASN 21 HD21 ASN 21 16.300 16.441 -6.949 140 HD22 ASN 21 HD22 ASN 21 16.237 14.734 -6.653 141 H ASP 22 HN ASP 22 20.048 16.970 -3.460 142 HA ASP 22 HA ASP 22 22.590 15.976 -4.140 143 HB2 ASP 22 HB2 ASP 22 21.965 16.936 -1.937 144 HB3 ASP 22 HB1 ASP 22 21.030 15.486 -1.600 145 H GLU 23 HN GLU 23 19.505 14.403 -3.987 146 HA GLU 23 HA GLU 23 20.754 11.749 -4.086 147 HB2 GLU 23 HB2 GLU 23 17.921 12.651 -3.580 148 HB3 GLU 23 HB1 GLU 23 18.347 10.965 -3.845 149 HG2 GLU 23 HG2 GLU 23 19.501 12.687 -1.665 150 HG3 GLU 23 HG1 GLU 23 18.135 11.589 -1.460 151 H ASP 24 HN ASP 24 20.282 13.935 -6.302 152 HA ASP 24 HA ASP 24 18.993 12.112 -8.232 153 HB2 ASP 24 HB2 ASP 24 17.859 14.368 -7.655 154 HB3 ASP 24 HB1 ASP 24 19.156 15.097 -8.597 155 H GLN 25 HN GLN 25 19.700 13.174 -10.592 156 HA GLN 25 HA GLN 25 22.620 13.395 -10.530 157 HB2 GLN 25 HB2 GLN 25 22.118 12.027 -12.893 158 HB3 GLN 25 HB1 GLN 25 22.835 11.369 -11.432 159 HG2 GLN 25 HG2 GLN 25 21.191 9.865 -11.583 160 HG3 GLN 25 HG1 GLN 25 20.208 11.126 -10.845 161 HE21 GLN 25 HE21 GLN 25 19.457 8.933 -12.611 162 HE22 GLN 25 HE22 GLN 25 18.677 9.665 -13.980 163 H HIS 26 HN HIS 26 19.760 13.685 -12.668 164 HA HIS 26 HA HIS 26 20.315 16.436 -13.099 165 HB2 HIS 26 HB2 HIS 26 20.796 16.461 -15.451 166 HB3 HIS 26 HB1 HIS 26 21.967 15.405 -14.679 167 HD1 HIS 26 HD1 HIS 26 21.400 12.739 -14.969 168 HD2 HIS 26 HD2 HIS 26 19.493 15.367 -17.549 169 HE1 HIS 26 HE1 HIS 26 20.647 11.341 -16.916 170 HE2 HIS 26 HE2 HIS 26 19.709 13.003 -18.571 171 H SER 27 HN SER 27 18.426 17.443 -13.408 172 HA SER 27 HA SER 27 16.217 15.999 -14.640 173 HB2 SER 27 HB2 SER 27 16.177 17.073 -11.817 174 HB3 SER 27 HB1 SER 27 14.723 16.642 -12.717 175 HG SER 27 HG SER 27 16.805 14.977 -11.768 176 H LEU 28 HN LEU 28 14.697 17.254 -15.583 177 HA LEU 28 HA LEU 28 15.110 20.150 -15.567 178 HB2 LEU 28 HB2 LEU 28 13.749 18.242 -17.435 179 HB3 LEU 28 HB1 LEU 28 13.233 19.916 -17.404 180 HG LEU 28 HG LEU 28 14.814 19.579 -19.196 181 HD11 LEU 28 HD11 LEU 28 16.023 21.123 -16.911 182 HD12 LEU 28 HD12 LEU 28 14.857 21.728 -18.088 183 HD13 LEU 28 HD13 LEU 28 16.480 21.272 -18.608 184 HD21 LEU 28 HD21 LEU 28 17.127 18.920 -18.768 185 HD22 LEU 28 HD22 LEU 28 16.000 17.642 -18.317 186 HD23 LEU 28 HD23 LEU 28 16.739 18.648 -17.071 187 H TRP 29 HN TRP 29 13.926 21.300 -14.224 188 HA TRP 29 HA TRP 29 11.459 20.090 -13.175 189 HB2 TRP 29 HB2 TRP 29 13.334 20.536 -11.568 190 HB3 TRP 29 HB1 TRP 29 13.157 22.252 -11.911 191 HD1 TRP 29 HD1 TRP 29 11.594 23.521 -10.329 192 HE1 TRP 29 HE1 TRP 29 9.762 22.874 -8.638 193 HE3 TRP 29 HE3 TRP 29 11.402 18.493 -11.232 194 HZ2 TRP 29 HZ2 TRP 29 8.416 20.538 -7.798 195 HZ3 TRP 29 HZ3 TRP 29 9.818 17.125 -9.937 196 HH2 TRP 29 HH2 TRP 29 8.359 18.129 -8.257 197 HA PRO 30 HA PRO 30 9.452 23.280 -15.573 198 HB2 PRO 30 HB2 PRO 30 7.048 22.271 -14.198 199 HB3 PRO 30 HB1 PRO 30 7.400 22.360 -15.927 200 HG2 PRO 30 HG2 PRO 30 7.366 20.017 -14.633 201 HG3 PRO 30 HG1 PRO 30 8.525 20.342 -15.936 202 HD2 PRO 30 HD2 PRO 30 8.949 20.395 -12.967 203 HD3 PRO 30 HD1 PRO 30 9.997 19.741 -14.246 204 H VAL 31 HN VAL 31 9.159 25.349 -15.072 205 HA VAL 31 HA VAL 31 8.968 26.188 -12.331 206 HB VAL 31 HB VAL 31 8.725 27.884 -14.823 207 HG11 VAL 31 HG11 VAL 31 9.355 29.735 -13.363 208 HG12 VAL 31 HG12 VAL 31 9.387 28.645 -11.977 209 HG13 VAL 31 HG13 VAL 31 7.864 28.974 -12.805 210 HG21 VAL 31 HG21 VAL 31 10.843 26.705 -14.818 211 HG22 VAL 31 HG22 VAL 31 11.148 27.216 -13.159 212 HG23 VAL 31 HG23 VAL 31 11.103 28.410 -14.456 213 H PHE 32 HN PHE 32 7.078 25.070 -11.833 214 HA PHE 32 HA PHE 32 4.669 26.600 -12.059 215 HB2 PHE 32 HB2 PHE 32 4.687 25.259 -14.202 216 HB3 PHE 32 HB1 PHE 32 4.678 23.799 -13.221 217 HD1 PHE 32 HD1 PHE 32 2.752 26.828 -14.066 218 HD2 PHE 32 HD2 PHE 32 2.670 22.940 -12.346 219 HE1 PHE 32 HE1 PHE 32 0.297 26.915 -14.006 220 HE2 PHE 32 HE2 PHE 32 0.211 23.013 -12.284 221 HZ PHE 32 HZ PHE 32 -0.976 25.004 -13.114 222 H ALA 33 HN ALA 33 6.374 23.681 -11.167 223 HA ALA 33 HA ALA 33 4.778 23.393 -8.739 224 HB1 ALA 33 HB1 ALA 33 5.394 21.355 -9.954 225 HB2 ALA 33 HB2 ALA 33 6.120 21.382 -8.348 226 HB3 ALA 33 HB3 ALA 33 7.100 21.756 -9.764 227 H ASP 34 HN ASP 34 6.060 23.166 -6.649 228 HA ASP 34 HA ASP 34 7.895 25.439 -6.547 229 HB2 ASP 34 HB2 ASP 34 7.521 25.498 -4.174 230 HB3 ASP 34 HB1 ASP 34 5.960 25.331 -4.965 231 H ILE 35 HN ILE 35 9.955 25.353 -5.768 232 HA ILE 35 HA ILE 35 11.245 22.753 -5.906 233 HB ILE 35 HB ILE 35 12.490 25.476 -5.459 234 HG12 ILE 35 HG12 ILE 35 12.189 23.888 -8.022 235 HG13 ILE 35 HG11 ILE 35 11.262 25.326 -7.608 236 HG21 ILE 35 HG21 ILE 35 13.891 23.620 -4.733 237 HG22 ILE 35 HG22 ILE 35 14.561 24.381 -6.176 238 HG23 ILE 35 HG23 ILE 35 13.700 22.847 -6.305 239 HD11 ILE 35 HD11 ILE 35 14.240 25.201 -8.007 240 HD12 ILE 35 HD12 ILE 35 13.313 26.642 -7.596 241 HD13 ILE 35 HD13 ILE 35 13.062 25.847 -9.149 242 HA PRO 36 HA PRO 36 10.959 22.425 -1.495 243 HB2 PRO 36 HB2 PRO 36 12.022 19.981 -1.203 244 HB3 PRO 36 HB1 PRO 36 10.466 20.231 -2.003 245 HG2 PRO 36 HG2 PRO 36 13.167 19.790 -3.228 246 HG3 PRO 36 HG1 PRO 36 11.607 19.082 -3.682 247 HD2 PRO 36 HD2 PRO 36 12.748 21.224 -4.961 248 HD3 PRO 36 HD1 PRO 36 11.003 20.902 -4.925 249 H ALA 37 HN ALA 37 13.746 20.431 -1.398 250 HA ALA 37 HA ALA 37 15.528 22.584 -0.613 251 HB1 ALA 37 HB1 ALA 37 14.225 22.248 1.407 252 HB2 ALA 37 HB2 ALA 37 15.868 21.649 1.646 253 HB3 ALA 37 HB3 ALA 37 14.549 20.516 1.352 254 H GLY 38 HN GLY 38 17.716 21.777 -0.104 255 HA2 GLY 38 HA2 GLY 38 19.512 20.353 -0.378 256 HA3 GLY 38 HA1 GLY 38 18.373 19.025 -0.561 257 H TRP 39 HN TRP 39 18.333 21.915 -2.514 258 HA TRP 39 HA TRP 39 18.824 20.226 -4.862 259 HB2 TRP 39 HB2 TRP 39 17.483 22.011 -6.074 260 HB3 TRP 39 HB1 TRP 39 16.590 21.002 -4.942 261 HD1 TRP 39 HD1 TRP 39 15.503 22.152 -2.862 262 HE1 TRP 39 HE1 TRP 39 15.142 24.599 -2.178 263 HE3 TRP 39 HE3 TRP 39 18.637 24.400 -6.218 264 HZ2 TRP 39 HZ2 TRP 39 16.058 27.146 -2.956 265 HZ3 TRP 39 HZ3 TRP 39 18.834 26.852 -6.180 266 HH2 TRP 39 HH2 TRP 39 17.570 28.194 -4.580 267 H ARG 40 HN ARG 40 19.437 21.612 -6.813 268 HA ARG 40 HA ARG 40 21.219 23.830 -6.281 269 HB2 ARG 40 HB2 ARG 40 22.719 21.991 -5.863 270 HB3 ARG 40 HB1 ARG 40 22.168 21.145 -7.302 271 HG2 ARG 40 HG2 ARG 40 24.329 22.071 -7.720 272 HG3 ARG 40 HG1 ARG 40 23.141 22.950 -8.681 273 HD2 ARG 40 HD2 ARG 40 23.151 24.763 -7.062 274 HD3 ARG 40 HD1 ARG 40 24.290 23.874 -6.050 275 HE ARG 40 HE ARG 40 25.411 24.113 -8.594 276 HH11 ARG 40 HH11 ARG 40 24.501 26.205 -5.932 277 HH12 ARG 40 HH12 ARG 40 25.736 27.373 -6.273 278 HH21 ARG 40 HH21 ARG 40 27.014 25.618 -9.044 279 HH22 ARG 40 HH22 ARG 40 27.187 27.047 -8.066 280 H VAL 41 HN VAL 41 21.019 25.237 -7.931 281 HA VAL 41 HA VAL 41 19.644 24.372 -10.345 282 HB VAL 41 HB VAL 41 20.558 27.134 -9.512 283 HG11 VAL 41 HG11 VAL 41 18.797 26.276 -11.807 284 HG12 VAL 41 HG12 VAL 41 20.417 26.963 -11.929 285 HG13 VAL 41 HG13 VAL 41 19.088 27.944 -11.309 286 HG21 VAL 41 HG21 VAL 41 18.186 27.547 -9.062 287 HG22 VAL 41 HG22 VAL 41 18.819 26.244 -8.057 288 HG23 VAL 41 HG23 VAL 41 17.820 25.868 -9.461 289 H VAL 42 HN VAL 42 20.723 23.683 -12.057 290 HA VAL 42 HA VAL 42 23.570 24.302 -12.307 291 HB VAL 42 HB VAL 42 21.902 22.371 -13.933 292 HG11 VAL 42 HG11 VAL 42 24.892 22.631 -13.639 293 HG12 VAL 42 HG12 VAL 42 23.941 23.069 -15.060 294 HG13 VAL 42 HG13 VAL 42 24.048 21.382 -14.556 295 HG21 VAL 42 HG21 VAL 42 23.640 21.842 -11.525 296 HG22 VAL 42 HG22 VAL 42 22.880 20.610 -12.530 297 HG23 VAL 42 HG23 VAL 42 21.883 21.720 -11.593 298 H HIS 43 HN HIS 43 20.510 24.999 -13.767 299 HA HIS 43 HA HIS 43 21.614 27.060 -15.405 300 HB2 HIS 43 HB2 HIS 43 22.125 25.047 -16.778 301 HB3 HIS 43 HB1 HIS 43 20.411 24.654 -16.798 302 HD1 HIS 43 HD1 HIS 43 22.307 27.866 -17.590 303 HD2 HIS 43 HD2 HIS 43 19.473 25.306 -19.235 304 HE1 HIS 43 HE1 HIS 43 21.697 28.865 -19.815 305 HE2 HIS 43 HE2 HIS 43 20.196 27.153 -20.892 306 H GLY 44 HN GLY 44 20.006 28.497 -16.119 307 HA2 GLY 44 HA2 GLY 44 17.465 28.169 -14.740 308 HA3 GLY 44 HA1 GLY 44 18.043 29.628 -15.524 309 H GLU 45 HN GLU 45 15.822 29.728 -16.308 310 HA GLU 45 HA GLU 45 14.896 27.711 -18.096 311 HB2 GLU 45 HB2 GLU 45 13.042 29.394 -18.596 312 HB3 GLU 45 HB1 GLU 45 13.150 28.747 -16.970 313 HG2 GLU 45 HG2 GLU 45 12.810 30.913 -16.454 314 HG3 GLU 45 HG1 GLU 45 14.558 30.957 -16.594 315 H ALA 46 HN ALA 46 16.169 27.423 -19.738 316 HA ALA 46 HA ALA 46 16.023 29.461 -21.847 317 HB1 ALA 46 HB1 ALA 46 18.249 28.839 -22.640 318 HB2 ALA 46 HB2 ALA 46 18.423 27.703 -21.302 319 HB3 ALA 46 HB3 ALA 46 18.332 29.435 -20.982 320 H SER 47 HN SER 47 16.389 28.333 -24.047 321 HA SER 47 HA SER 47 14.309 26.870 -24.754 322 HB2 SER 47 HB2 SER 47 17.096 26.415 -25.833 323 HB3 SER 47 HB1 SER 47 15.600 25.966 -26.653 324 HG SER 47 HG SER 47 15.083 28.077 -26.924 325 H ARG 48 HN ARG 48 13.412 24.958 -24.504 326 HA ARG 48 HA ARG 48 14.181 23.141 -22.553 327 HB2 ARG 48 HB2 ARG 48 11.895 23.344 -23.373 328 HB3 ARG 48 HB1 ARG 48 12.376 22.732 -24.948 329 HG2 ARG 48 HG2 ARG 48 11.333 20.936 -23.896 330 HG3 ARG 48 HG1 ARG 48 13.059 20.607 -23.725 331 HD2 ARG 48 HD2 ARG 48 13.033 21.396 -21.448 332 HD3 ARG 48 HD1 ARG 48 11.351 21.908 -21.611 333 HE ARG 48 HE ARG 48 11.976 19.075 -22.018 334 HH11 ARG 48 HH11 ARG 48 10.558 21.583 -20.019 335 HH12 ARG 48 HH12 ARG 48 9.680 20.477 -19.023 336 HH21 ARG 48 HH21 ARG 48 10.834 17.613 -20.713 337 HH22 ARG 48 HH22 ARG 48 9.840 18.197 -19.418 338 H ALA 49 HN ALA 49 14.570 22.920 -26.075 339 HA ALA 49 HA ALA 49 15.703 20.356 -26.167 340 HB1 ALA 49 HB1 ALA 49 16.482 20.969 -28.393 341 HB2 ALA 49 HB2 ALA 49 16.160 22.670 -28.048 342 HB3 ALA 49 HB3 ALA 49 14.825 21.521 -28.135 343 H ALA 50 HN ALA 50 17.094 23.495 -25.528 344 HA ALA 50 HA ALA 50 19.821 22.673 -25.829 345 HB1 ALA 50 HB1 ALA 50 20.385 24.869 -25.014 346 HB2 ALA 50 HB2 ALA 50 18.736 25.120 -24.443 347 HB3 ALA 50 HB3 ALA 50 19.062 25.003 -26.172 348 H CYS 51 HN CYS 51 17.607 23.148 -23.111 349 HA CYS 51 HA CYS 51 19.536 22.647 -21.092 350 HB2 CYS 51 HB2 CYS 51 16.524 22.388 -21.011 351 HB3 CYS 51 HB1 CYS 51 17.578 22.323 -19.602 352 HG CYS 51 HG CYS 51 16.418 24.970 -21.260 353 H LEU 52 HN LEU 52 17.130 20.560 -22.691 354 HA LEU 52 HA LEU 52 17.801 18.188 -21.335 355 HB2 LEU 52 HB2 LEU 52 16.434 18.831 -23.893 356 HB3 LEU 52 HB1 LEU 52 17.021 17.194 -23.686 357 HG LEU 52 HG LEU 52 14.666 17.392 -23.063 358 HD11 LEU 52 HD11 LEU 52 16.465 16.887 -20.699 359 HD12 LEU 52 HD12 LEU 52 16.052 15.721 -21.957 360 HD13 LEU 52 HD13 LEU 52 14.801 16.332 -20.873 361 HD21 LEU 52 HD21 LEU 52 14.705 19.734 -22.332 362 HD22 LEU 52 HD22 LEU 52 15.627 19.264 -20.903 363 HD23 LEU 52 HD23 LEU 52 13.980 18.674 -21.125 364 H ASP 53 HN ASP 53 19.010 19.557 -24.376 365 HA ASP 53 HA ASP 53 20.814 17.539 -25.023 366 HB2 ASP 53 HB2 ASP 53 20.294 19.378 -26.545 367 HB3 ASP 53 HB1 ASP 53 21.082 20.519 -25.464 368 H TYR 54 HN TYR 54 21.386 20.497 -23.124 369 HA TYR 54 HA TYR 54 24.062 20.092 -22.515 370 HB2 TYR 54 HB2 TYR 54 22.909 22.201 -22.099 371 HB3 TYR 54 HB1 TYR 54 21.931 21.444 -20.849 372 HD1 TYR 54 HD1 TYR 54 25.512 22.069 -21.715 373 HD2 TYR 54 HD2 TYR 54 22.600 21.643 -18.642 374 HE1 TYR 54 HE1 TYR 54 27.203 22.676 -20.039 375 HE2 TYR 54 HE2 TYR 54 24.285 22.254 -16.957 376 HH TYR 54 HH TYR 54 26.768 22.201 -16.739 377 H VAL 55 HN VAL 55 21.224 19.079 -20.573 378 HA VAL 55 HA VAL 55 22.798 17.990 -18.492 379 HB VAL 55 HB VAL 55 20.781 16.934 -17.647 380 HG11 VAL 55 HG11 VAL 55 19.384 18.910 -17.401 381 HG12 VAL 55 HG12 VAL 55 20.229 19.679 -18.744 382 HG13 VAL 55 HG13 VAL 55 21.094 19.310 -17.251 383 HG21 VAL 55 HG21 VAL 55 19.822 16.109 -19.730 384 HG22 VAL 55 HG22 VAL 55 19.475 17.763 -20.237 385 HG23 VAL 55 HG23 VAL 55 18.647 17.081 -18.838 386 H GLU 56 HN GLU 56 21.415 16.582 -21.409 387 HA GLU 56 HA GLU 56 22.150 13.904 -20.748 388 HB2 GLU 56 HB2 GLU 56 21.474 15.141 -23.421 389 HB3 GLU 56 HB1 GLU 56 21.590 13.415 -23.092 390 HG2 GLU 56 HG2 GLU 56 19.701 15.225 -21.623 391 HG3 GLU 56 HG1 GLU 56 19.259 14.407 -23.113 392 H LYS 57 HN LYS 57 23.693 16.531 -22.539 393 HA LYS 57 HA LYS 57 25.930 15.147 -23.507 394 HB2 LYS 57 HB2 LYS 57 25.768 17.985 -22.462 395 HB3 LYS 57 HB1 LYS 57 27.131 17.330 -23.355 396 HG2 LYS 57 HG2 LYS 57 25.796 17.082 -25.330 397 HG3 LYS 57 HG1 LYS 57 24.331 17.521 -24.445 398 HD2 LYS 57 HD2 LYS 57 24.879 19.519 -25.481 399 HD3 LYS 57 HD1 LYS 57 25.635 19.704 -23.899 400 HE2 LYS 57 HE2 LYS 57 27.375 20.341 -25.225 401 HE3 LYS 57 HE1 LYS 57 27.686 18.606 -25.144 402 HZ1 LYS 57 HZ1 LYS 57 26.399 20.113 -27.348 403 HZ2 LYS 57 HZ2 LYS 57 26.383 18.420 -27.259 404 HZ3 LYS 57 HZ3 LYS 57 27.857 19.244 -27.403 405 H ASN 58 HN ASN 58 25.412 16.773 -20.387 406 HA ASN 58 HA ASN 58 27.983 16.157 -19.353 407 HB2 ASN 58 HB2 ASN 58 25.439 16.916 -17.903 408 HB3 ASN 58 HB1 ASN 58 27.029 16.824 -17.153 409 HD21 ASN 58 HD21 ASN 58 28.166 17.870 -19.783 410 HD22 ASN 58 HD22 ASN 58 27.892 19.571 -19.701 411 H TRP 59 HN TRP 59 24.922 14.483 -19.322 412 HA TRP 59 HA TRP 59 25.617 12.565 -17.346 413 HB2 TRP 59 HB2 TRP 59 23.282 13.047 -18.035 414 HB3 TRP 59 HB1 TRP 59 23.617 12.327 -19.606 415 HD1 TRP 59 HD1 TRP 59 22.894 9.890 -19.800 416 HE1 TRP 59 HE1 TRP 59 22.464 7.952 -18.161 417 HE3 TRP 59 HE3 TRP 59 24.268 12.187 -15.447 418 HZ2 TRP 59 HZ2 TRP 59 22.661 7.471 -15.392 419 HZ3 TRP 59 HZ3 TRP 59 24.119 10.918 -13.348 420 HH2 TRP 59 HH2 TRP 59 23.333 8.607 -13.319 421 H THR 60 HN THR 60 26.182 12.875 -20.754 422 HA THR 60 HA THR 60 27.157 10.161 -21.070 423 HB THR 60 HB THR 60 27.310 12.466 -23.025 424 HG1 THR 60 HG1 THR 60 25.160 12.215 -22.731 425 HG21 THR 60 HG21 THR 60 28.757 10.543 -23.543 426 HG22 THR 60 HG22 THR 60 27.451 10.715 -24.716 427 HG23 THR 60 HG23 THR 60 27.356 9.474 -23.463 428 H ASP 61 HN ASP 61 28.441 13.456 -21.190 429 HA ASP 61 HA ASP 61 31.142 12.387 -20.708 430 HB2 ASP 61 HB2 ASP 61 31.062 13.276 -22.946 431 HB3 ASP 61 HB1 ASP 61 30.261 14.741 -22.390 432 H LEU 62 HN LEU 62 31.775 12.865 -18.714 433 HA LEU 62 HA LEU 62 30.320 14.772 -17.149 434 HB2 LEU 62 HB2 LEU 62 32.655 12.983 -16.503 435 HB3 LEU 62 HB1 LEU 62 31.977 14.105 -15.342 436 HG LEU 62 HG LEU 62 31.105 11.940 -14.873 437 HD11 LEU 62 HD11 LEU 62 29.531 13.754 -14.603 438 HD12 LEU 62 HD12 LEU 62 28.693 12.296 -15.134 439 HD13 LEU 62 HD13 LEU 62 29.020 13.595 -16.282 440 HD21 LEU 62 HD21 LEU 62 30.237 11.815 -17.755 441 HD22 LEU 62 HD22 LEU 62 29.804 10.644 -16.511 442 HD23 LEU 62 HD23 LEU 62 31.491 10.838 -16.991 443 H ARG 63 HN ARG 63 30.897 16.596 -18.519 444 HA ARG 63 HA ARG 63 33.113 18.031 -17.298 445 HB2 ARG 63 HB2 ARG 63 32.852 17.526 -20.257 446 HB3 ARG 63 HB1 ARG 63 33.651 18.973 -19.658 447 HG2 ARG 63 HG2 ARG 63 35.483 17.855 -19.009 448 HG3 ARG 63 HG1 ARG 63 34.563 16.463 -18.439 449 HD2 ARG 63 HD2 ARG 63 35.936 15.797 -20.289 450 HD3 ARG 63 HD1 ARG 63 34.247 15.766 -20.783 451 HE ARG 63 HE ARG 63 35.489 18.242 -21.445 452 HH11 ARG 63 HH11 ARG 63 35.017 14.927 -22.449 453 HH12 ARG 63 HH12 ARG 63 35.518 15.211 -24.087 454 HH21 ARG 63 HH21 ARG 63 36.099 18.640 -23.630 455 HH22 ARG 63 HH22 ARG 63 36.122 17.313 -24.763 456 HA PRO 64 HA PRO 64 29.325 20.579 -17.399 457 HB2 PRO 64 HB2 PRO 64 29.998 22.040 -15.208 458 HB3 PRO 64 HB1 PRO 64 29.230 20.452 -15.105 459 HG2 PRO 64 HG2 PRO 64 32.124 21.176 -14.819 460 HG3 PRO 64 HG1 PRO 64 31.148 20.061 -13.843 461 HD2 PRO 64 HD2 PRO 64 32.831 19.199 -15.778 462 HD3 PRO 64 HD1 PRO 64 31.312 18.361 -15.397 463 H LYS 65 HN LYS 65 29.039 22.628 -18.216 464 HA LYS 65 HA LYS 65 31.421 23.822 -19.336 465 HB2 LYS 65 HB2 LYS 65 28.520 24.611 -19.664 466 HB3 LYS 65 HB1 LYS 65 29.872 25.281 -20.568 467 HG2 LYS 65 HG2 LYS 65 30.344 22.939 -21.367 468 HG3 LYS 65 HG1 LYS 65 28.788 22.484 -20.670 469 HD2 LYS 65 HD2 LYS 65 28.530 22.959 -23.033 470 HD3 LYS 65 HD1 LYS 65 27.693 24.187 -22.080 471 HE2 LYS 65 HE2 LYS 65 28.903 25.247 -23.881 472 HE3 LYS 65 HE1 LYS 65 29.639 25.675 -22.339 473 HZ1 LYS 65 HZ1 LYS 65 30.642 23.693 -24.307 474 HZ2 LYS 65 HZ2 LYS 65 31.303 23.897 -22.758 475 HZ3 LYS 65 HZ3 LYS 65 31.358 25.167 -23.881 476 H SER 66 HN SER 66 32.264 24.416 -17.248 477 HA SER 66 HA SER 66 32.973 26.021 -15.831 478 HB2 SER 66 HB2 SER 66 32.785 27.445 -17.911 479 HB3 SER 66 HB1 SER 66 31.206 27.967 -17.325 480 HG SER 66 HG SER 66 32.173 28.924 -15.573 481 H LEU 67 HN LEU 67 32.184 25.397 -13.910 482 HA LEU 67 HA LEU 67 29.460 26.140 -13.172 483 HB2 LEU 67 HB2 LEU 67 29.925 24.875 -11.088 484 HB3 LEU 67 HB1 LEU 67 30.077 23.917 -12.544 485 HG LEU 67 HG LEU 67 32.634 24.486 -12.297 486 HD11 LEU 67 HD11 LEU 67 31.662 24.770 -9.461 487 HD12 LEU 67 HD12 LEU 67 32.400 26.037 -10.440 488 HD13 LEU 67 HD13 LEU 67 33.344 24.625 -9.966 489 HD21 LEU 67 HD21 LEU 67 32.920 22.439 -10.984 490 HD22 LEU 67 HD22 LEU 67 31.698 22.249 -12.241 491 HD23 LEU 67 HD23 LEU 67 31.208 22.476 -10.561 492 H ARG 68 HN ARG 68 32.613 27.293 -12.987 493 HA ARG 68 HA ARG 68 32.009 29.110 -10.772 494 HB2 ARG 68 HB2 ARG 68 34.209 27.993 -10.768 495 HB3 ARG 68 HB1 ARG 68 34.568 28.690 -12.339 496 HG2 ARG 68 HG2 ARG 68 34.529 30.925 -11.375 497 HG3 ARG 68 HG1 ARG 68 34.122 30.245 -9.799 498 HD2 ARG 68 HD2 ARG 68 36.498 30.752 -9.926 499 HD3 ARG 68 HD1 ARG 68 36.239 29.014 -9.786 500 HE ARG 68 HE ARG 68 36.550 30.032 -12.484 501 HH11 ARG 68 HH11 ARG 68 38.123 28.630 -9.680 502 HH12 ARG 68 HH12 ARG 68 39.476 28.031 -10.588 503 HH21 ARG 68 HH21 ARG 68 38.320 29.217 -13.674 504 HH22 ARG 68 HH22 ARG 68 39.595 28.368 -12.837 505 H ASP 69 HN ASP 69 32.079 31.358 -11.050 506 HA ASP 69 HA ASP 69 31.598 33.323 -12.053 507 HB2 ASP 69 HB2 ASP 69 33.826 33.026 -13.075 508 HB3 ASP 69 HB1 ASP 69 33.086 32.168 -14.421 509 H ALA 70 HN ALA 70 29.414 32.428 -11.906 510 HA ALA 70 HA ALA 70 28.160 32.464 -14.568 511 HB1 ALA 70 HB1 ALA 70 27.414 30.598 -12.317 512 HB2 ALA 70 HB2 ALA 70 28.205 30.139 -13.826 513 HB3 ALA 70 HB3 ALA 70 26.552 30.758 -13.847 514 H MET 71 HN MET 71 28.227 33.382 -11.277 515 HA MET 71 HA MET 71 26.097 35.310 -11.771 516 HB2 MET 71 HB2 MET 71 25.066 34.882 -9.571 517 HB3 MET 71 HB1 MET 71 24.951 33.479 -10.626 518 HG2 MET 71 HG2 MET 71 26.853 32.462 -9.458 519 HG3 MET 71 HG1 MET 71 26.926 33.860 -8.387 520 HE1 MET 71 HE1 MET 71 26.688 30.789 -7.406 521 HE2 MET 71 HE2 MET 71 25.554 31.007 -6.073 522 HE3 MET 71 HE3 MET 71 26.843 32.182 -6.334 523 H VAL 72 HN VAL 72 26.356 37.233 -10.591 524 HA VAL 72 HA VAL 72 29.112 37.555 -9.642 525 HB VAL 72 HB VAL 72 27.104 39.706 -10.338 526 HG11 VAL 72 HG11 VAL 72 30.093 39.832 -9.954 527 HG12 VAL 72 HG12 VAL 72 28.881 40.443 -8.830 528 HG13 VAL 72 HG13 VAL 72 29.050 41.174 -10.424 529 HG21 VAL 72 HG21 VAL 72 29.338 38.568 -12.015 530 HG22 VAL 72 HG22 VAL 72 28.311 39.933 -12.449 531 HG23 VAL 72 HG23 VAL 72 27.614 38.323 -12.289 532 H GLU 73 HN GLU 73 29.190 37.056 -7.526 533 HA GLU 73 HA GLU 73 27.174 37.948 -5.681 534 HB2 GLU 73 HB2 GLU 73 28.768 37.044 -3.948 535 HB3 GLU 73 HB1 GLU 73 28.201 35.879 -5.135 536 HG2 GLU 73 HG2 GLU 73 30.314 36.117 -6.357 537 HG3 GLU 73 HG1 GLU 73 30.882 37.250 -5.130 538 H ASP 74 HN ASP 74 27.204 40.164 -6.091 539 HA ASP 74 HA ASP 74 29.197 41.657 -4.630 540 HB2 ASP 74 HB2 ASP 74 30.291 41.493 -6.800 541 HB3 ASP 74 HB1 ASP 74 28.828 42.041 -7.612 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 -15.780 22.132 -23.643 2 H2 GLY 1 HT2 GLY 1 -14.916 22.092 -22.187 3 H3 GLY 1 HT3 GLY 1 -15.212 20.654 -23.038 4 HA2 GLY 1 HA1 GLY 1 -13.460 22.893 -23.883 5 HA3 GLY 1 HA2 GLY 1 -12.948 21.274 -23.413 6 H SER 2 HN SER 2 -13.645 23.250 -25.992 7 HA SER 2 HA SER 2 -14.896 21.192 -27.623 8 HB2 SER 2 HB2 SER 2 -14.370 24.115 -28.190 9 HB3 SER 2 HB1 SER 2 -15.278 23.021 -29.233 10 HG SER 2 HG SER 2 -16.174 24.424 -27.164 11 H HIS 3 HN HIS 3 -11.876 21.300 -26.897 12 HA HIS 3 HA HIS 3 -10.874 21.248 -29.636 13 HB2 HIS 3 HB2 HIS 3 -8.692 21.276 -28.824 14 HB3 HIS 3 HB1 HIS 3 -9.547 22.260 -27.654 15 HD1 HIS 3 HD1 HIS 3 -9.823 21.253 -25.241 16 HD2 HIS 3 HD2 HIS 3 -7.500 18.980 -27.841 17 HE1 HIS 3 HE1 HIS 3 -8.588 19.601 -23.789 18 HE2 HIS 3 HE2 HIS 3 -7.090 18.328 -25.373 19 H MET 4 HN MET 4 -11.216 19.497 -30.768 20 HA MET 4 HA MET 4 -11.902 17.038 -29.430 21 HB2 MET 4 HB2 MET 4 -12.413 16.191 -31.712 22 HB3 MET 4 HB1 MET 4 -13.289 17.651 -31.286 23 HG2 MET 4 HG2 MET 4 -10.786 17.647 -32.957 24 HG3 MET 4 HG1 MET 4 -12.410 17.551 -33.632 25 HE1 MET 4 HE1 MET 4 -13.941 20.990 -32.512 26 HE2 MET 4 HE2 MET 4 -14.036 19.455 -31.648 27 HE3 MET 4 HE3 MET 4 -14.226 19.495 -33.401 28 H SER 5 HN SER 5 -9.657 16.993 -28.552 29 HA SER 5 HA SER 5 -8.246 14.921 -29.972 30 HB2 SER 5 HB2 SER 5 -6.876 17.550 -29.343 31 HB3 SER 5 HB1 SER 5 -6.028 16.069 -29.791 32 HG SER 5 HG SER 5 -8.015 16.643 -31.546 33 H THR 6 HN THR 6 -8.089 13.439 -28.444 34 HA THR 6 HA THR 6 -8.081 14.089 -25.662 35 HB THR 6 HB THR 6 -7.546 11.553 -25.479 36 HG1 THR 6 HG1 THR 6 -7.026 11.748 -27.957 37 HG21 THR 6 HG21 THR 6 -9.761 12.523 -25.087 38 HG22 THR 6 HG22 THR 6 -9.888 10.986 -25.943 39 HG23 THR 6 HG23 THR 6 -10.081 12.503 -26.821 40 H ASN 7 HN ASN 7 -6.391 14.916 -24.683 41 HA ASN 7 HA ASN 7 -3.813 15.061 -25.745 42 HB2 ASN 7 HB2 ASN 7 -4.786 15.477 -22.915 43 HB3 ASN 7 HB1 ASN 7 -3.153 15.849 -23.448 44 HD21 ASN 7 HD21 ASN 7 -3.334 18.008 -23.000 45 HD22 ASN 7 HD22 ASN 7 -4.318 19.092 -23.928 46 HA PRO 8 HA PRO 8 -2.288 11.100 -24.249 47 HB2 PRO 8 HB2 PRO 8 -0.162 11.232 -26.107 48 HB3 PRO 8 HB1 PRO 8 -1.667 10.331 -26.287 49 HG2 PRO 8 HG2 PRO 8 -0.871 12.534 -27.819 50 HG3 PRO 8 HG1 PRO 8 -2.500 11.844 -27.746 51 HD2 PRO 8 HD2 PRO 8 -1.392 14.240 -26.367 52 HD3 PRO 8 HD1 PRO 8 -3.036 13.938 -26.966 53 H PHE 9 HN PHE 9 -1.179 14.184 -23.969 54 HA PHE 9 HA PHE 9 1.149 13.350 -22.399 55 HB2 PHE 9 HB2 PHE 9 2.353 15.397 -23.187 56 HB3 PHE 9 HB1 PHE 9 2.086 14.203 -24.451 57 HD1 PHE 9 HD1 PHE 9 1.099 17.509 -23.182 58 HD2 PHE 9 HD2 PHE 9 0.682 14.677 -26.331 59 HE1 PHE 9 HE1 PHE 9 0.061 19.237 -24.593 60 HE2 PHE 9 HE2 PHE 9 -0.362 16.397 -27.744 61 HZ PHE 9 HZ PHE 9 -0.670 18.681 -26.879 62 H ASP 10 HN ASP 10 1.828 15.017 -20.828 63 HA ASP 10 HA ASP 10 -0.498 16.090 -19.488 64 HB2 ASP 10 HB2 ASP 10 2.439 16.170 -18.747 65 HB3 ASP 10 HB1 ASP 10 1.134 16.774 -17.731 66 H ASP 11 HN ASP 11 -0.470 18.339 -18.632 67 HA ASP 11 HA ASP 11 0.063 20.109 -20.847 68 HB2 ASP 11 HB2 ASP 11 -1.219 21.774 -19.606 69 HB3 ASP 11 HB1 ASP 11 -2.093 20.250 -19.671 70 H ASP 12 HN ASP 12 2.355 19.959 -20.755 71 HA ASP 12 HA ASP 12 3.870 21.022 -18.604 72 HB2 ASP 12 HB2 ASP 12 4.893 19.606 -20.320 73 HB3 ASP 12 HB1 ASP 12 4.533 20.806 -21.554 74 H ASN 13 HN ASN 13 3.425 23.007 -17.874 75 HA ASN 13 HA ASN 13 2.868 25.118 -19.848 76 HB2 ASN 13 HB2 ASN 13 1.243 26.070 -18.303 77 HB3 ASN 13 HB1 ASN 13 0.829 24.398 -18.661 78 HD21 ASN 13 HD21 ASN 13 1.084 22.825 -17.066 79 HD22 ASN 13 HD22 ASN 13 1.236 23.248 -15.395 80 H GLY 14 HN GLY 14 3.172 27.323 -19.002 81 HA2 GLY 14 HA2 GLY 14 4.475 28.953 -18.060 82 HA3 GLY 14 HA1 GLY 14 4.826 27.828 -16.756 83 H ALA 15 HN ALA 15 6.953 28.713 -16.776 84 HA ALA 15 HA ALA 15 8.662 27.878 -18.997 85 HB1 ALA 15 HB1 ALA 15 9.333 29.439 -16.501 86 HB2 ALA 15 HB2 ALA 15 8.993 30.128 -18.089 87 HB3 ALA 15 HB3 ALA 15 10.424 29.126 -17.850 88 H PHE 16 HN PHE 16 10.864 26.947 -18.173 89 HA PHE 16 HA PHE 16 10.494 25.162 -15.888 90 HB2 PHE 16 HB2 PHE 16 11.743 23.404 -17.421 91 HB3 PHE 16 HB1 PHE 16 9.993 23.560 -17.486 92 HD1 PHE 16 HD1 PHE 16 12.930 25.234 -19.047 93 HD2 PHE 16 HD2 PHE 16 9.097 23.490 -19.587 94 HE1 PHE 16 HE1 PHE 16 13.059 25.720 -21.439 95 HE2 PHE 16 HE2 PHE 16 9.215 23.965 -22.000 96 HZ PHE 16 HZ PHE 16 11.201 25.083 -22.931 97 H PHE 17 HN PHE 17 12.416 24.607 -14.834 98 HA PHE 17 HA PHE 17 14.725 26.257 -15.637 99 HB2 PHE 17 HB2 PHE 17 13.386 25.830 -13.095 100 HB3 PHE 17 HB1 PHE 17 15.090 25.416 -12.979 101 HD1 PHE 17 HD2 PHE 17 13.156 28.128 -14.678 102 HD2 PHE 17 HD1 PHE 17 16.317 27.086 -12.029 103 HE1 PHE 17 HE2 PHE 17 13.701 30.509 -14.400 104 HE2 PHE 17 HE1 PHE 17 16.868 29.467 -11.743 105 HZ PHE 17 HZ PHE 17 15.558 31.183 -12.928 106 H VAL 18 HN VAL 18 16.869 25.385 -15.252 107 HA VAL 18 HA VAL 18 16.972 22.500 -15.677 108 HB VAL 18 HB VAL 18 19.320 24.390 -15.472 109 HG11 VAL 18 HG11 VAL 18 19.880 22.037 -15.276 110 HG12 VAL 18 HG12 VAL 18 20.463 22.685 -16.812 111 HG13 VAL 18 HG13 VAL 18 19.008 21.688 -16.769 112 HG21 VAL 18 HG21 VAL 18 19.287 24.566 -17.893 113 HG22 VAL 18 HG22 VAL 18 17.791 25.194 -17.203 114 HG23 VAL 18 HG23 VAL 18 17.814 23.603 -17.959 115 H LEU 19 HN LEU 19 16.595 21.451 -13.797 116 HA LEU 19 HA LEU 19 18.029 22.383 -11.398 117 HB2 LEU 19 HB2 LEU 19 15.462 22.519 -11.516 118 HB3 LEU 19 HB1 LEU 19 15.482 20.771 -11.435 119 HG LEU 19 HG LEU 19 16.685 20.965 -9.246 120 HD11 LEU 19 HD11 LEU 19 16.552 23.121 -8.085 121 HD12 LEU 19 HD12 LEU 19 15.989 23.867 -9.580 122 HD13 LEU 19 HD13 LEU 19 17.609 23.174 -9.494 123 HD21 LEU 19 HD21 LEU 19 14.293 20.529 -9.363 124 HD22 LEU 19 HD22 LEU 19 13.976 22.262 -9.426 125 HD23 LEU 19 HD23 LEU 19 14.685 21.549 -7.979 126 H VAL 20 HN VAL 20 18.626 20.646 -9.874 127 HA VAL 20 HA VAL 20 18.366 17.929 -10.871 128 HB VAL 20 HB VAL 20 20.544 18.556 -11.752 129 HG11 VAL 20 HG11 VAL 20 21.298 19.223 -8.913 130 HG12 VAL 20 HG12 VAL 20 21.080 20.373 -10.232 131 HG13 VAL 20 HG13 VAL 20 22.396 19.198 -10.295 132 HG21 VAL 20 HG21 VAL 20 20.274 16.263 -10.982 133 HG22 VAL 20 HG22 VAL 20 20.791 16.730 -9.362 134 HG23 VAL 20 HG23 VAL 20 21.927 16.817 -10.708 135 H ASN 21 HN ASN 21 17.844 16.573 -9.295 136 HA ASN 21 HA ASN 21 17.860 17.566 -6.560 137 HB2 ASN 21 HB2 ASN 21 15.797 16.524 -7.348 138 HB3 ASN 21 HB1 ASN 21 16.669 15.045 -7.747 139 HD21 ASN 21 HD21 ASN 21 15.511 17.074 -5.136 140 HD22 ASN 21 HD22 ASN 21 15.624 15.872 -3.898 141 H ASP 22 HN ASP 22 18.758 16.416 -4.828 142 HA ASP 22 HA ASP 22 21.381 15.642 -5.082 143 HB2 ASP 22 HB2 ASP 22 20.263 16.299 -2.977 144 HB3 ASP 22 HB1 ASP 22 19.440 14.745 -2.943 145 H GLU 23 HN GLU 23 18.516 13.581 -5.223 146 HA GLU 23 HA GLU 23 20.229 11.202 -5.402 147 HB2 GLU 23 HB2 GLU 23 17.237 11.390 -5.041 148 HB3 GLU 23 HB1 GLU 23 18.199 9.920 -4.977 149 HG2 GLU 23 HG2 GLU 23 19.338 10.731 -2.995 150 HG3 GLU 23 HG1 GLU 23 18.422 12.236 -3.072 151 H ASP 24 HN ASP 24 19.150 13.336 -7.554 152 HA ASP 24 HA ASP 24 18.296 11.277 -9.488 153 HB2 ASP 24 HB2 ASP 24 16.449 12.786 -8.954 154 HB3 ASP 24 HB1 ASP 24 17.438 14.180 -9.369 155 H GLN 25 HN GLN 25 18.797 11.761 -11.759 156 HA GLN 25 HA GLN 25 21.555 12.560 -12.001 157 HB2 GLN 25 HB2 GLN 25 19.554 11.546 -14.026 158 HB3 GLN 25 HB1 GLN 25 21.240 11.884 -14.395 159 HG2 GLN 25 HG2 GLN 25 21.973 10.169 -12.885 160 HG3 GLN 25 HG1 GLN 25 20.324 9.905 -12.322 161 HE21 GLN 25 HE21 GLN 25 20.398 7.724 -12.901 162 HE22 GLN 25 HE22 GLN 25 20.328 7.220 -14.557 163 H HIS 26 HN HIS 26 18.438 13.731 -13.227 164 HA HIS 26 HA HIS 26 19.352 16.416 -13.363 165 HB2 HIS 26 HB2 HIS 26 18.934 16.640 -15.883 166 HB3 HIS 26 HB1 HIS 26 20.462 15.936 -15.376 167 HD1 HIS 26 HD1 HIS 26 17.151 14.099 -15.755 168 HD2 HIS 26 HD2 HIS 26 20.946 14.229 -17.451 169 HE1 HIS 26 HE1 HIS 26 17.220 12.207 -17.412 170 HE2 HIS 26 HE2 HIS 26 19.442 12.446 -18.579 171 H SER 27 HN SER 27 17.649 17.759 -13.151 172 HA SER 27 HA SER 27 14.998 16.519 -13.482 173 HB2 SER 27 HB2 SER 27 15.728 18.510 -11.336 174 HB3 SER 27 HB1 SER 27 14.298 17.483 -11.421 175 HG SER 27 HG SER 27 16.165 15.748 -11.442 176 H LEU 28 HN LEU 28 13.904 17.545 -15.060 177 HA LEU 28 HA LEU 28 14.267 20.416 -15.415 178 HB2 LEU 28 HB2 LEU 28 13.105 18.243 -17.065 179 HB3 LEU 28 HB1 LEU 28 12.393 19.834 -17.247 180 HG LEU 28 HG LEU 28 14.137 19.407 -18.933 181 HD11 LEU 28 HD11 LEU 28 15.397 21.465 -18.621 182 HD12 LEU 28 HD12 LEU 28 14.900 21.524 -16.928 183 HD13 LEU 28 HD13 LEU 28 13.699 21.690 -18.209 184 HD21 LEU 28 HD21 LEU 28 15.997 19.245 -16.570 185 HD22 LEU 28 HD22 LEU 28 16.489 19.301 -18.261 186 HD23 LEU 28 HD23 LEU 28 15.571 17.922 -17.653 187 H TRP 29 HN TRP 29 13.233 21.589 -13.998 188 HA TRP 29 HA TRP 29 10.640 20.642 -12.982 189 HB2 TRP 29 HB2 TRP 29 12.455 20.773 -11.320 190 HB3 TRP 29 HB1 TRP 29 12.688 22.473 -11.702 191 HD1 TRP 29 HD1 TRP 29 11.629 24.015 -9.990 192 HE1 TRP 29 HE1 TRP 29 9.617 23.908 -8.376 193 HE3 TRP 29 HE3 TRP 29 9.852 19.371 -11.199 194 HZ2 TRP 29 HZ2 TRP 29 7.565 22.095 -7.705 195 HZ3 TRP 29 HZ3 TRP 29 7.859 18.528 -10.022 196 HH2 TRP 29 HH2 TRP 29 6.743 19.865 -8.312 197 HA PRO 30 HA PRO 30 8.903 24.091 -15.228 198 HB2 PRO 30 HB2 PRO 30 6.484 23.431 -13.678 199 HB3 PRO 30 HB1 PRO 30 6.723 23.463 -15.427 200 HG2 PRO 30 HG2 PRO 30 6.463 21.153 -14.096 201 HG3 PRO 30 HG1 PRO 30 7.552 21.306 -15.487 202 HD2 PRO 30 HD2 PRO 30 8.201 21.305 -12.563 203 HD3 PRO 30 HD1 PRO 30 9.057 20.519 -13.906 204 H VAL 31 HN VAL 31 8.817 26.167 -14.784 205 HA VAL 31 HA VAL 31 9.018 27.106 -12.054 206 HB VAL 31 HB VAL 31 8.820 28.775 -14.563 207 HG11 VAL 31 HG11 VAL 31 10.077 30.423 -13.255 208 HG12 VAL 31 HG12 VAL 31 10.035 29.342 -11.861 209 HG13 VAL 31 HG13 VAL 31 8.535 30.020 -12.497 210 HG21 VAL 31 HG21 VAL 31 10.603 27.158 -14.859 211 HG22 VAL 31 HG22 VAL 31 11.287 27.605 -13.295 212 HG23 VAL 31 HG23 VAL 31 11.267 28.774 -14.615 213 H PHE 32 HN PHE 32 6.931 26.342 -11.434 214 HA PHE 32 HA PHE 32 4.827 28.271 -11.763 215 HB2 PHE 32 HB2 PHE 32 4.529 26.872 -13.792 216 HB3 PHE 32 HB1 PHE 32 4.395 25.446 -12.770 217 HD1 PHE 32 HD1 PHE 32 2.798 28.690 -13.548 218 HD2 PHE 32 HD2 PHE 32 2.339 24.816 -11.853 219 HE1 PHE 32 HE1 PHE 32 0.368 29.052 -13.387 220 HE2 PHE 32 HE2 PHE 32 -0.089 25.168 -11.688 221 HZ PHE 32 HZ PHE 32 -1.075 27.289 -12.455 222 H ALA 33 HN ALA 33 5.927 25.146 -10.607 223 HA ALA 33 HA ALA 33 4.191 25.381 -8.259 224 HB1 ALA 33 HB1 ALA 33 5.878 23.051 -9.175 225 HB2 ALA 33 HB2 ALA 33 4.146 23.233 -9.448 226 HB3 ALA 33 HB3 ALA 33 4.766 23.055 -7.807 227 H ASP 34 HN ASP 34 5.228 24.790 -6.155 228 HA ASP 34 HA ASP 34 7.414 26.543 -5.683 229 HB2 ASP 34 HB2 ASP 34 6.127 24.458 -3.913 230 HB3 ASP 34 HB1 ASP 34 7.330 25.620 -3.362 231 H ILE 35 HN ILE 35 9.553 26.131 -5.227 232 HA ILE 35 HA ILE 35 10.617 23.649 -6.242 233 HB ILE 35 HB ILE 35 12.015 26.012 -4.969 234 HG12 ILE 35 HG12 ILE 35 11.706 25.191 -7.869 235 HG13 ILE 35 HG11 ILE 35 10.890 26.542 -7.093 236 HG21 ILE 35 HG21 ILE 35 13.172 23.651 -6.447 237 HG22 ILE 35 HG22 ILE 35 13.336 23.985 -4.724 238 HG23 ILE 35 HG23 ILE 35 14.075 25.067 -5.904 239 HD11 ILE 35 HD11 ILE 35 13.029 27.650 -6.748 240 HD12 ILE 35 HD12 ILE 35 12.772 27.275 -8.455 241 HD13 ILE 35 HD13 ILE 35 13.863 26.283 -7.490 242 HA PRO 36 HA PRO 36 10.445 21.627 -2.254 243 HB2 PRO 36 HB2 PRO 36 11.732 19.361 -3.032 244 HB3 PRO 36 HB1 PRO 36 10.041 19.692 -3.426 245 HG2 PRO 36 HG2 PRO 36 12.489 20.042 -5.111 246 HG3 PRO 36 HG1 PRO 36 10.907 19.379 -5.559 247 HD2 PRO 36 HD2 PRO 36 11.645 21.906 -6.164 248 HD3 PRO 36 HD1 PRO 36 9.962 21.462 -5.815 249 H ALA 37 HN ALA 37 12.491 19.852 -1.469 250 HA ALA 37 HA ALA 37 14.792 21.666 -1.192 251 HB1 ALA 37 HB1 ALA 37 13.963 19.352 0.557 252 HB2 ALA 37 HB2 ALA 37 13.720 21.060 0.918 253 HB3 ALA 37 HB3 ALA 37 15.354 20.402 0.825 254 H GLY 38 HN GLY 38 16.902 20.315 -0.788 255 HA2 GLY 38 HA2 GLY 38 18.465 18.831 -1.598 256 HA3 GLY 38 HA1 GLY 38 17.133 17.798 -2.099 257 H TRP 39 HN TRP 39 17.540 21.110 -3.114 258 HA TRP 39 HA TRP 39 17.651 20.141 -5.882 259 HB2 TRP 39 HB2 TRP 39 16.594 22.315 -6.456 260 HB3 TRP 39 HB1 TRP 39 15.609 21.353 -5.357 261 HD1 TRP 39 HD1 TRP 39 15.464 22.210 -2.782 262 HE1 TRP 39 HE1 TRP 39 15.787 24.547 -1.748 263 HE3 TRP 39 HE3 TRP 39 17.880 24.494 -6.670 264 HZ2 TRP 39 HZ2 TRP 39 16.908 27.019 -2.487 265 HZ3 TRP 39 HZ3 TRP 39 18.545 26.849 -6.420 266 HH2 TRP 39 HH2 TRP 39 18.068 28.086 -4.370 267 H ARG 40 HN ARG 40 19.091 20.977 -7.315 268 HA ARG 40 HA ARG 40 20.618 23.350 -6.523 269 HB2 ARG 40 HB2 ARG 40 22.063 21.319 -6.279 270 HB3 ARG 40 HB1 ARG 40 21.811 20.981 -7.987 271 HG2 ARG 40 HG2 ARG 40 22.825 23.172 -8.527 272 HG3 ARG 40 HG1 ARG 40 23.169 23.397 -6.813 273 HD2 ARG 40 HD2 ARG 40 24.522 21.316 -6.864 274 HD3 ARG 40 HD1 ARG 40 24.251 21.222 -8.605 275 HE ARG 40 HE ARG 40 25.651 23.468 -7.299 276 HH11 ARG 40 HH11 ARG 40 25.365 21.126 -9.893 277 HH12 ARG 40 HH12 ARG 40 26.698 21.792 -10.799 278 HH21 ARG 40 HH21 ARG 40 27.394 24.332 -8.477 279 HH22 ARG 40 HH22 ARG 40 27.842 23.622 -10.001 280 H VAL 41 HN VAL 41 20.538 24.906 -8.041 281 HA VAL 41 HA VAL 41 19.177 24.312 -10.546 282 HB VAL 41 HB VAL 41 20.103 26.952 -9.394 283 HG11 VAL 41 HG11 VAL 41 18.390 26.408 -11.817 284 HG12 VAL 41 HG12 VAL 41 20.044 27.018 -11.833 285 HG13 VAL 41 HG13 VAL 41 18.751 27.996 -11.143 286 HG21 VAL 41 HG21 VAL 41 17.698 27.357 -9.020 287 HG22 VAL 41 HG22 VAL 41 18.300 25.978 -8.101 288 HG23 VAL 41 HG23 VAL 41 17.356 25.714 -9.566 289 H VAL 42 HN VAL 42 20.271 23.782 -12.278 290 HA VAL 42 HA VAL 42 23.115 24.286 -12.465 291 HB VAL 42 HB VAL 42 21.277 23.030 -14.515 292 HG11 VAL 42 HG11 VAL 42 23.387 23.789 -15.457 293 HG12 VAL 42 HG12 VAL 42 23.342 22.027 -15.394 294 HG13 VAL 42 HG13 VAL 42 24.275 22.929 -14.199 295 HG21 VAL 42 HG21 VAL 42 21.179 21.782 -12.420 296 HG22 VAL 42 HG22 VAL 42 22.940 21.702 -12.372 297 HG23 VAL 42 HG23 VAL 42 22.055 20.869 -13.648 298 H HIS 43 HN HIS 43 20.129 25.284 -14.064 299 HA HIS 43 HA HIS 43 21.221 27.831 -14.747 300 HB2 HIS 43 HB2 HIS 43 21.394 25.739 -16.725 301 HB3 HIS 43 HB1 HIS 43 20.282 26.988 -17.276 302 HD1 HIS 43 HD1 HIS 43 23.666 27.123 -15.526 303 HD2 HIS 43 HD2 HIS 43 21.672 28.741 -18.797 304 HE1 HIS 43 HE1 HIS 43 25.297 28.712 -16.595 305 HE2 HIS 43 HE2 HIS 43 24.139 29.546 -18.670 306 H GLY 44 HN GLY 44 19.529 29.080 -16.110 307 HA2 GLY 44 HA2 GLY 44 17.080 28.811 -14.603 308 HA3 GLY 44 HA1 GLY 44 17.493 30.104 -15.715 309 H GLU 45 HN GLU 45 15.684 30.186 -16.911 310 HA GLU 45 HA GLU 45 14.546 27.730 -17.963 311 HB2 GLU 45 HB2 GLU 45 13.094 29.838 -19.049 312 HB3 GLU 45 HB1 GLU 45 12.658 28.882 -17.636 313 HG2 GLU 45 HG2 GLU 45 12.503 31.101 -16.940 314 HG3 GLU 45 HG1 GLU 45 14.023 30.484 -16.292 315 H ALA 46 HN ALA 46 15.823 26.994 -19.416 316 HA ALA 46 HA ALA 46 16.244 28.572 -21.871 317 HB1 ALA 46 HB1 ALA 46 18.032 26.384 -20.801 318 HB2 ALA 46 HB2 ALA 46 18.367 28.111 -20.695 319 HB3 ALA 46 HB3 ALA 46 18.294 27.322 -22.271 320 H SER 47 HN SER 47 16.445 27.108 -23.840 321 HA SER 47 HA SER 47 14.138 25.778 -24.379 322 HB2 SER 47 HB2 SER 47 16.817 24.993 -25.544 323 HB3 SER 47 HB1 SER 47 15.238 24.903 -26.327 324 HG SER 47 HG SER 47 15.174 27.099 -26.496 325 H ARG 48 HN ARG 48 13.256 23.843 -23.951 326 HA ARG 48 HA ARG 48 14.101 22.350 -21.765 327 HB2 ARG 48 HB2 ARG 48 11.788 22.475 -22.722 328 HB3 ARG 48 HB1 ARG 48 12.309 21.386 -24.001 329 HG2 ARG 48 HG2 ARG 48 11.153 20.085 -22.405 330 HG3 ARG 48 HG1 ARG 48 12.868 19.716 -22.206 331 HD2 ARG 48 HD2 ARG 48 13.022 21.061 -20.264 332 HD3 ARG 48 HD1 ARG 48 11.441 21.784 -20.551 333 HE ARG 48 HE ARG 48 11.970 19.102 -19.498 334 HH11 ARG 48 HH11 ARG 48 9.665 21.552 -20.454 335 HH12 ARG 48 HH12 ARG 48 8.341 20.859 -19.563 336 HH21 ARG 48 HH21 ARG 48 10.236 18.175 -18.300 337 HH22 ARG 48 HH22 ARG 48 8.669 18.928 -18.360 338 H ALA 49 HN ALA 49 14.198 21.389 -25.200 339 HA ALA 49 HA ALA 49 15.542 18.966 -24.846 340 HB1 ALA 49 HB1 ALA 49 14.381 19.592 -26.916 341 HB2 ALA 49 HB2 ALA 49 16.038 19.071 -27.223 342 HB3 ALA 49 HB3 ALA 49 15.636 20.788 -27.246 343 H ALA 50 HN ALA 50 16.758 22.242 -25.209 344 HA ALA 50 HA ALA 50 19.490 21.537 -25.541 345 HB1 ALA 50 HB1 ALA 50 19.959 23.896 -25.112 346 HB2 ALA 50 HB2 ALA 50 18.296 24.135 -24.575 347 HB3 ALA 50 HB3 ALA 50 18.627 23.709 -26.254 348 H CYS 51 HN CYS 51 17.469 22.269 -22.737 349 HA CYS 51 HA CYS 51 19.514 22.301 -20.800 350 HB2 CYS 51 HB2 CYS 51 16.631 21.428 -20.488 351 HB3 CYS 51 HB1 CYS 51 17.718 21.871 -19.175 352 HG CYS 51 HG CYS 51 16.457 23.952 -21.583 353 H LEU 52 HN LEU 52 17.321 19.683 -21.830 354 HA LEU 52 HA LEU 52 18.478 17.589 -20.397 355 HB2 LEU 52 HB2 LEU 52 17.230 17.564 -23.150 356 HB3 LEU 52 HB1 LEU 52 17.600 16.125 -22.220 357 HG LEU 52 HG LEU 52 15.672 18.273 -21.330 358 HD11 LEU 52 HD11 LEU 52 13.915 16.670 -21.896 359 HD12 LEU 52 HD12 LEU 52 15.129 15.573 -22.557 360 HD13 LEU 52 HD13 LEU 52 14.845 17.137 -23.320 361 HD21 LEU 52 HD21 LEU 52 16.694 17.026 -19.497 362 HD22 LEU 52 HD22 LEU 52 16.228 15.507 -20.259 363 HD23 LEU 52 HD23 LEU 52 14.989 16.615 -19.671 364 H ASP 53 HN ASP 53 19.238 18.802 -23.616 365 HA ASP 53 HA ASP 53 21.257 17.050 -24.355 366 HB2 ASP 53 HB2 ASP 53 20.190 18.709 -25.843 367 HB3 ASP 53 HB1 ASP 53 21.006 20.005 -24.978 368 H TYR 54 HN TYR 54 21.572 20.211 -22.758 369 HA TYR 54 HA TYR 54 24.344 20.234 -22.514 370 HB2 TYR 54 HB2 TYR 54 23.072 22.244 -22.174 371 HB3 TYR 54 HB1 TYR 54 22.211 21.533 -20.814 372 HD1 TYR 54 HD1 TYR 54 25.606 22.582 -21.925 373 HD2 TYR 54 HD2 TYR 54 23.019 21.813 -18.639 374 HE1 TYR 54 HE1 TYR 54 27.296 23.502 -20.388 375 HE2 TYR 54 HE2 TYR 54 24.696 22.727 -17.093 376 HH TYR 54 HH TYR 54 27.131 23.085 -17.020 377 H VAL 55 HN VAL 55 21.908 19.143 -20.126 378 HA VAL 55 HA VAL 55 23.864 18.610 -18.146 379 HB VAL 55 HB VAL 55 22.103 17.363 -16.931 380 HG11 VAL 55 HG11 VAL 55 20.630 19.282 -16.568 381 HG12 VAL 55 HG12 VAL 55 21.237 20.025 -18.047 382 HG13 VAL 55 HG13 VAL 55 22.321 19.777 -16.679 383 HG21 VAL 55 HG21 VAL 55 20.922 16.397 -18.844 384 HG22 VAL 55 HG22 VAL 55 20.380 18.006 -19.321 385 HG23 VAL 55 HG23 VAL 55 19.828 17.303 -17.801 386 H GLU 56 HN GLU 56 22.317 16.515 -20.572 387 HA GLU 56 HA GLU 56 23.513 14.145 -19.504 388 HB2 GLU 56 HB2 GLU 56 22.301 14.601 -22.235 389 HB3 GLU 56 HB1 GLU 56 22.687 13.036 -21.522 390 HG2 GLU 56 HG2 GLU 56 21.144 13.876 -19.587 391 HG3 GLU 56 HG1 GLU 56 20.517 14.954 -20.826 392 H LYS 57 HN LYS 57 24.488 16.502 -21.930 393 HA LYS 57 HA LYS 57 26.628 14.976 -22.993 394 HB2 LYS 57 HB2 LYS 57 25.938 17.883 -23.011 395 HB3 LYS 57 HB1 LYS 57 27.535 17.373 -23.542 396 HG2 LYS 57 HG2 LYS 57 26.524 15.917 -25.210 397 HG3 LYS 57 HG1 LYS 57 24.920 16.412 -24.673 398 HD2 LYS 57 HD2 LYS 57 25.268 18.645 -25.408 399 HD3 LYS 57 HD1 LYS 57 26.986 18.353 -25.683 400 HE2 LYS 57 HE2 LYS 57 25.578 18.403 -27.751 401 HE3 LYS 57 HE1 LYS 57 26.531 16.935 -27.537 402 HZ1 LYS 57 HZ1 LYS 57 24.242 16.501 -28.254 403 HZ2 LYS 57 HZ2 LYS 57 23.657 17.211 -26.834 404 HZ3 LYS 57 HZ3 LYS 57 24.585 15.784 -26.754 405 H ASN 58 HN ASN 58 26.317 16.892 -20.110 406 HA ASN 58 HA ASN 58 29.095 17.064 -19.514 407 HB2 ASN 58 HB2 ASN 58 26.572 17.423 -17.940 408 HB3 ASN 58 HB1 ASN 58 28.092 17.241 -17.071 409 HD21 ASN 58 HD21 ASN 58 26.285 19.228 -19.306 410 HD22 ASN 58 HD22 ASN 58 27.266 20.641 -19.126 411 H TRP 59 HN TRP 59 26.607 14.705 -19.023 412 HA TRP 59 HA TRP 59 26.616 12.523 -18.471 413 HB2 TRP 59 HB2 TRP 59 28.180 12.652 -20.475 414 HB3 TRP 59 HB1 TRP 59 29.503 12.494 -19.324 415 HD1 TRP 59 HD1 TRP 59 26.243 10.541 -20.138 416 HE1 TRP 59 HE1 TRP 59 26.761 8.031 -19.961 417 HE3 TRP 59 HE3 TRP 59 31.134 10.833 -18.699 418 HZ2 TRP 59 HZ2 TRP 59 28.964 6.387 -19.300 419 HZ3 TRP 59 HZ3 TRP 59 32.378 8.744 -18.313 420 HH2 TRP 59 HH2 TRP 59 31.312 6.568 -18.607 421 H THR 60 HN THR 60 26.351 12.711 -16.260 422 HA THR 60 HA THR 60 28.780 12.179 -14.676 423 HB THR 60 HB THR 60 27.499 14.244 -14.039 424 HG1 THR 60 HG1 THR 60 28.127 13.862 -12.054 425 HG21 THR 60 HG21 THR 60 25.366 13.986 -12.860 426 HG22 THR 60 HG22 THR 60 25.367 12.264 -13.239 427 HG23 THR 60 HG23 THR 60 25.244 13.451 -14.536 428 H ASP 61 HN ASP 61 26.267 10.777 -16.158 429 HA ASP 61 HA ASP 61 25.628 8.803 -14.097 430 HB2 ASP 61 HB2 ASP 61 23.857 8.124 -15.730 431 HB3 ASP 61 HB1 ASP 61 23.729 9.802 -15.205 432 H LEU 62 HN LEU 62 24.881 6.784 -16.026 433 HA LEU 62 HA LEU 62 27.538 5.912 -16.946 434 HB2 LEU 62 HB2 LEU 62 25.459 4.239 -15.530 435 HB3 LEU 62 HB1 LEU 62 26.901 3.596 -16.287 436 HG LEU 62 HG LEU 62 28.163 5.200 -14.657 437 HD11 LEU 62 HD11 LEU 62 25.547 4.851 -13.201 438 HD12 LEU 62 HD12 LEU 62 26.169 6.370 -13.844 439 HD13 LEU 62 HD13 LEU 62 27.025 5.547 -12.538 440 HD21 LEU 62 HD21 LEU 62 28.220 3.425 -12.985 441 HD22 LEU 62 HD22 LEU 62 28.294 2.771 -14.621 442 HD23 LEU 62 HD23 LEU 62 26.787 2.694 -13.708 443 H ARG 63 HN ARG 63 24.908 7.015 -18.152 444 HA ARG 63 HA ARG 63 24.144 4.760 -19.860 445 HB2 ARG 63 HB2 ARG 63 22.371 6.046 -18.717 446 HB3 ARG 63 HB1 ARG 63 22.904 7.501 -19.544 447 HG2 ARG 63 HG2 ARG 63 22.285 6.542 -21.685 448 HG3 ARG 63 HG1 ARG 63 21.804 5.041 -20.887 449 HD2 ARG 63 HD2 ARG 63 20.583 7.757 -20.388 450 HD3 ARG 63 HD1 ARG 63 19.879 6.493 -21.395 451 HE ARG 63 HE ARG 63 19.681 5.134 -19.367 452 HH11 ARG 63 HH11 ARG 63 20.231 8.580 -18.957 453 HH12 ARG 63 HH12 ARG 63 19.490 8.633 -17.383 454 HH21 ARG 63 HH21 ARG 63 18.705 5.207 -17.296 455 HH22 ARG 63 HH22 ARG 63 18.580 6.729 -16.453 456 HA PRO 64 HA PRO 64 26.653 6.769 -22.963 457 HB2 PRO 64 HB2 PRO 64 26.965 4.605 -24.540 458 HB3 PRO 64 HB1 PRO 64 27.836 4.811 -23.018 459 HG2 PRO 64 HG2 PRO 64 25.604 3.004 -23.672 460 HG3 PRO 64 HG1 PRO 64 26.831 2.867 -22.404 461 HD2 PRO 64 HD2 PRO 64 24.132 3.791 -22.157 462 HD3 PRO 64 HD1 PRO 64 25.370 3.687 -20.891 463 H LYS 65 HN LYS 65 25.206 8.192 -23.867 464 HA LYS 65 HA LYS 65 23.788 7.170 -26.246 465 HB2 LYS 65 HB2 LYS 65 22.971 9.451 -24.429 466 HB3 LYS 65 HB1 LYS 65 22.191 9.063 -25.956 467 HG2 LYS 65 HG2 LYS 65 22.298 7.297 -23.518 468 HG3 LYS 65 HG1 LYS 65 20.905 8.226 -24.077 469 HD2 LYS 65 HD2 LYS 65 20.930 6.927 -26.181 470 HD3 LYS 65 HD1 LYS 65 22.261 5.961 -25.545 471 HE2 LYS 65 HE2 LYS 65 20.809 5.265 -23.669 472 HE3 LYS 65 HE1 LYS 65 19.481 6.169 -24.397 473 HZ1 LYS 65 HZ1 LYS 65 19.751 4.740 -26.396 474 HZ2 LYS 65 HZ2 LYS 65 19.257 3.897 -25.011 475 HZ3 LYS 65 HZ3 LYS 65 20.868 3.802 -25.530 476 H SER 66 HN SER 66 24.414 8.135 -28.131 477 HA SER 66 HA SER 66 25.630 10.765 -28.036 478 HB2 SER 66 HB2 SER 66 27.158 8.345 -29.004 479 HB3 SER 66 HB1 SER 66 27.677 10.016 -29.227 480 HG SER 66 HG SER 66 27.092 9.749 -26.678 481 H LEU 67 HN LEU 67 24.788 11.897 -29.578 482 HA LEU 67 HA LEU 67 24.333 10.627 -32.199 483 HB2 LEU 67 HB2 LEU 67 22.534 12.377 -32.544 484 HB3 LEU 67 HB1 LEU 67 22.160 11.085 -31.425 485 HG LEU 67 HG LEU 67 23.163 13.736 -30.418 486 HD11 LEU 67 HD11 LEU 67 20.294 13.011 -31.001 487 HD12 LEU 67 HD12 LEU 67 21.252 14.207 -31.874 488 HD13 LEU 67 HD13 LEU 67 20.852 14.466 -30.177 489 HD21 LEU 67 HD21 LEU 67 21.877 13.093 -28.428 490 HD22 LEU 67 HD22 LEU 67 23.093 11.882 -28.832 491 HD23 LEU 67 HD23 LEU 67 21.399 11.594 -29.223 492 H ARG 68 HN ARG 68 24.489 13.934 -30.873 493 HA ARG 68 HA ARG 68 26.807 14.448 -32.612 494 HB2 ARG 68 HB2 ARG 68 24.335 16.128 -32.282 495 HB3 ARG 68 HB1 ARG 68 25.875 16.906 -32.607 496 HG2 ARG 68 HG2 ARG 68 24.992 16.692 -34.711 497 HG3 ARG 68 HG1 ARG 68 26.005 15.253 -34.597 498 HD2 ARG 68 HD2 ARG 68 23.900 14.641 -35.558 499 HD3 ARG 68 HD1 ARG 68 23.995 13.959 -33.933 500 HE ARG 68 HE ARG 68 22.715 16.493 -33.896 501 HH11 ARG 68 HH11 ARG 68 22.171 13.169 -34.851 502 HH12 ARG 68 HH12 ARG 68 20.457 13.230 -34.544 503 HH21 ARG 68 HH21 ARG 68 20.469 16.583 -33.508 504 HH22 ARG 68 HH22 ARG 68 19.489 15.169 -33.770 505 H ASP 69 HN ASP 69 26.991 13.561 -30.044 506 HA ASP 69 HA ASP 69 27.008 15.801 -28.221 507 HB2 ASP 69 HB2 ASP 69 27.694 12.892 -27.780 508 HB3 ASP 69 HB1 ASP 69 27.583 14.114 -26.514 509 H ALA 70 HN ALA 70 28.638 17.088 -29.028 510 HA ALA 70 HA ALA 70 31.334 16.115 -28.367 511 HB1 ALA 70 HB1 ALA 70 31.146 16.411 -30.777 512 HB2 ALA 70 HB2 ALA 70 32.215 17.635 -30.091 513 HB3 ALA 70 HB3 ALA 70 30.564 18.059 -30.544 514 H MET 71 HN MET 71 32.260 17.208 -26.764 515 HA MET 71 HA MET 71 31.002 19.589 -25.724 516 HB2 MET 71 HB2 MET 71 33.480 18.090 -24.854 517 HB3 MET 71 HB1 MET 71 32.830 19.495 -24.018 518 HG2 MET 71 HG2 MET 71 31.426 16.862 -24.422 519 HG3 MET 71 HG1 MET 71 32.157 17.435 -22.924 520 HE1 MET 71 HE1 MET 71 31.178 19.345 -21.417 521 HE2 MET 71 HE2 MET 71 29.861 20.403 -21.915 522 HE3 MET 71 HE3 MET 71 31.402 20.450 -22.772 523 H VAL 72 HN VAL 72 31.479 21.587 -26.243 524 HA VAL 72 HA VAL 72 33.393 22.141 -28.278 525 HB VAL 72 HB VAL 72 31.837 24.088 -26.564 526 HG11 VAL 72 HG11 VAL 72 33.208 24.474 -29.224 527 HG12 VAL 72 HG12 VAL 72 33.736 25.134 -27.675 528 HG13 VAL 72 HG13 VAL 72 32.217 25.673 -28.393 529 HG21 VAL 72 HG21 VAL 72 30.266 24.178 -28.454 530 HG22 VAL 72 HG22 VAL 72 30.343 22.572 -27.729 531 HG23 VAL 72 HG23 VAL 72 31.172 22.893 -29.253 532 H GLU 73 HN GLU 73 35.496 22.213 -27.912 533 HA GLU 73 HA GLU 73 36.459 23.885 -25.705 534 HB2 GLU 73 HB2 GLU 73 36.603 21.456 -25.048 535 HB3 GLU 73 HB1 GLU 73 37.713 21.221 -26.393 536 HG2 GLU 73 HG2 GLU 73 38.898 21.484 -24.281 537 HG3 GLU 73 HG1 GLU 73 39.280 22.788 -25.406 538 H ASP 74 HN ASP 74 37.254 25.517 -26.850 539 HA ASP 74 HA ASP 74 38.896 24.924 -29.217 540 HB2 ASP 74 HB2 ASP 74 36.863 26.407 -29.488 541 HB3 ASP 74 HB1 ASP 74 37.676 27.585 -28.461 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 -6.900 22.315 -10.251 2 H2 GLY 1 HT2 GLY 1 -6.259 23.508 -11.273 3 H3 GLY 1 HT3 GLY 1 -5.686 21.912 -11.361 4 HA2 GLY 1 HA1 GLY 1 -8.467 22.742 -11.989 5 HA3 GLY 1 HA2 GLY 1 -7.211 22.484 -13.192 6 H SER 2 HN SER 2 -9.767 21.103 -12.836 7 HA SER 2 HA SER 2 -9.348 18.511 -11.779 8 HB2 SER 2 HB2 SER 2 -11.275 19.238 -13.991 9 HB3 SER 2 HB1 SER 2 -11.433 17.946 -12.797 10 HG SER 2 HG SER 2 -11.743 20.731 -12.482 11 H HIS 3 HN HIS 3 -8.729 16.587 -12.790 12 HA HIS 3 HA HIS 3 -8.024 16.628 -15.604 13 HB2 HIS 3 HB2 HIS 3 -5.683 16.133 -15.320 14 HB3 HIS 3 HB1 HIS 3 -6.032 17.616 -14.441 15 HD1 HIS 3 HD1 HIS 3 -4.597 14.285 -14.042 16 HD2 HIS 3 HD2 HIS 3 -6.200 17.201 -11.545 17 HE1 HIS 3 HE1 HIS 3 -3.858 13.667 -11.716 18 HE2 HIS 3 HE2 HIS 3 -4.901 15.398 -10.210 19 H MET 4 HN MET 4 -7.716 14.556 -16.479 20 HA MET 4 HA MET 4 -8.291 12.313 -14.662 21 HB2 MET 4 HB2 MET 4 -8.458 12.446 -17.683 22 HB3 MET 4 HB1 MET 4 -8.824 11.029 -16.709 23 HG2 MET 4 HG2 MET 4 -10.649 12.258 -15.632 24 HG3 MET 4 HG1 MET 4 -10.297 13.653 -16.650 25 HE1 MET 4 HE1 MET 4 -13.212 12.405 -16.497 26 HE2 MET 4 HE2 MET 4 -13.640 12.436 -18.209 27 HE3 MET 4 HE3 MET 4 -12.749 13.783 -17.494 28 H SER 5 HN SER 5 -6.393 12.941 -17.609 29 HA SER 5 HA SER 5 -4.263 11.193 -16.751 30 HB2 SER 5 HB2 SER 5 -3.142 12.217 -18.836 31 HB3 SER 5 HB1 SER 5 -4.600 11.259 -19.102 32 HG SER 5 HG SER 5 -5.714 13.032 -19.593 33 H THR 6 HN THR 6 -1.922 12.403 -17.124 34 HA THR 6 HA THR 6 -1.876 15.064 -16.062 35 HB THR 6 HB THR 6 -2.245 13.794 -13.985 36 HG1 THR 6 HG1 THR 6 -0.901 15.097 -12.984 37 HG21 THR 6 HG21 THR 6 -0.499 12.298 -13.122 38 HG22 THR 6 HG22 THR 6 0.368 12.436 -14.652 39 HG23 THR 6 HG23 THR 6 -1.220 11.672 -14.606 40 H ASN 7 HN ASN 7 -0.021 16.094 -16.551 41 HA ASN 7 HA ASN 7 2.176 14.500 -17.691 42 HB2 ASN 7 HB2 ASN 7 0.989 15.686 -19.469 43 HB3 ASN 7 HB1 ASN 7 1.154 17.204 -18.596 44 HD21 ASN 7 HD21 ASN 7 2.213 18.162 -20.330 45 HD22 ASN 7 HD22 ASN 7 3.865 17.792 -20.706 46 HA PRO 8 HA PRO 8 4.431 16.243 -14.263 47 HB2 PRO 8 HB2 PRO 8 6.934 15.697 -15.351 48 HB3 PRO 8 HB1 PRO 8 5.978 14.589 -14.363 49 HG2 PRO 8 HG2 PRO 8 6.241 14.737 -17.336 50 HG3 PRO 8 HG1 PRO 8 6.139 13.310 -16.287 51 HD2 PRO 8 HD2 PRO 8 4.034 14.135 -17.710 52 HD3 PRO 8 HD1 PRO 8 3.832 13.487 -16.068 53 H PHE 9 HN PHE 9 5.499 16.992 -17.595 54 HA PHE 9 HA PHE 9 5.999 19.726 -16.680 55 HB2 PHE 9 HB2 PHE 9 8.038 19.786 -18.176 56 HB3 PHE 9 HB1 PHE 9 8.192 18.831 -16.709 57 HD1 PHE 9 HD2 PHE 9 8.296 16.397 -16.815 58 HD2 PHE 9 HD1 PHE 9 8.115 18.763 -20.346 59 HE1 PHE 9 HE2 PHE 9 9.041 14.466 -18.142 60 HE2 PHE 9 HE1 PHE 9 8.861 16.836 -21.681 61 HZ PHE 9 HZ PHE 9 9.325 14.683 -20.579 62 H ASP 10 HN ASP 10 4.849 21.089 -17.769 63 HA ASP 10 HA ASP 10 3.899 20.429 -20.456 64 HB2 ASP 10 HB2 ASP 10 2.222 21.135 -18.799 65 HB3 ASP 10 HB1 ASP 10 3.087 22.648 -18.555 66 H ASP 11 HN ASP 11 4.145 21.951 -22.204 67 HA ASP 11 HA ASP 11 6.685 23.383 -21.985 68 HB2 ASP 11 HB2 ASP 11 5.090 22.294 -24.269 69 HB3 ASP 11 HB1 ASP 11 6.265 23.572 -24.565 70 H ASP 12 HN ASP 12 3.354 24.072 -22.036 71 HA ASP 12 HA ASP 12 3.667 26.658 -23.346 72 HB2 ASP 12 HB2 ASP 12 1.645 25.179 -23.704 73 HB3 ASP 12 HB1 ASP 12 1.185 25.517 -22.041 74 H ASN 13 HN ASN 13 2.145 25.605 -20.312 75 HA ASN 13 HA ASN 13 2.781 28.216 -19.147 76 HB2 ASN 13 HB2 ASN 13 0.909 26.003 -18.299 77 HB3 ASN 13 HB1 ASN 13 1.275 27.384 -17.266 78 HD21 ASN 13 HD21 ASN 13 -0.369 26.283 -20.113 79 HD22 ASN 13 HD22 ASN 13 -1.264 27.739 -20.404 80 H GLY 14 HN GLY 14 4.132 25.224 -19.349 81 HA2 GLY 14 HA2 GLY 14 5.145 25.177 -16.611 82 HA3 GLY 14 HA1 GLY 14 5.378 23.939 -17.820 83 H ALA 15 HN ALA 15 6.338 27.097 -16.820 84 HA ALA 15 HA ALA 15 8.627 27.268 -18.519 85 HB1 ALA 15 HB1 ALA 15 7.615 29.282 -17.588 86 HB2 ALA 15 HB2 ALA 15 9.301 29.147 -17.090 87 HB3 ALA 15 HB3 ALA 15 8.010 28.743 -15.958 88 H PHE 16 HN PHE 16 10.224 25.850 -18.360 89 HA PHE 16 HA PHE 16 10.668 24.461 -15.835 90 HB2 PHE 16 HB2 PHE 16 12.222 23.091 -17.496 91 HB3 PHE 16 HB1 PHE 16 10.481 22.841 -17.470 92 HD1 PHE 16 HD1 PHE 16 12.965 25.072 -19.108 93 HD2 PHE 16 HD2 PHE 16 9.397 22.792 -19.493 94 HE1 PHE 16 HE1 PHE 16 12.836 25.687 -21.473 95 HE2 PHE 16 HE2 PHE 16 9.263 23.393 -21.877 96 HZ PHE 16 HZ PHE 16 10.982 24.848 -22.872 97 H PHE 17 HN PHE 17 12.596 24.338 -14.810 98 HA PHE 17 HA PHE 17 14.743 26.127 -15.739 99 HB2 PHE 17 HB2 PHE 17 13.684 25.431 -13.044 100 HB3 PHE 17 HB1 PHE 17 15.429 25.597 -13.174 101 HD1 PHE 17 HD2 PHE 17 12.923 27.582 -15.048 102 HD2 PHE 17 HD1 PHE 17 15.741 27.492 -11.862 103 HE1 PHE 17 HE2 PHE 17 12.713 30.020 -14.794 104 HE2 PHE 17 HE1 PHE 17 15.536 29.929 -11.602 105 HZ PHE 17 HZ PHE 17 14.018 31.195 -13.071 106 H VAL 18 HN VAL 18 16.960 25.370 -15.123 107 HA VAL 18 HA VAL 18 17.217 22.505 -15.656 108 HB VAL 18 HB VAL 18 19.411 24.565 -15.359 109 HG11 VAL 18 HG11 VAL 18 20.151 22.266 -15.055 110 HG12 VAL 18 HG12 VAL 18 20.780 22.937 -16.560 111 HG13 VAL 18 HG13 VAL 18 19.418 21.817 -16.595 112 HG21 VAL 18 HG21 VAL 18 18.047 23.577 -17.859 113 HG22 VAL 18 HG22 VAL 18 19.464 24.626 -17.810 114 HG23 VAL 18 HG23 VAL 18 17.921 25.196 -17.173 115 H LEU 19 HN LEU 19 16.800 21.399 -13.782 116 HA LEU 19 HA LEU 19 18.087 22.395 -11.326 117 HB2 LEU 19 HB2 LEU 19 15.581 22.247 -11.412 118 HB3 LEU 19 HB1 LEU 19 15.742 20.512 -11.577 119 HG LEU 19 HG LEU 19 16.853 20.433 -9.367 120 HD11 LEU 19 HD11 LEU 19 16.144 23.362 -9.282 121 HD12 LEU 19 HD12 LEU 19 17.769 22.676 -9.314 122 HD13 LEU 19 HD13 LEU 19 16.726 22.409 -7.916 123 HD21 LEU 19 HD21 LEU 19 14.457 20.024 -9.568 124 HD22 LEU 19 HD22 LEU 19 14.141 21.750 -9.385 125 HD23 LEU 19 HD23 LEU 19 14.837 20.833 -8.048 126 H VAL 20 HN VAL 20 19.679 21.225 -10.481 127 HA VAL 20 HA VAL 20 19.844 18.366 -11.178 128 HB VAL 20 HB VAL 20 22.081 20.240 -10.356 129 HG11 VAL 20 HG11 VAL 20 23.586 18.362 -10.799 130 HG12 VAL 20 HG12 VAL 20 22.199 17.318 -11.111 131 HG13 VAL 20 HG13 VAL 20 22.456 17.986 -9.498 132 HG21 VAL 20 HG21 VAL 20 21.357 20.637 -12.631 133 HG22 VAL 20 HG22 VAL 20 21.478 18.917 -12.999 134 HG23 VAL 20 HG23 VAL 20 22.933 19.846 -12.630 135 H ASN 21 HN ASN 21 20.206 16.900 -9.483 136 HA ASN 21 HA ASN 21 19.451 17.998 -6.860 137 HB2 ASN 21 HB2 ASN 21 19.176 15.150 -7.854 138 HB3 ASN 21 HB1 ASN 21 18.579 15.783 -6.324 139 HD21 ASN 21 HD21 ASN 21 18.082 15.571 -9.728 140 HD22 ASN 21 HD22 ASN 21 16.500 16.264 -9.763 141 H ASP 22 HN ASP 22 20.265 16.509 -5.008 142 HA ASP 22 HA ASP 22 23.133 16.366 -5.227 143 HB2 ASP 22 HB2 ASP 22 21.929 17.077 -3.140 144 HB3 ASP 22 HB1 ASP 22 21.379 15.415 -2.950 145 H GLU 23 HN GLU 23 20.437 14.138 -5.153 146 HA GLU 23 HA GLU 23 22.273 11.856 -5.327 147 HB2 GLU 23 HB2 GLU 23 19.297 11.944 -4.825 148 HB3 GLU 23 HB1 GLU 23 20.290 10.493 -4.825 149 HG2 GLU 23 HG2 GLU 23 21.510 11.279 -2.902 150 HG3 GLU 23 HG1 GLU 23 20.633 12.811 -2.935 151 H ASP 24 HN ASP 24 20.597 13.864 -7.380 152 HA ASP 24 HA ASP 24 20.406 11.761 -9.423 153 HB2 ASP 24 HB2 ASP 24 18.131 12.226 -8.654 154 HB3 ASP 24 HB1 ASP 24 18.362 13.945 -8.966 155 H GLN 25 HN GLN 25 20.812 12.414 -11.548 156 HA GLN 25 HA GLN 25 22.810 14.476 -11.597 157 HB2 GLN 25 HB2 GLN 25 21.891 12.446 -13.614 158 HB3 GLN 25 HB1 GLN 25 23.105 13.663 -13.990 159 HG2 GLN 25 HG2 GLN 25 23.316 11.651 -11.759 160 HG3 GLN 25 HG1 GLN 25 24.060 11.485 -13.348 161 HE21 GLN 25 HE21 GLN 25 24.668 14.342 -13.516 162 HE22 GLN 25 HE22 GLN 25 26.016 14.600 -12.470 163 H HIS 26 HN HIS 26 19.474 14.330 -12.659 164 HA HIS 26 HA HIS 26 19.614 17.010 -13.614 165 HB2 HIS 26 HB2 HIS 26 18.978 16.489 -16.004 166 HB3 HIS 26 HB1 HIS 26 20.653 16.185 -15.570 167 HD1 HIS 26 HD1 HIS 26 17.434 14.349 -16.348 168 HD2 HIS 26 HD2 HIS 26 21.504 13.591 -15.896 169 HE1 HIS 26 HE1 HIS 26 17.786 11.993 -17.155 170 HE2 HIS 26 HE2 HIS 26 20.248 11.543 -16.853 171 H SER 27 HN SER 27 17.727 17.949 -13.410 172 HA SER 27 HA SER 27 15.294 16.455 -14.057 173 HB2 SER 27 HB2 SER 27 15.646 18.127 -11.553 174 HB3 SER 27 HB1 SER 27 14.143 17.375 -12.079 175 HG SER 27 HG SER 27 16.127 15.549 -11.994 176 H LEU 28 HN LEU 28 14.241 17.574 -15.568 177 HA LEU 28 HA LEU 28 14.578 20.460 -15.751 178 HB2 LEU 28 HB2 LEU 28 13.443 18.349 -17.539 179 HB3 LEU 28 HB1 LEU 28 12.876 19.992 -17.738 180 HG LEU 28 HG LEU 28 14.745 19.322 -19.282 181 HD11 LEU 28 HD11 LEU 28 15.991 21.411 -18.998 182 HD12 LEU 28 HD12 LEU 28 15.277 21.618 -17.399 183 HD13 LEU 28 HD13 LEU 28 14.253 21.660 -18.834 184 HD21 LEU 28 HD21 LEU 28 17.021 19.308 -18.377 185 HD22 LEU 28 HD22 LEU 28 16.060 17.972 -17.750 186 HD23 LEU 28 HD23 LEU 28 16.369 19.383 -16.740 187 H TRP 29 HN TRP 29 13.489 21.391 -14.134 188 HA TRP 29 HA TRP 29 10.844 20.323 -13.422 189 HB2 TRP 29 HB2 TRP 29 12.661 20.133 -11.732 190 HB3 TRP 29 HB1 TRP 29 12.807 21.884 -11.729 191 HD1 TRP 29 HD1 TRP 29 11.531 23.044 -9.865 192 HE1 TRP 29 HE1 TRP 29 9.546 22.451 -8.330 193 HE3 TRP 29 HE3 TRP 29 10.277 18.506 -11.874 194 HZ2 TRP 29 HZ2 TRP 29 7.703 20.336 -8.016 195 HZ3 TRP 29 HZ3 TRP 29 8.395 17.260 -10.891 196 HH2 TRP 29 HH2 TRP 29 7.136 18.160 -9.001 197 HA PRO 30 HA PRO 30 9.268 24.271 -14.801 198 HB2 PRO 30 HB2 PRO 30 6.677 23.826 -14.177 199 HB3 PRO 30 HB1 PRO 30 7.455 23.090 -15.583 200 HG2 PRO 30 HG2 PRO 30 6.884 21.910 -12.895 201 HG3 PRO 30 HG1 PRO 30 6.708 21.179 -14.501 202 HD2 PRO 30 HD2 PRO 30 8.827 20.695 -12.856 203 HD3 PRO 30 HD1 PRO 30 8.930 20.624 -14.626 204 H VAL 31 HN VAL 31 8.892 26.186 -13.853 205 HA VAL 31 HA VAL 31 9.169 26.400 -11.003 206 HB VAL 31 HB VAL 31 9.177 28.811 -11.355 207 HG11 VAL 31 HG11 VAL 31 11.233 27.561 -11.747 208 HG12 VAL 31 HG12 VAL 31 11.129 28.966 -12.807 209 HG13 VAL 31 HG13 VAL 31 10.793 27.356 -13.443 210 HG21 VAL 31 HG21 VAL 31 8.942 29.767 -13.607 211 HG22 VAL 31 HG22 VAL 31 7.456 28.986 -13.068 212 HG23 VAL 31 HG23 VAL 31 8.507 28.176 -14.229 213 H PHE 32 HN PHE 32 6.572 25.527 -12.617 214 HA PHE 32 HA PHE 32 4.661 27.300 -11.307 215 HB2 PHE 32 HB2 PHE 32 4.484 26.389 -13.749 216 HB3 PHE 32 HB1 PHE 32 3.911 24.913 -12.981 217 HD1 PHE 32 HD1 PHE 32 3.272 28.579 -13.031 218 HD2 PHE 32 HD2 PHE 32 1.653 24.671 -12.568 219 HE1 PHE 32 HE1 PHE 32 1.008 29.534 -12.938 220 HE2 PHE 32 HE2 PHE 32 -0.615 25.619 -12.472 221 HZ PHE 32 HZ PHE 32 -0.940 28.053 -12.659 222 H ALA 33 HN ALA 33 6.499 24.900 -10.336 223 HA ALA 33 HA ALA 33 4.502 23.871 -8.443 224 HB1 ALA 33 HB1 ALA 33 4.935 22.123 -10.086 225 HB2 ALA 33 HB2 ALA 33 5.593 21.673 -8.513 226 HB3 ALA 33 HB3 ALA 33 6.667 22.252 -9.786 227 H ASP 34 HN ASP 34 5.570 22.980 -6.465 228 HA ASP 34 HA ASP 34 7.356 24.948 -5.422 229 HB2 ASP 34 HB2 ASP 34 6.250 22.393 -4.246 230 HB3 ASP 34 HB1 ASP 34 7.301 23.489 -3.355 231 H ILE 35 HN ILE 35 9.478 24.777 -4.820 232 HA ILE 35 HA ILE 35 10.928 22.447 -5.874 233 HB ILE 35 HB ILE 35 12.048 25.178 -5.181 234 HG12 ILE 35 HG12 ILE 35 11.388 23.986 -7.887 235 HG13 ILE 35 HG11 ILE 35 10.523 25.304 -7.106 236 HG21 ILE 35 HG21 ILE 35 13.698 23.411 -5.001 237 HG22 ILE 35 HG22 ILE 35 14.025 24.405 -6.422 238 HG23 ILE 35 HG23 ILE 35 13.272 22.820 -6.607 239 HD11 ILE 35 HD11 ILE 35 12.479 26.715 -7.258 240 HD12 ILE 35 HD12 ILE 35 12.041 26.091 -8.848 241 HD13 ILE 35 HD13 ILE 35 13.401 25.390 -7.970 242 HA PRO 36 HA PRO 36 11.656 21.333 -1.590 243 HB2 PRO 36 HB2 PRO 36 13.320 19.254 -2.077 244 HB3 PRO 36 HB1 PRO 36 11.587 19.164 -2.394 245 HG2 PRO 36 HG2 PRO 36 13.833 19.713 -4.298 246 HG3 PRO 36 HG1 PRO 36 12.456 18.611 -4.484 247 HD2 PRO 36 HD2 PRO 36 12.503 21.070 -5.601 248 HD3 PRO 36 HD1 PRO 36 11.003 20.315 -5.025 249 H ALA 37 HN ALA 37 14.194 20.218 -0.835 250 HA ALA 37 HA ALA 37 16.118 22.334 -1.530 251 HB1 ALA 37 HB1 ALA 37 16.983 22.275 0.752 252 HB2 ALA 37 HB2 ALA 37 15.765 21.080 1.193 253 HB3 ALA 37 HB3 ALA 37 15.275 22.712 0.740 254 H GLY 38 HN GLY 38 18.352 21.692 -1.441 255 HA2 GLY 38 HA2 GLY 38 20.045 19.993 -1.233 256 HA3 GLY 38 HA1 GLY 38 18.797 18.777 -1.473 257 H TRP 39 HN TRP 39 19.075 21.686 -3.401 258 HA TRP 39 HA TRP 39 19.736 19.983 -5.713 259 HB2 TRP 39 HB2 TRP 39 18.211 21.558 -7.016 260 HB3 TRP 39 HB1 TRP 39 17.429 20.410 -5.933 261 HD1 TRP 39 HD1 TRP 39 15.877 21.363 -4.134 262 HE1 TRP 39 HE1 TRP 39 15.199 23.713 -3.354 263 HE3 TRP 39 HE3 TRP 39 19.285 24.106 -6.783 264 HZ2 TRP 39 HZ2 TRP 39 16.006 26.385 -3.802 265 HZ3 TRP 39 HZ3 TRP 39 19.266 26.554 -6.547 266 HH2 TRP 39 HH2 TRP 39 17.660 27.669 -5.087 267 H ARG 40 HN ARG 40 20.319 21.299 -7.652 268 HA ARG 40 HA ARG 40 21.602 23.871 -7.059 269 HB2 ARG 40 HB2 ARG 40 22.915 21.401 -7.920 270 HB3 ARG 40 HB1 ARG 40 23.214 22.740 -9.015 271 HG2 ARG 40 HG2 ARG 40 24.988 22.754 -7.488 272 HG3 ARG 40 HG1 ARG 40 23.925 24.066 -6.985 273 HD2 ARG 40 HD2 ARG 40 23.003 22.700 -5.222 274 HD3 ARG 40 HD1 ARG 40 23.931 21.304 -5.778 275 HE ARG 40 HE ARG 40 25.449 23.676 -5.019 276 HH11 ARG 40 HH11 ARG 40 24.193 20.545 -4.055 277 HH12 ARG 40 HH12 ARG 40 25.403 20.293 -2.832 278 HH21 ARG 40 HH21 ARG 40 27.043 23.350 -3.407 279 HH22 ARG 40 HH22 ARG 40 26.993 21.910 -2.432 280 H VAL 41 HN VAL 41 20.524 25.286 -8.337 281 HA VAL 41 HA VAL 41 19.395 24.439 -10.866 282 HB VAL 41 HB VAL 41 19.461 27.175 -9.566 283 HG11 VAL 41 HG11 VAL 41 17.989 26.285 -12.042 284 HG12 VAL 41 HG12 VAL 41 19.389 27.358 -12.004 285 HG13 VAL 41 HG13 VAL 41 17.867 27.868 -11.272 286 HG21 VAL 41 HG21 VAL 41 17.223 25.174 -9.879 287 HG22 VAL 41 HG22 VAL 41 17.060 26.794 -9.202 288 HG23 VAL 41 HG23 VAL 41 18.047 25.591 -8.376 289 H VAL 42 HN VAL 42 20.577 24.344 -12.638 290 HA VAL 42 HA VAL 42 23.194 25.564 -12.737 291 HB VAL 42 HB VAL 42 21.740 23.991 -14.873 292 HG11 VAL 42 HG11 VAL 42 23.992 23.579 -15.766 293 HG12 VAL 42 HG12 VAL 42 24.658 24.667 -14.546 294 HG13 VAL 42 HG13 VAL 42 23.566 25.289 -15.785 295 HG21 VAL 42 HG21 VAL 42 23.715 23.036 -12.803 296 HG22 VAL 42 HG22 VAL 42 23.011 22.067 -14.099 297 HG23 VAL 42 HG23 VAL 42 21.984 22.700 -12.813 298 H HIS 43 HN HIS 43 20.082 25.947 -14.338 299 HA HIS 43 HA HIS 43 20.741 28.649 -15.107 300 HB2 HIS 43 HB2 HIS 43 20.350 26.488 -17.173 301 HB3 HIS 43 HB1 HIS 43 19.927 28.157 -17.524 302 HD1 HIS 43 HD1 HIS 43 22.513 25.957 -18.211 303 HD2 HIS 43 HD2 HIS 43 22.424 29.836 -16.721 304 HE1 HIS 43 HE1 HIS 43 24.795 26.911 -18.669 305 HE2 HIS 43 HE2 HIS 43 24.642 29.322 -17.948 306 H GLY 44 HN GLY 44 18.853 29.785 -15.984 307 HA2 GLY 44 HA2 GLY 44 16.486 28.995 -14.568 308 HA3 GLY 44 HA1 GLY 44 16.683 30.436 -15.554 309 H GLU 45 HN GLU 45 14.889 30.352 -16.791 310 HA GLU 45 HA GLU 45 14.114 27.838 -17.996 311 HB2 GLU 45 HB2 GLU 45 12.420 29.761 -19.045 312 HB3 GLU 45 HB1 GLU 45 12.093 28.734 -17.653 313 HG2 GLU 45 HG2 GLU 45 11.636 30.925 -16.967 314 HG3 GLU 45 HG1 GLU 45 13.175 30.450 -16.248 315 H ALA 46 HN ALA 46 15.483 27.326 -19.432 316 HA ALA 46 HA ALA 46 15.742 29.020 -21.835 317 HB1 ALA 46 HB1 ALA 46 17.764 27.034 -20.788 318 HB2 ALA 46 HB2 ALA 46 17.905 28.789 -20.692 319 HB3 ALA 46 HB3 ALA 46 17.918 27.986 -22.263 320 H SER 47 HN SER 47 16.134 27.629 -23.841 321 HA SER 47 HA SER 47 13.952 26.057 -24.346 322 HB2 SER 47 HB2 SER 47 15.434 25.095 -26.239 323 HB3 SER 47 HB1 SER 47 15.123 26.831 -26.220 324 HG SER 47 HG SER 47 17.402 25.995 -26.497 325 H ARG 48 HN ARG 48 13.345 24.021 -23.995 326 HA ARG 48 HA ARG 48 14.589 22.594 -21.918 327 HB2 ARG 48 HB2 ARG 48 12.136 22.603 -22.670 328 HB3 ARG 48 HB1 ARG 48 12.619 21.377 -23.833 329 HG2 ARG 48 HG2 ARG 48 13.562 20.746 -21.174 330 HG3 ARG 48 HG1 ARG 48 11.814 20.975 -21.211 331 HD2 ARG 48 HD2 ARG 48 13.440 19.076 -22.895 332 HD3 ARG 48 HD1 ARG 48 12.312 18.653 -21.609 333 HE ARG 48 HE ARG 48 11.674 19.035 -24.308 334 HH11 ARG 48 HH11 ARG 48 10.424 19.991 -21.165 335 HH12 ARG 48 HH12 ARG 48 8.784 20.091 -21.716 336 HH21 ARG 48 HH21 ARG 48 9.509 19.123 -25.000 337 HH22 ARG 48 HH22 ARG 48 8.267 19.631 -23.888 338 H ALA 49 HN ALA 49 14.636 22.159 -25.418 339 HA ALA 49 HA ALA 49 15.899 19.661 -25.527 340 HB1 ALA 49 HB1 ALA 49 14.859 20.741 -27.459 341 HB2 ALA 49 HB2 ALA 49 16.526 20.274 -27.805 342 HB3 ALA 49 HB3 ALA 49 16.134 21.961 -27.467 343 H ALA 50 HN ALA 50 17.308 22.926 -25.592 344 HA ALA 50 HA ALA 50 19.996 22.103 -25.737 345 HB1 ALA 50 HB1 ALA 50 19.308 24.371 -26.292 346 HB2 ALA 50 HB2 ALA 50 20.540 24.387 -25.031 347 HB3 ALA 50 HB3 ALA 50 18.848 24.659 -24.614 348 H CYS 51 HN CYS 51 17.891 22.857 -23.010 349 HA CYS 51 HA CYS 51 19.823 22.600 -20.982 350 HB2 CYS 51 HB2 CYS 51 16.836 22.140 -20.870 351 HB3 CYS 51 HB1 CYS 51 17.885 22.331 -19.468 352 HG CYS 51 HG CYS 51 16.767 24.666 -21.644 353 H LEU 52 HN LEU 52 17.532 20.263 -22.355 354 HA LEU 52 HA LEU 52 18.203 18.097 -20.693 355 HB2 LEU 52 HB2 LEU 52 16.398 18.545 -22.736 356 HB3 LEU 52 HB1 LEU 52 17.488 17.362 -23.433 357 HG LEU 52 HG LEU 52 17.085 16.050 -21.230 358 HD11 LEU 52 HD11 LEU 52 14.667 17.832 -21.258 359 HD12 LEU 52 HD12 LEU 52 15.942 17.828 -20.041 360 HD13 LEU 52 HD13 LEU 52 14.902 16.417 -20.232 361 HD21 LEU 52 HD21 LEU 52 16.363 15.307 -23.435 362 HD22 LEU 52 HD22 LEU 52 14.925 16.324 -23.313 363 HD23 LEU 52 HD23 LEU 52 15.139 14.958 -22.215 364 H ASP 53 HN ASP 53 19.384 19.061 -23.887 365 HA ASP 53 HA ASP 53 21.187 16.995 -24.341 366 HB2 ASP 53 HB2 ASP 53 20.628 18.642 -26.055 367 HB3 ASP 53 HB1 ASP 53 21.404 19.915 -25.119 368 H TYR 54 HN TYR 54 21.696 20.101 -22.703 369 HA TYR 54 HA TYR 54 24.428 19.768 -22.193 370 HB2 TYR 54 HB2 TYR 54 23.231 21.927 -22.025 371 HB3 TYR 54 HB1 TYR 54 22.421 21.350 -20.573 372 HD1 TYR 54 HD1 TYR 54 25.834 21.923 -21.959 373 HD2 TYR 54 HD2 TYR 54 23.374 21.779 -18.490 374 HE1 TYR 54 HE1 TYR 54 27.714 22.732 -20.598 375 HE2 TYR 54 HE2 TYR 54 25.248 22.590 -17.122 376 HH TYR 54 HH TYR 54 27.709 22.593 -17.220 377 H VAL 55 HN VAL 55 21.624 19.048 -20.093 378 HA VAL 55 HA VAL 55 23.222 18.263 -17.888 379 HB VAL 55 HB VAL 55 21.195 17.335 -16.892 380 HG11 VAL 55 HG11 VAL 55 19.843 19.382 -16.887 381 HG12 VAL 55 HG12 VAL 55 20.755 19.971 -18.276 382 HG13 VAL 55 HG13 VAL 55 21.567 19.716 -16.732 383 HG21 VAL 55 HG21 VAL 55 19.049 17.414 -18.079 384 HG22 VAL 55 HG22 VAL 55 20.183 16.312 -18.858 385 HG23 VAL 55 HG23 VAL 55 19.885 17.907 -19.550 386 H GLU 56 HN GLU 56 21.814 16.464 -20.564 387 HA GLU 56 HA GLU 56 22.414 13.876 -19.559 388 HB2 GLU 56 HB2 GLU 56 21.886 14.914 -22.345 389 HB3 GLU 56 HB1 GLU 56 22.134 13.211 -21.989 390 HG2 GLU 56 HG2 GLU 56 20.079 14.645 -20.415 391 HG3 GLU 56 HG1 GLU 56 19.721 14.308 -22.106 392 H LYS 57 HN LYS 57 24.131 16.133 -21.665 393 HA LYS 57 HA LYS 57 26.315 14.293 -22.039 394 HB2 LYS 57 HB2 LYS 57 25.710 17.057 -22.999 395 HB3 LYS 57 HB1 LYS 57 27.339 16.408 -23.159 396 HG2 LYS 57 HG2 LYS 57 26.727 14.855 -24.701 397 HG3 LYS 57 HG1 LYS 57 25.090 14.708 -24.069 398 HD2 LYS 57 HD2 LYS 57 25.105 15.735 -26.280 399 HD3 LYS 57 HD1 LYS 57 24.511 16.858 -25.057 400 HE2 LYS 57 HE2 LYS 57 26.671 17.965 -24.993 401 HE3 LYS 57 HE1 LYS 57 27.317 16.806 -26.158 402 HZ1 LYS 57 HZ1 LYS 57 25.792 17.597 -27.806 403 HZ2 LYS 57 HZ2 LYS 57 26.638 18.925 -27.179 404 HZ3 LYS 57 HZ3 LYS 57 25.038 18.632 -26.693 405 H ASN 58 HN ASN 58 25.503 16.707 -19.732 406 HA ASN 58 HA ASN 58 28.184 16.969 -18.707 407 HB2 ASN 58 HB2 ASN 58 25.480 17.812 -17.774 408 HB3 ASN 58 HB1 ASN 58 26.739 17.636 -16.559 409 HD21 ASN 58 HD21 ASN 58 27.335 18.632 -19.867 410 HD22 ASN 58 HD22 ASN 58 27.794 20.252 -19.485 411 H TRP 59 HN TRP 59 25.562 14.756 -18.402 412 HA TRP 59 HA TRP 59 26.708 13.279 -16.226 413 HB2 TRP 59 HB2 TRP 59 24.341 13.086 -16.573 414 HB3 TRP 59 HB1 TRP 59 24.566 12.632 -18.259 415 HD1 TRP 59 HD1 TRP 59 25.107 11.198 -14.714 416 HE1 TRP 59 HE1 TRP 59 25.058 8.629 -14.875 417 HE3 TRP 59 HE3 TRP 59 24.782 10.724 -19.792 418 HZ2 TRP 59 HZ2 TRP 59 24.902 6.667 -16.902 419 HZ3 TRP 59 HZ3 TRP 59 24.687 8.464 -20.763 420 HH2 TRP 59 HH2 TRP 59 24.746 6.480 -19.342 421 H THR 60 HN THR 60 26.674 13.055 -19.758 422 HA THR 60 HA THR 60 28.220 10.720 -20.023 423 HB THR 60 HB THR 60 28.203 13.090 -21.903 424 HG1 THR 60 HG1 THR 60 26.112 11.810 -21.166 425 HG21 THR 60 HG21 THR 60 28.717 10.152 -22.363 426 HG22 THR 60 HG22 THR 60 29.924 11.437 -22.404 427 HG23 THR 60 HG23 THR 60 28.649 11.386 -23.621 428 H ASP 61 HN ASP 61 29.264 14.105 -20.452 429 HA ASP 61 HA ASP 61 31.965 13.363 -19.602 430 HB2 ASP 61 HB2 ASP 61 31.935 14.694 -21.617 431 HB3 ASP 61 HB1 ASP 61 30.869 15.883 -20.879 432 H LEU 62 HN LEU 62 31.655 13.067 -17.448 433 HA LEU 62 HA LEU 62 30.095 14.821 -15.838 434 HB2 LEU 62 HB2 LEU 62 30.635 12.324 -15.478 435 HB3 LEU 62 HB1 LEU 62 32.153 12.881 -14.809 436 HG LEU 62 HG LEU 62 30.401 12.336 -13.115 437 HD11 LEU 62 HD11 LEU 62 31.321 15.206 -13.128 438 HD12 LEU 62 HD12 LEU 62 32.244 13.822 -12.539 439 HD13 LEU 62 HD13 LEU 62 30.755 14.305 -11.723 440 HD21 LEU 62 HD21 LEU 62 28.583 13.949 -12.766 441 HD22 LEU 62 HD22 LEU 62 28.443 13.099 -14.305 442 HD23 LEU 62 HD23 LEU 62 29.034 14.761 -14.268 443 H ARG 63 HN ARG 63 30.795 16.856 -15.804 444 HA ARG 63 HA ARG 63 33.296 17.343 -14.387 445 HB2 ARG 63 HB2 ARG 63 33.803 17.617 -16.795 446 HB3 ARG 63 HB1 ARG 63 32.518 18.809 -16.922 447 HG2 ARG 63 HG2 ARG 63 34.692 19.878 -16.780 448 HG3 ARG 63 HG1 ARG 63 33.710 20.264 -15.364 449 HD2 ARG 63 HD2 ARG 63 34.885 18.455 -14.128 450 HD3 ARG 63 HD1 ARG 63 35.931 18.231 -15.529 451 HE ARG 63 HE ARG 63 36.216 20.860 -14.993 452 HH11 ARG 63 HH11 ARG 63 36.500 17.964 -13.038 453 HH12 ARG 63 HH12 ARG 63 37.634 18.671 -11.921 454 HH21 ARG 63 HH21 ARG 63 37.719 21.787 -13.542 455 HH22 ARG 63 HH22 ARG 63 38.335 20.847 -12.219 456 HA PRO 64 HA PRO 64 29.967 19.687 -12.402 457 HB2 PRO 64 HB2 PRO 64 31.821 19.828 -10.148 458 HB3 PRO 64 HB1 PRO 64 30.227 19.075 -10.235 459 HG2 PRO 64 HG2 PRO 64 32.509 17.634 -10.045 460 HG3 PRO 64 HG1 PRO 64 31.073 17.049 -10.906 461 HD2 PRO 64 HD2 PRO 64 33.586 18.257 -12.008 462 HD3 PRO 64 HD1 PRO 64 32.637 16.881 -12.612 463 H LYS 65 HN LYS 65 30.140 21.576 -13.592 464 HA LYS 65 HA LYS 65 32.349 23.384 -13.060 465 HB2 LYS 65 HB2 LYS 65 29.969 23.688 -14.902 466 HB3 LYS 65 HB1 LYS 65 31.333 24.793 -14.806 467 HG2 LYS 65 HG2 LYS 65 31.477 21.904 -15.643 468 HG3 LYS 65 HG1 LYS 65 31.508 23.295 -16.726 469 HD2 LYS 65 HD2 LYS 65 33.536 22.768 -14.556 470 HD3 LYS 65 HD1 LYS 65 33.755 22.350 -16.256 471 HE2 LYS 65 HE2 LYS 65 33.652 24.654 -16.901 472 HE3 LYS 65 HE1 LYS 65 33.204 25.141 -15.266 473 HZ1 LYS 65 HZ1 LYS 65 35.549 25.545 -15.752 474 HZ2 LYS 65 HZ2 LYS 65 35.789 23.891 -16.027 475 HZ3 LYS 65 HZ3 LYS 65 35.357 24.440 -14.483 476 H SER 66 HN SER 66 32.013 23.995 -10.940 477 HA SER 66 HA SER 66 29.500 25.330 -10.277 478 HB2 SER 66 HB2 SER 66 31.874 24.760 -8.487 479 HB3 SER 66 HB1 SER 66 30.266 25.276 -7.979 480 HG SER 66 HG SER 66 30.101 23.068 -9.514 481 H LEU 67 HN LEU 67 29.453 27.357 -11.042 482 HA LEU 67 HA LEU 67 31.778 29.084 -10.496 483 HB2 LEU 67 HB2 LEU 67 31.470 28.575 -12.912 484 HB3 LEU 67 HB1 LEU 67 29.865 29.271 -12.828 485 HG LEU 67 HG LEU 67 30.886 31.458 -12.221 486 HD11 LEU 67 HD11 LEU 67 32.965 30.639 -11.258 487 HD12 LEU 67 HD12 LEU 67 33.283 31.775 -12.569 488 HD13 LEU 67 HD13 LEU 67 33.475 30.042 -12.838 489 HD21 LEU 67 HD21 LEU 67 30.263 30.929 -14.535 490 HD22 LEU 67 HD22 LEU 67 31.875 30.262 -14.809 491 HD23 LEU 67 HD23 LEU 67 31.680 31.980 -14.459 492 H ARG 68 HN ARG 68 31.342 31.164 -9.747 493 HA ARG 68 HA ARG 68 28.525 31.832 -9.256 494 HB2 ARG 68 HB2 ARG 68 29.248 32.773 -7.020 495 HB3 ARG 68 HB1 ARG 68 29.244 31.020 -7.139 496 HG2 ARG 68 HG2 ARG 68 31.641 30.992 -7.412 497 HG3 ARG 68 HG1 ARG 68 31.687 32.754 -7.431 498 HD2 ARG 68 HD2 ARG 68 31.007 32.869 -5.147 499 HD3 ARG 68 HD1 ARG 68 30.660 31.140 -5.106 500 HE ARG 68 HE ARG 68 33.176 30.949 -5.612 501 HH11 ARG 68 HH11 ARG 68 31.712 33.411 -3.582 502 HH12 ARG 68 HH12 ARG 68 33.139 33.633 -2.609 503 HH21 ARG 68 HH21 ARG 68 35.033 31.227 -4.330 504 HH22 ARG 68 HH22 ARG 68 35.020 32.376 -3.021 505 H ASP 69 HN ASP 69 31.856 32.940 -9.522 506 HA ASP 69 HA ASP 69 30.900 35.505 -10.556 507 HB2 ASP 69 HB2 ASP 69 31.313 36.076 -8.285 508 HB3 ASP 69 HB1 ASP 69 32.791 35.121 -8.235 509 H ALA 70 HN ALA 70 32.138 36.313 -12.178 510 HA ALA 70 HA ALA 70 34.845 35.450 -12.611 511 HB1 ALA 70 HB1 ALA 70 33.635 33.542 -13.551 512 HB2 ALA 70 HB2 ALA 70 34.461 34.455 -14.813 513 HB3 ALA 70 HB3 ALA 70 32.720 34.629 -14.596 514 H MET 71 HN MET 71 35.522 36.326 -14.912 515 HA MET 71 HA MET 71 34.845 39.118 -14.917 516 HB2 MET 71 HB2 MET 71 36.627 37.527 -16.775 517 HB3 MET 71 HB1 MET 71 36.468 39.276 -16.790 518 HG2 MET 71 HG2 MET 71 38.463 38.791 -15.642 519 HG3 MET 71 HG1 MET 71 37.291 39.269 -14.418 520 HE1 MET 71 HE1 MET 71 39.149 36.285 -16.130 521 HE2 MET 71 HE2 MET 71 37.465 35.783 -16.279 522 HE3 MET 71 HE3 MET 71 38.557 34.900 -15.212 523 H VAL 72 HN VAL 72 32.591 38.891 -15.391 524 HA VAL 72 HA VAL 72 31.957 38.126 -18.148 525 HB VAL 72 HB VAL 72 29.604 38.237 -17.486 526 HG11 VAL 72 HG11 VAL 72 30.741 36.130 -17.197 527 HG12 VAL 72 HG12 VAL 72 29.585 36.363 -15.888 528 HG13 VAL 72 HG13 VAL 72 31.306 36.616 -15.599 529 HG21 VAL 72 HG21 VAL 72 28.953 38.615 -15.164 530 HG22 VAL 72 HG22 VAL 72 29.759 40.032 -15.838 531 HG23 VAL 72 HG23 VAL 72 30.629 38.959 -14.742 532 H GLU 73 HN GLU 73 30.478 39.575 -19.355 533 HA GLU 73 HA GLU 73 31.216 42.369 -18.838 534 HB2 GLU 73 HB2 GLU 73 31.898 41.325 -21.017 535 HB3 GLU 73 HB1 GLU 73 30.193 41.154 -21.408 536 HG2 GLU 73 HG2 GLU 73 29.908 43.552 -21.359 537 HG3 GLU 73 HG1 GLU 73 31.586 43.764 -20.866 538 H ASP 74 HN ASP 74 29.657 43.192 -17.578 539 HA ASP 74 HA ASP 74 26.863 42.804 -18.424 540 HB2 ASP 74 HB2 ASP 74 27.297 41.719 -16.269 541 HB3 ASP 74 HB1 ASP 74 27.923 43.233 -15.621 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 19.964 30.109 -35.308 2 H2 GLY 1 HT2 GLY 1 19.527 30.443 -33.706 3 H3 GLY 1 HT3 GLY 1 20.802 31.294 -34.433 4 HA2 GLY 1 HA1 GLY 1 19.277 32.310 -35.999 5 HA3 GLY 1 HA2 GLY 1 17.955 31.427 -35.249 6 H SER 2 HN SER 2 17.681 34.082 -35.388 7 HA SER 2 HA SER 2 18.722 35.397 -33.045 8 HB2 SER 2 HB2 SER 2 18.269 36.599 -35.189 9 HB3 SER 2 HB1 SER 2 16.547 36.307 -34.949 10 HG SER 2 HG SER 2 17.365 38.399 -34.212 11 H HIS 3 HN HIS 3 17.562 36.011 -31.208 12 HA HIS 3 HA HIS 3 14.909 34.763 -30.886 13 HB2 HIS 3 HB2 HIS 3 17.072 34.935 -28.774 14 HB3 HIS 3 HB1 HIS 3 15.456 34.280 -28.542 15 HD1 HIS 3 HD1 HIS 3 14.925 32.018 -29.901 16 HD2 HIS 3 HD2 HIS 3 18.928 33.148 -29.683 17 HE1 HIS 3 HE1 HIS 3 16.245 29.966 -30.500 18 HE2 HIS 3 HE2 HIS 3 18.659 30.623 -30.206 19 H MET 4 HN MET 4 13.371 35.986 -29.945 20 HA MET 4 HA MET 4 14.054 38.354 -28.439 21 HB2 MET 4 HB2 MET 4 12.676 39.862 -29.800 22 HB3 MET 4 HB1 MET 4 14.037 39.237 -30.714 23 HG2 MET 4 HG2 MET 4 12.596 37.672 -31.858 24 HG3 MET 4 HG1 MET 4 11.221 38.191 -30.885 25 HE1 MET 4 HE1 MET 4 13.831 39.218 -33.618 26 HE2 MET 4 HE2 MET 4 14.063 40.490 -32.419 27 HE3 MET 4 HE3 MET 4 13.352 40.875 -33.986 28 H SER 5 HN SER 5 12.028 39.374 -27.521 29 HA SER 5 HA SER 5 10.427 37.172 -26.523 30 HB2 SER 5 HB2 SER 5 11.447 38.929 -25.026 31 HB3 SER 5 HB1 SER 5 10.299 40.083 -25.701 32 HG SER 5 HG SER 5 8.741 39.230 -24.553 33 H THR 6 HN THR 6 9.509 36.984 -28.765 34 HA THR 6 HA THR 6 6.914 38.356 -28.765 35 HB THR 6 HB THR 6 6.996 38.404 -31.290 36 HG1 THR 6 HG1 THR 6 8.882 36.942 -31.336 37 HG21 THR 6 HG21 THR 6 7.291 40.463 -30.029 38 HG22 THR 6 HG22 THR 6 8.366 40.461 -31.427 39 HG23 THR 6 HG23 THR 6 9.007 40.116 -29.821 40 H ASN 7 HN ASN 7 5.508 36.708 -28.419 41 HA ASN 7 HA ASN 7 6.088 34.173 -29.786 42 HB2 ASN 7 HB2 ASN 7 4.863 33.022 -27.983 43 HB3 ASN 7 HB1 ASN 7 6.278 33.880 -27.395 44 HD21 ASN 7 HD21 ASN 7 3.808 32.962 -26.079 45 HD22 ASN 7 HD22 ASN 7 3.166 34.372 -25.290 46 HA PRO 8 HA PRO 8 2.007 34.898 -31.553 47 HB2 PRO 8 HB2 PRO 8 2.659 34.366 -34.083 48 HB3 PRO 8 HB1 PRO 8 3.095 35.913 -33.346 49 HG2 PRO 8 HG2 PRO 8 4.805 33.566 -33.974 50 HG3 PRO 8 HG1 PRO 8 5.229 35.284 -33.936 51 HD2 PRO 8 HD2 PRO 8 5.667 33.343 -31.898 52 HD3 PRO 8 HD1 PRO 8 5.968 35.089 -31.800 53 H PHE 9 HN PHE 9 3.497 32.434 -30.415 54 HA PHE 9 HA PHE 9 2.519 30.315 -32.170 55 HB2 PHE 9 HB2 PHE 9 4.344 30.182 -29.760 56 HB3 PHE 9 HB1 PHE 9 3.948 28.835 -30.820 57 HD1 PHE 9 HD1 PHE 9 4.404 29.391 -33.407 58 HD2 PHE 9 HD2 PHE 9 6.352 31.216 -30.098 59 HE1 PHE 9 HE1 PHE 9 6.307 29.974 -34.855 60 HE2 PHE 9 HE2 PHE 9 8.260 31.799 -31.538 61 HZ PHE 9 HZ PHE 9 8.239 31.179 -33.922 62 H ASP 10 HN ASP 10 2.426 28.309 -30.149 63 HA ASP 10 HA ASP 10 -0.277 28.792 -29.194 64 HB2 ASP 10 HB2 ASP 10 0.486 26.655 -30.354 65 HB3 ASP 10 HB1 ASP 10 1.381 26.274 -28.888 66 H ASP 11 HN ASP 11 -0.440 27.299 -26.915 67 HA ASP 11 HA ASP 11 0.398 29.108 -24.936 68 HB2 ASP 11 HB2 ASP 11 -1.561 27.713 -24.630 69 HB3 ASP 11 HB1 ASP 11 -0.580 26.256 -24.702 70 H ASP 12 HN ASP 12 2.168 29.279 -23.774 71 HA ASP 12 HA ASP 12 4.344 27.382 -24.252 72 HB2 ASP 12 HB2 ASP 12 4.974 29.631 -24.705 73 HB3 ASP 12 HB1 ASP 12 4.245 30.215 -23.215 74 H ASN 13 HN ASN 13 5.770 26.848 -22.398 75 HA ASN 13 HA ASN 13 4.132 25.835 -20.242 76 HB2 ASN 13 HB2 ASN 13 7.007 25.472 -21.042 77 HB3 ASN 13 HB1 ASN 13 6.433 24.915 -19.476 78 HD21 ASN 13 HD21 ASN 13 6.216 24.475 -22.935 79 HD22 ASN 13 HD22 ASN 13 5.442 22.930 -22.882 80 H GLY 14 HN GLY 14 5.937 28.641 -20.762 81 HA2 GLY 14 HA2 GLY 14 5.842 30.438 -19.206 82 HA3 GLY 14 HA1 GLY 14 5.724 29.276 -17.903 83 H ALA 15 HN ALA 15 7.551 28.168 -17.270 84 HA ALA 15 HA ALA 15 10.135 28.810 -18.360 85 HB1 ALA 15 HB1 ALA 15 9.461 29.710 -15.559 86 HB2 ALA 15 HB2 ALA 15 9.711 30.771 -16.946 87 HB3 ALA 15 HB3 ALA 15 11.045 29.796 -16.327 88 H PHE 16 HN PHE 16 11.719 27.391 -17.692 89 HA PHE 16 HA PHE 16 11.123 25.451 -15.606 90 HB2 PHE 16 HB2 PHE 16 12.096 23.690 -17.340 91 HB3 PHE 16 HB1 PHE 16 10.374 24.056 -17.294 92 HD1 PHE 16 HD1 PHE 16 13.489 25.287 -18.934 93 HD2 PHE 16 HD2 PHE 16 9.329 24.488 -19.284 94 HE1 PHE 16 HE1 PHE 16 13.561 25.961 -21.286 95 HE2 PHE 16 HE2 PHE 16 9.389 25.156 -21.646 96 HZ PHE 16 HZ PHE 16 11.512 25.896 -22.656 97 H PHE 17 HN PHE 17 12.982 24.553 -14.673 98 HA PHE 17 HA PHE 17 15.500 25.822 -15.546 99 HB2 PHE 17 HB2 PHE 17 14.450 25.278 -12.774 100 HB3 PHE 17 HB1 PHE 17 16.161 25.517 -13.072 101 HD1 PHE 17 HD2 PHE 17 14.445 27.558 -15.337 102 HD2 PHE 17 HD1 PHE 17 15.464 27.257 -11.223 103 HE1 PHE 17 HE2 PHE 17 14.136 29.987 -15.088 104 HE2 PHE 17 HE1 PHE 17 15.156 29.683 -10.961 105 HZ PHE 17 HZ PHE 17 14.493 31.053 -12.896 106 H VAL 18 HN VAL 18 17.447 24.652 -14.790 107 HA VAL 18 HA VAL 18 17.104 21.760 -15.079 108 HB VAL 18 HB VAL 18 19.588 23.483 -15.207 109 HG11 VAL 18 HG11 VAL 18 20.103 21.309 -14.209 110 HG12 VAL 18 HG12 VAL 18 20.803 21.463 -15.817 111 HG13 VAL 18 HG13 VAL 18 19.344 20.500 -15.576 112 HG21 VAL 18 HG21 VAL 18 18.179 23.668 -17.170 113 HG22 VAL 18 HG22 VAL 18 18.102 21.914 -17.314 114 HG23 VAL 18 HG23 VAL 18 19.634 22.755 -17.561 115 H LEU 19 HN LEU 19 16.627 20.867 -13.191 116 HA LEU 19 HA LEU 19 17.891 21.902 -10.756 117 HB2 LEU 19 HB2 LEU 19 15.329 21.655 -11.080 118 HB3 LEU 19 HB1 LEU 19 15.615 19.940 -10.865 119 HG LEU 19 HG LEU 19 16.663 20.488 -8.642 120 HD11 LEU 19 HD11 LEU 19 17.195 22.798 -8.977 121 HD12 LEU 19 HD12 LEU 19 16.002 22.684 -7.680 122 HD13 LEU 19 HD13 LEU 19 15.506 23.187 -9.292 123 HD21 LEU 19 HD21 LEU 19 14.386 19.615 -8.848 124 HD22 LEU 19 HD22 LEU 19 13.774 21.259 -9.034 125 HD23 LEU 19 HD23 LEU 19 14.521 20.762 -7.515 126 H VAL 20 HN VAL 20 19.402 20.732 -9.755 127 HA VAL 20 HA VAL 20 19.517 17.833 -10.272 128 HB VAL 20 HB VAL 20 21.893 19.695 -10.048 129 HG11 VAL 20 HG11 VAL 20 23.242 17.715 -10.598 130 HG12 VAL 20 HG12 VAL 20 21.794 16.714 -10.491 131 HG13 VAL 20 HG13 VAL 20 22.400 17.548 -9.058 132 HG21 VAL 20 HG21 VAL 20 20.864 18.149 -12.424 133 HG22 VAL 20 HG22 VAL 20 22.334 19.123 -12.383 134 HG23 VAL 20 HG23 VAL 20 20.757 19.893 -12.199 135 H ASN 21 HN ASN 21 20.043 16.559 -8.525 136 HA ASN 21 HA ASN 21 20.415 17.927 -5.939 137 HB2 ASN 21 HB2 ASN 21 18.118 16.977 -6.200 138 HB3 ASN 21 HB1 ASN 21 18.831 15.387 -6.437 139 HD21 ASN 21 HD21 ASN 21 18.218 17.944 -4.140 140 HD22 ASN 21 HD22 ASN 21 18.486 16.994 -2.718 141 H ASP 22 HN ASP 22 21.302 16.150 -4.283 142 HA ASP 22 HA ASP 22 23.836 15.408 -5.330 143 HB2 ASP 22 HB2 ASP 22 23.457 16.049 -2.964 144 HB3 ASP 22 HB1 ASP 22 22.554 14.558 -2.724 145 H GLU 23 HN GLU 23 20.828 13.713 -4.838 146 HA GLU 23 HA GLU 23 22.091 11.228 -5.792 147 HB2 GLU 23 HB2 GLU 23 19.678 11.688 -4.052 148 HB3 GLU 23 HB1 GLU 23 20.019 10.135 -4.804 149 HG2 GLU 23 HG2 GLU 23 21.984 11.559 -3.032 150 HG3 GLU 23 HG1 GLU 23 20.795 10.410 -2.423 151 H ASP 24 HN ASP 24 20.627 13.704 -7.096 152 HA ASP 24 HA ASP 24 18.956 12.080 -8.917 153 HB2 ASP 24 HB2 ASP 24 17.768 13.902 -7.604 154 HB3 ASP 24 HB1 ASP 24 18.746 15.070 -8.486 155 H GLN 25 HN GLN 25 19.606 12.037 -11.050 156 HA GLN 25 HA GLN 25 22.260 12.978 -11.551 157 HB2 GLN 25 HB2 GLN 25 20.247 11.801 -13.476 158 HB3 GLN 25 HB1 GLN 25 21.969 11.979 -13.771 159 HG2 GLN 25 HG2 GLN 25 22.479 10.362 -12.065 160 HG3 GLN 25 HG1 GLN 25 20.780 10.267 -11.601 161 HE21 GLN 25 HE21 GLN 25 22.605 8.170 -12.548 162 HE22 GLN 25 HE22 GLN 25 21.836 7.477 -13.932 163 H HIS 26 HN HIS 26 19.127 13.685 -13.101 164 HA HIS 26 HA HIS 26 19.626 16.466 -13.177 165 HB2 HIS 26 HB2 HIS 26 19.513 16.608 -15.753 166 HB3 HIS 26 HB1 HIS 26 21.058 16.234 -15.004 167 HD1 HIS 26 HD1 HIS 26 22.166 14.087 -15.659 168 HD2 HIS 26 HD2 HIS 26 18.262 14.358 -17.050 169 HE1 HIS 26 HE1 HIS 26 21.883 12.163 -17.252 170 HE2 HIS 26 HE2 HIS 26 19.614 12.530 -18.283 171 H SER 27 HN SER 27 17.693 17.447 -13.084 172 HA SER 27 HA SER 27 15.426 16.125 -14.411 173 HB2 SER 27 HB2 SER 27 15.464 17.313 -11.629 174 HB3 SER 27 HB1 SER 27 14.001 16.808 -12.480 175 HG SER 27 HG SER 27 16.119 15.235 -11.458 176 H LEU 28 HN LEU 28 14.264 17.419 -15.678 177 HA LEU 28 HA LEU 28 14.725 20.279 -15.660 178 HB2 LEU 28 HB2 LEU 28 13.309 18.366 -17.458 179 HB3 LEU 28 HB1 LEU 28 12.758 20.031 -17.457 180 HG LEU 28 HG LEU 28 14.337 19.663 -19.264 181 HD11 LEU 28 HD11 LEU 28 14.300 21.857 -18.205 182 HD12 LEU 28 HD12 LEU 28 15.925 21.451 -18.757 183 HD13 LEU 28 HD13 LEU 28 15.516 21.330 -17.045 184 HD21 LEU 28 HD21 LEU 28 16.322 18.917 -17.122 185 HD22 LEU 28 HD22 LEU 28 16.661 19.086 -18.844 186 HD23 LEU 28 HD23 LEU 28 15.591 17.804 -18.277 187 H TRP 29 HN TRP 29 13.745 21.400 -14.129 188 HA TRP 29 HA TRP 29 11.112 20.470 -13.204 189 HB2 TRP 29 HB2 TRP 29 13.092 20.488 -11.592 190 HB3 TRP 29 HB1 TRP 29 13.013 22.244 -11.675 191 HD1 TRP 29 HD1 TRP 29 11.580 23.323 -9.854 192 HE1 TRP 29 HE1 TRP 29 9.690 22.542 -8.281 193 HE3 TRP 29 HE3 TRP 29 10.946 18.582 -11.644 194 HZ2 TRP 29 HZ2 TRP 29 8.143 20.223 -7.863 195 HZ3 TRP 29 HZ3 TRP 29 9.242 17.144 -10.607 196 HH2 TRP 29 HH2 TRP 29 7.867 17.946 -8.755 197 HA PRO 30 HA PRO 30 9.679 24.231 -15.174 198 HB2 PRO 30 HB2 PRO 30 7.121 23.451 -13.938 199 HB3 PRO 30 HB1 PRO 30 7.514 23.699 -15.642 200 HG2 PRO 30 HG2 PRO 30 7.075 21.249 -14.630 201 HG3 PRO 30 HG1 PRO 30 8.253 21.529 -15.926 202 HD2 PRO 30 HD2 PRO 30 8.712 21.109 -12.998 203 HD3 PRO 30 HD1 PRO 30 9.641 20.502 -14.385 204 H VAL 31 HN VAL 31 9.339 26.264 -14.440 205 HA VAL 31 HA VAL 31 9.640 26.762 -11.612 206 HB VAL 31 HB VAL 31 9.175 28.782 -13.819 207 HG11 VAL 31 HG11 VAL 31 10.468 30.285 -12.352 208 HG12 VAL 31 HG12 VAL 31 10.499 29.021 -11.122 209 HG13 VAL 31 HG13 VAL 31 8.963 29.737 -11.609 210 HG21 VAL 31 HG21 VAL 31 11.777 27.594 -12.867 211 HG22 VAL 31 HG22 VAL 31 11.621 28.945 -13.989 212 HG23 VAL 31 HG23 VAL 31 11.029 27.347 -14.444 213 H PHE 32 HN PHE 32 7.149 25.682 -13.131 214 HA PHE 32 HA PHE 32 5.099 27.463 -12.062 215 HB2 PHE 32 HB2 PHE 32 4.876 26.528 -14.360 216 HB3 PHE 32 HB1 PHE 32 4.855 24.908 -13.681 217 HD1 PHE 32 HD2 PHE 32 3.027 28.136 -13.618 218 HD2 PHE 32 HD1 PHE 32 2.844 23.923 -13.084 219 HE1 PHE 32 HE2 PHE 32 0.580 28.278 -13.395 220 HE2 PHE 32 HE1 PHE 32 0.398 24.052 -12.869 221 HZ PHE 32 HZ PHE 32 -0.735 26.228 -13.017 222 H ALA 33 HN ALA 33 7.000 24.923 -11.089 223 HA ALA 33 HA ALA 33 4.979 23.870 -9.228 224 HB1 ALA 33 HB1 ALA 33 7.451 22.499 -10.280 225 HB2 ALA 33 HB2 ALA 33 5.794 22.187 -10.796 226 HB3 ALA 33 HB3 ALA 33 6.289 21.813 -9.144 227 H ASP 34 HN ASP 34 5.893 23.109 -7.146 228 HA ASP 34 HA ASP 34 7.270 25.253 -5.887 229 HB2 ASP 34 HB2 ASP 34 6.206 22.611 -4.967 230 HB3 ASP 34 HB1 ASP 34 7.255 23.542 -3.907 231 H ILE 35 HN ILE 35 9.272 25.390 -5.036 232 HA ILE 35 HA ILE 35 11.138 23.182 -5.621 233 HB ILE 35 HB ILE 35 11.782 26.138 -5.445 234 HG12 ILE 35 HG12 ILE 35 11.722 24.290 -7.845 235 HG13 ILE 35 HG11 ILE 35 10.556 25.563 -7.500 236 HG21 ILE 35 HG21 ILE 35 13.546 23.786 -6.120 237 HG22 ILE 35 HG22 ILE 35 13.616 24.758 -4.650 238 HG23 ILE 35 HG23 ILE 35 14.020 25.481 -6.206 239 HD11 ILE 35 HD11 ILE 35 13.487 26.002 -8.024 240 HD12 ILE 35 HD12 ILE 35 12.264 27.251 -7.783 241 HD13 ILE 35 HD13 ILE 35 12.194 26.212 -9.204 242 HA PRO 36 HA PRO 36 11.266 23.240 -1.173 243 HB2 PRO 36 HB2 PRO 36 12.395 20.863 -0.796 244 HB3 PRO 36 HB1 PRO 36 10.783 21.002 -1.498 245 HG2 PRO 36 HG2 PRO 36 13.395 20.513 -2.872 246 HG3 PRO 36 HG1 PRO 36 11.821 19.757 -3.164 247 HD2 PRO 36 HD2 PRO 36 12.875 21.867 -4.636 248 HD3 PRO 36 HD1 PRO 36 11.156 21.434 -4.557 249 H ALA 37 HN ALA 37 14.088 21.319 -1.173 250 HA ALA 37 HA ALA 37 15.908 23.559 -0.911 251 HB1 ALA 37 HB1 ALA 37 16.541 22.982 1.381 252 HB2 ALA 37 HB2 ALA 37 15.282 21.745 1.414 253 HB3 ALA 37 HB3 ALA 37 14.840 23.448 1.284 254 H GLY 38 HN GLY 38 18.154 22.737 -0.337 255 HA2 GLY 38 HA2 GLY 38 19.932 21.341 -0.804 256 HA3 GLY 38 HA1 GLY 38 18.800 19.995 -0.743 257 H TRP 39 HN TRP 39 18.371 22.688 -2.902 258 HA TRP 39 HA TRP 39 18.614 20.817 -5.139 259 HB2 TRP 39 HB2 TRP 39 17.342 22.668 -6.374 260 HB3 TRP 39 HB1 TRP 39 16.461 21.760 -5.153 261 HD1 TRP 39 HD1 TRP 39 15.532 23.066 -3.099 262 HE1 TRP 39 HE1 TRP 39 15.397 25.558 -2.479 263 HE3 TRP 39 HE3 TRP 39 18.716 24.943 -6.633 264 HZ2 TRP 39 HZ2 TRP 39 16.505 28.002 -3.375 265 HZ3 TRP 39 HZ3 TRP 39 19.124 27.366 -6.683 266 HH2 TRP 39 HH2 TRP 39 18.041 28.865 -5.088 267 H ARG 40 HN ARG 40 19.652 21.418 -7.064 268 HA ARG 40 HA ARG 40 21.401 23.780 -6.903 269 HB2 ARG 40 HB2 ARG 40 22.058 21.018 -7.948 270 HB3 ARG 40 HB1 ARG 40 23.001 22.435 -8.380 271 HG2 ARG 40 HG2 ARG 40 24.163 21.356 -6.636 272 HG3 ARG 40 HG1 ARG 40 23.409 22.777 -5.919 273 HD2 ARG 40 HD2 ARG 40 21.601 21.374 -5.045 274 HD3 ARG 40 HD1 ARG 40 22.348 19.954 -5.774 275 HE ARG 40 HE ARG 40 24.028 20.010 -4.146 276 HH11 ARG 40 HH11 ARG 40 21.771 22.673 -3.771 277 HH12 ARG 40 HH12 ARG 40 22.251 23.027 -2.137 278 HH21 ARG 40 HH21 ARG 40 24.663 20.453 -1.995 279 HH22 ARG 40 HH22 ARG 40 23.908 21.769 -1.130 280 H VAL 41 HN VAL 41 20.669 25.205 -8.380 281 HA VAL 41 HA VAL 41 19.397 24.203 -10.811 282 HB VAL 41 HB VAL 41 19.673 27.033 -9.777 283 HG11 VAL 41 HG11 VAL 41 18.171 26.005 -12.185 284 HG12 VAL 41 HG12 VAL 41 19.632 26.993 -12.220 285 HG13 VAL 41 HG13 VAL 41 18.131 27.660 -11.572 286 HG21 VAL 41 HG21 VAL 41 18.134 25.669 -8.465 287 HG22 VAL 41 HG22 VAL 41 17.283 25.194 -9.935 288 HG23 VAL 41 HG23 VAL 41 17.253 26.876 -9.400 289 H VAL 42 HN VAL 42 20.762 23.648 -12.355 290 HA VAL 42 HA VAL 42 23.395 24.850 -12.501 291 HB VAL 42 HB VAL 42 22.184 22.720 -14.278 292 HG11 VAL 42 HG11 VAL 42 24.094 23.797 -15.316 293 HG12 VAL 42 HG12 VAL 42 24.537 22.171 -14.792 294 HG13 VAL 42 HG13 VAL 42 25.048 23.569 -13.852 295 HG21 VAL 42 HG21 VAL 42 23.926 22.423 -11.830 296 HG22 VAL 42 HG22 VAL 42 23.399 21.116 -12.889 297 HG23 VAL 42 HG23 VAL 42 22.214 22.011 -11.938 298 H HIS 43 HN HIS 43 20.359 25.051 -14.174 299 HA HIS 43 HA HIS 43 21.427 27.143 -15.890 300 HB2 HIS 43 HB2 HIS 43 21.724 25.007 -17.138 301 HB3 HIS 43 HB1 HIS 43 19.990 24.737 -17.026 302 HD1 HIS 43 HD1 HIS 43 18.541 25.815 -18.762 303 HD2 HIS 43 HD2 HIS 43 22.449 27.235 -18.824 304 HE1 HIS 43 HE1 HIS 43 18.727 27.181 -20.857 305 HE2 HIS 43 HE2 HIS 43 21.070 28.116 -20.834 306 H GLY 44 HN GLY 44 19.869 28.612 -16.569 307 HA2 GLY 44 HA2 GLY 44 17.453 28.589 -14.971 308 HA3 GLY 44 HA1 GLY 44 18.045 29.915 -15.956 309 H GLU 45 HN GLU 45 15.885 30.212 -16.692 310 HA GLU 45 HA GLU 45 14.622 28.055 -18.104 311 HB2 GLU 45 HB2 GLU 45 12.823 29.782 -18.565 312 HB3 GLU 45 HB1 GLU 45 13.097 29.360 -16.883 313 HG2 GLU 45 HG2 GLU 45 13.031 31.575 -16.581 314 HG3 GLU 45 HG1 GLU 45 14.712 31.510 -17.106 315 H ALA 46 HN ALA 46 15.712 27.530 -19.837 316 HA ALA 46 HA ALA 46 15.372 29.291 -22.133 317 HB1 ALA 46 HB1 ALA 46 18.018 27.978 -21.495 318 HB2 ALA 46 HB2 ALA 46 17.686 29.711 -21.458 319 HB3 ALA 46 HB3 ALA 46 17.628 28.830 -22.987 320 H SER 47 HN SER 47 15.865 27.919 -24.191 321 HA SER 47 HA SER 47 13.835 26.284 -24.577 322 HB2 SER 47 HB2 SER 47 16.555 25.744 -25.771 323 HB3 SER 47 HB1 SER 47 14.997 25.295 -26.462 324 HG SER 47 HG SER 47 14.583 27.701 -26.248 325 H ARG 48 HN ARG 48 13.079 24.376 -24.075 326 HA ARG 48 HA ARG 48 14.151 22.961 -21.895 327 HB2 ARG 48 HB2 ARG 48 11.722 23.213 -22.562 328 HB3 ARG 48 HB1 ARG 48 12.014 22.019 -23.815 329 HG2 ARG 48 HG2 ARG 48 12.591 21.386 -20.950 330 HG3 ARG 48 HG1 ARG 48 10.949 21.292 -21.582 331 HD2 ARG 48 HD2 ARG 48 13.363 19.762 -22.542 332 HD3 ARG 48 HD1 ARG 48 11.965 19.116 -21.685 333 HE ARG 48 HE ARG 48 11.483 20.392 -24.270 334 HH11 ARG 48 HH11 ARG 48 11.637 17.472 -22.341 335 HH12 ARG 48 HH12 ARG 48 11.053 16.441 -23.616 336 HH21 ARG 48 HH21 ARG 48 10.668 19.046 -25.941 337 HH22 ARG 48 HH22 ARG 48 10.478 17.338 -25.655 338 H ALA 49 HN ALA 49 14.120 22.320 -25.372 339 HA ALA 49 HA ALA 49 15.228 19.717 -25.245 340 HB1 ALA 49 HB1 ALA 49 15.674 19.980 -27.619 341 HB2 ALA 49 HB2 ALA 49 15.401 21.718 -27.496 342 HB3 ALA 49 HB3 ALA 49 14.068 20.598 -27.223 343 H ALA 50 HN ALA 50 16.689 22.922 -25.446 344 HA ALA 50 HA ALA 50 19.359 22.057 -25.835 345 HB1 ALA 50 HB1 ALA 50 19.986 24.329 -25.144 346 HB2 ALA 50 HB2 ALA 50 18.325 24.621 -24.622 347 HB3 ALA 50 HB3 ALA 50 18.676 24.343 -26.328 348 H CYS 51 HN CYS 51 17.421 22.800 -22.981 349 HA CYS 51 HA CYS 51 19.416 22.354 -21.056 350 HB2 CYS 51 HB2 CYS 51 16.423 21.974 -20.888 351 HB3 CYS 51 HB1 CYS 51 17.507 21.951 -19.501 352 HG CYS 51 HG CYS 51 16.239 24.550 -21.174 353 H LEU 52 HN LEU 52 17.078 20.135 -22.568 354 HA LEU 52 HA LEU 52 17.767 17.785 -21.258 355 HB2 LEU 52 HB2 LEU 52 16.989 18.184 -24.145 356 HB3 LEU 52 HB1 LEU 52 17.105 16.618 -23.369 357 HG LEU 52 HG LEU 52 15.177 18.819 -22.638 358 HD11 LEU 52 HD11 LEU 52 14.794 16.151 -23.982 359 HD12 LEU 52 HD12 LEU 52 14.634 17.736 -24.737 360 HD13 LEU 52 HD13 LEU 52 13.499 17.237 -23.482 361 HD21 LEU 52 HD21 LEU 52 15.830 17.558 -20.668 362 HD22 LEU 52 HD22 LEU 52 15.522 16.040 -21.515 363 HD23 LEU 52 HD23 LEU 52 14.186 17.132 -21.144 364 H ASP 53 HN ASP 53 19.211 19.185 -24.187 365 HA ASP 53 HA ASP 53 21.125 17.232 -24.685 366 HB2 ASP 53 HB2 ASP 53 20.663 19.060 -26.242 367 HB3 ASP 53 HB1 ASP 53 21.326 20.225 -25.100 368 H TYR 54 HN TYR 54 21.416 20.191 -22.764 369 HA TYR 54 HA TYR 54 24.064 19.870 -21.945 370 HB2 TYR 54 HB2 TYR 54 22.537 21.910 -21.729 371 HB3 TYR 54 HB1 TYR 54 21.924 21.159 -20.260 372 HD1 TYR 54 HD1 TYR 54 25.054 22.355 -21.872 373 HD2 TYR 54 HD2 TYR 54 23.048 21.474 -18.223 374 HE1 TYR 54 HE1 TYR 54 26.907 23.376 -20.620 375 HE2 TYR 54 HE2 TYR 54 24.899 22.490 -16.960 376 HH TYR 54 HH TYR 54 27.319 22.973 -17.287 377 H VAL 55 HN VAL 55 21.063 18.860 -20.278 378 HA VAL 55 HA VAL 55 22.424 17.923 -17.970 379 HB VAL 55 HB VAL 55 20.341 16.912 -17.269 380 HG11 VAL 55 HG11 VAL 55 19.923 19.577 -18.598 381 HG12 VAL 55 HG12 VAL 55 20.558 19.298 -16.975 382 HG13 VAL 55 HG13 VAL 55 18.885 18.884 -17.353 383 HG21 VAL 55 HG21 VAL 55 19.628 15.938 -19.399 384 HG22 VAL 55 HG22 VAL 55 19.277 17.553 -20.018 385 HG23 VAL 55 HG23 VAL 55 18.347 16.905 -18.666 386 H GLU 56 HN GLU 56 21.411 16.337 -20.937 387 HA GLU 56 HA GLU 56 21.894 13.685 -20.006 388 HB2 GLU 56 HB2 GLU 56 21.558 14.860 -22.761 389 HB3 GLU 56 HB1 GLU 56 21.784 13.139 -22.473 390 HG2 GLU 56 HG2 GLU 56 19.611 14.658 -21.093 391 HG3 GLU 56 HG1 GLU 56 19.394 14.047 -22.725 392 H LYS 57 HN LYS 57 23.789 16.044 -21.842 393 HA LYS 57 HA LYS 57 25.999 14.231 -22.184 394 HB2 LYS 57 HB2 LYS 57 25.598 17.166 -22.698 395 HB3 LYS 57 HB1 LYS 57 27.171 16.401 -22.899 396 HG2 LYS 57 HG2 LYS 57 26.514 15.200 -24.725 397 HG3 LYS 57 HG1 LYS 57 24.824 15.151 -24.223 398 HD2 LYS 57 HD2 LYS 57 25.150 16.556 -26.203 399 HD3 LYS 57 HD1 LYS 57 24.553 17.484 -24.828 400 HE2 LYS 57 HE2 LYS 57 26.855 18.245 -24.379 401 HE3 LYS 57 HE1 LYS 57 27.403 17.367 -25.808 402 HZ1 LYS 57 HZ1 LYS 57 26.067 18.757 -27.195 403 HZ2 LYS 57 HZ2 LYS 57 26.993 19.765 -26.192 404 HZ3 LYS 57 HZ3 LYS 57 25.347 19.510 -25.860 405 H ASN 58 HN ASN 58 24.906 16.189 -19.645 406 HA ASN 58 HA ASN 58 27.553 16.377 -18.413 407 HB2 ASN 58 HB2 ASN 58 24.917 17.684 -17.873 408 HB3 ASN 58 HB1 ASN 58 26.093 17.559 -16.569 409 HD21 ASN 58 HD21 ASN 58 27.030 17.907 -19.911 410 HD22 ASN 58 HD22 ASN 58 27.636 19.517 -19.773 411 H TRP 59 HN TRP 59 25.721 13.887 -18.714 412 HA TRP 59 HA TRP 59 24.905 13.139 -16.126 413 HB2 TRP 59 HB2 TRP 59 24.297 11.123 -17.044 414 HB3 TRP 59 HB1 TRP 59 24.390 12.095 -18.504 415 HD1 TRP 59 HD1 TRP 59 25.626 8.947 -17.025 416 HE1 TRP 59 HE1 TRP 59 27.426 7.871 -18.519 417 HE3 TRP 59 HE3 TRP 59 26.559 12.901 -20.137 418 HZ2 TRP 59 HZ2 TRP 59 29.019 8.606 -20.726 419 HZ3 TRP 59 HZ3 TRP 59 28.236 12.626 -21.913 420 HH2 TRP 59 HH2 TRP 59 29.442 10.523 -22.200 421 H THR 60 HN THR 60 27.997 13.227 -17.604 422 HA THR 60 HA THR 60 29.358 11.375 -15.947 423 HB THR 60 HB THR 60 30.460 13.822 -17.352 424 HG1 THR 60 HG1 THR 60 30.058 11.126 -18.199 425 HG21 THR 60 HG21 THR 60 31.836 11.302 -16.404 426 HG22 THR 60 HG22 THR 60 31.984 12.896 -15.666 427 HG23 THR 60 HG23 THR 60 32.595 12.620 -17.297 428 H ASP 61 HN ASP 61 30.044 11.574 -13.891 429 HA ASP 61 HA ASP 61 29.094 13.777 -12.360 430 HB2 ASP 61 HB2 ASP 61 30.070 12.610 -10.420 431 HB3 ASP 61 HB1 ASP 61 29.075 11.550 -11.404 432 H LEU 62 HN LEU 62 30.203 15.516 -13.366 433 HA LEU 62 HA LEU 62 32.965 15.825 -12.393 434 HB2 LEU 62 HB2 LEU 62 32.565 15.971 -14.882 435 HB3 LEU 62 HB1 LEU 62 31.591 17.391 -14.585 436 HG LEU 62 HG LEU 62 33.985 17.754 -15.384 437 HD11 LEU 62 HD11 LEU 62 32.623 19.559 -14.461 438 HD12 LEU 62 HD12 LEU 62 34.317 19.725 -14.009 439 HD13 LEU 62 HD13 LEU 62 33.148 19.124 -12.835 440 HD21 LEU 62 HD21 LEU 62 34.562 16.996 -12.527 441 HD22 LEU 62 HD22 LEU 62 35.706 17.747 -13.640 442 HD23 LEU 62 HD23 LEU 62 35.086 16.130 -13.972 443 H ARG 63 HN ARG 63 32.893 16.822 -10.482 444 HA ARG 63 HA ARG 63 30.799 18.710 -9.855 445 HB2 ARG 63 HB2 ARG 63 31.993 18.925 -7.672 446 HB3 ARG 63 HB1 ARG 63 31.524 17.278 -8.071 447 HG2 ARG 63 HG2 ARG 63 33.774 16.722 -8.680 448 HG3 ARG 63 HG1 ARG 63 34.283 18.402 -8.499 449 HD2 ARG 63 HD2 ARG 63 34.962 17.125 -6.565 450 HD3 ARG 63 HD1 ARG 63 33.722 18.290 -6.109 451 HE ARG 63 HE ARG 63 32.317 16.007 -6.610 452 HH11 ARG 63 HH11 ARG 63 35.047 16.808 -4.575 453 HH12 ARG 63 HH12 ARG 63 34.688 15.614 -3.370 454 HH21 ARG 63 HH21 ARG 63 31.807 14.419 -5.009 455 HH22 ARG 63 HH22 ARG 63 32.832 14.259 -3.610 456 HA PRO 64 HA PRO 64 33.337 22.047 -11.403 457 HB2 PRO 64 HB2 PRO 64 31.388 23.882 -11.550 458 HB3 PRO 64 HB1 PRO 64 31.493 22.548 -12.705 459 HG2 PRO 64 HG2 PRO 64 29.687 22.875 -10.349 460 HG3 PRO 64 HG1 PRO 64 29.341 22.179 -11.942 461 HD2 PRO 64 HD2 PRO 64 29.916 20.722 -9.648 462 HD3 PRO 64 HD1 PRO 64 30.059 20.113 -11.308 463 H LYS 65 HN LYS 65 34.351 23.766 -10.449 464 HA LYS 65 HA LYS 65 34.184 24.123 -7.657 465 HB2 LYS 65 HB2 LYS 65 35.426 25.889 -9.776 466 HB3 LYS 65 HB1 LYS 65 35.655 26.097 -8.045 467 HG2 LYS 65 HG2 LYS 65 36.715 23.895 -7.924 468 HG3 LYS 65 HG1 LYS 65 36.498 23.703 -9.667 469 HD2 LYS 65 HD2 LYS 65 37.879 25.670 -10.067 470 HD3 LYS 65 HD1 LYS 65 38.080 25.896 -8.329 471 HE2 LYS 65 HE2 LYS 65 39.218 23.728 -8.186 472 HE3 LYS 65 HE1 LYS 65 39.012 23.510 -9.925 473 HZ1 LYS 65 HZ1 LYS 65 40.382 25.427 -10.321 474 HZ2 LYS 65 HZ2 LYS 65 41.227 24.337 -9.334 475 HZ3 LYS 65 HZ3 LYS 65 40.525 25.730 -8.661 476 H SER 66 HN SER 66 32.259 24.777 -6.861 477 HA SER 66 HA SER 66 30.610 26.628 -8.326 478 HB2 SER 66 HB2 SER 66 30.117 25.400 -5.606 479 HB3 SER 66 HB1 SER 66 28.918 26.139 -6.670 480 HG SER 66 HG SER 66 30.415 24.111 -7.807 481 H LEU 67 HN LEU 67 31.961 28.482 -8.238 482 HA LEU 67 HA LEU 67 32.043 29.837 -5.633 483 HB2 LEU 67 HB2 LEU 67 34.049 29.607 -7.338 484 HB3 LEU 67 HB1 LEU 67 33.262 30.952 -8.135 485 HG LEU 67 HG LEU 67 34.257 30.969 -5.282 486 HD11 LEU 67 HD11 LEU 67 36.004 32.459 -6.140 487 HD12 LEU 67 HD12 LEU 67 35.411 32.201 -7.781 488 HD13 LEU 67 HD13 LEU 67 36.088 30.854 -6.866 489 HD21 LEU 67 HD21 LEU 67 32.363 32.474 -5.614 490 HD22 LEU 67 HD22 LEU 67 33.178 33.209 -6.994 491 HD23 LEU 67 HD23 LEU 67 33.861 33.378 -5.378 492 H ARG 68 HN ARG 68 29.845 30.379 -5.519 493 HA ARG 68 HA ARG 68 29.070 32.627 -7.204 494 HB2 ARG 68 HB2 ARG 68 28.200 30.543 -8.302 495 HB3 ARG 68 HB1 ARG 68 27.255 30.234 -6.852 496 HG2 ARG 68 HG2 ARG 68 26.112 32.410 -7.196 497 HG3 ARG 68 HG1 ARG 68 26.982 32.579 -8.722 498 HD2 ARG 68 HD2 ARG 68 25.981 30.403 -9.437 499 HD3 ARG 68 HD1 ARG 68 24.997 30.436 -7.974 500 HE ARG 68 HE ARG 68 24.857 32.533 -10.053 501 HH11 ARG 68 HH11 ARG 68 23.298 30.341 -7.811 502 HH12 ARG 68 HH12 ARG 68 21.695 30.917 -8.164 503 HH21 ARG 68 HH21 ARG 68 22.762 33.278 -10.529 504 HH22 ARG 68 HH22 ARG 68 21.393 32.588 -9.712 505 H ASP 69 HN ASP 69 29.037 34.022 -5.518 506 HA ASP 69 HA ASP 69 27.508 33.350 -3.117 507 HB2 ASP 69 HB2 ASP 69 29.657 34.467 -2.775 508 HB3 ASP 69 HB1 ASP 69 29.154 35.798 -3.813 509 H ALA 70 HN ALA 70 25.389 33.686 -3.175 510 HA ALA 70 HA ALA 70 24.380 35.867 -4.884 511 HB1 ALA 70 HB1 ALA 70 22.983 33.304 -4.119 512 HB2 ALA 70 HB2 ALA 70 23.747 33.637 -5.673 513 HB3 ALA 70 HB3 ALA 70 22.339 34.568 -5.165 514 H MET 71 HN MET 71 23.307 33.935 -2.085 515 HA MET 71 HA MET 71 22.014 34.437 -0.291 516 HB2 MET 71 HB2 MET 71 23.446 37.101 -0.411 517 HB3 MET 71 HB1 MET 71 22.601 36.442 0.982 518 HG2 MET 71 HG2 MET 71 25.118 35.401 -0.290 519 HG3 MET 71 HG1 MET 71 24.938 36.134 1.304 520 HE1 MET 71 HE1 MET 71 25.818 32.440 2.193 521 HE2 MET 71 HE2 MET 71 26.218 34.139 2.453 522 HE3 MET 71 HE3 MET 71 26.461 33.409 0.867 523 H VAL 72 HN VAL 72 20.092 34.362 -1.528 524 HA VAL 72 HA VAL 72 18.858 36.985 -1.975 525 HB VAL 72 HB VAL 72 17.817 36.154 -4.058 526 HG11 VAL 72 HG11 VAL 72 19.826 37.521 -4.181 527 HG12 VAL 72 HG12 VAL 72 19.797 36.330 -5.480 528 HG13 VAL 72 HG13 VAL 72 20.829 36.075 -4.074 529 HG21 VAL 72 HG21 VAL 72 17.959 33.752 -3.585 530 HG22 VAL 72 HG22 VAL 72 19.711 33.822 -3.767 531 HG23 VAL 72 HG23 VAL 72 18.667 34.148 -5.151 532 H GLU 73 HN GLU 73 16.590 37.001 -1.959 533 HA GLU 73 HA GLU 73 14.473 36.397 -1.484 534 HB2 GLU 73 HB2 GLU 73 14.880 34.449 -2.941 535 HB3 GLU 73 HB1 GLU 73 15.454 33.543 -1.548 536 HG2 GLU 73 HG2 GLU 73 13.263 33.708 -0.511 537 HG3 GLU 73 HG1 GLU 73 12.680 34.669 -1.869 538 H ASP 74 HN ASP 74 14.799 37.455 0.523 539 HA ASP 74 HA ASP 74 14.361 35.547 2.705 540 HB2 ASP 74 HB2 ASP 74 15.347 37.112 4.313 541 HB3 ASP 74 HB1 ASP 74 16.526 36.620 3.106 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 -12.174 28.682 -34.228 2 H2 GLY 1 HT2 GLY 1 -13.827 28.338 -34.100 3 H3 GLY 1 HT3 GLY 1 -12.730 27.096 -34.448 4 HA2 GLY 1 HA1 GLY 1 -11.704 27.360 -32.271 5 HA3 GLY 1 HA2 GLY 1 -12.867 28.632 -31.913 6 H SER 2 HN SER 2 -12.567 26.286 -30.371 7 HA SER 2 HA SER 2 -14.404 24.266 -31.063 8 HB2 SER 2 HB2 SER 2 -13.466 25.083 -28.303 9 HB3 SER 2 HB1 SER 2 -14.157 23.523 -28.753 10 HG SER 2 HG SER 2 -12.251 22.921 -29.370 11 H HIS 3 HN HIS 3 -16.526 24.546 -31.336 12 HA HIS 3 HA HIS 3 -17.992 26.623 -29.987 13 HB2 HIS 3 HB2 HIS 3 -18.969 24.277 -31.638 14 HB3 HIS 3 HB1 HIS 3 -19.971 25.618 -31.087 15 HD1 HIS 3 HD1 HIS 3 -17.410 24.689 -33.631 16 HD2 HIS 3 HD2 HIS 3 -19.560 28.055 -32.470 17 HE1 HIS 3 HE1 HIS 3 -17.126 26.350 -35.497 18 HE2 HIS 3 HE2 HIS 3 -18.336 28.419 -34.722 19 H MET 4 HN MET 4 -19.197 26.448 -28.163 20 HA MET 4 HA MET 4 -19.696 25.698 -26.082 21 HB2 MET 4 HB2 MET 4 -19.902 23.017 -27.471 22 HB3 MET 4 HB1 MET 4 -20.426 23.336 -25.824 23 HG2 MET 4 HG2 MET 4 -22.118 24.844 -26.591 24 HG3 MET 4 HG1 MET 4 -21.525 24.733 -28.248 25 HE1 MET 4 HE1 MET 4 -21.788 21.757 -25.703 26 HE2 MET 4 HE2 MET 4 -23.413 21.150 -26.021 27 HE3 MET 4 HE3 MET 4 -23.192 22.735 -25.277 28 H SER 5 HN SER 5 -17.532 26.286 -25.495 29 HA SER 5 HA SER 5 -15.712 23.986 -25.207 30 HB2 SER 5 HB2 SER 5 -14.899 25.662 -26.813 31 HB3 SER 5 HB1 SER 5 -15.011 26.909 -25.572 32 HG SER 5 HG SER 5 -13.132 26.301 -24.881 33 H THR 6 HN THR 6 -15.341 23.369 -23.218 34 HA THR 6 HA THR 6 -15.543 25.322 -21.031 35 HB THR 6 HB THR 6 -15.459 23.236 -19.570 36 HG1 THR 6 HG1 THR 6 -14.703 21.939 -21.488 37 HG21 THR 6 HG21 THR 6 -17.775 23.569 -21.478 38 HG22 THR 6 HG22 THR 6 -17.545 24.419 -19.951 39 HG23 THR 6 HG23 THR 6 -17.832 22.679 -19.956 40 H ASN 7 HN ASN 7 -13.708 26.067 -20.192 41 HA ASN 7 HA ASN 7 -11.199 25.038 -21.206 42 HB2 ASN 7 HB2 ASN 7 -11.761 27.388 -19.386 43 HB3 ASN 7 HB1 ASN 7 -10.206 27.009 -20.118 44 HD21 ASN 7 HD21 ASN 7 -13.426 28.194 -20.664 45 HD22 ASN 7 HD22 ASN 7 -13.128 28.840 -22.243 46 HA PRO 8 HA PRO 8 -10.508 22.505 -17.608 47 HB2 PRO 8 HB2 PRO 8 -7.888 21.924 -18.187 48 HB3 PRO 8 HB1 PRO 8 -9.271 21.083 -18.893 49 HG2 PRO 8 HG2 PRO 8 -7.583 23.257 -20.043 50 HG3 PRO 8 HG1 PRO 8 -8.276 21.832 -20.838 51 HD2 PRO 8 HD2 PRO 8 -9.338 24.310 -21.081 52 HD3 PRO 8 HD1 PRO 8 -10.326 22.837 -21.123 53 H PHE 9 HN PHE 9 -8.085 24.915 -18.619 54 HA PHE 9 HA PHE 9 -6.870 26.455 -17.482 55 HB2 PHE 9 HB2 PHE 9 -9.049 25.990 -15.450 56 HB3 PHE 9 HB1 PHE 9 -7.739 27.128 -15.165 57 HD1 PHE 9 HD2 PHE 9 -7.358 28.723 -17.349 58 HD2 PHE 9 HD1 PHE 9 -11.018 26.922 -16.136 59 HE1 PHE 9 HE2 PHE 9 -8.613 30.473 -18.543 60 HE2 PHE 9 HE1 PHE 9 -12.278 28.669 -17.324 61 HZ PHE 9 HZ PHE 9 -11.076 30.447 -18.529 62 H ASP 10 HN ASP 10 -6.096 23.674 -17.348 63 HA ASP 10 HA ASP 10 -4.825 23.631 -14.687 64 HB2 ASP 10 HB2 ASP 10 -4.975 21.287 -14.607 65 HB3 ASP 10 HB1 ASP 10 -6.533 21.798 -15.249 66 H ASP 11 HN ASP 11 -4.275 23.939 -17.976 67 HA ASP 11 HA ASP 11 -1.601 22.733 -17.827 68 HB2 ASP 11 HB2 ASP 11 -3.045 21.959 -19.669 69 HB3 ASP 11 HB1 ASP 11 -3.183 23.616 -20.250 70 H ASP 12 HN ASP 12 0.212 23.880 -18.246 71 HA ASP 12 HA ASP 12 0.021 26.708 -18.970 72 HB2 ASP 12 HB2 ASP 12 0.095 26.523 -16.450 73 HB3 ASP 12 HB1 ASP 12 1.654 25.725 -16.607 74 H ASN 13 HN ASN 13 2.063 27.500 -19.854 75 HA ASN 13 HA ASN 13 3.429 25.639 -21.453 76 HB2 ASN 13 HB2 ASN 13 4.193 28.449 -20.625 77 HB3 ASN 13 HB1 ASN 13 5.083 27.508 -21.818 78 HD21 ASN 13 HD21 ASN 13 4.210 27.171 -23.835 79 HD22 ASN 13 HD22 ASN 13 2.809 28.010 -24.399 80 H GLY 14 HN GLY 14 4.080 26.963 -18.294 81 HA2 GLY 14 HA2 GLY 14 5.420 26.223 -16.599 82 HA3 GLY 14 HA1 GLY 14 5.582 24.732 -17.482 83 H ALA 15 HN ALA 15 6.848 27.914 -17.071 84 HA ALA 15 HA ALA 15 9.202 27.622 -18.613 85 HB1 ALA 15 HB1 ALA 15 10.074 29.505 -17.321 86 HB2 ALA 15 HB2 ALA 15 8.746 29.339 -16.170 87 HB3 ALA 15 HB3 ALA 15 8.414 29.805 -17.838 88 H PHE 16 HN PHE 16 10.704 26.142 -18.304 89 HA PHE 16 HA PHE 16 10.844 24.779 -15.725 90 HB2 PHE 16 HB2 PHE 16 12.279 23.179 -17.284 91 HB3 PHE 16 HB1 PHE 16 10.519 23.151 -17.316 92 HD1 PHE 16 HD1 PHE 16 13.365 24.921 -18.941 93 HD2 PHE 16 HD2 PHE 16 9.470 23.278 -19.354 94 HE1 PHE 16 HE1 PHE 16 13.385 25.488 -21.325 95 HE2 PHE 16 HE2 PHE 16 9.481 23.835 -21.751 96 HZ PHE 16 HZ PHE 16 11.442 24.950 -22.740 97 H PHE 17 HN PHE 17 12.691 24.488 -14.579 98 HA PHE 17 HA PHE 17 15.125 25.853 -15.534 99 HB2 PHE 17 HB2 PHE 17 13.901 25.538 -12.825 100 HB3 PHE 17 HB1 PHE 17 15.655 25.510 -12.925 101 HD1 PHE 17 HD2 PHE 17 13.119 27.568 -14.736 102 HD2 PHE 17 HD1 PHE 17 16.442 27.484 -12.083 103 HE1 PHE 17 HE2 PHE 17 13.168 30.028 -14.724 104 HE2 PHE 17 HE1 PHE 17 16.498 29.941 -12.068 105 HZ PHE 17 HZ PHE 17 14.861 31.218 -13.392 106 H VAL 18 HN VAL 18 17.150 24.768 -15.115 107 HA VAL 18 HA VAL 18 16.933 21.884 -15.267 108 HB VAL 18 HB VAL 18 19.447 23.564 -15.135 109 HG11 VAL 18 HG11 VAL 18 19.789 21.221 -14.556 110 HG12 VAL 18 HG12 VAL 18 20.522 21.595 -16.117 111 HG13 VAL 18 HG13 VAL 18 18.989 20.726 -16.046 112 HG21 VAL 18 HG21 VAL 18 18.060 24.190 -17.053 113 HG22 VAL 18 HG22 VAL 18 17.993 22.501 -17.552 114 HG23 VAL 18 HG23 VAL 18 19.531 23.361 -17.560 115 H LEU 19 HN LEU 19 16.326 21.047 -13.358 116 HA LEU 19 HA LEU 19 17.703 21.954 -10.928 117 HB2 LEU 19 HB2 LEU 19 15.176 22.101 -11.126 118 HB3 LEU 19 HB1 LEU 19 15.155 20.348 -11.121 119 HG LEU 19 HG LEU 19 16.291 20.432 -8.877 120 HD11 LEU 19 HD11 LEU 19 15.661 23.356 -9.168 121 HD12 LEU 19 HD12 LEU 19 17.248 22.619 -8.944 122 HD13 LEU 19 HD13 LEU 19 16.058 22.569 -7.644 123 HD21 LEU 19 HD21 LEU 19 13.905 20.009 -9.079 124 HD22 LEU 19 HD22 LEU 19 13.589 21.743 -9.116 125 HD23 LEU 19 HD23 LEU 19 14.246 20.999 -7.660 126 H VAL 20 HN VAL 20 19.115 20.644 -10.007 127 HA VAL 20 HA VAL 20 18.974 17.773 -10.621 128 HB VAL 20 HB VAL 20 21.307 19.420 -9.606 129 HG11 VAL 20 HG11 VAL 20 21.358 17.184 -8.628 130 HG12 VAL 20 HG12 VAL 20 22.636 17.374 -9.827 131 HG13 VAL 20 HG13 VAL 20 21.178 16.470 -10.231 132 HG21 VAL 20 HG21 VAL 20 22.335 18.870 -11.750 133 HG22 VAL 20 HG22 VAL 20 20.817 19.740 -11.979 134 HG23 VAL 20 HG23 VAL 20 20.882 17.994 -12.228 135 H ASN 21 HN ASN 21 18.749 16.328 -8.997 136 HA ASN 21 HA ASN 21 18.057 17.434 -6.379 137 HB2 ASN 21 HB2 ASN 21 17.515 14.727 -7.616 138 HB3 ASN 21 HB1 ASN 21 17.107 15.141 -5.956 139 HD21 ASN 21 HD21 ASN 21 16.355 15.655 -9.315 140 HD22 ASN 21 HD22 ASN 21 14.832 16.433 -9.051 141 H ASP 22 HN ASP 22 18.522 15.354 -4.681 142 HA ASP 22 HA ASP 22 21.370 15.607 -4.369 143 HB2 ASP 22 HB2 ASP 22 19.786 15.701 -2.451 144 HB3 ASP 22 HB1 ASP 22 19.391 14.008 -2.726 145 H GLU 23 HN GLU 23 19.075 13.028 -5.028 146 HA GLU 23 HA GLU 23 21.319 11.243 -5.699 147 HB2 GLU 23 HB2 GLU 23 18.548 10.672 -4.660 148 HB3 GLU 23 HB1 GLU 23 19.577 9.420 -5.344 149 HG2 GLU 23 HG2 GLU 23 20.481 11.164 -3.085 150 HG3 GLU 23 HG1 GLU 23 19.566 9.682 -2.823 151 H ASP 24 HN ASP 24 19.734 13.277 -7.355 152 HA ASP 24 HA ASP 24 18.907 11.421 -9.491 153 HB2 ASP 24 HB2 ASP 24 16.905 12.433 -8.795 154 HB3 ASP 24 HB1 ASP 24 17.665 14.005 -8.582 155 H GLN 25 HN GLN 25 19.417 12.003 -11.627 156 HA GLN 25 HA GLN 25 21.945 13.355 -11.808 157 HB2 GLN 25 HB2 GLN 25 20.254 12.243 -14.048 158 HB3 GLN 25 HB1 GLN 25 21.970 12.618 -14.107 159 HG2 GLN 25 HG2 GLN 25 22.450 10.831 -12.556 160 HG3 GLN 25 HG1 GLN 25 20.728 10.495 -12.373 161 HE21 GLN 25 HE21 GLN 25 22.824 8.708 -13.276 162 HE22 GLN 25 HE22 GLN 25 22.387 8.206 -14.869 163 H HIS 26 HN HIS 26 18.691 13.888 -13.166 164 HA HIS 26 HA HIS 26 19.060 16.709 -13.312 165 HB2 HIS 26 HB2 HIS 26 19.059 16.994 -15.724 166 HB3 HIS 26 HB1 HIS 26 20.450 16.035 -15.242 167 HD1 HIS 26 HD1 HIS 26 19.231 13.215 -15.196 168 HD2 HIS 26 HD2 HIS 26 18.436 16.017 -18.161 169 HE1 HIS 26 HE1 HIS 26 18.544 11.885 -17.211 170 HE2 HIS 26 HE2 HIS 26 17.913 13.607 -18.938 171 H SER 27 HN SER 27 17.143 17.686 -13.268 172 HA SER 27 HA SER 27 14.825 16.366 -14.474 173 HB2 SER 27 HB2 SER 27 14.884 17.520 -11.673 174 HB3 SER 27 HB1 SER 27 13.449 16.915 -12.498 175 HG SER 27 HG SER 27 15.749 15.444 -11.686 176 H LEU 28 HN LEU 28 13.837 17.763 -15.812 177 HA LEU 28 HA LEU 28 14.373 20.600 -15.580 178 HB2 LEU 28 HB2 LEU 28 13.003 18.865 -17.589 179 HB3 LEU 28 HB1 LEU 28 12.572 20.564 -17.537 180 HG LEU 28 HG LEU 28 14.321 20.077 -19.238 181 HD11 LEU 28 HD11 LEU 28 14.178 22.294 -18.246 182 HD12 LEU 28 HD12 LEU 28 15.854 21.863 -18.585 183 HD13 LEU 28 HD13 LEU 28 15.242 21.791 -16.933 184 HD21 LEU 28 HD21 LEU 28 16.578 19.511 -18.524 185 HD22 LEU 28 HD22 LEU 28 15.442 18.239 -18.070 186 HD23 LEU 28 HD23 LEU 28 16.032 19.372 -16.853 187 H TRP 29 HN TRP 29 13.388 21.610 -13.994 188 HA TRP 29 HA TRP 29 10.683 20.754 -13.215 189 HB2 TRP 29 HB2 TRP 29 12.495 20.424 -11.549 190 HB3 TRP 29 HB1 TRP 29 12.807 22.153 -11.568 191 HD1 TRP 29 HD1 TRP 29 11.395 23.626 -9.974 192 HE1 TRP 29 HE1 TRP 29 9.495 23.164 -8.293 193 HE3 TRP 29 HE3 TRP 29 10.348 18.789 -11.250 194 HZ2 TRP 29 HZ2 TRP 29 7.781 21.022 -7.605 195 HZ3 TRP 29 HZ3 TRP 29 8.564 17.604 -10.037 196 HH2 TRP 29 HH2 TRP 29 7.310 18.700 -8.253 197 HA PRO 30 HA PRO 30 9.510 24.786 -14.791 198 HB2 PRO 30 HB2 PRO 30 6.835 24.033 -13.846 199 HB3 PRO 30 HB1 PRO 30 7.389 24.377 -15.487 200 HG2 PRO 30 HG2 PRO 30 6.739 21.887 -14.698 201 HG3 PRO 30 HG1 PRO 30 8.031 22.197 -15.874 202 HD2 PRO 30 HD2 PRO 30 8.242 21.573 -12.946 203 HD3 PRO 30 HD1 PRO 30 9.221 20.968 -14.303 204 H VAL 31 HN VAL 31 9.263 26.735 -13.881 205 HA VAL 31 HA VAL 31 9.410 27.061 -11.062 206 HB VAL 31 HB VAL 31 9.221 29.481 -11.533 207 HG11 VAL 31 HG11 VAL 31 11.093 28.003 -13.386 208 HG12 VAL 31 HG12 VAL 31 11.399 28.396 -11.694 209 HG13 VAL 31 HG13 VAL 31 11.257 29.688 -12.888 210 HG21 VAL 31 HG21 VAL 31 7.615 29.388 -13.360 211 HG22 VAL 31 HG22 VAL 31 8.811 28.598 -14.389 212 HG23 VAL 31 HG23 VAL 31 9.067 30.258 -13.853 213 H PHE 32 HN PHE 32 6.827 26.183 -12.823 214 HA PHE 32 HA PHE 32 4.782 27.807 -11.650 215 HB2 PHE 32 HB2 PHE 32 4.577 26.608 -13.852 216 HB3 PHE 32 HB1 PHE 32 4.516 25.093 -12.961 217 HD1 PHE 32 HD1 PHE 32 2.780 28.354 -13.353 218 HD2 PHE 32 HD2 PHE 32 2.484 24.275 -12.164 219 HE1 PHE 32 HE1 PHE 32 0.347 28.602 -13.115 220 HE2 PHE 32 HE2 PHE 32 0.046 24.521 -11.924 221 HZ PHE 32 HZ PHE 32 -1.024 26.687 -12.400 222 H ALA 33 HN ALA 33 6.673 25.166 -10.653 223 HA ALA 33 HA ALA 33 4.822 24.596 -8.437 224 HB1 ALA 33 HB1 ALA 33 5.912 22.416 -8.246 225 HB2 ALA 33 HB2 ALA 33 6.973 22.827 -9.593 226 HB3 ALA 33 HB3 ALA 33 5.239 22.654 -9.858 227 H ASP 34 HN ASP 34 5.668 24.473 -6.340 228 HA ASP 34 HA ASP 34 7.719 26.331 -5.755 229 HB2 ASP 34 HB2 ASP 34 5.866 25.914 -4.203 230 HB3 ASP 34 HB1 ASP 34 6.426 24.264 -3.959 231 H ILE 35 HN ILE 35 9.802 26.066 -5.055 232 HA ILE 35 HA ILE 35 11.035 23.498 -5.705 233 HB ILE 35 HB ILE 35 12.329 26.169 -5.110 234 HG12 ILE 35 HG12 ILE 35 11.900 24.732 -7.741 235 HG13 ILE 35 HG11 ILE 35 11.009 26.151 -7.200 236 HG21 ILE 35 HG21 ILE 35 13.792 24.292 -4.563 237 HG22 ILE 35 HG22 ILE 35 14.375 25.154 -5.988 238 HG23 ILE 35 HG23 ILE 35 13.534 23.613 -6.172 239 HD11 ILE 35 HD11 ILE 35 13.087 27.447 -7.224 240 HD12 ILE 35 HD12 ILE 35 12.715 26.758 -8.804 241 HD13 ILE 35 HD13 ILE 35 13.957 26.023 -7.792 242 HA PRO 36 HA PRO 36 11.287 22.623 -1.296 243 HB2 PRO 36 HB2 PRO 36 12.424 20.184 -1.599 244 HB3 PRO 36 HB1 PRO 36 10.699 20.463 -1.856 245 HG2 PRO 36 HG2 PRO 36 12.910 20.249 -3.860 246 HG3 PRO 36 HG1 PRO 36 11.278 19.558 -3.920 247 HD2 PRO 36 HD2 PRO 36 11.971 21.808 -5.260 248 HD3 PRO 36 HD1 PRO 36 10.336 21.530 -4.633 249 H ALA 37 HN ALA 37 13.364 21.048 -0.320 250 HA ALA 37 HA ALA 37 15.748 22.667 -0.896 251 HB1 ALA 37 HB1 ALA 37 15.094 22.669 1.443 252 HB2 ALA 37 HB2 ALA 37 16.618 21.806 1.246 253 HB3 ALA 37 HB3 ALA 37 15.118 20.906 1.473 254 H GLY 38 HN GLY 38 17.850 21.232 -0.465 255 HA2 GLY 38 HA2 GLY 38 19.150 19.448 -1.171 256 HA3 GLY 38 HA1 GLY 38 17.671 18.519 -1.396 257 H TRP 39 HN TRP 39 18.274 21.641 -2.819 258 HA TRP 39 HA TRP 39 17.901 20.408 -5.455 259 HB2 TRP 39 HB2 TRP 39 17.123 22.685 -6.136 260 HB3 TRP 39 HB1 TRP 39 16.118 21.921 -4.910 261 HD1 TRP 39 HD1 TRP 39 16.101 23.002 -2.481 262 HE1 TRP 39 HE1 TRP 39 16.812 25.321 -1.609 263 HE3 TRP 39 HE3 TRP 39 18.858 24.576 -6.487 264 HZ2 TRP 39 HZ2 TRP 39 18.337 27.521 -2.500 265 HZ3 TRP 39 HZ3 TRP 39 19.905 26.800 -6.400 266 HH2 TRP 39 HH2 TRP 39 19.649 28.243 -4.447 267 H ARG 40 HN ARG 40 19.027 21.227 -7.243 268 HA ARG 40 HA ARG 40 21.241 23.070 -6.748 269 HB2 ARG 40 HB2 ARG 40 22.011 20.633 -6.619 270 HB3 ARG 40 HB1 ARG 40 21.612 20.518 -8.325 271 HG2 ARG 40 HG2 ARG 40 23.964 20.916 -8.081 272 HG3 ARG 40 HG1 ARG 40 23.205 22.347 -8.788 273 HD2 ARG 40 HD2 ARG 40 23.137 23.375 -6.548 274 HD3 ARG 40 HD1 ARG 40 23.970 21.967 -5.893 275 HE ARG 40 HE ARG 40 25.747 22.658 -7.661 276 HH11 ARG 40 HH11 ARG 40 23.764 24.789 -5.694 277 HH12 ARG 40 HH12 ARG 40 24.939 26.077 -5.681 278 HH21 ARG 40 HH21 ARG 40 27.291 24.343 -7.628 279 HH22 ARG 40 HH22 ARG 40 26.957 25.817 -6.774 280 H VAL 41 HN VAL 41 20.881 24.704 -8.159 281 HA VAL 41 HA VAL 41 19.394 24.123 -10.608 282 HB VAL 41 HB VAL 41 20.220 26.790 -9.452 283 HG11 VAL 41 HG11 VAL 41 19.992 26.886 -11.876 284 HG12 VAL 41 HG12 VAL 41 18.673 27.751 -11.089 285 HG13 VAL 41 HG13 VAL 41 18.395 26.148 -11.763 286 HG21 VAL 41 HG21 VAL 41 18.566 25.635 -8.075 287 HG22 VAL 41 HG22 VAL 41 17.534 25.421 -9.488 288 HG23 VAL 41 HG23 VAL 41 17.861 27.040 -8.871 289 H VAL 42 HN VAL 42 20.492 23.608 -12.351 290 HA VAL 42 HA VAL 42 23.292 24.367 -12.596 291 HB VAL 42 HB VAL 42 21.598 22.653 -14.425 292 HG11 VAL 42 HG11 VAL 42 23.733 21.853 -15.307 293 HG12 VAL 42 HG12 VAL 42 24.590 22.989 -14.264 294 HG13 VAL 42 HG13 VAL 42 23.542 23.590 -15.550 295 HG21 VAL 42 HG21 VAL 42 23.542 21.826 -12.272 296 HG22 VAL 42 HG22 VAL 42 22.654 20.747 -13.348 297 HG23 VAL 42 HG23 VAL 42 21.785 21.721 -12.163 298 H HIS 43 HN HIS 43 20.193 25.047 -14.113 299 HA HIS 43 HA HIS 43 21.267 27.399 -15.375 300 HB2 HIS 43 HB2 HIS 43 21.817 25.440 -16.935 301 HB3 HIS 43 HB1 HIS 43 20.085 25.307 -17.205 302 HD1 HIS 43 HD1 HIS 43 18.953 27.187 -18.607 303 HD2 HIS 43 HD2 HIS 43 23.072 27.597 -18.175 304 HE1 HIS 43 HE1 HIS 43 19.649 28.917 -20.300 305 HE2 HIS 43 HE2 HIS 43 22.135 29.198 -19.979 306 H GLY 44 HN GLY 44 19.647 28.829 -16.061 307 HA2 GLY 44 HA2 GLY 44 17.100 28.455 -14.773 308 HA3 GLY 44 HA1 GLY 44 17.622 29.870 -15.672 309 H GLU 45 HN GLU 45 15.357 29.791 -16.389 310 HA GLU 45 HA GLU 45 14.450 27.631 -17.974 311 HB2 GLU 45 HB2 GLU 45 12.675 29.393 -18.693 312 HB3 GLU 45 HB1 GLU 45 12.685 28.778 -17.049 313 HG2 GLU 45 HG2 GLU 45 13.710 30.767 -16.229 314 HG3 GLU 45 HG1 GLU 45 13.992 31.356 -17.858 315 H ALA 46 HN ALA 46 15.740 27.159 -19.583 316 HA ALA 46 HA ALA 46 15.533 28.908 -21.926 317 HB1 ALA 46 HB1 ALA 46 18.024 27.374 -21.167 318 HB2 ALA 46 HB2 ALA 46 17.832 29.122 -21.061 319 HB3 ALA 46 HB3 ALA 46 17.794 28.325 -22.633 320 H SER 47 HN SER 47 15.974 27.516 -23.967 321 HA SER 47 HA SER 47 13.999 25.765 -24.382 322 HB2 SER 47 HB2 SER 47 16.759 25.449 -25.583 323 HB3 SER 47 HB1 SER 47 15.239 24.907 -26.296 324 HG SER 47 HG SER 47 14.694 27.315 -25.980 325 H ARG 48 HN ARG 48 13.419 23.724 -23.935 326 HA ARG 48 HA ARG 48 14.655 22.520 -21.689 327 HB2 ARG 48 HB2 ARG 48 12.157 22.542 -22.450 328 HB3 ARG 48 HB1 ARG 48 12.608 21.127 -23.386 329 HG2 ARG 48 HG2 ARG 48 13.264 21.204 -20.482 330 HG3 ARG 48 HG1 ARG 48 11.604 20.884 -20.984 331 HD2 ARG 48 HD2 ARG 48 14.003 19.345 -21.967 332 HD3 ARG 48 HD1 ARG 48 12.997 18.842 -20.610 333 HE ARG 48 HE ARG 48 11.659 19.305 -23.163 334 HH11 ARG 48 HH11 ARG 48 12.978 17.008 -20.874 335 HH12 ARG 48 HH12 ARG 48 12.106 15.657 -21.519 336 HH21 ARG 48 HH21 ARG 48 10.455 17.541 -23.984 337 HH22 ARG 48 HH22 ARG 48 10.645 15.964 -23.271 338 H ALA 49 HN ALA 49 14.489 21.647 -25.119 339 HA ALA 49 HA ALA 49 15.827 19.174 -24.879 340 HB1 ALA 49 HB1 ALA 49 15.717 21.032 -27.254 341 HB2 ALA 49 HB2 ALA 49 14.536 19.784 -26.859 342 HB3 ALA 49 HB3 ALA 49 16.184 19.331 -27.289 343 H ALA 50 HN ALA 50 16.991 22.468 -25.328 344 HA ALA 50 HA ALA 50 19.716 21.821 -25.732 345 HB1 ALA 50 HB1 ALA 50 20.160 24.160 -25.244 346 HB2 ALA 50 HB2 ALA 50 18.527 24.355 -24.606 347 HB3 ALA 50 HB3 ALA 50 18.769 24.007 -26.317 348 H CYS 51 HN CYS 51 17.797 22.557 -22.848 349 HA CYS 51 HA CYS 51 19.883 22.476 -20.976 350 HB2 CYS 51 HB2 CYS 51 16.964 21.754 -20.657 351 HB3 CYS 51 HB1 CYS 51 18.090 21.989 -19.326 352 HG CYS 51 HG CYS 51 16.628 24.286 -21.328 353 H LEU 52 HN LEU 52 17.634 19.895 -22.006 354 HA LEU 52 HA LEU 52 18.761 17.752 -20.656 355 HB2 LEU 52 HB2 LEU 52 17.616 17.830 -23.446 356 HB3 LEU 52 HB1 LEU 52 17.965 16.354 -22.568 357 HG LEU 52 HG LEU 52 15.952 18.444 -21.737 358 HD11 LEU 52 HD11 LEU 52 15.249 17.262 -23.732 359 HD12 LEU 52 HD12 LEU 52 14.303 16.726 -22.344 360 HD13 LEU 52 HD13 LEU 52 15.604 15.713 -22.966 361 HD21 LEU 52 HD21 LEU 52 15.266 16.816 -20.069 362 HD22 LEU 52 HD22 LEU 52 16.959 17.255 -19.842 363 HD23 LEU 52 HD23 LEU 52 16.539 15.714 -20.594 364 H ASP 53 HN ASP 53 19.607 18.980 -23.874 365 HA ASP 53 HA ASP 53 21.605 17.175 -24.531 366 HB2 ASP 53 HB2 ASP 53 20.714 18.726 -26.160 367 HB3 ASP 53 HB1 ASP 53 21.287 20.104 -25.230 368 H TYR 54 HN TYR 54 21.888 20.308 -22.912 369 HA TYR 54 HA TYR 54 24.641 20.354 -22.555 370 HB2 TYR 54 HB2 TYR 54 23.233 22.307 -22.175 371 HB3 TYR 54 HB1 TYR 54 22.467 21.519 -20.803 372 HD1 TYR 54 HD1 TYR 54 25.781 22.697 -22.018 373 HD2 TYR 54 HD2 TYR 54 23.306 21.860 -18.663 374 HE1 TYR 54 HE1 TYR 54 27.475 23.680 -20.530 375 HE2 TYR 54 HE2 TYR 54 24.988 22.836 -17.166 376 HH TYR 54 HH TYR 54 27.600 24.702 -18.316 377 H VAL 55 HN VAL 55 22.134 19.125 -20.320 378 HA VAL 55 HA VAL 55 24.101 18.440 -18.353 379 HB VAL 55 HB VAL 55 22.269 17.428 -17.086 380 HG11 VAL 55 HG11 VAL 55 21.562 20.093 -18.297 381 HG12 VAL 55 HG12 VAL 55 22.656 19.824 -16.939 382 HG13 VAL 55 HG13 VAL 55 20.937 19.450 -16.779 383 HG21 VAL 55 HG21 VAL 55 20.986 16.465 -18.930 384 HG22 VAL 55 HG22 VAL 55 20.549 18.083 -19.478 385 HG23 VAL 55 HG23 VAL 55 19.974 17.494 -17.919 386 H GLU 56 HN GLU 56 22.405 16.637 -20.864 387 HA GLU 56 HA GLU 56 23.184 14.073 -19.883 388 HB2 GLU 56 HB2 GLU 56 22.114 15.001 -22.540 389 HB3 GLU 56 HB1 GLU 56 22.502 13.318 -22.208 390 HG2 GLU 56 HG2 GLU 56 20.885 13.302 -20.377 391 HG3 GLU 56 HG1 GLU 56 20.508 14.991 -20.695 392 H LYS 57 HN LYS 57 24.571 16.365 -22.170 393 HA LYS 57 HA LYS 57 26.652 14.537 -22.957 394 HB2 LYS 57 HB2 LYS 57 26.076 17.424 -23.501 395 HB3 LYS 57 HB1 LYS 57 27.639 16.736 -23.926 396 HG2 LYS 57 HG2 LYS 57 26.761 15.382 -25.554 397 HG3 LYS 57 HG1 LYS 57 25.162 15.337 -24.807 398 HD2 LYS 57 HD2 LYS 57 25.295 16.652 -26.931 399 HD3 LYS 57 HD1 LYS 57 24.675 17.548 -25.546 400 HE2 LYS 57 HE2 LYS 57 26.981 18.456 -25.212 401 HE3 LYS 57 HE1 LYS 57 27.438 17.697 -26.737 402 HZ1 LYS 57 HZ1 LYS 57 25.989 19.081 -27.933 403 HZ2 LYS 57 HZ2 LYS 57 26.757 20.114 -26.826 404 HZ3 LYS 57 HZ3 LYS 57 25.169 19.589 -26.535 405 H ASN 58 HN ASN 58 26.182 16.701 -20.335 406 HA ASN 58 HA ASN 58 29.009 16.828 -19.693 407 HB2 ASN 58 HB2 ASN 58 26.528 17.972 -18.524 408 HB3 ASN 58 HB1 ASN 58 27.868 17.680 -17.419 409 HD21 ASN 58 HD21 ASN 58 26.757 19.509 -20.167 410 HD22 ASN 58 HD22 ASN 58 28.028 20.687 -20.134 411 H TRP 59 HN TRP 59 26.285 14.838 -19.017 412 HA TRP 59 HA TRP 59 27.362 13.460 -16.772 413 HB2 TRP 59 HB2 TRP 59 24.981 13.382 -17.203 414 HB3 TRP 59 HB1 TRP 59 25.251 12.690 -18.797 415 HD1 TRP 59 HD1 TRP 59 25.977 11.680 -15.107 416 HE1 TRP 59 HE1 TRP 59 25.622 9.139 -14.911 417 HE3 TRP 59 HE3 TRP 59 24.851 10.633 -19.984 418 HZ2 TRP 59 HZ2 TRP 59 24.956 6.978 -16.593 419 HZ3 TRP 59 HZ3 TRP 59 24.370 8.304 -20.606 420 HH2 TRP 59 HH2 TRP 59 24.422 6.515 -18.945 421 H THR 60 HN THR 60 29.161 12.304 -16.840 422 HA THR 60 HA THR 60 30.190 11.329 -19.348 423 HB THR 60 HB THR 60 31.684 12.388 -17.703 424 HG1 THR 60 HG1 THR 60 33.069 10.219 -17.584 425 HG21 THR 60 HG21 THR 60 31.100 9.960 -16.005 426 HG22 THR 60 HG22 THR 60 30.672 11.631 -15.632 427 HG23 THR 60 HG23 THR 60 32.369 11.147 -15.686 428 H ASP 61 HN ASP 61 30.370 9.232 -19.987 429 HA ASP 61 HA ASP 61 28.537 7.394 -18.691 430 HB2 ASP 61 HB2 ASP 61 28.569 7.735 -21.182 431 HB3 ASP 61 HB1 ASP 61 30.144 6.954 -21.217 432 H LEU 62 HN LEU 62 29.668 6.896 -16.812 433 HA LEU 62 HA LEU 62 31.873 4.993 -17.248 434 HB2 LEU 62 HB2 LEU 62 31.398 6.966 -15.068 435 HB3 LEU 62 HB1 LEU 62 32.133 5.437 -14.636 436 HG LEU 62 HG LEU 62 33.886 7.005 -14.962 437 HD11 LEU 62 HD11 LEU 62 35.154 5.992 -16.785 438 HD12 LEU 62 HD12 LEU 62 33.679 5.243 -17.399 439 HD13 LEU 62 HD13 LEU 62 34.319 4.773 -15.824 440 HD21 LEU 62 HD21 LEU 62 32.664 8.661 -16.258 441 HD22 LEU 62 HD22 LEU 62 32.687 7.592 -17.660 442 HD23 LEU 62 HD23 LEU 62 34.195 8.253 -17.030 443 H ARG 63 HN ARG 63 28.968 5.694 -15.386 444 HA ARG 63 HA ARG 63 28.834 3.075 -14.220 445 HB2 ARG 63 HB2 ARG 63 27.859 5.250 -13.270 446 HB3 ARG 63 HB1 ARG 63 26.571 5.060 -14.452 447 HG2 ARG 63 HG2 ARG 63 26.028 2.868 -13.461 448 HG3 ARG 63 HG1 ARG 63 27.265 3.150 -12.233 449 HD2 ARG 63 HD2 ARG 63 26.022 5.311 -11.716 450 HD3 ARG 63 HD1 ARG 63 24.707 4.656 -12.688 451 HE ARG 63 HE ARG 63 25.565 2.810 -10.684 452 HH11 ARG 63 HH11 ARG 63 23.527 5.582 -11.311 453 HH12 ARG 63 HH12 ARG 63 22.587 5.390 -9.859 454 HH21 ARG 63 HH21 ARG 63 24.318 2.532 -8.781 455 HH22 ARG 63 HH22 ARG 63 23.030 3.644 -8.429 456 HA PRO 64 HA PRO 64 27.160 1.126 -17.857 457 HB2 PRO 64 HB2 PRO 64 26.115 -1.080 -16.575 458 HB3 PRO 64 HB1 PRO 64 27.801 -0.917 -17.081 459 HG2 PRO 64 HG2 PRO 64 26.575 -0.491 -14.390 460 HG3 PRO 64 HG1 PRO 64 28.127 -1.237 -14.813 461 HD2 PRO 64 HD2 PRO 64 27.966 1.281 -13.866 462 HD3 PRO 64 HD1 PRO 64 29.182 0.807 -15.071 463 H LYS 65 HN LYS 65 25.464 2.286 -18.573 464 HA LYS 65 HA LYS 65 23.011 2.515 -17.091 465 HB2 LYS 65 HB2 LYS 65 22.264 3.489 -19.444 466 HB3 LYS 65 HB1 LYS 65 23.274 4.415 -18.345 467 HG2 LYS 65 HG2 LYS 65 24.317 4.700 -20.389 468 HG3 LYS 65 HG1 LYS 65 25.252 3.408 -19.641 469 HD2 LYS 65 HD2 LYS 65 23.805 1.779 -20.909 470 HD3 LYS 65 HD1 LYS 65 23.155 3.164 -21.790 471 HE2 LYS 65 HE2 LYS 65 26.014 2.214 -21.718 472 HE3 LYS 65 HE1 LYS 65 24.916 2.185 -23.094 473 HZ1 LYS 65 HZ1 LYS 65 25.988 4.624 -21.766 474 HZ2 LYS 65 HZ2 LYS 65 24.898 4.615 -23.071 475 HZ3 LYS 65 HZ3 LYS 65 26.467 4.006 -23.271 476 H SER 66 HN SER 66 20.982 1.669 -17.684 477 HA SER 66 HA SER 66 21.271 -1.004 -18.850 478 HB2 SER 66 HB2 SER 66 20.385 -0.624 -16.482 479 HB3 SER 66 HB1 SER 66 18.938 0.042 -17.237 480 HG SER 66 HG SER 66 19.882 -2.586 -17.169 481 H LEU 67 HN LEU 67 19.691 -1.812 -20.310 482 HA LEU 67 HA LEU 67 18.508 0.299 -21.964 483 HB2 LEU 67 HB2 LEU 67 20.098 -1.174 -23.086 484 HB3 LEU 67 HB1 LEU 67 19.161 -2.578 -22.610 485 HG LEU 67 HG LEU 67 17.274 -1.733 -24.000 486 HD11 LEU 67 HD11 LEU 67 19.297 0.311 -24.899 487 HD12 LEU 67 HD12 LEU 67 17.826 0.632 -23.983 488 HD13 LEU 67 HD13 LEU 67 17.721 0.027 -25.636 489 HD21 LEU 67 HD21 LEU 67 19.896 -2.139 -25.429 490 HD22 LEU 67 HD22 LEU 67 18.296 -2.299 -26.153 491 HD23 LEU 67 HD23 LEU 67 18.801 -3.404 -24.876 492 H ARG 68 HN ARG 68 16.440 0.675 -21.520 493 HA ARG 68 HA ARG 68 14.670 -1.652 -21.208 494 HB2 ARG 68 HB2 ARG 68 14.687 0.949 -19.730 495 HB3 ARG 68 HB1 ARG 68 13.166 0.103 -19.977 496 HG2 ARG 68 HG2 ARG 68 15.603 -1.025 -18.619 497 HG3 ARG 68 HG1 ARG 68 14.149 -0.424 -17.818 498 HD2 ARG 68 HD2 ARG 68 12.837 -2.124 -19.102 499 HD3 ARG 68 HD1 ARG 68 14.368 -2.796 -19.665 500 HE ARG 68 HE ARG 68 14.434 -2.642 -16.869 501 HH11 ARG 68 HH11 ARG 68 12.807 -4.425 -19.411 502 HH12 ARG 68 HH12 ARG 68 12.480 -5.809 -18.407 503 HH21 ARG 68 HH21 ARG 68 14.040 -4.450 -15.558 504 HH22 ARG 68 HH22 ARG 68 13.179 -5.824 -16.204 505 H ASP 69 HN ASP 69 13.931 -1.846 -23.241 506 HA ASP 69 HA ASP 69 12.576 0.498 -24.411 507 HB2 ASP 69 HB2 ASP 69 14.276 -0.216 -25.925 508 HB3 ASP 69 HB1 ASP 69 13.847 -1.911 -25.718 509 H ALA 70 HN ALA 70 10.431 0.353 -24.914 510 HA ALA 70 HA ALA 70 9.126 -2.247 -24.433 511 HB1 ALA 70 HB1 ALA 70 8.891 -0.858 -22.437 512 HB2 ALA 70 HB2 ALA 70 7.334 -1.120 -23.220 513 HB3 ALA 70 HB3 ALA 70 8.166 0.423 -23.408 514 H MET 71 HN MET 71 9.842 -0.452 -26.845 515 HA MET 71 HA MET 71 7.127 -0.457 -27.987 516 HB2 MET 71 HB2 MET 71 7.919 1.848 -27.648 517 HB3 MET 71 HB1 MET 71 9.341 1.502 -28.624 518 HG2 MET 71 HG2 MET 71 7.672 2.722 -29.894 519 HG3 MET 71 HG1 MET 71 7.937 1.115 -30.568 520 HE1 MET 71 HE1 MET 71 5.534 3.412 -28.491 521 HE2 MET 71 HE2 MET 71 5.855 2.098 -27.358 522 HE3 MET 71 HE3 MET 71 4.245 2.291 -28.053 523 H VAL 72 HN VAL 72 7.434 -2.537 -28.785 524 HA VAL 72 HA VAL 72 9.375 -2.758 -30.990 525 HB VAL 72 HB VAL 72 8.025 -5.009 -29.481 526 HG11 VAL 72 HG11 VAL 72 10.213 -5.031 -31.555 527 HG12 VAL 72 HG12 VAL 72 8.564 -5.616 -31.765 528 HG13 VAL 72 HG13 VAL 72 9.655 -6.438 -30.648 529 HG21 VAL 72 HG21 VAL 72 10.856 -3.991 -29.287 530 HG22 VAL 72 HG22 VAL 72 10.228 -5.437 -28.499 531 HG23 VAL 72 HG23 VAL 72 9.610 -3.849 -28.046 532 H GLU 73 HN GLU 73 8.388 -2.310 -32.851 533 HA GLU 73 HA GLU 73 5.644 -3.327 -33.239 534 HB2 GLU 73 HB2 GLU 73 5.286 -1.430 -34.789 535 HB3 GLU 73 HB1 GLU 73 5.624 -0.900 -33.147 536 HG2 GLU 73 HG2 GLU 73 7.955 -0.460 -33.791 537 HG3 GLU 73 HG1 GLU 73 7.570 -0.937 -35.443 538 H ASP 74 HN ASP 74 5.120 -3.619 -35.623 539 HA ASP 74 HA ASP 74 7.334 -5.079 -36.823 540 HB2 ASP 74 HB2 ASP 74 5.677 -6.126 -38.266 541 HB3 ASP 74 HB1 ASP 74 5.183 -6.249 -36.584 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 -4.908 19.043 1.878 2 H2 GLY 1 HT2 GLY 1 -6.256 19.758 2.621 3 H3 GLY 1 HT3 GLY 1 -5.658 20.387 1.166 4 HA2 GLY 1 HA1 GLY 1 -6.884 17.713 1.517 5 HA3 GLY 1 HA2 GLY 1 -7.662 19.111 0.784 6 H SER 2 HN SER 2 -7.738 17.157 -0.845 7 HA SER 2 HA SER 2 -5.348 16.702 -2.357 8 HB2 SER 2 HB2 SER 2 -8.221 16.098 -3.098 9 HB3 SER 2 HB1 SER 2 -6.776 15.385 -3.817 10 HG SER 2 HG SER 2 -6.302 14.438 -1.810 11 H HIS 3 HN HIS 3 -4.488 18.205 -3.635 12 HA HIS 3 HA HIS 3 -5.991 20.383 -4.730 13 HB2 HIS 3 HB2 HIS 3 -3.236 19.389 -5.508 14 HB3 HIS 3 HB1 HIS 3 -3.930 20.944 -5.946 15 HD1 HIS 3 HD1 HIS 3 -1.308 20.160 -4.138 16 HD2 HIS 3 HD2 HIS 3 -4.920 21.817 -2.890 17 HE1 HIS 3 HE1 HIS 3 -0.797 21.367 -1.986 18 HE2 HIS 3 HE2 HIS 3 -3.009 22.275 -1.194 19 H MET 4 HN MET 4 -6.969 20.551 -6.685 20 HA MET 4 HA MET 4 -6.673 18.257 -8.506 21 HB2 MET 4 HB2 MET 4 -9.023 18.313 -9.002 22 HB3 MET 4 HB1 MET 4 -8.824 18.194 -7.261 23 HG2 MET 4 HG2 MET 4 -9.304 20.552 -7.012 24 HG3 MET 4 HG1 MET 4 -9.424 20.735 -8.761 25 HE1 MET 4 HE1 MET 4 -11.811 21.794 -8.752 26 HE2 MET 4 HE2 MET 4 -11.698 21.829 -6.993 27 HE3 MET 4 HE3 MET 4 -13.144 21.186 -7.771 28 H SER 5 HN SER 5 -6.633 18.664 -10.658 29 HA SER 5 HA SER 5 -7.274 21.326 -11.640 30 HB2 SER 5 HB2 SER 5 -4.598 20.006 -12.186 31 HB3 SER 5 HB1 SER 5 -5.169 21.517 -12.894 32 HG SER 5 HG SER 5 -5.406 21.718 -10.259 33 H THR 6 HN THR 6 -9.069 20.165 -12.481 34 HA THR 6 HA THR 6 -8.676 17.885 -14.173 35 HB THR 6 HB THR 6 -11.195 19.543 -14.064 36 HG1 THR 6 HG1 THR 6 -10.965 19.199 -11.943 37 HG21 THR 6 HG21 THR 6 -12.271 17.365 -14.396 38 HG22 THR 6 HG22 THR 6 -10.691 16.576 -14.381 39 HG23 THR 6 HG23 THR 6 -11.110 17.698 -15.680 40 H ASN 7 HN ASN 7 -7.537 18.303 -15.987 41 HA ASN 7 HA ASN 7 -8.392 20.577 -17.650 42 HB2 ASN 7 HB2 ASN 7 -5.728 19.183 -17.424 43 HB3 ASN 7 HB1 ASN 7 -6.116 20.281 -18.744 44 HD21 ASN 7 HD21 ASN 7 -4.078 20.475 -16.661 45 HD22 ASN 7 HD22 ASN 7 -4.370 21.973 -15.851 46 HA PRO 8 HA PRO 8 -9.651 17.154 -20.357 47 HB2 PRO 8 HB2 PRO 8 -11.588 19.020 -21.414 48 HB3 PRO 8 HB1 PRO 8 -11.875 17.534 -20.508 49 HG2 PRO 8 HG2 PRO 8 -12.409 20.035 -19.533 50 HG3 PRO 8 HG1 PRO 8 -12.037 18.637 -18.508 51 HD2 PRO 8 HD2 PRO 8 -10.256 20.885 -19.374 52 HD3 PRO 8 HD1 PRO 8 -10.366 20.073 -17.795 53 H PHE 9 HN PHE 9 -8.293 20.156 -20.668 54 HA PHE 9 HA PHE 9 -7.643 19.699 -23.487 55 HB2 PHE 9 HB2 PHE 9 -7.733 22.130 -23.894 56 HB3 PHE 9 HB1 PHE 9 -9.307 21.505 -23.414 57 HD1 PHE 9 HD2 PHE 9 -10.245 22.046 -21.225 58 HD2 PHE 9 HD1 PHE 9 -6.513 23.653 -22.489 59 HE1 PHE 9 HE2 PHE 9 -10.358 23.720 -19.425 60 HE2 PHE 9 HE1 PHE 9 -6.623 25.329 -20.693 61 HZ PHE 9 HZ PHE 9 -8.546 25.362 -19.155 62 H ASP 10 HN ASP 10 -5.570 20.674 -24.101 63 HA ASP 10 HA ASP 10 -3.758 20.830 -21.801 64 HB2 ASP 10 HB2 ASP 10 -1.944 20.414 -23.386 65 HB3 ASP 10 HB1 ASP 10 -3.185 19.176 -23.540 66 H ASP 11 HN ASP 11 -2.508 22.599 -21.402 67 HA ASP 11 HA ASP 11 -3.142 24.999 -22.990 68 HB2 ASP 11 HB2 ASP 11 -3.873 24.799 -20.504 69 HB3 ASP 11 HB1 ASP 11 -2.172 25.059 -20.137 70 H ASP 12 HN ASP 12 -1.110 26.625 -21.791 71 HA ASP 12 HA ASP 12 1.176 25.600 -23.292 72 HB2 ASP 12 HB2 ASP 12 0.361 27.960 -23.590 73 HB3 ASP 12 HB1 ASP 12 0.879 28.292 -21.940 74 H ASN 13 HN ASN 13 3.307 25.550 -22.395 75 HA ASN 13 HA ASN 13 3.218 24.533 -19.669 76 HB2 ASN 13 HB2 ASN 13 5.387 24.426 -21.777 77 HB3 ASN 13 HB1 ASN 13 5.495 23.676 -20.187 78 HD21 ASN 13 HD21 ASN 13 4.383 21.799 -19.784 79 HD22 ASN 13 HD22 ASN 13 3.561 20.898 -21.012 80 H GLY 14 HN GLY 14 4.477 25.304 -17.995 81 HA2 GLY 14 HA2 GLY 14 5.203 28.093 -18.176 82 HA3 GLY 14 HA1 GLY 14 5.244 27.092 -16.732 83 H ALA 15 HN ALA 15 7.288 28.678 -16.853 84 HA ALA 15 HA ALA 15 9.464 27.924 -18.473 85 HB1 ALA 15 HB1 ALA 15 10.830 29.269 -16.959 86 HB2 ALA 15 HB2 ALA 15 9.496 29.329 -15.803 87 HB3 ALA 15 HB3 ALA 15 9.333 30.104 -17.380 88 H PHE 16 HN PHE 16 11.310 26.748 -18.000 89 HA PHE 16 HA PHE 16 11.102 24.839 -15.777 90 HB2 PHE 16 HB2 PHE 16 12.276 23.273 -17.590 91 HB3 PHE 16 HB1 PHE 16 10.523 23.411 -17.501 92 HD1 PHE 16 HD1 PHE 16 13.337 25.280 -19.076 93 HD2 PHE 16 HD2 PHE 16 9.447 23.618 -19.522 94 HE1 PHE 16 HE1 PHE 16 13.266 26.072 -21.391 95 HE2 PHE 16 HE2 PHE 16 9.366 24.406 -21.842 96 HZ PHE 16 HZ PHE 16 11.279 25.640 -22.786 97 H PHE 17 HN PHE 17 13.058 24.188 -14.869 98 HA PHE 17 HA PHE 17 15.405 25.759 -15.729 99 HB2 PHE 17 HB2 PHE 17 14.339 25.127 -12.993 100 HB3 PHE 17 HB1 PHE 17 16.062 25.375 -13.210 101 HD1 PHE 17 HD2 PHE 17 13.349 27.210 -14.958 102 HD2 PHE 17 HD1 PHE 17 16.381 27.317 -11.977 103 HE1 PHE 17 HE2 PHE 17 13.046 29.644 -14.735 104 HE2 PHE 17 HE1 PHE 17 16.086 29.744 -11.753 105 HZ PHE 17 HZ PHE 17 14.419 30.914 -13.131 106 H VAL 18 HN VAL 18 17.489 24.795 -15.329 107 HA VAL 18 HA VAL 18 17.508 21.907 -15.653 108 HB VAL 18 HB VAL 18 19.845 23.821 -15.436 109 HG11 VAL 18 HG11 VAL 18 21.128 22.008 -16.491 110 HG12 VAL 18 HG12 VAL 18 19.707 20.967 -16.403 111 HG13 VAL 18 HG13 VAL 18 20.476 21.536 -14.922 112 HG21 VAL 18 HG21 VAL 18 19.978 23.651 -17.877 113 HG22 VAL 18 HG22 VAL 18 18.459 24.376 -17.352 114 HG23 VAL 18 HG23 VAL 18 18.497 22.696 -17.888 115 H LEU 19 HN LEU 19 17.086 20.811 -13.800 116 HA LEU 19 HA LEU 19 18.245 21.883 -11.311 117 HB2 LEU 19 HB2 LEU 19 15.695 21.806 -11.662 118 HB3 LEU 19 HB1 LEU 19 15.856 20.069 -11.493 119 HG LEU 19 HG LEU 19 16.936 20.519 -9.238 120 HD11 LEU 19 HD11 LEU 19 15.849 23.261 -9.815 121 HD12 LEU 19 HD12 LEU 19 17.528 22.821 -9.503 122 HD13 LEU 19 HD13 LEU 19 16.326 22.697 -8.219 123 HD21 LEU 19 HD21 LEU 19 14.805 20.806 -8.102 124 HD22 LEU 19 HD22 LEU 19 14.632 19.713 -9.474 125 HD23 LEU 19 HD23 LEU 19 14.068 21.378 -9.601 126 H VAL 20 HN VAL 20 19.708 20.642 -10.307 127 HA VAL 20 HA VAL 20 19.596 17.736 -10.816 128 HB VAL 20 HB VAL 20 22.064 19.418 -10.289 129 HG11 VAL 20 HG11 VAL 20 22.241 17.253 -9.197 130 HG12 VAL 20 HG12 VAL 20 23.320 17.329 -10.590 131 HG13 VAL 20 HG13 VAL 20 21.800 16.439 -10.698 132 HG21 VAL 20 HG21 VAL 20 22.740 18.728 -12.539 133 HG22 VAL 20 HG22 VAL 20 21.225 19.627 -12.574 134 HG23 VAL 20 HG23 VAL 20 21.212 17.872 -12.738 135 H ASN 21 HN ASN 21 19.348 16.504 -9.046 136 HA ASN 21 HA ASN 21 19.285 17.835 -6.458 137 HB2 ASN 21 HB2 ASN 21 18.456 15.059 -7.335 138 HB3 ASN 21 HB1 ASN 21 18.390 15.610 -5.663 139 HD21 ASN 21 HD21 ASN 21 16.968 15.835 -8.820 140 HD22 ASN 21 HD22 ASN 21 15.569 16.729 -8.345 141 H ASP 22 HN ASP 22 20.435 16.965 -4.632 142 HA ASP 22 HA ASP 22 23.149 16.532 -5.222 143 HB2 ASP 22 HB2 ASP 22 22.311 17.579 -3.130 144 HB3 ASP 22 HB1 ASP 22 21.725 16.002 -2.607 145 H GLU 23 HN GLU 23 20.513 14.361 -4.776 146 HA GLU 23 HA GLU 23 22.342 12.057 -4.857 147 HB2 GLU 23 HB2 GLU 23 19.536 12.291 -3.766 148 HB3 GLU 23 HB1 GLU 23 20.396 10.767 -3.937 149 HG2 GLU 23 HG2 GLU 23 21.349 13.083 -2.268 150 HG3 GLU 23 HG1 GLU 23 20.453 11.698 -1.649 151 H ASP 24 HN ASP 24 21.290 13.679 -7.151 152 HA ASP 24 HA ASP 24 20.129 11.434 -8.642 153 HB2 ASP 24 HB2 ASP 24 18.307 13.057 -7.922 154 HB3 ASP 24 HB1 ASP 24 19.085 14.260 -8.944 155 H GLN 25 HN GLN 25 20.336 11.736 -11.011 156 HA GLN 25 HA GLN 25 22.981 12.746 -11.589 157 HB2 GLN 25 HB2 GLN 25 21.012 11.400 -13.451 158 HB3 GLN 25 HB1 GLN 25 22.730 11.639 -13.737 159 HG2 GLN 25 HG2 GLN 25 21.567 9.959 -11.532 160 HG3 GLN 25 HG1 GLN 25 22.164 9.340 -13.069 161 HE21 GLN 25 HE21 GLN 25 24.350 9.219 -13.433 162 HE22 GLN 25 HE22 GLN 25 25.524 9.443 -12.180 163 H HIS 26 HN HIS 26 19.675 13.353 -12.796 164 HA HIS 26 HA HIS 26 20.221 16.086 -13.338 165 HB2 HIS 26 HB2 HIS 26 20.015 16.048 -15.793 166 HB3 HIS 26 HB1 HIS 26 21.452 15.206 -15.243 167 HD1 HIS 26 HD1 HIS 26 19.041 12.731 -14.652 168 HD2 HIS 26 HD2 HIS 26 20.625 14.367 -18.136 169 HE1 HIS 26 HE1 HIS 26 18.628 11.029 -16.455 170 HE2 HIS 26 HE2 HIS 26 19.460 12.105 -18.581 171 H SER 27 HN SER 27 18.343 17.274 -13.680 172 HA SER 27 HA SER 27 15.898 15.827 -14.319 173 HB2 SER 27 HB2 SER 27 16.165 17.486 -11.802 174 HB3 SER 27 HB1 SER 27 14.698 16.694 -12.374 175 HG SER 27 HG SER 27 16.597 14.853 -12.281 176 H LEU 28 HN LEU 28 14.236 17.102 -15.105 177 HA LEU 28 HA LEU 28 14.890 19.939 -15.591 178 HB2 LEU 28 HB2 LEU 28 13.994 17.856 -17.370 179 HB3 LEU 28 HB1 LEU 28 12.788 19.127 -17.302 180 HG LEU 28 HG LEU 28 14.372 19.443 -19.156 181 HD11 LEU 28 HD11 LEU 28 14.615 21.528 -16.990 182 HD12 LEU 28 HD12 LEU 28 13.300 21.389 -18.156 183 HD13 LEU 28 HD13 LEU 28 14.929 21.779 -18.708 184 HD21 LEU 28 HD21 LEU 28 16.438 19.700 -16.972 185 HD22 LEU 28 HD22 LEU 28 16.699 20.072 -18.677 186 HD23 LEU 28 HD23 LEU 28 16.342 18.416 -18.179 187 H TRP 29 HN TRP 29 13.755 21.220 -14.270 188 HA TRP 29 HA TRP 29 11.164 20.203 -13.305 189 HB2 TRP 29 HB2 TRP 29 12.961 20.139 -11.606 190 HB3 TRP 29 HB1 TRP 29 13.174 21.875 -11.788 191 HD1 TRP 29 HD1 TRP 29 11.799 23.350 -10.202 192 HE1 TRP 29 HE1 TRP 29 9.819 22.969 -8.595 193 HE3 TRP 29 HE3 TRP 29 10.690 18.504 -11.406 194 HZ2 TRP 29 HZ2 TRP 29 8.036 20.893 -7.928 195 HZ3 TRP 29 HZ3 TRP 29 8.833 17.393 -10.233 196 HH2 TRP 29 HH2 TRP 29 7.536 18.566 -8.530 197 HA PRO 30 HA PRO 30 9.683 24.096 -14.964 198 HB2 PRO 30 HB2 PRO 30 7.064 23.610 -14.538 199 HB3 PRO 30 HB1 PRO 30 7.955 22.861 -15.867 200 HG2 PRO 30 HG2 PRO 30 7.193 21.716 -13.213 201 HG3 PRO 30 HG1 PRO 30 7.152 20.957 -14.814 202 HD2 PRO 30 HD2 PRO 30 9.152 20.548 -12.993 203 HD3 PRO 30 HD1 PRO 30 9.378 20.414 -14.748 204 H VAL 31 HN VAL 31 9.385 26.004 -13.944 205 HA VAL 31 HA VAL 31 9.452 26.016 -11.068 206 HB VAL 31 HB VAL 31 9.621 28.476 -11.280 207 HG11 VAL 31 HG11 VAL 31 11.624 27.102 -11.326 208 HG12 VAL 31 HG12 VAL 31 11.807 28.493 -12.398 209 HG13 VAL 31 HG13 VAL 31 11.463 26.899 -13.072 210 HG21 VAL 31 HG21 VAL 31 9.828 29.500 -13.486 211 HG22 VAL 31 HG22 VAL 31 8.235 28.767 -13.288 212 HG23 VAL 31 HG23 VAL 31 9.469 27.954 -14.251 213 H PHE 32 HN PHE 32 6.931 25.497 -12.936 214 HA PHE 32 HA PHE 32 4.995 27.263 -11.775 215 HB2 PHE 32 HB2 PHE 32 4.648 26.133 -13.963 216 HB3 PHE 32 HB1 PHE 32 4.573 24.586 -13.128 217 HD1 PHE 32 HD2 PHE 32 2.924 27.895 -13.348 218 HD2 PHE 32 HD1 PHE 32 2.546 23.798 -12.274 219 HE1 PHE 32 HE2 PHE 32 0.508 28.212 -13.008 220 HE2 PHE 32 HE1 PHE 32 0.127 24.106 -11.932 221 HZ PHE 32 HZ PHE 32 -0.893 26.313 -12.297 222 H ALA 33 HN ALA 33 6.466 24.221 -11.010 223 HA ALA 33 HA ALA 33 4.759 23.924 -8.641 224 HB1 ALA 33 HB1 ALA 33 5.693 21.670 -8.462 225 HB2 ALA 33 HB2 ALA 33 6.724 21.982 -9.857 226 HB3 ALA 33 HB3 ALA 33 4.972 21.937 -10.049 227 H ASP 34 HN ASP 34 5.669 23.843 -6.587 228 HA ASP 34 HA ASP 34 7.880 25.579 -6.216 229 HB2 ASP 34 HB2 ASP 34 6.345 23.868 -4.256 230 HB3 ASP 34 HB1 ASP 34 7.560 25.054 -3.791 231 H ILE 35 HN ILE 35 9.958 25.183 -5.962 232 HA ILE 35 HA ILE 35 11.011 22.538 -6.280 233 HB ILE 35 HB ILE 35 12.532 25.024 -5.467 234 HG12 ILE 35 HG12 ILE 35 11.878 24.054 -8.262 235 HG13 ILE 35 HG11 ILE 35 11.172 25.469 -7.488 236 HG21 ILE 35 HG21 ILE 35 14.421 23.927 -6.548 237 HG22 ILE 35 HG22 ILE 35 13.399 22.546 -6.953 238 HG23 ILE 35 HG23 ILE 35 13.756 22.915 -5.265 239 HD11 ILE 35 HD11 ILE 35 14.075 25.097 -8.195 240 HD12 ILE 35 HD12 ILE 35 13.386 26.509 -7.393 241 HD13 ILE 35 HD13 ILE 35 12.909 26.113 -9.044 242 HA PRO 36 HA PRO 36 10.839 21.605 -1.958 243 HB2 PRO 36 HB2 PRO 36 11.954 19.160 -2.015 244 HB3 PRO 36 HB1 PRO 36 10.367 19.479 -2.715 245 HG2 PRO 36 HG2 PRO 36 13.020 19.242 -4.075 246 HG3 PRO 36 HG1 PRO 36 11.451 18.589 -4.573 247 HD2 PRO 36 HD2 PRO 36 12.547 20.881 -5.593 248 HD3 PRO 36 HD1 PRO 36 10.804 20.558 -5.539 249 H ALA 37 HN ALA 37 13.662 19.666 -2.294 250 HA ALA 37 HA ALA 37 15.435 21.651 -1.140 251 HB1 ALA 37 HB1 ALA 37 14.191 20.896 0.799 252 HB2 ALA 37 HB2 ALA 37 15.849 20.295 0.878 253 HB3 ALA 37 HB3 ALA 37 14.539 19.214 0.395 254 H GLY 38 HN GLY 38 17.643 20.808 -0.857 255 HA2 GLY 38 HA2 GLY 38 19.460 19.533 -1.493 256 HA3 GLY 38 HA1 GLY 38 18.348 18.226 -1.873 257 H TRP 39 HN TRP 39 18.126 21.426 -3.249 258 HA TRP 39 HA TRP 39 18.438 20.188 -5.880 259 HB2 TRP 39 HB2 TRP 39 17.191 22.274 -6.657 260 HB3 TRP 39 HB1 TRP 39 16.281 21.089 -5.726 261 HD1 TRP 39 HD1 TRP 39 15.508 21.791 -3.273 262 HE1 TRP 39 HE1 TRP 39 15.203 24.085 -2.153 263 HE3 TRP 39 HE3 TRP 39 18.186 24.644 -6.558 264 HZ2 TRP 39 HZ2 TRP 39 15.998 26.763 -2.610 265 HZ3 TRP 39 HZ3 TRP 39 18.364 27.061 -6.149 266 HH2 TRP 39 HH2 TRP 39 17.294 28.100 -4.217 267 H ARG 40 HN ARG 40 19.841 20.862 -7.329 268 HA ARG 40 HA ARG 40 21.376 23.317 -6.809 269 HB2 ARG 40 HB2 ARG 40 22.899 21.491 -6.633 270 HB3 ARG 40 HB1 ARG 40 22.224 20.695 -8.047 271 HG2 ARG 40 HG2 ARG 40 24.388 21.654 -8.555 272 HG3 ARG 40 HG1 ARG 40 23.121 22.470 -9.473 273 HD2 ARG 40 HD2 ARG 40 24.646 24.120 -8.634 274 HD3 ARG 40 HD1 ARG 40 23.120 24.270 -7.765 275 HE ARG 40 HE ARG 40 24.619 22.619 -6.196 276 HH11 ARG 40 HH11 ARG 40 25.030 25.840 -7.518 277 HH12 ARG 40 HH12 ARG 40 26.088 26.358 -6.230 278 HH21 ARG 40 HH21 ARG 40 25.986 23.302 -4.516 279 HH22 ARG 40 HH22 ARG 40 26.637 24.914 -4.537 280 H VAL 41 HN VAL 41 20.721 24.872 -8.125 281 HA VAL 41 HA VAL 41 19.558 24.253 -10.709 282 HB VAL 41 HB VAL 41 20.175 26.942 -9.461 283 HG11 VAL 41 HG11 VAL 41 18.683 27.864 -11.168 284 HG12 VAL 41 HG12 VAL 41 18.528 26.263 -11.892 285 HG13 VAL 41 HG13 VAL 41 20.091 27.082 -11.890 286 HG21 VAL 41 HG21 VAL 41 17.568 25.438 -9.679 287 HG22 VAL 41 HG22 VAL 41 17.773 27.064 -9.022 288 HG23 VAL 41 HG23 VAL 41 18.503 25.681 -8.205 289 H VAL 42 HN VAL 42 20.878 23.718 -12.308 290 HA VAL 42 HA VAL 42 23.614 24.667 -12.382 291 HB VAL 42 HB VAL 42 22.117 23.052 -14.458 292 HG11 VAL 42 HG11 VAL 42 24.359 22.376 -15.197 293 HG12 VAL 42 HG12 VAL 42 25.070 23.468 -14.010 294 HG13 VAL 42 HG13 VAL 42 24.118 24.118 -15.342 295 HG21 VAL 42 HG21 VAL 42 23.241 21.099 -13.446 296 HG22 VAL 42 HG22 VAL 42 22.107 21.875 -12.341 297 HG23 VAL 42 HG23 VAL 42 23.841 22.139 -12.156 298 H HIS 43 HN HIS 43 20.602 25.186 -14.090 299 HA HIS 43 HA HIS 43 21.467 27.790 -14.965 300 HB2 HIS 43 HB2 HIS 43 21.244 25.520 -16.875 301 HB3 HIS 43 HB1 HIS 43 20.492 27.033 -17.368 302 HD1 HIS 43 HD1 HIS 43 22.105 29.131 -17.562 303 HD2 HIS 43 HD2 HIS 43 23.994 25.445 -17.113 304 HE1 HIS 43 HE1 HIS 43 24.508 29.508 -18.219 305 HE2 HIS 43 HE2 HIS 43 25.616 27.254 -18.022 306 H GLY 44 HN GLY 44 19.684 29.056 -15.770 307 HA2 GLY 44 HA2 GLY 44 17.279 28.388 -14.334 308 HA3 GLY 44 HA1 GLY 44 17.608 29.883 -15.197 309 H GLU 45 HN GLU 45 16.001 30.175 -16.585 310 HA GLU 45 HA GLU 45 14.850 27.832 -17.871 311 HB2 GLU 45 HB2 GLU 45 13.257 29.824 -18.758 312 HB3 GLU 45 HB1 GLU 45 12.982 28.927 -17.271 313 HG2 GLU 45 HG2 GLU 45 12.726 31.139 -16.644 314 HG3 GLU 45 HG1 GLU 45 14.358 30.715 -16.142 315 H ALA 46 HN ALA 46 16.137 27.269 -19.337 316 HA ALA 46 HA ALA 46 16.604 29.067 -21.622 317 HB1 ALA 46 HB1 ALA 46 18.259 26.689 -20.769 318 HB2 ALA 46 HB2 ALA 46 18.698 28.383 -20.550 319 HB3 ALA 46 HB3 ALA 46 18.563 27.711 -22.174 320 H SER 47 HN SER 47 16.744 27.804 -23.740 321 HA SER 47 HA SER 47 14.338 26.719 -24.410 322 HB2 SER 47 HB2 SER 47 16.978 25.903 -25.650 323 HB3 SER 47 HB1 SER 47 15.391 25.859 -26.423 324 HG SER 47 HG SER 47 15.324 28.178 -26.098 325 H ARG 48 HN ARG 48 13.289 24.846 -24.198 326 HA ARG 48 HA ARG 48 13.985 23.006 -22.242 327 HB2 ARG 48 HB2 ARG 48 11.691 23.444 -23.136 328 HB3 ARG 48 HB1 ARG 48 12.114 22.521 -24.572 329 HG2 ARG 48 HG2 ARG 48 12.223 21.322 -21.818 330 HG3 ARG 48 HG1 ARG 48 10.732 21.372 -22.757 331 HD2 ARG 48 HD2 ARG 48 13.314 20.002 -23.501 332 HD3 ARG 48 HD1 ARG 48 11.787 19.232 -23.076 333 HE ARG 48 HE ARG 48 11.279 20.859 -25.273 334 HH11 ARG 48 HH11 ARG 48 13.149 18.001 -24.494 335 HH12 ARG 48 HH12 ARG 48 13.205 17.427 -26.133 336 HH21 ARG 48 HH21 ARG 48 11.334 20.102 -27.427 337 HH22 ARG 48 HH22 ARG 48 12.192 18.636 -27.806 338 H ALA 49 HN ALA 49 14.278 22.693 -25.775 339 HA ALA 49 HA ALA 49 15.302 20.075 -25.797 340 HB1 ALA 49 HB1 ALA 49 15.833 22.295 -27.769 341 HB2 ALA 49 HB2 ALA 49 14.449 21.203 -27.795 342 HB3 ALA 49 HB3 ALA 49 16.075 20.572 -28.051 343 H ALA 50 HN ALA 50 16.906 23.210 -25.569 344 HA ALA 50 HA ALA 50 19.561 22.260 -25.677 345 HB1 ALA 50 HB1 ALA 50 18.934 24.614 -26.042 346 HB2 ALA 50 HB2 ALA 50 20.197 24.434 -24.826 347 HB3 ALA 50 HB3 ALA 50 18.535 24.756 -24.330 348 H CYS 51 HN CYS 51 17.299 22.756 -23.020 349 HA CYS 51 HA CYS 51 19.137 22.280 -20.929 350 HB2 CYS 51 HB2 CYS 51 16.133 21.983 -21.028 351 HB3 CYS 51 HB1 CYS 51 17.087 21.857 -19.554 352 HG CYS 51 HG CYS 51 16.072 24.569 -21.209 353 H LEU 52 HN LEU 52 16.862 20.107 -22.613 354 HA LEU 52 HA LEU 52 17.581 17.787 -21.164 355 HB2 LEU 52 HB2 LEU 52 16.180 18.327 -23.732 356 HB3 LEU 52 HB1 LEU 52 16.773 16.702 -23.458 357 HG LEU 52 HG LEU 52 14.425 16.908 -22.827 358 HD11 LEU 52 HD11 LEU 52 15.830 15.314 -21.633 359 HD12 LEU 52 HD12 LEU 52 14.570 15.970 -20.589 360 HD13 LEU 52 HD13 LEU 52 16.230 16.551 -20.439 361 HD21 LEU 52 HD21 LEU 52 13.745 18.278 -20.922 362 HD22 LEU 52 HD22 LEU 52 14.390 19.272 -22.228 363 HD23 LEU 52 HD23 LEU 52 15.377 18.936 -20.805 364 H ASP 53 HN ASP 53 18.742 19.139 -24.216 365 HA ASP 53 HA ASP 53 20.666 17.228 -24.859 366 HB2 ASP 53 HB2 ASP 53 20.059 19.024 -26.378 367 HB3 ASP 53 HB1 ASP 53 20.663 20.231 -25.251 368 H TYR 54 HN TYR 54 20.871 20.089 -22.817 369 HA TYR 54 HA TYR 54 23.577 19.997 -22.149 370 HB2 TYR 54 HB2 TYR 54 21.903 21.867 -21.775 371 HB3 TYR 54 HB1 TYR 54 21.336 20.974 -20.371 372 HD1 TYR 54 HD2 TYR 54 22.814 20.716 -18.398 373 HD2 TYR 54 HD1 TYR 54 23.916 23.129 -21.724 374 HE1 TYR 54 HE2 TYR 54 24.513 21.835 -17.017 375 HE2 TYR 54 HE1 TYR 54 25.614 24.257 -20.353 376 HH TYR 54 HH TYR 54 26.723 23.080 -17.474 377 H VAL 55 HN VAL 55 20.767 18.671 -20.378 378 HA VAL 55 HA VAL 55 22.368 17.702 -18.243 379 HB VAL 55 HB VAL 55 20.382 16.542 -17.438 380 HG11 VAL 55 HG11 VAL 55 19.790 19.303 -18.471 381 HG12 VAL 55 HG12 VAL 55 20.620 18.906 -16.966 382 HG13 VAL 55 HG13 VAL 55 18.921 18.481 -17.176 383 HG21 VAL 55 HG21 VAL 55 19.089 17.396 -20.025 384 HG22 VAL 55 HG22 VAL 55 18.259 16.662 -18.653 385 HG23 VAL 55 HG23 VAL 55 19.469 15.742 -19.548 386 H GLU 56 HN GLU 56 21.131 16.227 -21.185 387 HA GLU 56 HA GLU 56 21.783 13.557 -20.421 388 HB2 GLU 56 HB2 GLU 56 21.084 14.847 -23.047 389 HB3 GLU 56 HB1 GLU 56 21.446 13.130 -22.908 390 HG2 GLU 56 HG2 GLU 56 19.388 14.382 -21.151 391 HG3 GLU 56 HG1 GLU 56 18.989 13.929 -22.803 392 H LYS 57 HN LYS 57 23.455 16.066 -22.265 393 HA LYS 57 HA LYS 57 25.641 14.324 -22.923 394 HB2 LYS 57 HB2 LYS 57 25.078 17.234 -23.275 395 HB3 LYS 57 HB1 LYS 57 26.727 16.648 -23.467 396 HG2 LYS 57 HG2 LYS 57 26.254 15.493 -25.364 397 HG3 LYS 57 HG1 LYS 57 24.591 15.167 -24.881 398 HD2 LYS 57 HD2 LYS 57 24.681 16.673 -26.793 399 HD3 LYS 57 HD1 LYS 57 23.985 17.474 -25.382 400 HE2 LYS 57 HE2 LYS 57 26.128 18.572 -24.951 401 HE3 LYS 57 HE1 LYS 57 26.828 17.762 -26.355 402 HZ1 LYS 57 HZ1 LYS 57 26.074 20.088 -26.768 403 HZ2 LYS 57 HZ2 LYS 57 24.478 19.570 -26.500 404 HZ3 LYS 57 HZ3 LYS 57 25.364 18.936 -27.796 405 H ASN 58 HN ASN 58 24.775 16.086 -20.152 406 HA ASN 58 HA ASN 58 27.480 16.126 -19.100 407 HB2 ASN 58 HB2 ASN 58 24.849 17.142 -18.170 408 HB3 ASN 58 HB1 ASN 58 26.005 16.683 -16.925 409 HD21 ASN 58 HD21 ASN 58 25.269 18.913 -19.473 410 HD22 ASN 58 HD22 ASN 58 26.531 20.047 -19.115 411 H TRP 59 HN TRP 59 24.432 14.389 -18.493 412 HA TRP 59 HA TRP 59 26.028 12.306 -17.180 413 HB2 TRP 59 HB2 TRP 59 23.461 13.531 -16.191 414 HB3 TRP 59 HB1 TRP 59 24.015 11.949 -15.654 415 HD1 TRP 59 HD1 TRP 59 24.514 15.625 -15.038 416 HE1 TRP 59 HE1 TRP 59 26.295 15.961 -13.210 417 HE3 TRP 59 HE3 TRP 59 26.286 10.837 -14.740 418 HZ2 TRP 59 HZ2 TRP 59 28.198 14.402 -11.825 419 HZ3 TRP 59 HZ3 TRP 59 28.087 10.345 -13.140 420 HH2 TRP 59 HH2 TRP 59 29.022 12.091 -11.713 421 H THR 60 HN THR 60 25.983 10.763 -18.662 422 HA THR 60 HA THR 60 23.378 9.545 -19.207 423 HB THR 60 HB THR 60 23.918 10.780 -21.253 424 HG1 THR 60 HG1 THR 60 22.947 9.015 -21.959 425 HG21 THR 60 HG21 THR 60 25.907 10.231 -22.578 426 HG22 THR 60 HG22 THR 60 26.474 9.169 -21.289 427 HG23 THR 60 HG23 THR 60 26.346 10.905 -21.007 428 H ASP 61 HN ASP 61 23.518 7.255 -19.556 429 HA ASP 61 HA ASP 61 25.858 6.105 -18.228 430 HB2 ASP 61 HB2 ASP 61 23.493 5.580 -17.502 431 HB3 ASP 61 HB1 ASP 61 23.299 4.701 -19.016 432 H LEU 62 HN LEU 62 24.648 6.596 -21.320 433 HA LEU 62 HA LEU 62 25.890 4.226 -22.478 434 HB2 LEU 62 HB2 LEU 62 24.459 6.534 -23.798 435 HB3 LEU 62 HB1 LEU 62 25.002 5.077 -24.606 436 HG LEU 62 HG LEU 62 22.896 5.179 -22.443 437 HD11 LEU 62 HD11 LEU 62 21.338 4.636 -24.258 438 HD12 LEU 62 HD12 LEU 62 22.651 4.799 -25.426 439 HD13 LEU 62 HD13 LEU 62 22.112 6.201 -24.500 440 HD21 LEU 62 HD21 LEU 62 22.486 2.847 -23.060 441 HD22 LEU 62 HD22 LEU 62 24.124 3.075 -22.446 442 HD23 LEU 62 HD23 LEU 62 23.848 2.904 -24.180 443 H ARG 63 HN ARG 63 27.446 4.458 -24.254 444 HA ARG 63 HA ARG 63 28.930 6.994 -24.177 445 HB2 ARG 63 HB2 ARG 63 30.039 5.166 -22.792 446 HB3 ARG 63 HB1 ARG 63 30.308 4.306 -24.300 447 HG2 ARG 63 HG2 ARG 63 31.302 7.110 -23.900 448 HG3 ARG 63 HG1 ARG 63 32.223 5.710 -23.357 449 HD2 ARG 63 HD2 ARG 63 32.359 4.860 -25.595 450 HD3 ARG 63 HD1 ARG 63 31.258 6.103 -26.182 451 HE ARG 63 HE ARG 63 33.566 7.254 -24.973 452 HH11 ARG 63 HH11 ARG 63 32.501 5.597 -27.870 453 HH12 ARG 63 HH12 ARG 63 33.646 6.396 -28.911 454 HH21 ARG 63 HH21 ARG 63 35.071 8.337 -26.339 455 HH22 ARG 63 HH22 ARG 63 35.102 7.963 -28.041 456 HA PRO 64 HA PRO 64 28.626 6.089 -28.602 457 HB2 PRO 64 HB2 PRO 64 27.210 8.257 -29.322 458 HB3 PRO 64 HB1 PRO 64 26.423 6.816 -28.672 459 HG2 PRO 64 HG2 PRO 64 26.847 9.450 -27.412 460 HG3 PRO 64 HG1 PRO 64 25.639 8.209 -27.044 461 HD2 PRO 64 HD2 PRO 64 28.133 8.738 -25.696 462 HD3 PRO 64 HD1 PRO 64 26.902 7.525 -25.294 463 H LYS 65 HN LYS 65 29.554 7.449 -30.396 464 HA LYS 65 HA LYS 65 31.673 9.124 -29.320 465 HB2 LYS 65 HB2 LYS 65 32.555 9.159 -31.642 466 HB3 LYS 65 HB1 LYS 65 32.373 7.541 -30.988 467 HG2 LYS 65 HG2 LYS 65 30.315 7.252 -32.266 468 HG3 LYS 65 HG1 LYS 65 30.502 8.878 -32.929 469 HD2 LYS 65 HD2 LYS 65 32.674 8.194 -33.891 470 HD3 LYS 65 HD1 LYS 65 32.390 6.556 -33.298 471 HE2 LYS 65 HE2 LYS 65 31.773 6.633 -35.608 472 HE3 LYS 65 HE1 LYS 65 30.302 6.497 -34.647 473 HZ1 LYS 65 HZ1 LYS 65 29.917 8.107 -36.316 474 HZ2 LYS 65 HZ2 LYS 65 31.366 8.922 -35.988 475 HZ3 LYS 65 HZ3 LYS 65 30.095 8.969 -34.865 476 H SER 66 HN SER 66 30.092 10.676 -28.567 477 HA SER 66 HA SER 66 28.854 12.350 -30.596 478 HB2 SER 66 HB2 SER 66 27.550 11.792 -28.591 479 HB3 SER 66 HB1 SER 66 28.783 12.531 -27.571 480 HG SER 66 HG SER 66 27.132 13.825 -29.489 481 H LEU 67 HN LEU 67 30.266 13.648 -31.590 482 HA LEU 67 HA LEU 67 32.236 15.090 -29.973 483 HB2 LEU 67 HB2 LEU 67 31.919 14.675 -32.935 484 HB3 LEU 67 HB1 LEU 67 32.951 15.943 -32.304 485 HG LEU 67 HG LEU 67 34.321 14.055 -32.840 486 HD11 LEU 67 HD11 LEU 67 33.935 14.184 -29.857 487 HD12 LEU 67 HD12 LEU 67 34.908 15.296 -30.818 488 HD13 LEU 67 HD13 LEU 67 35.368 13.597 -30.700 489 HD21 LEU 67 HD21 LEU 67 34.006 11.858 -31.815 490 HD22 LEU 67 HD22 LEU 67 32.623 12.315 -32.809 491 HD23 LEU 67 HD23 LEU 67 32.522 12.428 -31.052 492 H ARG 68 HN ARG 68 32.499 17.410 -30.368 493 HA ARG 68 HA ARG 68 30.419 18.950 -31.523 494 HB2 ARG 68 HB2 ARG 68 29.407 19.903 -29.562 495 HB3 ARG 68 HB1 ARG 68 29.268 18.158 -29.436 496 HG2 ARG 68 HG2 ARG 68 31.433 19.731 -28.065 497 HG3 ARG 68 HG1 ARG 68 29.872 19.386 -27.325 498 HD2 ARG 68 HD2 ARG 68 31.867 17.342 -28.293 499 HD3 ARG 68 HD1 ARG 68 31.578 17.786 -26.611 500 HE ARG 68 HE ARG 68 29.556 16.495 -28.329 501 HH11 ARG 68 HH11 ARG 68 31.203 16.865 -25.261 502 HH12 ARG 68 HH12 ARG 68 30.194 15.701 -24.442 503 HH21 ARG 68 HH21 ARG 68 28.250 14.939 -27.251 504 HH22 ARG 68 HH22 ARG 68 28.537 14.620 -25.565 505 H ASP 69 HN ASP 69 30.689 21.345 -30.557 506 HA ASP 69 HA ASP 69 33.410 22.070 -30.989 507 HB2 ASP 69 HB2 ASP 69 31.624 23.596 -31.610 508 HB3 ASP 69 HB1 ASP 69 31.067 23.677 -29.942 509 H ALA 70 HN ALA 70 34.861 21.398 -29.545 510 HA ALA 70 HA ALA 70 34.169 21.287 -26.728 511 HB1 ALA 70 HB1 ALA 70 35.250 19.355 -27.746 512 HB2 ALA 70 HB2 ALA 70 36.253 20.044 -26.468 513 HB3 ALA 70 HB3 ALA 70 36.649 20.347 -28.161 514 H MET 71 HN MET 71 34.328 23.163 -25.717 515 HA MET 71 HA MET 71 36.968 24.388 -25.592 516 HB2 MET 71 HB2 MET 71 36.088 26.646 -25.750 517 HB3 MET 71 HB1 MET 71 35.667 25.751 -27.200 518 HG2 MET 71 HG2 MET 71 33.701 26.800 -26.800 519 HG3 MET 71 HG1 MET 71 33.436 25.315 -25.891 520 HE1 MET 71 HE1 MET 71 34.624 29.351 -23.990 521 HE2 MET 71 HE2 MET 71 34.304 29.131 -25.712 522 HE3 MET 71 HE3 MET 71 35.725 28.389 -24.975 523 H VAL 72 HN VAL 72 37.315 25.508 -23.584 524 HA VAL 72 HA VAL 72 35.306 25.156 -21.523 525 HB VAL 72 HB VAL 72 36.398 22.980 -21.512 526 HG11 VAL 72 HG11 VAL 72 38.968 24.485 -21.042 527 HG12 VAL 72 HG12 VAL 72 38.538 23.582 -22.495 528 HG13 VAL 72 HG13 VAL 72 38.775 22.736 -20.965 529 HG21 VAL 72 HG21 VAL 72 37.097 22.900 -19.170 530 HG22 VAL 72 HG22 VAL 72 35.655 23.895 -19.380 531 HG23 VAL 72 HG23 VAL 72 37.229 24.659 -19.148 532 H GLU 73 HN GLU 73 35.432 26.679 -20.002 533 HA GLU 73 HA GLU 73 37.710 28.529 -20.142 534 HB2 GLU 73 HB2 GLU 73 34.893 28.984 -19.129 535 HB3 GLU 73 HB1 GLU 73 36.171 30.194 -19.165 536 HG2 GLU 73 HG2 GLU 73 34.991 28.827 -21.579 537 HG3 GLU 73 HG1 GLU 73 34.603 30.455 -21.023 538 H ASP 74 HN ASP 74 38.106 29.684 -17.975 539 HA ASP 74 HA ASP 74 38.746 27.649 -16.067 540 HB2 ASP 74 HB2 ASP 74 40.226 29.595 -16.474 541 HB3 ASP 74 HB1 ASP 74 38.994 30.650 -15.784 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 29.630 44.188 -14.333 2 H2 GLY 1 HT2 GLY 1 29.145 45.078 -12.977 3 H3 GLY 1 HT3 GLY 1 30.725 45.230 -13.566 4 HA2 GLY 1 HA1 GLY 1 29.557 47.153 -14.261 5 HA3 GLY 1 HA2 GLY 1 29.794 46.130 -15.671 6 H SER 2 HN SER 2 28.047 45.431 -16.792 7 HA SER 2 HA SER 2 25.453 46.407 -15.872 8 HB2 SER 2 HB2 SER 2 26.355 45.302 -18.541 9 HB3 SER 2 HB1 SER 2 24.708 45.824 -18.189 10 HG SER 2 HG SER 2 25.603 47.596 -19.029 11 H HIS 3 HN HIS 3 24.379 45.064 -14.602 12 HA HIS 3 HA HIS 3 23.703 42.460 -15.686 13 HB2 HIS 3 HB2 HIS 3 25.599 41.952 -14.202 14 HB3 HIS 3 HB1 HIS 3 24.780 42.760 -12.870 15 HD1 HIS 3 HD1 HIS 3 24.569 39.668 -15.021 16 HD2 HIS 3 HD2 HIS 3 22.887 41.230 -11.546 17 HE1 HIS 3 HE1 HIS 3 23.243 37.789 -14.000 18 HE2 HIS 3 HE2 HIS 3 22.348 38.712 -11.832 19 H MET 4 HN MET 4 21.610 42.825 -15.920 20 HA MET 4 HA MET 4 20.132 44.393 -14.004 21 HB2 MET 4 HB2 MET 4 19.296 42.911 -16.503 22 HB3 MET 4 HB1 MET 4 18.162 43.783 -15.480 23 HG2 MET 4 HG2 MET 4 18.709 45.204 -17.289 24 HG3 MET 4 HG1 MET 4 19.527 45.842 -15.866 25 HE1 MET 4 HE1 MET 4 22.028 46.743 -18.729 26 HE2 MET 4 HE2 MET 4 21.178 47.346 -17.308 27 HE3 MET 4 HE3 MET 4 20.265 46.821 -18.722 28 H SER 5 HN SER 5 19.953 43.396 -12.083 29 HA SER 5 HA SER 5 19.440 40.650 -11.687 30 HB2 SER 5 HB2 SER 5 18.730 42.937 -9.838 31 HB3 SER 5 HB1 SER 5 18.994 41.253 -9.389 32 HG SER 5 HG SER 5 21.137 41.465 -9.741 33 H THR 6 HN THR 6 17.403 43.466 -12.118 34 HA THR 6 HA THR 6 14.947 42.048 -11.641 35 HB THR 6 HB THR 6 15.272 44.701 -13.055 36 HG1 THR 6 HG1 THR 6 15.539 43.999 -10.342 37 HG21 THR 6 HG21 THR 6 13.010 43.510 -11.437 38 HG22 THR 6 HG22 THR 6 13.042 43.722 -13.189 39 HG23 THR 6 HG23 THR 6 13.029 45.133 -12.130 40 H ASN 7 HN ASN 7 14.888 40.323 -13.033 41 HA ASN 7 HA ASN 7 15.477 40.491 -15.807 42 HB2 ASN 7 HB2 ASN 7 14.054 38.426 -14.126 43 HB3 ASN 7 HB1 ASN 7 14.248 38.246 -15.867 44 HD21 ASN 7 HD21 ASN 7 15.318 36.776 -13.487 45 HD22 ASN 7 HD22 ASN 7 17.025 36.706 -13.754 46 HA PRO 8 HA PRO 8 11.521 42.270 -16.930 47 HB2 PRO 8 HB2 PRO 8 12.113 42.784 -19.489 48 HB3 PRO 8 HB1 PRO 8 12.830 43.725 -18.173 49 HG2 PRO 8 HG2 PRO 8 14.007 41.473 -19.755 50 HG3 PRO 8 HG1 PRO 8 14.761 42.999 -19.256 51 HD2 PRO 8 HD2 PRO 8 15.114 40.606 -17.952 52 HD3 PRO 8 HD1 PRO 8 15.279 42.193 -17.174 53 H PHE 9 HN PHE 9 12.118 39.320 -16.986 54 HA PHE 9 HA PHE 9 10.643 38.513 -19.393 55 HB2 PHE 9 HB2 PHE 9 12.282 36.797 -17.516 56 HB3 PHE 9 HB1 PHE 9 11.560 36.288 -19.038 57 HD1 PHE 9 HD2 PHE 9 12.393 37.386 -21.175 58 HD2 PHE 9 HD1 PHE 9 14.433 37.690 -17.452 59 HE1 PHE 9 HE2 PHE 9 14.461 38.011 -22.360 60 HE2 PHE 9 HE1 PHE 9 16.495 38.318 -18.627 61 HZ PHE 9 HZ PHE 9 16.517 38.478 -21.084 62 H ASP 10 HN ASP 10 8.516 38.536 -18.911 63 HA ASP 10 HA ASP 10 7.692 36.991 -16.542 64 HB2 ASP 10 HB2 ASP 10 6.349 39.314 -17.913 65 HB3 ASP 10 HB1 ASP 10 5.443 38.203 -16.894 66 H ASP 11 HN ASP 11 6.864 35.081 -16.958 67 HA ASP 11 HA ASP 11 6.021 34.512 -19.706 68 HB2 ASP 11 HB2 ASP 11 6.624 32.281 -19.373 69 HB3 ASP 11 HB1 ASP 11 7.844 33.159 -18.457 70 H ASP 12 HN ASP 12 4.325 32.590 -19.702 71 HA ASP 12 HA ASP 12 2.107 33.415 -17.934 72 HB2 ASP 12 HB2 ASP 12 1.985 32.826 -20.903 73 HB3 ASP 12 HB1 ASP 12 0.586 33.118 -19.880 74 H ASN 13 HN ASN 13 3.958 31.018 -17.847 75 HA ASN 13 HA ASN 13 1.948 28.950 -17.769 76 HB2 ASN 13 HB2 ASN 13 2.821 27.513 -19.477 77 HB3 ASN 13 HB1 ASN 13 2.542 29.086 -20.202 78 HD21 ASN 13 HD21 ASN 13 5.054 30.155 -18.909 79 HD22 ASN 13 HD22 ASN 13 6.329 29.520 -19.890 80 H GLY 14 HN GLY 14 3.737 26.735 -17.950 81 HA2 GLY 14 HA2 GLY 14 5.227 27.110 -15.470 82 HA3 GLY 14 HA1 GLY 14 4.901 25.585 -16.261 83 H ALA 15 HN ALA 15 6.979 28.315 -16.078 84 HA ALA 15 HA ALA 15 8.725 27.571 -18.217 85 HB1 ALA 15 HB1 ALA 15 9.296 29.341 -15.841 86 HB2 ALA 15 HB2 ALA 15 8.586 29.881 -17.361 87 HB3 ALA 15 HB3 ALA 15 10.234 29.254 -17.332 88 H PHE 16 HN PHE 16 10.582 26.331 -18.155 89 HA PHE 16 HA PHE 16 10.776 24.632 -15.771 90 HB2 PHE 16 HB2 PHE 16 12.187 23.201 -17.473 91 HB3 PHE 16 HB1 PHE 16 10.426 23.183 -17.529 92 HD1 PHE 16 HD1 PHE 16 13.288 25.109 -18.952 93 HD2 PHE 16 HD2 PHE 16 9.420 23.451 -19.571 94 HE1 PHE 16 HE1 PHE 16 13.334 25.883 -21.281 95 HE2 PHE 16 HE2 PHE 16 9.465 24.206 -21.912 96 HZ PHE 16 HZ PHE 16 11.424 25.423 -22.768 97 H PHE 17 HN PHE 17 12.655 24.174 -14.743 98 HA PHE 17 HA PHE 17 15.041 25.745 -15.485 99 HB2 PHE 17 HB2 PHE 17 13.620 25.435 -12.936 100 HB3 PHE 17 HB1 PHE 17 15.342 25.110 -12.810 101 HD1 PHE 17 HD2 PHE 17 13.672 27.598 -15.007 102 HD2 PHE 17 HD1 PHE 17 16.093 26.910 -11.577 103 HE1 PHE 17 HE2 PHE 17 14.121 30.010 -14.840 104 HE2 PHE 17 HE1 PHE 17 16.543 29.321 -11.405 105 HZ PHE 17 HZ PHE 17 15.556 30.874 -13.040 106 H VAL 18 HN VAL 18 17.091 24.712 -15.060 107 HA VAL 18 HA VAL 18 16.964 21.812 -15.251 108 HB VAL 18 HB VAL 18 19.380 23.634 -15.256 109 HG11 VAL 18 HG11 VAL 18 20.596 21.685 -16.120 110 HG12 VAL 18 HG12 VAL 18 19.144 20.700 -15.933 111 HG13 VAL 18 HG13 VAL 18 19.940 21.377 -14.511 112 HG21 VAL 18 HG21 VAL 18 17.958 24.030 -17.180 113 HG22 VAL 18 HG22 VAL 18 17.908 22.302 -17.527 114 HG23 VAL 18 HG23 VAL 18 19.425 23.188 -17.678 115 H LEU 19 HN LEU 19 16.457 20.949 -13.329 116 HA LEU 19 HA LEU 19 17.855 21.902 -10.925 117 HB2 LEU 19 HB2 LEU 19 15.264 21.824 -11.211 118 HB3 LEU 19 HB1 LEU 19 15.450 20.103 -10.941 119 HG LEU 19 HG LEU 19 16.578 20.669 -8.758 120 HD11 LEU 19 HD11 LEU 19 17.228 22.933 -9.234 121 HD12 LEU 19 HD12 LEU 19 16.116 22.926 -7.865 122 HD13 LEU 19 HD13 LEU 19 15.547 23.406 -9.459 123 HD21 LEU 19 HD21 LEU 19 13.724 21.575 -9.140 124 HD22 LEU 19 HD22 LEU 19 14.470 21.146 -7.600 125 HD23 LEU 19 HD23 LEU 19 14.261 19.921 -8.852 126 H VAL 20 HN VAL 20 19.295 20.593 -9.966 127 HA VAL 20 HA VAL 20 19.326 17.766 -10.782 128 HB VAL 20 HB VAL 20 21.570 19.471 -9.687 129 HG11 VAL 20 HG11 VAL 20 21.763 17.194 -8.833 130 HG12 VAL 20 HG12 VAL 20 23.014 17.518 -10.035 131 HG13 VAL 20 HG13 VAL 20 21.601 16.552 -10.468 132 HG21 VAL 20 HG21 VAL 20 21.082 19.937 -12.004 133 HG22 VAL 20 HG22 VAL 20 21.121 18.215 -12.390 134 HG23 VAL 20 HG23 VAL 20 22.598 19.043 -11.888 135 H ASN 21 HN ASN 21 19.115 16.207 -9.322 136 HA ASN 21 HA ASN 21 18.633 16.988 -6.526 137 HB2 ASN 21 HB2 ASN 21 16.860 15.760 -7.981 138 HB3 ASN 21 HB1 ASN 21 17.882 14.346 -7.778 139 HD21 ASN 21 HD21 ASN 21 15.180 14.701 -6.953 140 HD22 ASN 21 HD22 ASN 21 15.141 14.502 -5.234 141 H ASP 22 HN ASP 22 19.334 15.277 -4.917 142 HA ASP 22 HA ASP 22 22.108 15.149 -4.995 143 HB2 ASP 22 HB2 ASP 22 20.820 15.151 -2.921 144 HB3 ASP 22 HB1 ASP 22 20.185 13.553 -3.291 145 H GLU 23 HN GLU 23 19.766 12.535 -5.583 146 HA GLU 23 HA GLU 23 21.993 10.919 -6.638 147 HB2 GLU 23 HB2 GLU 23 19.366 9.953 -5.505 148 HB3 GLU 23 HB1 GLU 23 20.632 8.926 -6.164 149 HG2 GLU 23 HG2 GLU 23 22.141 9.942 -4.381 150 HG3 GLU 23 HG1 GLU 23 20.653 10.545 -3.647 151 H ASP 24 HN ASP 24 20.370 12.934 -8.099 152 HA ASP 24 HA ASP 24 18.923 11.141 -9.943 153 HB2 ASP 24 HB2 ASP 24 17.475 12.790 -8.844 154 HB3 ASP 24 HB1 ASP 24 18.481 14.094 -9.468 155 H GLN 25 HN GLN 25 18.998 11.605 -12.202 156 HA GLN 25 HA GLN 25 21.632 12.456 -13.019 157 HB2 GLN 25 HB2 GLN 25 20.521 11.808 -15.367 158 HB3 GLN 25 HB1 GLN 25 21.245 10.637 -14.284 159 HG2 GLN 25 HG2 GLN 25 19.238 9.684 -15.005 160 HG3 GLN 25 HG1 GLN 25 18.922 10.236 -13.366 161 HE21 GLN 25 HE21 GLN 25 17.366 11.817 -13.026 162 HE22 GLN 25 HE22 GLN 25 16.362 12.426 -14.296 163 H HIS 26 HN HIS 26 18.297 13.424 -13.873 164 HA HIS 26 HA HIS 26 19.038 16.155 -13.855 165 HB2 HIS 26 HB2 HIS 26 18.477 16.662 -16.241 166 HB3 HIS 26 HB1 HIS 26 19.993 15.811 -16.015 167 HD1 HIS 26 HD1 HIS 26 16.381 14.879 -16.869 168 HD2 HIS 26 HD2 HIS 26 20.293 13.792 -17.758 169 HE1 HIS 26 HE1 HIS 26 16.206 13.154 -18.688 170 HE2 HIS 26 HE2 HIS 26 18.587 12.619 -19.314 171 H SER 27 HN SER 27 17.329 17.276 -13.239 172 HA SER 27 HA SER 27 14.666 16.237 -13.936 173 HB2 SER 27 HB2 SER 27 15.525 17.592 -11.365 174 HB3 SER 27 HB1 SER 27 13.866 17.161 -11.770 175 HG SER 27 HG SER 27 15.951 15.228 -11.744 176 H LEU 28 HN LEU 28 14.042 17.583 -15.564 177 HA LEU 28 HA LEU 28 14.503 20.433 -15.402 178 HB2 LEU 28 HB2 LEU 28 13.168 18.611 -17.367 179 HB3 LEU 28 HB1 LEU 28 12.815 20.325 -17.418 180 HG LEU 28 HG LEU 28 14.572 19.665 -19.035 181 HD11 LEU 28 HD11 LEU 28 14.528 21.942 -18.164 182 HD12 LEU 28 HD12 LEU 28 16.184 21.407 -18.451 183 HD13 LEU 28 HD13 LEU 28 15.544 21.455 -16.808 184 HD21 LEU 28 HD21 LEU 28 16.797 19.054 -18.221 185 HD22 LEU 28 HD22 LEU 28 15.589 17.846 -17.776 186 HD23 LEU 28 HD23 LEU 28 16.178 18.992 -16.569 187 H TRP 29 HN TRP 29 13.433 21.386 -13.781 188 HA TRP 29 HA TRP 29 10.703 20.479 -13.169 189 HB2 TRP 29 HB2 TRP 29 12.387 20.114 -11.401 190 HB3 TRP 29 HB1 TRP 29 12.726 21.840 -11.374 191 HD1 TRP 29 HD1 TRP 29 11.324 23.266 -9.753 192 HE1 TRP 29 HE1 TRP 29 9.270 22.844 -8.257 193 HE3 TRP 29 HE3 TRP 29 10.069 18.588 -11.398 194 HZ2 TRP 29 HZ2 TRP 29 7.370 20.798 -7.836 195 HZ3 TRP 29 HZ3 TRP 29 8.120 17.470 -10.397 196 HH2 TRP 29 HH2 TRP 29 6.799 18.553 -8.652 197 HA PRO 30 HA PRO 30 9.380 24.510 -14.541 198 HB2 PRO 30 HB2 PRO 30 6.822 23.800 -13.287 199 HB3 PRO 30 HB1 PRO 30 7.183 24.133 -14.983 200 HG2 PRO 30 HG2 PRO 30 6.601 21.654 -14.103 201 HG3 PRO 30 HG1 PRO 30 7.743 21.942 -15.429 202 HD2 PRO 30 HD2 PRO 30 8.296 21.315 -12.554 203 HD3 PRO 30 HD1 PRO 30 9.105 20.718 -14.018 204 H VAL 31 HN VAL 31 9.558 26.409 -13.575 205 HA VAL 31 HA VAL 31 9.732 26.638 -10.724 206 HB VAL 31 HB VAL 31 10.101 29.044 -11.133 207 HG11 VAL 31 HG11 VAL 31 11.686 27.236 -12.950 208 HG12 VAL 31 HG12 VAL 31 11.976 27.490 -11.230 209 HG13 VAL 31 HG13 VAL 31 12.198 28.820 -12.367 210 HG21 VAL 31 HG21 VAL 31 9.634 28.334 -14.032 211 HG22 VAL 31 HG22 VAL 31 10.264 29.872 -13.449 212 HG23 VAL 31 HG23 VAL 31 8.621 29.381 -13.036 213 H PHE 32 HN PHE 32 7.156 26.544 -12.785 214 HA PHE 32 HA PHE 32 5.394 28.356 -11.440 215 HB2 PHE 32 HB2 PHE 32 5.049 27.597 -13.790 216 HB3 PHE 32 HB1 PHE 32 4.736 25.972 -13.193 217 HD1 PHE 32 HD1 PHE 32 3.483 29.444 -13.178 218 HD2 PHE 32 HD2 PHE 32 2.598 25.353 -12.414 219 HE1 PHE 32 HE1 PHE 32 1.099 30.008 -12.945 220 HE2 PHE 32 HE2 PHE 32 0.213 25.907 -12.178 221 HZ PHE 32 HZ PHE 32 -0.540 28.237 -12.448 222 H ALA 33 HN ALA 33 6.619 25.216 -10.868 223 HA ALA 33 HA ALA 33 4.501 24.593 -8.940 224 HB1 ALA 33 HB1 ALA 33 5.086 22.822 -10.518 225 HB2 ALA 33 HB2 ALA 33 5.492 22.357 -8.866 226 HB3 ALA 33 HB3 ALA 33 6.761 22.882 -9.972 227 H ASP 34 HN ASP 34 5.239 23.710 -6.835 228 HA ASP 34 HA ASP 34 6.972 25.574 -5.574 229 HB2 ASP 34 HB2 ASP 34 5.035 24.634 -4.407 230 HB3 ASP 34 HB1 ASP 34 5.744 23.025 -4.501 231 H ILE 35 HN ILE 35 9.106 25.520 -5.514 232 HA ILE 35 HA ILE 35 10.557 23.067 -6.008 233 HB ILE 35 HB ILE 35 11.560 25.842 -5.326 234 HG12 ILE 35 HG12 ILE 35 11.497 24.331 -7.950 235 HG13 ILE 35 HG11 ILE 35 10.466 25.691 -7.526 236 HG21 ILE 35 HG21 ILE 35 13.765 25.004 -6.027 237 HG22 ILE 35 HG22 ILE 35 13.083 23.386 -6.186 238 HG23 ILE 35 HG23 ILE 35 13.152 24.161 -4.604 239 HD11 ILE 35 HD11 ILE 35 12.418 27.139 -7.404 240 HD12 ILE 35 HD12 ILE 35 12.275 26.374 -8.988 241 HD13 ILE 35 HD13 ILE 35 13.456 25.776 -7.820 242 HA PRO 36 HA PRO 36 10.625 22.114 -1.619 243 HB2 PRO 36 HB2 PRO 36 11.870 19.731 -1.854 244 HB3 PRO 36 HB1 PRO 36 10.191 19.957 -2.346 245 HG2 PRO 36 HG2 PRO 36 12.669 19.921 -4.022 246 HG3 PRO 36 HG1 PRO 36 11.111 19.125 -4.314 247 HD2 PRO 36 HD2 PRO 36 11.825 21.472 -5.490 248 HD3 PRO 36 HD1 PRO 36 10.143 21.044 -5.123 249 H ALA 37 HN ALA 37 12.796 20.599 -0.575 250 HA ALA 37 HA ALA 37 15.084 22.412 -0.991 251 HB1 ALA 37 HB1 ALA 37 14.136 22.442 1.292 252 HB2 ALA 37 HB2 ALA 37 15.803 21.869 1.258 253 HB3 ALA 37 HB3 ALA 37 14.481 20.717 1.435 254 H GLY 38 HN GLY 38 17.229 21.447 -0.970 255 HA2 GLY 38 HA2 GLY 38 18.706 19.579 -1.060 256 HA3 GLY 38 HA1 GLY 38 17.321 18.535 -1.354 257 H TRP 39 HN TRP 39 17.886 21.550 -3.022 258 HA TRP 39 HA TRP 39 18.209 20.025 -5.524 259 HB2 TRP 39 HB2 TRP 39 16.882 21.821 -6.614 260 HB3 TRP 39 HB1 TRP 39 15.961 20.943 -5.401 261 HD1 TRP 39 HD1 TRP 39 15.282 22.244 -3.182 262 HE1 TRP 39 HE1 TRP 39 15.162 24.745 -2.603 263 HE3 TRP 39 HE3 TRP 39 18.034 24.120 -7.061 264 HZ2 TRP 39 HZ2 TRP 39 16.111 27.194 -3.640 265 HZ3 TRP 39 HZ3 TRP 39 18.385 26.553 -7.186 266 HH2 TRP 39 HH2 TRP 39 17.442 28.057 -5.511 267 H ARG 40 HN ARG 40 19.299 21.125 -7.243 268 HA ARG 40 HA ARG 40 20.559 23.676 -6.649 269 HB2 ARG 40 HB2 ARG 40 22.023 21.122 -7.073 270 HB3 ARG 40 HB1 ARG 40 22.663 22.548 -7.877 271 HG2 ARG 40 HG2 ARG 40 22.111 22.353 -4.923 272 HG3 ARG 40 HG1 ARG 40 23.693 22.133 -5.676 273 HD2 ARG 40 HD2 ARG 40 23.671 24.388 -6.501 274 HD3 ARG 40 HD1 ARG 40 22.016 24.621 -5.945 275 HE ARG 40 HE ARG 40 22.947 24.366 -3.636 276 HH11 ARG 40 HH11 ARG 40 25.057 25.329 -6.275 277 HH12 ARG 40 HH12 ARG 40 26.076 26.308 -5.260 278 HH21 ARG 40 HH21 ARG 40 24.296 25.654 -2.314 279 HH22 ARG 40 HH22 ARG 40 25.650 26.494 -3.019 280 H VAL 41 HN VAL 41 20.280 25.000 -8.319 281 HA VAL 41 HA VAL 41 19.326 23.918 -10.842 282 HB VAL 41 HB VAL 41 19.586 26.775 -9.869 283 HG11 VAL 41 HG11 VAL 41 19.871 26.734 -12.276 284 HG12 VAL 41 HG12 VAL 41 18.279 27.382 -11.874 285 HG13 VAL 41 HG13 VAL 41 18.435 25.724 -12.455 286 HG21 VAL 41 HG21 VAL 41 17.131 26.730 -9.833 287 HG22 VAL 41 HG22 VAL 41 17.816 25.512 -8.757 288 HG23 VAL 41 HG23 VAL 41 17.156 25.036 -10.321 289 H VAL 42 HN VAL 42 20.586 23.610 -12.548 290 HA VAL 42 HA VAL 42 23.321 24.649 -12.495 291 HB VAL 42 HB VAL 42 22.065 22.686 -14.423 292 HG11 VAL 42 HG11 VAL 42 24.942 23.444 -13.936 293 HG12 VAL 42 HG12 VAL 42 23.999 23.752 -15.396 294 HG13 VAL 42 HG13 VAL 42 24.412 22.098 -14.943 295 HG21 VAL 42 HG21 VAL 42 23.748 22.199 -11.966 296 HG22 VAL 42 HG22 VAL 42 23.288 20.966 -13.140 297 HG23 VAL 42 HG23 VAL 42 22.050 21.771 -12.177 298 H HIS 43 HN HIS 43 20.354 24.868 -14.353 299 HA HIS 43 HA HIS 43 21.450 27.115 -15.850 300 HB2 HIS 43 HB2 HIS 43 21.945 25.127 -17.221 301 HB3 HIS 43 HB1 HIS 43 20.244 24.685 -17.194 302 HD1 HIS 43 HD1 HIS 43 18.907 25.485 -19.114 303 HD2 HIS 43 HD2 HIS 43 22.371 27.721 -18.588 304 HE1 HIS 43 HE1 HIS 43 19.004 27.051 -21.071 305 HE2 HIS 43 HE2 HIS 43 21.190 28.275 -20.822 306 H GLY 44 HN GLY 44 19.877 28.564 -16.574 307 HA2 GLY 44 HA2 GLY 44 17.421 28.459 -15.079 308 HA3 GLY 44 HA1 GLY 44 17.971 29.780 -16.097 309 H GLU 45 HN GLU 45 15.840 29.998 -16.876 310 HA GLU 45 HA GLU 45 14.600 27.768 -18.233 311 HB2 GLU 45 HB2 GLU 45 13.057 29.967 -18.833 312 HB3 GLU 45 HB1 GLU 45 12.791 28.851 -17.494 313 HG2 GLU 45 HG2 GLU 45 12.740 31.045 -16.606 314 HG3 GLU 45 HG1 GLU 45 14.229 30.246 -16.105 315 H ALA 46 HN ALA 46 15.658 27.279 -19.909 316 HA ALA 46 HA ALA 46 15.329 29.002 -22.237 317 HB1 ALA 46 HB1 ALA 46 17.658 29.360 -21.539 318 HB2 ALA 46 HB2 ALA 46 17.563 28.530 -23.091 319 HB3 ALA 46 HB3 ALA 46 17.945 27.621 -21.629 320 H SER 47 HN SER 47 15.738 27.662 -24.262 321 HA SER 47 HA SER 47 13.799 25.934 -24.682 322 HB2 SER 47 HB2 SER 47 16.555 25.576 -25.861 323 HB3 SER 47 HB1 SER 47 15.033 25.034 -26.573 324 HG SER 47 HG SER 47 14.386 27.258 -26.621 325 H ARG 48 HN ARG 48 13.117 24.012 -24.185 326 HA ARG 48 HA ARG 48 14.195 22.495 -22.116 327 HB2 ARG 48 HB2 ARG 48 11.822 22.448 -22.868 328 HB3 ARG 48 HB1 ARG 48 12.315 21.555 -24.297 329 HG2 ARG 48 HG2 ARG 48 11.504 19.912 -22.871 330 HG3 ARG 48 HG1 ARG 48 13.251 19.820 -22.646 331 HD2 ARG 48 HD2 ARG 48 13.056 21.196 -20.627 332 HD3 ARG 48 HD1 ARG 48 11.311 21.279 -20.855 333 HE ARG 48 HE ARG 48 12.729 18.731 -20.394 334 HH11 ARG 48 HH11 ARG 48 10.041 20.893 -19.760 335 HH12 ARG 48 HH12 ARG 48 9.308 19.835 -18.588 336 HH21 ARG 48 HH21 ARG 48 11.769 17.353 -18.845 337 HH22 ARG 48 HH22 ARG 48 10.282 17.831 -18.084 338 H ALA 49 HN ALA 49 14.297 21.930 -25.624 339 HA ALA 49 HA ALA 49 15.660 19.486 -25.587 340 HB1 ALA 49 HB1 ALA 49 16.226 19.959 -27.914 341 HB2 ALA 49 HB2 ALA 49 15.752 21.643 -27.693 342 HB3 ALA 49 HB3 ALA 49 14.546 20.365 -27.570 343 H ALA 50 HN ALA 50 16.879 22.795 -25.638 344 HA ALA 50 HA ALA 50 19.612 22.165 -25.948 345 HB1 ALA 50 HB1 ALA 50 20.037 24.454 -25.226 346 HB2 ALA 50 HB2 ALA 50 18.373 24.595 -24.656 347 HB3 ALA 50 HB3 ALA 50 18.702 24.399 -26.378 348 H CYS 51 HN CYS 51 17.614 22.717 -23.059 349 HA CYS 51 HA CYS 51 19.698 22.514 -21.178 350 HB2 CYS 51 HB2 CYS 51 16.758 21.861 -20.839 351 HB3 CYS 51 HB1 CYS 51 17.912 22.043 -19.525 352 HG CYS 51 HG CYS 51 16.417 24.410 -21.405 353 H LEU 52 HN LEU 52 17.383 20.036 -22.289 354 HA LEU 52 HA LEU 52 18.451 17.879 -20.876 355 HB2 LEU 52 HB2 LEU 52 16.851 18.123 -23.379 356 HB3 LEU 52 HB1 LEU 52 17.559 16.567 -22.995 357 HG LEU 52 HG LEU 52 15.281 16.613 -22.214 358 HD11 LEU 52 HD11 LEU 52 15.607 16.139 -19.839 359 HD12 LEU 52 HD12 LEU 52 17.214 16.861 -19.919 360 HD13 LEU 52 HD13 LEU 52 16.857 15.396 -20.836 361 HD21 LEU 52 HD21 LEU 52 14.981 19.015 -22.017 362 HD22 LEU 52 HD22 LEU 52 16.063 19.046 -20.623 363 HD23 LEU 52 HD23 LEU 52 14.519 18.199 -20.522 364 H ASP 53 HN ASP 53 19.258 19.045 -24.137 365 HA ASP 53 HA ASP 53 21.123 17.050 -24.749 366 HB2 ASP 53 HB2 ASP 53 20.209 18.620 -26.417 367 HB3 ASP 53 HB1 ASP 53 21.131 19.927 -25.677 368 H TYR 54 HN TYR 54 21.602 20.238 -23.260 369 HA TYR 54 HA TYR 54 24.383 20.140 -23.048 370 HB2 TYR 54 HB2 TYR 54 23.275 22.223 -22.672 371 HB3 TYR 54 HB1 TYR 54 22.321 21.555 -21.351 372 HD1 TYR 54 HD1 TYR 54 25.755 22.521 -22.354 373 HD2 TYR 54 HD2 TYR 54 23.150 21.565 -19.127 374 HE1 TYR 54 HE1 TYR 54 27.479 23.237 -20.755 375 HE2 TYR 54 HE2 TYR 54 24.865 22.281 -17.523 376 HH TYR 54 HH TYR 54 27.381 22.474 -17.508 377 H VAL 55 HN VAL 55 21.921 19.168 -20.640 378 HA VAL 55 HA VAL 55 23.895 18.474 -18.711 379 HB VAL 55 HB VAL 55 22.089 17.411 -17.426 380 HG11 VAL 55 HG11 VAL 55 22.461 19.811 -17.245 381 HG12 VAL 55 HG12 VAL 55 20.750 19.424 -17.068 382 HG13 VAL 55 HG13 VAL 55 21.349 20.095 -18.584 383 HG21 VAL 55 HG21 VAL 55 20.305 18.122 -19.754 384 HG22 VAL 55 HG22 VAL 55 19.796 17.426 -18.215 385 HG23 VAL 55 HG23 VAL 55 20.803 16.489 -19.317 386 H GLU 56 HN GLU 56 22.149 16.574 -21.133 387 HA GLU 56 HA GLU 56 23.119 14.089 -20.128 388 HB2 GLU 56 HB2 GLU 56 21.912 14.763 -22.810 389 HB3 GLU 56 HB1 GLU 56 22.250 13.132 -22.237 390 HG2 GLU 56 HG2 GLU 56 20.763 13.625 -20.277 391 HG3 GLU 56 HG1 GLU 56 20.295 15.110 -21.098 392 H LYS 57 HN LYS 57 24.345 16.411 -22.465 393 HA LYS 57 HA LYS 57 26.396 14.690 -23.469 394 HB2 LYS 57 HB2 LYS 57 26.061 17.680 -23.508 395 HB3 LYS 57 HB1 LYS 57 27.462 16.881 -24.203 396 HG2 LYS 57 HG2 LYS 57 25.909 15.600 -25.667 397 HG3 LYS 57 HG1 LYS 57 24.594 16.606 -25.056 398 HD2 LYS 57 HD2 LYS 57 25.132 17.850 -26.867 399 HD3 LYS 57 HD1 LYS 57 26.300 18.533 -25.738 400 HE2 LYS 57 HE2 LYS 57 26.775 16.449 -27.857 401 HE3 LYS 57 HE1 LYS 57 27.445 18.075 -27.777 402 HZ1 LYS 57 HZ1 LYS 57 28.110 15.755 -26.060 403 HZ2 LYS 57 HZ2 LYS 57 28.608 17.332 -25.697 404 HZ3 LYS 57 HZ3 LYS 57 29.135 16.584 -27.120 405 H ASN 58 HN ASN 58 26.234 17.119 -20.888 406 HA ASN 58 HA ASN 58 28.991 16.886 -20.170 407 HB2 ASN 58 HB2 ASN 58 26.569 18.017 -18.787 408 HB3 ASN 58 HB1 ASN 58 28.094 17.858 -17.929 409 HD21 ASN 58 HD21 ASN 58 27.950 18.576 -21.345 410 HD22 ASN 58 HD22 ASN 58 28.504 20.206 -21.216 411 H TRP 59 HN TRP 59 26.034 15.326 -19.245 412 HA TRP 59 HA TRP 59 25.519 13.453 -18.132 413 HB2 TRP 59 HB2 TRP 59 27.336 12.540 -19.664 414 HB3 TRP 59 HB1 TRP 59 28.424 12.655 -18.283 415 HD1 TRP 59 HD1 TRP 59 24.811 11.237 -18.589 416 HE1 TRP 59 HE1 TRP 59 24.793 8.876 -17.566 417 HE3 TRP 59 HE3 TRP 59 29.763 10.855 -17.356 418 HZ2 TRP 59 HZ2 TRP 59 26.636 7.089 -16.397 419 HZ3 TRP 59 HZ3 TRP 59 30.550 8.784 -16.289 420 HH2 TRP 59 HH2 TRP 59 29.019 6.942 -15.820 421 H THR 60 HN THR 60 25.028 14.695 -16.323 422 HA THR 60 HA THR 60 26.929 15.229 -14.272 423 HB THR 60 HB THR 60 23.912 15.167 -14.042 424 HG1 THR 60 HG1 THR 60 25.672 17.264 -14.865 425 HG21 THR 60 HG21 THR 60 26.020 16.650 -12.467 426 HG22 THR 60 HG22 THR 60 25.054 15.293 -11.887 427 HG23 THR 60 HG23 THR 60 24.279 16.833 -12.263 428 H ASP 61 HN ASP 61 27.917 13.270 -13.772 429 HA ASP 61 HA ASP 61 26.194 11.247 -12.512 430 HB2 ASP 61 HB2 ASP 61 27.350 10.283 -14.380 431 HB3 ASP 61 HB1 ASP 61 28.886 10.967 -13.851 432 H LEU 62 HN LEU 62 26.190 11.432 -10.397 433 HA LEU 62 HA LEU 62 28.735 11.921 -9.007 434 HB2 LEU 62 HB2 LEU 62 25.871 12.138 -8.064 435 HB3 LEU 62 HB1 LEU 62 27.239 12.190 -6.972 436 HG LEU 62 HG LEU 62 26.602 14.430 -7.311 437 HD11 LEU 62 HD11 LEU 62 29.013 14.048 -7.418 438 HD12 LEU 62 HD12 LEU 62 28.524 15.435 -8.391 439 HD13 LEU 62 HD13 LEU 62 28.910 13.901 -9.173 440 HD21 LEU 62 HD21 LEU 62 26.311 15.454 -9.510 441 HD22 LEU 62 HD22 LEU 62 25.181 14.122 -9.264 442 HD23 LEU 62 HD23 LEU 62 26.606 13.895 -10.279 443 H ARG 63 HN ARG 63 27.290 9.505 -10.301 444 HA ARG 63 HA ARG 63 26.971 7.308 -10.005 445 HB2 ARG 63 HB2 ARG 63 29.425 7.593 -9.330 446 HB3 ARG 63 HB1 ARG 63 28.867 7.421 -7.672 447 HG2 ARG 63 HG2 ARG 63 29.728 5.324 -8.723 448 HG3 ARG 63 HG1 ARG 63 28.093 5.207 -8.069 449 HD2 ARG 63 HD2 ARG 63 28.453 4.145 -10.329 450 HD3 ARG 63 HD1 ARG 63 27.124 5.297 -10.226 451 HE ARG 63 HE ARG 63 28.960 6.907 -11.154 452 HH11 ARG 63 HH11 ARG 63 28.390 3.574 -12.062 453 HH12 ARG 63 HH12 ARG 63 29.006 3.772 -13.673 454 HH21 ARG 63 HH21 ARG 63 29.724 7.200 -13.272 455 HH22 ARG 63 HH22 ARG 63 29.760 5.840 -14.370 456 HA PRO 64 HA PRO 64 23.811 8.011 -6.792 457 HB2 PRO 64 HB2 PRO 64 21.858 6.685 -8.158 458 HB3 PRO 64 HB1 PRO 64 22.240 8.391 -8.416 459 HG2 PRO 64 HG2 PRO 64 23.069 6.001 -10.010 460 HG3 PRO 64 HG1 PRO 64 22.544 7.597 -10.574 461 HD2 PRO 64 HD2 PRO 64 25.147 6.867 -10.489 462 HD3 PRO 64 HD1 PRO 64 24.615 8.541 -10.232 463 H LYS 65 HN LYS 65 23.603 6.712 -5.095 464 HA LYS 65 HA LYS 65 23.113 3.904 -5.360 465 HB2 LYS 65 HB2 LYS 65 25.636 4.128 -5.599 466 HB3 LYS 65 HB1 LYS 65 25.657 4.713 -3.939 467 HG2 LYS 65 HG2 LYS 65 26.208 2.353 -4.035 468 HG3 LYS 65 HG1 LYS 65 24.684 2.603 -3.182 469 HD2 LYS 65 HD2 LYS 65 23.458 2.029 -5.231 470 HD3 LYS 65 HD1 LYS 65 24.989 1.752 -6.062 471 HE2 LYS 65 HE2 LYS 65 25.514 -0.047 -4.489 472 HE3 LYS 65 HE1 LYS 65 23.985 0.234 -3.655 473 HZ1 LYS 65 HZ1 LYS 65 24.257 -0.575 -6.499 474 HZ2 LYS 65 HZ2 LYS 65 22.799 -0.373 -5.653 475 HZ3 LYS 65 HZ3 LYS 65 23.864 -1.622 -5.222 476 H SER 66 HN SER 66 21.309 4.211 -4.134 477 HA SER 66 HA SER 66 21.161 5.835 -1.850 478 HB2 SER 66 HB2 SER 66 19.407 3.483 -2.595 479 HB3 SER 66 HB1 SER 66 18.992 4.777 -1.470 480 HG SER 66 HG SER 66 19.380 6.227 -3.338 481 H LEU 67 HN LEU 67 22.630 5.489 -0.362 482 HA LEU 67 HA LEU 67 22.534 3.334 1.464 483 HB2 LEU 67 HB2 LEU 67 23.723 2.450 -0.746 484 HB3 LEU 67 HB1 LEU 67 25.095 3.323 -0.101 485 HG LEU 67 HG LEU 67 25.118 0.893 0.413 486 HD11 LEU 67 HD11 LEU 67 26.332 2.450 1.844 487 HD12 LEU 67 HD12 LEU 67 25.684 1.096 2.771 488 HD13 LEU 67 HD13 LEU 67 24.890 2.670 2.834 489 HD21 LEU 67 HD21 LEU 67 22.720 1.543 2.119 490 HD22 LEU 67 HD22 LEU 67 23.577 0.001 2.078 491 HD23 LEU 67 HD23 LEU 67 22.710 0.569 0.649 492 H ARG 68 HN ARG 68 24.165 5.980 -0.081 493 HA ARG 68 HA ARG 68 25.673 6.697 2.292 494 HB2 ARG 68 HB2 ARG 68 25.512 7.742 -0.508 495 HB3 ARG 68 HB1 ARG 68 26.199 8.747 0.759 496 HG2 ARG 68 HG2 ARG 68 27.167 5.965 0.141 497 HG3 ARG 68 HG1 ARG 68 27.855 7.426 -0.571 498 HD2 ARG 68 HD2 ARG 68 29.219 6.827 1.291 499 HD3 ARG 68 HD1 ARG 68 28.293 8.254 1.748 500 HE ARG 68 HE ARG 68 27.660 5.515 2.638 501 HH11 ARG 68 HH11 ARG 68 27.703 8.978 3.149 502 HH12 ARG 68 HH12 ARG 68 27.108 8.871 4.785 503 HH21 ARG 68 HH21 ARG 68 26.870 5.377 4.784 504 HH22 ARG 68 HH22 ARG 68 26.652 6.824 5.716 505 H ASP 69 HN ASP 69 22.585 6.821 1.803 506 HA ASP 69 HA ASP 69 21.803 9.502 2.127 507 HB2 ASP 69 HB2 ASP 69 20.170 7.823 1.519 508 HB3 ASP 69 HB1 ASP 69 20.463 6.938 3.014 509 H ALA 70 HN ALA 70 22.313 10.823 3.717 510 HA ALA 70 HA ALA 70 23.404 9.877 6.181 511 HB1 ALA 70 HB1 ALA 70 24.179 11.957 5.181 512 HB2 ALA 70 HB2 ALA 70 23.532 12.236 6.799 513 HB3 ALA 70 HB3 ALA 70 22.575 12.664 5.380 514 H MET 71 HN MET 71 21.860 8.667 7.229 515 HA MET 71 HA MET 71 19.281 9.842 7.813 516 HB2 MET 71 HB2 MET 71 18.870 7.701 9.052 517 HB3 MET 71 HB1 MET 71 19.211 7.513 7.340 518 HG2 MET 71 HG2 MET 71 21.513 6.877 7.876 519 HG3 MET 71 HG1 MET 71 21.151 7.049 9.592 520 HE1 MET 71 HE1 MET 71 21.474 3.174 9.123 521 HE2 MET 71 HE2 MET 71 22.071 4.597 9.977 522 HE3 MET 71 HE3 MET 71 22.385 4.408 8.251 523 H VAL 72 HN VAL 72 19.631 11.558 9.099 524 HA VAL 72 HA VAL 72 20.818 11.043 11.743 525 HB VAL 72 HB VAL 72 20.992 13.513 11.956 526 HG11 VAL 72 HG11 VAL 72 22.863 13.798 10.413 527 HG12 VAL 72 HG12 VAL 72 22.333 12.384 9.503 528 HG13 VAL 72 HG13 VAL 72 22.894 12.203 11.163 529 HG21 VAL 72 HG21 VAL 72 20.074 13.504 9.082 530 HG22 VAL 72 HG22 VAL 72 20.725 14.903 9.937 531 HG23 VAL 72 HG23 VAL 72 19.203 14.179 10.460 532 H GLU 73 HN GLU 73 19.690 11.949 13.603 533 HA GLU 73 HA GLU 73 16.860 11.443 13.318 534 HB2 GLU 73 HB2 GLU 73 18.411 12.244 15.784 535 HB3 GLU 73 HB1 GLU 73 16.782 11.581 15.746 536 HG2 GLU 73 HG2 GLU 73 19.297 10.153 14.902 537 HG3 GLU 73 HG1 GLU 73 18.411 9.905 16.404 538 H ASP 74 HN ASP 74 18.824 14.160 14.522 539 HA ASP 74 HA ASP 74 16.610 15.952 13.781 540 HB2 ASP 74 HB2 ASP 74 16.736 15.672 16.267 541 HB3 ASP 74 HB1 ASP 74 18.380 16.298 16.218 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 23.649 15.103 -32.325 2 H2 GLY 1 HT2 GLY 1 23.927 16.332 -31.189 3 H3 GLY 1 HT3 GLY 1 25.139 15.916 -32.302 4 HA2 GLY 1 HA1 GLY 1 24.056 17.976 -32.942 5 HA3 GLY 1 HA2 GLY 1 23.796 16.702 -34.127 6 H SER 2 HN SER 2 22.332 18.076 -31.195 7 HA SER 2 HA SER 2 19.763 17.003 -31.755 8 HB2 SER 2 HB2 SER 2 20.508 19.271 -29.899 9 HB3 SER 2 HB1 SER 2 19.009 18.344 -29.865 10 HG SER 2 HG SER 2 21.225 17.798 -28.580 11 H HIS 3 HN HIS 3 19.205 17.622 -33.827 12 HA HIS 3 HA HIS 3 19.024 20.404 -34.545 13 HB2 HIS 3 HB2 HIS 3 17.865 19.536 -36.597 14 HB3 HIS 3 HB1 HIS 3 19.471 18.868 -36.337 15 HD1 HIS 3 HD1 HIS 3 19.670 16.360 -36.113 16 HD2 HIS 3 HD2 HIS 3 15.723 17.684 -36.115 17 HE1 HIS 3 HE1 HIS 3 18.261 14.289 -36.293 18 HE2 HIS 3 HE2 HIS 3 15.891 15.125 -36.458 19 H MET 4 HN MET 4 17.200 21.683 -34.610 20 HA MET 4 HA MET 4 14.722 20.550 -33.570 21 HB2 MET 4 HB2 MET 4 14.523 22.268 -31.835 22 HB3 MET 4 HB1 MET 4 15.949 21.270 -31.576 23 HG2 MET 4 HG2 MET 4 17.370 23.001 -32.477 24 HG3 MET 4 HG1 MET 4 15.962 23.989 -32.865 25 HE1 MET 4 HE1 MET 4 14.127 23.501 -30.311 26 HE2 MET 4 HE2 MET 4 14.379 25.092 -31.026 27 HE3 MET 4 HE3 MET 4 14.597 24.861 -29.292 28 H SER 5 HN SER 5 12.936 22.092 -33.629 29 HA SER 5 HA SER 5 13.283 24.285 -35.544 30 HB2 SER 5 HB2 SER 5 12.302 22.320 -36.716 31 HB3 SER 5 HB1 SER 5 10.984 22.304 -35.546 32 HG SER 5 HG SER 5 11.155 23.698 -37.786 33 H THR 6 HN THR 6 12.156 26.118 -35.007 34 HA THR 6 HA THR 6 10.833 26.086 -32.400 35 HB THR 6 HB THR 6 11.668 28.461 -34.080 36 HG1 THR 6 HG1 THR 6 13.017 26.919 -32.122 37 HG21 THR 6 HG21 THR 6 11.492 29.708 -31.977 38 HG22 THR 6 HG22 THR 6 10.956 28.246 -31.150 39 HG23 THR 6 HG23 THR 6 9.944 28.970 -32.399 40 H ASN 7 HN ASN 7 8.682 26.462 -32.157 41 HA ASN 7 HA ASN 7 7.084 26.643 -34.556 42 HB2 ASN 7 HB2 ASN 7 5.142 26.387 -33.088 43 HB3 ASN 7 HB1 ASN 7 6.341 25.147 -32.752 44 HD21 ASN 7 HD21 ASN 7 7.379 25.129 -30.775 45 HD22 ASN 7 HD22 ASN 7 6.878 26.121 -29.445 46 HA PRO 8 HA PRO 8 6.946 31.014 -34.463 47 HB2 PRO 8 HB2 PRO 8 5.099 31.455 -36.347 48 HB3 PRO 8 HB1 PRO 8 6.655 30.711 -36.741 49 HG2 PRO 8 HG2 PRO 8 3.990 29.410 -36.315 50 HG3 PRO 8 HG1 PRO 8 5.195 29.100 -37.578 51 HD2 PRO 8 HD2 PRO 8 4.922 27.565 -35.326 52 HD3 PRO 8 HD1 PRO 8 6.445 27.742 -36.220 53 H PHE 9 HN PHE 9 5.015 29.470 -32.591 54 HA PHE 9 HA PHE 9 2.720 31.220 -32.521 55 HB2 PHE 9 HB2 PHE 9 3.637 28.996 -30.697 56 HB3 PHE 9 HB1 PHE 9 2.185 29.947 -30.410 57 HD1 PHE 9 HD2 PHE 9 0.430 29.976 -32.270 58 HD2 PHE 9 HD1 PHE 9 3.553 27.100 -32.036 59 HE1 PHE 9 HE2 PHE 9 -0.860 28.464 -33.720 60 HE2 PHE 9 HE1 PHE 9 2.274 25.586 -33.491 61 HZ PHE 9 HZ PHE 9 0.064 26.263 -34.335 62 H ASP 10 HN ASP 10 2.370 32.873 -31.140 63 HA ASP 10 HA ASP 10 4.710 33.868 -29.709 64 HB2 ASP 10 HB2 ASP 10 3.645 35.986 -29.658 65 HB3 ASP 10 HB1 ASP 10 3.310 35.327 -31.255 66 H ASP 11 HN ASP 11 2.512 31.717 -28.959 67 HA ASP 11 HA ASP 11 1.549 32.643 -26.424 68 HB2 ASP 11 HB2 ASP 11 1.823 29.776 -27.366 69 HB3 ASP 11 HB1 ASP 11 0.828 30.352 -26.034 70 H ASP 12 HN ASP 12 3.525 33.451 -25.573 71 HA ASP 12 HA ASP 12 5.709 31.603 -25.138 72 HB2 ASP 12 HB2 ASP 12 6.067 33.965 -25.864 73 HB3 ASP 12 HB1 ASP 12 5.456 34.494 -24.300 74 H ASN 13 HN ASN 13 5.063 30.146 -23.633 75 HA ASN 13 HA ASN 13 5.132 31.009 -20.895 76 HB2 ASN 13 HB2 ASN 13 2.755 31.373 -21.347 77 HB3 ASN 13 HB1 ASN 13 2.603 29.736 -21.978 78 HD21 ASN 13 HD21 ASN 13 2.471 28.017 -20.557 79 HD22 ASN 13 HD22 ASN 13 2.279 28.221 -18.844 80 H GLY 14 HN GLY 14 6.804 29.662 -20.462 81 HA2 GLY 14 HA2 GLY 14 6.316 27.043 -19.709 82 HA3 GLY 14 HA1 GLY 14 6.932 26.959 -21.343 83 H ALA 15 HN ALA 15 7.611 27.951 -18.112 84 HA ALA 15 HA ALA 15 10.448 28.265 -18.774 85 HB1 ALA 15 HB1 ALA 15 8.929 29.261 -16.371 86 HB2 ALA 15 HB2 ALA 15 9.452 30.224 -17.751 87 HB3 ALA 15 HB3 ALA 15 10.648 29.508 -16.670 88 H PHE 16 HN PHE 16 11.732 26.704 -18.313 89 HA PHE 16 HA PHE 16 11.281 25.014 -15.954 90 HB2 PHE 16 HB2 PHE 16 12.394 23.212 -17.606 91 HB3 PHE 16 HB1 PHE 16 10.650 23.438 -17.526 92 HD1 PHE 16 HD1 PHE 16 13.572 24.912 -19.257 93 HD2 PHE 16 HD2 PHE 16 9.537 23.637 -19.531 94 HE1 PHE 16 HE1 PHE 16 13.555 25.544 -21.599 95 HE2 PHE 16 HE2 PHE 16 9.499 24.251 -21.914 96 HZ PHE 16 HZ PHE 16 11.515 25.212 -22.962 97 H PHE 17 HN PHE 17 13.194 24.310 -14.940 98 HA PHE 17 HA PHE 17 15.612 25.707 -15.891 99 HB2 PHE 17 HB2 PHE 17 14.581 25.169 -13.105 100 HB3 PHE 17 HB1 PHE 17 16.293 25.444 -13.384 101 HD1 PHE 17 HD2 PHE 17 13.507 27.180 -15.116 102 HD2 PHE 17 HD1 PHE 17 16.582 27.418 -12.195 103 HE1 PHE 17 HE2 PHE 17 13.135 29.601 -14.930 104 HE2 PHE 17 HE1 PHE 17 16.221 29.844 -12.004 105 HZ PHE 17 HZ PHE 17 14.491 30.935 -13.374 106 H VAL 18 HN VAL 18 17.661 24.689 -15.245 107 HA VAL 18 HA VAL 18 17.536 21.772 -15.349 108 HB VAL 18 HB VAL 18 19.926 23.628 -15.500 109 HG11 VAL 18 HG11 VAL 18 20.544 21.456 -14.572 110 HG12 VAL 18 HG12 VAL 18 21.180 21.637 -16.207 111 HG13 VAL 18 HG13 VAL 18 19.754 20.640 -15.922 112 HG21 VAL 18 HG21 VAL 18 18.461 23.798 -17.447 113 HG22 VAL 18 HG22 VAL 18 18.524 22.050 -17.658 114 HG23 VAL 18 HG23 VAL 18 19.983 23.017 -17.870 115 H LEU 19 HN LEU 19 17.034 21.033 -13.380 116 HA LEU 19 HA LEU 19 18.377 22.224 -11.052 117 HB2 LEU 19 HB2 LEU 19 15.850 22.291 -11.250 118 HB3 LEU 19 HB1 LEU 19 15.870 20.549 -11.064 119 HG LEU 19 HG LEU 19 16.967 20.854 -8.845 120 HD11 LEU 19 HD11 LEU 19 16.866 23.082 -7.816 121 HD12 LEU 19 HD12 LEU 19 16.370 23.757 -9.366 122 HD13 LEU 19 HD13 LEU 19 17.966 23.028 -9.193 123 HD21 LEU 19 HD21 LEU 19 14.587 20.464 -8.979 124 HD22 LEU 19 HD22 LEU 19 14.296 22.184 -9.241 125 HD23 LEU 19 HD23 LEU 19 14.935 21.624 -7.696 126 H VAL 20 HN VAL 20 19.768 21.033 -9.927 127 HA VAL 20 HA VAL 20 19.738 18.114 -10.332 128 HB VAL 20 HB VAL 20 22.095 19.881 -9.630 129 HG11 VAL 20 HG11 VAL 20 23.447 17.849 -9.813 130 HG12 VAL 20 HG12 VAL 20 21.983 16.895 -10.055 131 HG13 VAL 20 HG13 VAL 20 22.256 17.717 -8.518 132 HG21 VAL 20 HG21 VAL 20 22.965 19.203 -11.817 133 HG22 VAL 20 HG22 VAL 20 21.432 20.061 -11.967 134 HG23 VAL 20 HG23 VAL 20 21.479 18.306 -12.130 135 H ASN 21 HN ASN 21 19.567 16.836 -8.597 136 HA ASN 21 HA ASN 21 19.395 18.115 -5.944 137 HB2 ASN 21 HB2 ASN 21 17.295 17.067 -6.946 138 HB3 ASN 21 HB1 ASN 21 18.103 15.513 -6.823 139 HD21 ASN 21 HD21 ASN 21 15.651 16.582 -5.600 140 HD22 ASN 21 HD22 ASN 21 15.853 16.362 -3.892 141 H ASP 22 HN ASP 22 20.220 16.802 -4.142 142 HA ASP 22 HA ASP 22 22.803 15.852 -4.597 143 HB2 ASP 22 HB2 ASP 22 22.013 16.625 -2.402 144 HB3 ASP 22 HB1 ASP 22 20.977 15.205 -2.275 145 H GLU 23 HN GLU 23 19.752 14.116 -4.376 146 HA GLU 23 HA GLU 23 21.178 11.607 -4.940 147 HB2 GLU 23 HB2 GLU 23 19.107 10.497 -4.079 148 HB3 GLU 23 HB1 GLU 23 19.971 11.452 -2.882 149 HG2 GLU 23 HG2 GLU 23 18.369 13.261 -3.149 150 HG3 GLU 23 HG1 GLU 23 17.517 12.339 -4.388 151 H ASP 24 HN ASP 24 20.187 13.771 -6.830 152 HA ASP 24 HA ASP 24 18.787 11.933 -8.650 153 HB2 ASP 24 HB2 ASP 24 17.136 13.535 -7.697 154 HB3 ASP 24 HB1 ASP 24 18.102 14.867 -8.322 155 H GLN 25 HN GLN 25 19.588 11.963 -10.727 156 HA GLN 25 HA GLN 25 22.213 13.029 -10.940 157 HB2 GLN 25 HB2 GLN 25 20.450 11.715 -13.008 158 HB3 GLN 25 HB1 GLN 25 22.147 12.102 -13.250 159 HG2 GLN 25 HG2 GLN 25 21.068 10.230 -11.156 160 HG3 GLN 25 HG1 GLN 25 21.786 9.746 -12.691 161 HE21 GLN 25 HE21 GLN 25 22.376 10.923 -9.496 162 HE22 GLN 25 HE22 GLN 25 24.099 10.787 -9.540 163 H HIS 26 HN HIS 26 19.242 13.717 -12.809 164 HA HIS 26 HA HIS 26 19.772 16.506 -12.810 165 HB2 HIS 26 HB2 HIS 26 19.996 16.751 -15.318 166 HB3 HIS 26 HB1 HIS 26 21.412 16.125 -14.487 167 HD1 HIS 26 HD1 HIS 26 22.184 13.749 -15.089 168 HD2 HIS 26 HD2 HIS 26 18.673 14.906 -17.002 169 HE1 HIS 26 HE1 HIS 26 21.806 12.053 -16.909 170 HE2 HIS 26 HE2 HIS 26 19.836 12.940 -18.215 171 H SER 27 HN SER 27 17.858 17.534 -12.932 172 HA SER 27 HA SER 27 15.686 16.174 -14.379 173 HB2 SER 27 HB2 SER 27 15.535 17.519 -11.675 174 HB3 SER 27 HB1 SER 27 14.124 17.026 -12.609 175 HG SER 27 HG SER 27 16.180 15.373 -11.534 176 H LEU 28 HN LEU 28 14.568 17.404 -15.772 177 HA LEU 28 HA LEU 28 15.018 20.262 -15.895 178 HB2 LEU 28 HB2 LEU 28 13.798 18.218 -17.625 179 HB3 LEU 28 HB1 LEU 28 12.967 19.761 -17.642 180 HG LEU 28 HG LEU 28 14.606 19.575 -19.464 181 HD11 LEU 28 HD11 LEU 28 14.065 21.768 -18.560 182 HD12 LEU 28 HD12 LEU 28 15.751 21.696 -19.069 183 HD13 LEU 28 HD13 LEU 28 15.343 21.603 -17.356 184 HD21 LEU 28 HD21 LEU 28 16.643 19.398 -17.244 185 HD22 LEU 28 HD22 LEU 28 17.000 19.590 -18.961 186 HD23 LEU 28 HD23 LEU 28 16.226 18.115 -18.381 187 H TRP 29 HN TRP 29 14.063 21.398 -14.348 188 HA TRP 29 HA TRP 29 11.476 20.456 -13.313 189 HB2 TRP 29 HB2 TRP 29 13.492 20.448 -11.794 190 HB3 TRP 29 HB1 TRP 29 13.514 22.202 -11.921 191 HD1 TRP 29 HD1 TRP 29 11.885 23.534 -10.382 192 HE1 TRP 29 HE1 TRP 29 10.191 22.874 -8.556 193 HE3 TRP 29 HE3 TRP 29 11.784 18.490 -11.173 194 HZ2 TRP 29 HZ2 TRP 29 9.000 20.516 -7.570 195 HZ3 TRP 29 HZ3 TRP 29 10.346 17.101 -9.740 196 HH2 TRP 29 HH2 TRP 29 8.984 18.095 -7.975 197 HA PRO 30 HA PRO 30 9.979 24.280 -15.117 198 HB2 PRO 30 HB2 PRO 30 7.361 23.853 -14.595 199 HB3 PRO 30 HB1 PRO 30 8.213 23.030 -15.907 200 HG2 PRO 30 HG2 PRO 30 7.517 22.031 -13.176 201 HG3 PRO 30 HG1 PRO 30 7.419 21.189 -14.734 202 HD2 PRO 30 HD2 PRO 30 9.464 20.834 -12.966 203 HD3 PRO 30 HD1 PRO 30 9.648 20.645 -14.721 204 H VAL 31 HN VAL 31 9.062 26.234 -14.343 205 HA VAL 31 HA VAL 31 9.536 26.707 -11.551 206 HB VAL 31 HB VAL 31 8.887 29.040 -12.027 207 HG11 VAL 31 HG11 VAL 31 11.184 28.334 -12.391 208 HG12 VAL 31 HG12 VAL 31 10.711 29.545 -13.580 209 HG13 VAL 31 HG13 VAL 31 10.789 27.844 -14.039 210 HG21 VAL 31 HG21 VAL 31 8.348 29.730 -14.300 211 HG22 VAL 31 HG22 VAL 31 7.146 28.592 -13.690 212 HG23 VAL 31 HG23 VAL 31 8.379 28.047 -14.829 213 H PHE 32 HN PHE 32 6.959 25.369 -13.052 214 HA PHE 32 HA PHE 32 4.973 26.554 -11.251 215 HB2 PHE 32 HB2 PHE 32 4.449 26.363 -13.705 216 HB3 PHE 32 HB1 PHE 32 4.518 24.613 -13.534 217 HD1 PHE 32 HD1 PHE 32 2.954 27.350 -11.529 218 HD2 PHE 32 HD2 PHE 32 2.422 23.694 -13.642 219 HE1 PHE 32 HE1 PHE 32 0.583 27.317 -10.870 220 HE2 PHE 32 HE2 PHE 32 0.049 23.658 -12.993 221 HZ PHE 32 HZ PHE 32 -0.871 25.471 -11.602 222 H ALA 33 HN ALA 33 7.190 24.689 -10.567 223 HA ALA 33 HA ALA 33 5.521 22.774 -9.113 224 HB1 ALA 33 HB1 ALA 33 7.136 20.994 -9.452 225 HB2 ALA 33 HB2 ALA 33 8.144 22.065 -10.424 226 HB3 ALA 33 HB3 ALA 33 6.550 21.585 -11.007 227 H ASP 34 HN ASP 34 5.915 22.793 -6.997 228 HA ASP 34 HA ASP 34 7.696 24.652 -5.859 229 HB2 ASP 34 HB2 ASP 34 7.127 23.541 -3.681 230 HB3 ASP 34 HB1 ASP 34 5.733 24.041 -4.630 231 H ILE 35 HN ILE 35 9.778 24.562 -5.512 232 HA ILE 35 HA ILE 35 11.264 22.182 -6.093 233 HB ILE 35 HB ILE 35 12.251 24.829 -5.011 234 HG12 ILE 35 HG12 ILE 35 12.064 23.818 -7.861 235 HG13 ILE 35 HG11 ILE 35 11.081 25.092 -7.150 236 HG21 ILE 35 HG21 ILE 35 13.742 22.589 -6.375 237 HG22 ILE 35 HG22 ILE 35 13.837 23.010 -4.664 238 HG23 ILE 35 HG23 ILE 35 14.427 24.138 -5.885 239 HD11 ILE 35 HD11 ILE 35 12.847 25.996 -8.555 240 HD12 ILE 35 HD12 ILE 35 14.061 25.195 -7.556 241 HD13 ILE 35 HD13 ILE 35 13.062 26.480 -6.871 242 HA PRO 36 HA PRO 36 11.356 20.669 -1.872 243 HB2 PRO 36 HB2 PRO 36 13.077 18.620 -2.333 244 HB3 PRO 36 HB1 PRO 36 11.377 18.567 -2.817 245 HG2 PRO 36 HG2 PRO 36 13.806 19.181 -4.458 246 HG3 PRO 36 HG1 PRO 36 12.403 18.175 -4.865 247 HD2 PRO 36 HD2 PRO 36 12.697 20.719 -5.749 248 HD3 PRO 36 HD1 PRO 36 11.112 19.983 -5.439 249 H ALA 37 HN ALA 37 13.683 19.447 -0.850 250 HA ALA 37 HA ALA 37 15.600 21.671 -0.799 251 HB1 ALA 37 HB1 ALA 37 14.646 21.067 1.370 252 HB2 ALA 37 HB2 ALA 37 16.380 20.750 1.323 253 HB3 ALA 37 HB3 ALA 37 15.235 19.417 1.171 254 H GLY 38 HN GLY 38 17.939 20.962 -0.475 255 HA2 GLY 38 HA2 GLY 38 19.780 19.701 -1.103 256 HA3 GLY 38 HA1 GLY 38 18.692 18.375 -1.490 257 H TRP 39 HN TRP 39 18.360 21.588 -2.803 258 HA TRP 39 HA TRP 39 18.762 20.442 -5.480 259 HB2 TRP 39 HB2 TRP 39 17.233 22.209 -6.260 260 HB3 TRP 39 HB1 TRP 39 16.478 21.187 -5.042 261 HD1 TRP 39 HD1 TRP 39 16.042 22.276 -2.618 262 HE1 TRP 39 HE1 TRP 39 15.799 24.727 -1.864 263 HE3 TRP 39 HE3 TRP 39 18.053 24.593 -6.714 264 HZ2 TRP 39 HZ2 TRP 39 16.389 27.296 -2.868 265 HZ3 TRP 39 HZ3 TRP 39 18.177 27.051 -6.734 266 HH2 TRP 39 HH2 TRP 39 17.360 28.373 -4.851 267 H ARG 40 HN ARG 40 19.877 21.589 -7.045 268 HA ARG 40 HA ARG 40 20.842 24.264 -6.414 269 HB2 ARG 40 HB2 ARG 40 22.623 21.932 -7.085 270 HB3 ARG 40 HB1 ARG 40 23.098 23.578 -7.485 271 HG2 ARG 40 HG2 ARG 40 22.442 22.557 -4.727 272 HG3 ARG 40 HG1 ARG 40 24.061 22.874 -5.361 273 HD2 ARG 40 HD2 ARG 40 23.750 25.171 -5.363 274 HD3 ARG 40 HD1 ARG 40 21.992 25.033 -5.400 275 HE ARG 40 HE ARG 40 23.379 24.131 -2.989 276 HH11 ARG 40 HH11 ARG 40 21.502 26.612 -4.595 277 HH12 ARG 40 HH12 ARG 40 20.930 27.329 -3.114 278 HH21 ARG 40 HH21 ARG 40 22.601 25.061 -1.026 279 HH22 ARG 40 HH22 ARG 40 21.549 26.442 -1.104 280 H VAL 41 HN VAL 41 20.596 25.593 -8.073 281 HA VAL 41 HA VAL 41 19.589 24.543 -10.575 282 HB VAL 41 HB VAL 41 19.996 27.408 -9.679 283 HG11 VAL 41 HG11 VAL 41 18.504 26.327 -12.069 284 HG12 VAL 41 HG12 VAL 41 20.043 27.190 -12.114 285 HG13 VAL 41 HG13 VAL 41 18.584 28.018 -11.573 286 HG21 VAL 41 HG21 VAL 41 17.498 25.720 -9.801 287 HG22 VAL 41 HG22 VAL 41 17.556 27.439 -9.408 288 HG23 VAL 41 HG23 VAL 41 18.324 26.264 -8.338 289 H VAL 42 HN VAL 42 20.924 23.982 -12.156 290 HA VAL 42 HA VAL 42 23.615 25.107 -12.239 291 HB VAL 42 HB VAL 42 22.419 22.950 -13.988 292 HG11 VAL 42 HG11 VAL 42 25.290 23.727 -13.479 293 HG12 VAL 42 HG12 VAL 42 24.386 24.021 -14.962 294 HG13 VAL 42 HG13 VAL 42 24.752 22.369 -14.465 295 HG21 VAL 42 HG21 VAL 42 22.366 22.271 -11.650 296 HG22 VAL 42 HG22 VAL 42 24.068 22.699 -11.473 297 HG23 VAL 42 HG23 VAL 42 23.601 21.364 -12.526 298 H HIS 43 HN HIS 43 20.573 25.339 -13.862 299 HA HIS 43 HA HIS 43 21.554 27.498 -15.507 300 HB2 HIS 43 HB2 HIS 43 21.970 25.217 -16.716 301 HB3 HIS 43 HB1 HIS 43 20.230 25.235 -16.981 302 HD1 HIS 43 HD1 HIS 43 19.307 27.265 -18.464 303 HD2 HIS 43 HD2 HIS 43 23.438 26.770 -18.412 304 HE1 HIS 43 HE1 HIS 43 20.180 28.583 -20.422 305 HE2 HIS 43 HE2 HIS 43 22.655 28.101 -20.484 306 H GLY 44 HN GLY 44 19.892 28.890 -16.135 307 HA2 GLY 44 HA2 GLY 44 17.345 28.471 -14.827 308 HA3 GLY 44 HA1 GLY 44 17.835 29.897 -15.723 309 H GLU 45 HN GLU 45 15.878 30.025 -16.868 310 HA GLU 45 HA GLU 45 14.945 27.660 -18.248 311 HB2 GLU 45 HB2 GLU 45 13.237 29.597 -19.108 312 HB3 GLU 45 HB1 GLU 45 12.992 28.594 -17.681 313 HG2 GLU 45 HG2 GLU 45 12.595 30.786 -16.982 314 HG3 GLU 45 HG1 GLU 45 14.193 30.348 -16.390 315 H ALA 46 HN ALA 46 16.233 27.204 -19.742 316 HA ALA 46 HA ALA 46 16.371 29.002 -22.076 317 HB1 ALA 46 HB1 ALA 46 18.401 27.789 -22.765 318 HB2 ALA 46 HB2 ALA 46 18.326 26.836 -21.284 319 HB3 ALA 46 HB3 ALA 46 18.612 28.575 -21.199 320 H SER 47 HN SER 47 16.482 27.671 -24.171 321 HA SER 47 HA SER 47 14.104 26.396 -24.576 322 HB2 SER 47 HB2 SER 47 15.920 27.186 -26.255 323 HB3 SER 47 HB1 SER 47 16.541 25.545 -26.118 324 HG SER 47 HG SER 47 14.529 26.429 -27.600 325 H ARG 48 HN ARG 48 13.251 24.430 -24.263 326 HA ARG 48 HA ARG 48 14.231 22.685 -22.359 327 HB2 ARG 48 HB2 ARG 48 11.902 22.674 -22.931 328 HB3 ARG 48 HB1 ARG 48 12.247 22.204 -24.591 329 HG2 ARG 48 HG2 ARG 48 11.410 20.304 -23.428 330 HG3 ARG 48 HG1 ARG 48 13.124 20.046 -23.734 331 HD2 ARG 48 HD2 ARG 48 12.769 19.329 -21.526 332 HD3 ARG 48 HD1 ARG 48 13.528 20.913 -21.388 333 HE ARG 48 HE ARG 48 11.217 21.780 -20.994 334 HH11 ARG 48 HH11 ARG 48 11.940 18.408 -20.412 335 HH12 ARG 48 HH12 ARG 48 10.758 18.239 -19.148 336 HH21 ARG 48 HH21 ARG 48 9.628 21.541 -19.332 337 HH22 ARG 48 HH22 ARG 48 9.460 20.003 -18.548 338 H ALA 49 HN ALA 49 14.479 22.454 -25.897 339 HA ALA 49 HA ALA 49 15.718 19.950 -26.049 340 HB1 ALA 49 HB1 ALA 49 16.460 20.634 -28.275 341 HB2 ALA 49 HB2 ALA 49 16.050 22.308 -27.899 342 HB3 ALA 49 HB3 ALA 49 14.779 21.089 -27.992 343 H ALA 50 HN ALA 50 17.160 23.189 -25.811 344 HA ALA 50 HA ALA 50 19.847 22.356 -25.918 345 HB1 ALA 50 HB1 ALA 50 19.183 24.671 -26.296 346 HB2 ALA 50 HB2 ALA 50 20.377 24.561 -25.003 347 HB3 ALA 50 HB3 ALA 50 18.676 24.810 -24.612 348 H CYS 51 HN CYS 51 17.612 22.840 -23.234 349 HA CYS 51 HA CYS 51 19.465 22.385 -21.159 350 HB2 CYS 51 HB2 CYS 51 16.468 21.994 -21.235 351 HB3 CYS 51 HB1 CYS 51 17.445 21.927 -19.772 352 HG CYS 51 HG CYS 51 16.261 24.578 -21.400 353 H LEU 52 HN LEU 52 17.221 20.185 -22.842 354 HA LEU 52 HA LEU 52 17.958 17.835 -21.486 355 HB2 LEU 52 HB2 LEU 52 16.977 18.207 -24.317 356 HB3 LEU 52 HB1 LEU 52 17.108 16.656 -23.512 357 HG LEU 52 HG LEU 52 15.309 18.925 -22.657 358 HD11 LEU 52 HD11 LEU 52 14.671 16.288 -23.964 359 HD12 LEU 52 HD12 LEU 52 14.588 17.871 -24.735 360 HD13 LEU 52 HD13 LEU 52 13.497 17.479 -23.406 361 HD21 LEU 52 HD21 LEU 52 15.595 16.119 -21.590 362 HD22 LEU 52 HD22 LEU 52 14.356 17.277 -21.110 363 HD23 LEU 52 HD23 LEU 52 16.052 17.603 -20.756 364 H ASP 53 HN ASP 53 19.219 19.321 -24.439 365 HA ASP 53 HA ASP 53 21.108 17.390 -25.124 366 HB2 ASP 53 HB2 ASP 53 20.439 19.367 -26.514 367 HB3 ASP 53 HB1 ASP 53 21.406 20.383 -25.452 368 H TYR 54 HN TYR 54 21.398 20.209 -23.013 369 HA TYR 54 HA TYR 54 24.111 19.907 -22.364 370 HB2 TYR 54 HB2 TYR 54 22.941 21.989 -21.960 371 HB3 TYR 54 HB1 TYR 54 21.855 21.201 -20.821 372 HD1 TYR 54 HD1 TYR 54 25.385 22.200 -21.364 373 HD2 TYR 54 HD2 TYR 54 22.444 20.997 -18.534 374 HE1 TYR 54 HE1 TYR 54 26.925 22.763 -19.532 375 HE2 TYR 54 HE2 TYR 54 23.976 21.558 -16.697 376 HH TYR 54 HH TYR 54 26.481 21.730 -16.396 377 H VAL 55 HN VAL 55 21.199 18.817 -20.580 378 HA VAL 55 HA VAL 55 22.689 17.818 -18.395 379 HB VAL 55 HB VAL 55 20.655 16.696 -17.651 380 HG11 VAL 55 HG11 VAL 55 19.211 18.649 -17.476 381 HG12 VAL 55 HG12 VAL 55 20.119 19.439 -18.764 382 HG13 VAL 55 HG13 VAL 55 20.904 19.075 -17.227 383 HG21 VAL 55 HG21 VAL 55 19.820 15.869 -19.787 384 HG22 VAL 55 HG22 VAL 55 19.467 17.522 -20.300 385 HG23 VAL 55 HG23 VAL 55 18.585 16.808 -18.947 386 H GLU 56 HN GLU 56 21.440 16.262 -21.305 387 HA GLU 56 HA GLU 56 22.165 13.635 -20.489 388 HB2 GLU 56 HB2 GLU 56 21.455 14.766 -23.190 389 HB3 GLU 56 HB1 GLU 56 21.668 13.049 -22.854 390 HG2 GLU 56 HG2 GLU 56 19.694 14.802 -21.420 391 HG3 GLU 56 HG1 GLU 56 19.292 13.840 -22.837 392 H LYS 57 HN LYS 57 23.732 16.086 -22.532 393 HA LYS 57 HA LYS 57 25.916 14.363 -23.226 394 HB2 LYS 57 HB2 LYS 57 25.333 17.276 -23.561 395 HB3 LYS 57 HB1 LYS 57 26.967 16.680 -23.837 396 HG2 LYS 57 HG2 LYS 57 26.325 15.381 -25.646 397 HG3 LYS 57 HG1 LYS 57 24.629 15.370 -25.163 398 HD2 LYS 57 HD2 LYS 57 25.124 16.797 -27.142 399 HD3 LYS 57 HD1 LYS 57 24.365 17.657 -25.800 400 HE2 LYS 57 HE2 LYS 57 26.547 18.526 -25.123 401 HE3 LYS 57 HE1 LYS 57 27.314 17.652 -26.451 402 HZ1 LYS 57 HZ1 LYS 57 26.115 18.961 -28.023 403 HZ2 LYS 57 HZ2 LYS 57 26.878 20.021 -26.943 404 HZ3 LYS 57 HZ3 LYS 57 25.209 19.719 -26.805 405 H ASN 58 HN ASN 58 25.200 16.360 -20.508 406 HA ASN 58 HA ASN 58 27.916 16.282 -19.515 407 HB2 ASN 58 HB2 ASN 58 25.302 17.231 -18.391 408 HB3 ASN 58 HB1 ASN 58 26.659 16.942 -17.308 409 HD21 ASN 58 HD21 ASN 58 26.886 18.141 -20.603 410 HD22 ASN 58 HD22 ASN 58 27.504 19.698 -20.181 411 H TRP 59 HN TRP 59 24.866 14.613 -18.986 412 HA TRP 59 HA TRP 59 24.330 12.602 -18.102 413 HB2 TRP 59 HB2 TRP 59 26.155 11.923 -19.743 414 HB3 TRP 59 HB1 TRP 59 27.251 11.878 -18.369 415 HD1 TRP 59 HD1 TRP 59 27.687 9.393 -17.945 416 HE1 TRP 59 HE1 TRP 59 26.231 7.292 -17.623 417 HE3 TRP 59 HE3 TRP 59 23.104 11.430 -18.941 418 HZ2 TRP 59 HZ2 TRP 59 23.499 6.604 -17.763 419 HZ3 TRP 59 HZ3 TRP 59 21.118 9.982 -18.824 420 HH2 TRP 59 HH2 TRP 59 21.314 7.620 -18.247 421 H THR 60 HN THR 60 25.435 14.851 -16.483 422 HA THR 60 HA THR 60 25.833 15.381 -14.329 423 HB THR 60 HB THR 60 25.149 12.499 -13.715 424 HG1 THR 60 HG1 THR 60 23.232 14.406 -13.246 425 HG21 THR 60 HG21 THR 60 26.223 13.659 -11.841 426 HG22 THR 60 HG22 THR 60 24.511 13.387 -11.509 427 HG23 THR 60 HG23 THR 60 25.072 14.986 -11.996 428 H ASP 61 HN ASP 61 28.016 15.694 -14.974 429 HA ASP 61 HA ASP 61 29.880 13.671 -13.929 430 HB2 ASP 61 HB2 ASP 61 30.147 14.195 -16.338 431 HB3 ASP 61 HB1 ASP 61 30.397 15.889 -15.930 432 H LEU 62 HN LEU 62 31.925 14.700 -12.972 433 HA LEU 62 HA LEU 62 30.991 16.541 -10.961 434 HB2 LEU 62 HB2 LEU 62 32.399 14.588 -10.397 435 HB3 LEU 62 HB1 LEU 62 33.725 15.313 -11.285 436 HG LEU 62 HG LEU 62 33.777 17.188 -9.707 437 HD11 LEU 62 HD11 LEU 62 32.433 17.122 -7.665 438 HD12 LEU 62 HD12 LEU 62 31.579 15.704 -8.273 439 HD13 LEU 62 HD13 LEU 62 31.420 17.254 -9.102 440 HD21 LEU 62 HD21 LEU 62 34.592 15.956 -7.755 441 HD22 LEU 62 HD22 LEU 62 35.159 15.232 -9.260 442 HD23 LEU 62 HD23 LEU 62 33.832 14.489 -8.366 443 H ARG 63 HN ARG 63 30.655 18.379 -12.196 444 HA ARG 63 HA ARG 63 33.022 19.828 -13.099 445 HB2 ARG 63 HB2 ARG 63 31.034 21.609 -13.453 446 HB3 ARG 63 HB1 ARG 63 31.413 20.367 -14.635 447 HG2 ARG 63 HG2 ARG 63 29.031 20.485 -14.292 448 HG3 ARG 63 HG1 ARG 63 29.648 18.947 -13.689 449 HD2 ARG 63 HD2 ARG 63 29.794 20.482 -11.455 450 HD3 ARG 63 HD1 ARG 63 28.379 21.173 -12.252 451 HE ARG 63 HE ARG 63 28.104 18.409 -12.326 452 HH11 ARG 63 HH11 ARG 63 28.219 20.960 -9.942 453 HH12 ARG 63 HH12 ARG 63 27.277 20.096 -8.771 454 HH21 ARG 63 HH21 ARG 63 26.864 17.258 -10.800 455 HH22 ARG 63 HH22 ARG 63 26.484 17.980 -9.264 456 HA PRO 64 HA PRO 64 33.678 22.591 -9.637 457 HB2 PRO 64 HB2 PRO 64 32.324 24.912 -10.634 458 HB3 PRO 64 HB1 PRO 64 34.059 24.611 -10.568 459 HG2 PRO 64 HG2 PRO 64 32.182 24.304 -12.822 460 HG3 PRO 64 HG1 PRO 64 33.932 24.584 -12.842 461 HD2 PRO 64 HD2 PRO 64 32.872 22.207 -13.514 462 HD3 PRO 64 HD1 PRO 64 34.420 22.324 -12.651 463 H LYS 65 HN LYS 65 32.622 22.780 -7.754 464 HA LYS 65 HA LYS 65 30.012 21.916 -7.429 465 HB2 LYS 65 HB2 LYS 65 30.165 22.553 -5.136 466 HB3 LYS 65 HB1 LYS 65 31.764 22.024 -5.625 467 HG2 LYS 65 HG2 LYS 65 30.936 24.912 -5.474 468 HG3 LYS 65 HG1 LYS 65 31.708 24.041 -4.153 469 HD2 LYS 65 HD2 LYS 65 33.670 23.641 -5.534 470 HD3 LYS 65 HD1 LYS 65 32.886 24.431 -6.904 471 HE2 LYS 65 HE2 LYS 65 33.610 25.726 -4.278 472 HE3 LYS 65 HE1 LYS 65 34.454 25.942 -5.811 473 HZ1 LYS 65 HZ1 LYS 65 32.433 26.897 -6.739 474 HZ2 LYS 65 HZ2 LYS 65 32.954 27.776 -5.387 475 HZ3 LYS 65 HZ3 LYS 65 31.644 26.714 -5.249 476 H SER 66 HN SER 66 28.053 22.850 -7.460 477 HA SER 66 HA SER 66 27.935 25.403 -8.772 478 HB2 SER 66 HB2 SER 66 25.689 23.573 -7.909 479 HB3 SER 66 HB1 SER 66 25.565 24.917 -9.047 480 HG SER 66 HG SER 66 27.429 23.571 -10.085 481 H LEU 67 HN LEU 67 28.656 26.844 -7.146 482 HA LEU 67 HA LEU 67 26.947 27.189 -4.821 483 HB2 LEU 67 HB2 LEU 67 29.515 27.566 -4.921 484 HB3 LEU 67 HB1 LEU 67 29.112 29.089 -5.685 485 HG LEU 67 HG LEU 67 29.568 29.209 -3.212 486 HD11 LEU 67 HD11 LEU 67 28.366 30.998 -4.293 487 HD12 LEU 67 HD12 LEU 67 27.670 30.682 -2.704 488 HD13 LEU 67 HD13 LEU 67 26.852 30.103 -4.153 489 HD21 LEU 67 HD21 LEU 67 27.767 28.504 -1.702 490 HD22 LEU 67 HD22 LEU 67 28.518 27.141 -2.534 491 HD23 LEU 67 HD23 LEU 67 26.944 27.738 -3.062 492 H ARG 68 HN ARG 68 25.031 27.571 -5.933 493 HA ARG 68 HA ARG 68 24.706 30.343 -6.782 494 HB2 ARG 68 HB2 ARG 68 25.045 28.935 -8.831 495 HB3 ARG 68 HB1 ARG 68 23.624 28.006 -8.376 496 HG2 ARG 68 HG2 ARG 68 22.195 29.874 -8.702 497 HG3 ARG 68 HG1 ARG 68 23.566 30.970 -8.876 498 HD2 ARG 68 HD2 ARG 68 22.905 28.696 -10.744 499 HD3 ARG 68 HD1 ARG 68 22.527 30.394 -11.036 500 HE ARG 68 HE ARG 68 25.168 30.518 -10.665 501 HH11 ARG 68 HH11 ARG 68 23.272 28.286 -12.569 502 HH12 ARG 68 HH12 ARG 68 24.488 28.077 -13.787 503 HH21 ARG 68 HH21 ARG 68 26.789 30.251 -12.265 504 HH22 ARG 68 HH22 ARG 68 26.490 29.185 -13.609 505 H ASP 69 HN ASP 69 23.458 30.940 -5.123 506 HA ASP 69 HA ASP 69 21.057 29.337 -4.568 507 HB2 ASP 69 HB2 ASP 69 22.843 28.933 -2.866 508 HB3 ASP 69 HB1 ASP 69 22.790 30.648 -2.462 509 H ALA 70 HN ALA 70 19.217 30.470 -4.299 510 HA ALA 70 HA ALA 70 19.192 33.277 -3.694 511 HB1 ALA 70 HB1 ALA 70 18.350 32.369 -6.443 512 HB2 ALA 70 HB2 ALA 70 19.773 33.340 -6.075 513 HB3 ALA 70 HB3 ALA 70 18.160 33.994 -5.790 514 H MET 71 HN MET 71 16.886 34.108 -3.785 515 HA MET 71 HA MET 71 15.154 32.102 -2.628 516 HB2 MET 71 HB2 MET 71 15.227 34.343 -1.633 517 HB3 MET 71 HB1 MET 71 14.689 35.049 -3.150 518 HG2 MET 71 HG2 MET 71 12.565 33.858 -2.954 519 HG3 MET 71 HG1 MET 71 13.103 33.152 -1.431 520 HE1 MET 71 HE1 MET 71 10.345 35.725 -0.331 521 HE2 MET 71 HE2 MET 71 10.882 34.048 -0.243 522 HE3 MET 71 HE3 MET 71 10.361 34.727 -1.785 523 H VAL 72 HN VAL 72 14.587 30.718 -4.250 524 HA VAL 72 HA VAL 72 13.024 31.874 -6.464 525 HB VAL 72 HB VAL 72 14.377 29.165 -6.429 526 HG11 VAL 72 HG11 VAL 72 13.877 29.145 -8.821 527 HG12 VAL 72 HG12 VAL 72 13.067 30.703 -8.672 528 HG13 VAL 72 HG13 VAL 72 12.403 29.284 -7.864 529 HG21 VAL 72 HG21 VAL 72 16.037 30.962 -6.428 530 HG22 VAL 72 HG22 VAL 72 15.245 31.699 -7.821 531 HG23 VAL 72 HG23 VAL 72 16.009 30.117 -7.977 532 H GLU 73 HN GLU 73 11.074 31.927 -5.379 533 HA GLU 73 HA GLU 73 9.739 29.364 -5.145 534 HB2 GLU 73 HB2 GLU 73 8.891 29.935 -2.843 535 HB3 GLU 73 HB1 GLU 73 10.594 29.511 -2.925 536 HG2 GLU 73 HG2 GLU 73 11.098 31.969 -2.970 537 HG3 GLU 73 HG1 GLU 73 9.393 32.246 -2.618 538 H ASP 74 HN ASP 74 7.462 30.345 -3.770 539 HA ASP 74 HA ASP 74 6.207 31.622 -6.020 540 HB2 ASP 74 HB2 ASP 74 4.105 31.270 -4.781 541 HB3 ASP 74 HB1 ASP 74 5.048 29.791 -4.912 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 6.188 29.035 -50.016 2 H2 GLY 1 HT2 GLY 1 5.422 28.211 -51.284 3 H3 GLY 1 HT3 GLY 1 6.525 29.456 -51.620 4 HA2 GLY 1 HA1 GLY 1 7.199 26.876 -50.313 5 HA3 GLY 1 HA2 GLY 1 7.489 27.255 -52.005 6 H SER 2 HN SER 2 8.192 28.436 -48.727 7 HA SER 2 HA SER 2 10.667 29.629 -49.770 8 HB2 SER 2 HB2 SER 2 9.320 30.056 -47.090 9 HB3 SER 2 HB1 SER 2 10.697 30.959 -47.725 10 HG SER 2 HG SER 2 8.285 31.683 -47.977 11 H HIS 3 HN HIS 3 9.965 26.726 -48.916 12 HA HIS 3 HA HIS 3 11.033 24.955 -47.977 13 HB2 HIS 3 HB2 HIS 3 13.379 26.864 -48.069 14 HB3 HIS 3 HB1 HIS 3 13.515 25.159 -47.651 15 HD1 HIS 3 HD1 HIS 3 13.277 27.465 -50.518 16 HD2 HIS 3 HD2 HIS 3 12.962 23.373 -49.827 17 HE1 HIS 3 HE1 HIS 3 13.431 26.380 -52.780 18 HE2 HIS 3 HE2 HIS 3 13.460 23.906 -52.313 19 H MET 4 HN MET 4 9.601 26.716 -46.269 20 HA MET 4 HA MET 4 11.205 26.731 -43.809 21 HB2 MET 4 HB2 MET 4 9.561 28.342 -42.940 22 HB3 MET 4 HB1 MET 4 10.311 28.910 -44.425 23 HG2 MET 4 HG2 MET 4 8.345 28.293 -45.694 24 HG3 MET 4 HG1 MET 4 7.596 27.624 -44.245 25 HE1 MET 4 HE1 MET 4 8.303 29.710 -41.992 26 HE2 MET 4 HE2 MET 4 6.694 29.034 -42.245 27 HE3 MET 4 HE3 MET 4 6.902 30.777 -42.083 28 H SER 5 HN SER 5 10.598 25.610 -42.051 29 HA SER 5 HA SER 5 8.309 23.824 -42.289 30 HB2 SER 5 HB2 SER 5 10.337 23.985 -40.044 31 HB3 SER 5 HB1 SER 5 9.248 22.646 -40.412 32 HG SER 5 HG SER 5 11.405 23.580 -42.016 33 H THR 6 HN THR 6 6.738 23.677 -40.562 34 HA THR 6 HA THR 6 6.245 26.304 -39.331 35 HB THR 6 HB THR 6 4.279 24.042 -39.763 36 HG1 THR 6 HG1 THR 6 4.667 24.775 -41.782 37 HG21 THR 6 HG21 THR 6 2.583 25.775 -39.330 38 HG22 THR 6 HG22 THR 6 3.870 26.938 -39.002 39 HG23 THR 6 HG23 THR 6 3.653 25.541 -37.946 40 H ASN 7 HN ASN 7 6.327 26.499 -37.158 41 HA ASN 7 HA ASN 7 6.662 24.046 -35.581 42 HB2 ASN 7 HB2 ASN 7 7.361 26.927 -35.006 43 HB3 ASN 7 HB1 ASN 7 7.424 25.671 -33.779 44 HD21 ASN 7 HD21 ASN 7 9.572 25.851 -33.432 45 HD22 ASN 7 HD22 ASN 7 10.777 25.379 -34.585 46 HA PRO 8 HA PRO 8 2.688 25.242 -33.791 47 HB2 PRO 8 HB2 PRO 8 1.485 22.834 -34.070 48 HB3 PRO 8 HB1 PRO 8 1.565 24.013 -35.380 49 HG2 PRO 8 HG2 PRO 8 2.935 21.448 -35.119 50 HG3 PRO 8 HG1 PRO 8 2.739 22.468 -36.552 51 HD2 PRO 8 HD2 PRO 8 5.020 22.246 -34.745 52 HD3 PRO 8 HD1 PRO 8 4.922 23.048 -36.328 53 H PHE 9 HN PHE 9 5.082 22.924 -33.079 54 HA PHE 9 HA PHE 9 4.006 22.505 -30.385 55 HB2 PHE 9 HB2 PHE 9 5.397 20.379 -32.026 56 HB3 PHE 9 HB1 PHE 9 4.700 20.185 -30.424 57 HD1 PHE 9 HD1 PHE 9 2.104 21.114 -30.446 58 HD2 PHE 9 HD2 PHE 9 4.219 19.342 -33.678 59 HE1 PHE 9 HE1 PHE 9 -0.033 20.402 -31.444 60 HE2 PHE 9 HE2 PHE 9 2.093 18.636 -34.691 61 HZ PHE 9 HZ PHE 9 -0.038 19.166 -33.573 62 H ASP 10 HN ASP 10 5.365 23.719 -29.227 63 HA ASP 10 HA ASP 10 8.186 22.935 -29.233 64 HB2 ASP 10 HB2 ASP 10 7.124 25.715 -29.597 65 HB3 ASP 10 HB1 ASP 10 8.613 25.482 -28.691 66 H ASP 11 HN ASP 11 9.219 24.153 -27.181 67 HA ASP 11 HA ASP 11 7.439 23.448 -24.974 68 HB2 ASP 11 HB2 ASP 11 10.411 23.925 -25.108 69 HB3 ASP 11 HB1 ASP 11 9.552 23.801 -23.576 70 H ASP 12 HN ASP 12 6.080 25.239 -25.240 71 HA ASP 12 HA ASP 12 7.243 27.835 -24.472 72 HB2 ASP 12 HB2 ASP 12 5.302 28.853 -25.579 73 HB3 ASP 12 HB1 ASP 12 6.173 27.800 -26.689 74 H ASN 13 HN ASN 13 5.856 25.360 -22.990 75 HA ASN 13 HA ASN 13 3.683 26.708 -21.644 76 HB2 ASN 13 HB2 ASN 13 3.559 24.285 -22.133 77 HB3 ASN 13 HB1 ASN 13 4.919 24.009 -21.046 78 HD21 ASN 13 HD21 ASN 13 3.820 22.745 -19.606 79 HD22 ASN 13 HD22 ASN 13 2.543 23.335 -18.597 80 H GLY 14 HN GLY 14 4.825 28.467 -20.732 81 HA2 GLY 14 HA2 GLY 14 5.540 29.521 -18.814 82 HA3 GLY 14 HA1 GLY 14 5.545 27.957 -18.017 83 H ALA 15 HN ALA 15 7.459 27.895 -17.023 84 HA ALA 15 HA ALA 15 9.848 28.029 -18.714 85 HB1 ALA 15 HB1 ALA 15 9.585 29.485 -16.082 86 HB2 ALA 15 HB2 ALA 15 9.637 30.237 -17.678 87 HB3 ALA 15 HB3 ALA 15 11.048 29.372 -17.062 88 H PHE 16 HN PHE 16 11.659 26.917 -17.859 89 HA PHE 16 HA PHE 16 11.155 25.071 -15.647 90 HB2 PHE 16 HB2 PHE 16 12.319 23.340 -17.322 91 HB3 PHE 16 HB1 PHE 16 10.573 23.546 -17.277 92 HD1 PHE 16 HD1 PHE 16 13.500 25.159 -18.906 93 HD2 PHE 16 HD2 PHE 16 9.519 23.721 -19.305 94 HE1 PHE 16 HE1 PHE 16 13.514 25.808 -21.257 95 HE2 PHE 16 HE2 PHE 16 9.526 24.358 -21.684 96 HZ PHE 16 HZ PHE 16 11.529 25.406 -22.668 97 H PHE 17 HN PHE 17 13.013 24.356 -14.620 98 HA PHE 17 HA PHE 17 15.534 25.580 -15.546 99 HB2 PHE 17 HB2 PHE 17 14.392 25.221 -12.793 100 HB3 PHE 17 HB1 PHE 17 16.135 25.210 -13.000 101 HD1 PHE 17 HD2 PHE 17 13.539 27.317 -14.645 102 HD2 PHE 17 HD1 PHE 17 16.896 27.148 -12.044 103 HE1 PHE 17 HE2 PHE 17 13.553 29.770 -14.512 104 HE2 PHE 17 HE1 PHE 17 16.919 29.604 -11.906 105 HZ PHE 17 HZ PHE 17 15.244 30.919 -13.144 106 H VAL 18 HN VAL 18 17.493 24.375 -14.948 107 HA VAL 18 HA VAL 18 17.070 21.487 -15.053 108 HB VAL 18 HB VAL 18 19.637 23.084 -15.227 109 HG11 VAL 18 HG11 VAL 18 20.036 20.872 -14.300 110 HG12 VAL 18 HG12 VAL 18 20.677 20.981 -15.940 111 HG13 VAL 18 HG13 VAL 18 19.159 20.132 -15.639 112 HG21 VAL 18 HG21 VAL 18 18.046 21.680 -17.372 113 HG22 VAL 18 HG22 VAL 18 19.605 22.471 -17.601 114 HG23 VAL 18 HG23 VAL 18 18.191 23.422 -17.154 115 H LEU 19 HN LEU 19 16.544 20.743 -13.098 116 HA LEU 19 HA LEU 19 18.017 21.739 -10.757 117 HB2 LEU 19 HB2 LEU 19 15.422 21.837 -11.024 118 HB3 LEU 19 HB1 LEU 19 15.489 20.127 -10.642 119 HG LEU 19 HG LEU 19 16.624 20.702 -8.507 120 HD11 LEU 19 HD11 LEU 19 17.606 22.814 -9.107 121 HD12 LEU 19 HD12 LEU 19 16.500 23.055 -7.755 122 HD13 LEU 19 HD13 LEU 19 16.012 23.515 -9.384 123 HD21 LEU 19 HD21 LEU 19 13.946 21.985 -8.973 124 HD22 LEU 19 HD22 LEU 19 14.617 21.558 -7.402 125 HD23 LEU 19 HD23 LEU 19 14.237 20.296 -8.571 126 H VAL 20 HN VAL 20 19.366 20.393 -9.724 127 HA VAL 20 HA VAL 20 19.139 17.505 -10.275 128 HB VAL 20 HB VAL 20 21.699 19.116 -10.104 129 HG11 VAL 20 HG11 VAL 20 21.322 16.156 -10.552 130 HG12 VAL 20 HG12 VAL 20 21.932 16.899 -9.073 131 HG13 VAL 20 HG13 VAL 20 22.857 17.027 -10.571 132 HG21 VAL 20 HG21 VAL 20 20.533 19.367 -12.233 133 HG22 VAL 20 HG22 VAL 20 20.449 17.613 -12.401 134 HG23 VAL 20 HG23 VAL 20 22.013 18.428 -12.430 135 H ASN 21 HN ASN 21 19.181 16.207 -8.565 136 HA ASN 21 HA ASN 21 19.863 17.328 -5.935 137 HB2 ASN 21 HB2 ASN 21 17.600 16.381 -6.124 138 HB3 ASN 21 HB1 ASN 21 18.269 14.852 -6.678 139 HD21 ASN 21 HD21 ASN 21 17.283 13.747 -4.994 140 HD22 ASN 21 HD22 ASN 21 17.855 13.845 -3.361 141 H ASP 22 HN ASP 22 21.275 16.052 -4.542 142 HA ASP 22 HA ASP 22 23.489 15.031 -6.004 143 HB2 ASP 22 HB2 ASP 22 24.629 14.865 -3.966 144 HB3 ASP 22 HB1 ASP 22 23.525 16.212 -3.721 145 H GLU 23 HN GLU 23 20.653 13.580 -4.867 146 HA GLU 23 HA GLU 23 21.823 10.903 -5.157 147 HB2 GLU 23 HB2 GLU 23 19.193 11.726 -3.902 148 HB3 GLU 23 HB1 GLU 23 19.820 10.083 -3.984 149 HG2 GLU 23 HG2 GLU 23 21.729 10.742 -2.612 150 HG3 GLU 23 HG1 GLU 23 21.098 12.386 -2.526 151 H ASP 24 HN ASP 24 20.856 12.965 -7.202 152 HA ASP 24 HA ASP 24 19.187 11.093 -8.745 153 HB2 ASP 24 HB2 ASP 24 18.014 13.240 -7.776 154 HB3 ASP 24 HB1 ASP 24 18.877 14.069 -9.064 155 H GLN 25 HN GLN 25 19.192 12.561 -11.149 156 HA GLN 25 HA GLN 25 22.081 12.799 -11.718 157 HB2 GLN 25 HB2 GLN 25 20.016 11.589 -13.571 158 HB3 GLN 25 HB1 GLN 25 21.747 11.698 -13.857 159 HG2 GLN 25 HG2 GLN 25 22.172 10.186 -12.007 160 HG3 GLN 25 HG1 GLN 25 20.444 10.099 -11.667 161 HE21 GLN 25 HE21 GLN 25 22.996 9.144 -13.809 162 HE22 GLN 25 HE22 GLN 25 22.111 7.916 -14.648 163 H HIS 26 HN HIS 26 18.860 13.461 -13.126 164 HA HIS 26 HA HIS 26 19.331 16.254 -13.127 165 HB2 HIS 26 HB2 HIS 26 19.189 16.659 -15.563 166 HB3 HIS 26 HB1 HIS 26 20.674 15.857 -15.087 167 HD1 HIS 26 HD1 HIS 26 17.291 14.939 -16.608 168 HD2 HIS 26 HD2 HIS 26 21.266 13.704 -16.605 169 HE1 HIS 26 HE1 HIS 26 17.447 13.147 -18.357 170 HE2 HIS 26 HE2 HIS 26 19.905 12.630 -18.532 171 H SER 27 HN SER 27 17.465 17.429 -13.406 172 HA SER 27 HA SER 27 15.101 16.081 -14.416 173 HB2 SER 27 HB2 SER 27 15.188 17.278 -11.635 174 HB3 SER 27 HB1 SER 27 13.770 16.588 -12.423 175 HG SER 27 HG SER 27 15.829 14.840 -12.474 176 H LEU 28 HN LEU 28 14.005 17.453 -15.668 177 HA LEU 28 HA LEU 28 14.586 20.291 -15.542 178 HB2 LEU 28 HB2 LEU 28 13.119 18.510 -17.438 179 HB3 LEU 28 HB1 LEU 28 12.704 20.212 -17.416 180 HG LEU 28 HG LEU 28 14.362 19.655 -19.172 181 HD11 LEU 28 HD11 LEU 28 15.413 21.428 -16.974 182 HD12 LEU 28 HD12 LEU 28 14.289 21.901 -18.247 183 HD13 LEU 28 HD13 LEU 28 15.943 21.442 -18.656 184 HD21 LEU 28 HD21 LEU 28 16.137 18.960 -16.835 185 HD22 LEU 28 HD22 LEU 28 16.668 19.127 -18.510 186 HD23 LEU 28 HD23 LEU 28 15.538 17.846 -18.064 187 H TRP 29 HN TRP 29 13.595 21.485 -14.103 188 HA TRP 29 HA TRP 29 11.000 20.572 -13.069 189 HB2 TRP 29 HB2 TRP 29 12.863 20.546 -11.458 190 HB3 TRP 29 HB1 TRP 29 13.128 22.262 -11.740 191 HD1 TRP 29 HD1 TRP 29 11.877 23.877 -10.188 192 HE1 TRP 29 HE1 TRP 29 9.990 23.663 -8.446 193 HE3 TRP 29 HE3 TRP 29 10.598 19.002 -10.987 194 HZ2 TRP 29 HZ2 TRP 29 8.217 21.670 -7.517 195 HZ3 TRP 29 HZ3 TRP 29 8.804 18.010 -9.634 196 HH2 TRP 29 HH2 TRP 29 7.637 19.316 -7.934 197 HA PRO 30 HA PRO 30 9.412 24.336 -14.960 198 HB2 PRO 30 HB2 PRO 30 6.868 23.413 -13.826 199 HB3 PRO 30 HB1 PRO 30 7.310 23.669 -15.514 200 HG2 PRO 30 HG2 PRO 30 6.931 21.203 -14.497 201 HG3 PRO 30 HG1 PRO 30 8.129 21.527 -15.766 202 HD2 PRO 30 HD2 PRO 30 8.539 21.176 -12.817 203 HD3 PRO 30 HD1 PRO 30 9.504 20.543 -14.170 204 H VAL 31 HN VAL 31 8.991 26.319 -14.138 205 HA VAL 31 HA VAL 31 9.421 26.660 -11.321 206 HB VAL 31 HB VAL 31 9.393 29.052 -11.764 207 HG11 VAL 31 HG11 VAL 31 10.889 27.501 -13.873 208 HG12 VAL 31 HG12 VAL 31 11.440 27.835 -12.230 209 HG13 VAL 31 HG13 VAL 31 11.236 29.157 -13.379 210 HG21 VAL 31 HG21 VAL 31 7.562 29.141 -13.363 211 HG22 VAL 31 HG22 VAL 31 8.550 28.305 -14.561 212 HG23 VAL 31 HG23 VAL 31 8.999 29.923 -14.020 213 H PHE 32 HN PHE 32 6.689 25.947 -13.001 214 HA PHE 32 HA PHE 32 4.771 27.632 -11.760 215 HB2 PHE 32 HB2 PHE 32 4.256 26.370 -13.801 216 HB3 PHE 32 HB1 PHE 32 4.441 24.855 -12.924 217 HD1 PHE 32 HD1 PHE 32 2.440 27.988 -12.970 218 HD2 PHE 32 HD2 PHE 32 2.614 23.871 -11.899 219 HE1 PHE 32 HE1 PHE 32 0.052 28.043 -12.373 220 HE2 PHE 32 HE2 PHE 32 0.230 23.921 -11.302 221 HZ PHE 32 HZ PHE 32 -1.056 26.009 -11.539 222 H ALA 33 HN ALA 33 6.319 24.632 -10.873 223 HA ALA 33 HA ALA 33 4.801 24.550 -8.359 224 HB1 ALA 33 HB1 ALA 33 6.623 22.475 -9.585 225 HB2 ALA 33 HB2 ALA 33 4.860 22.452 -9.616 226 HB3 ALA 33 HB3 ALA 33 5.716 22.294 -8.083 227 H ASP 34 HN ASP 34 5.839 24.753 -6.395 228 HA ASP 34 HA ASP 34 8.237 26.315 -6.501 229 HB2 ASP 34 HB2 ASP 34 6.424 26.700 -4.817 230 HB3 ASP 34 HB1 ASP 34 6.886 25.188 -4.039 231 H ILE 35 HN ILE 35 10.261 25.806 -5.721 232 HA ILE 35 HA ILE 35 11.080 23.166 -6.343 233 HB ILE 35 HB ILE 35 12.662 25.407 -5.073 234 HG12 ILE 35 HG12 ILE 35 12.361 24.604 -7.977 235 HG13 ILE 35 HG11 ILE 35 11.683 26.048 -7.232 236 HG21 ILE 35 HG21 ILE 35 13.733 23.240 -4.780 237 HG22 ILE 35 HG22 ILE 35 14.632 24.237 -5.918 238 HG23 ILE 35 HG23 ILE 35 13.607 22.934 -6.509 239 HD11 ILE 35 HD11 ILE 35 14.619 25.441 -7.507 240 HD12 ILE 35 HD12 ILE 35 13.916 26.908 -6.826 241 HD13 ILE 35 HD13 ILE 35 13.690 26.532 -8.534 242 HA PRO 36 HA PRO 36 10.800 21.313 -2.249 243 HB2 PRO 36 HB2 PRO 36 12.355 19.151 -2.833 244 HB3 PRO 36 HB1 PRO 36 10.644 19.264 -3.272 245 HG2 PRO 36 HG2 PRO 36 13.075 19.735 -4.946 246 HG3 PRO 36 HG1 PRO 36 11.562 18.920 -5.375 247 HD2 PRO 36 HD2 PRO 36 12.109 21.453 -6.131 248 HD3 PRO 36 HD1 PRO 36 10.459 20.907 -5.769 249 H ALA 37 HN ALA 37 12.758 19.869 -1.084 250 HA ALA 37 HA ALA 37 14.990 21.754 -0.819 251 HB1 ALA 37 HB1 ALA 37 15.509 20.585 1.253 252 HB2 ALA 37 HB2 ALA 37 14.251 19.395 0.917 253 HB3 ALA 37 HB3 ALA 37 13.815 21.074 1.236 254 H GLY 38 HN GLY 38 17.181 20.607 -0.356 255 HA2 GLY 38 HA2 GLY 38 18.885 19.249 -1.112 256 HA3 GLY 38 HA1 GLY 38 17.661 18.080 -1.587 257 H TRP 39 HN TRP 39 17.767 21.374 -2.736 258 HA TRP 39 HA TRP 39 17.863 20.313 -5.459 259 HB2 TRP 39 HB2 TRP 39 16.978 22.583 -6.057 260 HB3 TRP 39 HB1 TRP 39 15.928 21.647 -4.999 261 HD1 TRP 39 HD1 TRP 39 15.683 22.467 -2.462 262 HE1 TRP 39 HE1 TRP 39 16.123 24.746 -1.338 263 HE3 TRP 39 HE3 TRP 39 18.483 24.654 -6.142 264 HZ2 TRP 39 HZ2 TRP 39 17.479 27.150 -1.945 265 HZ3 TRP 39 HZ3 TRP 39 19.310 26.943 -5.793 266 HH2 TRP 39 HH2 TRP 39 18.818 28.166 -3.739 267 H ARG 40 HN ARG 40 19.161 21.223 -7.062 268 HA ARG 40 HA ARG 40 20.907 23.442 -6.391 269 HB2 ARG 40 HB2 ARG 40 21.983 20.965 -6.118 270 HB3 ARG 40 HB1 ARG 40 22.286 21.244 -7.829 271 HG2 ARG 40 HG2 ARG 40 24.192 21.937 -6.512 272 HG3 ARG 40 HG1 ARG 40 23.433 23.346 -7.263 273 HD2 ARG 40 HD2 ARG 40 22.167 23.666 -5.114 274 HD3 ARG 40 HD1 ARG 40 23.197 22.424 -4.407 275 HE ARG 40 HE ARG 40 25.076 24.020 -5.147 276 HH11 ARG 40 HH11 ARG 40 21.925 24.954 -3.953 277 HH12 ARG 40 HH12 ARG 40 22.456 26.497 -3.352 278 HH21 ARG 40 HH21 ARG 40 25.804 26.038 -4.321 279 HH22 ARG 40 HH22 ARG 40 24.663 27.103 -3.551 280 H VAL 41 HN VAL 41 20.927 24.829 -8.059 281 HA VAL 41 HA VAL 41 19.576 24.016 -10.510 282 HB VAL 41 HB VAL 41 20.441 26.776 -9.617 283 HG11 VAL 41 HG11 VAL 41 18.640 25.902 -11.872 284 HG12 VAL 41 HG12 VAL 41 20.242 26.624 -12.030 285 HG13 VAL 41 HG13 VAL 41 18.908 27.571 -11.367 286 HG21 VAL 41 HG21 VAL 41 18.759 25.841 -8.120 287 HG22 VAL 41 HG22 VAL 41 17.731 25.455 -9.499 288 HG23 VAL 41 HG23 VAL 41 18.070 27.138 -9.099 289 H VAL 42 HN VAL 42 20.753 23.323 -12.161 290 HA VAL 42 HA VAL 42 23.555 24.116 -12.379 291 HB VAL 42 HB VAL 42 22.017 22.152 -14.097 292 HG11 VAL 42 HG11 VAL 42 24.246 21.310 -14.696 293 HG12 VAL 42 HG12 VAL 42 24.978 22.609 -13.754 294 HG13 VAL 42 HG13 VAL 42 24.017 22.989 -15.183 295 HG21 VAL 42 HG21 VAL 42 23.774 21.635 -11.698 296 HG22 VAL 42 HG22 VAL 42 23.066 20.403 -12.740 297 HG23 VAL 42 HG23 VAL 42 22.023 21.435 -11.764 298 H HIS 43 HN HIS 43 20.484 24.655 -13.922 299 HA HIS 43 HA HIS 43 21.618 26.724 -15.588 300 HB2 HIS 43 HB2 HIS 43 21.781 24.389 -16.777 301 HB3 HIS 43 HB1 HIS 43 20.051 24.593 -17.013 302 HD1 HIS 43 HD1 HIS 43 23.366 25.854 -18.137 303 HD2 HIS 43 HD2 HIS 43 19.333 26.556 -18.901 304 HE1 HIS 43 HE1 HIS 43 23.300 27.201 -20.261 305 HE2 HIS 43 HE2 HIS 43 20.871 27.780 -20.596 306 H GLY 44 HN GLY 44 20.037 28.230 -16.231 307 HA2 GLY 44 HA2 GLY 44 17.557 28.037 -14.732 308 HA3 GLY 44 HA1 GLY 44 18.127 29.434 -15.632 309 H GLU 45 HN GLU 45 16.196 29.820 -16.696 310 HA GLU 45 HA GLU 45 14.917 27.627 -18.085 311 HB2 GLU 45 HB2 GLU 45 13.599 29.932 -18.875 312 HB3 GLU 45 HB1 GLU 45 13.106 28.817 -17.607 313 HG2 GLU 45 HG2 GLU 45 13.054 30.923 -16.612 314 HG3 GLU 45 HG1 GLU 45 14.549 30.160 -16.062 315 H ALA 46 HN ALA 46 16.131 27.007 -19.629 316 HA ALA 46 HA ALA 46 16.286 28.764 -21.983 317 HB1 ALA 46 HB1 ALA 46 18.344 27.625 -22.677 318 HB2 ALA 46 HB2 ALA 46 18.331 26.681 -21.189 319 HB3 ALA 46 HB3 ALA 46 18.558 28.429 -21.122 320 H SER 47 HN SER 47 16.219 27.494 -24.027 321 HA SER 47 HA SER 47 13.961 26.084 -24.341 322 HB2 SER 47 HB2 SER 47 16.505 25.524 -25.874 323 HB3 SER 47 HB1 SER 47 14.857 25.251 -26.440 324 HG SER 47 HG SER 47 14.505 27.440 -26.489 325 H ARG 48 HN ARG 48 13.158 24.140 -23.909 326 HA ARG 48 HA ARG 48 14.241 22.485 -21.986 327 HB2 ARG 48 HB2 ARG 48 11.854 22.603 -22.606 328 HB3 ARG 48 HB1 ARG 48 12.205 21.763 -24.106 329 HG2 ARG 48 HG2 ARG 48 12.861 20.486 -21.483 330 HG3 ARG 48 HG1 ARG 48 11.208 20.467 -22.101 331 HD2 ARG 48 HD2 ARG 48 13.660 19.383 -23.484 332 HD3 ARG 48 HD1 ARG 48 12.371 18.437 -22.740 333 HE ARG 48 HE ARG 48 11.177 20.079 -24.648 334 HH11 ARG 48 HH11 ARG 48 13.535 17.496 -24.574 335 HH12 ARG 48 HH12 ARG 48 13.136 16.897 -26.150 336 HH21 ARG 48 HH21 ARG 48 10.609 19.280 -26.704 337 HH22 ARG 48 HH22 ARG 48 11.440 17.898 -27.361 338 H ALA 49 HN ALA 49 14.172 21.965 -25.513 339 HA ALA 49 HA ALA 49 15.475 19.502 -25.582 340 HB1 ALA 49 HB1 ALA 49 15.573 21.715 -27.624 341 HB2 ALA 49 HB2 ALA 49 14.346 20.453 -27.516 342 HB3 ALA 49 HB3 ALA 49 16.013 20.032 -27.908 343 H ALA 50 HN ALA 50 16.803 22.765 -25.428 344 HA ALA 50 HA ALA 50 19.506 21.963 -25.908 345 HB1 ALA 50 HB1 ALA 50 20.090 24.249 -25.290 346 HB2 ALA 50 HB2 ALA 50 18.449 24.520 -24.709 347 HB3 ALA 50 HB3 ALA 50 18.739 24.225 -26.423 348 H CYS 51 HN CYS 51 17.530 22.497 -23.045 349 HA CYS 51 HA CYS 51 19.639 22.267 -21.162 350 HB2 CYS 51 HB2 CYS 51 16.664 21.814 -20.882 351 HB3 CYS 51 HB1 CYS 51 17.790 21.824 -19.529 352 HG CYS 51 HG CYS 51 16.363 24.371 -21.106 353 H LEU 52 HN LEU 52 17.238 19.931 -22.377 354 HA LEU 52 HA LEU 52 18.229 17.646 -21.119 355 HB2 LEU 52 HB2 LEU 52 16.675 18.167 -23.596 356 HB3 LEU 52 HB1 LEU 52 17.427 16.593 -23.448 357 HG LEU 52 HG LEU 52 16.218 16.226 -21.328 358 HD11 LEU 52 HD11 LEU 52 14.383 17.728 -20.717 359 HD12 LEU 52 HD12 LEU 52 14.881 18.844 -21.988 360 HD13 LEU 52 HD13 LEU 52 15.949 18.533 -20.620 361 HD21 LEU 52 HD21 LEU 52 14.487 16.957 -23.683 362 HD22 LEU 52 HD22 LEU 52 14.018 15.909 -22.343 363 HD23 LEU 52 HD23 LEU 52 15.314 15.419 -23.435 364 H ASP 53 HN ASP 53 19.096 19.069 -24.247 365 HA ASP 53 HA ASP 53 21.021 17.245 -25.065 366 HB2 ASP 53 HB2 ASP 53 20.172 19.028 -26.499 367 HB3 ASP 53 HB1 ASP 53 20.916 20.247 -25.473 368 H TYR 54 HN TYR 54 21.421 20.179 -23.110 369 HA TYR 54 HA TYR 54 24.184 20.058 -22.790 370 HB2 TYR 54 HB2 TYR 54 22.845 22.041 -22.227 371 HB3 TYR 54 HB1 TYR 54 22.120 21.173 -20.878 372 HD1 TYR 54 HD1 TYR 54 25.294 22.566 -22.168 373 HD2 TYR 54 HD2 TYR 54 23.221 21.044 -18.774 374 HE1 TYR 54 HE1 TYR 54 27.127 23.316 -20.717 375 HE2 TYR 54 HE2 TYR 54 25.057 21.787 -17.318 376 HH TYR 54 HH TYR 54 27.595 22.222 -17.655 377 H VAL 55 HN VAL 55 21.625 18.782 -20.632 378 HA VAL 55 HA VAL 55 23.524 17.859 -18.720 379 HB VAL 55 HB VAL 55 21.656 16.688 -17.636 380 HG11 VAL 55 HG11 VAL 55 20.320 18.685 -17.122 381 HG12 VAL 55 HG12 VAL 55 21.043 19.505 -18.507 382 HG13 VAL 55 HG13 VAL 55 22.052 19.022 -17.144 383 HG21 VAL 55 HG21 VAL 55 19.992 17.677 -19.953 384 HG22 VAL 55 HG22 VAL 55 19.382 16.882 -18.504 385 HG23 VAL 55 HG23 VAL 55 20.409 15.996 -19.628 386 H GLU 56 HN GLU 56 21.798 16.289 -21.365 387 HA GLU 56 HA GLU 56 22.531 13.646 -20.618 388 HB2 GLU 56 HB2 GLU 56 21.499 14.819 -23.194 389 HB3 GLU 56 HB1 GLU 56 21.772 13.097 -22.957 390 HG2 GLU 56 HG2 GLU 56 20.067 14.612 -21.041 391 HG3 GLU 56 HG1 GLU 56 19.406 14.101 -22.592 392 H LYS 57 HN LYS 57 23.909 16.011 -22.866 393 HA LYS 57 HA LYS 57 25.857 14.194 -23.896 394 HB2 LYS 57 HB2 LYS 57 25.632 17.194 -23.969 395 HB3 LYS 57 HB1 LYS 57 26.968 16.324 -24.712 396 HG2 LYS 57 HG2 LYS 57 25.493 15.204 -26.215 397 HG3 LYS 57 HG1 LYS 57 24.076 15.845 -25.383 398 HD2 LYS 57 HD2 LYS 57 24.477 17.086 -27.420 399 HD3 LYS 57 HD1 LYS 57 24.755 18.119 -26.019 400 HE2 LYS 57 HE2 LYS 57 27.176 17.702 -26.239 401 HE3 LYS 57 HE1 LYS 57 26.859 16.746 -27.686 402 HZ1 LYS 57 HZ1 LYS 57 25.832 18.739 -28.676 403 HZ2 LYS 57 HZ2 LYS 57 27.478 18.964 -28.316 404 HZ3 LYS 57 HZ3 LYS 57 26.294 19.639 -27.314 405 H ASN 58 HN ASN 58 25.636 16.002 -21.009 406 HA ASN 58 HA ASN 58 28.519 15.922 -20.588 407 HB2 ASN 58 HB2 ASN 58 26.257 17.330 -19.256 408 HB3 ASN 58 HB1 ASN 58 27.705 16.997 -18.313 409 HD21 ASN 58 HD21 ASN 58 26.379 18.747 -21.010 410 HD22 ASN 58 HD22 ASN 58 27.720 19.824 -21.219 411 H TRP 59 HN TRP 59 25.537 14.652 -19.075 412 HA TRP 59 HA TRP 59 27.062 12.342 -18.244 413 HB2 TRP 59 HB2 TRP 59 26.456 12.452 -15.883 414 HB3 TRP 59 HB1 TRP 59 27.418 13.847 -16.342 415 HD1 TRP 59 HD1 TRP 59 23.976 12.862 -15.075 416 HE1 TRP 59 HE1 TRP 59 22.699 14.975 -14.347 417 HE3 TRP 59 HE3 TRP 59 27.202 16.413 -16.839 418 HZ2 TRP 59 HZ2 TRP 59 23.011 17.769 -14.510 419 HZ3 TRP 59 HZ3 TRP 59 26.639 18.784 -16.509 420 HH2 TRP 59 HH2 TRP 59 24.586 19.448 -15.368 421 H THR 60 HN THR 60 25.930 10.652 -18.771 422 HA THR 60 HA THR 60 23.001 10.818 -18.795 423 HB THR 60 HB THR 60 23.414 8.529 -20.084 424 HG1 THR 60 HG1 THR 60 25.727 10.024 -20.819 425 HG21 THR 60 HG21 THR 60 23.387 9.790 -22.204 426 HG22 THR 60 HG22 THR 60 23.774 11.265 -21.316 427 HG23 THR 60 HG23 THR 60 22.242 10.436 -21.029 428 H ASP 61 HN ASP 61 25.661 8.627 -17.921 429 HA ASP 61 HA ASP 61 23.847 7.358 -15.977 430 HB2 ASP 61 HB2 ASP 61 24.444 5.826 -17.806 431 HB3 ASP 61 HB1 ASP 61 26.154 6.090 -17.473 432 H LEU 62 HN LEU 62 24.782 6.677 -13.976 433 HA LEU 62 HA LEU 62 26.859 8.536 -13.128 434 HB2 LEU 62 HB2 LEU 62 24.944 6.815 -11.568 435 HB3 LEU 62 HB1 LEU 62 26.166 7.834 -10.830 436 HG LEU 62 HG LEU 62 23.821 8.759 -12.490 437 HD11 LEU 62 HD11 LEU 62 24.479 9.131 -9.572 438 HD12 LEU 62 HD12 LEU 62 23.232 8.069 -10.224 439 HD13 LEU 62 HD13 LEU 62 23.092 9.816 -10.419 440 HD21 LEU 62 HD21 LEU 62 25.786 10.148 -12.913 441 HD22 LEU 62 HD22 LEU 62 25.998 10.379 -11.177 442 HD23 LEU 62 HD23 LEU 62 24.570 11.023 -11.985 443 H ARG 63 HN ARG 63 27.591 6.177 -14.659 444 HA ARG 63 HA ARG 63 28.869 4.236 -13.120 445 HB2 ARG 63 HB2 ARG 63 28.659 4.456 -15.697 446 HB3 ARG 63 HB1 ARG 63 30.097 5.457 -15.596 447 HG2 ARG 63 HG2 ARG 63 29.975 2.634 -14.567 448 HG3 ARG 63 HG1 ARG 63 30.474 3.057 -16.202 449 HD2 ARG 63 HD2 ARG 63 32.300 4.414 -15.288 450 HD3 ARG 63 HD1 ARG 63 31.797 3.991 -13.654 451 HE ARG 63 HE ARG 63 32.557 1.857 -15.512 452 HH11 ARG 63 HH11 ARG 63 33.230 3.733 -12.636 453 HH12 ARG 63 HH12 ARG 63 34.420 2.623 -12.027 454 HH21 ARG 63 HH21 ARG 63 34.157 0.410 -14.745 455 HH22 ARG 63 HH22 ARG 63 34.950 0.737 -13.226 456 HA PRO 64 HA PRO 64 31.307 6.568 -10.277 457 HB2 PRO 64 HB2 PRO 64 33.234 4.380 -10.985 458 HB3 PRO 64 HB1 PRO 64 32.853 5.067 -9.399 459 HG2 PRO 64 HG2 PRO 64 31.742 2.775 -10.221 460 HG3 PRO 64 HG1 PRO 64 30.843 3.945 -9.242 461 HD2 PRO 64 HD2 PRO 64 30.500 3.217 -12.070 462 HD3 PRO 64 HD1 PRO 64 29.366 4.023 -10.970 463 H LYS 65 HN LYS 65 32.099 8.430 -10.872 464 HA LYS 65 HA LYS 65 34.060 8.563 -13.057 465 HB2 LYS 65 HB2 LYS 65 31.936 9.859 -13.296 466 HB3 LYS 65 HB1 LYS 65 32.386 10.789 -11.874 467 HG2 LYS 65 HG2 LYS 65 32.890 12.009 -13.909 468 HG3 LYS 65 HG1 LYS 65 34.372 11.611 -13.037 469 HD2 LYS 65 HD2 LYS 65 34.658 11.222 -15.420 470 HD3 LYS 65 HD1 LYS 65 34.720 9.695 -14.536 471 HE2 LYS 65 HE2 LYS 65 32.278 9.411 -15.084 472 HE3 LYS 65 HE1 LYS 65 32.436 10.799 -16.159 473 HZ1 LYS 65 HZ1 LYS 65 33.997 8.284 -16.359 474 HZ2 LYS 65 HZ2 LYS 65 34.106 9.603 -17.419 475 HZ3 LYS 65 HZ3 LYS 65 32.676 8.694 -17.336 476 H SER 66 HN SER 66 33.415 9.441 -9.726 477 HA SER 66 HA SER 66 36.117 10.552 -9.477 478 HB2 SER 66 HB2 SER 66 34.195 11.861 -8.559 479 HB3 SER 66 HB1 SER 66 33.860 10.530 -7.453 480 HG SER 66 HG SER 66 35.693 12.518 -7.253 481 H LEU 67 HN LEU 67 37.573 8.954 -9.167 482 HA LEU 67 HA LEU 67 36.778 6.515 -7.849 483 HB2 LEU 67 HB2 LEU 67 38.276 6.494 -9.818 484 HB3 LEU 67 HB1 LEU 67 39.494 7.329 -8.872 485 HG LEU 67 HG LEU 67 39.588 5.397 -7.326 486 HD11 LEU 67 HD11 LEU 67 37.320 4.553 -7.693 487 HD12 LEU 67 HD12 LEU 67 38.531 3.298 -7.947 488 HD13 LEU 67 HD13 LEU 67 37.765 4.076 -9.331 489 HD21 LEU 67 HD21 LEU 67 40.741 3.876 -8.871 490 HD22 LEU 67 HD22 LEU 67 41.187 5.561 -9.139 491 HD23 LEU 67 HD23 LEU 67 40.059 4.762 -10.236 492 H ARG 68 HN ARG 68 36.278 7.434 -5.821 493 HA ARG 68 HA ARG 68 38.663 7.609 -4.121 494 HB2 ARG 68 HB2 ARG 68 37.226 9.070 -2.582 495 HB3 ARG 68 HB1 ARG 68 37.872 9.821 -4.034 496 HG2 ARG 68 HG2 ARG 68 35.781 9.786 -5.109 497 HG3 ARG 68 HG1 ARG 68 35.102 8.677 -3.916 498 HD2 ARG 68 HD2 ARG 68 34.364 11.051 -3.672 499 HD3 ARG 68 HD1 ARG 68 35.105 10.357 -2.234 500 HE ARG 68 HE ARG 68 37.162 11.612 -3.556 501 HH11 ARG 68 HH11 ARG 68 34.022 12.582 -2.332 502 HH12 ARG 68 HH12 ARG 68 34.541 14.192 -1.932 503 HH21 ARG 68 HH21 ARG 68 37.844 13.723 -3.002 504 HH22 ARG 68 HH22 ARG 68 36.709 14.825 -2.284 505 H ASP 69 HN ASP 69 38.748 5.865 -2.912 506 HA ASP 69 HA ASP 69 36.386 4.261 -2.487 507 HB2 ASP 69 HB2 ASP 69 38.603 3.239 -2.960 508 HB3 ASP 69 HB1 ASP 69 39.182 3.847 -1.412 509 H ALA 70 HN ALA 70 35.152 5.711 -1.270 510 HA ALA 70 HA ALA 70 35.643 5.501 1.580 511 HB1 ALA 70 HB1 ALA 70 36.762 7.619 0.948 512 HB2 ALA 70 HB2 ALA 70 35.394 7.867 2.033 513 HB3 ALA 70 HB3 ALA 70 35.227 8.212 0.313 514 H MET 71 HN MET 71 33.817 4.224 1.673 515 HA MET 71 HA MET 71 31.309 5.266 0.630 516 HB2 MET 71 HB2 MET 71 31.853 2.855 0.423 517 HB3 MET 71 HB1 MET 71 31.840 2.719 2.177 518 HG2 MET 71 HG2 MET 71 29.766 1.911 1.173 519 HG3 MET 71 HG1 MET 71 29.494 3.291 2.237 520 HE1 MET 71 HE1 MET 71 27.411 2.158 0.026 521 HE2 MET 71 HE2 MET 71 26.786 3.678 -0.614 522 HE3 MET 71 HE3 MET 71 27.047 3.490 1.119 523 H VAL 72 HN VAL 72 30.479 6.864 1.792 524 HA VAL 72 HA VAL 72 30.576 6.715 4.716 525 HB VAL 72 HB VAL 72 29.688 9.032 2.976 526 HG11 VAL 72 HG11 VAL 72 30.335 8.903 5.922 527 HG12 VAL 72 HG12 VAL 72 28.726 9.064 5.221 528 HG13 VAL 72 HG13 VAL 72 29.907 10.357 5.021 529 HG21 VAL 72 HG21 VAL 72 32.334 8.571 4.358 530 HG22 VAL 72 HG22 VAL 72 31.856 10.038 3.503 531 HG23 VAL 72 HG23 VAL 72 32.050 8.526 2.619 532 H GLU 73 HN GLU 73 28.978 5.339 5.278 533 HA GLU 73 HA GLU 73 26.309 5.699 4.152 534 HB2 GLU 73 HB2 GLU 73 27.389 3.611 6.059 535 HB3 GLU 73 HB1 GLU 73 25.770 3.616 5.370 536 HG2 GLU 73 HG2 GLU 73 26.713 3.382 3.134 537 HG3 GLU 73 HG1 GLU 73 28.340 3.409 3.809 538 H ASP 74 HN ASP 74 24.624 5.088 6.122 539 HA ASP 74 HA ASP 74 24.915 7.368 7.919 540 HB2 ASP 74 HB2 ASP 74 22.799 7.142 6.658 541 HB3 ASP 74 HB1 ASP 74 22.511 5.590 7.441 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 13.942 4.952 -33.596 2 H2 GLY 1 HT2 GLY 1 14.557 6.392 -34.244 3 H3 GLY 1 HT3 GLY 1 13.116 6.413 -33.348 4 HA2 GLY 1 HA1 GLY 1 15.785 5.690 -32.266 5 HA3 GLY 1 HA2 GLY 1 15.007 7.256 -32.060 6 H SER 2 HN SER 2 15.709 5.986 -29.820 7 HA SER 2 HA SER 2 13.749 4.312 -28.691 8 HB2 SER 2 HB2 SER 2 15.547 6.314 -27.299 9 HB3 SER 2 HB1 SER 2 14.711 4.965 -26.528 10 HG SER 2 HG SER 2 16.041 3.899 -28.508 11 H HIS 3 HN HIS 3 11.656 4.892 -28.781 12 HA HIS 3 HA HIS 3 10.743 7.578 -28.464 13 HB2 HIS 3 HB2 HIS 3 9.501 5.885 -29.779 14 HB3 HIS 3 HB1 HIS 3 9.190 4.981 -28.303 15 HD1 HIS 3 HD1 HIS 3 6.646 5.218 -28.555 16 HD2 HIS 3 HD2 HIS 3 8.654 8.856 -28.328 17 HE1 HIS 3 HE1 HIS 3 4.864 6.957 -28.176 18 HE2 HIS 3 HE2 HIS 3 6.083 9.164 -28.246 19 H MET 4 HN MET 4 11.096 8.556 -26.576 20 HA MET 4 HA MET 4 10.773 6.993 -24.102 21 HB2 MET 4 HB2 MET 4 12.312 9.543 -24.622 22 HB3 MET 4 HB1 MET 4 12.135 8.793 -23.043 23 HG2 MET 4 HG2 MET 4 13.276 6.788 -23.887 24 HG3 MET 4 HG1 MET 4 13.489 7.590 -25.444 25 HE1 MET 4 HE1 MET 4 17.120 7.578 -23.903 26 HE2 MET 4 HE2 MET 4 16.138 7.115 -25.292 27 HE3 MET 4 HE3 MET 4 15.896 6.321 -23.735 28 H SER 5 HN SER 5 9.894 8.105 -22.238 29 HA SER 5 HA SER 5 8.311 10.488 -22.717 30 HB2 SER 5 HB2 SER 5 7.036 7.918 -21.730 31 HB3 SER 5 HB1 SER 5 6.235 9.486 -21.864 32 HG SER 5 HG SER 5 7.368 8.898 -24.207 33 H THR 6 HN THR 6 9.770 11.436 -21.249 34 HA THR 6 HA THR 6 10.401 10.445 -18.709 35 HB THR 6 HB THR 6 10.177 13.383 -19.329 36 HG1 THR 6 HG1 THR 6 12.576 12.116 -19.912 37 HG21 THR 6 HG21 THR 6 12.189 13.516 -17.926 38 HG22 THR 6 HG22 THR 6 12.143 11.768 -17.696 39 HG23 THR 6 HG23 THR 6 10.845 12.774 -17.055 40 H ASN 7 HN ASN 7 7.917 12.800 -19.702 41 HA ASN 7 HA ASN 7 6.433 12.077 -17.266 42 HB2 ASN 7 HB2 ASN 7 5.537 14.270 -17.073 43 HB3 ASN 7 HB1 ASN 7 7.261 14.487 -17.336 44 HD21 ASN 7 HD21 ASN 7 7.971 15.454 -19.215 45 HD22 ASN 7 HD22 ASN 7 6.901 16.239 -20.320 46 HA PRO 8 HA PRO 8 3.333 10.944 -20.270 47 HB2 PRO 8 HB2 PRO 8 1.586 9.821 -18.593 48 HB3 PRO 8 HB1 PRO 8 3.158 9.071 -18.907 49 HG2 PRO 8 HG2 PRO 8 2.244 10.652 -16.550 50 HG3 PRO 8 HG1 PRO 8 3.317 9.244 -16.606 51 HD2 PRO 8 HD2 PRO 8 4.118 11.922 -16.425 52 HD3 PRO 8 HD1 PRO 8 5.157 10.551 -16.861 53 H PHE 9 HN PHE 9 3.311 13.584 -18.452 54 HA PHE 9 HA PHE 9 0.469 14.075 -18.231 55 HB2 PHE 9 HB2 PHE 9 2.796 15.932 -17.681 56 HB3 PHE 9 HB1 PHE 9 1.119 16.203 -17.218 57 HD1 PHE 9 HD2 PHE 9 0.058 14.548 -15.598 58 HD2 PHE 9 HD1 PHE 9 4.249 14.797 -16.275 59 HE1 PHE 9 HE2 PHE 9 0.469 13.387 -13.466 60 HE2 PHE 9 HE1 PHE 9 4.669 13.637 -14.149 61 HZ PHE 9 HZ PHE 9 2.777 12.927 -12.742 62 H ASP 10 HN ASP 10 3.137 14.949 -20.288 63 HA ASP 10 HA ASP 10 3.233 15.825 -22.376 64 HB2 ASP 10 HB2 ASP 10 1.249 14.695 -23.077 65 HB3 ASP 10 HB1 ASP 10 0.223 15.831 -22.203 66 H ASP 11 HN ASP 11 0.760 17.541 -20.455 67 HA ASP 11 HA ASP 11 1.480 20.052 -21.635 68 HB2 ASP 11 HB2 ASP 11 -0.823 19.538 -20.791 69 HB3 ASP 11 HB1 ASP 11 -0.187 19.624 -19.149 70 H ASP 12 HN ASP 12 3.742 19.785 -21.168 71 HA ASP 12 HA ASP 12 4.507 20.760 -18.504 72 HB2 ASP 12 HB2 ASP 12 5.731 18.811 -19.622 73 HB3 ASP 12 HB1 ASP 12 6.324 19.974 -20.800 74 H ASN 13 HN ASN 13 4.065 22.915 -18.509 75 HA ASN 13 HA ASN 13 4.892 24.461 -20.880 76 HB2 ASN 13 HB2 ASN 13 2.325 23.986 -20.401 77 HB3 ASN 13 HB1 ASN 13 2.522 25.314 -19.265 78 HD21 ASN 13 HD21 ASN 13 0.901 25.185 -21.642 79 HD22 ASN 13 HD22 ASN 13 1.436 26.466 -22.674 80 H GLY 14 HN GLY 14 4.952 26.871 -20.362 81 HA2 GLY 14 HA2 GLY 14 5.544 28.648 -18.974 82 HA3 GLY 14 HA1 GLY 14 5.615 27.535 -17.612 83 H ALA 15 HN ALA 15 7.600 28.253 -16.900 84 HA ALA 15 HA ALA 15 9.878 27.868 -18.697 85 HB1 ALA 15 HB1 ALA 15 11.189 29.069 -17.010 86 HB2 ALA 15 HB2 ALA 15 9.755 29.190 -15.988 87 HB3 ALA 15 HB3 ALA 15 9.798 30.013 -17.547 88 H PHE 16 HN PHE 16 11.826 26.896 -17.663 89 HA PHE 16 HA PHE 16 11.268 24.826 -15.697 90 HB2 PHE 16 HB2 PHE 16 12.523 23.245 -17.450 91 HB3 PHE 16 HB1 PHE 16 10.771 23.433 -17.474 92 HD1 PHE 16 HD1 PHE 16 13.814 25.032 -18.885 93 HD2 PHE 16 HD2 PHE 16 9.760 23.925 -19.476 94 HE1 PHE 16 HE1 PHE 16 13.916 25.886 -21.175 95 HE2 PHE 16 HE2 PHE 16 9.853 24.774 -21.775 96 HZ PHE 16 HZ PHE 16 11.933 25.762 -22.629 97 H PHE 17 HN PHE 17 13.129 24.086 -14.668 98 HA PHE 17 HA PHE 17 15.588 25.559 -15.360 99 HB2 PHE 17 HB2 PHE 17 14.335 24.996 -12.680 100 HB3 PHE 17 HB1 PHE 17 16.064 25.272 -12.816 101 HD1 PHE 17 HD2 PHE 17 13.284 26.991 -14.608 102 HD2 PHE 17 HD1 PHE 17 16.405 27.270 -11.735 103 HE1 PHE 17 HE2 PHE 17 12.914 29.419 -14.447 104 HE2 PHE 17 HE1 PHE 17 16.039 29.697 -11.564 105 HZ PHE 17 HZ PHE 17 14.287 30.772 -12.925 106 H VAL 18 HN VAL 18 17.582 24.492 -14.854 107 HA VAL 18 HA VAL 18 17.402 21.577 -14.854 108 HB VAL 18 HB VAL 18 19.866 23.335 -14.990 109 HG11 VAL 18 HG11 VAL 18 19.517 20.387 -15.550 110 HG12 VAL 18 HG12 VAL 18 20.339 21.090 -14.157 111 HG13 VAL 18 HG13 VAL 18 21.001 21.313 -15.776 112 HG21 VAL 18 HG21 VAL 18 19.882 22.803 -17.386 113 HG22 VAL 18 HG22 VAL 18 18.437 23.698 -16.918 114 HG23 VAL 18 HG23 VAL 18 18.345 21.959 -17.201 115 H LEU 19 HN LEU 19 16.890 20.881 -12.885 116 HA LEU 19 HA LEU 19 18.105 22.165 -10.545 117 HB2 LEU 19 HB2 LEU 19 15.552 21.827 -10.929 118 HB3 LEU 19 HB1 LEU 19 15.865 20.162 -10.476 119 HG LEU 19 HG LEU 19 16.794 21.005 -8.306 120 HD11 LEU 19 HD11 LEU 19 16.189 23.311 -7.652 121 HD12 LEU 19 HD12 LEU 19 15.690 23.621 -9.312 122 HD13 LEU 19 HD13 LEU 19 17.377 23.255 -8.950 123 HD21 LEU 19 HD21 LEU 19 14.620 21.450 -7.310 124 HD22 LEU 19 HD22 LEU 19 14.508 20.150 -8.495 125 HD23 LEU 19 HD23 LEU 19 13.940 21.767 -8.908 126 H VAL 20 HN VAL 20 19.393 21.062 -9.155 127 HA VAL 20 HA VAL 20 19.698 18.164 -9.565 128 HB VAL 20 HB VAL 20 21.942 20.164 -9.205 129 HG11 VAL 20 HG11 VAL 20 22.109 17.152 -9.326 130 HG12 VAL 20 HG12 VAL 20 22.352 18.129 -7.881 131 HG13 VAL 20 HG13 VAL 20 23.470 18.268 -9.237 132 HG21 VAL 20 HG21 VAL 20 21.282 18.263 -11.454 133 HG22 VAL 20 HG22 VAL 20 22.723 19.274 -11.359 134 HG23 VAL 20 HG23 VAL 20 21.131 20.021 -11.489 135 H ASN 21 HN ASN 21 19.695 16.999 -7.763 136 HA ASN 21 HA ASN 21 20.005 18.372 -5.173 137 HB2 ASN 21 HB2 ASN 21 17.706 17.550 -5.497 138 HB3 ASN 21 HB1 ASN 21 18.318 15.939 -5.856 139 HD21 ASN 21 HD21 ASN 21 17.112 15.038 -4.176 140 HD22 ASN 21 HD22 ASN 21 17.553 15.252 -2.514 141 H ASP 22 HN ASP 22 21.155 17.160 -3.531 142 HA ASP 22 HA ASP 22 23.411 15.786 -4.513 143 HB2 ASP 22 HB2 ASP 22 23.468 16.986 -2.386 144 HB3 ASP 22 HB1 ASP 22 22.296 15.863 -1.703 145 H GLU 23 HN GLU 23 20.326 14.699 -3.316 146 HA GLU 23 HA GLU 23 21.092 11.899 -3.385 147 HB2 GLU 23 HB2 GLU 23 18.419 13.222 -2.880 148 HB3 GLU 23 HB1 GLU 23 18.772 11.515 -2.653 149 HG2 GLU 23 HG2 GLU 23 20.180 11.935 -0.824 150 HG3 GLU 23 HG1 GLU 23 20.278 13.656 -1.192 151 H ASP 24 HN ASP 24 20.785 13.896 -5.753 152 HA ASP 24 HA ASP 24 19.387 12.011 -7.514 153 HB2 ASP 24 HB2 ASP 24 18.026 14.142 -6.817 154 HB3 ASP 24 HB1 ASP 24 19.107 14.979 -7.926 155 H GLN 25 HN GLN 25 19.801 13.377 -9.904 156 HA GLN 25 HA GLN 25 22.695 13.907 -9.916 157 HB2 GLN 25 HB2 GLN 25 22.926 12.695 -12.038 158 HB3 GLN 25 HB1 GLN 25 22.367 11.638 -10.751 159 HG2 GLN 25 HG2 GLN 25 20.098 11.762 -11.611 160 HG3 GLN 25 HG1 GLN 25 20.629 12.866 -12.877 161 HE21 GLN 25 HE21 GLN 25 22.458 10.111 -11.750 162 HE22 GLN 25 HE22 GLN 25 22.309 9.175 -13.197 163 H HIS 26 HN HIS 26 19.708 14.144 -11.833 164 HA HIS 26 HA HIS 26 20.085 16.919 -12.424 165 HB2 HIS 26 HB2 HIS 26 20.675 14.858 -14.539 166 HB3 HIS 26 HB1 HIS 26 19.940 16.387 -14.995 167 HD1 HIS 26 HD1 HIS 26 21.403 18.556 -14.502 168 HD2 HIS 26 HD2 HIS 26 23.392 14.922 -14.183 169 HE1 HIS 26 HE1 HIS 26 23.853 19.116 -14.579 170 HE2 HIS 26 HE2 HIS 26 25.039 16.922 -14.231 171 H SER 27 HN SER 27 18.073 17.746 -12.545 172 HA SER 27 HA SER 27 15.948 16.063 -13.681 173 HB2 SER 27 HB2 SER 27 15.767 17.667 -11.118 174 HB3 SER 27 HB1 SER 27 14.409 16.865 -11.906 175 HG SER 27 HG SER 27 16.685 15.343 -11.327 176 H LEU 28 HN LEU 28 14.774 17.087 -15.172 177 HA LEU 28 HA LEU 28 15.012 19.951 -15.502 178 HB2 LEU 28 HB2 LEU 28 14.258 17.729 -17.156 179 HB3 LEU 28 HB1 LEU 28 12.955 18.903 -17.159 180 HG LEU 28 HG LEU 28 14.495 19.261 -19.032 181 HD11 LEU 28 HD11 LEU 28 14.615 21.428 -16.942 182 HD12 LEU 28 HD12 LEU 28 13.332 21.188 -18.128 183 HD13 LEU 28 HD13 LEU 28 14.952 21.645 -18.660 184 HD21 LEU 28 HD21 LEU 28 16.563 19.736 -16.891 185 HD22 LEU 28 HD22 LEU 28 16.782 20.037 -18.615 186 HD23 LEU 28 HD23 LEU 28 16.530 18.390 -18.033 187 H TRP 29 HN TRP 29 13.931 21.124 -14.046 188 HA TRP 29 HA TRP 29 11.336 20.105 -13.099 189 HB2 TRP 29 HB2 TRP 29 13.125 20.300 -11.402 190 HB3 TRP 29 HB1 TRP 29 13.268 22.014 -11.764 191 HD1 TRP 29 HD1 TRP 29 11.845 23.592 -10.353 192 HE1 TRP 29 HE1 TRP 29 9.912 23.316 -8.673 193 HE3 TRP 29 HE3 TRP 29 10.958 18.602 -10.961 194 HZ2 TRP 29 HZ2 TRP 29 8.239 21.241 -7.724 195 HZ3 TRP 29 HZ3 TRP 29 9.184 17.541 -9.630 196 HH2 TRP 29 HH2 TRP 29 7.852 18.834 -8.044 197 HA PRO 30 HA PRO 30 9.802 23.726 -15.267 198 HB2 PRO 30 HB2 PRO 30 7.188 23.078 -15.122 199 HB3 PRO 30 HB1 PRO 30 8.288 22.297 -16.264 200 HG2 PRO 30 HG2 PRO 30 7.259 21.304 -13.641 201 HG3 PRO 30 HG1 PRO 30 7.506 20.420 -15.157 202 HD2 PRO 30 HD2 PRO 30 9.244 20.353 -13.032 203 HD3 PRO 30 HD1 PRO 30 9.719 20.051 -14.715 204 H VAL 31 HN VAL 31 9.011 25.668 -14.581 205 HA VAL 31 HA VAL 31 8.812 26.076 -11.745 206 HB VAL 31 HB VAL 31 8.555 28.421 -12.222 207 HG11 VAL 31 HG11 VAL 31 10.553 27.137 -14.081 208 HG12 VAL 31 HG12 VAL 31 10.805 27.546 -12.383 209 HG13 VAL 31 HG13 VAL 31 10.574 28.826 -13.574 210 HG21 VAL 31 HG21 VAL 31 8.192 27.607 -15.103 211 HG22 VAL 31 HG22 VAL 31 8.371 29.267 -14.530 212 HG23 VAL 31 HG23 VAL 31 6.968 28.310 -14.049 213 H PHE 32 HN PHE 32 6.630 24.900 -13.868 214 HA PHE 32 HA PHE 32 4.229 26.173 -13.121 215 HB2 PHE 32 HB2 PHE 32 4.575 24.490 -15.009 216 HB3 PHE 32 HB1 PHE 32 4.541 23.237 -13.774 217 HD1 PHE 32 HD1 PHE 32 2.559 25.892 -15.390 218 HD2 PHE 32 HD2 PHE 32 2.495 22.467 -12.862 219 HE1 PHE 32 HE1 PHE 32 0.101 25.836 -15.528 220 HE2 PHE 32 HE2 PHE 32 0.042 22.404 -12.998 221 HZ PHE 32 HZ PHE 32 -1.160 24.088 -14.328 222 H ALA 33 HN ALA 33 6.311 23.853 -11.614 223 HA ALA 33 HA ALA 33 4.537 23.766 -9.270 224 HB1 ALA 33 HB1 ALA 33 5.052 21.555 -10.152 225 HB2 ALA 33 HB2 ALA 33 5.814 21.782 -8.575 226 HB3 ALA 33 HB3 ALA 33 6.780 21.900 -10.046 227 H ASP 34 HN ASP 34 5.513 24.111 -7.205 228 HA ASP 34 HA ASP 34 7.592 26.112 -7.312 229 HB2 ASP 34 HB2 ASP 34 7.131 26.489 -4.973 230 HB3 ASP 34 HB1 ASP 34 5.605 26.369 -5.838 231 H ILE 35 HN ILE 35 9.605 26.003 -6.370 232 HA ILE 35 HA ILE 35 10.731 23.329 -6.262 233 HB ILE 35 HB ILE 35 12.194 25.932 -5.803 234 HG12 ILE 35 HG12 ILE 35 11.706 24.513 -8.434 235 HG13 ILE 35 HG11 ILE 35 10.969 26.035 -7.947 236 HG21 ILE 35 HG21 ILE 35 13.097 23.212 -6.739 237 HG22 ILE 35 HG22 ILE 35 13.430 23.953 -5.171 238 HG23 ILE 35 HG23 ILE 35 14.122 24.644 -6.640 239 HD11 ILE 35 HD11 ILE 35 13.154 27.099 -7.916 240 HD12 ILE 35 HD12 ILE 35 12.823 26.376 -9.489 241 HD13 ILE 35 HD13 ILE 35 13.914 25.571 -8.359 242 HA PRO 36 HA PRO 36 10.060 23.183 -1.889 243 HB2 PRO 36 HB2 PRO 36 11.340 20.847 -1.378 244 HB3 PRO 36 HB1 PRO 36 9.767 20.935 -2.167 245 HG2 PRO 36 HG2 PRO 36 12.471 20.593 -3.402 246 HG3 PRO 36 HG1 PRO 36 10.958 19.749 -3.774 247 HD2 PRO 36 HD2 PRO 36 11.886 21.800 -5.279 248 HD3 PRO 36 HD1 PRO 36 10.153 21.489 -5.052 249 H ALA 37 HN ALA 37 13.029 21.417 -1.627 250 HA ALA 37 HA ALA 37 14.607 23.691 -0.830 251 HB1 ALA 37 HB1 ALA 37 13.557 21.713 1.177 252 HB2 ALA 37 HB2 ALA 37 13.222 23.445 1.119 253 HB3 ALA 37 HB3 ALA 37 14.848 22.872 1.500 254 H GLY 38 HN GLY 38 16.767 22.972 0.010 255 HA2 GLY 38 HA2 GLY 38 18.666 21.677 -0.140 256 HA3 GLY 38 HA1 GLY 38 17.616 20.274 -0.273 257 H TRP 39 HN TRP 39 17.533 22.984 -2.477 258 HA TRP 39 HA TRP 39 18.165 21.108 -4.636 259 HB2 TRP 39 HB2 TRP 39 16.959 22.809 -6.065 260 HB3 TRP 39 HB1 TRP 39 15.964 21.972 -4.881 261 HD1 TRP 39 HD1 TRP 39 14.808 23.419 -3.013 262 HE1 TRP 39 HE1 TRP 39 14.600 25.952 -2.599 263 HE3 TRP 39 HE3 TRP 39 18.313 25.087 -6.353 264 HZ2 TRP 39 HZ2 TRP 39 15.763 28.329 -3.558 265 HZ3 TRP 39 HZ3 TRP 39 18.700 27.509 -6.538 266 HH2 TRP 39 HH2 TRP 39 17.451 29.096 -5.169 267 H ARG 40 HN ARG 40 19.291 21.910 -6.497 268 HA ARG 40 HA ARG 40 20.851 24.361 -6.142 269 HB2 ARG 40 HB2 ARG 40 22.314 22.534 -5.438 270 HB3 ARG 40 HB1 ARG 40 21.970 21.655 -6.920 271 HG2 ARG 40 HG2 ARG 40 24.162 22.699 -7.004 272 HG3 ARG 40 HG1 ARG 40 23.087 23.389 -8.217 273 HD2 ARG 40 HD2 ARG 40 22.731 25.345 -6.879 274 HD3 ARG 40 HD1 ARG 40 23.599 24.631 -5.521 275 HE ARG 40 HE ARG 40 25.579 24.666 -7.138 276 HH11 ARG 40 HH11 ARG 40 23.002 27.043 -7.227 277 HH12 ARG 40 HH12 ARG 40 24.041 28.314 -7.787 278 HH21 ARG 40 HH21 ARG 40 26.932 26.359 -7.856 279 HH22 ARG 40 HH22 ARG 40 26.259 27.936 -8.131 280 H VAL 41 HN VAL 41 20.559 25.616 -7.888 281 HA VAL 41 HA VAL 41 19.494 24.409 -10.320 282 HB VAL 41 HB VAL 41 19.830 27.322 -9.589 283 HG11 VAL 41 HG11 VAL 41 19.913 26.988 -11.998 284 HG12 VAL 41 HG12 VAL 41 18.409 27.777 -11.522 285 HG13 VAL 41 HG13 VAL 41 18.413 26.062 -11.928 286 HG21 VAL 41 HG21 VAL 41 17.372 27.292 -9.369 287 HG22 VAL 41 HG22 VAL 41 18.173 26.246 -8.198 288 HG23 VAL 41 HG23 VAL 41 17.395 25.545 -9.616 289 H VAL 42 HN VAL 42 20.898 23.731 -11.782 290 HA VAL 42 HA VAL 42 23.570 24.817 -11.955 291 HB VAL 42 HB VAL 42 22.196 22.874 -13.832 292 HG11 VAL 42 HG11 VAL 42 24.158 23.958 -14.805 293 HG12 VAL 42 HG12 VAL 42 24.461 22.249 -14.493 294 HG13 VAL 42 HG13 VAL 42 25.121 23.474 -13.409 295 HG21 VAL 42 HG21 VAL 42 22.221 21.998 -11.572 296 HG22 VAL 42 HG22 VAL 42 23.945 22.351 -11.430 297 HG23 VAL 42 HG23 VAL 42 23.384 21.127 -12.574 298 H HIS 43 HN HIS 43 20.614 24.888 -13.852 299 HA HIS 43 HA HIS 43 21.469 27.374 -15.123 300 HB2 HIS 43 HB2 HIS 43 20.955 24.806 -16.534 301 HB3 HIS 43 HB1 HIS 43 20.231 26.243 -17.244 302 HD1 HIS 43 HD1 HIS 43 23.702 25.894 -15.699 303 HD2 HIS 43 HD2 HIS 43 21.872 26.756 -19.330 304 HE1 HIS 43 HE1 HIS 43 25.568 26.464 -17.277 305 HE2 HIS 43 HE2 HIS 43 24.455 26.813 -19.505 306 H GLY 44 HN GLY 44 19.775 28.782 -15.389 307 HA2 GLY 44 HA2 GLY 44 17.282 28.105 -14.142 308 HA3 GLY 44 HA1 GLY 44 17.685 29.639 -14.901 309 H GLU 45 HN GLU 45 16.072 30.025 -16.321 310 HA GLU 45 HA GLU 45 15.023 27.774 -17.829 311 HB2 GLU 45 HB2 GLU 45 13.573 29.862 -18.771 312 HB3 GLU 45 HB1 GLU 45 13.117 28.863 -17.402 313 HG2 GLU 45 HG2 GLU 45 12.822 31.019 -16.637 314 HG3 GLU 45 HG1 GLU 45 14.387 30.530 -15.994 315 H ALA 46 HN ALA 46 16.416 27.253 -19.212 316 HA ALA 46 HA ALA 46 16.997 29.124 -21.416 317 HB1 ALA 46 HB1 ALA 46 19.058 28.453 -20.286 318 HB2 ALA 46 HB2 ALA 46 18.988 27.762 -21.906 319 HB3 ALA 46 HB3 ALA 46 18.637 26.754 -20.501 320 H SER 47 HN SER 47 17.216 27.894 -23.549 321 HA SER 47 HA SER 47 14.871 26.869 -24.363 322 HB2 SER 47 HB2 SER 47 17.515 25.860 -25.418 323 HB3 SER 47 HB1 SER 47 15.999 26.036 -26.307 324 HG SER 47 HG SER 47 16.807 27.923 -26.806 325 H ARG 48 HN ARG 48 13.698 25.091 -24.138 326 HA ARG 48 HA ARG 48 14.199 23.141 -22.238 327 HB2 ARG 48 HB2 ARG 48 11.971 23.591 -23.100 328 HB3 ARG 48 HB1 ARG 48 12.429 22.994 -24.691 329 HG2 ARG 48 HG2 ARG 48 11.165 21.286 -23.719 330 HG3 ARG 48 HG1 ARG 48 12.840 20.756 -23.563 331 HD2 ARG 48 HD2 ARG 48 12.898 21.365 -21.257 332 HD3 ARG 48 HD1 ARG 48 11.341 22.186 -21.376 333 HE ARG 48 HE ARG 48 11.466 19.300 -21.893 334 HH11 ARG 48 HH11 ARG 48 10.424 21.955 -19.855 335 HH12 ARG 48 HH12 ARG 48 9.281 20.993 -18.965 336 HH21 ARG 48 HH21 ARG 48 9.974 18.036 -20.710 337 HH22 ARG 48 HH22 ARG 48 9.040 18.772 -19.427 338 H ALA 49 HN ALA 49 14.692 22.978 -25.733 339 HA ALA 49 HA ALA 49 15.674 20.379 -25.930 340 HB1 ALA 49 HB1 ALA 49 15.068 21.758 -27.860 341 HB2 ALA 49 HB2 ALA 49 16.694 21.097 -28.023 342 HB3 ALA 49 HB3 ALA 49 16.469 22.785 -27.566 343 H ALA 50 HN ALA 50 17.382 23.399 -25.241 344 HA ALA 50 HA ALA 50 19.990 22.286 -25.317 345 HB1 ALA 50 HB1 ALA 50 20.714 24.390 -24.321 346 HB2 ALA 50 HB2 ALA 50 19.038 24.810 -23.965 347 HB3 ALA 50 HB3 ALA 50 19.575 24.674 -25.639 348 H CYS 51 HN CYS 51 17.659 22.850 -22.723 349 HA CYS 51 HA CYS 51 19.348 22.148 -20.574 350 HB2 CYS 51 HB2 CYS 51 16.339 21.935 -20.822 351 HB3 CYS 51 HB1 CYS 51 17.238 21.773 -19.318 352 HG CYS 51 HG CYS 51 16.455 24.556 -21.052 353 H LEU 52 HN LEU 52 16.983 20.222 -22.421 354 HA LEU 52 HA LEU 52 17.556 17.737 -21.257 355 HB2 LEU 52 HB2 LEU 52 16.710 18.357 -24.091 356 HB3 LEU 52 HB1 LEU 52 16.658 16.770 -23.349 357 HG LEU 52 HG LEU 52 15.050 19.167 -22.455 358 HD11 LEU 52 HD11 LEU 52 14.208 16.667 -23.911 359 HD12 LEU 52 HD12 LEU 52 14.305 18.286 -24.608 360 HD13 LEU 52 HD13 LEU 52 13.137 17.943 -23.332 361 HD21 LEU 52 HD21 LEU 52 15.563 17.705 -20.594 362 HD22 LEU 52 HD22 LEU 52 15.028 16.302 -21.521 363 HD23 LEU 52 HD23 LEU 52 13.865 17.542 -21.046 364 H ASP 53 HN ASP 53 18.989 19.376 -24.043 365 HA ASP 53 HA ASP 53 20.795 17.438 -24.868 366 HB2 ASP 53 HB2 ASP 53 20.318 19.564 -26.052 367 HB3 ASP 53 HB1 ASP 53 21.192 20.443 -24.805 368 H TYR 54 HN TYR 54 21.134 19.944 -22.422 369 HA TYR 54 HA TYR 54 23.805 19.495 -21.706 370 HB2 TYR 54 HB2 TYR 54 22.399 21.487 -21.110 371 HB3 TYR 54 HB1 TYR 54 21.568 20.490 -19.926 372 HD1 TYR 54 HD1 TYR 54 24.735 22.154 -20.774 373 HD2 TYR 54 HD2 TYR 54 22.618 19.949 -17.807 374 HE1 TYR 54 HE1 TYR 54 26.433 22.771 -19.110 375 HE2 TYR 54 HE2 TYR 54 24.320 20.561 -16.135 376 HH TYR 54 HH TYR 54 26.837 21.248 -16.243 377 H VAL 55 HN VAL 55 20.789 18.247 -20.232 378 HA VAL 55 HA VAL 55 22.197 16.830 -18.200 379 HB VAL 55 HB VAL 55 20.089 15.824 -17.582 380 HG11 VAL 55 HG11 VAL 55 18.770 17.854 -17.209 381 HG12 VAL 55 HG12 VAL 55 19.782 18.708 -18.376 382 HG13 VAL 55 HG13 VAL 55 20.487 18.101 -16.877 383 HG21 VAL 55 HG21 VAL 55 19.204 15.302 -19.796 384 HG22 VAL 55 HG22 VAL 55 18.952 17.019 -20.107 385 HG23 VAL 55 HG23 VAL 55 18.032 16.207 -18.840 386 H GLU 56 HN GLU 56 20.889 15.857 -21.330 387 HA GLU 56 HA GLU 56 21.281 13.071 -20.885 388 HB2 GLU 56 HB2 GLU 56 20.882 14.554 -23.489 389 HB3 GLU 56 HB1 GLU 56 20.703 12.819 -23.248 390 HG2 GLU 56 HG2 GLU 56 19.041 14.973 -21.959 391 HG3 GLU 56 HG1 GLU 56 18.535 13.925 -23.273 392 H LYS 57 HN LYS 57 23.159 15.586 -22.523 393 HA LYS 57 HA LYS 57 25.124 13.773 -23.497 394 HB2 LYS 57 HB2 LYS 57 24.938 16.742 -23.299 395 HB3 LYS 57 HB1 LYS 57 26.488 15.995 -23.677 396 HG2 LYS 57 HG2 LYS 57 25.742 15.127 -25.679 397 HG3 LYS 57 HG1 LYS 57 24.049 15.186 -25.193 398 HD2 LYS 57 HD2 LYS 57 24.536 16.862 -26.885 399 HD3 LYS 57 HD1 LYS 57 24.087 17.616 -25.357 400 HE2 LYS 57 HE2 LYS 57 26.432 18.051 -24.867 401 HE3 LYS 57 HE1 LYS 57 26.899 17.267 -26.378 402 HZ1 LYS 57 HZ1 LYS 57 25.125 19.639 -26.224 403 HZ2 LYS 57 HZ2 LYS 57 25.793 18.949 -27.624 404 HZ3 LYS 57 HZ3 LYS 57 26.796 19.726 -26.502 405 H ASN 58 HN ASN 58 24.562 15.062 -20.404 406 HA ASN 58 HA ASN 58 27.196 14.806 -19.361 407 HB2 ASN 58 HB2 ASN 58 24.457 14.927 -18.158 408 HB3 ASN 58 HB1 ASN 58 25.796 14.386 -17.156 409 HD21 ASN 58 HD21 ASN 58 26.289 16.700 -19.695 410 HD22 ASN 58 HD22 ASN 58 26.533 18.069 -18.672 411 H TRP 59 HN TRP 59 24.818 12.545 -20.322 412 HA TRP 59 HA TRP 59 24.678 10.282 -20.313 413 HB2 TRP 59 HB2 TRP 59 27.671 10.471 -19.917 414 HB3 TRP 59 HB1 TRP 59 26.801 9.029 -20.427 415 HD1 TRP 59 HD1 TRP 59 28.763 11.697 -21.856 416 HE1 TRP 59 HE1 TRP 59 28.273 12.031 -24.364 417 HE3 TRP 59 HE3 TRP 59 24.419 9.022 -22.186 418 HZ2 TRP 59 HZ2 TRP 59 26.307 11.249 -26.228 419 HZ3 TRP 59 HZ3 TRP 59 23.296 8.867 -24.369 420 HH2 TRP 59 HH2 TRP 59 24.221 9.958 -26.347 421 H THR 60 HN THR 60 23.976 11.364 -17.922 422 HA THR 60 HA THR 60 25.293 9.930 -15.783 423 HB THR 60 HB THR 60 23.470 10.973 -14.378 424 HG1 THR 60 HG1 THR 60 21.820 11.630 -15.531 425 HG21 THR 60 HG21 THR 60 25.161 12.822 -16.067 426 HG22 THR 60 HG22 THR 60 25.649 12.037 -14.564 427 HG23 THR 60 HG23 THR 60 24.379 13.260 -14.549 428 H ASP 61 HN ASP 61 24.872 7.827 -15.496 429 HA ASP 61 HA ASP 61 22.338 6.691 -16.355 430 HB2 ASP 61 HB2 ASP 61 24.583 5.563 -16.738 431 HB3 ASP 61 HB1 ASP 61 24.641 5.254 -15.008 432 H LEU 62 HN LEU 62 21.425 4.974 -14.750 433 HA LEU 62 HA LEU 62 20.229 4.570 -12.880 434 HB2 LEU 62 HB2 LEU 62 22.433 6.177 -11.618 435 HB3 LEU 62 HB1 LEU 62 21.050 5.653 -10.679 436 HG LEU 62 HG LEU 62 22.821 4.104 -10.300 437 HD11 LEU 62 HD11 LEU 62 21.848 2.004 -11.085 438 HD12 LEU 62 HD12 LEU 62 20.835 2.898 -12.216 439 HD13 LEU 62 HD13 LEU 62 20.616 3.112 -10.480 440 HD21 LEU 62 HD21 LEU 62 23.911 2.850 -12.088 441 HD22 LEU 62 HD22 LEU 62 24.188 4.583 -12.255 442 HD23 LEU 62 HD23 LEU 62 23.010 3.773 -13.289 443 H ARG 63 HN ARG 63 18.393 5.491 -13.566 444 HA ARG 63 HA ARG 63 17.823 8.240 -12.677 445 HB2 ARG 63 HB2 ARG 63 17.288 7.094 -15.427 446 HB3 ARG 63 HB1 ARG 63 16.642 8.620 -14.845 447 HG2 ARG 63 HG2 ARG 63 18.913 9.491 -14.619 448 HG3 ARG 63 HG1 ARG 63 19.553 7.959 -15.215 449 HD2 ARG 63 HD2 ARG 63 18.534 8.274 -17.346 450 HD3 ARG 63 HD1 ARG 63 17.623 9.667 -16.763 451 HE ARG 63 HE ARG 63 20.490 9.940 -16.577 452 HH11 ARG 63 HH11 ARG 63 17.702 10.341 -18.655 453 HH12 ARG 63 HH12 ARG 63 18.400 11.659 -19.552 454 HH21 ARG 63 HH21 ARG 63 21.402 11.685 -17.770 455 HH22 ARG 63 HH22 ARG 63 20.473 12.420 -19.045 456 HA PRO 64 HA PRO 64 13.718 6.613 -11.690 457 HB2 PRO 64 HB2 PRO 64 12.097 8.545 -12.794 458 HB3 PRO 64 HB1 PRO 64 12.869 8.687 -11.212 459 HG2 PRO 64 HG2 PRO 64 13.709 9.838 -13.837 460 HG3 PRO 64 HG1 PRO 64 13.754 10.573 -12.225 461 HD2 PRO 64 HD2 PRO 64 15.960 9.574 -13.401 462 HD3 PRO 64 HD1 PRO 64 15.709 9.484 -11.645 463 H LYS 65 HN LYS 65 13.278 4.832 -12.860 464 HA LYS 65 HA LYS 65 13.647 4.558 -15.599 465 HB2 LYS 65 HB2 LYS 65 13.426 2.777 -13.736 466 HB3 LYS 65 HB1 LYS 65 11.701 2.861 -14.061 467 HG2 LYS 65 HG2 LYS 65 12.106 2.236 -16.387 468 HG3 LYS 65 HG1 LYS 65 13.839 2.156 -16.060 469 HD2 LYS 65 HD2 LYS 65 13.347 0.432 -14.315 470 HD3 LYS 65 HD1 LYS 65 11.673 0.432 -14.865 471 HE2 LYS 65 HE2 LYS 65 12.809 -1.402 -15.902 472 HE3 LYS 65 HE1 LYS 65 12.482 -0.185 -17.136 473 HZ1 LYS 65 HZ1 LYS 65 15.084 -0.586 -15.747 474 HZ2 LYS 65 HZ2 LYS 65 14.773 0.566 -16.957 475 HZ3 LYS 65 HZ3 LYS 65 14.719 -1.087 -17.328 476 H SER 66 HN SER 66 12.613 5.744 -17.063 477 HA SER 66 HA SER 66 9.862 6.525 -16.718 478 HB2 SER 66 HB2 SER 66 11.654 6.932 -19.120 479 HB3 SER 66 HB1 SER 66 10.171 7.808 -18.741 480 HG SER 66 HG SER 66 11.920 7.927 -16.679 481 H LEU 67 HN LEU 67 8.775 4.536 -16.736 482 HA LEU 67 HA LEU 67 8.241 3.500 -19.395 483 HB2 LEU 67 HB2 LEU 67 10.100 2.107 -18.559 484 HB3 LEU 67 HB1 LEU 67 9.158 1.716 -17.132 485 HG LEU 67 HG LEU 67 7.479 0.611 -18.595 486 HD11 LEU 67 HD11 LEU 67 8.083 0.083 -20.899 487 HD12 LEU 67 HD12 LEU 67 9.532 1.077 -20.751 488 HD13 LEU 67 HD13 LEU 67 7.936 1.823 -20.656 489 HD21 LEU 67 HD21 LEU 67 8.843 -1.373 -19.064 490 HD22 LEU 67 HD22 LEU 67 9.185 -0.700 -17.469 491 HD23 LEU 67 HD23 LEU 67 10.305 -0.421 -18.801 492 H ARG 68 HN ARG 68 6.159 2.939 -19.622 493 HA ARG 68 HA ARG 68 4.539 2.679 -17.179 494 HB2 ARG 68 HB2 ARG 68 2.651 3.659 -18.425 495 HB3 ARG 68 HB1 ARG 68 4.007 4.771 -18.322 496 HG2 ARG 68 HG2 ARG 68 4.616 4.342 -20.594 497 HG3 ARG 68 HG1 ARG 68 3.431 3.043 -20.716 498 HD2 ARG 68 HD2 ARG 68 1.656 4.752 -20.255 499 HD3 ARG 68 HD1 ARG 68 2.903 5.991 -20.406 500 HE ARG 68 HE ARG 68 3.082 5.512 -22.703 501 HH11 ARG 68 HH11 ARG 68 0.632 3.576 -21.107 502 HH12 ARG 68 HH12 ARG 68 -0.104 3.047 -22.597 503 HH21 ARG 68 HH21 ARG 68 2.123 4.838 -24.657 504 HH22 ARG 68 HH22 ARG 68 0.756 3.761 -24.623 505 H ASP 69 HN ASP 69 5.022 1.654 -20.509 506 HA ASP 69 HA ASP 69 4.183 -1.015 -19.914 507 HB2 ASP 69 HB2 ASP 69 1.980 0.038 -20.326 508 HB3 ASP 69 HB1 ASP 69 2.554 0.614 -21.889 509 H ALA 70 HN ALA 70 5.080 -2.454 -21.373 510 HA ALA 70 HA ALA 70 7.136 -1.282 -23.058 511 HB1 ALA 70 HB1 ALA 70 8.028 -3.531 -23.213 512 HB2 ALA 70 HB2 ALA 70 6.583 -4.180 -22.433 513 HB3 ALA 70 HB3 ALA 70 7.677 -3.130 -21.530 514 H MET 71 HN MET 71 6.815 -0.870 -25.117 515 HA MET 71 HA MET 71 5.053 -2.649 -26.672 516 HB2 MET 71 HB2 MET 71 4.049 -0.411 -26.390 517 HB3 MET 71 HB1 MET 71 5.497 0.322 -27.066 518 HG2 MET 71 HG2 MET 71 3.785 0.262 -28.739 519 HG3 MET 71 HG1 MET 71 5.070 -0.858 -29.187 520 HE1 MET 71 HE1 MET 71 1.424 -0.456 -27.842 521 HE2 MET 71 HE2 MET 71 2.195 -1.317 -26.511 522 HE3 MET 71 HE3 MET 71 0.967 -2.122 -27.488 523 H VAL 72 HN VAL 72 6.381 -3.908 -27.840 524 HA VAL 72 HA VAL 72 8.940 -2.851 -28.768 525 HB VAL 72 HB VAL 72 7.808 -5.645 -29.059 526 HG11 VAL 72 HG11 VAL 72 10.086 -6.308 -29.570 527 HG12 VAL 72 HG12 VAL 72 10.630 -4.640 -29.404 528 HG13 VAL 72 HG13 VAL 72 9.533 -5.084 -30.711 529 HG21 VAL 72 HG21 VAL 72 8.099 -5.059 -26.711 530 HG22 VAL 72 HG22 VAL 72 9.764 -4.568 -27.029 531 HG23 VAL 72 HG23 VAL 72 9.291 -6.257 -27.216 532 H GLU 73 HN GLU 73 6.292 -4.739 -30.219 533 HA GLU 73 HA GLU 73 6.443 -3.012 -32.559 534 HB2 GLU 73 HB2 GLU 73 6.188 -5.124 -34.004 535 HB3 GLU 73 HB1 GLU 73 7.780 -4.738 -33.373 536 HG2 GLU 73 HG2 GLU 73 7.549 -7.045 -33.104 537 HG3 GLU 73 HG1 GLU 73 7.285 -6.364 -31.501 538 H ASP 74 HN ASP 74 4.553 -2.735 -33.650 539 HA ASP 74 HA ASP 74 2.193 -4.109 -32.625 540 HB2 ASP 74 HB2 ASP 74 0.958 -1.963 -32.472 541 HB3 ASP 74 HB1 ASP 74 2.281 -2.074 -31.321 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 4.758 -8.743 -28.673 2 H2 GLY 1 HT2 GLY 1 4.790 -10.032 -27.572 3 H3 GLY 1 HT3 GLY 1 6.143 -9.022 -27.736 4 HA2 GLY 1 HA1 GLY 1 3.489 -8.208 -26.697 5 HA3 GLY 1 HA2 GLY 1 4.920 -8.508 -25.719 6 H SER 2 HN SER 2 3.909 -6.138 -25.318 7 HA SER 2 HA SER 2 5.589 -4.322 -26.920 8 HB2 SER 2 HB2 SER 2 2.866 -3.747 -25.726 9 HB3 SER 2 HB1 SER 2 3.878 -2.575 -26.569 10 HG SER 2 HG SER 2 2.997 -3.273 -28.329 11 H HIS 3 HN HIS 3 7.023 -3.190 -25.820 12 HA HIS 3 HA HIS 3 6.824 -3.147 -22.886 13 HB2 HIS 3 HB2 HIS 3 9.090 -3.207 -24.801 14 HB3 HIS 3 HB1 HIS 3 9.318 -2.247 -23.343 15 HD1 HIS 3 HD1 HIS 3 10.891 -3.703 -22.062 16 HD2 HIS 3 HD2 HIS 3 7.554 -5.776 -23.434 17 HE1 HIS 3 HE1 HIS 3 11.012 -5.978 -20.989 18 HE2 HIS 3 HE2 HIS 3 8.852 -7.108 -21.636 19 H MET 4 HN MET 4 6.344 -1.306 -21.902 20 HA MET 4 HA MET 4 6.352 1.164 -23.447 21 HB2 MET 4 HB2 MET 4 4.322 0.634 -22.195 22 HB3 MET 4 HB1 MET 4 5.244 0.545 -20.701 23 HG2 MET 4 HG2 MET 4 5.735 2.904 -20.814 24 HG3 MET 4 HG1 MET 4 4.947 3.025 -22.384 25 HE1 MET 4 HE1 MET 4 2.342 2.809 -22.762 26 HE2 MET 4 HE2 MET 4 1.199 2.397 -21.487 27 HE3 MET 4 HE3 MET 4 2.387 1.209 -22.020 28 H SER 5 HN SER 5 8.429 1.854 -23.544 29 HA SER 5 HA SER 5 9.580 2.692 -20.971 30 HB2 SER 5 HB2 SER 5 10.837 0.749 -22.003 31 HB3 SER 5 HB1 SER 5 11.222 1.808 -23.357 32 HG SER 5 HG SER 5 11.792 2.585 -20.697 33 H THR 6 HN THR 6 9.119 4.808 -21.010 34 HA THR 6 HA THR 6 9.903 6.336 -23.392 35 HB THR 6 HB THR 6 7.453 6.078 -23.402 36 HG1 THR 6 HG1 THR 6 7.111 8.574 -22.991 37 HG21 THR 6 HG21 THR 6 7.104 5.802 -20.993 38 HG22 THR 6 HG22 THR 6 6.079 7.077 -21.647 39 HG23 THR 6 HG23 THR 6 7.528 7.494 -20.735 40 H ASN 7 HN ASN 7 10.018 8.728 -22.845 41 HA ASN 7 HA ASN 7 11.765 9.041 -20.600 42 HB2 ASN 7 HB2 ASN 7 10.651 11.022 -22.600 43 HB3 ASN 7 HB1 ASN 7 11.785 11.461 -21.328 44 HD21 ASN 7 HD21 ASN 7 13.330 12.106 -22.820 45 HD22 ASN 7 HD22 ASN 7 14.237 10.975 -23.758 46 HA PRO 8 HA PRO 8 8.553 10.020 -17.713 47 HB2 PRO 8 HB2 PRO 8 10.103 10.796 -15.649 48 HB3 PRO 8 HB1 PRO 8 9.992 9.108 -16.161 49 HG2 PRO 8 HG2 PRO 8 12.104 11.140 -16.772 50 HG3 PRO 8 HG1 PRO 8 12.295 9.442 -16.295 51 HD2 PRO 8 HD2 PRO 8 12.475 10.289 -18.873 52 HD3 PRO 8 HD1 PRO 8 11.896 8.671 -18.426 53 H PHE 9 HN PHE 9 9.388 12.101 -19.673 54 HA PHE 9 HA PHE 9 9.181 14.519 -18.022 55 HB2 PHE 9 HB2 PHE 9 9.917 14.258 -20.946 56 HB3 PHE 9 HB1 PHE 9 9.918 15.749 -20.008 57 HD1 PHE 9 HD1 PHE 9 11.355 15.470 -17.720 58 HD2 PHE 9 HD2 PHE 9 11.959 13.334 -21.350 59 HE1 PHE 9 HE1 PHE 9 13.702 15.075 -17.091 60 HE2 PHE 9 HE2 PHE 9 14.304 12.931 -20.730 61 HZ PHE 9 HZ PHE 9 15.178 13.801 -18.599 62 H ASP 10 HN ASP 10 7.048 14.806 -17.639 63 HA ASP 10 HA ASP 10 5.069 14.411 -19.694 64 HB2 ASP 10 HB2 ASP 10 4.577 14.021 -17.283 65 HB3 ASP 10 HB1 ASP 10 4.783 15.746 -16.991 66 H ASP 11 HN ASP 11 3.707 16.129 -20.525 67 HA ASP 11 HA ASP 11 5.288 18.157 -21.653 68 HB2 ASP 11 HB2 ASP 11 3.213 17.126 -22.653 69 HB3 ASP 11 HB1 ASP 11 2.271 18.125 -21.550 70 H ASP 12 HN ASP 12 5.703 20.200 -21.095 71 HA ASP 12 HA ASP 12 4.764 21.070 -18.476 72 HB2 ASP 12 HB2 ASP 12 6.567 22.703 -18.556 73 HB3 ASP 12 HB1 ASP 12 7.188 21.100 -18.937 74 H ASN 13 HN ASN 13 4.286 23.407 -18.174 75 HA ASN 13 HA ASN 13 2.841 24.532 -20.486 76 HB2 ASN 13 HB2 ASN 13 1.294 23.305 -18.966 77 HB3 ASN 13 HB1 ASN 13 1.795 24.356 -17.648 78 HD21 ASN 13 HD21 ASN 13 -0.182 25.215 -17.269 79 HD22 ASN 13 HD22 ASN 13 -1.000 26.274 -18.371 80 H GLY 14 HN GLY 14 5.424 25.111 -18.909 81 HA2 GLY 14 HA2 GLY 14 5.122 27.972 -18.888 82 HA3 GLY 14 HA1 GLY 14 5.283 27.298 -17.272 83 H ALA 15 HN ALA 15 7.261 28.489 -17.052 84 HA ALA 15 HA ALA 15 9.484 27.818 -18.769 85 HB1 ALA 15 HB1 ALA 15 10.812 29.237 -17.291 86 HB2 ALA 15 HB2 ALA 15 9.467 29.322 -16.150 87 HB3 ALA 15 HB3 ALA 15 9.312 30.047 -17.749 88 H PHE 16 HN PHE 16 11.568 27.087 -17.617 89 HA PHE 16 HA PHE 16 11.151 25.152 -15.503 90 HB2 PHE 16 HB2 PHE 16 12.353 23.433 -17.157 91 HB3 PHE 16 HB1 PHE 16 10.600 23.576 -17.091 92 HD1 PHE 16 HD1 PHE 16 13.455 25.236 -18.797 93 HD2 PHE 16 HD2 PHE 16 9.508 23.691 -19.100 94 HE1 PHE 16 HE1 PHE 16 13.405 25.856 -21.159 95 HE2 PHE 16 HE2 PHE 16 9.449 24.296 -21.482 96 HZ PHE 16 HZ PHE 16 11.397 25.383 -22.520 97 H PHE 17 HN PHE 17 13.046 24.530 -14.513 98 HA PHE 17 HA PHE 17 15.499 25.863 -15.470 99 HB2 PHE 17 HB2 PHE 17 14.312 25.566 -12.746 100 HB3 PHE 17 HB1 PHE 17 16.059 25.457 -12.875 101 HD1 PHE 17 HD2 PHE 17 13.670 27.673 -14.690 102 HD2 PHE 17 HD1 PHE 17 16.872 27.359 -11.908 103 HE1 PHE 17 HE2 PHE 17 13.830 30.121 -14.604 104 HE2 PHE 17 HE1 PHE 17 17.042 29.809 -11.819 105 HZ PHE 17 HZ PHE 17 15.516 31.195 -13.166 106 H VAL 18 HN VAL 18 17.465 24.700 -15.216 107 HA VAL 18 HA VAL 18 17.212 21.821 -15.015 108 HB VAL 18 HB VAL 18 19.657 23.579 -15.317 109 HG11 VAL 18 HG11 VAL 18 19.459 20.569 -15.386 110 HG12 VAL 18 HG12 VAL 18 20.228 21.532 -14.123 111 HG13 VAL 18 HG13 VAL 18 20.899 21.519 -15.754 112 HG21 VAL 18 HG21 VAL 18 18.212 23.544 -17.279 113 HG22 VAL 18 HG22 VAL 18 18.241 21.781 -17.283 114 HG23 VAL 18 HG23 VAL 18 19.721 22.689 -17.595 115 H LEU 19 HN LEU 19 16.836 21.062 -13.051 116 HA LEU 19 HA LEU 19 18.227 22.333 -10.786 117 HB2 LEU 19 HB2 LEU 19 15.744 22.821 -11.034 118 HB3 LEU 19 HB1 LEU 19 15.466 21.120 -10.717 119 HG LEU 19 HG LEU 19 16.490 21.370 -8.492 120 HD11 LEU 19 HD11 LEU 19 18.023 23.192 -8.954 121 HD12 LEU 19 HD12 LEU 19 16.945 23.627 -7.628 122 HD13 LEU 19 HD13 LEU 19 16.670 24.285 -9.241 123 HD21 LEU 19 HD21 LEU 19 14.273 23.332 -9.081 124 HD22 LEU 19 HD22 LEU 19 14.687 22.691 -7.490 125 HD23 LEU 19 HD23 LEU 19 14.079 21.611 -8.745 126 H VAL 20 HN VAL 20 19.386 20.981 -9.554 127 HA VAL 20 HA VAL 20 18.893 18.094 -9.877 128 HB VAL 20 HB VAL 20 21.579 19.450 -9.560 129 HG11 VAL 20 HG11 VAL 20 20.906 16.523 -9.868 130 HG12 VAL 20 HG12 VAL 20 21.528 17.306 -8.414 131 HG13 VAL 20 HG13 VAL 20 22.530 17.213 -9.862 132 HG21 VAL 20 HG21 VAL 20 20.657 19.719 -11.798 133 HG22 VAL 20 HG22 VAL 20 20.393 17.979 -11.914 134 HG23 VAL 20 HG23 VAL 20 22.035 18.620 -11.815 135 H ASN 21 HN ASN 21 18.607 16.986 -8.079 136 HA ASN 21 HA ASN 21 18.888 18.354 -5.514 137 HB2 ASN 21 HB2 ASN 21 16.753 17.177 -6.175 138 HB3 ASN 21 HB1 ASN 21 17.640 15.659 -6.105 139 HD21 ASN 21 HD21 ASN 21 16.108 15.003 -4.539 140 HD22 ASN 21 HD22 ASN 21 16.287 15.501 -2.886 141 H ASP 22 HN ASP 22 19.751 16.914 -3.665 142 HA ASP 22 HA ASP 22 22.423 16.287 -4.338 143 HB2 ASP 22 HB2 ASP 22 21.913 17.067 -2.113 144 HB3 ASP 22 HB1 ASP 22 20.855 15.687 -1.826 145 H GLU 23 HN GLU 23 19.668 14.196 -3.511 146 HA GLU 23 HA GLU 23 21.232 11.828 -4.115 147 HB2 GLU 23 HB2 GLU 23 19.170 10.591 -3.545 148 HB3 GLU 23 HB1 GLU 23 19.666 11.694 -2.271 149 HG2 GLU 23 HG2 GLU 23 17.705 12.695 -4.251 150 HG3 GLU 23 HG1 GLU 23 17.154 11.484 -3.096 151 H ASP 24 HN ASP 24 20.208 14.006 -6.109 152 HA ASP 24 HA ASP 24 19.077 12.105 -8.060 153 HB2 ASP 24 HB2 ASP 24 17.520 13.953 -7.354 154 HB3 ASP 24 HB1 ASP 24 18.663 15.103 -8.037 155 H GLN 25 HN GLN 25 19.670 12.560 -10.325 156 HA GLN 25 HA GLN 25 22.442 13.506 -10.443 157 HB2 GLN 25 HB2 GLN 25 20.955 11.453 -12.075 158 HB3 GLN 25 HB1 GLN 25 22.576 12.019 -12.469 159 HG2 GLN 25 HG2 GLN 25 23.496 11.075 -10.548 160 HG3 GLN 25 HG1 GLN 25 21.932 10.904 -9.768 161 HE21 GLN 25 HE21 GLN 25 22.431 8.730 -9.348 162 HE22 GLN 25 HE22 GLN 25 22.305 7.528 -10.586 163 H HIS 26 HN HIS 26 19.299 13.769 -12.022 164 HA HIS 26 HA HIS 26 19.978 16.264 -13.182 165 HB2 HIS 26 HB2 HIS 26 19.746 15.634 -15.576 166 HB3 HIS 26 HB1 HIS 26 21.181 14.947 -14.829 167 HD1 HIS 26 HD1 HIS 26 19.769 13.831 -17.442 168 HD2 HIS 26 HD2 HIS 26 19.361 12.292 -13.591 169 HE1 HIS 26 HE1 HIS 26 19.065 11.443 -17.731 170 HE2 HIS 26 HE2 HIS 26 19.145 10.465 -15.412 171 H SER 27 HN SER 27 18.155 17.428 -13.319 172 HA SER 27 HA SER 27 15.647 16.152 -14.028 173 HB2 SER 27 HB2 SER 27 16.071 17.493 -11.348 174 HB3 SER 27 HB1 SER 27 14.489 17.094 -12.014 175 HG SER 27 HG SER 27 16.558 15.351 -11.170 176 H LEU 28 HN LEU 28 14.168 17.517 -14.915 177 HA LEU 28 HA LEU 28 14.894 20.358 -15.113 178 HB2 LEU 28 HB2 LEU 28 13.494 18.465 -16.944 179 HB3 LEU 28 HB1 LEU 28 12.947 20.130 -16.945 180 HG LEU 28 HG LEU 28 14.571 19.722 -18.735 181 HD11 LEU 28 HD11 LEU 28 14.446 21.942 -17.724 182 HD12 LEU 28 HD12 LEU 28 16.088 21.565 -18.243 183 HD13 LEU 28 HD13 LEU 28 15.660 21.474 -16.535 184 HD21 LEU 28 HD21 LEU 28 15.858 17.930 -17.706 185 HD22 LEU 28 HD22 LEU 28 16.491 19.059 -16.505 186 HD23 LEU 28 HD23 LEU 28 16.914 19.255 -18.206 187 H TRP 29 HN TRP 29 13.802 21.656 -13.801 188 HA TRP 29 HA TRP 29 11.239 20.685 -12.722 189 HB2 TRP 29 HB2 TRP 29 13.049 20.921 -11.062 190 HB3 TRP 29 HB1 TRP 29 13.233 22.611 -11.509 191 HD1 TRP 29 HD1 TRP 29 11.684 24.330 -10.347 192 HE1 TRP 29 HE1 TRP 29 9.833 24.173 -8.564 193 HE3 TRP 29 HE3 TRP 29 11.096 19.259 -10.257 194 HZ2 TRP 29 HZ2 TRP 29 8.329 22.149 -7.282 195 HZ3 TRP 29 HZ3 TRP 29 9.436 18.289 -8.721 196 HH2 TRP 29 HH2 TRP 29 8.082 19.707 -7.265 197 HA PRO 30 HA PRO 30 9.486 24.113 -15.012 198 HB2 PRO 30 HB2 PRO 30 7.027 23.425 -13.556 199 HB3 PRO 30 HB1 PRO 30 7.340 23.420 -15.294 200 HG2 PRO 30 HG2 PRO 30 7.047 21.139 -13.895 201 HG3 PRO 30 HG1 PRO 30 8.157 21.262 -15.274 202 HD2 PRO 30 HD2 PRO 30 8.763 21.335 -12.339 203 HD3 PRO 30 HD1 PRO 30 9.644 20.528 -13.653 204 H VAL 31 HN VAL 31 9.322 26.199 -14.532 205 HA VAL 31 HA VAL 31 9.612 27.113 -11.826 206 HB VAL 31 HB VAL 31 9.086 28.775 -14.299 207 HG11 VAL 31 HG11 VAL 31 10.428 29.443 -11.687 208 HG12 VAL 31 HG12 VAL 31 8.871 30.046 -12.258 209 HG13 VAL 31 HG13 VAL 31 10.357 30.503 -13.096 210 HG21 VAL 31 HG21 VAL 31 10.962 27.292 -14.712 211 HG22 VAL 31 HG22 VAL 31 11.719 27.811 -13.206 212 HG23 VAL 31 HG23 VAL 31 11.511 28.958 -14.529 213 H PHE 32 HN PHE 32 7.014 26.283 -13.771 214 HA PHE 32 HA PHE 32 5.012 28.013 -12.709 215 HB2 PHE 32 HB2 PHE 32 4.836 26.693 -14.856 216 HB3 PHE 32 HB1 PHE 32 4.651 25.243 -13.878 217 HD1 PHE 32 HD2 PHE 32 3.125 28.539 -14.606 218 HD2 PHE 32 HD1 PHE 32 2.548 24.614 -13.064 219 HE1 PHE 32 HE2 PHE 32 0.702 28.946 -14.490 220 HE2 PHE 32 HE1 PHE 32 0.123 25.013 -12.948 221 HZ PHE 32 HZ PHE 32 -0.802 27.184 -13.658 222 H ALA 33 HN ALA 33 6.729 25.316 -11.548 223 HA ALA 33 HA ALA 33 4.838 24.943 -9.329 224 HB1 ALA 33 HB1 ALA 33 7.127 23.178 -10.213 225 HB2 ALA 33 HB2 ALA 33 5.416 22.884 -10.520 226 HB3 ALA 33 HB3 ALA 33 6.033 22.853 -8.870 227 H ASP 34 HN ASP 34 5.604 25.147 -7.191 228 HA ASP 34 HA ASP 34 7.493 27.226 -6.860 229 HB2 ASP 34 HB2 ASP 34 5.557 26.757 -5.325 230 HB3 ASP 34 HB1 ASP 34 6.460 25.379 -4.700 231 H ILE 35 HN ILE 35 9.612 27.149 -6.772 232 HA ILE 35 HA ILE 35 11.022 24.654 -6.781 233 HB ILE 35 HB ILE 35 12.143 27.455 -6.542 234 HG12 ILE 35 HG12 ILE 35 11.718 25.716 -8.985 235 HG13 ILE 35 HG11 ILE 35 10.791 27.156 -8.579 236 HG21 ILE 35 HG21 ILE 35 14.222 26.452 -7.372 237 HG22 ILE 35 HG22 ILE 35 13.464 24.860 -7.334 238 HG23 ILE 35 HG23 ILE 35 13.728 25.747 -5.833 239 HD11 ILE 35 HD11 ILE 35 13.737 27.094 -9.178 240 HD12 ILE 35 HD12 ILE 35 12.769 28.529 -8.840 241 HD13 ILE 35 HD13 ILE 35 12.468 27.586 -10.301 242 HA PRO 36 HA PRO 36 11.259 24.535 -2.304 243 HB2 PRO 36 HB2 PRO 36 12.141 22.008 -2.106 244 HB3 PRO 36 HB1 PRO 36 10.471 22.371 -2.563 245 HG2 PRO 36 HG2 PRO 36 12.789 21.609 -4.295 246 HG3 PRO 36 HG1 PRO 36 11.105 21.058 -4.370 247 HD2 PRO 36 HD2 PRO 36 12.154 23.013 -5.992 248 HD3 PRO 36 HD1 PRO 36 10.435 22.887 -5.573 249 H ALA 37 HN ALA 37 13.024 23.774 -0.736 250 HA ALA 37 HA ALA 37 15.573 24.854 -1.676 251 HB1 ALA 37 HB1 ALA 37 16.153 25.046 0.678 252 HB2 ALA 37 HB2 ALA 37 14.663 24.217 1.131 253 HB3 ALA 37 HB3 ALA 37 14.592 25.806 0.363 254 H GLY 38 HN GLY 38 17.576 23.779 -1.078 255 HA2 GLY 38 HA2 GLY 38 18.788 21.843 -0.372 256 HA3 GLY 38 HA1 GLY 38 17.323 20.887 -0.578 257 H TRP 39 HN TRP 39 16.841 22.338 -3.149 258 HA TRP 39 HA TRP 39 18.385 20.559 -4.834 259 HB2 TRP 39 HB2 TRP 39 16.118 22.479 -5.403 260 HB3 TRP 39 HB1 TRP 39 16.922 21.535 -6.653 261 HD1 TRP 39 HD1 TRP 39 15.170 20.732 -3.260 262 HE1 TRP 39 HE1 TRP 39 13.760 18.597 -3.591 263 HE3 TRP 39 HE3 TRP 39 16.308 19.759 -8.148 264 HZ2 TRP 39 HZ2 TRP 39 13.202 16.760 -5.661 265 HZ3 TRP 39 HZ3 TRP 39 15.292 17.801 -9.232 266 HH2 TRP 39 HH2 TRP 39 13.770 16.330 -8.015 267 H ARG 40 HN ARG 40 19.712 21.252 -6.541 268 HA ARG 40 HA ARG 40 20.853 23.932 -6.103 269 HB2 ARG 40 HB2 ARG 40 22.216 21.806 -5.633 270 HB3 ARG 40 HB1 ARG 40 22.255 21.585 -7.374 271 HG2 ARG 40 HG2 ARG 40 23.202 24.133 -6.120 272 HG3 ARG 40 HG1 ARG 40 24.247 22.719 -6.222 273 HD2 ARG 40 HD2 ARG 40 23.979 22.697 -8.654 274 HD3 ARG 40 HD1 ARG 40 22.917 24.102 -8.550 275 HE ARG 40 HE ARG 40 25.194 24.918 -7.302 276 HH11 ARG 40 HH11 ARG 40 24.505 23.577 -10.466 277 HH12 ARG 40 HH12 ARG 40 25.836 24.383 -11.243 278 HH21 ARG 40 HH21 ARG 40 26.923 25.971 -8.300 279 HH22 ARG 40 HH22 ARG 40 27.203 25.772 -10.005 280 H VAL 41 HN VAL 41 20.450 25.353 -7.660 281 HA VAL 41 HA VAL 41 19.391 24.588 -10.208 282 HB VAL 41 HB VAL 41 20.371 27.302 -9.285 283 HG11 VAL 41 HG11 VAL 41 18.587 26.533 -11.597 284 HG12 VAL 41 HG12 VAL 41 20.244 27.129 -11.713 285 HG13 VAL 41 HG13 VAL 41 18.971 28.181 -11.095 286 HG21 VAL 41 HG21 VAL 41 17.997 27.796 -8.872 287 HG22 VAL 41 HG22 VAL 41 18.589 26.488 -7.847 288 HG23 VAL 41 HG23 VAL 41 17.592 26.125 -9.257 289 H VAL 42 HN VAL 42 20.534 23.956 -11.905 290 HA VAL 42 HA VAL 42 23.396 24.597 -12.012 291 HB VAL 42 HB VAL 42 21.808 22.600 -13.638 292 HG11 VAL 42 HG11 VAL 42 24.003 21.710 -14.301 293 HG12 VAL 42 HG12 VAL 42 24.787 23.039 -13.447 294 HG13 VAL 42 HG13 VAL 42 23.769 23.371 -14.848 295 HG21 VAL 42 HG21 VAL 42 23.644 22.186 -11.280 296 HG22 VAL 42 HG22 VAL 42 22.937 20.902 -12.259 297 HG23 VAL 42 HG23 VAL 42 21.896 21.953 -11.302 298 H HIS 43 HN HIS 43 20.375 25.049 -13.704 299 HA HIS 43 HA HIS 43 21.587 27.027 -15.455 300 HB2 HIS 43 HB2 HIS 43 21.844 24.785 -16.599 301 HB3 HIS 43 HB1 HIS 43 20.090 24.672 -16.634 302 HD1 HIS 43 HD1 HIS 43 22.909 26.764 -18.031 303 HD2 HIS 43 HD2 HIS 43 18.905 25.914 -18.770 304 HE1 HIS 43 HE1 HIS 43 22.397 27.792 -20.270 305 HE2 HIS 43 HE2 HIS 43 20.064 27.020 -20.804 306 H GLY 44 HN GLY 44 20.068 28.531 -16.195 307 HA2 GLY 44 HA2 GLY 44 17.623 28.573 -14.657 308 HA3 GLY 44 HA1 GLY 44 18.220 29.847 -15.702 309 H GLU 45 HN GLU 45 16.073 30.111 -16.448 310 HA GLU 45 HA GLU 45 14.799 27.900 -17.801 311 HB2 GLU 45 HB2 GLU 45 13.053 29.694 -18.352 312 HB3 GLU 45 HB1 GLU 45 13.252 29.240 -16.663 313 HG2 GLU 45 HG2 GLU 45 14.553 31.225 -16.238 314 HG3 GLU 45 HG1 GLU 45 14.514 31.646 -17.943 315 H ALA 46 HN ALA 46 15.918 27.358 -19.534 316 HA ALA 46 HA ALA 46 15.760 29.190 -21.824 317 HB1 ALA 46 HB1 ALA 46 17.944 28.393 -22.640 318 HB2 ALA 46 HB2 ALA 46 18.152 27.462 -21.157 319 HB3 ALA 46 HB3 ALA 46 18.097 29.223 -21.091 320 H SER 47 HN SER 47 15.940 27.869 -23.912 321 HA SER 47 HA SER 47 13.891 26.227 -24.313 322 HB2 SER 47 HB2 SER 47 16.606 25.756 -25.562 323 HB3 SER 47 HB1 SER 47 15.050 25.267 -26.236 324 HG SER 47 HG SER 47 14.793 27.210 -26.982 325 H ARG 48 HN ARG 48 13.183 24.237 -23.797 326 HA ARG 48 HA ARG 48 14.452 22.851 -21.708 327 HB2 ARG 48 HB2 ARG 48 11.980 22.835 -22.250 328 HB3 ARG 48 HB1 ARG 48 12.356 21.649 -23.498 329 HG2 ARG 48 HG2 ARG 48 13.633 20.638 -21.294 330 HG3 ARG 48 HG1 ARG 48 12.161 21.333 -20.615 331 HD2 ARG 48 HD2 ARG 48 12.225 19.460 -22.963 332 HD3 ARG 48 HD1 ARG 48 11.980 18.951 -21.297 333 HE ARG 48 HE ARG 48 10.046 20.753 -21.541 334 HH11 ARG 48 HH11 ARG 48 11.012 18.216 -23.754 335 HH12 ARG 48 HH12 ARG 48 9.417 17.995 -24.400 336 HH21 ARG 48 HH21 ARG 48 7.959 20.468 -22.359 337 HH22 ARG 48 HH22 ARG 48 7.664 19.262 -23.593 338 H ALA 49 HN ALA 49 14.213 22.127 -25.175 339 HA ALA 49 HA ALA 49 15.582 19.702 -25.195 340 HB1 ALA 49 HB1 ALA 49 14.423 20.614 -27.150 341 HB2 ALA 49 HB2 ALA 49 16.087 20.176 -27.538 342 HB3 ALA 49 HB3 ALA 49 15.654 21.868 -27.295 343 H ALA 50 HN ALA 50 16.822 23.010 -25.275 344 HA ALA 50 HA ALA 50 19.550 22.336 -25.566 345 HB1 ALA 50 HB1 ALA 50 20.009 24.624 -24.861 346 HB2 ALA 50 HB2 ALA 50 18.341 24.804 -24.316 347 HB3 ALA 50 HB3 ALA 50 18.689 24.581 -26.030 348 H CYS 51 HN CYS 51 17.464 22.820 -22.769 349 HA CYS 51 HA CYS 51 19.437 22.562 -20.774 350 HB2 CYS 51 HB2 CYS 51 16.474 21.951 -20.725 351 HB3 CYS 51 HB1 CYS 51 17.506 21.964 -19.296 352 HG CYS 51 HG CYS 51 16.198 24.537 -21.003 353 H LEU 52 HN LEU 52 17.191 20.142 -22.138 354 HA LEU 52 HA LEU 52 18.159 17.901 -20.834 355 HB2 LEU 52 HB2 LEU 52 16.758 18.379 -23.395 356 HB3 LEU 52 HB1 LEU 52 17.555 16.829 -23.230 357 HG LEU 52 HG LEU 52 16.250 16.388 -21.180 358 HD11 LEU 52 HD11 LEU 52 15.886 18.691 -20.474 359 HD12 LEU 52 HD12 LEU 52 14.365 17.807 -20.602 360 HD13 LEU 52 HD13 LEU 52 14.829 18.954 -21.860 361 HD21 LEU 52 HD21 LEU 52 14.095 16.037 -22.292 362 HD22 LEU 52 HD22 LEU 52 15.448 15.570 -23.322 363 HD23 LEU 52 HD23 LEU 52 14.607 17.093 -23.608 364 H ASP 53 HN ASP 53 19.248 19.175 -24.002 365 HA ASP 53 HA ASP 53 21.257 17.300 -24.440 366 HB2 ASP 53 HB2 ASP 53 20.910 20.139 -25.333 367 HB3 ASP 53 HB1 ASP 53 22.416 19.296 -25.678 368 H TYR 54 HN TYR 54 21.408 20.354 -22.657 369 HA TYR 54 HA TYR 54 24.152 20.369 -22.150 370 HB2 TYR 54 HB2 TYR 54 22.739 22.316 -21.740 371 HB3 TYR 54 HB1 TYR 54 21.898 21.457 -20.455 372 HD1 TYR 54 HD1 TYR 54 25.379 22.435 -21.409 373 HD2 TYR 54 HD2 TYR 54 22.550 21.877 -18.279 374 HE1 TYR 54 HE1 TYR 54 27.015 23.292 -19.786 375 HE2 TYR 54 HE2 TYR 54 24.180 22.731 -16.646 376 HH TYR 54 HH TYR 54 27.036 24.338 -17.564 377 H VAL 55 HN VAL 55 21.504 19.040 -20.147 378 HA VAL 55 HA VAL 55 23.276 18.219 -18.077 379 HB VAL 55 HB VAL 55 21.397 17.058 -17.079 380 HG11 VAL 55 HG11 VAL 55 19.830 18.931 -16.906 381 HG12 VAL 55 HG12 VAL 55 20.599 19.689 -18.300 382 HG13 VAL 55 HG13 VAL 55 21.510 19.457 -16.805 383 HG21 VAL 55 HG21 VAL 55 19.907 17.626 -19.642 384 HG22 VAL 55 HG22 VAL 55 19.201 16.970 -18.165 385 HG23 VAL 55 HG23 VAL 55 20.407 16.039 -19.054 386 H GLU 56 HN GLU 56 21.860 16.547 -20.842 387 HA GLU 56 HA GLU 56 22.751 13.971 -20.017 388 HB2 GLU 56 HB2 GLU 56 21.904 14.893 -22.767 389 HB3 GLU 56 HB1 GLU 56 22.015 13.225 -22.212 390 HG2 GLU 56 HG2 GLU 56 20.152 15.330 -21.132 391 HG3 GLU 56 HG1 GLU 56 19.708 14.012 -22.205 392 H LYS 57 HN LYS 57 24.112 16.522 -22.025 393 HA LYS 57 HA LYS 57 26.330 14.973 -22.934 394 HB2 LYS 57 HB2 LYS 57 25.878 17.946 -22.758 395 HB3 LYS 57 HB1 LYS 57 27.376 17.251 -23.359 396 HG2 LYS 57 HG2 LYS 57 26.146 16.107 -25.128 397 HG3 LYS 57 HG1 LYS 57 24.636 16.789 -24.519 398 HD2 LYS 57 HD2 LYS 57 25.482 19.041 -24.950 399 HD3 LYS 57 HD1 LYS 57 26.991 18.361 -25.562 400 HE2 LYS 57 HE2 LYS 57 25.727 17.212 -27.335 401 HE3 LYS 57 HE1 LYS 57 24.240 17.946 -26.734 402 HZ1 LYS 57 HZ1 LYS 57 25.196 20.128 -27.192 403 HZ2 LYS 57 HZ2 LYS 57 25.097 19.186 -28.595 404 HZ3 LYS 57 HZ3 LYS 57 26.593 19.395 -27.819 405 H ASN 58 HN ASN 58 25.723 17.019 -20.130 406 HA ASN 58 HA ASN 58 28.281 16.871 -18.960 407 HB2 ASN 58 HB2 ASN 58 25.510 17.192 -17.846 408 HB3 ASN 58 HB1 ASN 58 26.847 16.891 -16.746 409 HD21 ASN 58 HD21 ASN 58 27.182 18.738 -19.706 410 HD22 ASN 58 HD22 ASN 58 27.417 20.268 -18.938 411 H TRP 59 HN TRP 59 25.532 14.707 -18.962 412 HA TRP 59 HA TRP 59 25.295 12.495 -18.611 413 HB2 TRP 59 HB2 TRP 59 27.149 12.422 -20.290 414 HB3 TRP 59 HB1 TRP 59 28.297 12.339 -18.961 415 HD1 TRP 59 HD1 TRP 59 25.596 10.255 -17.799 416 HE1 TRP 59 HE1 TRP 59 25.996 7.770 -18.335 417 HE3 TRP 59 HE3 TRP 59 29.301 10.768 -21.286 418 HZ2 TRP 59 HZ2 TRP 59 27.661 6.231 -20.025 419 HZ3 TRP 59 HZ3 TRP 59 30.241 8.740 -22.316 420 HH2 TRP 59 HH2 TRP 59 29.436 6.519 -21.697 421 H THR 60 HN THR 60 24.693 13.068 -16.438 422 HA THR 60 HA THR 60 26.635 12.192 -14.423 423 HB THR 60 HB THR 60 24.930 13.155 -12.806 424 HG1 THR 60 HG1 THR 60 23.330 14.457 -13.656 425 HG21 THR 60 HG21 THR 60 26.112 15.067 -14.821 426 HG22 THR 60 HG22 THR 60 26.976 14.363 -13.453 427 HG23 THR 60 HG23 THR 60 25.620 15.458 -13.175 428 H ASP 61 HN ASP 61 24.262 10.961 -16.305 429 HA ASP 61 HA ASP 61 22.815 9.481 -14.272 430 HB2 ASP 61 HB2 ASP 61 21.730 10.504 -16.341 431 HB3 ASP 61 HB1 ASP 61 22.505 9.222 -17.262 432 H LEU 62 HN LEU 62 22.426 7.122 -14.706 433 HA LEU 62 HA LEU 62 24.911 5.746 -14.581 434 HB2 LEU 62 HB2 LEU 62 22.105 4.646 -14.800 435 HB3 LEU 62 HB1 LEU 62 23.527 3.733 -14.336 436 HG LEU 62 HG LEU 62 22.369 6.036 -12.763 437 HD11 LEU 62 HD11 LEU 62 20.882 4.111 -12.745 438 HD12 LEU 62 HD12 LEU 62 21.663 4.311 -11.176 439 HD13 LEU 62 HD13 LEU 62 22.224 3.065 -12.288 440 HD21 LEU 62 HD21 LEU 62 24.767 5.808 -12.450 441 HD22 LEU 62 HD22 LEU 62 24.579 4.085 -12.133 442 HD23 LEU 62 HD23 LEU 62 23.910 5.266 -11.009 443 H ARG 63 HN ARG 63 22.435 6.155 -17.069 444 HA ARG 63 HA ARG 63 24.289 5.270 -19.083 445 HB2 ARG 63 HB2 ARG 63 23.195 3.153 -18.061 446 HB3 ARG 63 HB1 ARG 63 21.751 3.668 -18.918 447 HG2 ARG 63 HG2 ARG 63 22.952 2.046 -20.230 448 HG3 ARG 63 HG1 ARG 63 23.011 3.619 -21.031 449 HD2 ARG 63 HD2 ARG 63 25.250 3.991 -20.073 450 HD3 ARG 63 HD1 ARG 63 25.189 2.387 -19.346 451 HE ARG 63 HE ARG 63 24.740 1.981 -22.026 452 HH11 ARG 63 HH11 ARG 63 27.299 3.402 -20.085 453 HH12 ARG 63 HH12 ARG 63 28.551 3.003 -21.231 454 HH21 ARG 63 HH21 ARG 63 26.373 1.471 -23.519 455 HH22 ARG 63 HH22 ARG 63 28.017 1.934 -23.198 456 HA PRO 64 HA PRO 64 21.591 8.244 -21.045 457 HB2 PRO 64 HB2 PRO 64 23.059 8.579 -23.285 458 HB3 PRO 64 HB1 PRO 64 23.538 9.270 -21.731 459 HG2 PRO 64 HG2 PRO 64 24.536 6.811 -23.103 460 HG3 PRO 64 HG1 PRO 64 25.444 8.041 -22.206 461 HD2 PRO 64 HD2 PRO 64 24.718 5.613 -21.164 462 HD3 PRO 64 HD1 PRO 64 25.006 7.065 -20.187 463 H LYS 65 HN LYS 65 19.792 7.835 -22.133 464 HA LYS 65 HA LYS 65 19.730 5.542 -23.963 465 HB2 LYS 65 HB2 LYS 65 18.056 5.584 -22.146 466 HB3 LYS 65 HB1 LYS 65 17.448 7.117 -22.751 467 HG2 LYS 65 HG2 LYS 65 16.006 5.301 -23.441 468 HG3 LYS 65 HG1 LYS 65 16.789 6.028 -24.845 469 HD2 LYS 65 HD2 LYS 65 16.824 3.624 -25.076 470 HD3 LYS 65 HD1 LYS 65 18.468 4.200 -24.796 471 HE2 LYS 65 HE2 LYS 65 18.108 2.234 -23.465 472 HE3 LYS 65 HE1 LYS 65 18.200 3.633 -22.396 473 HZ1 LYS 65 HZ1 LYS 65 15.739 3.654 -22.363 474 HZ2 LYS 65 HZ2 LYS 65 16.403 2.246 -21.702 475 HZ3 LYS 65 HZ3 LYS 65 15.735 2.214 -23.259 476 H SER 66 HN SER 66 18.998 8.982 -23.731 477 HA SER 66 HA SER 66 18.070 9.219 -26.420 478 HB2 SER 66 HB2 SER 66 19.064 11.378 -24.543 479 HB3 SER 66 HB1 SER 66 18.126 11.632 -26.013 480 HG SER 66 HG SER 66 17.267 11.056 -23.529 481 H LEU 67 HN LEU 67 19.716 8.259 -27.686 482 HA LEU 67 HA LEU 67 22.241 9.737 -27.839 483 HB2 LEU 67 HB2 LEU 67 21.934 7.114 -27.885 484 HB3 LEU 67 HB1 LEU 67 21.583 7.387 -29.579 485 HG LEU 67 HG LEU 67 24.148 8.199 -28.204 486 HD11 LEU 67 HD11 LEU 67 23.880 5.769 -28.316 487 HD12 LEU 67 HD12 LEU 67 25.167 6.336 -29.377 488 HD13 LEU 67 HD13 LEU 67 23.603 5.881 -30.054 489 HD21 LEU 67 HD21 LEU 67 24.987 8.547 -30.473 490 HD22 LEU 67 HD22 LEU 67 23.618 9.601 -30.126 491 HD23 LEU 67 HD23 LEU 67 23.393 8.166 -31.125 492 H ARG 68 HN ARG 68 21.740 11.619 -28.857 493 HA ARG 68 HA ARG 68 20.297 11.439 -31.421 494 HB2 ARG 68 HB2 ARG 68 19.216 12.753 -29.544 495 HB3 ARG 68 HB1 ARG 68 20.558 13.881 -29.659 496 HG2 ARG 68 HG2 ARG 68 19.016 14.937 -30.963 497 HG3 ARG 68 HG1 ARG 68 19.853 13.973 -32.182 498 HD2 ARG 68 HD2 ARG 68 17.272 13.234 -30.802 499 HD3 ARG 68 HD1 ARG 68 17.422 13.849 -32.445 500 HE ARG 68 HE ARG 68 18.920 11.679 -32.638 501 HH11 ARG 68 HH11 ARG 68 15.863 12.080 -30.981 502 HH12 ARG 68 HH12 ARG 68 15.319 10.459 -31.318 503 HH21 ARG 68 HH21 ARG 68 18.238 9.551 -33.058 504 HH22 ARG 68 HH22 ARG 68 16.679 9.010 -32.511 505 H ASP 69 HN ASP 69 21.658 11.579 -33.084 506 HA ASP 69 HA ASP 69 23.733 13.659 -32.980 507 HB2 ASP 69 HB2 ASP 69 25.399 12.258 -33.931 508 HB3 ASP 69 HB1 ASP 69 24.710 11.350 -32.593 509 H ALA 70 HN ALA 70 24.640 14.012 -35.273 510 HA ALA 70 HA ALA 70 22.796 13.462 -37.430 511 HB1 ALA 70 HB1 ALA 70 21.741 15.406 -36.373 512 HB2 ALA 70 HB2 ALA 70 22.376 15.812 -37.967 513 HB3 ALA 70 HB3 ALA 70 23.251 16.307 -36.518 514 H MET 71 HN MET 71 23.765 13.669 -39.425 515 HA MET 71 HA MET 71 26.646 13.888 -39.385 516 HB2 MET 71 HB2 MET 71 25.330 12.172 -40.721 517 HB3 MET 71 HB1 MET 71 24.865 13.481 -41.796 518 HG2 MET 71 HG2 MET 71 27.734 12.797 -41.231 519 HG3 MET 71 HG1 MET 71 26.808 12.022 -42.512 520 HE1 MET 71 HE1 MET 71 25.844 13.291 -44.620 521 HE2 MET 71 HE2 MET 71 25.990 15.031 -44.869 522 HE3 MET 71 HE3 MET 71 24.988 14.408 -43.557 523 H VAL 72 HN VAL 72 27.465 15.859 -39.298 524 HA VAL 72 HA VAL 72 26.229 17.979 -40.933 525 HB VAL 72 HB VAL 72 27.960 18.327 -38.477 526 HG11 VAL 72 HG11 VAL 72 26.368 20.323 -40.084 527 HG12 VAL 72 HG12 VAL 72 28.125 20.189 -40.029 528 HG13 VAL 72 HG13 VAL 72 27.232 20.670 -38.586 529 HG21 VAL 72 HG21 VAL 72 25.890 19.045 -37.346 530 HG22 VAL 72 HG22 VAL 72 25.829 17.354 -37.841 531 HG23 VAL 72 HG23 VAL 72 24.964 18.577 -38.771 532 H GLU 73 HN GLU 73 27.326 18.075 -42.768 533 HA GLU 73 HA GLU 73 30.230 18.398 -42.654 534 HB2 GLU 73 HB2 GLU 73 29.833 16.021 -43.103 535 HB3 GLU 73 HB1 GLU 73 28.802 16.442 -44.462 536 HG2 GLU 73 HG2 GLU 73 30.804 17.583 -45.475 537 HG3 GLU 73 HG1 GLU 73 31.768 16.821 -44.207 538 H ASP 74 HN ASP 74 30.646 20.248 -43.637 539 HA ASP 74 HA ASP 74 29.216 20.869 -46.127 540 HB2 ASP 74 HB2 ASP 74 28.226 22.334 -44.518 541 HB3 ASP 74 HB1 ASP 74 29.793 22.737 -43.824 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 9.211 38.230 4.957 2 H2 GLY 1 HT2 GLY 1 9.081 37.406 6.434 3 H3 GLY 1 HT3 GLY 1 9.948 38.862 6.347 4 HA2 GLY 1 HA1 GLY 1 7.777 39.179 7.376 5 HA3 GLY 1 HA2 GLY 1 7.963 40.100 5.890 6 H SER 2 HN SER 2 6.880 39.401 3.998 7 HA SER 2 HA SER 2 4.377 38.104 4.557 8 HB2 SER 2 HB2 SER 2 4.077 38.459 2.017 9 HB3 SER 2 HB1 SER 2 4.189 39.890 3.043 10 HG SER 2 HG SER 2 5.580 40.276 1.403 11 H HIS 3 HN HIS 3 4.542 35.990 4.942 12 HA HIS 3 HA HIS 3 5.556 34.322 2.746 13 HB2 HIS 3 HB2 HIS 3 6.466 32.706 4.315 14 HB3 HIS 3 HB1 HIS 3 7.184 34.284 4.622 15 HD1 HIS 3 HD1 HIS 3 5.601 31.510 6.306 16 HD2 HIS 3 HD2 HIS 3 5.903 35.612 6.946 17 HE1 HIS 3 HE1 HIS 3 5.016 31.869 8.729 18 HE2 HIS 3 HE2 HIS 3 5.013 34.373 9.031 19 H MET 4 HN MET 4 2.925 35.351 3.535 20 HA MET 4 HA MET 4 1.502 33.009 4.491 21 HB2 MET 4 HB2 MET 4 0.459 35.716 3.635 22 HB3 MET 4 HB1 MET 4 -0.501 34.439 4.372 23 HG2 MET 4 HG2 MET 4 1.781 35.932 5.646 24 HG3 MET 4 HG1 MET 4 0.066 36.120 6.005 25 HE1 MET 4 HE1 MET 4 -0.799 32.657 7.631 26 HE2 MET 4 HE2 MET 4 -0.952 33.120 5.937 27 HE3 MET 4 HE3 MET 4 -1.409 34.255 7.205 28 H SER 5 HN SER 5 1.606 31.489 2.912 29 HA SER 5 HA SER 5 1.156 32.079 0.156 30 HB2 SER 5 HB2 SER 5 1.098 29.366 1.495 31 HB3 SER 5 HB1 SER 5 1.413 29.717 -0.206 32 HG SER 5 HG SER 5 3.397 29.477 0.648 33 H THR 6 HN THR 6 -0.920 33.230 0.693 34 HA THR 6 HA THR 6 -3.224 31.538 1.089 35 HB THR 6 HB THR 6 -4.434 33.739 0.422 36 HG1 THR 6 HG1 THR 6 -3.068 35.592 0.754 37 HG21 THR 6 HG21 THR 6 -4.093 34.668 2.672 38 HG22 THR 6 HG22 THR 6 -2.700 33.607 2.890 39 HG23 THR 6 HG23 THR 6 -4.315 32.918 2.713 40 H ASN 7 HN ASN 7 -1.695 33.283 -1.571 41 HA ASN 7 HA ASN 7 -3.471 32.059 -3.514 42 HB2 ASN 7 HB2 ASN 7 -2.732 34.363 -3.892 43 HB3 ASN 7 HB1 ASN 7 -1.050 33.849 -3.864 44 HD21 ASN 7 HD21 ASN 7 -4.030 33.823 -5.664 45 HD22 ASN 7 HD22 ASN 7 -3.328 33.381 -7.182 46 HA PRO 8 HA PRO 8 -0.841 28.497 -3.674 47 HB2 PRO 8 HB2 PRO 8 -2.128 27.155 -5.618 48 HB3 PRO 8 HB1 PRO 8 -2.807 27.355 -3.998 49 HG2 PRO 8 HG2 PRO 8 -3.422 28.870 -6.504 50 HG3 PRO 8 HG1 PRO 8 -4.534 28.243 -5.274 51 HD2 PRO 8 HD2 PRO 8 -3.731 30.842 -5.381 52 HD3 PRO 8 HD1 PRO 8 -4.188 30.022 -3.875 53 H PHE 9 HN PHE 9 -0.557 30.974 -5.653 54 HA PHE 9 HA PHE 9 0.762 31.590 -7.379 55 HB2 PHE 9 HB2 PHE 9 2.303 29.124 -6.565 56 HB3 PHE 9 HB1 PHE 9 2.920 30.410 -7.594 57 HD1 PHE 9 HD2 PHE 9 3.017 32.772 -6.584 58 HD2 PHE 9 HD1 PHE 9 2.547 29.232 -4.262 59 HE1 PHE 9 HE2 PHE 9 3.794 33.981 -4.587 60 HE2 PHE 9 HE1 PHE 9 3.327 30.435 -2.263 61 HZ PHE 9 HZ PHE 9 3.953 32.812 -2.425 62 H ASP 10 HN ASP 10 -0.939 31.172 -8.891 63 HA ASP 10 HA ASP 10 -0.538 28.763 -10.519 64 HB2 ASP 10 HB2 ASP 10 -2.884 30.635 -10.239 65 HB3 ASP 10 HB1 ASP 10 -2.749 29.522 -11.596 66 H ASP 11 HN ASP 11 0.409 28.913 -12.412 67 HA ASP 11 HA ASP 11 0.441 31.516 -13.783 68 HB2 ASP 11 HB2 ASP 11 2.677 30.674 -12.777 69 HB3 ASP 11 HB1 ASP 11 2.646 29.475 -14.065 70 H ASP 12 HN ASP 12 1.462 30.664 -16.229 71 HA ASP 12 HA ASP 12 -0.616 28.737 -17.059 72 HB2 ASP 12 HB2 ASP 12 -1.257 31.048 -17.651 73 HB3 ASP 12 HB1 ASP 12 0.236 31.213 -18.570 74 H ASN 13 HN ASN 13 2.561 30.119 -17.724 75 HA ASN 13 HA ASN 13 3.041 28.094 -19.770 76 HB2 ASN 13 HB2 ASN 13 4.662 30.485 -18.888 77 HB3 ASN 13 HB1 ASN 13 5.234 29.312 -20.068 78 HD21 ASN 13 HD21 ASN 13 4.218 29.191 -22.087 79 HD22 ASN 13 HD22 ASN 13 3.228 30.474 -22.685 80 H GLY 14 HN GLY 14 3.778 26.193 -19.169 81 HA2 GLY 14 HA2 GLY 14 5.087 25.774 -16.651 82 HA3 GLY 14 HA1 GLY 14 4.850 24.585 -17.908 83 H ALA 15 HN ALA 15 6.800 27.238 -16.889 84 HA ALA 15 HA ALA 15 8.898 26.791 -18.780 85 HB1 ALA 15 HB1 ALA 15 8.975 28.361 -16.201 86 HB2 ALA 15 HB2 ALA 15 8.525 29.005 -17.780 87 HB3 ALA 15 HB3 ALA 15 10.166 28.425 -17.499 88 H PHE 16 HN PHE 16 11.193 26.452 -17.845 89 HA PHE 16 HA PHE 16 11.141 24.202 -15.977 90 HB2 PHE 16 HB2 PHE 16 12.763 23.128 -17.796 91 HB3 PHE 16 HB1 PHE 16 11.016 22.926 -17.897 92 HD1 PHE 16 HD1 PHE 16 13.744 25.177 -19.052 93 HD2 PHE 16 HD2 PHE 16 9.925 23.506 -19.857 94 HE1 PHE 16 HE1 PHE 16 13.730 26.259 -21.248 95 HE2 PHE 16 HE2 PHE 16 9.903 24.585 -22.061 96 HZ PHE 16 HZ PHE 16 11.809 25.972 -22.758 97 H PHE 17 HN PHE 17 13.045 23.851 -14.888 98 HA PHE 17 HA PHE 17 15.250 25.743 -15.409 99 HB2 PHE 17 HB2 PHE 17 13.975 24.847 -12.851 100 HB3 PHE 17 HB1 PHE 17 15.698 25.184 -12.849 101 HD1 PHE 17 HD2 PHE 17 13.430 27.102 -14.991 102 HD2 PHE 17 HD1 PHE 17 15.441 26.952 -11.249 103 HE1 PHE 17 HE2 PHE 17 12.963 29.492 -14.646 104 HE2 PHE 17 HE1 PHE 17 14.978 29.339 -10.896 105 HZ PHE 17 HZ PHE 17 13.738 30.616 -12.596 106 H VAL 18 HN VAL 18 17.382 24.947 -14.979 107 HA VAL 18 HA VAL 18 17.635 22.065 -15.316 108 HB VAL 18 HB VAL 18 19.844 24.130 -15.146 109 HG11 VAL 18 HG11 VAL 18 20.597 21.869 -14.678 110 HG12 VAL 18 HG12 VAL 18 21.201 22.406 -16.244 111 HG13 VAL 18 HG13 VAL 18 19.838 21.291 -16.160 112 HG21 VAL 18 HG21 VAL 18 18.484 22.968 -17.577 113 HG22 VAL 18 HG22 VAL 18 19.914 23.998 -17.601 114 HG23 VAL 18 HG23 VAL 18 18.378 24.636 -17.017 115 H LEU 19 HN LEU 19 17.220 21.051 -13.438 116 HA LEU 19 HA LEU 19 18.317 22.183 -10.961 117 HB2 LEU 19 HB2 LEU 19 15.812 21.773 -11.302 118 HB3 LEU 19 HB1 LEU 19 16.188 20.066 -11.188 119 HG LEU 19 HG LEU 19 17.119 20.478 -8.914 120 HD11 LEU 19 HD11 LEU 19 17.696 22.802 -9.099 121 HD12 LEU 19 HD12 LEU 19 16.510 22.597 -7.810 122 HD13 LEU 19 HD13 LEU 19 16.007 23.236 -9.376 123 HD21 LEU 19 HD21 LEU 19 14.253 21.316 -9.322 124 HD22 LEU 19 HD22 LEU 19 14.956 20.731 -7.815 125 HD23 LEU 19 HD23 LEU 19 14.841 19.657 -9.210 126 H VAL 20 HN VAL 20 19.768 21.089 -9.779 127 HA VAL 20 HA VAL 20 20.218 18.249 -10.393 128 HB VAL 20 HB VAL 20 22.380 20.307 -9.874 129 HG11 VAL 20 HG11 VAL 20 23.942 18.453 -10.320 130 HG12 VAL 20 HG12 VAL 20 22.575 17.340 -10.373 131 HG13 VAL 20 HG13 VAL 20 22.972 18.182 -8.875 132 HG21 VAL 20 HG21 VAL 20 21.482 20.474 -12.130 133 HG22 VAL 20 HG22 VAL 20 21.708 18.742 -12.365 134 HG23 VAL 20 HG23 VAL 20 23.108 19.792 -12.162 135 H ASN 21 HN ASN 21 20.505 16.949 -8.652 136 HA ASN 21 HA ASN 21 20.703 18.233 -6.009 137 HB2 ASN 21 HB2 ASN 21 18.429 17.339 -6.343 138 HB3 ASN 21 HB1 ASN 21 19.102 15.756 -6.713 139 HD21 ASN 21 HD21 ASN 21 18.474 18.092 -4.214 140 HD22 ASN 21 HD22 ASN 21 18.723 17.026 -2.880 141 H ASP 22 HN ASP 22 21.825 16.978 -4.392 142 HA ASP 22 HA ASP 22 24.251 15.963 -5.296 143 HB2 ASP 22 HB2 ASP 22 23.886 16.880 -3.042 144 HB3 ASP 22 HB1 ASP 22 22.918 15.472 -2.628 145 H GLU 23 HN GLU 23 21.298 14.201 -4.410 146 HA GLU 23 HA GLU 23 22.674 11.700 -5.125 147 HB2 GLU 23 HB2 GLU 23 20.788 10.544 -4.008 148 HB3 GLU 23 HB1 GLU 23 21.690 11.601 -2.930 149 HG2 GLU 23 HG2 GLU 23 19.962 13.256 -3.015 150 HG3 GLU 23 HG1 GLU 23 19.099 12.354 -4.261 151 H ASP 24 HN ASP 24 21.559 13.735 -6.982 152 HA ASP 24 HA ASP 24 19.796 11.916 -8.478 153 HB2 ASP 24 HB2 ASP 24 18.417 13.748 -7.688 154 HB3 ASP 24 HB1 ASP 24 19.581 14.929 -8.282 155 H GLN 25 HN GLN 25 20.031 11.992 -10.785 156 HA GLN 25 HA GLN 25 22.770 12.551 -11.542 157 HB2 GLN 25 HB2 GLN 25 20.450 11.243 -12.958 158 HB3 GLN 25 HB1 GLN 25 21.972 11.569 -13.769 159 HG2 GLN 25 HG2 GLN 25 21.827 9.259 -13.016 160 HG3 GLN 25 HG1 GLN 25 23.139 10.117 -12.214 161 HE21 GLN 25 HE21 GLN 25 19.922 8.791 -11.826 162 HE22 GLN 25 HE22 GLN 25 19.966 8.695 -10.099 163 H HIS 26 HN HIS 26 19.551 13.429 -12.809 164 HA HIS 26 HA HIS 26 20.251 16.176 -13.067 165 HB2 HIS 26 HB2 HIS 26 20.443 14.460 -15.479 166 HB3 HIS 26 HB1 HIS 26 19.603 15.997 -15.670 167 HD1 HIS 26 HD1 HIS 26 22.646 14.934 -16.605 168 HD2 HIS 26 HD2 HIS 26 21.556 17.911 -13.912 169 HE1 HIS 26 HE1 HIS 26 24.635 16.466 -16.442 170 HE2 HIS 26 HE2 HIS 26 24.015 18.165 -14.686 171 H SER 27 HN SER 27 18.438 17.318 -12.782 172 HA SER 27 HA SER 27 15.895 16.022 -13.489 173 HB2 SER 27 HB2 SER 27 16.498 17.945 -11.232 174 HB3 SER 27 HB1 SER 27 14.881 17.387 -11.662 175 HG SER 27 HG SER 27 17.068 15.732 -10.871 176 H LEU 28 HN LEU 28 15.108 16.918 -15.281 177 HA LEU 28 HA LEU 28 15.360 19.778 -15.739 178 HB2 LEU 28 HB2 LEU 28 15.216 17.685 -17.462 179 HB3 LEU 28 HB1 LEU 28 13.528 18.153 -17.406 180 HG LEU 28 HG LEU 28 14.819 19.157 -19.287 181 HD11 LEU 28 HD11 LEU 28 13.708 21.149 -17.323 182 HD12 LEU 28 HD12 LEU 28 12.758 20.193 -18.462 183 HD13 LEU 28 HD13 LEU 28 13.909 21.390 -19.060 184 HD21 LEU 28 HD21 LEU 28 16.346 20.986 -18.814 185 HD22 LEU 28 HD22 LEU 28 16.933 19.478 -18.121 186 HD23 LEU 28 HD23 LEU 28 16.184 20.693 -17.085 187 H TRP 29 HN TRP 29 14.155 20.896 -14.306 188 HA TRP 29 HA TRP 29 11.651 19.648 -13.398 189 HB2 TRP 29 HB2 TRP 29 13.505 19.856 -11.750 190 HB3 TRP 29 HB1 TRP 29 13.440 21.604 -11.940 191 HD1 TRP 29 HD1 TRP 29 11.863 22.857 -10.351 192 HE1 TRP 29 HE1 TRP 29 10.012 22.179 -8.691 193 HE3 TRP 29 HE3 TRP 29 11.567 17.880 -11.458 194 HZ2 TRP 29 HZ2 TRP 29 8.628 19.838 -7.941 195 HZ3 TRP 29 HZ3 TRP 29 9.953 16.491 -10.225 196 HH2 TRP 29 HH2 TRP 29 8.515 17.451 -8.502 197 HA PRO 30 HA PRO 30 9.608 23.214 -15.184 198 HB2 PRO 30 HB2 PRO 30 7.205 22.057 -13.966 199 HB3 PRO 30 HB1 PRO 30 7.569 22.330 -15.671 200 HG2 PRO 30 HG2 PRO 30 7.469 19.858 -14.594 201 HG3 PRO 30 HG1 PRO 30 8.573 20.274 -15.920 202 HD2 PRO 30 HD2 PRO 30 9.144 20.012 -12.986 203 HD3 PRO 30 HD1 PRO 30 10.107 19.465 -14.374 204 H VAL 31 HN VAL 31 9.069 25.149 -14.358 205 HA VAL 31 HA VAL 31 9.434 25.622 -11.568 206 HB VAL 31 HB VAL 31 9.021 27.951 -12.045 207 HG11 VAL 31 HG11 VAL 31 11.198 27.072 -12.652 208 HG12 VAL 31 HG12 VAL 31 10.705 28.344 -13.776 209 HG13 VAL 31 HG13 VAL 31 10.598 26.649 -14.255 210 HG21 VAL 31 HG21 VAL 31 8.115 27.051 -14.777 211 HG22 VAL 31 HG22 VAL 31 8.315 28.722 -14.254 212 HG23 VAL 31 HG23 VAL 31 7.085 27.706 -13.504 213 H PHE 32 HN PHE 32 6.776 24.624 -13.351 214 HA PHE 32 HA PHE 32 4.747 25.957 -11.804 215 HB2 PHE 32 HB2 PHE 32 4.471 25.200 -14.204 216 HB3 PHE 32 HB1 PHE 32 4.417 23.546 -13.607 217 HD1 PHE 32 HD2 PHE 32 2.769 26.846 -13.121 218 HD2 PHE 32 HD1 PHE 32 2.371 22.611 -13.085 219 HE1 PHE 32 HE2 PHE 32 0.351 27.079 -12.726 220 HE2 PHE 32 HE1 PHE 32 -0.047 22.835 -12.699 221 HZ PHE 32 HZ PHE 32 -1.061 25.071 -12.517 222 H ALA 33 HN ALA 33 6.796 23.338 -11.347 223 HA ALA 33 HA ALA 33 5.051 22.172 -9.290 224 HB1 ALA 33 HB1 ALA 33 6.520 20.230 -9.347 225 HB2 ALA 33 HB2 ALA 33 7.553 21.026 -10.533 226 HB3 ALA 33 HB3 ALA 33 5.900 20.585 -10.958 227 H ASP 34 HN ASP 34 5.704 22.138 -7.175 228 HA ASP 34 HA ASP 34 7.439 24.238 -6.391 229 HB2 ASP 34 HB2 ASP 34 5.460 23.483 -5.068 230 HB3 ASP 34 HB1 ASP 34 6.342 22.015 -4.657 231 H ILE 35 HN ILE 35 9.520 24.257 -5.832 232 HA ILE 35 HA ILE 35 11.127 21.960 -6.505 233 HB ILE 35 HB ILE 35 11.974 24.636 -5.372 234 HG12 ILE 35 HG12 ILE 35 11.849 23.702 -8.248 235 HG13 ILE 35 HG11 ILE 35 10.741 24.847 -7.501 236 HG21 ILE 35 HG21 ILE 35 14.169 24.100 -6.328 237 HG22 ILE 35 HG22 ILE 35 13.565 22.513 -6.805 238 HG23 ILE 35 HG23 ILE 35 13.687 22.934 -5.097 239 HD11 ILE 35 HD11 ILE 35 13.694 25.251 -7.917 240 HD12 ILE 35 HD12 ILE 35 12.599 26.400 -7.150 241 HD13 ILE 35 HD13 ILE 35 12.396 25.987 -8.854 242 HA PRO 36 HA PRO 36 11.376 20.312 -2.338 243 HB2 PRO 36 HB2 PRO 36 13.598 18.770 -2.742 244 HB3 PRO 36 HB1 PRO 36 11.974 18.299 -3.247 245 HG2 PRO 36 HG2 PRO 36 14.183 19.521 -4.856 246 HG3 PRO 36 HG1 PRO 36 13.081 18.200 -5.289 247 HD2 PRO 36 HD2 PRO 36 12.710 20.701 -6.192 248 HD3 PRO 36 HD1 PRO 36 11.342 19.643 -5.787 249 H ALA 37 HN ALA 37 13.637 19.656 -0.998 250 HA ALA 37 HA ALA 37 15.029 22.236 -0.715 251 HB1 ALA 37 HB1 ALA 37 15.621 21.453 1.541 252 HB2 ALA 37 HB2 ALA 37 14.760 19.945 1.233 253 HB3 ALA 37 HB3 ALA 37 13.877 21.469 1.286 254 H GLY 38 HN GLY 38 17.353 22.138 -0.140 255 HA2 GLY 38 HA2 GLY 38 19.513 21.410 -0.509 256 HA3 GLY 38 HA1 GLY 38 18.874 19.780 -0.665 257 H TRP 39 HN TRP 39 17.809 22.457 -2.617 258 HA TRP 39 HA TRP 39 18.426 20.935 -4.999 259 HB2 TRP 39 HB2 TRP 39 17.189 22.844 -6.125 260 HB3 TRP 39 HB1 TRP 39 16.258 21.891 -4.975 261 HD1 TRP 39 HD1 TRP 39 15.509 23.077 -2.724 262 HE1 TRP 39 HE1 TRP 39 15.360 25.547 -2.020 263 HE3 TRP 39 HE3 TRP 39 18.350 25.143 -6.436 264 HZ2 TRP 39 HZ2 TRP 39 16.324 28.044 -2.923 265 HZ3 TRP 39 HZ3 TRP 39 18.687 27.581 -6.445 266 HH2 TRP 39 HH2 TRP 39 17.694 29.000 -4.726 267 H ARG 40 HN ARG 40 19.575 21.723 -6.780 268 HA ARG 40 HA ARG 40 21.102 24.194 -6.394 269 HB2 ARG 40 HB2 ARG 40 22.649 22.376 -5.938 270 HB3 ARG 40 HB1 ARG 40 22.182 21.561 -7.423 271 HG2 ARG 40 HG2 ARG 40 24.337 22.661 -7.654 272 HG3 ARG 40 HG1 ARG 40 23.140 23.377 -8.734 273 HD2 ARG 40 HD2 ARG 40 22.792 25.189 -7.098 274 HD3 ARG 40 HD1 ARG 40 24.048 24.486 -6.078 275 HE ARG 40 HE ARG 40 25.129 24.903 -8.626 276 HH11 ARG 40 HH11 ARG 40 23.853 26.807 -5.967 277 HH12 ARG 40 HH12 ARG 40 24.902 28.162 -6.268 278 HH21 ARG 40 HH21 ARG 40 26.523 26.694 -9.008 279 HH22 ARG 40 HH22 ARG 40 26.412 28.090 -7.976 280 H VAL 41 HN VAL 41 20.561 25.554 -7.957 281 HA VAL 41 HA VAL 41 19.476 24.482 -10.457 282 HB VAL 41 HB VAL 41 19.472 27.304 -9.363 283 HG11 VAL 41 HG11 VAL 41 19.572 27.368 -11.786 284 HG12 VAL 41 HG12 VAL 41 17.958 27.828 -11.238 285 HG13 VAL 41 HG13 VAL 41 18.241 26.216 -11.894 286 HG21 VAL 41 HG21 VAL 41 17.968 25.804 -8.168 287 HG22 VAL 41 HG22 VAL 41 17.250 25.289 -9.695 288 HG23 VAL 41 HG23 VAL 41 17.050 26.952 -9.144 289 H VAL 42 HN VAL 42 20.873 24.157 -12.035 290 HA VAL 42 HA VAL 42 23.434 25.421 -12.167 291 HB VAL 42 HB VAL 42 21.976 23.868 -14.325 292 HG11 VAL 42 HG11 VAL 42 24.898 24.545 -14.013 293 HG12 VAL 42 HG12 VAL 42 23.798 25.182 -15.239 294 HG13 VAL 42 HG13 VAL 42 24.223 23.469 -15.238 295 HG21 VAL 42 HG21 VAL 42 23.296 21.948 -13.558 296 HG22 VAL 42 HG22 VAL 42 22.223 22.549 -12.293 297 HG23 VAL 42 HG23 VAL 42 23.948 22.928 -12.244 298 H HIS 43 HN HIS 43 20.419 25.721 -13.980 299 HA HIS 43 HA HIS 43 20.901 28.521 -14.439 300 HB2 HIS 43 HB2 HIS 43 21.116 26.529 -16.639 301 HB3 HIS 43 HB1 HIS 43 20.220 28.004 -16.983 302 HD1 HIS 43 HD1 HIS 43 21.590 30.279 -16.626 303 HD2 HIS 43 HD2 HIS 43 23.847 26.788 -16.756 304 HE1 HIS 43 HE1 HIS 43 23.959 31.020 -17.018 305 HE2 HIS 43 HE2 HIS 43 25.334 28.910 -16.864 306 H GLY 44 HN GLY 44 19.005 29.612 -15.225 307 HA2 GLY 44 HA2 GLY 44 16.601 28.408 -14.174 308 HA3 GLY 44 HA1 GLY 44 16.763 30.029 -14.839 309 H GLU 45 HN GLU 45 15.235 30.194 -16.354 310 HA GLU 45 HA GLU 45 14.585 27.876 -17.953 311 HB2 GLU 45 HB2 GLU 45 13.134 30.041 -18.954 312 HB3 GLU 45 HB1 GLU 45 12.569 28.793 -17.846 313 HG2 GLU 45 HG2 GLU 45 12.031 30.818 -16.822 314 HG3 GLU 45 HG1 GLU 45 13.466 30.207 -15.994 315 H ALA 46 HN ALA 46 16.157 27.469 -19.217 316 HA ALA 46 HA ALA 46 16.884 29.429 -21.297 317 HB1 ALA 46 HB1 ALA 46 18.811 28.666 -19.985 318 HB2 ALA 46 HB2 ALA 46 18.915 28.098 -21.650 319 HB3 ALA 46 HB3 ALA 46 18.419 26.991 -20.369 320 H SER 47 HN SER 47 17.320 28.305 -23.471 321 HA SER 47 HA SER 47 15.026 27.263 -24.492 322 HB2 SER 47 HB2 SER 47 17.817 26.572 -25.439 323 HB3 SER 47 HB1 SER 47 16.338 26.490 -26.402 324 HG SER 47 HG SER 47 16.166 28.843 -25.709 325 H ARG 48 HN ARG 48 13.958 25.408 -24.477 326 HA ARG 48 HA ARG 48 14.540 23.451 -22.569 327 HB2 ARG 48 HB2 ARG 48 12.272 23.981 -23.383 328 HB3 ARG 48 HB1 ARG 48 12.667 23.275 -24.943 329 HG2 ARG 48 HG2 ARG 48 12.904 21.607 -22.482 330 HG3 ARG 48 HG1 ARG 48 11.308 21.942 -23.156 331 HD2 ARG 48 HD2 ARG 48 11.970 20.986 -25.280 332 HD3 ARG 48 HD1 ARG 48 13.612 20.744 -24.685 333 HE ARG 48 HE ARG 48 11.654 19.423 -23.071 334 HH11 ARG 48 HH11 ARG 48 13.437 19.180 -26.076 335 HH12 ARG 48 HH12 ARG 48 13.506 17.441 -26.038 336 HH21 ARG 48 HH21 ARG 48 11.747 17.143 -23.015 337 HH22 ARG 48 HH22 ARG 48 12.547 16.287 -24.308 338 H ALA 49 HN ALA 49 15.059 23.479 -26.066 339 HA ALA 49 HA ALA 49 15.949 20.852 -26.391 340 HB1 ALA 49 HB1 ALA 49 15.446 22.354 -28.265 341 HB2 ALA 49 HB2 ALA 49 17.051 21.637 -28.419 342 HB3 ALA 49 HB3 ALA 49 16.880 23.308 -27.881 343 H ALA 50 HN ALA 50 17.732 23.781 -25.534 344 HA ALA 50 HA ALA 50 20.289 22.549 -25.525 345 HB1 ALA 50 HB1 ALA 50 21.073 24.615 -24.523 346 HB2 ALA 50 HB2 ALA 50 19.413 25.104 -24.185 347 HB3 ALA 50 HB3 ALA 50 19.968 24.958 -25.852 348 H CYS 51 HN CYS 51 17.904 23.247 -23.001 349 HA CYS 51 HA CYS 51 19.507 22.527 -20.808 350 HB2 CYS 51 HB2 CYS 51 16.498 22.358 -21.095 351 HB3 CYS 51 HB1 CYS 51 17.385 22.266 -19.575 352 HG CYS 51 HG CYS 51 16.373 24.936 -21.235 353 H LEU 52 HN LEU 52 17.119 20.596 -22.632 354 HA LEU 52 HA LEU 52 17.611 18.186 -21.252 355 HB2 LEU 52 HB2 LEU 52 16.357 18.876 -23.872 356 HB3 LEU 52 HB1 LEU 52 16.748 17.201 -23.541 357 HG LEU 52 HG LEU 52 14.432 17.624 -22.996 358 HD11 LEU 52 HD11 LEU 52 14.424 16.916 -20.638 359 HD12 LEU 52 HD12 LEU 52 16.150 17.271 -20.546 360 HD13 LEU 52 HD13 LEU 52 15.566 16.003 -21.624 361 HD21 LEU 52 HD21 LEU 52 15.491 19.744 -21.136 362 HD22 LEU 52 HD22 LEU 52 13.821 19.173 -21.184 363 HD23 LEU 52 HD23 LEU 52 14.513 19.998 -22.580 364 H ASP 53 HN ASP 53 19.081 19.617 -24.116 365 HA ASP 53 HA ASP 53 20.681 17.434 -24.850 366 HB2 ASP 53 HB2 ASP 53 20.289 19.601 -26.134 367 HB3 ASP 53 HB1 ASP 53 21.505 20.327 -25.089 368 H TYR 54 HN TYR 54 21.448 20.231 -22.788 369 HA TYR 54 HA TYR 54 24.010 19.503 -22.019 370 HB2 TYR 54 HB2 TYR 54 23.268 21.686 -21.471 371 HB3 TYR 54 HB1 TYR 54 21.867 21.081 -20.596 372 HD1 TYR 54 HD1 TYR 54 25.600 21.099 -20.473 373 HD2 TYR 54 HD2 TYR 54 21.962 20.885 -18.277 374 HE1 TYR 54 HE1 TYR 54 26.871 21.218 -18.368 375 HE2 TYR 54 HE2 TYR 54 23.219 20.997 -16.173 376 HH TYR 54 HH TYR 54 26.428 21.922 -15.966 377 H VAL 55 HN VAL 55 20.928 18.685 -20.395 378 HA VAL 55 HA VAL 55 22.243 17.389 -18.245 379 HB VAL 55 HB VAL 55 20.052 16.520 -17.576 380 HG11 VAL 55 HG11 VAL 55 20.684 18.761 -16.916 381 HG12 VAL 55 HG12 VAL 55 18.949 18.691 -17.233 382 HG13 VAL 55 HG13 VAL 55 20.036 19.411 -18.421 383 HG21 VAL 55 HG21 VAL 55 18.040 17.083 -18.839 384 HG22 VAL 55 HG22 VAL 55 19.111 16.042 -19.776 385 HG23 VAL 55 HG23 VAL 55 19.032 17.768 -20.124 386 H GLU 56 HN GLU 56 20.828 16.135 -21.263 387 HA GLU 56 HA GLU 56 21.202 13.410 -20.496 388 HB2 GLU 56 HB2 GLU 56 20.716 14.608 -23.229 389 HB3 GLU 56 HB1 GLU 56 20.696 12.886 -22.863 390 HG2 GLU 56 HG2 GLU 56 18.900 13.441 -21.146 391 HG3 GLU 56 HG1 GLU 56 18.793 15.009 -21.943 392 H LYS 57 HN LYS 57 23.174 15.752 -22.240 393 HA LYS 57 HA LYS 57 25.094 13.877 -23.187 394 HB2 LYS 57 HB2 LYS 57 25.343 16.834 -22.640 395 HB3 LYS 57 HB1 LYS 57 26.590 15.870 -23.416 396 HG2 LYS 57 HG2 LYS 57 25.120 15.389 -25.268 397 HG3 LYS 57 HG1 LYS 57 23.797 16.246 -24.468 398 HD2 LYS 57 HD2 LYS 57 24.689 17.760 -26.043 399 HD3 LYS 57 HD1 LYS 57 25.298 18.281 -24.473 400 HE2 LYS 57 HE2 LYS 57 27.104 18.386 -26.024 401 HE3 LYS 57 HE1 LYS 57 27.398 17.012 -24.958 402 HZ1 LYS 57 HZ1 LYS 57 27.816 16.524 -27.319 403 HZ2 LYS 57 HZ2 LYS 57 26.178 16.809 -27.660 404 HZ3 LYS 57 HZ3 LYS 57 26.622 15.521 -26.648 405 H ASN 58 HN ASN 58 24.840 15.819 -20.248 406 HA ASN 58 HA ASN 58 27.373 14.822 -19.249 407 HB2 ASN 58 HB2 ASN 58 25.272 16.628 -18.054 408 HB3 ASN 58 HB1 ASN 58 26.660 16.067 -17.134 409 HD21 ASN 58 HD21 ASN 58 26.739 16.874 -20.543 410 HD22 ASN 58 HD22 ASN 58 27.724 18.286 -20.382 411 H TRP 59 HN TRP 59 24.419 13.491 -19.557 412 HA TRP 59 HA TRP 59 24.259 12.117 -17.028 413 HB2 TRP 59 HB2 TRP 59 22.219 12.593 -18.341 414 HB3 TRP 59 HB1 TRP 59 22.832 11.592 -19.652 415 HD1 TRP 59 HD1 TRP 59 21.406 11.325 -16.104 416 HE1 TRP 59 HE1 TRP 59 20.561 8.921 -15.733 417 HE3 TRP 59 HE3 TRP 59 23.111 9.200 -20.432 418 HZ2 TRP 59 HZ2 TRP 59 20.622 6.451 -17.099 419 HZ3 TRP 59 HZ3 TRP 59 22.675 6.811 -20.822 420 HH2 TRP 59 HH2 TRP 59 21.457 5.466 -19.189 421 H THR 60 HN THR 60 25.553 10.494 -16.518 422 HA THR 60 HA THR 60 26.938 9.052 -18.652 423 HB THR 60 HB THR 60 27.495 8.828 -15.695 424 HG1 THR 60 HG1 THR 60 27.800 10.990 -17.300 425 HG21 THR 60 HG21 THR 60 28.531 7.148 -17.145 426 HG22 THR 60 HG22 THR 60 29.751 8.243 -16.494 427 HG23 THR 60 HG23 THR 60 29.203 8.422 -18.161 428 H ASP 61 HN ASP 61 26.666 6.895 -18.982 429 HA ASP 61 HA ASP 61 24.342 5.668 -17.772 430 HB2 ASP 61 HB2 ASP 61 24.669 3.894 -19.409 431 HB3 ASP 61 HB1 ASP 61 24.781 5.464 -20.201 432 H LEU 62 HN LEU 62 27.193 6.067 -16.513 433 HA LEU 62 HA LEU 62 27.976 3.390 -15.816 434 HB2 LEU 62 HB2 LEU 62 29.587 5.265 -15.988 435 HB3 LEU 62 HB1 LEU 62 28.820 6.033 -14.613 436 HG LEU 62 HG LEU 62 29.505 4.165 -13.177 437 HD11 LEU 62 HD11 LEU 62 31.059 2.472 -14.000 438 HD12 LEU 62 HD12 LEU 62 30.906 3.117 -15.634 439 HD13 LEU 62 HD13 LEU 62 29.512 2.382 -14.843 440 HD21 LEU 62 HD21 LEU 62 30.961 6.101 -13.380 441 HD22 LEU 62 HD22 LEU 62 31.767 5.370 -14.767 442 HD23 LEU 62 HD23 LEU 62 31.907 4.629 -13.174 443 H ARG 63 HN ARG 63 25.385 3.538 -15.279 444 HA ARG 63 HA ARG 63 25.273 3.603 -12.338 445 HB2 ARG 63 HB2 ARG 63 23.728 5.174 -13.777 446 HB3 ARG 63 HB1 ARG 63 22.816 3.702 -14.072 447 HG2 ARG 63 HG2 ARG 63 23.411 4.843 -11.349 448 HG3 ARG 63 HG1 ARG 63 21.907 5.072 -12.235 449 HD2 ARG 63 HD2 ARG 63 23.038 2.458 -11.239 450 HD3 ARG 63 HD1 ARG 63 21.648 3.320 -10.583 451 HE ARG 63 HE ARG 63 21.593 2.375 -13.366 452 HH11 ARG 63 HH11 ARG 63 20.369 2.237 -10.095 453 HH12 ARG 63 HH12 ARG 63 18.967 1.298 -10.521 454 HH21 ARG 63 HH21 ARG 63 19.770 1.141 -13.948 455 HH22 ARG 63 HH22 ARG 63 18.645 0.632 -12.713 456 HA PRO 64 HA PRO 64 24.783 -0.724 -13.594 457 HB2 PRO 64 HB2 PRO 64 26.516 -1.786 -11.844 458 HB3 PRO 64 HB1 PRO 64 27.056 -0.990 -13.326 459 HG2 PRO 64 HG2 PRO 64 27.166 -0.035 -10.525 460 HG3 PRO 64 HG1 PRO 64 28.221 0.357 -11.891 461 HD2 PRO 64 HD2 PRO 64 26.074 1.908 -10.863 462 HD3 PRO 64 HD1 PRO 64 27.028 2.225 -12.325 463 H LYS 65 HN LYS 65 23.514 -2.292 -12.746 464 HA LYS 65 HA LYS 65 21.971 -1.801 -10.419 465 HB2 LYS 65 HB2 LYS 65 21.213 -3.183 -12.334 466 HB3 LYS 65 HB1 LYS 65 22.401 -4.403 -11.906 467 HG2 LYS 65 HG2 LYS 65 21.261 -4.734 -9.756 468 HG3 LYS 65 HG1 LYS 65 20.051 -3.540 -10.237 469 HD2 LYS 65 HD2 LYS 65 19.392 -4.907 -12.115 470 HD3 LYS 65 HD1 LYS 65 20.673 -6.068 -11.758 471 HE2 LYS 65 HE2 LYS 65 19.585 -6.501 -9.565 472 HE3 LYS 65 HE1 LYS 65 18.260 -5.443 -10.060 473 HZ1 LYS 65 HZ1 LYS 65 17.765 -6.905 -11.880 474 HZ2 LYS 65 HZ2 LYS 65 17.807 -7.825 -10.455 475 HZ3 LYS 65 HZ3 LYS 65 19.111 -7.876 -11.534 476 H SER 66 HN SER 66 23.259 -1.502 -8.656 477 HA SER 66 HA SER 66 25.461 -3.280 -8.105 478 HB2 SER 66 HB2 SER 66 24.388 -1.005 -6.423 479 HB3 SER 66 HB1 SER 66 25.983 -1.755 -6.301 480 HG SER 66 HG SER 66 25.230 -0.716 -8.780 481 H LEU 67 HN LEU 67 25.431 -4.993 -6.807 482 HA LEU 67 HA LEU 67 23.017 -5.695 -5.387 483 HB2 LEU 67 HB2 LEU 67 25.695 -7.087 -5.552 484 HB3 LEU 67 HB1 LEU 67 24.259 -7.754 -4.799 485 HG LEU 67 HG LEU 67 24.572 -7.106 -7.734 486 HD11 LEU 67 HD11 LEU 67 25.850 -9.070 -7.027 487 HD12 LEU 67 HD12 LEU 67 24.486 -9.514 -8.052 488 HD13 LEU 67 HD13 LEU 67 24.391 -9.757 -6.307 489 HD21 LEU 67 HD21 LEU 67 22.282 -6.755 -6.944 490 HD22 LEU 67 HD22 LEU 67 22.270 -8.377 -6.260 491 HD23 LEU 67 HD23 LEU 67 22.391 -8.160 -8.005 492 H ARG 68 HN ARG 68 23.776 -3.422 -4.330 493 HA ARG 68 HA ARG 68 25.495 -3.787 -2.023 494 HB2 ARG 68 HB2 ARG 68 25.515 -1.669 -3.293 495 HB3 ARG 68 HB1 ARG 68 23.825 -1.412 -2.895 496 HG2 ARG 68 HG2 ARG 68 24.816 -0.079 -1.343 497 HG3 ARG 68 HG1 ARG 68 24.711 -1.582 -0.430 498 HD2 ARG 68 HD2 ARG 68 27.139 -0.751 -2.002 499 HD3 ARG 68 HD1 ARG 68 26.912 -0.375 -0.297 500 HE ARG 68 HE ARG 68 27.038 -3.145 -1.326 501 HH11 ARG 68 HH11 ARG 68 27.860 -0.684 1.020 502 HH12 ARG 68 HH12 ARG 68 28.791 -1.754 2.017 503 HH21 ARG 68 HH21 ARG 68 28.296 -4.558 -0.040 504 HH22 ARG 68 HH22 ARG 68 29.063 -3.954 1.406 505 H ASP 69 HN ASP 69 24.208 -5.482 -1.090 506 HA ASP 69 HA ASP 69 22.721 -6.366 0.369 507 HB2 ASP 69 HB2 ASP 69 22.191 -3.466 1.047 508 HB3 ASP 69 HB1 ASP 69 21.509 -4.827 1.931 509 H ALA 70 HN ALA 70 21.124 -7.420 -0.544 510 HA ALA 70 HA ALA 70 19.425 -6.213 -2.487 511 HB1 ALA 70 HB1 ALA 70 20.136 -8.539 -2.669 512 HB2 ALA 70 HB2 ALA 70 18.379 -8.405 -2.663 513 HB3 ALA 70 HB3 ALA 70 19.228 -8.935 -1.213 514 H MET 71 HN MET 71 18.663 -4.516 -0.906 515 HA MET 71 HA MET 71 16.562 -5.202 0.885 516 HB2 MET 71 HB2 MET 71 15.945 -2.814 0.776 517 HB3 MET 71 HB1 MET 71 17.663 -3.042 1.070 518 HG2 MET 71 HG2 MET 71 18.097 -2.599 -1.318 519 HG3 MET 71 HG1 MET 71 16.374 -2.293 -1.543 520 HE1 MET 71 HE1 MET 71 18.619 -0.237 -2.398 521 HE2 MET 71 HE2 MET 71 17.941 1.285 -1.818 522 HE3 MET 71 HE3 MET 71 16.898 0.090 -2.591 523 H VAL 72 HN VAL 72 16.762 -4.502 -2.528 524 HA VAL 72 HA VAL 72 13.967 -5.313 -2.853 525 HB VAL 72 HB VAL 72 14.587 -3.330 -4.142 526 HG11 VAL 72 HG11 VAL 72 16.971 -3.669 -4.354 527 HG12 VAL 72 HG12 VAL 72 16.256 -3.447 -5.951 528 HG13 VAL 72 HG13 VAL 72 16.709 -5.061 -5.405 529 HG21 VAL 72 HG21 VAL 72 12.957 -4.818 -5.141 530 HG22 VAL 72 HG22 VAL 72 14.246 -5.755 -5.900 531 HG23 VAL 72 HG23 VAL 72 13.961 -4.084 -6.394 532 H GLU 73 HN GLU 73 13.487 -7.325 -3.613 533 HA GLU 73 HA GLU 73 15.662 -9.214 -3.514 534 HB2 GLU 73 HB2 GLU 73 13.871 -10.922 -3.713 535 HB3 GLU 73 HB1 GLU 73 13.617 -9.800 -2.385 536 HG2 GLU 73 HG2 GLU 73 12.004 -8.565 -3.754 537 HG3 GLU 73 HG1 GLU 73 12.239 -9.728 -5.058 538 H ASP 74 HN ASP 74 16.630 -10.208 -5.140 539 HA ASP 74 HA ASP 74 15.442 -10.068 -7.827 540 HB2 ASP 74 HB2 ASP 74 17.219 -8.412 -7.778 541 HB3 ASP 74 HB1 ASP 74 18.345 -9.587 -7.104 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 13.417 40.460 0.967 2 H2 GLY 1 HT2 GLY 1 12.988 40.985 -0.595 3 H3 GLY 1 HT3 GLY 1 14.476 40.218 -0.337 4 HA2 GLY 1 HA1 GLY 1 13.341 38.165 0.270 5 HA3 GLY 1 HA2 GLY 1 11.803 38.963 -0.025 6 H SER 2 HN SER 2 14.303 39.927 -2.114 7 HA SER 2 HA SER 2 12.929 38.729 -4.352 8 HB2 SER 2 HB2 SER 2 14.745 40.075 -5.606 9 HB3 SER 2 HB1 SER 2 13.531 40.982 -4.700 10 HG SER 2 HG SER 2 15.251 41.861 -3.830 11 H HIS 3 HN HIS 3 14.299 37.807 -6.145 12 HA HIS 3 HA HIS 3 16.553 36.213 -5.103 13 HB2 HIS 3 HB2 HIS 3 14.659 35.386 -7.319 14 HB3 HIS 3 HB1 HIS 3 15.963 34.425 -6.640 15 HD1 HIS 3 HD1 HIS 3 12.502 34.475 -6.630 16 HD2 HIS 3 HD2 HIS 3 15.316 34.213 -3.577 17 HE1 HIS 3 HE1 HIS 3 11.306 33.422 -4.688 18 HE2 HIS 3 HE2 HIS 3 12.948 33.541 -2.789 19 H MET 4 HN MET 4 17.807 35.361 -7.221 20 HA MET 4 HA MET 4 18.660 37.638 -8.718 21 HB2 MET 4 HB2 MET 4 20.073 35.599 -8.173 22 HB3 MET 4 HB1 MET 4 19.155 34.726 -9.390 23 HG2 MET 4 HG2 MET 4 20.668 37.246 -10.005 24 HG3 MET 4 HG1 MET 4 21.403 35.649 -10.087 25 HE1 MET 4 HE1 MET 4 20.933 36.696 -13.850 26 HE2 MET 4 HE2 MET 4 22.090 36.213 -12.608 27 HE3 MET 4 HE3 MET 4 21.285 37.779 -12.501 28 H SER 5 HN SER 5 17.290 38.564 -10.115 29 HA SER 5 HA SER 5 15.210 36.968 -11.352 30 HB2 SER 5 HB2 SER 5 14.896 39.305 -10.300 31 HB3 SER 5 HB1 SER 5 15.625 39.918 -11.783 32 HG SER 5 HG SER 5 13.487 39.890 -12.209 33 H THR 6 HN THR 6 15.930 35.813 -13.012 34 HA THR 6 HA THR 6 17.821 36.862 -14.907 35 HB THR 6 HB THR 6 18.068 34.561 -14.399 36 HG1 THR 6 HG1 THR 6 16.856 34.007 -16.794 37 HG21 THR 6 HG21 THR 6 16.294 32.886 -14.779 38 HG22 THR 6 HG22 THR 6 15.169 34.191 -15.153 39 HG23 THR 6 HG23 THR 6 15.864 34.058 -13.537 40 H ASN 7 HN ASN 7 14.395 35.890 -14.989 41 HA ASN 7 HA ASN 7 14.115 37.426 -17.480 42 HB2 ASN 7 HB2 ASN 7 13.480 35.097 -17.786 43 HB3 ASN 7 HB1 ASN 7 12.400 35.177 -16.399 44 HD21 ASN 7 HD21 ASN 7 10.411 36.093 -16.610 45 HD22 ASN 7 HD22 ASN 7 9.737 36.570 -18.126 46 HA PRO 8 HA PRO 8 11.928 40.059 -14.583 47 HB2 PRO 8 HB2 PRO 8 12.567 42.371 -15.721 48 HB3 PRO 8 HB1 PRO 8 13.804 41.388 -14.929 49 HG2 PRO 8 HG2 PRO 8 13.243 41.745 -17.837 50 HG3 PRO 8 HG1 PRO 8 14.796 41.555 -17.004 51 HD2 PRO 8 HD2 PRO 8 13.336 39.528 -18.313 52 HD3 PRO 8 HD1 PRO 8 14.721 39.298 -17.231 53 H PHE 9 HN PHE 9 10.631 38.817 -17.110 54 HA PHE 9 HA PHE 9 8.627 40.939 -17.490 55 HB2 PHE 9 HB2 PHE 9 9.501 38.868 -19.517 56 HB3 PHE 9 HB1 PHE 9 8.210 40.043 -19.755 57 HD1 PHE 9 HD2 PHE 9 8.977 42.551 -19.283 58 HD2 PHE 9 HD1 PHE 9 11.552 39.359 -20.405 59 HE1 PHE 9 HE2 PHE 9 10.614 44.182 -20.138 60 HE2 PHE 9 HE1 PHE 9 13.200 40.980 -21.253 61 HZ PHE 9 HZ PHE 9 12.727 43.394 -21.123 62 H ASP 10 HN ASP 10 6.439 40.257 -17.721 63 HA ASP 10 HA ASP 10 5.884 37.922 -16.099 64 HB2 ASP 10 HB2 ASP 10 4.125 40.107 -17.211 65 HB3 ASP 10 HB1 ASP 10 3.467 38.699 -16.382 66 H ASP 11 HN ASP 11 6.327 36.161 -17.333 67 HA ASP 11 HA ASP 11 5.139 35.874 -19.964 68 HB2 ASP 11 HB2 ASP 11 7.442 34.987 -19.238 69 HB3 ASP 11 HB1 ASP 11 6.555 33.723 -18.391 70 H ASP 12 HN ASP 12 3.706 33.991 -20.445 71 HA ASP 12 HA ASP 12 1.694 33.860 -18.343 72 HB2 ASP 12 HB2 ASP 12 1.622 33.121 -21.268 73 HB3 ASP 12 HB1 ASP 12 0.292 32.793 -20.165 74 H ASN 13 HN ASN 13 3.519 31.596 -20.401 75 HA ASN 13 HA ASN 13 2.378 29.339 -18.995 76 HB2 ASN 13 HB2 ASN 13 3.664 27.940 -20.511 77 HB3 ASN 13 HB1 ASN 13 2.819 29.185 -21.420 78 HD21 ASN 13 HD21 ASN 13 5.914 28.005 -20.360 79 HD22 ASN 13 HD22 ASN 13 6.869 29.001 -21.404 80 H GLY 14 HN GLY 14 3.946 27.566 -18.278 81 HA2 GLY 14 HA2 GLY 14 5.631 28.750 -16.245 82 HA3 GLY 14 HA1 GLY 14 5.263 27.044 -16.443 83 H ALA 15 HN ALA 15 7.775 28.815 -16.170 84 HA ALA 15 HA ALA 15 9.307 27.971 -18.481 85 HB1 ALA 15 HB1 ALA 15 11.177 29.122 -17.413 86 HB2 ALA 15 HB2 ALA 15 10.213 29.360 -15.955 87 HB3 ALA 15 HB3 ALA 15 9.753 30.159 -17.459 88 H PHE 16 HN PHE 16 11.559 26.973 -17.845 89 HA PHE 16 HA PHE 16 11.210 24.899 -15.801 90 HB2 PHE 16 HB2 PHE 16 12.415 23.389 -17.632 91 HB3 PHE 16 HB1 PHE 16 10.662 23.561 -17.607 92 HD1 PHE 16 HD1 PHE 16 13.644 25.259 -19.049 93 HD2 PHE 16 HD2 PHE 16 9.610 24.045 -19.599 94 HE1 PHE 16 HE1 PHE 16 13.687 26.173 -21.312 95 HE2 PHE 16 HE2 PHE 16 9.645 24.947 -21.883 96 HZ PHE 16 HZ PHE 16 11.688 26.015 -22.749 97 H PHE 17 HN PHE 17 13.113 24.189 -14.849 98 HA PHE 17 HA PHE 17 15.518 25.749 -15.546 99 HB2 PHE 17 HB2 PHE 17 14.401 24.913 -12.873 100 HB3 PHE 17 HB1 PHE 17 16.112 25.254 -13.057 101 HD1 PHE 17 HD2 PHE 17 14.418 27.385 -15.245 102 HD2 PHE 17 HD1 PHE 17 15.228 26.793 -11.114 103 HE1 PHE 17 HE2 PHE 17 13.992 29.770 -14.821 104 HE2 PHE 17 HE1 PHE 17 14.800 29.177 -10.677 105 HZ PHE 17 HZ PHE 17 14.181 30.669 -12.535 106 H VAL 18 HN VAL 18 17.561 24.724 -14.821 107 HA VAL 18 HA VAL 18 17.516 21.818 -15.215 108 HB VAL 18 HB VAL 18 19.815 23.781 -15.222 109 HG11 VAL 18 HG11 VAL 18 20.563 21.647 -14.318 110 HG12 VAL 18 HG12 VAL 18 21.210 21.887 -15.939 111 HG13 VAL 18 HG13 VAL 18 19.846 20.801 -15.689 112 HG21 VAL 18 HG21 VAL 18 19.967 23.230 -17.603 113 HG22 VAL 18 HG22 VAL 18 18.382 23.897 -17.204 114 HG23 VAL 18 HG23 VAL 18 18.574 22.161 -17.446 115 H LEU 19 HN LEU 19 16.984 20.925 -13.300 116 HA LEU 19 HA LEU 19 18.263 21.942 -10.854 117 HB2 LEU 19 HB2 LEU 19 15.686 21.731 -11.228 118 HB3 LEU 19 HB1 LEU 19 15.956 20.025 -10.939 119 HG LEU 19 HG LEU 19 17.009 20.683 -8.731 120 HD11 LEU 19 HD11 LEU 19 16.325 22.896 -7.858 121 HD12 LEU 19 HD12 LEU 19 15.765 23.326 -9.474 122 HD13 LEU 19 HD13 LEU 19 17.473 22.999 -9.194 123 HD21 LEU 19 HD21 LEU 19 14.760 19.742 -8.898 124 HD22 LEU 19 HD22 LEU 19 14.097 21.351 -9.172 125 HD23 LEU 19 HD23 LEU 19 14.845 20.959 -7.627 126 H VAL 20 HN VAL 20 19.765 20.689 -9.868 127 HA VAL 20 HA VAL 20 19.762 17.811 -10.512 128 HB VAL 20 HB VAL 20 22.229 19.521 -10.106 129 HG11 VAL 20 HG11 VAL 20 21.966 16.600 -10.819 130 HG12 VAL 20 HG12 VAL 20 22.513 17.244 -9.272 131 HG13 VAL 20 HG13 VAL 20 23.474 17.507 -10.728 132 HG21 VAL 20 HG21 VAL 20 21.158 18.226 -12.616 133 HG22 VAL 20 HG22 VAL 20 22.692 19.083 -12.471 134 HG23 VAL 20 HG23 VAL 20 21.173 19.956 -12.267 135 H ASN 21 HN ASN 21 19.722 16.492 -8.841 136 HA ASN 21 HA ASN 21 20.230 17.562 -6.146 137 HB2 ASN 21 HB2 ASN 21 17.951 16.641 -6.616 138 HB3 ASN 21 HB1 ASN 21 18.680 15.086 -6.979 139 HD21 ASN 21 HD21 ASN 21 16.723 15.984 -4.942 140 HD22 ASN 21 HD22 ASN 21 17.356 15.433 -3.431 141 H ASP 22 HN ASP 22 21.546 16.314 -4.720 142 HA ASP 22 HA ASP 22 23.884 15.306 -5.871 143 HB2 ASP 22 HB2 ASP 22 23.815 16.214 -3.605 144 HB3 ASP 22 HB1 ASP 22 22.810 14.867 -3.079 145 H GLU 23 HN GLU 23 21.004 13.617 -4.736 146 HA GLU 23 HA GLU 23 22.261 11.066 -5.449 147 HB2 GLU 23 HB2 GLU 23 19.707 11.629 -3.936 148 HB3 GLU 23 HB1 GLU 23 20.341 10.024 -4.280 149 HG2 GLU 23 HG2 GLU 23 22.397 10.641 -3.022 150 HG3 GLU 23 HG1 GLU 23 21.607 12.150 -2.568 151 H ASP 24 HN ASP 24 21.019 13.235 -7.228 152 HA ASP 24 HA ASP 24 19.373 11.388 -8.833 153 HB2 ASP 24 HB2 ASP 24 17.923 13.147 -8.061 154 HB3 ASP 24 HB1 ASP 24 19.099 14.384 -8.487 155 H GLN 25 HN GLN 25 19.486 12.045 -11.261 156 HA GLN 25 HA GLN 25 22.341 12.393 -11.860 157 HB2 GLN 25 HB2 GLN 25 20.159 11.739 -13.836 158 HB3 GLN 25 HB1 GLN 25 21.877 11.393 -13.959 159 HG2 GLN 25 HG2 GLN 25 20.060 10.110 -11.940 160 HG3 GLN 25 HG1 GLN 25 20.416 9.422 -13.521 161 HE21 GLN 25 HE21 GLN 25 23.162 10.300 -13.532 162 HE22 GLN 25 HE22 GLN 25 24.000 9.271 -12.420 163 H HIS 26 HN HIS 26 19.204 13.487 -13.118 164 HA HIS 26 HA HIS 26 19.898 16.220 -13.041 165 HB2 HIS 26 HB2 HIS 26 19.716 16.630 -15.529 166 HB3 HIS 26 HB1 HIS 26 21.213 15.880 -14.990 167 HD1 HIS 26 HD1 HIS 26 21.654 13.438 -15.729 168 HD2 HIS 26 HD2 HIS 26 18.104 15.046 -17.180 169 HE1 HIS 26 HE1 HIS 26 20.908 11.897 -17.566 170 HE2 HIS 26 HE2 HIS 26 18.903 13.025 -18.586 171 H SER 27 HN SER 27 18.030 17.306 -12.751 172 HA SER 27 HA SER 27 15.586 16.057 -13.821 173 HB2 SER 27 HB2 SER 27 15.951 17.616 -11.254 174 HB3 SER 27 HB1 SER 27 14.387 17.118 -11.901 175 HG SER 27 HG SER 27 16.533 15.439 -11.055 176 H LEU 28 HN LEU 28 15.019 17.192 -15.581 177 HA LEU 28 HA LEU 28 15.328 20.050 -15.714 178 HB2 LEU 28 HB2 LEU 28 14.977 18.085 -17.599 179 HB3 LEU 28 HB1 LEU 28 13.375 18.791 -17.523 180 HG LEU 28 HG LEU 28 14.652 19.819 -19.301 181 HD11 LEU 28 HD11 LEU 28 14.333 21.703 -16.972 182 HD12 LEU 28 HD12 LEU 28 13.075 21.241 -18.119 183 HD13 LEU 28 HD13 LEU 28 14.471 22.168 -18.668 184 HD21 LEU 28 HD21 LEU 28 16.685 21.077 -18.863 185 HD22 LEU 28 HD22 LEU 28 16.881 19.385 -18.415 186 HD23 LEU 28 HD23 LEU 28 16.627 20.605 -17.166 187 H TRP 29 HN TRP 29 14.189 21.062 -14.130 188 HA TRP 29 HA TRP 29 11.486 20.049 -13.555 189 HB2 TRP 29 HB2 TRP 29 13.446 20.037 -11.825 190 HB3 TRP 29 HB1 TRP 29 13.073 21.749 -11.664 191 HD1 TRP 29 HD1 TRP 29 11.431 22.247 -9.775 192 HE1 TRP 29 HE1 TRP 29 9.573 20.958 -8.545 193 HE3 TRP 29 HE3 TRP 29 11.556 17.891 -12.455 194 HZ2 TRP 29 HZ2 TRP 29 8.320 18.438 -8.702 195 HZ3 TRP 29 HZ3 TRP 29 9.987 16.092 -11.848 196 HH2 TRP 29 HH2 TRP 29 8.405 16.364 -10.010 197 HA PRO 30 HA PRO 30 10.120 23.983 -15.189 198 HB2 PRO 30 HB2 PRO 30 7.478 23.061 -14.291 199 HB3 PRO 30 HB1 PRO 30 8.033 23.449 -15.922 200 HG2 PRO 30 HG2 PRO 30 7.532 20.917 -15.152 201 HG3 PRO 30 HG1 PRO 30 8.824 21.311 -16.300 202 HD2 PRO 30 HD2 PRO 30 9.010 20.700 -13.374 203 HD3 PRO 30 HD1 PRO 30 10.057 20.161 -14.705 204 H VAL 31 HN VAL 31 9.464 25.924 -14.308 205 HA VAL 31 HA VAL 31 9.687 26.167 -11.450 206 HB VAL 31 HB VAL 31 9.518 28.553 -11.784 207 HG11 VAL 31 HG11 VAL 31 11.159 27.291 -13.982 208 HG12 VAL 31 HG12 VAL 31 11.665 27.527 -12.307 209 HG13 VAL 31 HG13 VAL 31 11.370 28.922 -13.345 210 HG21 VAL 31 HG21 VAL 31 8.799 27.963 -14.654 211 HG22 VAL 31 HG22 VAL 31 9.047 29.558 -13.945 212 HG23 VAL 31 HG23 VAL 31 7.691 28.561 -13.418 213 H PHE 32 HN PHE 32 7.223 25.347 -13.457 214 HA PHE 32 HA PHE 32 5.052 26.533 -11.951 215 HB2 PHE 32 HB2 PHE 32 4.848 26.119 -14.389 216 HB3 PHE 32 HB1 PHE 32 5.051 24.396 -14.105 217 HD1 PHE 32 HD1 PHE 32 2.815 27.266 -13.350 218 HD2 PHE 32 HD2 PHE 32 3.208 23.038 -13.672 219 HE1 PHE 32 HE1 PHE 32 0.379 27.023 -13.100 220 HE2 PHE 32 HE2 PHE 32 0.771 22.790 -13.421 221 HZ PHE 32 HZ PHE 32 -0.645 24.788 -13.135 222 H ALA 33 HN ALA 33 7.172 23.968 -11.639 223 HA ALA 33 HA ALA 33 5.301 22.253 -10.183 224 HB1 ALA 33 HB1 ALA 33 6.709 21.181 -11.871 225 HB2 ALA 33 HB2 ALA 33 7.068 20.570 -10.256 226 HB3 ALA 33 HB3 ALA 33 8.151 21.733 -11.023 227 H ASP 34 HN ASP 34 6.103 21.289 -8.146 228 HA ASP 34 HA ASP 34 6.744 23.324 -6.288 229 HB2 ASP 34 HB2 ASP 34 6.639 20.314 -5.995 230 HB3 ASP 34 HB1 ASP 34 6.854 21.425 -4.650 231 H ILE 35 HN ILE 35 8.655 24.075 -5.695 232 HA ILE 35 HA ILE 35 11.063 22.522 -6.259 233 HB ILE 35 HB ILE 35 10.657 25.381 -5.391 234 HG12 ILE 35 HG12 ILE 35 10.322 24.757 -7.802 235 HG13 ILE 35 HG11 ILE 35 11.574 25.954 -7.533 236 HG21 ILE 35 HG21 ILE 35 13.267 23.917 -5.725 237 HG22 ILE 35 HG22 ILE 35 12.600 24.537 -4.214 238 HG23 ILE 35 HG23 ILE 35 13.091 25.656 -5.484 239 HD11 ILE 35 HD11 ILE 35 13.280 24.231 -7.782 240 HD12 ILE 35 HD12 ILE 35 12.233 24.305 -9.201 241 HD13 ILE 35 HD13 ILE 35 12.021 23.016 -8.013 242 HA PRO 36 HA PRO 36 10.924 21.325 -1.918 243 HB2 PRO 36 HB2 PRO 36 12.508 19.197 -2.148 244 HB3 PRO 36 HB1 PRO 36 10.893 19.185 -2.867 245 HG2 PRO 36 HG2 PRO 36 13.543 19.667 -4.184 246 HG3 PRO 36 HG1 PRO 36 12.186 18.667 -4.739 247 HD2 PRO 36 HD2 PRO 36 12.679 21.241 -5.599 248 HD3 PRO 36 HD1 PRO 36 11.087 20.457 -5.636 249 H ALA 37 HN ALA 37 13.240 20.167 -0.810 250 HA ALA 37 HA ALA 37 15.301 22.249 -1.163 251 HB1 ALA 37 HB1 ALA 37 16.003 21.801 1.135 252 HB2 ALA 37 HB2 ALA 37 14.745 20.574 1.287 253 HB3 ALA 37 HB3 ALA 37 14.303 22.268 1.080 254 H GLY 38 HN GLY 38 17.515 21.528 -1.084 255 HA2 GLY 38 HA2 GLY 38 19.187 19.840 -1.114 256 HA3 GLY 38 HA1 GLY 38 17.934 18.641 -1.396 257 H TRP 39 HN TRP 39 18.187 21.642 -3.136 258 HA TRP 39 HA TRP 39 18.711 20.097 -5.578 259 HB2 TRP 39 HB2 TRP 39 17.341 21.839 -6.739 260 HB3 TRP 39 HB1 TRP 39 16.431 20.863 -5.591 261 HD1 TRP 39 HD1 TRP 39 15.389 22.081 -3.506 262 HE1 TRP 39 HE1 TRP 39 15.103 24.551 -2.857 263 HE3 TRP 39 HE3 TRP 39 18.525 24.200 -6.945 264 HZ2 TRP 39 HZ2 TRP 39 16.072 27.062 -3.686 265 HZ3 TRP 39 HZ3 TRP 39 18.788 26.645 -6.946 266 HH2 TRP 39 HH2 TRP 39 17.586 28.046 -5.349 267 H ARG 40 HN ARG 40 19.682 21.320 -7.334 268 HA ARG 40 HA ARG 40 20.846 23.899 -6.660 269 HB2 ARG 40 HB2 ARG 40 22.618 22.272 -6.137 270 HB3 ARG 40 HB1 ARG 40 22.476 21.591 -7.750 271 HG2 ARG 40 HG2 ARG 40 24.409 23.038 -7.602 272 HG3 ARG 40 HG1 ARG 40 23.219 23.711 -8.715 273 HD2 ARG 40 HD2 ARG 40 22.446 25.234 -6.959 274 HD3 ARG 40 HD1 ARG 40 23.638 24.559 -5.849 275 HE ARG 40 HE ARG 40 25.282 25.364 -7.686 276 HH11 ARG 40 HH11 ARG 40 22.370 27.008 -6.662 277 HH12 ARG 40 HH12 ARG 40 22.962 28.591 -7.065 278 HH21 ARG 40 HH21 ARG 40 26.070 27.430 -8.212 279 HH22 ARG 40 HH22 ARG 40 25.061 28.831 -7.974 280 H VAL 41 HN VAL 41 20.013 25.168 -8.186 281 HA VAL 41 HA VAL 41 19.332 24.191 -10.793 282 HB VAL 41 HB VAL 41 19.395 27.029 -9.729 283 HG11 VAL 41 HG11 VAL 41 18.090 27.637 -11.698 284 HG12 VAL 41 HG12 VAL 41 18.200 25.982 -12.297 285 HG13 VAL 41 HG13 VAL 41 19.654 26.970 -12.169 286 HG21 VAL 41 HG21 VAL 41 17.729 25.686 -8.601 287 HG22 VAL 41 HG22 VAL 41 17.112 25.094 -10.144 288 HG23 VAL 41 HG23 VAL 41 16.928 26.796 -9.714 289 H VAL 42 HN VAL 42 21.006 23.567 -11.992 290 HA VAL 42 HA VAL 42 23.568 24.869 -11.850 291 HB VAL 42 HB VAL 42 22.617 22.725 -13.761 292 HG11 VAL 42 HG11 VAL 42 25.003 22.235 -14.054 293 HG12 VAL 42 HG12 VAL 42 25.406 23.606 -13.020 294 HG13 VAL 42 HG13 VAL 42 24.608 23.876 -14.570 295 HG21 VAL 42 HG21 VAL 42 22.421 22.008 -11.444 296 HG22 VAL 42 HG22 VAL 42 24.089 22.494 -11.140 297 HG23 VAL 42 HG23 VAL 42 23.747 21.162 -12.244 298 H HIS 43 HN HIS 43 20.815 24.904 -13.975 299 HA HIS 43 HA HIS 43 21.971 27.165 -15.404 300 HB2 HIS 43 HB2 HIS 43 22.421 25.061 -16.739 301 HB3 HIS 43 HB1 HIS 43 20.677 24.866 -16.889 302 HD1 HIS 43 HD1 HIS 43 19.410 26.726 -18.297 303 HD2 HIS 43 HD2 HIS 43 23.563 26.831 -18.489 304 HE1 HIS 43 HE1 HIS 43 19.965 28.206 -20.250 305 HE2 HIS 43 HE2 HIS 43 22.473 28.132 -20.441 306 H GLY 44 HN GLY 44 20.463 28.660 -16.054 307 HA2 GLY 44 HA2 GLY 44 17.896 28.488 -14.772 308 HA3 GLY 44 HA1 GLY 44 18.514 29.845 -15.699 309 H GLU 45 HN GLU 45 16.551 30.143 -16.740 310 HA GLU 45 HA GLU 45 15.319 27.914 -18.124 311 HB2 GLU 45 HB2 GLU 45 13.847 30.181 -18.735 312 HB3 GLU 45 HB1 GLU 45 13.497 29.025 -17.449 313 HG2 GLU 45 HG2 GLU 45 13.465 31.164 -16.462 314 HG3 GLU 45 HG1 GLU 45 14.944 30.346 -15.964 315 H ALA 46 HN ALA 46 16.529 27.449 -19.756 316 HA ALA 46 HA ALA 46 16.628 29.397 -21.966 317 HB1 ALA 46 HB1 ALA 46 18.566 28.188 -22.857 318 HB2 ALA 46 HB2 ALA 46 18.541 27.119 -21.451 319 HB3 ALA 46 HB3 ALA 46 18.888 28.836 -21.248 320 H SER 47 HN SER 47 16.590 28.258 -24.138 321 HA SER 47 HA SER 47 14.237 27.061 -24.653 322 HB2 SER 47 HB2 SER 47 16.795 26.324 -26.086 323 HB3 SER 47 HB1 SER 47 15.161 26.305 -26.753 324 HG SER 47 HG SER 47 15.175 28.650 -26.179 325 H ARG 48 HN ARG 48 13.277 25.182 -24.375 326 HA ARG 48 HA ARG 48 14.013 23.362 -22.474 327 HB2 ARG 48 HB2 ARG 48 11.745 23.568 -23.256 328 HB3 ARG 48 HB1 ARG 48 12.201 23.019 -24.864 329 HG2 ARG 48 HG2 ARG 48 11.216 21.153 -23.991 330 HG3 ARG 48 HG1 ARG 48 12.913 20.858 -23.621 331 HD2 ARG 48 HD2 ARG 48 12.636 21.337 -21.367 332 HD3 ARG 48 HD1 ARG 48 11.131 22.218 -21.640 333 HE ARG 48 HE ARG 48 10.494 19.732 -22.442 334 HH11 ARG 48 HH11 ARG 48 12.037 20.867 -19.512 335 HH12 ARG 48 HH12 ARG 48 11.347 19.614 -18.526 336 HH21 ARG 48 HH21 ARG 48 9.578 18.121 -21.130 337 HH22 ARG 48 HH22 ARG 48 9.963 18.065 -19.436 338 H ALA 49 HN ALA 49 14.394 22.954 -25.997 339 HA ALA 49 HA ALA 49 15.467 20.369 -25.938 340 HB1 ALA 49 HB1 ALA 49 16.241 20.794 -28.179 341 HB2 ALA 49 HB2 ALA 49 16.073 22.534 -27.942 342 HB3 ALA 49 HB3 ALA 49 14.640 21.502 -27.961 343 H ALA 50 HN ALA 50 17.047 23.501 -25.623 344 HA ALA 50 HA ALA 50 19.711 22.502 -25.809 345 HB1 ALA 50 HB1 ALA 50 20.403 24.712 -25.093 346 HB2 ALA 50 HB2 ALA 50 18.751 25.093 -24.605 347 HB3 ALA 50 HB3 ALA 50 19.129 24.840 -26.309 348 H CYS 51 HN CYS 51 17.549 23.294 -23.117 349 HA CYS 51 HA CYS 51 19.425 22.777 -21.066 350 HB2 CYS 51 HB2 CYS 51 16.405 22.650 -21.032 351 HB3 CYS 51 HB1 CYS 51 17.419 22.563 -19.596 352 HG CYS 51 HG CYS 51 16.326 25.210 -21.216 353 H LEU 52 HN LEU 52 17.073 20.719 -22.733 354 HA LEU 52 HA LEU 52 17.477 18.371 -21.234 355 HB2 LEU 52 HB2 LEU 52 16.359 19.026 -23.891 356 HB3 LEU 52 HB1 LEU 52 16.928 17.379 -23.692 357 HG LEU 52 HG LEU 52 15.431 17.080 -21.769 358 HD11 LEU 52 HD11 LEU 52 13.764 18.741 -21.200 359 HD12 LEU 52 HD12 LEU 52 14.426 19.847 -22.406 360 HD13 LEU 52 HD13 LEU 52 15.387 19.404 -20.994 361 HD21 LEU 52 HD21 LEU 52 14.033 18.135 -24.224 362 HD22 LEU 52 HD22 LEU 52 13.329 17.074 -23.002 363 HD23 LEU 52 HD23 LEU 52 14.658 16.499 -24.010 364 H ASP 53 HN ASP 53 19.026 19.451 -24.251 365 HA ASP 53 HA ASP 53 20.797 17.314 -24.557 366 HB2 ASP 53 HB2 ASP 53 20.415 19.031 -26.276 367 HB3 ASP 53 HB1 ASP 53 21.208 20.229 -25.264 368 H TYR 54 HN TYR 54 21.166 20.333 -22.770 369 HA TYR 54 HA TYR 54 23.829 20.040 -21.976 370 HB2 TYR 54 HB2 TYR 54 22.339 22.099 -21.848 371 HB3 TYR 54 HB1 TYR 54 21.667 21.412 -20.377 372 HD1 TYR 54 HD1 TYR 54 25.122 21.898 -21.741 373 HD2 TYR 54 HD2 TYR 54 22.441 22.450 -18.482 374 HE1 TYR 54 HE1 TYR 54 26.916 22.983 -20.458 375 HE2 TYR 54 HE2 TYR 54 24.231 23.531 -17.183 376 HH TYR 54 HH TYR 54 26.503 23.859 -17.081 377 H VAL 55 HN VAL 55 20.825 19.020 -20.325 378 HA VAL 55 HA VAL 55 22.238 18.081 -18.019 379 HB VAL 55 HB VAL 55 20.138 17.135 -17.251 380 HG11 VAL 55 HG11 VAL 55 20.521 19.517 -16.963 381 HG12 VAL 55 HG12 VAL 55 18.806 19.163 -17.183 382 HG13 VAL 55 HG13 VAL 55 19.747 19.835 -18.516 383 HG21 VAL 55 HG21 VAL 55 19.293 16.235 -19.356 384 HG22 VAL 55 HG22 VAL 55 19.016 17.871 -19.955 385 HG23 VAL 55 HG23 VAL 55 18.092 17.265 -18.579 386 H GLU 56 HN GLU 56 21.103 16.574 -20.981 387 HA GLU 56 HA GLU 56 21.479 13.892 -20.103 388 HB2 GLU 56 HB2 GLU 56 21.286 15.080 -22.874 389 HB3 GLU 56 HB1 GLU 56 21.301 13.353 -22.538 390 HG2 GLU 56 HG2 GLU 56 19.292 15.128 -21.227 391 HG3 GLU 56 HG1 GLU 56 19.042 14.572 -22.876 392 H LYS 57 HN LYS 57 23.521 16.242 -21.768 393 HA LYS 57 HA LYS 57 25.613 14.401 -22.353 394 HB2 LYS 57 HB2 LYS 57 25.419 17.390 -22.319 395 HB3 LYS 57 HB1 LYS 57 26.966 16.591 -22.583 396 HG2 LYS 57 HG2 LYS 57 26.137 15.495 -24.541 397 HG3 LYS 57 HG1 LYS 57 24.501 16.086 -24.233 398 HD2 LYS 57 HD2 LYS 57 25.168 18.339 -24.633 399 HD3 LYS 57 HD1 LYS 57 26.871 17.879 -24.706 400 HE2 LYS 57 HE2 LYS 57 26.567 16.727 -26.749 401 HE3 LYS 57 HE1 LYS 57 24.811 16.786 -26.599 402 HZ1 LYS 57 HZ1 LYS 57 24.844 19.131 -26.941 403 HZ2 LYS 57 HZ2 LYS 57 25.712 18.394 -28.205 404 HZ3 LYS 57 HZ3 LYS 57 26.542 19.171 -26.949 405 H ASN 58 HN ASN 58 24.924 16.398 -19.544 406 HA ASN 58 HA ASN 58 27.530 15.901 -18.391 407 HB2 ASN 58 HB2 ASN 58 25.066 17.312 -17.397 408 HB3 ASN 58 HB1 ASN 58 26.392 16.930 -16.303 409 HD21 ASN 58 HD21 ASN 58 25.347 18.878 -18.973 410 HD22 ASN 58 HD22 ASN 58 26.711 19.942 -18.984 411 H TRP 59 HN TRP 59 24.312 14.632 -18.168 412 HA TRP 59 HA TRP 59 23.507 12.647 -17.508 413 HB2 TRP 59 HB2 TRP 59 25.567 11.710 -18.532 414 HB3 TRP 59 HB1 TRP 59 26.352 11.800 -16.957 415 HD1 TRP 59 HD1 TRP 59 22.797 10.500 -17.781 416 HE1 TRP 59 HE1 TRP 59 22.600 8.078 -16.920 417 HE3 TRP 59 HE3 TRP 59 27.595 9.848 -16.146 418 HZ2 TRP 59 HZ2 TRP 59 24.270 6.153 -15.699 419 HZ3 TRP 59 HZ3 TRP 59 28.213 7.683 -15.146 420 HH2 TRP 59 HH2 TRP 59 26.582 5.878 -14.931 421 H THR 60 HN THR 60 26.234 13.230 -15.209 422 HA THR 60 HA THR 60 24.227 13.007 -13.086 423 HB THR 60 HB THR 60 25.119 10.784 -13.287 424 HG1 THR 60 HG1 THR 60 26.162 10.701 -11.091 425 HG21 THR 60 HG21 THR 60 27.272 11.273 -14.331 426 HG22 THR 60 HG22 THR 60 27.482 10.269 -12.898 427 HG23 THR 60 HG23 THR 60 27.849 11.993 -12.830 428 H ASP 61 HN ASP 61 27.729 13.763 -13.622 429 HA ASP 61 HA ASP 61 27.388 15.805 -11.551 430 HB2 ASP 61 HB2 ASP 61 28.328 13.874 -10.410 431 HB3 ASP 61 HB1 ASP 61 29.640 13.789 -11.583 432 H LEU 62 HN LEU 62 28.639 17.566 -11.654 433 HA LEU 62 HA LEU 62 30.864 17.807 -13.464 434 HB2 LEU 62 HB2 LEU 62 29.995 19.594 -14.805 435 HB3 LEU 62 HB1 LEU 62 28.889 18.241 -14.933 436 HG LEU 62 HG LEU 62 28.384 20.530 -13.039 437 HD11 LEU 62 HD11 LEU 62 28.619 21.454 -15.289 438 HD12 LEU 62 HD12 LEU 62 26.947 21.514 -14.744 439 HD13 LEU 62 HD13 LEU 62 27.454 20.282 -15.898 440 HD21 LEU 62 HD21 LEU 62 27.090 18.503 -12.636 441 HD22 LEU 62 HD22 LEU 62 26.563 18.486 -14.320 442 HD23 LEU 62 HD23 LEU 62 26.053 19.792 -13.249 443 H ARG 63 HN ARG 63 29.543 18.286 -10.589 444 HA ARG 63 HA ARG 63 31.091 20.433 -9.669 445 HB2 ARG 63 HB2 ARG 63 29.565 21.706 -11.212 446 HB3 ARG 63 HB1 ARG 63 28.209 21.182 -10.227 447 HG2 ARG 63 HG2 ARG 63 28.738 23.395 -9.584 448 HG3 ARG 63 HG1 ARG 63 29.288 22.335 -8.285 449 HD2 ARG 63 HD2 ARG 63 31.569 22.463 -9.137 450 HD3 ARG 63 HD1 ARG 63 31.027 23.483 -10.468 451 HE ARG 63 HE ARG 63 30.394 24.522 -7.855 452 HH11 ARG 63 HH11 ARG 63 32.852 24.369 -10.356 453 HH12 ARG 63 HH12 ARG 63 33.582 25.883 -9.893 454 HH21 ARG 63 HH21 ARG 63 31.346 26.481 -7.256 455 HH22 ARG 63 HH22 ARG 63 32.738 27.082 -8.115 456 HA PRO 64 HA PRO 64 29.833 18.415 -5.865 457 HB2 PRO 64 HB2 PRO 64 30.271 21.160 -4.775 458 HB3 PRO 64 HB1 PRO 64 30.877 19.606 -4.190 459 HG2 PRO 64 HG2 PRO 64 32.474 21.265 -5.521 460 HG3 PRO 64 HG1 PRO 64 32.563 19.512 -5.770 461 HD2 PRO 64 HD2 PRO 64 31.405 21.621 -7.523 462 HD3 PRO 64 HD1 PRO 64 32.212 20.101 -7.960 463 H LYS 65 HN LYS 65 27.957 18.182 -4.783 464 HA LYS 65 HA LYS 65 26.027 20.336 -4.589 465 HB2 LYS 65 HB2 LYS 65 24.259 19.145 -5.753 466 HB3 LYS 65 HB1 LYS 65 25.621 19.363 -6.840 467 HG2 LYS 65 HG2 LYS 65 26.315 16.999 -6.151 468 HG3 LYS 65 HG1 LYS 65 24.685 16.856 -5.487 469 HD2 LYS 65 HD2 LYS 65 24.401 16.015 -7.610 470 HD3 LYS 65 HD1 LYS 65 23.970 17.710 -7.851 471 HE2 LYS 65 HE2 LYS 65 25.417 17.102 -9.638 472 HE3 LYS 65 HE1 LYS 65 26.352 18.115 -8.539 473 HZ1 LYS 65 HZ1 LYS 65 27.111 15.905 -7.519 474 HZ2 LYS 65 HZ2 LYS 65 27.773 16.353 -9.013 475 HZ3 LYS 65 HZ3 LYS 65 26.537 15.196 -8.946 476 H SER 66 HN SER 66 24.434 19.909 -2.968 477 HA SER 66 HA SER 66 24.105 17.391 -1.736 478 HB2 SER 66 HB2 SER 66 26.471 18.010 -1.001 479 HB3 SER 66 HB1 SER 66 25.736 19.306 -0.058 480 HG SER 66 HG SER 66 25.603 16.527 0.293 481 H LEU 67 HN LEU 67 23.292 17.933 0.725 482 HA LEU 67 HA LEU 67 21.203 19.983 0.360 483 HB2 LEU 67 HB2 LEU 67 20.349 17.685 0.429 484 HB3 LEU 67 HB1 LEU 67 21.157 17.407 1.952 485 HG LEU 67 HG LEU 67 18.602 17.830 1.928 486 HD11 LEU 67 HD11 LEU 67 18.688 18.926 4.107 487 HD12 LEU 67 HD12 LEU 67 20.378 19.349 3.831 488 HD13 LEU 67 HD13 LEU 67 19.899 17.656 3.970 489 HD21 LEU 67 HD21 LEU 67 17.967 20.181 2.160 490 HD22 LEU 67 HD22 LEU 67 18.609 19.823 0.557 491 HD23 LEU 67 HD23 LEU 67 19.613 20.659 1.740 492 H ARG 68 HN ARG 68 21.765 21.758 1.468 493 HA ARG 68 HA ARG 68 22.917 21.435 4.154 494 HB2 ARG 68 HB2 ARG 68 23.817 23.068 2.272 495 HB3 ARG 68 HB1 ARG 68 22.532 24.110 2.869 496 HG2 ARG 68 HG2 ARG 68 23.502 23.873 5.154 497 HG3 ARG 68 HG1 ARG 68 24.867 23.024 4.424 498 HD2 ARG 68 HD2 ARG 68 25.647 25.197 4.553 499 HD3 ARG 68 HD1 ARG 68 25.022 25.122 2.906 500 HE ARG 68 HE ARG 68 23.114 26.062 4.860 501 HH11 ARG 68 HH11 ARG 68 25.626 26.975 2.587 502 HH12 ARG 68 HH12 ARG 68 25.141 28.639 2.522 503 HH21 ARG 68 HH21 ARG 68 22.498 28.261 4.808 504 HH22 ARG 68 HH22 ARG 68 23.366 29.376 3.791 505 H ASP 69 HN ASP 69 20.164 22.512 2.375 506 HA ASP 69 HA ASP 69 18.047 23.066 2.904 507 HB2 ASP 69 HB2 ASP 69 18.154 21.093 4.411 508 HB3 ASP 69 HB1 ASP 69 18.683 22.153 5.714 509 H ALA 70 HN ALA 70 18.004 25.191 2.608 510 HA ALA 70 HA ALA 70 17.784 26.873 4.917 511 HB1 ALA 70 HB1 ALA 70 20.223 26.938 4.555 512 HB2 ALA 70 HB2 ALA 70 19.470 28.507 4.275 513 HB3 ALA 70 HB3 ALA 70 19.950 27.503 2.907 514 H MET 71 HN MET 71 16.672 28.792 4.445 515 HA MET 71 HA MET 71 15.382 28.796 1.824 516 HB2 MET 71 HB2 MET 71 13.678 30.207 2.811 517 HB3 MET 71 HB1 MET 71 13.934 28.814 3.849 518 HG2 MET 71 HG2 MET 71 15.082 31.558 4.321 519 HG3 MET 71 HG1 MET 71 13.642 30.908 5.101 520 HE1 MET 71 HE1 MET 71 16.202 32.149 6.592 521 HE2 MET 71 HE2 MET 71 16.391 31.023 7.935 522 HE3 MET 71 HE3 MET 71 14.782 31.569 7.464 523 H VAL 72 HN VAL 72 15.569 30.476 0.398 524 HA VAL 72 HA VAL 72 17.498 32.577 1.148 525 HB VAL 72 HB VAL 72 16.781 31.679 -1.651 526 HG11 VAL 72 HG11 VAL 72 17.561 33.961 -1.580 527 HG12 VAL 72 HG12 VAL 72 18.816 32.936 -2.276 528 HG13 VAL 72 HG13 VAL 72 18.954 33.494 -0.609 529 HG21 VAL 72 HG21 VAL 72 17.902 29.879 -0.445 530 HG22 VAL 72 HG22 VAL 72 19.201 30.980 0.014 531 HG23 VAL 72 HG23 VAL 72 18.960 30.559 -1.681 532 H GLU 73 HN GLU 73 16.046 33.983 2.047 533 HA GLU 73 HA GLU 73 14.589 35.641 0.214 534 HB2 GLU 73 HB2 GLU 73 12.921 33.866 0.654 535 HB3 GLU 73 HB1 GLU 73 13.068 34.165 2.379 536 HG2 GLU 73 HG2 GLU 73 12.151 36.377 2.123 537 HG3 GLU 73 HG1 GLU 73 12.115 36.192 0.369 538 H ASP 74 HN ASP 74 15.282 37.550 0.840 539 HA ASP 74 HA ASP 74 16.103 38.067 3.550 540 HB2 ASP 74 HB2 ASP 74 15.907 39.993 1.221 541 HB3 ASP 74 HB1 ASP 74 16.772 40.264 2.730 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 -5.966 40.698 -26.450 2 H2 GLY 1 HT2 GLY 1 -4.424 40.287 -25.879 3 H3 GLY 1 HT3 GLY 1 -5.437 41.276 -24.945 4 HA2 GLY 1 HA1 GLY 1 -7.012 39.440 -24.701 5 HA3 GLY 1 HA2 GLY 1 -5.904 38.423 -25.613 6 H SER 2 HN SER 2 -5.524 40.784 -22.968 7 HA SER 2 HA SER 2 -3.482 39.251 -21.709 8 HB2 SER 2 HB2 SER 2 -5.143 41.518 -20.582 9 HB3 SER 2 HB1 SER 2 -3.602 40.939 -19.950 10 HG SER 2 HG SER 2 -2.926 42.534 -21.190 11 H HIS 3 HN HIS 3 -3.776 37.469 -20.546 12 HA HIS 3 HA HIS 3 -5.805 37.373 -18.518 13 HB2 HIS 3 HB2 HIS 3 -6.937 35.371 -19.251 14 HB3 HIS 3 HB1 HIS 3 -7.032 36.561 -20.540 15 HD1 HIS 3 HD1 HIS 3 -6.039 33.118 -19.842 16 HD2 HIS 3 HD2 HIS 3 -5.201 35.973 -22.755 17 HE1 HIS 3 HE1 HIS 3 -5.051 31.850 -21.773 18 HE2 HIS 3 HE2 HIS 3 -4.494 33.592 -23.502 19 H MET 4 HN MET 4 -5.072 36.273 -16.804 20 HA MET 4 HA MET 4 -2.757 34.494 -17.226 21 HB2 MET 4 HB2 MET 4 -2.282 36.526 -15.862 22 HB3 MET 4 HB1 MET 4 -3.498 36.002 -14.705 23 HG2 MET 4 HG2 MET 4 -1.278 35.463 -13.921 24 HG3 MET 4 HG1 MET 4 -2.190 33.992 -14.244 25 HE1 MET 4 HE1 MET 4 -0.535 36.366 -16.917 26 HE2 MET 4 HE2 MET 4 1.070 35.648 -17.066 27 HE3 MET 4 HE3 MET 4 0.591 36.433 -15.562 28 H SER 5 HN SER 5 -4.142 32.752 -17.680 29 HA SER 5 HA SER 5 -6.213 32.021 -15.824 30 HB2 SER 5 HB2 SER 5 -5.178 30.402 -18.156 31 HB3 SER 5 HB1 SER 5 -6.770 30.318 -17.399 32 HG SER 5 HG SER 5 -7.382 31.810 -18.735 33 H THR 6 HN THR 6 -5.524 31.276 -13.924 34 HA THR 6 HA THR 6 -3.422 29.219 -13.891 35 HB THR 6 HB THR 6 -4.393 30.875 -11.548 36 HG1 THR 6 HG1 THR 6 -3.012 31.736 -13.567 37 HG21 THR 6 HG21 THR 6 -1.938 29.150 -11.921 38 HG22 THR 6 HG22 THR 6 -3.348 28.735 -10.947 39 HG23 THR 6 HG23 THR 6 -2.328 30.096 -10.481 40 H ASN 7 HN ASN 7 -4.419 27.306 -14.044 41 HA ASN 7 HA ASN 7 -6.769 26.830 -12.333 42 HB2 ASN 7 HB2 ASN 7 -6.111 25.661 -15.049 43 HB3 ASN 7 HB1 ASN 7 -7.417 25.084 -14.019 44 HD21 ASN 7 HD21 ASN 7 -7.541 26.187 -16.676 45 HD22 ASN 7 HD22 ASN 7 -8.585 27.570 -16.580 46 HA PRO 8 HA PRO 8 -4.456 23.587 -10.412 47 HB2 PRO 8 HB2 PRO 8 -6.435 21.971 -9.560 48 HB3 PRO 8 HB1 PRO 8 -6.165 23.571 -8.860 49 HG2 PRO 8 HG2 PRO 8 -8.154 22.727 -10.937 50 HG3 PRO 8 HG1 PRO 8 -8.400 23.754 -9.512 51 HD2 PRO 8 HD2 PRO 8 -8.052 24.767 -12.000 52 HD3 PRO 8 HD1 PRO 8 -7.505 25.610 -10.538 53 H PHE 9 HN PHE 9 -4.677 23.301 -13.289 54 HA PHE 9 HA PHE 9 -4.737 20.357 -13.460 55 HB2 PHE 9 HB2 PHE 9 -5.359 22.243 -15.747 56 HB3 PHE 9 HB1 PHE 9 -5.506 20.489 -15.744 57 HD1 PHE 9 HD2 PHE 9 -7.184 19.494 -14.031 58 HD2 PHE 9 HD1 PHE 9 -7.201 23.546 -15.319 59 HE1 PHE 9 HE2 PHE 9 -9.535 19.699 -13.341 60 HE2 PHE 9 HE1 PHE 9 -9.552 23.762 -14.630 61 HZ PHE 9 HZ PHE 9 -10.721 21.835 -13.638 62 H ASP 10 HN ASP 10 -3.833 22.401 -16.090 63 HA ASP 10 HA ASP 10 -1.089 22.730 -15.470 64 HB2 ASP 10 HB2 ASP 10 -0.066 21.228 -17.033 65 HB3 ASP 10 HB1 ASP 10 -1.135 20.261 -16.024 66 H ASP 11 HN ASP 11 0.083 23.588 -17.485 67 HA ASP 11 HA ASP 11 -1.696 24.712 -19.478 68 HB2 ASP 11 HB2 ASP 11 -1.772 26.253 -17.456 69 HB3 ASP 11 HB1 ASP 11 -0.072 26.598 -17.754 70 H ASP 12 HN ASP 12 -0.412 26.065 -21.068 71 HA ASP 12 HA ASP 12 2.011 24.615 -21.702 72 HB2 ASP 12 HB2 ASP 12 0.402 26.691 -23.192 73 HB3 ASP 12 HB1 ASP 12 1.924 26.053 -23.804 74 H ASN 13 HN ASN 13 1.279 27.425 -20.007 75 HA ASN 13 HA ASN 13 3.706 28.853 -20.686 76 HB2 ASN 13 HB2 ASN 13 1.521 29.328 -18.668 77 HB3 ASN 13 HB1 ASN 13 2.993 30.292 -18.675 78 HD21 ASN 13 HD21 ASN 13 0.028 29.565 -20.293 79 HD22 ASN 13 HD22 ASN 13 0.087 30.883 -21.419 80 H GLY 14 HN GLY 14 3.648 26.072 -19.388 81 HA2 GLY 14 HA2 GLY 14 4.936 26.531 -16.841 82 HA3 GLY 14 HA1 GLY 14 4.674 24.981 -17.609 83 H ALA 15 HN ALA 15 6.762 27.691 -17.300 84 HA ALA 15 HA ALA 15 8.711 26.865 -19.200 85 HB1 ALA 15 HB1 ALA 15 10.174 28.531 -18.155 86 HB2 ALA 15 HB2 ALA 15 9.009 28.725 -16.843 87 HB3 ALA 15 HB3 ALA 15 8.570 29.188 -18.486 88 H PHE 16 HN PHE 16 10.930 26.254 -18.603 89 HA PHE 16 HA PHE 16 10.914 24.301 -16.399 90 HB2 PHE 16 HB2 PHE 16 12.509 23.060 -18.145 91 HB3 PHE 16 HB1 PHE 16 10.756 22.872 -18.207 92 HD1 PHE 16 HD1 PHE 16 13.483 24.993 -19.563 93 HD2 PHE 16 HD2 PHE 16 9.636 23.311 -20.205 94 HE1 PHE 16 HE1 PHE 16 13.452 25.929 -21.817 95 HE2 PHE 16 HE2 PHE 16 9.597 24.240 -22.474 96 HZ PHE 16 HZ PHE 16 11.510 25.559 -23.287 97 H PHE 17 HN PHE 17 12.842 24.032 -15.292 98 HA PHE 17 HA PHE 17 14.995 25.943 -15.951 99 HB2 PHE 17 HB2 PHE 17 13.775 25.136 -13.323 100 HB3 PHE 17 HB1 PHE 17 15.466 25.611 -13.362 101 HD1 PHE 17 HD2 PHE 17 12.683 27.070 -15.352 102 HD2 PHE 17 HD1 PHE 17 15.433 27.581 -12.148 103 HE1 PHE 17 HE2 PHE 17 12.031 29.435 -15.178 104 HE2 PHE 17 HE1 PHE 17 14.789 29.948 -11.967 105 HZ PHE 17 HZ PHE 17 13.086 30.877 -13.486 106 H VAL 18 HN VAL 18 17.164 25.249 -15.357 107 HA VAL 18 HA VAL 18 17.485 22.350 -15.591 108 HB VAL 18 HB VAL 18 19.646 24.471 -15.611 109 HG11 VAL 18 HG11 VAL 18 21.020 22.720 -16.617 110 HG12 VAL 18 HG12 VAL 18 19.676 21.582 -16.476 111 HG13 VAL 18 HG13 VAL 18 20.435 22.240 -15.023 112 HG21 VAL 18 HG21 VAL 18 18.289 23.120 -17.941 113 HG22 VAL 18 HG22 VAL 18 19.659 24.225 -18.039 114 HG23 VAL 18 HG23 VAL 18 18.096 24.805 -17.468 115 H LEU 19 HN LEU 19 17.155 21.461 -13.639 116 HA LEU 19 HA LEU 19 18.399 22.740 -11.298 117 HB2 LEU 19 HB2 LEU 19 15.884 22.581 -11.396 118 HB3 LEU 19 HB1 LEU 19 16.055 20.839 -11.346 119 HG LEU 19 HG LEU 19 17.207 21.087 -9.134 120 HD11 LEU 19 HD11 LEU 19 17.961 23.365 -9.326 121 HD12 LEU 19 HD12 LEU 19 16.884 23.213 -7.942 122 HD13 LEU 19 HD13 LEU 19 16.299 23.942 -9.433 123 HD21 LEU 19 HD21 LEU 19 15.142 21.505 -7.886 124 HD22 LEU 19 HD22 LEU 19 14.864 20.462 -9.278 125 HD23 LEU 19 HD23 LEU 19 14.397 22.161 -9.343 126 H VAL 20 HN VAL 20 19.359 21.422 -9.737 127 HA VAL 20 HA VAL 20 19.766 18.590 -10.430 128 HB VAL 20 HB VAL 20 21.872 20.493 -9.370 129 HG11 VAL 20 HG11 VAL 20 22.062 17.514 -9.836 130 HG12 VAL 20 HG12 VAL 20 22.039 18.315 -8.266 131 HG13 VAL 20 HG13 VAL 20 23.390 18.574 -9.368 132 HG21 VAL 20 HG21 VAL 20 23.090 19.893 -11.412 133 HG22 VAL 20 HG22 VAL 20 21.547 20.672 -11.766 134 HG23 VAL 20 HG23 VAL 20 21.714 18.924 -11.937 135 H ASN 21 HN ASN 21 19.279 17.258 -8.810 136 HA ASN 21 HA ASN 21 19.216 18.373 -6.089 137 HB2 ASN 21 HB2 ASN 21 17.417 16.959 -5.492 138 HB3 ASN 21 HB1 ASN 21 16.981 17.604 -7.068 139 HD21 ASN 21 HD21 ASN 21 16.915 16.229 -8.843 140 HD22 ASN 21 HD22 ASN 21 16.940 14.510 -8.668 141 H ASP 22 HN ASP 22 19.966 16.978 -4.395 142 HA ASP 22 HA ASP 22 22.486 15.944 -5.162 143 HB2 ASP 22 HB2 ASP 22 22.153 17.111 -3.044 144 HB3 ASP 22 HB1 ASP 22 21.080 15.829 -2.487 145 H GLU 23 HN GLU 23 19.441 14.395 -4.843 146 HA GLU 23 HA GLU 23 20.720 11.797 -4.404 147 HB2 GLU 23 HB2 GLU 23 17.820 12.608 -4.219 148 HB3 GLU 23 HB1 GLU 23 18.437 10.987 -3.914 149 HG2 GLU 23 HG2 GLU 23 19.854 11.907 -2.116 150 HG3 GLU 23 HG1 GLU 23 19.109 13.482 -2.380 151 H ASP 24 HN ASP 24 20.302 13.519 -6.965 152 HA ASP 24 HA ASP 24 19.882 11.163 -8.650 153 HB2 ASP 24 HB2 ASP 24 17.756 12.681 -8.472 154 HB3 ASP 24 HB1 ASP 24 18.672 13.803 -9.469 155 H GLN 25 HN GLN 25 20.211 12.532 -11.108 156 HA GLN 25 HA GLN 25 22.986 13.460 -10.795 157 HB2 GLN 25 HB2 GLN 25 21.531 12.604 -13.304 158 HB3 GLN 25 HB1 GLN 25 23.249 12.943 -13.159 159 HG2 GLN 25 HG2 GLN 25 23.550 11.025 -11.732 160 HG3 GLN 25 HG1 GLN 25 21.815 10.713 -11.734 161 HE21 GLN 25 HE21 GLN 25 23.562 11.764 -14.563 162 HE22 GLN 25 HE22 GLN 25 23.422 10.281 -15.441 163 H HIS 26 HN HIS 26 20.039 14.166 -12.617 164 HA HIS 26 HA HIS 26 20.375 17.012 -12.286 165 HB2 HIS 26 HB2 HIS 26 20.653 15.693 -14.989 166 HB3 HIS 26 HB1 HIS 26 20.033 17.331 -14.845 167 HD1 HIS 26 HD1 HIS 26 21.716 19.188 -14.325 168 HD2 HIS 26 HD2 HIS 26 23.411 15.399 -14.452 169 HE1 HIS 26 HE1 HIS 26 24.198 19.561 -14.360 170 HE2 HIS 26 HE2 HIS 26 25.202 17.258 -14.215 171 H SER 27 HN SER 27 18.424 18.168 -13.187 172 HA SER 27 HA SER 27 16.142 16.431 -13.691 173 HB2 SER 27 HB2 SER 27 16.169 18.401 -11.391 174 HB3 SER 27 HB1 SER 27 14.815 17.384 -11.878 175 HG SER 27 HG SER 27 16.750 15.710 -11.556 176 H LEU 28 HN LEU 28 14.954 17.302 -15.283 177 HA LEU 28 HA LEU 28 15.056 20.158 -15.794 178 HB2 LEU 28 HB2 LEU 28 14.240 17.793 -17.275 179 HB3 LEU 28 HB1 LEU 28 13.027 19.055 -17.364 180 HG LEU 28 HG LEU 28 14.607 19.145 -19.255 181 HD11 LEU 28 HD11 LEU 28 13.492 21.178 -18.503 182 HD12 LEU 28 HD12 LEU 28 15.110 21.526 -19.109 183 HD13 LEU 28 HD13 LEU 28 14.810 21.491 -17.372 184 HD21 LEU 28 HD21 LEU 28 16.917 19.877 -18.858 185 HD22 LEU 28 HD22 LEU 28 16.597 18.294 -18.152 186 HD23 LEU 28 HD23 LEU 28 16.659 19.723 -17.120 187 H TRP 29 HN TRP 29 14.002 21.309 -14.311 188 HA TRP 29 HA TRP 29 11.550 20.173 -13.148 189 HB2 TRP 29 HB2 TRP 29 13.534 20.507 -11.653 190 HB3 TRP 29 HB1 TRP 29 13.417 22.235 -11.961 191 HD1 TRP 29 HD1 TRP 29 11.944 23.572 -10.350 192 HE1 TRP 29 HE1 TRP 29 10.227 22.988 -8.524 193 HE3 TRP 29 HE3 TRP 29 11.642 18.527 -11.108 194 HZ2 TRP 29 HZ2 TRP 29 8.927 20.691 -7.536 195 HZ3 TRP 29 HZ3 TRP 29 10.139 17.204 -9.676 196 HH2 TRP 29 HH2 TRP 29 8.809 18.269 -7.926 197 HA PRO 30 HA PRO 30 9.439 23.562 -15.155 198 HB2 PRO 30 HB2 PRO 30 7.009 23.112 -14.002 199 HB3 PRO 30 HB1 PRO 30 7.622 22.179 -15.371 200 HG2 PRO 30 HG2 PRO 30 7.606 21.487 -12.460 201 HG3 PRO 30 HG1 PRO 30 7.253 20.455 -13.859 202 HD2 PRO 30 HD2 PRO 30 9.634 20.392 -12.570 203 HD3 PRO 30 HD1 PRO 30 9.485 20.092 -14.313 204 H VAL 31 HN VAL 31 9.220 25.642 -14.592 205 HA VAL 31 HA VAL 31 9.920 26.487 -11.969 206 HB VAL 31 HB VAL 31 10.418 27.756 -14.073 207 HG11 VAL 31 HG11 VAL 31 8.286 27.558 -15.181 208 HG12 VAL 31 HG12 VAL 31 8.694 29.261 -14.962 209 HG13 VAL 31 HG13 VAL 31 7.506 28.493 -13.906 210 HG21 VAL 31 HG21 VAL 31 10.089 29.982 -13.092 211 HG22 VAL 31 HG22 VAL 31 10.678 28.821 -11.904 212 HG23 VAL 31 HG23 VAL 31 8.979 29.289 -11.909 213 H PHE 32 HN PHE 32 6.944 25.642 -13.393 214 HA PHE 32 HA PHE 32 5.241 27.216 -11.726 215 HB2 PHE 32 HB2 PHE 32 4.524 26.285 -13.911 216 HB3 PHE 32 HB1 PHE 32 4.624 24.665 -13.232 217 HD1 PHE 32 HD2 PHE 32 2.901 27.928 -12.828 218 HD2 PHE 32 HD1 PHE 32 2.783 23.730 -12.143 219 HE1 PHE 32 HE2 PHE 32 0.567 28.118 -12.065 220 HE2 PHE 32 HE1 PHE 32 0.452 23.916 -11.382 221 HZ PHE 32 HZ PHE 32 -0.659 26.110 -11.342 222 H ALA 33 HN ALA 33 7.161 24.484 -11.191 223 HA ALA 33 HA ALA 33 5.506 23.570 -8.942 224 HB1 ALA 33 HB1 ALA 33 6.844 21.542 -8.980 225 HB2 ALA 33 HB2 ALA 33 7.878 22.225 -10.237 226 HB3 ALA 33 HB3 ALA 33 6.187 21.866 -10.586 227 H ASP 34 HN ASP 34 6.268 23.618 -6.884 228 HA ASP 34 HA ASP 34 8.285 25.481 -6.218 229 HB2 ASP 34 HB2 ASP 34 6.429 25.132 -4.717 230 HB3 ASP 34 HB1 ASP 34 6.831 23.425 -4.546 231 H ILE 35 HN ILE 35 10.379 25.236 -5.719 232 HA ILE 35 HA ILE 35 11.668 22.744 -6.391 233 HB ILE 35 HB ILE 35 12.934 25.251 -5.268 234 HG12 ILE 35 HG12 ILE 35 12.521 24.470 -8.171 235 HG13 ILE 35 HG11 ILE 35 11.615 25.722 -7.327 236 HG21 ILE 35 HG21 ILE 35 14.052 22.951 -6.865 237 HG22 ILE 35 HG22 ILE 35 14.350 23.286 -5.160 238 HG23 ILE 35 HG23 ILE 35 14.946 24.397 -6.394 239 HD11 ILE 35 HD11 ILE 35 13.715 26.959 -6.983 240 HD12 ILE 35 HD12 ILE 35 13.329 26.715 -8.687 241 HD13 ILE 35 HD13 ILE 35 14.567 25.725 -7.912 242 HA PRO 36 HA PRO 36 11.174 21.240 -2.268 243 HB2 PRO 36 HB2 PRO 36 12.604 18.943 -2.510 244 HB3 PRO 36 HB1 PRO 36 10.984 19.166 -3.186 245 HG2 PRO 36 HG2 PRO 36 13.647 19.358 -4.543 246 HG3 PRO 36 HG1 PRO 36 12.149 18.601 -5.117 247 HD2 PRO 36 HD2 PRO 36 12.961 21.055 -5.939 248 HD3 PRO 36 HD1 PRO 36 11.249 20.609 -5.792 249 H ALA 37 HN ALA 37 14.255 19.653 -2.567 250 HA ALA 37 HA ALA 37 15.612 21.657 -0.958 251 HB1 ALA 37 HB1 ALA 37 16.015 20.091 0.896 252 HB2 ALA 37 HB2 ALA 37 14.926 18.933 0.127 253 HB3 ALA 37 HB3 ALA 37 14.306 20.480 0.701 254 H GLY 38 HN GLY 38 17.885 21.090 -0.528 255 HA2 GLY 38 HA2 GLY 38 19.939 20.275 -1.187 256 HA3 GLY 38 HA1 GLY 38 19.110 18.803 -1.684 257 H TRP 39 HN TRP 39 18.395 22.004 -2.885 258 HA TRP 39 HA TRP 39 18.714 20.919 -5.567 259 HB2 TRP 39 HB2 TRP 39 17.335 22.964 -6.193 260 HB3 TRP 39 HB1 TRP 39 16.534 21.730 -5.229 261 HD1 TRP 39 HD1 TRP 39 15.875 22.362 -2.721 262 HE1 TRP 39 HE1 TRP 39 15.627 24.627 -1.513 263 HE3 TRP 39 HE3 TRP 39 18.317 25.354 -6.085 264 HZ2 TRP 39 HZ2 TRP 39 16.362 27.311 -1.937 265 HZ3 TRP 39 HZ3 TRP 39 18.497 27.757 -5.604 266 HH2 TRP 39 HH2 TRP 39 17.540 28.717 -3.572 267 H ARG 40 HN ARG 40 19.987 21.702 -7.068 268 HA ARG 40 HA ARG 40 21.446 24.216 -6.576 269 HB2 ARG 40 HB2 ARG 40 22.420 21.557 -7.496 270 HB3 ARG 40 HB1 ARG 40 23.105 22.971 -8.279 271 HG2 ARG 40 HG2 ARG 40 24.522 22.260 -6.468 272 HG3 ARG 40 HG1 ARG 40 23.811 23.827 -6.095 273 HD2 ARG 40 HD2 ARG 40 22.230 22.818 -4.601 274 HD3 ARG 40 HD1 ARG 40 22.744 21.200 -5.084 275 HE ARG 40 HE ARG 40 24.764 21.507 -3.896 276 HH11 ARG 40 HH11 ARG 40 22.527 24.173 -3.505 277 HH12 ARG 40 HH12 ARG 40 23.342 24.826 -2.119 278 HH21 ARG 40 HH21 ARG 40 25.842 22.345 -2.086 279 HH22 ARG 40 HH22 ARG 40 25.251 23.788 -1.313 280 H VAL 41 HN VAL 41 20.695 25.709 -7.967 281 HA VAL 41 HA VAL 41 19.439 24.896 -10.448 282 HB VAL 41 HB VAL 41 19.911 27.671 -9.335 283 HG11 VAL 41 HG11 VAL 41 19.739 27.675 -11.782 284 HG12 VAL 41 HG12 VAL 41 18.328 28.427 -11.038 285 HG13 VAL 41 HG13 VAL 41 18.218 26.787 -11.675 286 HG21 VAL 41 HG21 VAL 41 17.394 26.007 -9.446 287 HG22 VAL 41 HG22 VAL 41 17.536 27.641 -8.793 288 HG23 VAL 41 HG23 VAL 41 18.359 26.296 -7.999 289 H VAL 42 HN VAL 42 20.655 24.414 -12.129 290 HA VAL 42 HA VAL 42 23.328 25.469 -12.434 291 HB VAL 42 HB VAL 42 21.751 23.802 -14.412 292 HG11 VAL 42 HG11 VAL 42 23.703 24.900 -15.377 293 HG12 VAL 42 HG12 VAL 42 23.953 23.157 -15.264 294 HG13 VAL 42 HG13 VAL 42 24.722 24.236 -14.098 295 HG21 VAL 42 HG21 VAL 42 23.576 22.911 -12.182 296 HG22 VAL 42 HG22 VAL 42 22.922 21.863 -13.441 297 HG23 VAL 42 HG23 VAL 42 21.836 22.641 -12.290 298 H HIS 43 HN HIS 43 20.179 25.832 -13.948 299 HA HIS 43 HA HIS 43 20.839 28.464 -14.895 300 HB2 HIS 43 HB2 HIS 43 20.582 26.169 -16.797 301 HB3 HIS 43 HB1 HIS 43 19.911 27.725 -17.265 302 HD1 HIS 43 HD1 HIS 43 21.837 29.770 -16.823 303 HD2 HIS 43 HD2 HIS 43 23.111 25.899 -17.670 304 HE1 HIS 43 HE1 HIS 43 24.196 29.998 -17.674 305 HE2 HIS 43 HE2 HIS 43 24.946 27.650 -18.206 306 H GLY 44 HN GLY 44 18.944 29.618 -15.632 307 HA2 GLY 44 HA2 GLY 44 16.540 28.733 -14.310 308 HA3 GLY 44 HA1 GLY 44 16.745 30.227 -15.215 309 H GLU 45 HN GLU 45 14.952 30.147 -16.503 310 HA GLU 45 HA GLU 45 14.364 27.737 -17.941 311 HB2 GLU 45 HB2 GLU 45 12.633 29.196 -19.131 312 HB3 GLU 45 HB1 GLU 45 12.407 28.887 -17.419 313 HG2 GLU 45 HG2 GLU 45 11.963 31.089 -17.416 314 HG3 GLU 45 HG1 GLU 45 13.707 31.197 -17.244 315 H ALA 46 HN ALA 46 15.893 27.170 -19.225 316 HA ALA 46 HA ALA 46 16.789 29.020 -21.333 317 HB1 ALA 46 HB1 ALA 46 18.135 26.538 -20.254 318 HB2 ALA 46 HB2 ALA 46 18.607 28.204 -19.918 319 HB3 ALA 46 HB3 ALA 46 18.753 27.558 -21.553 320 H SER 47 HN SER 47 17.303 27.818 -23.434 321 HA SER 47 HA SER 47 15.005 26.888 -24.579 322 HB2 SER 47 HB2 SER 47 17.767 25.979 -25.402 323 HB3 SER 47 HB1 SER 47 16.343 26.146 -26.432 324 HG SER 47 HG SER 47 18.180 27.963 -25.919 325 H ARG 48 HN ARG 48 13.853 25.085 -24.610 326 HA ARG 48 HA ARG 48 14.114 23.074 -22.736 327 HB2 ARG 48 HB2 ARG 48 12.002 23.517 -23.749 328 HB3 ARG 48 HB1 ARG 48 12.627 23.167 -25.363 329 HG2 ARG 48 HG2 ARG 48 11.406 21.291 -24.908 330 HG3 ARG 48 HG1 ARG 48 13.012 20.787 -24.385 331 HD2 ARG 48 HD2 ARG 48 12.458 20.860 -22.162 332 HD3 ARG 48 HD1 ARG 48 11.195 22.070 -22.407 333 HE ARG 48 HE ARG 48 10.613 19.542 -23.657 334 HH11 ARG 48 HH11 ARG 48 10.450 21.304 -20.631 335 HH12 ARG 48 HH12 ARG 48 9.064 20.432 -20.044 336 HH21 ARG 48 HH21 ARG 48 8.778 18.425 -22.914 337 HH22 ARG 48 HH22 ARG 48 8.085 18.817 -21.369 338 H ALA 49 HN ALA 49 14.883 22.851 -26.215 339 HA ALA 49 HA ALA 49 15.790 20.208 -26.203 340 HB1 ALA 49 HB1 ALA 49 15.285 21.448 -28.253 341 HB2 ALA 49 HB2 ALA 49 16.896 20.733 -28.307 342 HB3 ALA 49 HB3 ALA 49 16.706 22.457 -27.989 343 H ALA 50 HN ALA 50 17.590 23.230 -25.759 344 HA ALA 50 HA ALA 50 20.150 22.110 -25.544 345 HB1 ALA 50 HB1 ALA 50 19.761 24.503 -25.879 346 HB2 ALA 50 HB2 ALA 50 20.806 24.202 -24.490 347 HB3 ALA 50 HB3 ALA 50 19.112 24.625 -24.242 348 H CYS 51 HN CYS 51 17.682 22.726 -23.078 349 HA CYS 51 HA CYS 51 19.230 22.030 -20.834 350 HB2 CYS 51 HB2 CYS 51 16.244 21.754 -21.235 351 HB3 CYS 51 HB1 CYS 51 17.074 21.701 -19.684 352 HG CYS 51 HG CYS 51 16.675 24.396 -21.744 353 H LEU 52 HN LEU 52 16.952 20.063 -22.756 354 HA LEU 52 HA LEU 52 17.436 17.628 -21.449 355 HB2 LEU 52 HB2 LEU 52 16.399 18.387 -24.141 356 HB3 LEU 52 HB1 LEU 52 16.837 16.713 -23.865 357 HG LEU 52 HG LEU 52 15.243 16.617 -21.977 358 HD11 LEU 52 HD11 LEU 52 14.455 19.389 -22.859 359 HD12 LEU 52 HD12 LEU 52 15.273 18.980 -21.351 360 HD13 LEU 52 HD13 LEU 52 13.630 18.409 -21.647 361 HD21 LEU 52 HD21 LEU 52 14.528 15.879 -24.163 362 HD22 LEU 52 HD22 LEU 52 14.104 17.530 -24.615 363 HD23 LEU 52 HD23 LEU 52 13.196 16.701 -23.350 364 H ASP 53 HN ASP 53 18.981 19.022 -24.333 365 HA ASP 53 HA ASP 53 20.757 16.959 -24.916 366 HB2 ASP 53 HB2 ASP 53 20.381 18.914 -26.369 367 HB3 ASP 53 HB1 ASP 53 21.189 19.944 -25.194 368 H TYR 54 HN TYR 54 21.085 19.671 -22.694 369 HA TYR 54 HA TYR 54 23.737 19.257 -21.890 370 HB2 TYR 54 HB2 TYR 54 22.427 21.318 -21.471 371 HB3 TYR 54 HB1 TYR 54 21.455 20.446 -20.298 372 HD1 TYR 54 HD1 TYR 54 24.979 21.412 -21.022 373 HD2 TYR 54 HD2 TYR 54 22.082 20.458 -18.053 374 HE1 TYR 54 HE1 TYR 54 26.579 22.040 -19.265 375 HE2 TYR 54 HE2 TYR 54 23.679 21.074 -16.287 376 HH TYR 54 HH TYR 54 26.412 22.868 -16.841 377 H VAL 55 HN VAL 55 20.696 18.174 -20.351 378 HA VAL 55 HA VAL 55 22.093 16.833 -18.257 379 HB VAL 55 HB VAL 55 19.936 15.897 -17.587 380 HG11 VAL 55 HG11 VAL 55 19.803 18.816 -18.326 381 HG12 VAL 55 HG12 VAL 55 20.528 18.140 -16.866 382 HG13 VAL 55 HG13 VAL 55 18.787 18.010 -17.129 383 HG21 VAL 55 HG21 VAL 55 18.859 17.196 -20.086 384 HG22 VAL 55 HG22 VAL 55 17.882 16.494 -18.796 385 HG23 VAL 55 HG23 VAL 55 18.942 15.465 -19.760 386 H GLU 56 HN GLU 56 20.792 15.788 -21.360 387 HA GLU 56 HA GLU 56 21.101 13.005 -20.822 388 HB2 GLU 56 HB2 GLU 56 20.808 14.501 -23.425 389 HB3 GLU 56 HB1 GLU 56 20.819 12.747 -23.290 390 HG2 GLU 56 HG2 GLU 56 18.866 12.897 -21.776 391 HG3 GLU 56 HG1 GLU 56 18.830 14.636 -22.055 392 H LYS 57 HN LYS 57 23.191 15.476 -22.249 393 HA LYS 57 HA LYS 57 25.295 13.760 -23.022 394 HB2 LYS 57 HB2 LYS 57 25.167 16.640 -22.215 395 HB3 LYS 57 HB1 LYS 57 26.733 15.865 -22.392 396 HG2 LYS 57 HG2 LYS 57 26.140 15.259 -24.705 397 HG3 LYS 57 HG1 LYS 57 24.618 16.133 -24.516 398 HD2 LYS 57 HD2 LYS 57 25.750 18.205 -24.221 399 HD3 LYS 57 HD1 LYS 57 27.315 17.401 -24.084 400 HE2 LYS 57 HE2 LYS 57 27.025 18.449 -26.275 401 HE3 LYS 57 HE1 LYS 57 27.180 16.698 -26.404 402 HZ1 LYS 57 HZ1 LYS 57 25.428 17.559 -27.829 403 HZ2 LYS 57 HZ2 LYS 57 24.620 18.211 -26.486 404 HZ3 LYS 57 HZ3 LYS 57 24.789 16.535 -26.644 405 H ASN 58 HN ASN 58 24.235 14.911 -19.932 406 HA ASN 58 HA ASN 58 26.616 13.924 -18.574 407 HB2 ASN 58 HB2 ASN 58 24.160 15.399 -17.641 408 HB3 ASN 58 HB1 ASN 58 25.284 14.672 -16.499 409 HD21 ASN 58 HD21 ASN 58 26.334 16.061 -19.525 410 HD22 ASN 58 HD22 ASN 58 27.141 17.424 -18.840 411 H TRP 59 HN TRP 59 24.345 12.355 -19.989 412 HA TRP 59 HA TRP 59 23.486 10.270 -19.843 413 HB2 TRP 59 HB2 TRP 59 25.380 10.029 -17.502 414 HB3 TRP 59 HB1 TRP 59 24.523 8.683 -18.242 415 HD1 TRP 59 HD1 TRP 59 25.168 8.245 -20.937 416 HE1 TRP 59 HE1 TRP 59 27.473 8.430 -22.075 417 HE3 TRP 59 HE3 TRP 59 27.539 11.178 -17.483 418 HZ2 TRP 59 HZ2 TRP 59 29.958 9.663 -21.570 419 HZ3 TRP 59 HZ3 TRP 59 29.882 11.813 -17.885 420 HH2 TRP 59 HH2 TRP 59 31.067 11.069 -19.887 421 H THR 60 HN THR 60 22.186 12.472 -18.407 422 HA THR 60 HA THR 60 21.034 11.107 -16.093 423 HB THR 60 HB THR 60 20.436 13.899 -17.080 424 HG1 THR 60 HG1 THR 60 22.715 13.192 -16.293 425 HG21 THR 60 HG21 THR 60 20.029 12.581 -14.393 426 HG22 THR 60 HG22 THR 60 18.760 12.918 -15.572 427 HG23 THR 60 HG23 THR 60 19.630 14.247 -14.803 428 H ASP 61 HN ASP 61 19.733 9.560 -16.945 429 HA ASP 61 HA ASP 61 17.920 8.589 -17.917 430 HB2 ASP 61 HB2 ASP 61 16.946 10.325 -16.244 431 HB3 ASP 61 HB1 ASP 61 16.501 11.235 -17.682 432 H LEU 62 HN LEU 62 19.745 9.403 -19.759 433 HA LEU 62 HA LEU 62 18.750 11.088 -21.782 434 HB2 LEU 62 HB2 LEU 62 20.529 10.264 -23.181 435 HB3 LEU 62 HB1 LEU 62 21.138 10.544 -21.564 436 HG LEU 62 HG LEU 62 20.375 7.801 -22.560 437 HD11 LEU 62 HD11 LEU 62 23.085 9.124 -22.603 438 HD12 LEU 62 HD12 LEU 62 22.111 8.708 -24.013 439 HD13 LEU 62 HD13 LEU 62 22.754 7.434 -22.978 440 HD21 LEU 62 HD21 LEU 62 22.159 8.694 -20.294 441 HD22 LEU 62 HD22 LEU 62 21.785 7.029 -20.735 442 HD23 LEU 62 HD23 LEU 62 20.514 8.084 -20.119 443 H ARG 63 HN ARG 63 17.493 10.754 -23.509 444 HA ARG 63 HA ARG 63 16.383 8.039 -23.825 445 HB2 ARG 63 HB2 ARG 63 14.939 10.681 -24.095 446 HB3 ARG 63 HB1 ARG 63 14.231 9.100 -24.400 447 HG2 ARG 63 HG2 ARG 63 15.303 10.064 -21.760 448 HG3 ARG 63 HG1 ARG 63 13.599 9.980 -22.212 449 HD2 ARG 63 HD2 ARG 63 13.710 7.594 -22.398 450 HD3 ARG 63 HD1 ARG 63 15.457 7.611 -22.161 451 HE ARG 63 HE ARG 63 14.650 8.731 -19.890 452 HH11 ARG 63 HH11 ARG 63 13.301 5.990 -21.601 453 HH12 ARG 63 HH12 ARG 63 12.877 5.122 -20.153 454 HH21 ARG 63 HH21 ARG 63 14.099 7.622 -17.988 455 HH22 ARG 63 HH22 ARG 63 13.322 6.069 -18.089 456 HA PRO 64 HA PRO 64 17.920 8.737 -27.983 457 HB2 PRO 64 HB2 PRO 64 17.323 6.222 -28.863 458 HB3 PRO 64 HB1 PRO 64 18.798 6.630 -27.983 459 HG2 PRO 64 HG2 PRO 64 16.288 5.362 -26.994 460 HG3 PRO 64 HG1 PRO 64 17.969 5.014 -26.557 461 HD2 PRO 64 HD2 PRO 64 16.291 6.481 -24.997 462 HD3 PRO 64 HD1 PRO 64 18.050 6.720 -25.022 463 H LYS 65 HN LYS 65 16.189 10.222 -28.312 464 HA LYS 65 HA LYS 65 13.685 9.137 -29.349 465 HB2 LYS 65 HB2 LYS 65 13.151 11.680 -29.478 466 HB3 LYS 65 HB1 LYS 65 13.214 10.895 -27.905 467 HG2 LYS 65 HG2 LYS 65 15.527 11.712 -27.628 468 HG3 LYS 65 HG1 LYS 65 15.382 12.561 -29.168 469 HD2 LYS 65 HD2 LYS 65 13.678 13.985 -28.315 470 HD3 LYS 65 HD1 LYS 65 13.507 13.006 -26.857 471 HE2 LYS 65 HE2 LYS 65 15.964 14.574 -27.624 472 HE3 LYS 65 HE1 LYS 65 14.747 15.100 -26.462 473 HZ1 LYS 65 HZ1 LYS 65 15.284 13.248 -25.054 474 HZ2 LYS 65 HZ2 LYS 65 16.717 14.082 -25.413 475 HZ3 LYS 65 HZ3 LYS 65 16.366 12.623 -26.196 476 H SER 66 HN SER 66 16.668 9.926 -30.498 477 HA SER 66 HA SER 66 15.852 9.650 -33.201 478 HB2 SER 66 HB2 SER 66 15.359 12.077 -32.885 479 HB3 SER 66 HB1 SER 66 17.039 12.333 -32.416 480 HG SER 66 HG SER 66 16.160 12.535 -34.796 481 H LEU 67 HN LEU 67 17.720 9.458 -34.614 482 HA LEU 67 HA LEU 67 20.202 8.900 -33.126 483 HB2 LEU 67 HB2 LEU 67 18.955 6.987 -34.296 484 HB3 LEU 67 HB1 LEU 67 19.432 7.739 -35.804 485 HG LEU 67 HG LEU 67 20.845 5.795 -35.024 486 HD11 LEU 67 HD11 LEU 67 22.965 6.816 -35.671 487 HD12 LEU 67 HD12 LEU 67 22.258 8.420 -35.463 488 HD13 LEU 67 HD13 LEU 67 21.647 7.343 -36.719 489 HD21 LEU 67 HD21 LEU 67 20.900 6.354 -32.649 490 HD22 LEU 67 HD22 LEU 67 21.814 7.817 -33.009 491 HD23 LEU 67 HD23 LEU 67 22.528 6.236 -33.315 492 H ARG 68 HN ARG 68 18.832 10.186 -36.123 493 HA ARG 68 HA ARG 68 21.260 11.821 -36.420 494 HB2 ARG 68 HB2 ARG 68 21.104 9.985 -38.131 495 HB3 ARG 68 HB1 ARG 68 19.617 10.727 -38.708 496 HG2 ARG 68 HG2 ARG 68 20.869 12.778 -39.235 497 HG3 ARG 68 HG1 ARG 68 22.354 11.987 -38.707 498 HD2 ARG 68 HD2 ARG 68 22.271 11.831 -41.081 499 HD3 ARG 68 HD1 ARG 68 21.931 10.228 -40.432 500 HE ARG 68 HE ARG 68 19.539 11.719 -40.921 501 HH11 ARG 68 HH11 ARG 68 21.999 9.734 -42.462 502 HH12 ARG 68 HH12 ARG 68 20.978 9.323 -43.807 503 HH21 ARG 68 HH21 ARG 68 18.213 11.145 -42.670 504 HH22 ARG 68 HH22 ARG 68 18.832 10.118 -43.926 505 H ASP 69 HN ASP 69 20.387 13.632 -35.474 506 HA ASP 69 HA ASP 69 18.018 14.785 -36.789 507 HB2 ASP 69 HB2 ASP 69 17.844 14.496 -34.324 508 HB3 ASP 69 HB1 ASP 69 19.252 15.536 -34.125 509 H ALA 70 HN ALA 70 18.112 16.977 -37.467 510 HA ALA 70 HA ALA 70 20.685 17.540 -38.608 511 HB1 ALA 70 HB1 ALA 70 18.101 19.057 -38.883 512 HB2 ALA 70 HB2 ALA 70 18.649 17.755 -39.940 513 HB3 ALA 70 HB3 ALA 70 19.549 19.270 -39.869 514 H MET 71 HN MET 71 21.972 18.152 -36.850 515 HA MET 71 HA MET 71 21.417 20.868 -35.870 516 HB2 MET 71 HB2 MET 71 23.438 18.813 -34.948 517 HB3 MET 71 HB1 MET 71 23.381 20.464 -34.349 518 HG2 MET 71 HG2 MET 71 21.095 20.062 -33.532 519 HG3 MET 71 HG1 MET 71 21.220 18.390 -34.075 520 HE1 MET 71 HE1 MET 71 20.474 19.340 -31.067 521 HE2 MET 71 HE2 MET 71 21.375 18.132 -30.151 522 HE3 MET 71 HE3 MET 71 20.497 17.662 -31.607 523 H VAL 72 HN VAL 72 21.775 21.403 -38.185 524 HA VAL 72 HA VAL 72 24.549 21.204 -39.086 525 HB VAL 72 HB VAL 72 22.631 20.513 -40.574 526 HG11 VAL 72 HG11 VAL 72 21.058 22.269 -40.032 527 HG12 VAL 72 HG12 VAL 72 21.404 22.268 -41.762 528 HG13 VAL 72 HG13 VAL 72 22.140 23.483 -40.716 529 HG21 VAL 72 HG21 VAL 72 23.581 21.502 -42.604 530 HG22 VAL 72 HG22 VAL 72 24.836 20.962 -41.488 531 HG23 VAL 72 HG23 VAL 72 24.451 22.677 -41.617 532 H GLU 73 HN GLU 73 22.556 23.328 -37.485 533 HA GLU 73 HA GLU 73 22.878 25.417 -36.674 534 HB2 GLU 73 HB2 GLU 73 25.558 25.289 -38.063 535 HB3 GLU 73 HB1 GLU 73 25.081 26.461 -36.843 536 HG2 GLU 73 HG2 GLU 73 25.329 23.492 -36.422 537 HG3 GLU 73 HG1 GLU 73 26.496 24.708 -35.906 538 H ASP 74 HN ASP 74 21.900 24.806 -39.459 539 HA ASP 74 HA ASP 74 20.933 25.918 -41.168 540 HB2 ASP 74 HB2 ASP 74 20.082 27.377 -39.349 541 HB3 ASP 74 HB1 ASP 74 21.482 28.422 -39.574 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 23.534 36.217 -27.678 2 H2 GLY 1 HT2 GLY 1 25.117 36.501 -28.211 3 H3 GLY 1 HT3 GLY 1 23.924 36.009 -29.314 4 HA2 GLY 1 HA1 GLY 1 23.888 38.567 -27.816 5 HA3 GLY 1 HA2 GLY 1 24.443 38.390 -29.475 6 H SER 2 HN SER 2 21.839 39.145 -27.556 7 HA SER 2 HA SER 2 19.962 38.543 -29.745 8 HB2 SER 2 HB2 SER 2 19.429 37.495 -27.527 9 HB3 SER 2 HB1 SER 2 19.278 39.114 -26.849 10 HG SER 2 HG SER 2 17.451 37.700 -28.165 11 H HIS 3 HN HIS 3 18.368 40.181 -30.208 12 HA HIS 3 HA HIS 3 18.827 42.859 -29.225 13 HB2 HIS 3 HB2 HIS 3 19.217 43.837 -31.468 14 HB3 HIS 3 HB1 HIS 3 20.520 42.765 -30.978 15 HD1 HIS 3 HD1 HIS 3 18.270 43.462 -33.729 16 HD2 HIS 3 HD2 HIS 3 20.322 40.128 -32.309 17 HE1 HIS 3 HE1 HIS 3 18.329 41.830 -35.642 18 HE2 HIS 3 HE2 HIS 3 19.402 39.756 -34.704 19 H MET 4 HN MET 4 16.692 41.484 -28.718 20 HA MET 4 HA MET 4 14.515 40.938 -29.100 21 HB2 MET 4 HB2 MET 4 13.066 42.925 -29.460 22 HB3 MET 4 HB1 MET 4 14.254 43.126 -28.185 23 HG2 MET 4 HG2 MET 4 15.649 44.433 -29.748 24 HG3 MET 4 HG1 MET 4 14.372 44.287 -30.957 25 HE1 MET 4 HE1 MET 4 14.516 47.011 -31.085 26 HE2 MET 4 HE2 MET 4 15.692 47.035 -29.771 27 HE3 MET 4 HE3 MET 4 14.251 48.050 -29.686 28 H SER 5 HN SER 5 15.899 39.999 -31.167 29 HA SER 5 HA SER 5 14.588 40.683 -33.645 30 HB2 SER 5 HB2 SER 5 15.944 38.460 -34.257 31 HB3 SER 5 HB1 SER 5 16.749 40.025 -34.103 32 HG SER 5 HG SER 5 17.176 37.806 -32.692 33 H THR 6 HN THR 6 14.402 38.277 -31.132 34 HA THR 6 HA THR 6 12.614 36.517 -32.470 35 HB THR 6 HB THR 6 12.964 36.838 -29.485 36 HG1 THR 6 HG1 THR 6 14.443 34.842 -30.362 37 HG21 THR 6 HG21 THR 6 11.108 35.410 -30.171 38 HG22 THR 6 HG22 THR 6 12.398 34.452 -29.447 39 HG23 THR 6 HG23 THR 6 12.193 34.475 -31.199 40 H ASN 7 HN ASN 7 10.527 36.904 -32.902 41 HA ASN 7 HA ASN 7 9.128 39.152 -31.956 42 HB2 ASN 7 HB2 ASN 7 7.138 38.154 -32.991 43 HB3 ASN 7 HB1 ASN 7 8.530 38.047 -34.061 44 HD21 ASN 7 HD21 ASN 7 9.464 36.032 -34.458 45 HD22 ASN 7 HD22 ASN 7 8.612 34.557 -34.134 46 HA PRO 8 HA PRO 8 8.144 37.714 -27.922 47 HB2 PRO 8 HB2 PRO 8 6.651 39.784 -27.121 48 HB3 PRO 8 HB1 PRO 8 8.383 39.956 -27.426 49 HG2 PRO 8 HG2 PRO 8 6.069 40.699 -29.178 50 HG3 PRO 8 HG1 PRO 8 7.552 41.611 -28.835 51 HD2 PRO 8 HD2 PRO 8 7.169 40.110 -31.092 52 HD3 PRO 8 HD1 PRO 8 8.762 40.454 -30.394 53 H PHE 9 HN PHE 9 6.385 36.790 -30.174 54 HA PHE 9 HA PHE 9 3.751 36.854 -28.919 55 HB2 PHE 9 HB2 PHE 9 4.616 35.663 -31.565 56 HB3 PHE 9 HB1 PHE 9 2.960 35.753 -30.975 57 HD1 PHE 9 HD1 PHE 9 2.261 38.219 -30.228 58 HD2 PHE 9 HD2 PHE 9 5.263 37.258 -33.078 59 HE1 PHE 9 HE1 PHE 9 1.997 40.443 -31.244 60 HE2 PHE 9 HE2 PHE 9 5.010 39.480 -34.105 61 HZ PHE 9 HZ PHE 9 3.376 41.078 -33.183 62 H ASP 10 HN ASP 10 4.435 35.602 -27.087 63 HA ASP 10 HA ASP 10 4.854 32.756 -27.636 64 HB2 ASP 10 HB2 ASP 10 5.354 32.505 -25.268 65 HB3 ASP 10 HB1 ASP 10 6.319 33.820 -25.926 66 H ASP 11 HN ASP 11 3.515 31.188 -26.512 67 HA ASP 11 HA ASP 11 0.869 32.216 -25.764 68 HB2 ASP 11 HB2 ASP 11 0.873 31.407 -28.148 69 HB3 ASP 11 HB1 ASP 11 1.268 29.802 -27.540 70 H ASP 12 HN ASP 12 3.164 29.526 -25.731 71 HA ASP 12 HA ASP 12 1.763 28.100 -23.674 72 HB2 ASP 12 HB2 ASP 12 3.277 26.960 -25.287 73 HB3 ASP 12 HB1 ASP 12 4.644 27.796 -24.556 74 H ASN 13 HN ASN 13 1.619 28.809 -21.669 75 HA ASN 13 HA ASN 13 3.598 30.680 -20.646 76 HB2 ASN 13 HB2 ASN 13 0.940 29.763 -19.537 77 HB3 ASN 13 HB1 ASN 13 2.011 30.887 -18.708 78 HD21 ASN 13 HD21 ASN 13 -0.264 30.450 -21.256 79 HD22 ASN 13 HD22 ASN 13 -0.373 32.116 -21.726 80 H GLY 14 HN GLY 14 5.081 30.221 -19.152 81 HA2 GLY 14 HA2 GLY 14 5.443 28.980 -17.008 82 HA3 GLY 14 HA1 GLY 14 4.933 27.551 -17.894 83 H ALA 15 HN ALA 15 7.541 28.889 -16.645 84 HA ALA 15 HA ALA 15 9.315 28.078 -18.844 85 HB1 ALA 15 HB1 ALA 15 9.910 29.826 -16.454 86 HB2 ALA 15 HB2 ALA 15 9.665 30.377 -18.111 87 HB3 ALA 15 HB3 ALA 15 11.064 29.379 -17.710 88 H PHE 16 HN PHE 16 11.320 26.976 -18.151 89 HA PHE 16 HA PHE 16 10.896 25.282 -15.784 90 HB2 PHE 16 HB2 PHE 16 12.116 23.500 -17.327 91 HB3 PHE 16 HB1 PHE 16 10.370 23.714 -17.400 92 HD1 PHE 16 HD1 PHE 16 13.458 25.094 -18.954 93 HD2 PHE 16 HD2 PHE 16 9.403 23.931 -19.471 94 HE1 PHE 16 HE1 PHE 16 13.610 25.625 -21.337 95 HE2 PHE 16 HE2 PHE 16 9.552 24.456 -21.867 96 HZ PHE 16 HZ PHE 16 11.661 25.309 -22.804 97 H PHE 17 HN PHE 17 12.726 24.666 -14.673 98 HA PHE 17 HA PHE 17 15.237 25.971 -15.513 99 HB2 PHE 17 HB2 PHE 17 14.007 25.559 -12.802 100 HB3 PHE 17 HB1 PHE 17 15.753 25.663 -12.956 101 HD1 PHE 17 HD2 PHE 17 14.215 27.680 -15.415 102 HD2 PHE 17 HD1 PHE 17 15.215 27.561 -11.283 103 HE1 PHE 17 HE2 PHE 17 14.084 30.132 -15.315 104 HE2 PHE 17 HE1 PHE 17 15.082 30.013 -11.179 105 HZ PHE 17 HZ PHE 17 14.518 31.306 -13.195 106 H VAL 18 HN VAL 18 17.207 24.868 -14.776 107 HA VAL 18 HA VAL 18 16.930 21.966 -14.979 108 HB VAL 18 HB VAL 18 19.460 23.627 -14.898 109 HG11 VAL 18 HG11 VAL 18 20.526 21.605 -15.806 110 HG12 VAL 18 HG12 VAL 18 18.995 20.741 -15.655 111 HG13 VAL 18 HG13 VAL 18 19.826 21.326 -14.213 112 HG21 VAL 18 HG21 VAL 18 18.148 24.199 -16.856 113 HG22 VAL 18 HG22 VAL 18 17.975 22.492 -17.265 114 HG23 VAL 18 HG23 VAL 18 19.564 23.257 -17.324 115 H LEU 19 HN LEU 19 16.369 21.135 -13.059 116 HA LEU 19 HA LEU 19 17.775 22.087 -10.649 117 HB2 LEU 19 HB2 LEU 19 15.212 22.269 -10.847 118 HB3 LEU 19 HB1 LEU 19 15.197 20.521 -10.704 119 HG LEU 19 HG LEU 19 16.429 20.808 -8.505 120 HD11 LEU 19 HD11 LEU 19 16.177 23.021 -7.432 121 HD12 LEU 19 HD12 LEU 19 15.624 23.676 -8.970 122 HD13 LEU 19 HD13 LEU 19 17.265 23.049 -8.820 123 HD21 LEU 19 HD21 LEU 19 14.396 21.336 -7.262 124 HD22 LEU 19 HD22 LEU 19 14.034 20.285 -8.630 125 HD23 LEU 19 HD23 LEU 19 13.665 22.005 -8.720 126 H VAL 20 HN VAL 20 19.109 20.674 -9.661 127 HA VAL 20 HA VAL 20 18.838 17.826 -10.369 128 HB VAL 20 HB VAL 20 21.438 19.331 -10.005 129 HG11 VAL 20 HG11 VAL 20 20.910 16.444 -10.712 130 HG12 VAL 20 HG12 VAL 20 21.615 17.040 -9.209 131 HG13 VAL 20 HG13 VAL 20 22.492 17.225 -10.729 132 HG21 VAL 20 HG21 VAL 20 20.187 18.150 -12.486 133 HG22 VAL 20 HG22 VAL 20 21.786 18.886 -12.393 134 HG23 VAL 20 HG23 VAL 20 20.346 19.867 -12.123 135 H ASN 21 HN ASN 21 18.826 16.427 -8.772 136 HA ASN 21 HA ASN 21 19.039 17.403 -6.022 137 HB2 ASN 21 HB2 ASN 21 17.110 15.950 -6.983 138 HB3 ASN 21 HB1 ASN 21 18.253 14.618 -6.890 139 HD21 ASN 21 HD21 ASN 21 15.739 14.966 -5.509 140 HD22 ASN 21 HD22 ASN 21 16.094 14.927 -3.816 141 H ASP 22 HN ASP 22 20.267 16.043 -4.438 142 HA ASP 22 HA ASP 22 22.921 15.566 -5.315 143 HB2 ASP 22 HB2 ASP 22 22.472 16.229 -3.023 144 HB3 ASP 22 HB1 ASP 22 21.502 14.788 -2.757 145 H GLU 23 HN GLU 23 20.116 13.612 -5.296 146 HA GLU 23 HA GLU 23 21.667 11.140 -5.615 147 HB2 GLU 23 HB2 GLU 23 18.670 11.412 -5.449 148 HB3 GLU 23 HB1 GLU 23 19.631 9.958 -5.221 149 HG2 GLU 23 HG2 GLU 23 20.554 10.874 -3.168 150 HG3 GLU 23 HG1 GLU 23 19.625 12.356 -3.402 151 H ASP 24 HN ASP 24 20.763 13.532 -7.547 152 HA ASP 24 HA ASP 24 19.731 11.802 -9.696 153 HB2 ASP 24 HB2 ASP 24 17.945 13.237 -8.941 154 HB3 ASP 24 HB1 ASP 24 18.986 14.653 -9.010 155 H GLN 25 HN GLN 25 20.096 12.761 -11.892 156 HA GLN 25 HA GLN 25 22.800 13.915 -12.008 157 HB2 GLN 25 HB2 GLN 25 21.405 12.117 -14.000 158 HB3 GLN 25 HB1 GLN 25 23.034 12.762 -14.168 159 HG2 GLN 25 HG2 GLN 25 23.846 11.463 -12.384 160 HG3 GLN 25 HG1 GLN 25 22.220 11.060 -11.838 161 HE21 GLN 25 HE21 GLN 25 22.549 8.898 -11.904 162 HE22 GLN 25 HE22 GLN 25 22.702 7.999 -13.377 163 H HIS 26 HN HIS 26 19.520 14.033 -13.281 164 HA HIS 26 HA HIS 26 19.811 16.746 -14.069 165 HB2 HIS 26 HB2 HIS 26 19.439 16.458 -16.489 166 HB3 HIS 26 HB1 HIS 26 20.985 15.805 -15.969 167 HD1 HIS 26 HD1 HIS 26 21.233 13.196 -16.001 168 HD2 HIS 26 HD2 HIS 26 17.686 14.627 -17.623 169 HE1 HIS 26 HE1 HIS 26 20.271 11.282 -17.313 170 HE2 HIS 26 HE2 HIS 26 18.234 12.237 -18.452 171 H SER 27 HN SER 27 17.890 17.672 -13.783 172 HA SER 27 HA SER 27 15.493 16.307 -14.711 173 HB2 SER 27 HB2 SER 27 15.823 17.389 -11.904 174 HB3 SER 27 HB1 SER 27 14.287 16.889 -12.607 175 HG SER 27 HG SER 27 16.532 15.320 -11.898 176 H LEU 28 HN LEU 28 14.053 17.657 -15.626 177 HA LEU 28 HA LEU 28 14.610 20.535 -15.519 178 HB2 LEU 28 HB2 LEU 28 13.252 18.743 -17.482 179 HB3 LEU 28 HB1 LEU 28 12.735 20.413 -17.393 180 HG LEU 28 HG LEU 28 14.379 20.088 -19.179 181 HD11 LEU 28 HD11 LEU 28 15.895 21.883 -18.579 182 HD12 LEU 28 HD12 LEU 28 15.488 21.677 -16.874 183 HD13 LEU 28 HD13 LEU 28 14.261 22.235 -18.009 184 HD21 LEU 28 HD21 LEU 28 16.268 19.276 -16.972 185 HD22 LEU 28 HD22 LEU 28 16.696 19.532 -18.664 186 HD23 LEU 28 HD23 LEU 28 15.613 18.213 -18.219 187 H TRP 29 HN TRP 29 13.457 21.697 -14.154 188 HA TRP 29 HA TRP 29 10.848 20.647 -13.271 189 HB2 TRP 29 HB2 TRP 29 12.843 20.571 -11.650 190 HB3 TRP 29 HB1 TRP 29 12.699 22.322 -11.582 191 HD1 TRP 29 HD1 TRP 29 11.281 23.149 -9.628 192 HE1 TRP 29 HE1 TRP 29 9.405 22.171 -8.155 193 HE3 TRP 29 HE3 TRP 29 10.689 18.635 -11.958 194 HZ2 TRP 29 HZ2 TRP 29 7.874 19.810 -8.014 195 HZ3 TRP 29 HZ3 TRP 29 8.996 17.078 -11.093 196 HH2 TRP 29 HH2 TRP 29 7.618 17.652 -9.161 197 HA PRO 30 HA PRO 30 9.410 24.512 -14.976 198 HB2 PRO 30 HB2 PRO 30 6.847 24.301 -14.046 199 HB3 PRO 30 HB1 PRO 30 7.439 23.475 -15.491 200 HG2 PRO 30 HG2 PRO 30 7.070 22.414 -12.718 201 HG3 PRO 30 HG1 PRO 30 6.714 21.638 -14.273 202 HD2 PRO 30 HD2 PRO 30 8.931 21.058 -12.836 203 HD3 PRO 30 HD1 PRO 30 8.912 21.026 -14.612 204 H VAL 31 HN VAL 31 9.122 26.564 -14.231 205 HA VAL 31 HA VAL 31 9.771 27.068 -11.488 206 HB VAL 31 HB VAL 31 9.656 29.433 -12.065 207 HG11 VAL 31 HG11 VAL 31 11.357 29.477 -13.814 208 HG12 VAL 31 HG12 VAL 31 10.978 27.806 -14.231 209 HG13 VAL 31 HG13 VAL 31 11.669 28.187 -12.651 210 HG21 VAL 31 HG21 VAL 31 7.691 29.419 -13.492 211 HG22 VAL 31 HG22 VAL 31 8.566 28.505 -14.719 212 HG23 VAL 31 HG23 VAL 31 9.053 30.155 -14.335 213 H PHE 32 HN PHE 32 6.949 26.214 -12.879 214 HA PHE 32 HA PHE 32 5.235 27.877 -11.192 215 HB2 PHE 32 HB2 PHE 32 4.768 27.362 -13.674 216 HB3 PHE 32 HB1 PHE 32 4.331 25.747 -13.132 217 HD1 PHE 32 HD2 PHE 32 3.508 29.331 -12.727 218 HD2 PHE 32 HD1 PHE 32 2.178 25.315 -12.304 219 HE1 PHE 32 HE2 PHE 32 1.231 30.139 -12.261 220 HE2 PHE 32 HE1 PHE 32 -0.100 26.114 -11.841 221 HZ PHE 32 HZ PHE 32 -0.579 28.529 -11.821 222 H ALA 33 HN ALA 33 7.075 25.323 -10.709 223 HA ALA 33 HA ALA 33 5.091 23.808 -9.152 224 HB1 ALA 33 HB1 ALA 33 7.746 22.837 -10.197 225 HB2 ALA 33 HB2 ALA 33 6.186 22.538 -10.960 226 HB3 ALA 33 HB3 ALA 33 6.525 21.878 -9.362 227 H ASP 34 HN ASP 34 5.977 22.768 -7.172 228 HA ASP 34 HA ASP 34 7.190 24.786 -5.528 229 HB2 ASP 34 HB2 ASP 34 6.359 21.942 -4.912 230 HB3 ASP 34 HB1 ASP 34 6.950 23.082 -3.711 231 H ILE 35 HN ILE 35 9.209 24.844 -4.662 232 HA ILE 35 HA ILE 35 11.065 22.692 -5.442 233 HB ILE 35 HB ILE 35 11.759 25.594 -4.925 234 HG12 ILE 35 HG12 ILE 35 11.572 24.043 -7.520 235 HG13 ILE 35 HG11 ILE 35 10.506 25.349 -7.013 236 HG21 ILE 35 HG21 ILE 35 13.439 23.306 -5.938 237 HG22 ILE 35 HG22 ILE 35 13.553 24.047 -4.343 238 HG23 ILE 35 HG23 ILE 35 13.964 24.980 -5.781 239 HD11 ILE 35 HD11 ILE 35 13.447 25.605 -7.601 240 HD12 ILE 35 HD12 ILE 35 12.375 26.913 -7.105 241 HD13 ILE 35 HD13 ILE 35 12.127 26.107 -8.655 242 HA PRO 36 HA PRO 36 11.064 22.236 -1.021 243 HB2 PRO 36 HB2 PRO 36 12.033 19.765 -0.914 244 HB3 PRO 36 HB1 PRO 36 10.465 20.088 -1.658 245 HG2 PRO 36 HG2 PRO 36 13.111 19.614 -2.979 246 HG3 PRO 36 HG1 PRO 36 11.511 19.004 -3.435 247 HD2 PRO 36 HD2 PRO 36 12.763 21.221 -4.561 248 HD3 PRO 36 HD1 PRO 36 11.023 20.875 -4.632 249 H ALA 37 HN ALA 37 13.749 20.159 -1.264 250 HA ALA 37 HA ALA 37 15.741 22.179 -0.671 251 HB1 ALA 37 HB1 ALA 37 16.350 21.149 1.473 252 HB2 ALA 37 HB2 ALA 37 14.974 20.052 1.331 253 HB3 ALA 37 HB3 ALA 37 14.706 21.787 1.506 254 H GLY 38 HN GLY 38 17.934 21.118 -0.403 255 HA2 GLY 38 HA2 GLY 38 19.535 19.576 -1.036 256 HA3 GLY 38 HA1 GLY 38 18.251 18.393 -1.237 257 H TRP 39 HN TRP 39 18.305 21.496 -2.832 258 HA TRP 39 HA TRP 39 18.550 20.082 -5.399 259 HB2 TRP 39 HB2 TRP 39 17.013 21.843 -6.301 260 HB3 TRP 39 HB1 TRP 39 16.271 20.772 -5.119 261 HD1 TRP 39 HD1 TRP 39 15.412 21.825 -2.882 262 HE1 TRP 39 HE1 TRP 39 15.120 24.239 -2.044 263 HE3 TRP 39 HE3 TRP 39 18.121 24.260 -6.474 264 HZ2 TRP 39 HZ2 TRP 39 15.929 26.840 -2.810 265 HZ3 TRP 39 HZ3 TRP 39 18.309 26.710 -6.347 266 HH2 TRP 39 HH2 TRP 39 17.237 27.969 -4.555 267 H ARG 40 HN ARG 40 19.481 21.211 -7.135 268 HA ARG 40 HA ARG 40 20.704 23.807 -6.553 269 HB2 ARG 40 HB2 ARG 40 22.095 21.369 -7.629 270 HB3 ARG 40 HB1 ARG 40 22.664 22.980 -8.036 271 HG2 ARG 40 HG2 ARG 40 22.447 21.794 -5.278 272 HG3 ARG 40 HG1 ARG 40 23.929 22.112 -6.184 273 HD2 ARG 40 HD2 ARG 40 21.964 24.137 -5.124 274 HD3 ARG 40 HD1 ARG 40 23.617 23.867 -4.574 275 HE ARG 40 HE ARG 40 24.217 24.562 -6.974 276 HH11 ARG 40 HH11 ARG 40 21.511 25.849 -5.124 277 HH12 ARG 40 HH12 ARG 40 21.482 27.360 -5.993 278 HH21 ARG 40 HH21 ARG 40 24.180 26.553 -8.091 279 HH22 ARG 40 HH22 ARG 40 23.002 27.760 -7.666 280 H VAL 41 HN VAL 41 20.284 25.260 -8.084 281 HA VAL 41 HA VAL 41 19.090 24.395 -10.589 282 HB VAL 41 HB VAL 41 19.577 27.193 -9.533 283 HG11 VAL 41 HG11 VAL 41 19.531 27.138 -11.980 284 HG12 VAL 41 HG12 VAL 41 18.100 27.937 -11.335 285 HG13 VAL 41 HG13 VAL 41 17.988 26.285 -11.938 286 HG21 VAL 41 HG21 VAL 41 17.132 27.228 -9.189 287 HG22 VAL 41 HG22 VAL 41 17.936 26.007 -8.203 288 HG23 VAL 41 HG23 VAL 41 17.063 25.529 -9.659 289 H VAL 42 HN VAL 42 20.494 23.723 -12.057 290 HA VAL 42 HA VAL 42 23.213 24.653 -12.107 291 HB VAL 42 HB VAL 42 21.787 22.914 -14.130 292 HG11 VAL 42 HG11 VAL 42 24.050 22.108 -14.669 293 HG12 VAL 42 HG12 VAL 42 24.726 23.290 -13.546 294 HG13 VAL 42 HG13 VAL 42 23.863 23.833 -14.985 295 HG21 VAL 42 HG21 VAL 42 22.785 21.019 -12.896 296 HG22 VAL 42 HG22 VAL 42 21.604 21.911 -11.938 297 HG23 VAL 42 HG23 VAL 42 23.327 22.145 -11.652 298 H HIS 43 HN HIS 43 20.291 25.214 -13.950 299 HA HIS 43 HA HIS 43 21.462 27.547 -15.177 300 HB2 HIS 43 HB2 HIS 43 22.121 25.644 -16.698 301 HB3 HIS 43 HB1 HIS 43 20.409 25.338 -16.966 302 HD1 HIS 43 HD1 HIS 43 19.073 27.216 -18.272 303 HD2 HIS 43 HD2 HIS 43 23.205 27.683 -18.196 304 HE1 HIS 43 HE1 HIS 43 19.595 28.930 -20.033 305 HE2 HIS 43 HE2 HIS 43 22.111 29.022 -20.126 306 H GLY 44 HN GLY 44 19.890 28.960 -16.002 307 HA2 GLY 44 HA2 GLY 44 17.260 28.622 -14.886 308 HA3 GLY 44 HA1 GLY 44 17.836 29.997 -15.812 309 H GLU 45 HN GLU 45 16.016 30.157 -17.079 310 HA GLU 45 HA GLU 45 14.957 27.806 -18.360 311 HB2 GLU 45 HB2 GLU 45 13.587 29.977 -19.406 312 HB3 GLU 45 HB1 GLU 45 13.079 28.959 -18.061 313 HG2 GLU 45 HG2 GLU 45 12.922 31.195 -17.335 314 HG3 GLU 45 HG1 GLU 45 14.323 30.453 -16.560 315 H ALA 46 HN ALA 46 16.307 27.127 -19.766 316 HA ALA 46 HA ALA 46 16.565 28.702 -22.248 317 HB1 ALA 46 HB1 ALA 46 18.779 28.267 -21.287 318 HB2 ALA 46 HB2 ALA 46 18.562 27.384 -22.801 319 HB3 ALA 46 HB3 ALA 46 18.430 26.538 -21.260 320 H SER 47 HN SER 47 16.638 27.185 -24.222 321 HA SER 47 HA SER 47 14.240 25.935 -24.539 322 HB2 SER 47 HB2 SER 47 16.814 25.129 -25.914 323 HB3 SER 47 HB1 SER 47 15.182 24.820 -26.508 324 HG SER 47 HG SER 47 16.540 27.294 -26.246 325 H ARG 48 HN ARG 48 13.315 24.055 -24.027 326 HA ARG 48 HA ARG 48 14.187 22.488 -21.938 327 HB2 ARG 48 HB2 ARG 48 11.868 22.574 -22.665 328 HB3 ARG 48 HB1 ARG 48 12.282 21.769 -24.171 329 HG2 ARG 48 HG2 ARG 48 11.277 20.152 -22.783 330 HG3 ARG 48 HG1 ARG 48 13.004 19.797 -22.799 331 HD2 ARG 48 HD2 ARG 48 13.283 20.819 -20.637 332 HD3 ARG 48 HD1 ARG 48 11.601 21.353 -20.634 333 HE ARG 48 HE ARG 48 12.497 18.546 -20.430 334 HH11 ARG 48 HH11 ARG 48 10.085 21.033 -19.921 335 HH12 ARG 48 HH12 ARG 48 9.006 19.992 -19.049 336 HH21 ARG 48 HH21 ARG 48 11.085 17.171 -19.301 337 HH22 ARG 48 HH22 ARG 48 9.561 17.779 -18.719 338 H ALA 49 HN ALA 49 14.368 21.726 -25.416 339 HA ALA 49 HA ALA 49 15.603 19.205 -25.097 340 HB1 ALA 49 HB1 ALA 49 16.055 19.306 -27.467 341 HB2 ALA 49 HB2 ALA 49 15.760 21.043 -27.481 342 HB3 ALA 49 HB3 ALA 49 14.436 19.928 -27.151 343 H ALA 50 HN ALA 50 16.880 22.462 -25.434 344 HA ALA 50 HA ALA 50 19.595 21.725 -25.793 345 HB1 ALA 50 HB1 ALA 50 20.098 24.057 -25.309 346 HB2 ALA 50 HB2 ALA 50 18.458 24.300 -24.711 347 HB3 ALA 50 HB3 ALA 50 18.729 23.932 -26.414 348 H CYS 51 HN CYS 51 17.606 22.439 -22.971 349 HA CYS 51 HA CYS 51 19.688 22.340 -21.064 350 HB2 CYS 51 HB2 CYS 51 16.731 21.779 -20.776 351 HB3 CYS 51 HB1 CYS 51 17.852 21.926 -19.426 352 HG CYS 51 HG CYS 51 16.416 24.320 -21.276 353 H LEU 52 HN LEU 52 17.418 19.861 -22.233 354 HA LEU 52 HA LEU 52 18.374 17.716 -20.712 355 HB2 LEU 52 HB2 LEU 52 17.098 17.819 -23.438 356 HB3 LEU 52 HB1 LEU 52 17.498 16.308 -22.644 357 HG LEU 52 HG LEU 52 15.606 18.385 -21.538 358 HD11 LEU 52 HD11 LEU 52 14.691 17.331 -23.526 359 HD12 LEU 52 HD12 LEU 52 13.859 16.746 -22.086 360 HD13 LEU 52 HD13 LEU 52 15.067 15.735 -22.878 361 HD21 LEU 52 HD21 LEU 52 16.265 15.585 -20.625 362 HD22 LEU 52 HD22 LEU 52 15.033 16.638 -19.924 363 HD23 LEU 52 HD23 LEU 52 16.739 17.077 -19.813 364 H ASP 53 HN ASP 53 19.310 18.761 -23.973 365 HA ASP 53 HA ASP 53 21.270 16.830 -24.448 366 HB2 ASP 53 HB2 ASP 53 20.344 18.392 -26.149 367 HB3 ASP 53 HB1 ASP 53 21.248 19.703 -25.400 368 H TYR 54 HN TYR 54 21.512 20.027 -22.991 369 HA TYR 54 HA TYR 54 24.251 20.198 -22.594 370 HB2 TYR 54 HB2 TYR 54 22.664 22.054 -22.286 371 HB3 TYR 54 HB1 TYR 54 22.008 21.257 -20.863 372 HD1 TYR 54 HD1 TYR 54 25.026 22.905 -22.231 373 HD2 TYR 54 HD2 TYR 54 23.006 21.554 -18.733 374 HE1 TYR 54 HE1 TYR 54 26.621 24.149 -20.833 375 HE2 TYR 54 HE2 TYR 54 24.607 22.782 -17.330 376 HH TYR 54 HH TYR 54 26.655 25.156 -18.556 377 H VAL 55 HN VAL 55 21.768 18.936 -20.365 378 HA VAL 55 HA VAL 55 23.685 18.348 -18.339 379 HB VAL 55 HB VAL 55 21.821 17.196 -17.171 380 HG11 VAL 55 HG11 VAL 55 22.220 19.566 -16.843 381 HG12 VAL 55 HG12 VAL 55 20.491 19.224 -16.808 382 HG13 VAL 55 HG13 VAL 55 21.215 19.949 -18.243 383 HG21 VAL 55 HG21 VAL 55 20.254 17.975 -19.629 384 HG22 VAL 55 HG22 VAL 55 19.549 17.409 -18.114 385 HG23 VAL 55 HG23 VAL 55 20.582 16.338 -19.059 386 H GLU 56 HN GLU 56 22.169 16.423 -20.885 387 HA GLU 56 HA GLU 56 23.121 13.930 -19.858 388 HB2 GLU 56 HB2 GLU 56 22.182 14.667 -22.634 389 HB3 GLU 56 HB1 GLU 56 22.544 13.028 -22.102 390 HG2 GLU 56 HG2 GLU 56 20.815 13.356 -20.302 391 HG3 GLU 56 HG1 GLU 56 20.357 14.841 -21.135 392 H LYS 57 HN LYS 57 24.416 16.378 -22.007 393 HA LYS 57 HA LYS 57 26.685 14.837 -22.797 394 HB2 LYS 57 HB2 LYS 57 25.940 17.723 -22.998 395 HB3 LYS 57 HB1 LYS 57 27.600 17.230 -23.316 396 HG2 LYS 57 HG2 LYS 57 26.852 15.723 -25.060 397 HG3 LYS 57 HG1 LYS 57 25.169 16.124 -24.709 398 HD2 LYS 57 HD2 LYS 57 25.466 18.363 -25.459 399 HD3 LYS 57 HD1 LYS 57 27.218 18.164 -25.556 400 HE2 LYS 57 HE2 LYS 57 26.084 18.084 -27.756 401 HE3 LYS 57 HE1 LYS 57 26.997 16.624 -27.383 402 HZ1 LYS 57 HZ1 LYS 57 24.931 15.544 -26.744 403 HZ2 LYS 57 HZ2 LYS 57 24.851 16.099 -28.340 404 HZ3 LYS 57 HZ3 LYS 57 24.053 16.952 -27.107 405 H ASN 58 HN ASN 58 25.879 16.508 -19.924 406 HA ASN 58 HA ASN 58 28.555 16.828 -18.963 407 HB2 ASN 58 HB2 ASN 58 25.851 16.796 -17.657 408 HB3 ASN 58 HB1 ASN 58 27.301 16.704 -16.663 409 HD21 ASN 58 HD21 ASN 58 27.164 18.492 -19.664 410 HD22 ASN 58 HD22 ASN 58 27.267 20.061 -18.953 411 H TRP 59 HN TRP 59 26.036 14.378 -18.541 412 HA TRP 59 HA TRP 59 26.133 12.124 -18.282 413 HB2 TRP 59 HB2 TRP 59 27.567 12.473 -20.335 414 HB3 TRP 59 HB1 TRP 59 28.975 12.374 -19.288 415 HD1 TRP 59 HD1 TRP 59 30.022 10.074 -19.194 416 HE1 TRP 59 HE1 TRP 59 29.244 7.656 -19.592 417 HE3 TRP 59 HE3 TRP 59 25.081 10.977 -20.124 418 HZ2 TRP 59 HZ2 TRP 59 26.837 6.312 -20.212 419 HZ3 TRP 59 HZ3 TRP 59 23.607 9.071 -20.616 420 HH2 TRP 59 HH2 TRP 59 24.468 6.786 -20.660 421 H THR 60 HN THR 60 27.019 13.878 -16.067 422 HA THR 60 HA THR 60 28.632 11.899 -14.596 423 HB THR 60 HB THR 60 28.669 14.886 -14.114 424 HG1 THR 60 HG1 THR 60 29.640 13.833 -16.198 425 HG21 THR 60 HG21 THR 60 30.574 12.723 -13.209 426 HG22 THR 60 HG22 THR 60 29.307 13.431 -12.206 427 HG23 THR 60 HG23 THR 60 30.639 14.433 -12.784 428 H ASP 61 HN ASP 61 27.992 11.463 -12.478 429 HA ASP 61 HA ASP 61 25.326 12.019 -11.684 430 HB2 ASP 61 HB2 ASP 61 26.777 10.054 -10.957 431 HB3 ASP 61 HB1 ASP 61 27.601 11.173 -9.879 432 H LEU 62 HN LEU 62 24.807 14.127 -11.429 433 HA LEU 62 HA LEU 62 26.869 15.994 -10.684 434 HB2 LEU 62 HB2 LEU 62 25.326 16.426 -12.564 435 HB3 LEU 62 HB1 LEU 62 23.994 16.516 -11.428 436 HG LEU 62 HG LEU 62 24.971 18.500 -10.395 437 HD11 LEU 62 HD11 LEU 62 26.947 19.570 -11.349 438 HD12 LEU 62 HD12 LEU 62 27.143 18.223 -12.474 439 HD13 LEU 62 HD13 LEU 62 27.332 17.959 -10.739 440 HD21 LEU 62 HD21 LEU 62 23.464 18.755 -12.312 441 HD22 LEU 62 HD22 LEU 62 24.852 18.719 -13.400 442 HD23 LEU 62 HD23 LEU 62 24.668 20.044 -12.249 443 H ARG 63 HN ARG 63 27.311 16.008 -8.598 444 HA ARG 63 HA ARG 63 25.103 16.546 -6.733 445 HB2 ARG 63 HB2 ARG 63 27.787 15.373 -6.003 446 HB3 ARG 63 HB1 ARG 63 26.339 15.448 -5.007 447 HG2 ARG 63 HG2 ARG 63 25.222 13.884 -6.518 448 HG3 ARG 63 HG1 ARG 63 26.681 13.800 -7.503 449 HD2 ARG 63 HD2 ARG 63 26.764 11.903 -6.141 450 HD3 ARG 63 HD1 ARG 63 27.872 13.049 -5.388 451 HE ARG 63 HE ARG 63 25.515 13.494 -4.102 452 HH11 ARG 63 HH11 ARG 63 27.434 10.645 -4.752 453 HH12 ARG 63 HH12 ARG 63 26.934 9.810 -3.309 454 HH21 ARG 63 HH21 ARG 63 24.803 12.400 -2.228 455 HH22 ARG 63 HH22 ARG 63 25.441 10.816 -1.866 456 HA PRO 64 HA PRO 64 26.833 20.546 -6.225 457 HB2 PRO 64 HB2 PRO 64 26.072 21.042 -3.630 458 HB3 PRO 64 HB1 PRO 64 25.002 21.188 -5.029 459 HG2 PRO 64 HG2 PRO 64 25.270 18.945 -3.072 460 HG3 PRO 64 HG1 PRO 64 23.804 19.631 -3.797 461 HD2 PRO 64 HD2 PRO 64 24.874 17.319 -4.669 462 HD3 PRO 64 HD1 PRO 64 24.082 18.461 -5.772 463 H LYS 65 HN LYS 65 28.840 21.170 -5.870 464 HA LYS 65 HA LYS 65 30.489 19.797 -3.909 465 HB2 LYS 65 HB2 LYS 65 31.068 21.816 -6.066 466 HB3 LYS 65 HB1 LYS 65 32.253 21.475 -4.816 467 HG2 LYS 65 HG2 LYS 65 32.829 20.156 -6.685 468 HG3 LYS 65 HG1 LYS 65 32.131 19.060 -5.493 469 HD2 LYS 65 HD2 LYS 65 30.015 19.071 -6.695 470 HD3 LYS 65 HD1 LYS 65 30.663 20.228 -7.859 471 HE2 LYS 65 HE2 LYS 65 31.668 17.418 -7.392 472 HE3 LYS 65 HE1 LYS 65 30.696 17.957 -8.762 473 HZ1 LYS 65 HZ1 LYS 65 33.484 18.739 -8.104 474 HZ2 LYS 65 HZ2 LYS 65 32.551 19.528 -9.281 475 HZ3 LYS 65 HZ3 LYS 65 32.940 17.889 -9.471 476 H SER 66 HN SER 66 31.555 20.830 -2.198 477 HA SER 66 HA SER 66 30.002 22.922 -0.973 478 HB2 SER 66 HB2 SER 66 30.997 20.969 0.269 479 HB3 SER 66 HB1 SER 66 32.584 21.686 0.008 480 HG SER 66 HG SER 66 31.728 22.256 2.045 481 H LEU 67 HN LEU 67 30.269 24.807 -2.079 482 HA LEU 67 HA LEU 67 32.889 26.070 -1.817 483 HB2 LEU 67 HB2 LEU 67 32.655 27.057 -4.087 484 HB3 LEU 67 HB1 LEU 67 32.903 25.325 -4.091 485 HG LEU 67 HG LEU 67 30.293 25.224 -4.299 486 HD11 LEU 67 HD11 LEU 67 29.366 27.091 -5.579 487 HD12 LEU 67 HD12 LEU 67 30.879 27.976 -5.384 488 HD13 LEU 67 HD13 LEU 67 29.888 27.605 -3.975 489 HD21 LEU 67 HD21 LEU 67 31.898 24.436 -5.968 490 HD22 LEU 67 HD22 LEU 67 32.045 26.077 -6.595 491 HD23 LEU 67 HD23 LEU 67 30.509 25.223 -6.718 492 H ARG 68 HN ARG 68 32.780 28.420 -1.904 493 HA ARG 68 HA ARG 68 30.089 29.494 -1.406 494 HB2 ARG 68 HB2 ARG 68 32.548 30.354 0.125 495 HB3 ARG 68 HB1 ARG 68 30.882 30.827 0.428 496 HG2 ARG 68 HG2 ARG 68 30.380 28.471 1.022 497 HG3 ARG 68 HG1 ARG 68 32.099 28.105 0.849 498 HD2 ARG 68 HD2 ARG 68 32.523 29.940 2.542 499 HD3 ARG 68 HD1 ARG 68 30.783 29.942 2.837 500 HE ARG 68 HE ARG 68 32.507 27.573 3.251 501 HH11 ARG 68 HH11 ARG 68 29.791 29.599 4.162 502 HH12 ARG 68 HH12 ARG 68 29.480 28.733 5.642 503 HH21 ARG 68 HH21 ARG 68 32.079 26.417 5.160 504 HH22 ARG 68 HH22 ARG 68 30.762 26.888 6.188 505 H ASP 69 HN ASP 69 29.639 31.101 -2.750 506 HA ASP 69 HA ASP 69 31.841 32.394 -4.182 507 HB2 ASP 69 HB2 ASP 69 30.113 31.490 -5.611 508 HB3 ASP 69 HB1 ASP 69 28.864 32.353 -4.716 509 H ALA 70 HN ALA 70 32.179 34.565 -4.199 510 HA ALA 70 HA ALA 70 30.959 36.052 -2.004 511 HB1 ALA 70 HB1 ALA 70 33.354 36.715 -3.721 512 HB2 ALA 70 HB2 ALA 70 33.394 36.027 -2.097 513 HB3 ALA 70 HB3 ALA 70 32.781 37.659 -2.347 514 H MET 71 HN MET 71 28.946 36.472 -2.934 515 HA MET 71 HA MET 71 28.850 37.997 -5.418 516 HB2 MET 71 HB2 MET 71 27.186 36.143 -4.734 517 HB3 MET 71 HB1 MET 71 26.508 37.335 -3.636 518 HG2 MET 71 HG2 MET 71 26.758 37.750 -6.605 519 HG3 MET 71 HG1 MET 71 25.327 37.088 -5.822 520 HE1 MET 71 HE1 MET 71 23.832 38.953 -6.976 521 HE2 MET 71 HE2 MET 71 25.265 39.612 -7.763 522 HE3 MET 71 HE3 MET 71 24.176 40.680 -6.878 523 H VAL 72 HN VAL 72 29.660 39.990 -4.998 524 HA VAL 72 HA VAL 72 28.493 41.461 -2.732 525 HB VAL 72 HB VAL 72 30.893 41.009 -2.445 526 HG11 VAL 72 HG11 VAL 72 32.554 42.075 -3.883 527 HG12 VAL 72 HG12 VAL 72 31.271 42.646 -4.950 528 HG13 VAL 72 HG13 VAL 72 31.571 40.915 -4.778 529 HG21 VAL 72 HG21 VAL 72 29.966 42.999 -1.436 530 HG22 VAL 72 HG22 VAL 72 30.239 43.912 -2.921 531 HG23 VAL 72 HG23 VAL 72 31.614 43.314 -1.988 532 H GLU 73 HN GLU 73 27.745 43.510 -3.049 533 HA GLU 73 HA GLU 73 27.358 44.254 -5.864 534 HB2 GLU 73 HB2 GLU 73 25.381 45.501 -5.097 535 HB3 GLU 73 HB1 GLU 73 25.286 43.802 -4.667 536 HG2 GLU 73 HG2 GLU 73 26.165 45.953 -2.757 537 HG3 GLU 73 HG1 GLU 73 24.500 45.402 -2.912 538 H ASP 74 HN ASP 74 27.469 46.435 -6.482 539 HA ASP 74 HA ASP 74 28.186 48.595 -4.855 540 HB2 ASP 74 HB2 ASP 74 30.334 47.239 -4.689 541 HB3 ASP 74 HB1 ASP 74 30.545 47.503 -6.416 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 -5.261 28.661 8.650 2 H2 GLY 1 HT2 GLY 1 -5.309 28.263 7.000 3 H3 GLY 1 HT3 GLY 1 -4.925 27.074 8.148 4 HA2 GLY 1 HA1 GLY 1 -7.139 27.233 9.094 5 HA3 GLY 1 HA2 GLY 1 -7.535 28.460 7.898 6 H SER 2 HN SER 2 -8.941 26.033 8.236 7 HA SER 2 HA SER 2 -8.086 24.043 6.407 8 HB2 SER 2 HB2 SER 2 -10.900 24.505 7.409 9 HB3 SER 2 HB1 SER 2 -10.181 22.983 6.880 10 HG SER 2 HG SER 2 -10.166 23.051 9.127 11 H HIS 3 HN HIS 3 -7.822 24.603 4.326 12 HA HIS 3 HA HIS 3 -10.217 25.559 2.911 13 HB2 HIS 3 HB2 HIS 3 -7.363 26.402 2.340 14 HB3 HIS 3 HB1 HIS 3 -8.749 26.794 1.328 15 HD1 HIS 3 HD1 HIS 3 -10.695 28.218 2.695 16 HD2 HIS 3 HD2 HIS 3 -6.815 28.292 4.196 17 HE1 HIS 3 HE1 HIS 3 -10.590 30.223 4.206 18 HE2 HIS 3 HE2 HIS 3 -8.331 30.070 5.314 19 H MET 4 HN MET 4 -10.747 24.390 1.122 20 HA MET 4 HA MET 4 -9.145 21.959 0.795 21 HB2 MET 4 HB2 MET 4 -12.052 22.568 0.324 22 HB3 MET 4 HB1 MET 4 -11.296 21.142 -0.372 23 HG2 MET 4 HG2 MET 4 -12.387 20.518 1.653 24 HG3 MET 4 HG1 MET 4 -10.647 20.429 1.906 25 HE1 MET 4 HE1 MET 4 -11.919 21.468 5.443 26 HE2 MET 4 HE2 MET 4 -10.954 20.320 4.514 27 HE3 MET 4 HE3 MET 4 -12.705 20.369 4.309 28 H SER 5 HN SER 5 -7.622 22.529 -0.692 29 HA SER 5 HA SER 5 -8.453 23.447 -3.319 30 HB2 SER 5 HB2 SER 5 -6.275 24.182 -2.391 31 HB3 SER 5 HB1 SER 5 -5.740 22.503 -2.331 32 HG SER 5 HG SER 5 -5.030 22.929 -4.265 33 H THR 6 HN THR 6 -9.638 21.949 -4.341 34 HA THR 6 HA THR 6 -9.242 19.140 -3.891 35 HB THR 6 HB THR 6 -11.094 20.282 -5.969 36 HG1 THR 6 HG1 THR 6 -12.172 21.294 -4.456 37 HG21 THR 6 HG21 THR 6 -11.319 17.966 -4.042 38 HG22 THR 6 HG22 THR 6 -10.916 17.839 -5.752 39 HG23 THR 6 HG23 THR 6 -12.511 18.413 -5.262 40 H ASN 7 HN ASN 7 -7.591 21.222 -5.800 41 HA ASN 7 HA ASN 7 -7.367 19.354 -8.060 42 HB2 ASN 7 HB2 ASN 7 -6.449 22.232 -7.838 43 HB3 ASN 7 HB1 ASN 7 -6.289 21.216 -9.268 44 HD21 ASN 7 HD21 ASN 7 -8.085 20.801 -10.535 45 HD22 ASN 7 HD22 ASN 7 -9.586 21.646 -10.326 46 HA PRO 8 HA PRO 8 -3.315 18.545 -6.168 47 HB2 PRO 8 HB2 PRO 8 -3.509 15.858 -7.138 48 HB3 PRO 8 HB1 PRO 8 -3.637 16.417 -5.471 49 HG2 PRO 8 HG2 PRO 8 -5.716 15.316 -6.922 50 HG3 PRO 8 HG1 PRO 8 -5.914 16.362 -5.505 51 HD2 PRO 8 HD2 PRO 8 -6.111 17.051 -8.412 52 HD3 PRO 8 HD1 PRO 8 -7.095 17.623 -7.045 53 H PHE 9 HN PHE 9 -4.634 17.806 -9.312 54 HA PHE 9 HA PHE 9 -1.942 17.807 -10.475 55 HB2 PHE 9 HB2 PHE 9 -4.546 16.846 -11.683 56 HB3 PHE 9 HB1 PHE 9 -2.970 16.774 -12.457 57 HD1 PHE 9 HD2 PHE 9 -1.154 15.428 -11.219 58 HD2 PHE 9 HD1 PHE 9 -5.314 15.049 -10.476 59 HE1 PHE 9 HE2 PHE 9 -0.768 13.200 -10.246 60 HE2 PHE 9 HE1 PHE 9 -4.945 12.822 -9.498 61 HZ PHE 9 HZ PHE 9 -2.669 11.895 -9.379 62 H ASP 10 HN ASP 10 -1.634 20.045 -10.604 63 HA ASP 10 HA ASP 10 -3.500 21.616 -12.172 64 HB2 ASP 10 HB2 ASP 10 -0.815 22.248 -10.936 65 HB3 ASP 10 HB1 ASP 10 -1.648 23.377 -11.998 66 H ASP 11 HN ASP 11 -3.549 21.388 -14.311 67 HA ASP 11 HA ASP 11 -1.577 20.042 -15.811 68 HB2 ASP 11 HB2 ASP 11 -4.013 20.397 -16.453 69 HB3 ASP 11 HB1 ASP 11 -3.564 22.032 -16.923 70 H ASP 12 HN ASP 12 0.444 20.764 -16.063 71 HA ASP 12 HA ASP 12 0.913 23.628 -15.834 72 HB2 ASP 12 HB2 ASP 12 3.230 23.057 -15.360 73 HB3 ASP 12 HB1 ASP 12 2.148 22.119 -14.339 74 H ASN 13 HN ASN 13 1.404 24.878 -17.451 75 HA ASN 13 HA ASN 13 3.113 23.874 -19.589 76 HB2 ASN 13 HB2 ASN 13 0.787 23.773 -20.490 77 HB3 ASN 13 HB1 ASN 13 0.605 25.492 -20.152 78 HD21 ASN 13 HD21 ASN 13 0.434 24.070 -22.705 79 HD22 ASN 13 HD22 ASN 13 1.627 24.798 -23.729 80 H GLY 14 HN GLY 14 4.825 25.040 -18.841 81 HA2 GLY 14 HA2 GLY 14 4.794 27.869 -19.371 82 HA3 GLY 14 HA1 GLY 14 4.930 27.486 -17.659 83 H ALA 15 HN ALA 15 6.998 28.342 -17.505 84 HA ALA 15 HA ALA 15 9.104 27.391 -19.217 85 HB1 ALA 15 HB1 ALA 15 9.096 29.691 -18.364 86 HB2 ALA 15 HB2 ALA 15 10.561 28.820 -17.902 87 HB3 ALA 15 HB3 ALA 15 9.275 29.072 -16.722 88 H PHE 16 HN PHE 16 11.214 26.761 -17.993 89 HA PHE 16 HA PHE 16 10.725 24.799 -15.896 90 HB2 PHE 16 HB2 PHE 16 12.156 23.195 -17.483 91 HB3 PHE 16 HB1 PHE 16 10.399 23.265 -17.594 92 HD1 PHE 16 HD1 PHE 16 13.390 25.003 -18.964 93 HD2 PHE 16 HD2 PHE 16 9.481 23.502 -19.697 94 HE1 PHE 16 HE1 PHE 16 13.566 25.691 -21.305 95 HE2 PHE 16 HE2 PHE 16 9.648 24.186 -22.051 96 HZ PHE 16 HZ PHE 16 11.697 25.285 -22.862 97 H PHE 17 HN PHE 17 12.583 24.294 -14.727 98 HA PHE 17 HA PHE 17 14.953 25.911 -15.406 99 HB2 PHE 17 HB2 PHE 17 13.571 25.311 -12.844 100 HB3 PHE 17 HB1 PHE 17 15.328 25.327 -12.792 101 HD1 PHE 17 HD2 PHE 17 12.718 27.458 -14.431 102 HD2 PHE 17 HD1 PHE 17 16.159 27.251 -11.946 103 HE1 PHE 17 HE2 PHE 17 12.698 29.909 -14.202 104 HE2 PHE 17 HE1 PHE 17 16.149 29.698 -11.715 105 HZ PHE 17 HZ PHE 17 14.416 31.033 -12.847 106 H VAL 18 HN VAL 18 17.033 25.014 -14.880 107 HA VAL 18 HA VAL 18 17.115 22.114 -15.176 108 HB VAL 18 HB VAL 18 19.450 24.025 -14.969 109 HG11 VAL 18 HG11 VAL 18 20.015 21.698 -14.547 110 HG12 VAL 18 HG12 VAL 18 20.693 22.236 -16.084 111 HG13 VAL 18 HG13 VAL 18 19.249 21.222 -16.064 112 HG21 VAL 18 HG21 VAL 18 18.069 23.022 -17.458 113 HG22 VAL 18 HG22 VAL 18 19.547 23.983 -17.411 114 HG23 VAL 18 HG23 VAL 18 18.027 24.674 -16.842 115 H LEU 19 HN LEU 19 16.582 21.197 -13.265 116 HA LEU 19 HA LEU 19 17.870 22.228 -10.832 117 HB2 LEU 19 HB2 LEU 19 15.362 22.245 -10.994 118 HB3 LEU 19 HB1 LEU 19 15.410 20.495 -11.056 119 HG LEU 19 HG LEU 19 16.453 20.481 -8.799 120 HD11 LEU 19 HD11 LEU 19 15.956 23.445 -8.958 121 HD12 LEU 19 HD12 LEU 19 17.509 22.634 -8.776 122 HD13 LEU 19 HD13 LEU 19 16.321 22.568 -7.475 123 HD21 LEU 19 HD21 LEU 19 13.810 21.910 -9.036 124 HD22 LEU 19 HD22 LEU 19 14.416 21.126 -7.577 125 HD23 LEU 19 HD23 LEU 19 14.066 20.166 -9.014 126 H VAL 20 HN VAL 20 19.116 20.943 -9.620 127 HA VAL 20 HA VAL 20 19.186 18.063 -10.203 128 HB VAL 20 HB VAL 20 21.602 19.863 -9.820 129 HG11 VAL 20 HG11 VAL 20 21.470 16.870 -10.156 130 HG12 VAL 20 HG12 VAL 20 21.972 17.744 -8.707 131 HG13 VAL 20 HG13 VAL 20 22.944 17.838 -10.176 132 HG21 VAL 20 HG21 VAL 20 20.677 20.000 -12.060 133 HG22 VAL 20 HG22 VAL 20 20.696 18.242 -12.195 134 HG23 VAL 20 HG23 VAL 20 22.213 19.133 -12.083 135 H ASN 21 HN ASN 21 19.599 16.759 -8.380 136 HA ASN 21 HA ASN 21 19.572 18.214 -5.815 137 HB2 ASN 21 HB2 ASN 21 17.557 16.642 -6.650 138 HB3 ASN 21 HB1 ASN 21 18.583 15.407 -5.920 139 HD21 ASN 21 HD21 ASN 21 17.250 14.977 -4.199 140 HD22 ASN 21 HD22 ASN 21 16.936 16.128 -2.937 141 H ASP 22 HN ASP 22 20.164 16.120 -4.104 142 HA ASP 22 HA ASP 22 22.965 15.822 -4.676 143 HB2 ASP 22 HB2 ASP 22 22.164 16.290 -2.386 144 HB3 ASP 22 HB1 ASP 22 21.388 14.710 -2.353 145 H GLU 23 HN GLU 23 20.189 13.609 -4.404 146 HA GLU 23 HA GLU 23 21.933 11.447 -5.359 147 HB2 GLU 23 HB2 GLU 23 20.297 9.877 -4.570 148 HB3 GLU 23 HB1 GLU 23 20.617 11.032 -3.286 149 HG2 GLU 23 HG2 GLU 23 18.220 11.052 -5.114 150 HG3 GLU 23 HG1 GLU 23 18.251 10.465 -3.453 151 H ASP 24 HN ASP 24 19.721 13.664 -6.499 152 HA ASP 24 HA ASP 24 19.173 11.991 -8.863 153 HB2 ASP 24 HB2 ASP 24 17.169 12.966 -7.651 154 HB3 ASP 24 HB1 ASP 24 17.757 14.559 -8.118 155 H GLN 25 HN GLN 25 20.125 12.589 -10.754 156 HA GLN 25 HA GLN 25 21.946 14.874 -10.492 157 HB2 GLN 25 HB2 GLN 25 22.162 12.387 -12.188 158 HB3 GLN 25 HB1 GLN 25 23.325 13.708 -12.204 159 HG2 GLN 25 HG2 GLN 25 22.625 12.049 -9.791 160 HG3 GLN 25 HG1 GLN 25 24.043 11.813 -10.811 161 HE21 GLN 25 HE21 GLN 25 22.508 13.897 -8.473 162 HE22 GLN 25 HE22 GLN 25 23.918 14.803 -8.062 163 H HIS 26 HN HIS 26 19.055 14.340 -11.899 164 HA HIS 26 HA HIS 26 19.391 16.647 -13.532 165 HB2 HIS 26 HB2 HIS 26 18.677 15.595 -15.698 166 HB3 HIS 26 HB1 HIS 26 20.311 15.205 -15.193 167 HD1 HIS 26 HD1 HIS 26 16.842 13.600 -15.080 168 HD2 HIS 26 HD2 HIS 26 20.865 12.566 -15.296 169 HE1 HIS 26 HE1 HIS 26 16.885 11.116 -15.434 170 HE2 HIS 26 HE2 HIS 26 19.303 10.584 -15.884 171 H SER 27 HN SER 27 17.564 17.748 -13.456 172 HA SER 27 HA SER 27 15.017 16.365 -13.646 173 HB2 SER 27 HB2 SER 27 15.726 18.149 -11.300 174 HB3 SER 27 HB1 SER 27 14.106 17.551 -11.655 175 HG SER 27 HG SER 27 16.218 15.711 -11.414 176 H LEU 28 HN LEU 28 14.326 17.397 -15.451 177 HA LEU 28 HA LEU 28 14.510 20.263 -15.694 178 HB2 LEU 28 HB2 LEU 28 13.349 18.063 -17.345 179 HB3 LEU 28 HB1 LEU 28 12.710 19.678 -17.575 180 HG LEU 28 HG LEU 28 14.449 19.196 -19.222 181 HD11 LEU 28 HD11 LEU 28 15.873 21.139 -18.828 182 HD12 LEU 28 HD12 LEU 28 15.328 21.206 -17.151 183 HD13 LEU 28 HD13 LEU 28 14.185 21.492 -18.465 184 HD21 LEU 28 HD21 LEU 28 16.774 18.889 -18.527 185 HD22 LEU 28 HD22 LEU 28 15.742 17.576 -17.955 186 HD23 LEU 28 HD23 LEU 28 16.262 18.838 -16.842 187 H TRP 29 HN TRP 29 13.435 21.342 -14.200 188 HA TRP 29 HA TRP 29 10.850 20.287 -13.277 189 HB2 TRP 29 HB2 TRP 29 12.603 20.333 -11.569 190 HB3 TRP 29 HB1 TRP 29 12.888 22.039 -11.882 191 HD1 TRP 29 HD1 TRP 29 11.671 23.660 -10.330 192 HE1 TRP 29 HE1 TRP 29 9.700 23.510 -8.680 193 HE3 TRP 29 HE3 TRP 29 10.190 18.859 -11.270 194 HZ2 TRP 29 HZ2 TRP 29 7.782 21.601 -7.878 195 HZ3 TRP 29 HZ3 TRP 29 8.279 17.945 -10.014 196 HH2 TRP 29 HH2 TRP 29 7.101 19.292 -8.353 197 HA PRO 30 HA PRO 30 9.161 23.875 -15.346 198 HB2 PRO 30 HB2 PRO 30 6.673 23.002 -14.025 199 HB3 PRO 30 HB1 PRO 30 7.018 23.204 -15.744 200 HG2 PRO 30 HG2 PRO 30 6.748 20.775 -14.652 201 HG3 PRO 30 HG1 PRO 30 7.917 21.084 -15.950 202 HD2 PRO 30 HD2 PRO 30 8.379 20.836 -13.000 203 HD3 PRO 30 HD1 PRO 30 9.344 20.195 -14.346 204 H VAL 31 HN VAL 31 8.434 25.895 -14.752 205 HA VAL 31 HA VAL 31 8.903 26.668 -12.027 206 HB VAL 31 HB VAL 31 8.321 28.946 -12.792 207 HG11 VAL 31 HG11 VAL 31 10.186 29.211 -14.367 208 HG12 VAL 31 HG12 VAL 31 10.245 27.461 -14.573 209 HG13 VAL 31 HG13 VAL 31 10.604 28.176 -13.002 210 HG21 VAL 31 HG21 VAL 31 7.839 27.624 -15.460 211 HG22 VAL 31 HG22 VAL 31 7.868 29.359 -15.158 212 HG23 VAL 31 HG23 VAL 31 6.609 28.361 -14.431 213 H PHE 32 HN PHE 32 7.071 28.610 -11.497 214 HA PHE 32 HA PHE 32 4.990 29.066 -10.719 215 HB2 PHE 32 HB2 PHE 32 4.152 28.368 -12.933 216 HB3 PHE 32 HB1 PHE 32 4.085 26.701 -12.380 217 HD1 PHE 32 HD1 PHE 32 2.580 30.026 -12.094 218 HD2 PHE 32 HD2 PHE 32 2.302 25.928 -10.986 219 HE1 PHE 32 HE1 PHE 32 0.273 30.392 -11.329 220 HE2 PHE 32 HE2 PHE 32 -0.004 26.287 -10.214 221 HZ PHE 32 HZ PHE 32 -1.023 28.523 -10.389 222 H ALA 33 HN ALA 33 5.619 25.560 -10.800 223 HA ALA 33 HA ALA 33 4.234 25.022 -8.365 224 HB1 ALA 33 HB1 ALA 33 6.313 23.362 -9.792 225 HB2 ALA 33 HB2 ALA 33 4.573 23.309 -10.079 226 HB3 ALA 33 HB3 ALA 33 5.226 22.802 -8.521 227 H ASP 34 HN ASP 34 5.177 24.328 -6.359 228 HA ASP 34 HA ASP 34 7.375 26.038 -5.587 229 HB2 ASP 34 HB2 ASP 34 5.395 25.787 -4.134 230 HB3 ASP 34 HB1 ASP 34 5.770 24.079 -3.925 231 H ILE 35 HN ILE 35 9.343 25.418 -4.760 232 HA ILE 35 HA ILE 35 10.277 22.799 -5.709 233 HB ILE 35 HB ILE 35 11.893 25.232 -4.895 234 HG12 ILE 35 HG12 ILE 35 11.164 24.237 -7.658 235 HG13 ILE 35 HG11 ILE 35 10.482 25.656 -6.874 236 HG21 ILE 35 HG21 ILE 35 13.757 24.134 -6.013 237 HG22 ILE 35 HG22 ILE 35 12.731 22.749 -6.388 238 HG23 ILE 35 HG23 ILE 35 13.129 23.122 -4.711 239 HD11 ILE 35 HD11 ILE 35 12.185 26.259 -8.501 240 HD12 ILE 35 HD12 ILE 35 13.370 25.284 -7.633 241 HD13 ILE 35 HD13 ILE 35 12.677 26.713 -6.869 242 HA PRO 36 HA PRO 36 10.740 21.279 -1.501 243 HB2 PRO 36 HB2 PRO 36 12.814 19.537 -1.993 244 HB3 PRO 36 HB1 PRO 36 11.114 19.173 -2.305 245 HG2 PRO 36 HG2 PRO 36 13.231 20.118 -4.198 246 HG3 PRO 36 HG1 PRO 36 11.991 18.870 -4.434 247 HD2 PRO 36 HD2 PRO 36 11.694 21.313 -5.475 248 HD3 PRO 36 HD1 PRO 36 10.309 20.430 -4.797 249 H ALA 37 HN ALA 37 13.185 20.379 -0.428 250 HA ALA 37 HA ALA 37 14.689 22.915 -0.288 251 HB1 ALA 37 HB1 ALA 37 13.355 22.513 1.730 252 HB2 ALA 37 HB2 ALA 37 15.084 22.471 2.071 253 HB3 ALA 37 HB3 ALA 37 14.171 20.966 1.955 254 H GLY 38 HN GLY 38 16.926 22.817 -0.048 255 HA2 GLY 38 HA2 GLY 38 19.031 21.828 0.064 256 HA3 GLY 38 HA1 GLY 38 18.262 20.251 0.145 257 H TRP 39 HN TRP 39 17.591 22.618 -2.333 258 HA TRP 39 HA TRP 39 18.207 20.637 -4.359 259 HB2 TRP 39 HB2 TRP 39 17.214 22.448 -5.873 260 HB3 TRP 39 HB1 TRP 39 16.133 21.689 -4.713 261 HD1 TRP 39 HD1 TRP 39 14.960 23.229 -2.990 262 HE1 TRP 39 HE1 TRP 39 14.979 25.756 -2.497 263 HE3 TRP 39 HE3 TRP 39 18.905 24.602 -5.938 264 HZ2 TRP 39 HZ2 TRP 39 16.458 28.018 -3.261 265 HZ3 TRP 39 HZ3 TRP 39 19.558 26.972 -5.994 266 HH2 TRP 39 HH2 TRP 39 18.359 28.645 -4.682 267 H ARG 40 HN ARG 40 19.132 21.507 -6.453 268 HA ARG 40 HA ARG 40 21.131 23.622 -6.102 269 HB2 ARG 40 HB2 ARG 40 22.326 21.506 -5.817 270 HB3 ARG 40 HB1 ARG 40 21.629 20.889 -7.308 271 HG2 ARG 40 HG2 ARG 40 23.824 21.516 -7.842 272 HG3 ARG 40 HG1 ARG 40 22.795 22.789 -8.491 273 HD2 ARG 40 HD2 ARG 40 23.258 24.109 -6.413 274 HD3 ARG 40 HD1 ARG 40 24.430 22.874 -5.958 275 HE ARG 40 HE ARG 40 24.677 24.347 -8.500 276 HH11 ARG 40 HH11 ARG 40 26.043 23.254 -5.452 277 HH12 ARG 40 HH12 ARG 40 27.603 23.948 -5.770 278 HH21 ARG 40 HH21 ARG 40 26.734 25.248 -8.906 279 HH22 ARG 40 HH22 ARG 40 28.002 25.072 -7.726 280 H VAL 41 HN VAL 41 20.551 25.125 -7.574 281 HA VAL 41 HA VAL 41 19.233 24.280 -10.040 282 HB VAL 41 HB VAL 41 19.637 27.052 -8.886 283 HG11 VAL 41 HG11 VAL 41 18.161 26.211 -11.386 284 HG12 VAL 41 HG12 VAL 41 19.651 27.153 -11.324 285 HG13 VAL 41 HG13 VAL 41 18.153 27.829 -10.686 286 HG21 VAL 41 HG21 VAL 41 17.182 25.326 -9.180 287 HG22 VAL 41 HG22 VAL 41 17.187 27.000 -8.623 288 HG23 VAL 41 HG23 VAL 41 17.994 25.753 -7.673 289 H VAL 42 HN VAL 42 20.344 24.015 -11.848 290 HA VAL 42 HA VAL 42 23.111 24.855 -11.972 291 HB VAL 42 HB VAL 42 21.425 23.372 -13.997 292 HG11 VAL 42 HG11 VAL 42 23.532 22.794 -15.078 293 HG12 VAL 42 HG12 VAL 42 24.413 23.775 -13.906 294 HG13 VAL 42 HG13 VAL 42 23.305 24.542 -15.044 295 HG21 VAL 42 HG21 VAL 42 22.689 21.397 -13.236 296 HG22 VAL 42 HG22 VAL 42 21.702 22.104 -11.955 297 HG23 VAL 42 HG23 VAL 42 23.443 22.387 -11.983 298 H HIS 43 HN HIS 43 20.067 25.609 -13.588 299 HA HIS 43 HA HIS 43 20.936 28.225 -14.292 300 HB2 HIS 43 HB2 HIS 43 22.079 26.796 -16.042 301 HB3 HIS 43 HB1 HIS 43 20.480 26.332 -16.611 302 HD1 HIS 43 HD1 HIS 43 22.492 29.523 -16.087 303 HD2 HIS 43 HD2 HIS 43 19.525 27.962 -18.553 304 HE1 HIS 43 HE1 HIS 43 22.043 31.294 -17.814 305 HE2 HIS 43 HE2 HIS 43 20.422 30.231 -19.424 306 H GLY 44 HN GLY 44 19.218 29.485 -15.226 307 HA2 GLY 44 HA2 GLY 44 16.612 28.689 -14.382 308 HA3 GLY 44 HA1 GLY 44 17.019 30.154 -15.254 309 H GLU 45 HN GLU 45 15.269 30.051 -16.645 310 HA GLU 45 HA GLU 45 14.719 27.552 -17.984 311 HB2 GLU 45 HB2 GLU 45 13.183 29.711 -19.076 312 HB3 GLU 45 HB1 GLU 45 12.648 28.326 -18.134 313 HG2 GLU 45 HG2 GLU 45 11.908 30.115 -16.890 314 HG3 GLU 45 HG1 GLU 45 13.420 29.665 -16.100 315 H ALA 46 HN ALA 46 16.300 27.108 -19.296 316 HA ALA 46 HA ALA 46 16.735 28.861 -21.620 317 HB1 ALA 46 HB1 ALA 46 18.757 27.556 -22.042 318 HB2 ALA 46 HB2 ALA 46 18.397 26.521 -20.660 319 HB3 ALA 46 HB3 ALA 46 18.789 28.223 -20.410 320 H SER 47 HN SER 47 17.021 27.538 -23.711 321 HA SER 47 HA SER 47 14.660 26.407 -24.451 322 HB2 SER 47 HB2 SER 47 17.339 25.551 -25.570 323 HB3 SER 47 HB1 SER 47 15.785 25.559 -26.407 324 HG SER 47 HG SER 47 16.539 27.452 -27.043 325 H ARG 48 HN ARG 48 13.617 24.549 -24.160 326 HA ARG 48 HA ARG 48 14.276 22.738 -22.183 327 HB2 ARG 48 HB2 ARG 48 12.006 23.123 -23.102 328 HB3 ARG 48 HB1 ARG 48 12.471 22.281 -24.573 329 HG2 ARG 48 HG2 ARG 48 12.737 20.830 -21.999 330 HG3 ARG 48 HG1 ARG 48 11.117 21.110 -22.639 331 HD2 ARG 48 HD2 ARG 48 12.031 20.162 -24.837 332 HD3 ARG 48 HD1 ARG 48 13.389 19.583 -23.872 333 HE ARG 48 HE ARG 48 11.129 18.731 -22.554 334 HH11 ARG 48 HH11 ARG 48 12.433 18.315 -25.773 335 HH12 ARG 48 HH12 ARG 48 11.769 16.719 -25.975 336 HH21 ARG 48 HH21 ARG 48 10.229 16.662 -22.807 337 HH22 ARG 48 HH22 ARG 48 10.511 15.777 -24.282 338 H ALA 49 HN ALA 49 14.648 22.349 -25.694 339 HA ALA 49 HA ALA 49 15.777 19.784 -25.664 340 HB1 ALA 49 HB1 ALA 49 14.881 20.823 -27.690 341 HB2 ALA 49 HB2 ALA 49 16.538 20.275 -27.929 342 HB3 ALA 49 HB3 ALA 49 16.206 21.989 -27.682 343 H ALA 50 HN ALA 50 17.240 22.981 -25.357 344 HA ALA 50 HA ALA 50 19.934 22.086 -25.568 345 HB1 ALA 50 HB1 ALA 50 18.838 24.623 -24.358 346 HB2 ALA 50 HB2 ALA 50 19.309 24.398 -26.042 347 HB3 ALA 50 HB3 ALA 50 20.527 24.323 -24.768 348 H CYS 51 HN CYS 51 17.664 22.460 -22.926 349 HA CYS 51 HA CYS 51 19.549 22.105 -20.831 350 HB2 CYS 51 HB2 CYS 51 16.572 21.564 -20.890 351 HB3 CYS 51 HB1 CYS 51 17.564 21.614 -19.437 352 HG CYS 51 HG CYS 51 16.548 24.194 -21.405 353 H LEU 52 HN LEU 52 17.265 19.856 -22.427 354 HA LEU 52 HA LEU 52 18.177 17.494 -21.258 355 HB2 LEU 52 HB2 LEU 52 17.161 17.969 -24.058 356 HB3 LEU 52 HB1 LEU 52 17.400 16.381 -23.358 357 HG LEU 52 HG LEU 52 15.441 18.470 -22.407 358 HD11 LEU 52 HD11 LEU 52 14.772 17.380 -24.471 359 HD12 LEU 52 HD12 LEU 52 13.763 16.845 -23.128 360 HD13 LEU 52 HD13 LEU 52 15.046 15.797 -23.741 361 HD21 LEU 52 HD21 LEU 52 15.977 15.689 -21.362 362 HD22 LEU 52 HD22 LEU 52 14.671 16.757 -20.844 363 HD23 LEU 52 HD23 LEU 52 16.346 17.200 -20.531 364 H ASP 53 HN ASP 53 19.348 19.171 -24.149 365 HA ASP 53 HA ASP 53 21.377 17.453 -24.946 366 HB2 ASP 53 HB2 ASP 53 20.798 19.320 -26.332 367 HB3 ASP 53 HB1 ASP 53 21.134 20.468 -25.044 368 H TYR 54 HN TYR 54 21.406 20.034 -22.567 369 HA TYR 54 HA TYR 54 24.134 20.003 -21.969 370 HB2 TYR 54 HB2 TYR 54 22.382 21.767 -21.406 371 HB3 TYR 54 HB1 TYR 54 21.923 20.741 -20.054 372 HD1 TYR 54 HD1 TYR 54 24.966 22.318 -21.526 373 HD2 TYR 54 HD2 TYR 54 22.889 21.156 -18.003 374 HE1 TYR 54 HE1 TYR 54 26.695 23.400 -20.159 375 HE2 TYR 54 HE2 TYR 54 24.614 22.237 -16.622 376 HH TYR 54 HH TYR 54 26.889 22.971 -16.749 377 H VAL 55 HN VAL 55 21.390 18.422 -20.302 378 HA VAL 55 HA VAL 55 23.101 17.273 -18.323 379 HB VAL 55 HB VAL 55 21.132 16.008 -17.568 380 HG11 VAL 55 HG11 VAL 55 19.773 17.940 -16.922 381 HG12 VAL 55 HG12 VAL 55 20.597 18.921 -18.134 382 HG13 VAL 55 HG13 VAL 55 21.499 18.271 -16.762 383 HG21 VAL 55 HG21 VAL 55 20.074 15.565 -19.719 384 HG22 VAL 55 HG22 VAL 55 19.727 17.283 -19.916 385 HG23 VAL 55 HG23 VAL 55 18.953 16.370 -18.622 386 H GLU 56 HN GLU 56 21.762 16.097 -21.358 387 HA GLU 56 HA GLU 56 22.465 13.368 -20.903 388 HB2 GLU 56 HB2 GLU 56 21.730 14.882 -23.403 389 HB3 GLU 56 HB1 GLU 56 22.069 13.154 -23.389 390 HG2 GLU 56 HG2 GLU 56 20.246 12.795 -21.820 391 HG3 GLU 56 HG1 GLU 56 19.920 14.525 -21.789 392 H LYS 57 HN LYS 57 24.037 16.073 -22.567 393 HA LYS 57 HA LYS 57 26.239 14.479 -23.449 394 HB2 LYS 57 HB2 LYS 57 25.620 17.396 -23.450 395 HB3 LYS 57 HB1 LYS 57 27.272 16.867 -23.759 396 HG2 LYS 57 HG2 LYS 57 26.729 15.863 -25.746 397 HG3 LYS 57 HG1 LYS 57 25.057 15.578 -25.272 398 HD2 LYS 57 HD2 LYS 57 25.214 17.273 -27.017 399 HD3 LYS 57 HD1 LYS 57 24.567 17.948 -25.520 400 HE2 LYS 57 HE2 LYS 57 26.816 18.823 -24.994 401 HE3 LYS 57 HE1 LYS 57 27.387 18.217 -26.550 402 HZ1 LYS 57 HZ1 LYS 57 26.767 20.597 -26.572 403 HZ2 LYS 57 HZ2 LYS 57 25.161 20.155 -26.235 404 HZ3 LYS 57 HZ3 LYS 57 25.894 19.662 -27.686 405 H ASN 58 HN ASN 58 25.438 15.965 -20.473 406 HA ASN 58 HA ASN 58 28.070 16.077 -19.381 407 HB2 ASN 58 HB2 ASN 58 25.306 16.110 -18.271 408 HB3 ASN 58 HB1 ASN 58 26.601 15.642 -17.176 409 HD21 ASN 58 HD21 ASN 58 27.073 17.905 -19.798 410 HD22 ASN 58 HD22 ASN 58 27.268 19.302 -18.804 411 H TRP 59 HN TRP 59 26.030 13.550 -20.311 412 HA TRP 59 HA TRP 59 26.308 11.295 -20.379 413 HB2 TRP 59 HB2 TRP 59 28.852 12.143 -20.351 414 HB3 TRP 59 HB1 TRP 59 28.833 11.308 -18.803 415 HD1 TRP 59 HD1 TRP 59 28.442 10.644 -22.562 416 HE1 TRP 59 HE1 TRP 59 28.875 8.149 -23.010 417 HE3 TRP 59 HE3 TRP 59 28.815 9.007 -17.735 418 HZ2 TRP 59 HZ2 TRP 59 29.314 5.794 -21.515 419 HZ3 TRP 59 HZ3 TRP 59 29.240 6.619 -17.330 420 HH2 TRP 59 HH2 TRP 59 29.484 5.047 -19.181 421 H THR 60 HN THR 60 25.524 12.993 -17.842 422 HA THR 60 HA THR 60 25.881 10.975 -15.785 423 HB THR 60 HB THR 60 24.425 13.594 -15.473 424 HG1 THR 60 HG1 THR 60 26.996 13.249 -16.129 425 HG21 THR 60 HG21 THR 60 25.967 11.852 -13.544 426 HG22 THR 60 HG22 THR 60 24.210 11.980 -13.642 427 HG23 THR 60 HG23 THR 60 25.170 13.373 -13.145 428 H ASP 61 HN ASP 61 24.538 9.428 -16.918 429 HA ASP 61 HA ASP 61 21.895 9.360 -15.854 430 HB2 ASP 61 HB2 ASP 61 21.539 10.793 -17.883 431 HB3 ASP 61 HB1 ASP 61 22.130 9.465 -18.878 432 H LEU 62 HN LEU 62 20.791 7.279 -16.567 433 HA LEU 62 HA LEU 62 22.615 5.114 -16.371 434 HB2 LEU 62 HB2 LEU 62 19.690 5.112 -17.131 435 HB3 LEU 62 HB1 LEU 62 20.627 3.691 -16.713 436 HG LEU 62 HG LEU 62 19.978 5.983 -14.860 437 HD11 LEU 62 HD11 LEU 62 18.602 4.340 -13.689 438 HD12 LEU 62 HD12 LEU 62 18.983 3.139 -14.924 439 HD13 LEU 62 HD13 LEU 62 18.051 4.576 -15.346 440 HD21 LEU 62 HD21 LEU 62 20.990 4.602 -13.118 441 HD22 LEU 62 HD22 LEU 62 22.164 5.015 -14.372 442 HD23 LEU 62 HD23 LEU 62 21.446 3.403 -14.331 443 H ARG 63 HN ARG 63 20.759 6.542 -19.018 444 HA ARG 63 HA ARG 63 22.423 4.999 -20.898 445 HB2 ARG 63 HB2 ARG 63 19.466 5.569 -21.108 446 HB3 ARG 63 HB1 ARG 63 20.442 5.058 -22.475 447 HG2 ARG 63 HG2 ARG 63 21.000 2.987 -21.294 448 HG3 ARG 63 HG1 ARG 63 19.981 3.498 -19.947 449 HD2 ARG 63 HD2 ARG 63 19.014 3.134 -22.777 450 HD3 ARG 63 HD1 ARG 63 18.866 1.918 -21.511 451 HE ARG 63 HE ARG 63 17.602 3.859 -20.320 452 HH11 ARG 63 HH11 ARG 63 17.479 3.061 -23.727 453 HH12 ARG 63 HH12 ARG 63 15.859 3.665 -23.941 454 HH21 ARG 63 HH21 ARG 63 15.485 4.615 -20.564 455 HH22 ARG 63 HH22 ARG 63 14.706 4.543 -22.123 456 HA PRO 64 HA PRO 64 23.065 9.472 -21.821 457 HB2 PRO 64 HB2 PRO 64 25.639 8.388 -22.771 458 HB3 PRO 64 HB1 PRO 64 25.330 9.718 -21.654 459 HG2 PRO 64 HG2 PRO 64 26.305 7.374 -20.793 460 HG3 PRO 64 HG1 PRO 64 25.159 8.315 -19.818 461 HD2 PRO 64 HD2 PRO 64 24.664 5.905 -21.524 462 HD3 PRO 64 HD1 PRO 64 24.022 6.296 -19.914 463 H LYS 65 HN LYS 65 22.214 10.140 -23.673 464 HA LYS 65 HA LYS 65 22.791 8.650 -26.134 465 HB2 LYS 65 HB2 LYS 65 20.376 8.928 -26.766 466 HB3 LYS 65 HB1 LYS 65 20.654 7.818 -25.431 467 HG2 LYS 65 HG2 LYS 65 20.054 9.599 -23.850 468 HG3 LYS 65 HG1 LYS 65 19.730 10.673 -25.209 469 HD2 LYS 65 HD2 LYS 65 17.952 9.211 -25.972 470 HD3 LYS 65 HD1 LYS 65 18.309 8.065 -24.678 471 HE2 LYS 65 HE2 LYS 65 16.391 9.414 -24.075 472 HE3 LYS 65 HE1 LYS 65 17.752 9.797 -23.022 473 HZ1 LYS 65 HZ1 LYS 65 16.676 11.815 -23.699 474 HZ2 LYS 65 HZ2 LYS 65 16.804 11.399 -25.330 475 HZ3 LYS 65 HZ3 LYS 65 18.204 11.748 -24.439 476 H SER 66 HN SER 66 22.531 9.847 -28.071 477 HA SER 66 HA SER 66 21.670 12.571 -28.073 478 HB2 SER 66 HB2 SER 66 23.970 12.816 -27.117 479 HB3 SER 66 HB1 SER 66 24.620 12.063 -28.572 480 HG SER 66 HG SER 66 23.572 14.609 -28.190 481 H LEU 67 HN LEU 67 20.421 12.270 -29.821 482 HA LEU 67 HA LEU 67 21.546 10.764 -32.088 483 HB2 LEU 67 HB2 LEU 67 18.673 11.106 -31.231 484 HB3 LEU 67 HB1 LEU 67 19.189 10.258 -32.677 485 HG LEU 67 HG LEU 67 19.860 9.450 -29.844 486 HD11 LEU 67 HD11 LEU 67 17.507 9.102 -30.354 487 HD12 LEU 67 HD12 LEU 67 18.359 7.562 -30.264 488 HD13 LEU 67 HD13 LEU 67 17.940 8.247 -31.833 489 HD21 LEU 67 HD21 LEU 67 21.615 8.836 -31.415 490 HD22 LEU 67 HD22 LEU 67 20.420 8.084 -32.474 491 HD23 LEU 67 HD23 LEU 67 20.733 7.409 -30.875 492 H ARG 68 HN ARG 68 21.355 13.814 -31.348 493 HA ARG 68 HA ARG 68 20.853 14.628 -34.084 494 HB2 ARG 68 HB2 ARG 68 18.652 14.733 -32.697 495 HB3 ARG 68 HB1 ARG 68 19.385 16.142 -31.942 496 HG2 ARG 68 HG2 ARG 68 17.984 16.898 -33.715 497 HG3 ARG 68 HG1 ARG 68 19.662 17.126 -34.219 498 HD2 ARG 68 HD2 ARG 68 19.525 14.957 -35.433 499 HD3 ARG 68 HD1 ARG 68 17.810 14.890 -35.032 500 HE ARG 68 HE ARG 68 18.941 17.113 -36.611 501 HH11 ARG 68 HH11 ARG 68 16.585 14.561 -36.145 502 HH12 ARG 68 HH12 ARG 68 15.716 14.922 -37.603 503 HH21 ARG 68 HH21 ARG 68 17.792 17.598 -38.531 504 HH22 ARG 68 HH22 ARG 68 16.409 16.642 -38.971 505 H ASP 69 HN ASP 69 22.357 16.041 -34.656 506 HA ASP 69 HA ASP 69 23.386 17.875 -32.608 507 HB2 ASP 69 HB2 ASP 69 25.644 17.736 -33.638 508 HB3 ASP 69 HB1 ASP 69 25.122 16.219 -32.923 509 H ALA 70 HN ALA 70 21.908 19.398 -33.368 510 HA ALA 70 HA ALA 70 22.372 20.392 -36.100 511 HB1 ALA 70 HB1 ALA 70 19.956 20.772 -34.335 512 HB2 ALA 70 HB2 ALA 70 20.085 19.624 -35.668 513 HB3 ALA 70 HB3 ALA 70 20.139 21.359 -35.987 514 H MET 71 HN MET 71 23.605 22.129 -36.190 515 HA MET 71 HA MET 71 23.834 23.889 -33.905 516 HB2 MET 71 HB2 MET 71 25.478 25.127 -35.318 517 HB3 MET 71 HB1 MET 71 25.882 23.439 -35.054 518 HG2 MET 71 HG2 MET 71 25.119 22.876 -37.280 519 HG3 MET 71 HG1 MET 71 24.608 24.542 -37.549 520 HE1 MET 71 HE1 MET 71 28.034 26.446 -37.558 521 HE2 MET 71 HE2 MET 71 26.948 26.189 -36.193 522 HE3 MET 71 HE3 MET 71 26.291 26.593 -37.779 523 H VAL 72 HN VAL 72 21.858 24.843 -33.694 524 HA VAL 72 HA VAL 72 20.860 26.476 -35.910 525 HB VAL 72 HB VAL 72 19.589 25.952 -33.212 526 HG11 VAL 72 HG11 VAL 72 18.815 28.018 -34.231 527 HG12 VAL 72 HG12 VAL 72 17.540 26.798 -34.250 528 HG13 VAL 72 HG13 VAL 72 18.440 27.157 -35.724 529 HG21 VAL 72 HG21 VAL 72 19.770 23.876 -34.456 530 HG22 VAL 72 HG22 VAL 72 19.056 24.641 -35.877 531 HG23 VAL 72 HG23 VAL 72 18.090 24.415 -34.418 532 H GLU 73 HN GLU 73 21.379 28.564 -35.992 533 HA GLU 73 HA GLU 73 22.580 29.779 -33.612 534 HB2 GLU 73 HB2 GLU 73 22.658 30.695 -36.491 535 HB3 GLU 73 HB1 GLU 73 23.531 31.428 -35.151 536 HG2 GLU 73 HG2 GLU 73 24.725 29.264 -34.842 537 HG3 GLU 73 HG1 GLU 73 23.945 28.684 -36.314 538 H ASP 74 HN ASP 74 22.221 32.206 -33.454 539 HA ASP 74 HA ASP 74 19.554 33.035 -34.302 540 HB2 ASP 74 HB2 ASP 74 19.248 32.051 -32.056 541 HB3 ASP 74 HB1 ASP 74 20.473 33.146 -31.415 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 16.299 -2.176 -5.836 2 H2 GLY 1 HT2 GLY 1 16.488 -2.363 -4.157 3 H3 GLY 1 HT3 GLY 1 17.371 -1.179 -4.986 4 HA2 GLY 1 HA1 GLY 1 14.420 -1.209 -4.719 5 HA3 GLY 1 HA2 GLY 1 15.505 -0.239 -3.733 6 H SER 2 HN SER 2 13.497 0.916 -5.233 7 HA SER 2 HA SER 2 15.099 2.613 -6.970 8 HB2 SER 2 HB2 SER 2 14.204 0.857 -8.475 9 HB3 SER 2 HB1 SER 2 12.569 1.263 -7.960 10 HG SER 2 HG SER 2 14.321 3.163 -9.116 11 H HIS 3 HN HIS 3 14.757 4.521 -6.002 12 HA HIS 3 HA HIS 3 12.365 5.304 -4.710 13 HB2 HIS 3 HB2 HIS 3 14.701 6.869 -5.805 14 HB3 HIS 3 HB1 HIS 3 13.314 7.677 -5.088 15 HD1 HIS 3 HD1 HIS 3 16.318 5.627 -4.230 16 HD2 HIS 3 HD2 HIS 3 13.122 7.452 -2.294 17 HE1 HIS 3 HE1 HIS 3 16.923 5.640 -1.787 18 HE2 HIS 3 HE2 HIS 3 14.938 6.677 -0.623 19 H MET 4 HN MET 4 10.511 5.194 -5.839 20 HA MET 4 HA MET 4 10.390 5.763 -8.640 21 HB2 MET 4 HB2 MET 4 8.203 5.298 -6.606 22 HB3 MET 4 HB1 MET 4 7.925 5.477 -8.331 23 HG2 MET 4 HG2 MET 4 9.320 3.499 -8.743 24 HG3 MET 4 HG1 MET 4 9.533 3.310 -7.004 25 HE1 MET 4 HE1 MET 4 6.935 3.274 -9.970 26 HE2 MET 4 HE2 MET 4 6.284 4.486 -8.867 27 HE3 MET 4 HE3 MET 4 5.431 2.960 -9.103 28 H SER 5 HN SER 5 11.057 7.875 -8.934 29 HA SER 5 HA SER 5 9.903 10.101 -7.605 30 HB2 SER 5 HB2 SER 5 11.237 10.050 -10.320 31 HB3 SER 5 HB1 SER 5 11.078 11.435 -9.241 32 HG SER 5 HG SER 5 12.247 9.580 -7.824 33 H THR 6 HN THR 6 8.288 11.511 -8.291 34 HA THR 6 HA THR 6 6.337 10.244 -10.045 35 HB THR 6 HB THR 6 5.591 11.031 -7.835 36 HG1 THR 6 HG1 THR 6 3.697 11.714 -8.605 37 HG21 THR 6 HG21 THR 6 5.321 13.441 -7.417 38 HG22 THR 6 HG22 THR 6 6.213 13.783 -8.900 39 HG23 THR 6 HG23 THR 6 7.016 12.974 -7.553 40 H ASN 7 HN ASN 7 5.821 10.936 -12.019 41 HA ASN 7 HA ASN 7 6.915 13.521 -12.901 42 HB2 ASN 7 HB2 ASN 7 8.167 11.752 -13.987 43 HB3 ASN 7 HB1 ASN 7 6.677 10.948 -14.477 44 HD21 ASN 7 HD21 ASN 7 8.806 13.646 -15.053 45 HD22 ASN 7 HD22 ASN 7 8.146 14.096 -16.586 46 HA PRO 8 HA PRO 8 2.488 13.991 -13.679 47 HB2 PRO 8 HB2 PRO 8 2.816 16.788 -13.164 48 HB3 PRO 8 HB1 PRO 8 2.035 15.583 -12.142 49 HG2 PRO 8 HG2 PRO 8 4.380 16.897 -11.514 50 HG3 PRO 8 HG1 PRO 8 3.871 15.348 -10.821 51 HD2 PRO 8 HD2 PRO 8 5.816 15.895 -13.026 52 HD3 PRO 8 HD1 PRO 8 5.889 14.679 -11.731 53 H PHE 9 HN PHE 9 4.891 16.452 -14.627 54 HA PHE 9 HA PHE 9 3.290 17.141 -16.944 55 HB2 PHE 9 HB2 PHE 9 5.899 18.326 -15.984 56 HB3 PHE 9 HB1 PHE 9 4.841 18.994 -17.223 57 HD1 PHE 9 HD1 PHE 9 2.411 19.531 -16.470 58 HD2 PHE 9 HD2 PHE 9 5.691 19.047 -13.804 59 HE1 PHE 9 HE1 PHE 9 1.200 20.811 -14.756 60 HE2 PHE 9 HE2 PHE 9 4.487 20.327 -12.082 61 HZ PHE 9 HZ PHE 9 2.237 21.210 -12.558 62 H ASP 10 HN ASP 10 3.573 16.195 -18.829 63 HA ASP 10 HA ASP 10 6.224 15.135 -19.545 64 HB2 ASP 10 HB2 ASP 10 5.102 13.804 -21.231 65 HB3 ASP 10 HB1 ASP 10 4.260 13.574 -19.702 66 H ASP 11 HN ASP 11 4.190 17.737 -19.945 67 HA ASP 11 HA ASP 11 5.560 18.588 -22.403 68 HB2 ASP 11 HB2 ASP 11 3.267 18.020 -22.998 69 HB3 ASP 11 HB1 ASP 11 2.648 19.012 -21.682 70 H ASP 12 HN ASP 12 6.411 20.598 -22.340 71 HA ASP 12 HA ASP 12 6.681 21.877 -19.810 72 HB2 ASP 12 HB2 ASP 12 7.462 22.931 -22.538 73 HB3 ASP 12 HB1 ASP 12 8.067 23.496 -20.985 74 H ASN 13 HN ASN 13 4.784 22.679 -19.041 75 HA ASN 13 HA ASN 13 2.972 24.132 -20.756 76 HB2 ASN 13 HB2 ASN 13 2.220 22.581 -18.927 77 HB3 ASN 13 HB1 ASN 13 2.822 23.750 -17.758 78 HD21 ASN 13 HD21 ASN 13 0.427 23.106 -20.194 79 HD22 ASN 13 HD22 ASN 13 -0.664 24.367 -19.732 80 H GLY 14 HN GLY 14 5.452 24.888 -18.438 81 HA2 GLY 14 HA2 GLY 14 4.953 27.748 -18.909 82 HA3 GLY 14 HA1 GLY 14 5.148 27.168 -17.260 83 H ALA 15 HN ALA 15 6.993 28.407 -16.896 84 HA ALA 15 HA ALA 15 9.315 28.058 -18.587 85 HB1 ALA 15 HB1 ALA 15 10.449 29.534 -17.011 86 HB2 ALA 15 HB2 ALA 15 9.075 29.443 -15.912 87 HB3 ALA 15 HB3 ALA 15 8.893 30.220 -17.485 88 H PHE 16 HN PHE 16 11.121 26.870 -18.106 89 HA PHE 16 HA PHE 16 10.898 25.028 -15.822 90 HB2 PHE 16 HB2 PHE 16 12.220 23.470 -17.524 91 HB3 PHE 16 HB1 PHE 16 10.460 23.558 -17.557 92 HD1 PHE 16 HD1 PHE 16 13.489 25.074 -19.083 93 HD2 PHE 16 HD2 PHE 16 9.369 24.115 -19.528 94 HE1 PHE 16 HE1 PHE 16 13.551 25.861 -21.409 95 HE2 PHE 16 HE2 PHE 16 9.431 24.894 -21.859 96 HZ PHE 16 HZ PHE 16 11.523 25.774 -22.801 97 H PHE 17 HN PHE 17 12.793 24.484 -14.783 98 HA PHE 17 HA PHE 17 15.189 26.003 -15.590 99 HB2 PHE 17 HB2 PHE 17 13.963 25.494 -12.907 100 HB3 PHE 17 HB1 PHE 17 15.714 25.593 -13.012 101 HD1 PHE 17 HD2 PHE 17 13.330 27.587 -15.033 102 HD2 PHE 17 HD1 PHE 17 16.056 27.543 -11.764 103 HE1 PHE 17 HE2 PHE 17 13.201 30.036 -14.895 104 HE2 PHE 17 HE1 PHE 17 15.933 29.996 -11.627 105 HZ PHE 17 HZ PHE 17 14.503 31.244 -13.194 106 H VAL 18 HN VAL 18 17.220 24.964 -15.173 107 HA VAL 18 HA VAL 18 17.047 22.057 -15.215 108 HB VAL 18 HB VAL 18 19.458 23.853 -15.529 109 HG11 VAL 18 HG11 VAL 18 20.612 21.831 -16.301 110 HG12 VAL 18 HG12 VAL 18 19.185 20.871 -15.914 111 HG13 VAL 18 HG13 VAL 18 20.085 21.675 -14.626 112 HG21 VAL 18 HG21 VAL 18 17.865 22.305 -17.568 113 HG22 VAL 18 HG22 VAL 18 19.353 23.194 -17.888 114 HG23 VAL 18 HG23 VAL 18 17.901 24.059 -17.387 115 H LEU 19 HN LEU 19 16.617 21.381 -13.244 116 HA LEU 19 HA LEU 19 18.142 22.466 -10.986 117 HB2 LEU 19 HB2 LEU 19 15.645 22.548 -10.932 118 HB3 LEU 19 HB1 LEU 19 15.617 20.799 -11.018 119 HG LEU 19 HG LEU 19 16.803 20.711 -8.844 120 HD11 LEU 19 HD11 LEU 19 16.377 23.690 -8.899 121 HD12 LEU 19 HD12 LEU 19 17.929 22.851 -8.920 122 HD13 LEU 19 HD13 LEU 19 16.897 22.763 -7.494 123 HD21 LEU 19 HD21 LEU 19 14.235 22.280 -8.835 124 HD22 LEU 19 HD22 LEU 19 14.896 21.368 -7.477 125 HD23 LEU 19 HD23 LEU 19 14.378 20.526 -8.938 126 H VAL 20 HN VAL 20 19.150 20.987 -9.517 127 HA VAL 20 HA VAL 20 18.941 18.162 -10.212 128 HB VAL 20 HB VAL 20 20.958 18.927 -11.374 129 HG11 VAL 20 HG11 VAL 20 21.558 20.812 -9.960 130 HG12 VAL 20 HG12 VAL 20 22.917 19.706 -10.147 131 HG13 VAL 20 HG13 VAL 20 21.984 19.708 -8.652 132 HG21 VAL 20 HG21 VAL 20 22.531 17.298 -10.452 133 HG22 VAL 20 HG22 VAL 20 20.890 16.655 -10.525 134 HG23 VAL 20 HG23 VAL 20 21.559 17.194 -8.984 135 H ASN 21 HN ASN 21 18.618 16.962 -8.474 136 HA ASN 21 HA ASN 21 18.998 18.094 -5.836 137 HB2 ASN 21 HB2 ASN 21 18.036 15.360 -6.725 138 HB3 ASN 21 HB1 ASN 21 18.130 15.879 -5.046 139 HD21 ASN 21 HD21 ASN 21 15.827 15.021 -6.576 140 HD22 ASN 21 HD22 ASN 21 14.700 16.334 -6.532 141 H ASP 22 HN ASP 22 20.414 17.170 -4.255 142 HA ASP 22 HA ASP 22 22.979 16.646 -5.283 143 HB2 ASP 22 HB2 ASP 22 22.540 17.637 -3.050 144 HB3 ASP 22 HB1 ASP 22 21.970 16.066 -2.491 145 H GLU 23 HN GLU 23 20.365 14.553 -4.455 146 HA GLU 23 HA GLU 23 22.036 12.160 -4.586 147 HB2 GLU 23 HB2 GLU 23 19.951 10.983 -3.908 148 HB3 GLU 23 HB1 GLU 23 20.452 12.225 -2.768 149 HG2 GLU 23 HG2 GLU 23 18.804 13.760 -3.749 150 HG3 GLU 23 HG1 GLU 23 18.281 12.477 -4.838 151 H ASP 24 HN ASP 24 20.831 14.041 -6.881 152 HA ASP 24 HA ASP 24 19.755 11.809 -8.495 153 HB2 ASP 24 HB2 ASP 24 18.267 13.899 -7.824 154 HB3 ASP 24 HB1 ASP 24 19.115 14.658 -9.166 155 H GLN 25 HN GLN 25 19.806 12.831 -10.971 156 HA GLN 25 HA GLN 25 22.664 13.376 -11.445 157 HB2 GLN 25 HB2 GLN 25 22.242 12.342 -13.707 158 HB3 GLN 25 HB1 GLN 25 22.116 11.236 -12.347 159 HG2 GLN 25 HG2 GLN 25 19.680 11.422 -12.425 160 HG3 GLN 25 HG1 GLN 25 19.812 12.531 -13.787 161 HE21 GLN 25 HE21 GLN 25 18.493 9.934 -13.552 162 HE22 GLN 25 HE22 GLN 25 19.181 8.945 -14.801 163 H HIS 26 HN HIS 26 19.404 14.007 -12.758 164 HA HIS 26 HA HIS 26 19.932 16.777 -13.038 165 HB2 HIS 26 HB2 HIS 26 19.629 16.908 -15.526 166 HB3 HIS 26 HB1 HIS 26 21.165 16.240 -15.008 167 HD1 HIS 26 HD1 HIS 26 17.796 14.583 -15.774 168 HD2 HIS 26 HD2 HIS 26 21.822 14.322 -16.763 169 HE1 HIS 26 HE1 HIS 26 17.962 12.711 -17.441 170 HE2 HIS 26 HE2 HIS 26 20.346 12.791 -18.242 171 H SER 27 HN SER 27 18.053 17.841 -12.846 172 HA SER 27 HA SER 27 15.594 16.351 -13.482 173 HB2 SER 27 HB2 SER 27 15.949 18.235 -11.147 174 HB3 SER 27 HB1 SER 27 14.567 17.190 -11.475 175 HG SER 27 HG SER 27 15.651 15.487 -10.760 176 H LEU 28 HN LEU 28 14.935 17.377 -15.315 177 HA LEU 28 HA LEU 28 14.991 20.227 -15.591 178 HB2 LEU 28 HB2 LEU 28 13.963 17.942 -17.190 179 HB3 LEU 28 HB1 LEU 28 13.181 19.490 -17.444 180 HG LEU 28 HG LEU 28 15.038 18.981 -19.065 181 HD11 LEU 28 HD11 LEU 28 16.042 21.209 -18.924 182 HD12 LEU 28 HD12 LEU 28 15.411 21.397 -17.289 183 HD13 LEU 28 HD13 LEU 28 14.300 21.269 -18.653 184 HD21 LEU 28 HD21 LEU 28 16.766 19.345 -16.620 185 HD22 LEU 28 HD22 LEU 28 17.338 19.235 -18.284 186 HD23 LEU 28 HD23 LEU 28 16.550 17.849 -17.529 187 H TRP 29 HN TRP 29 13.873 21.344 -14.140 188 HA TRP 29 HA TRP 29 11.246 20.304 -13.300 189 HB2 TRP 29 HB2 TRP 29 13.056 20.177 -11.590 190 HB3 TRP 29 HB1 TRP 29 13.225 21.925 -11.678 191 HD1 TRP 29 HD1 TRP 29 11.646 23.343 -10.198 192 HE1 TRP 29 HE1 TRP 29 9.747 22.795 -8.543 193 HE3 TRP 29 HE3 TRP 29 11.063 18.365 -11.244 194 HZ2 TRP 29 HZ2 TRP 29 8.218 20.558 -7.786 195 HZ3 TRP 29 HZ3 TRP 29 9.357 17.096 -10.001 196 HH2 TRP 29 HH2 TRP 29 7.967 18.174 -8.307 197 HA PRO 30 HA PRO 30 9.886 24.252 -14.974 198 HB2 PRO 30 HB2 PRO 30 7.203 23.293 -14.340 199 HB3 PRO 30 HB1 PRO 30 7.921 23.622 -15.918 200 HG2 PRO 30 HG2 PRO 30 7.334 21.116 -15.067 201 HG3 PRO 30 HG1 PRO 30 8.668 21.474 -16.176 202 HD2 PRO 30 HD2 PRO 30 8.747 20.949 -13.227 203 HD3 PRO 30 HD1 PRO 30 9.847 20.382 -14.503 204 H VAL 31 HN VAL 31 9.325 26.138 -13.993 205 HA VAL 31 HA VAL 31 9.319 26.210 -11.135 206 HB VAL 31 HB VAL 31 9.070 28.639 -11.351 207 HG11 VAL 31 HG11 VAL 31 11.125 29.082 -12.630 208 HG12 VAL 31 HG12 VAL 31 11.052 27.446 -13.287 209 HG13 VAL 31 HG13 VAL 31 11.289 27.692 -11.558 210 HG21 VAL 31 HG21 VAL 31 7.518 28.723 -13.219 211 HG22 VAL 31 HG22 VAL 31 8.759 28.098 -14.303 212 HG23 VAL 31 HG23 VAL 31 8.951 29.689 -13.566 213 H PHE 32 HN PHE 32 6.915 25.639 -13.342 214 HA PHE 32 HA PHE 32 4.674 26.880 -12.135 215 HB2 PHE 32 HB2 PHE 32 4.779 25.891 -14.463 216 HB3 PHE 32 HB1 PHE 32 4.718 24.299 -13.719 217 HD1 PHE 32 HD1 PHE 32 2.845 27.458 -14.143 218 HD2 PHE 32 HD2 PHE 32 2.666 23.340 -13.089 219 HE1 PHE 32 HE1 PHE 32 0.389 27.560 -14.173 220 HE2 PHE 32 HE2 PHE 32 0.207 23.438 -13.115 221 HZ PHE 32 HZ PHE 32 -0.933 25.551 -13.658 222 H ALA 33 HN ALA 33 6.564 24.079 -11.425 223 HA ALA 33 HA ALA 33 4.644 23.191 -9.399 224 HB1 ALA 33 HB1 ALA 33 7.169 21.856 -10.374 225 HB2 ALA 33 HB2 ALA 33 5.532 21.470 -10.904 226 HB3 ALA 33 HB3 ALA 33 6.011 21.180 -9.231 227 H ASP 34 HN ASP 34 5.307 22.973 -7.223 228 HA ASP 34 HA ASP 34 6.972 25.129 -6.379 229 HB2 ASP 34 HB2 ASP 34 4.929 24.453 -5.158 230 HB3 ASP 34 HB1 ASP 34 5.711 22.938 -4.717 231 H ILE 35 HN ILE 35 9.008 25.124 -5.628 232 HA ILE 35 HA ILE 35 10.571 22.720 -6.077 233 HB ILE 35 HB ILE 35 11.496 25.503 -5.320 234 HG12 ILE 35 HG12 ILE 35 11.393 24.114 -8.011 235 HG13 ILE 35 HG11 ILE 35 10.425 25.495 -7.517 236 HG21 ILE 35 HG21 ILE 35 13.702 24.743 -6.018 237 HG22 ILE 35 HG22 ILE 35 13.054 23.136 -6.341 238 HG23 ILE 35 HG23 ILE 35 13.084 23.759 -4.692 239 HD11 ILE 35 HD11 ILE 35 13.411 25.480 -7.850 240 HD12 ILE 35 HD12 ILE 35 12.431 26.863 -7.363 241 HD13 ILE 35 HD13 ILE 35 12.238 26.168 -8.973 242 HA PRO 36 HA PRO 36 10.687 21.756 -1.686 243 HB2 PRO 36 HB2 PRO 36 12.276 19.577 -1.912 244 HB3 PRO 36 HB1 PRO 36 10.593 19.561 -2.430 245 HG2 PRO 36 HG2 PRO 36 13.075 19.913 -4.069 246 HG3 PRO 36 HG1 PRO 36 11.663 18.885 -4.380 247 HD2 PRO 36 HD2 PRO 36 12.004 21.307 -5.551 248 HD3 PRO 36 HD1 PRO 36 10.406 20.633 -5.178 249 H ALA 37 HN ALA 37 13.158 20.538 -0.690 250 HA ALA 37 HA ALA 37 15.196 22.569 -1.277 251 HB1 ALA 37 HB1 ALA 37 15.846 22.617 1.067 252 HB2 ALA 37 HB2 ALA 37 14.568 21.466 1.460 253 HB3 ALA 37 HB3 ALA 37 14.152 23.082 0.885 254 H GLY 38 HN GLY 38 17.411 21.833 -0.912 255 HA2 GLY 38 HA2 GLY 38 18.972 20.051 -0.468 256 HA3 GLY 38 HA1 GLY 38 17.693 18.894 -0.814 257 H TRP 39 HN TRP 39 18.382 21.731 -2.742 258 HA TRP 39 HA TRP 39 19.175 19.975 -4.968 259 HB2 TRP 39 HB2 TRP 39 17.744 21.494 -6.423 260 HB3 TRP 39 HB1 TRP 39 16.867 20.406 -5.348 261 HD1 TRP 39 HD1 TRP 39 15.283 21.461 -3.603 262 HE1 TRP 39 HE1 TRP 39 14.577 23.860 -3.007 263 HE3 TRP 39 HE3 TRP 39 18.745 24.041 -6.350 264 HZ2 TRP 39 HZ2 TRP 39 15.379 26.499 -3.618 265 HZ3 TRP 39 HZ3 TRP 39 18.706 26.499 -6.285 266 HH2 TRP 39 HH2 TRP 39 17.059 27.701 -4.948 267 H ARG 40 HN ARG 40 19.781 21.417 -6.915 268 HA ARG 40 HA ARG 40 20.829 24.037 -6.242 269 HB2 ARG 40 HB2 ARG 40 22.737 22.551 -5.798 270 HB3 ARG 40 HB1 ARG 40 22.577 21.852 -7.403 271 HG2 ARG 40 HG2 ARG 40 23.139 23.984 -8.415 272 HG3 ARG 40 HG1 ARG 40 23.245 24.729 -6.819 273 HD2 ARG 40 HD2 ARG 40 25.087 23.245 -6.238 274 HD3 ARG 40 HD1 ARG 40 24.966 22.460 -7.813 275 HE ARG 40 HE ARG 40 25.337 25.038 -8.488 276 HH11 ARG 40 HH11 ARG 40 27.042 22.941 -6.250 277 HH12 ARG 40 HH12 ARG 40 28.578 23.715 -6.507 278 HH21 ARG 40 HH21 ARG 40 27.346 26.086 -8.782 279 HH22 ARG 40 HH22 ARG 40 28.757 25.502 -7.949 280 H VAL 41 HN VAL 41 20.426 25.420 -7.890 281 HA VAL 41 HA VAL 41 19.404 24.329 -10.385 282 HB VAL 41 HB VAL 41 19.642 27.201 -9.447 283 HG11 VAL 41 HG11 VAL 41 18.219 27.757 -11.370 284 HG12 VAL 41 HG12 VAL 41 18.308 26.079 -11.908 285 HG13 VAL 41 HG13 VAL 41 19.764 27.073 -11.875 286 HG21 VAL 41 HG21 VAL 41 17.989 25.901 -8.192 287 HG22 VAL 41 HG22 VAL 41 17.223 25.407 -9.700 288 HG23 VAL 41 HG23 VAL 41 17.203 27.103 -9.216 289 H VAL 42 HN VAL 42 20.679 23.986 -12.090 290 HA VAL 42 HA VAL 42 23.334 25.261 -12.078 291 HB VAL 42 HB VAL 42 23.836 23.392 -13.814 292 HG11 VAL 42 HG11 VAL 42 24.858 23.507 -11.609 293 HG12 VAL 42 HG12 VAL 42 24.423 21.840 -11.988 294 HG13 VAL 42 HG13 VAL 42 23.423 22.784 -10.883 295 HG21 VAL 42 HG21 VAL 42 21.443 22.219 -12.405 296 HG22 VAL 42 HG22 VAL 42 22.547 21.344 -13.466 297 HG23 VAL 42 HG23 VAL 42 21.540 22.639 -14.114 298 H HIS 43 HN HIS 43 20.413 25.660 -13.502 299 HA HIS 43 HA HIS 43 21.397 27.354 -15.553 300 HB2 HIS 43 HB2 HIS 43 21.831 25.108 -16.574 301 HB3 HIS 43 HB1 HIS 43 20.108 24.774 -16.479 302 HD1 HIS 43 HD1 HIS 43 22.660 26.656 -18.433 303 HD2 HIS 43 HD2 HIS 43 18.532 26.127 -18.389 304 HE1 HIS 43 HE1 HIS 43 21.839 27.496 -20.659 305 HE2 HIS 43 HE2 HIS 43 19.332 27.328 -20.528 306 H GLY 44 HN GLY 44 19.785 28.734 -16.263 307 HA2 GLY 44 HA2 GLY 44 17.308 28.556 -14.730 308 HA3 GLY 44 HA1 GLY 44 17.864 29.938 -15.650 309 H GLU 45 HN GLU 45 15.836 30.223 -16.607 310 HA GLU 45 HA GLU 45 14.703 28.016 -18.078 311 HB2 GLU 45 HB2 GLU 45 12.896 29.723 -18.700 312 HB3 GLU 45 HB1 GLU 45 12.992 29.173 -17.039 313 HG2 GLU 45 HG2 GLU 45 12.717 31.382 -16.668 314 HG3 GLU 45 HG1 GLU 45 14.464 31.350 -16.786 315 H ALA 46 HN ALA 46 15.883 27.542 -19.708 316 HA ALA 46 HA ALA 46 15.715 29.353 -22.007 317 HB1 ALA 46 HB1 ALA 46 18.041 29.474 -21.231 318 HB2 ALA 46 HB2 ALA 46 17.933 28.656 -22.789 319 HB3 ALA 46 HB3 ALA 46 18.164 27.716 -21.315 320 H SER 47 HN SER 47 16.046 27.984 -24.088 321 HA SER 47 HA SER 47 13.953 26.351 -24.446 322 HB2 SER 47 HB2 SER 47 16.626 25.896 -25.784 323 HB3 SER 47 HB1 SER 47 15.035 25.492 -26.435 324 HG SER 47 HG SER 47 14.547 27.703 -26.502 325 H ARG 48 HN ARG 48 13.278 24.364 -23.948 326 HA ARG 48 HA ARG 48 14.595 22.972 -21.874 327 HB2 ARG 48 HB2 ARG 48 12.045 23.094 -22.680 328 HB3 ARG 48 HB1 ARG 48 12.487 21.575 -23.447 329 HG2 ARG 48 HG2 ARG 48 12.850 22.160 -20.516 330 HG3 ARG 48 HG1 ARG 48 11.437 21.359 -21.196 331 HD2 ARG 48 HD2 ARG 48 14.281 20.371 -21.374 332 HD3 ARG 48 HD1 ARG 48 13.052 19.765 -20.265 333 HE ARG 48 HE ARG 48 12.796 19.561 -23.203 334 HH11 ARG 48 HH11 ARG 48 12.485 18.195 -19.992 335 HH12 ARG 48 HH12 ARG 48 11.936 16.652 -20.565 336 HH21 ARG 48 HH21 ARG 48 12.051 17.536 -23.949 337 HH22 ARG 48 HH22 ARG 48 11.693 16.279 -22.807 338 H ALA 49 HN ALA 49 14.302 22.368 -25.331 339 HA ALA 49 HA ALA 49 15.538 19.868 -25.453 340 HB1 ALA 49 HB1 ALA 49 16.001 20.372 -27.777 341 HB2 ALA 49 HB2 ALA 49 15.733 22.091 -27.487 342 HB3 ALA 49 HB3 ALA 49 14.392 20.952 -27.347 343 H ALA 50 HN ALA 50 16.955 23.107 -25.428 344 HA ALA 50 HA ALA 50 19.643 22.234 -25.786 345 HB1 ALA 50 HB1 ALA 50 18.923 24.503 -26.364 346 HB2 ALA 50 HB2 ALA 50 20.254 24.524 -25.206 347 HB3 ALA 50 HB3 ALA 50 18.606 24.834 -24.660 348 H CYS 51 HN CYS 51 17.611 22.952 -23.000 349 HA CYS 51 HA CYS 51 19.616 22.725 -21.027 350 HB2 CYS 51 HB2 CYS 51 16.638 22.229 -20.863 351 HB3 CYS 51 HB1 CYS 51 17.710 22.347 -19.471 352 HG CYS 51 HG CYS 51 16.243 24.754 -21.197 353 H LEU 52 HN LEU 52 17.363 20.370 -22.412 354 HA LEU 52 HA LEU 52 18.146 18.149 -20.871 355 HB2 LEU 52 HB2 LEU 52 16.278 18.644 -22.835 356 HB3 LEU 52 HB1 LEU 52 17.396 17.556 -23.633 357 HG LEU 52 HG LEU 52 17.110 15.994 -21.669 358 HD11 LEU 52 HD11 LEU 52 16.279 17.588 -20.060 359 HD12 LEU 52 HD12 LEU 52 15.119 16.281 -20.300 360 HD13 LEU 52 HD13 LEU 52 14.841 17.856 -21.044 361 HD21 LEU 52 HD21 LEU 52 14.941 15.146 -22.455 362 HD22 LEU 52 HD22 LEU 52 16.010 15.579 -23.791 363 HD23 LEU 52 HD23 LEU 52 14.687 16.654 -23.334 364 H ASP 53 HN ASP 53 19.283 19.364 -24.000 365 HA ASP 53 HA ASP 53 21.143 17.319 -24.481 366 HB2 ASP 53 HB2 ASP 53 20.366 19.006 -26.166 367 HB3 ASP 53 HB1 ASP 53 21.388 20.197 -25.368 368 H TYR 54 HN TYR 54 21.421 20.392 -22.771 369 HA TYR 54 HA TYR 54 24.167 20.348 -22.267 370 HB2 TYR 54 HB2 TYR 54 22.817 22.340 -21.863 371 HB3 TYR 54 HB1 TYR 54 21.943 21.515 -20.578 372 HD1 TYR 54 HD1 TYR 54 25.424 22.448 -21.540 373 HD2 TYR 54 HD2 TYR 54 22.644 21.841 -18.372 374 HE1 TYR 54 HE1 TYR 54 27.099 23.235 -19.921 375 HE2 TYR 54 HE2 TYR 54 24.314 22.623 -16.751 376 HH TYR 54 HH TYR 54 26.709 22.848 -16.547 377 H VAL 55 HN VAL 55 21.478 19.122 -20.250 378 HA VAL 55 HA VAL 55 23.225 18.210 -18.193 379 HB VAL 55 HB VAL 55 21.311 17.037 -17.244 380 HG11 VAL 55 HG11 VAL 55 20.594 19.755 -18.320 381 HG12 VAL 55 HG12 VAL 55 21.515 19.423 -16.853 382 HG13 VAL 55 HG13 VAL 55 19.817 18.954 -16.956 383 HG21 VAL 55 HG21 VAL 55 19.872 17.771 -19.793 384 HG22 VAL 55 HG22 VAL 55 19.114 17.096 -18.351 385 HG23 VAL 55 HG23 VAL 55 20.291 16.144 -19.253 386 H GLU 56 HN GLU 56 21.881 16.702 -21.050 387 HA GLU 56 HA GLU 56 22.652 14.050 -20.349 388 HB2 GLU 56 HB2 GLU 56 21.791 15.311 -22.943 389 HB3 GLU 56 HB1 GLU 56 22.144 13.593 -22.775 390 HG2 GLU 56 HG2 GLU 56 20.177 14.966 -20.982 391 HG3 GLU 56 HG1 GLU 56 19.699 14.358 -22.561 392 H LYS 57 HN LYS 57 24.246 16.677 -22.064 393 HA LYS 57 HA LYS 57 26.438 15.032 -22.923 394 HB2 LYS 57 HB2 LYS 57 25.937 17.983 -22.866 395 HB3 LYS 57 HB1 LYS 57 27.568 17.384 -23.136 396 HG2 LYS 57 HG2 LYS 57 26.727 16.071 -25.054 397 HG3 LYS 57 HG1 LYS 57 25.135 16.794 -24.811 398 HD2 LYS 57 HD2 LYS 57 25.998 18.985 -25.272 399 HD3 LYS 57 HD1 LYS 57 27.653 18.375 -25.311 400 HE2 LYS 57 HE2 LYS 57 26.792 18.751 -27.562 401 HE3 LYS 57 HE1 LYS 57 27.136 17.046 -27.279 402 HZ1 LYS 57 HZ1 LYS 57 25.016 17.444 -28.444 403 HZ2 LYS 57 HZ2 LYS 57 24.434 18.276 -27.083 404 HZ3 LYS 57 HZ3 LYS 57 24.807 16.625 -26.975 405 H ASN 58 HN ASN 58 25.516 16.430 -19.980 406 HA ASN 58 HA ASN 58 28.216 16.290 -18.863 407 HB2 ASN 58 HB2 ASN 58 25.623 17.470 -17.965 408 HB3 ASN 58 HB1 ASN 58 26.786 16.984 -16.733 409 HD21 ASN 58 HD21 ASN 58 26.178 19.113 -19.437 410 HD22 ASN 58 HD22 ASN 58 27.463 20.227 -19.095 411 H TRP 59 HN TRP 59 26.299 14.067 -19.745 412 HA TRP 59 HA TRP 59 25.958 12.558 -17.287 413 HB2 TRP 59 HB2 TRP 59 24.312 12.668 -19.294 414 HB3 TRP 59 HB1 TRP 59 25.422 11.551 -20.078 415 HD1 TRP 59 HD1 TRP 59 23.985 11.538 -16.461 416 HE1 TRP 59 HE1 TRP 59 22.928 9.227 -16.050 417 HE3 TRP 59 HE3 TRP 59 24.762 9.464 -21.069 418 HZ2 TRP 59 HZ2 TRP 59 22.485 6.841 -17.493 419 HZ3 TRP 59 HZ3 TRP 59 23.987 7.164 -21.473 420 HH2 TRP 59 HH2 TRP 59 22.872 5.883 -19.720 421 H THR 60 HN THR 60 26.470 9.955 -18.441 422 HA THR 60 HA THR 60 29.349 9.980 -18.080 423 HB THR 60 HB THR 60 28.002 8.363 -16.806 424 HG1 THR 60 HG1 THR 60 29.994 7.546 -18.614 425 HG21 THR 60 HG21 THR 60 27.019 6.415 -17.949 426 HG22 THR 60 HG22 THR 60 27.388 7.157 -19.506 427 HG23 THR 60 HG23 THR 60 26.234 7.924 -18.416 428 H ASP 61 HN ASP 61 27.339 10.189 -20.714 429 HA ASP 61 HA ASP 61 29.092 8.594 -22.439 430 HB2 ASP 61 HB2 ASP 61 26.669 8.202 -22.665 431 HB3 ASP 61 HB1 ASP 61 26.438 9.896 -23.089 432 H LEU 62 HN LEU 62 30.827 9.726 -22.962 433 HA LEU 62 HA LEU 62 30.823 12.578 -23.210 434 HB2 LEU 62 HB2 LEU 62 32.959 10.547 -23.878 435 HB3 LEU 62 HB1 LEU 62 33.197 12.283 -23.820 436 HG LEU 62 HG LEU 62 32.467 10.528 -21.469 437 HD11 LEU 62 HD11 LEU 62 35.044 11.933 -22.171 438 HD12 LEU 62 HD12 LEU 62 34.764 10.191 -22.213 439 HD13 LEU 62 HD13 LEU 62 34.722 11.055 -20.676 440 HD21 LEU 62 HD21 LEU 62 33.077 13.480 -21.608 441 HD22 LEU 62 HD22 LEU 62 32.844 12.548 -20.129 442 HD23 LEU 62 HD23 LEU 62 31.507 12.757 -21.260 443 H ARG 63 HN ARG 63 30.469 13.751 -24.979 444 HA ARG 63 HA ARG 63 30.743 12.469 -27.612 445 HB2 ARG 63 HB2 ARG 63 28.486 14.287 -26.749 446 HB3 ARG 63 HB1 ARG 63 28.730 13.669 -28.377 447 HG2 ARG 63 HG2 ARG 63 28.412 11.387 -27.541 448 HG3 ARG 63 HG1 ARG 63 28.133 12.033 -25.922 449 HD2 ARG 63 HD2 ARG 63 26.224 13.325 -26.806 450 HD3 ARG 63 HD1 ARG 63 26.476 12.574 -28.382 451 HE ARG 63 HE ARG 63 26.182 10.646 -26.281 452 HH11 ARG 63 HH11 ARG 63 24.447 12.725 -28.510 453 HH12 ARG 63 HH12 ARG 63 22.987 11.783 -28.454 454 HH21 ARG 63 HH21 ARG 63 24.272 9.408 -26.201 455 HH22 ARG 63 HH22 ARG 63 22.878 9.906 -27.107 456 HA PRO 64 HA PRO 64 33.159 16.096 -28.539 457 HB2 PRO 64 HB2 PRO 64 32.411 15.551 -31.336 458 HB3 PRO 64 HB1 PRO 64 34.013 15.604 -30.595 459 HG2 PRO 64 HG2 PRO 64 32.877 13.290 -31.373 460 HG3 PRO 64 HG1 PRO 64 33.938 13.390 -29.955 461 HD2 PRO 64 HD2 PRO 64 30.962 13.221 -30.097 462 HD3 PRO 64 HD1 PRO 64 32.083 12.485 -28.933 463 H LYS 65 HN LYS 65 32.599 18.201 -28.694 464 HA LYS 65 HA LYS 65 29.884 18.959 -28.959 465 HB2 LYS 65 HB2 LYS 65 32.453 20.506 -28.797 466 HB3 LYS 65 HB1 LYS 65 30.940 21.328 -29.140 467 HG2 LYS 65 HG2 LYS 65 31.422 21.484 -26.795 468 HG3 LYS 65 HG1 LYS 65 30.017 20.447 -27.029 469 HD2 LYS 65 HD2 LYS 65 31.374 18.471 -26.702 470 HD3 LYS 65 HD1 LYS 65 32.834 19.460 -26.597 471 HE2 LYS 65 HE2 LYS 65 31.982 20.533 -24.584 472 HE3 LYS 65 HE1 LYS 65 30.493 19.596 -24.699 473 HZ1 LYS 65 HZ1 LYS 65 33.178 18.364 -24.413 474 HZ2 LYS 65 HZ2 LYS 65 31.665 17.604 -24.251 475 HZ3 LYS 65 HZ3 LYS 65 32.176 18.733 -23.095 476 H SER 66 HN SER 66 28.910 18.564 -30.858 477 HA SER 66 HA SER 66 30.253 19.408 -33.333 478 HB2 SER 66 HB2 SER 66 27.772 17.700 -33.007 479 HB3 SER 66 HB1 SER 66 28.703 17.941 -34.487 480 HG SER 66 HG SER 66 30.369 17.106 -32.592 481 H LEU 67 HN LEU 67 28.659 21.018 -31.246 482 HA LEU 67 HA LEU 67 26.713 22.203 -33.100 483 HB2 LEU 67 HB2 LEU 67 26.837 22.298 -30.088 484 HB3 LEU 67 HB1 LEU 67 25.690 23.203 -31.058 485 HG LEU 67 HG LEU 67 25.873 20.191 -30.909 486 HD11 LEU 67 HD11 LEU 67 25.022 21.213 -28.856 487 HD12 LEU 67 HD12 LEU 67 23.761 20.326 -29.710 488 HD13 LEU 67 HD13 LEU 67 23.812 22.088 -29.793 489 HD21 LEU 67 HD21 LEU 67 23.798 20.219 -32.210 490 HD22 LEU 67 HD22 LEU 67 25.124 20.967 -33.102 491 HD23 LEU 67 HD23 LEU 67 23.898 21.976 -32.334 492 H ARG 68 HN ARG 68 27.194 24.096 -33.928 493 HA ARG 68 HA ARG 68 29.325 25.702 -32.715 494 HB2 ARG 68 HB2 ARG 68 29.252 24.983 -35.217 495 HB3 ARG 68 HB1 ARG 68 28.022 26.224 -35.384 496 HG2 ARG 68 HG2 ARG 68 30.830 26.704 -34.398 497 HG3 ARG 68 HG1 ARG 68 30.279 26.971 -36.050 498 HD2 ARG 68 HD2 ARG 68 29.423 28.424 -33.555 499 HD3 ARG 68 HD1 ARG 68 30.291 29.077 -34.943 500 HE ARG 68 HE ARG 68 27.795 28.042 -35.765 501 HH11 ARG 68 HH11 ARG 68 29.226 30.778 -34.112 502 HH12 ARG 68 HH12 ARG 68 27.866 31.824 -34.395 503 HH21 ARG 68 HH21 ARG 68 26.006 29.408 -36.134 504 HH22 ARG 68 HH22 ARG 68 26.043 31.046 -35.551 505 H ASP 69 HN ASP 69 28.478 27.014 -31.197 506 HA ASP 69 HA ASP 69 26.843 29.191 -31.925 507 HB2 ASP 69 HB2 ASP 69 25.199 27.134 -31.648 508 HB3 ASP 69 HB1 ASP 69 25.400 27.476 -29.932 509 H ALA 70 HN ALA 70 26.035 30.280 -29.720 510 HA ALA 70 HA ALA 70 27.731 29.780 -27.459 511 HB1 ALA 70 HB1 ALA 70 29.002 31.843 -27.528 512 HB2 ALA 70 HB2 ALA 70 28.253 32.281 -29.064 513 HB3 ALA 70 HB3 ALA 70 29.325 30.883 -28.973 514 H MET 71 HN MET 71 24.884 30.743 -28.663 515 HA MET 71 HA MET 71 24.430 32.710 -26.510 516 HB2 MET 71 HB2 MET 71 24.148 33.653 -28.783 517 HB3 MET 71 HB1 MET 71 22.902 32.456 -29.108 518 HG2 MET 71 HG2 MET 71 21.575 33.381 -27.243 519 HG3 MET 71 HG1 MET 71 22.800 34.629 -27.026 520 HE1 MET 71 HE1 MET 71 21.355 33.045 -30.342 521 HE2 MET 71 HE2 MET 71 20.095 34.215 -30.741 522 HE3 MET 71 HE3 MET 71 19.944 33.220 -29.294 523 H VAL 72 HN VAL 72 23.692 31.513 -24.887 524 HA VAL 72 HA VAL 72 21.012 30.608 -24.975 525 HB VAL 72 HB VAL 72 21.866 28.601 -25.992 526 HG11 VAL 72 HG11 VAL 72 24.208 28.760 -25.397 527 HG12 VAL 72 HG12 VAL 72 23.569 27.185 -24.924 528 HG13 VAL 72 HG13 VAL 72 23.824 28.435 -23.707 529 HG21 VAL 72 HG21 VAL 72 21.331 28.106 -23.066 530 HG22 VAL 72 HG22 VAL 72 21.190 26.915 -24.360 531 HG23 VAL 72 HG23 VAL 72 20.113 28.311 -24.323 532 H GLU 73 HN GLU 73 20.366 31.500 -23.165 533 HA GLU 73 HA GLU 73 20.240 32.210 -21.017 534 HB2 GLU 73 HB2 GLU 73 20.635 29.871 -20.380 535 HB3 GLU 73 HB1 GLU 73 22.369 30.135 -20.468 536 HG2 GLU 73 HG2 GLU 73 22.112 31.857 -18.681 537 HG3 GLU 73 HG1 GLU 73 20.431 31.346 -18.517 538 H ASP 74 HN ASP 74 20.984 34.220 -21.621 539 HA ASP 74 HA ASP 74 23.838 34.723 -21.732 540 HB2 ASP 74 HB2 ASP 74 21.475 36.552 -22.203 541 HB3 ASP 74 HB1 ASP 74 23.161 37.007 -22.432 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 1.699 24.924 -2.885 2 H2 GLY 1 HT2 GLY 1 0.785 24.733 -4.291 3 H3 GLY 1 HT3 GLY 1 2.306 23.987 -4.162 4 HA2 GLY 1 HA1 GLY 1 -0.061 23.360 -2.485 5 HA3 GLY 1 HA2 GLY 1 0.462 22.422 -3.872 6 H SER 2 HN SER 2 3.283 22.683 -3.361 7 HA SER 2 HA SER 2 4.998 21.763 -2.211 8 HB2 SER 2 HB2 SER 2 3.068 21.638 0.118 9 HB3 SER 2 HB1 SER 2 4.801 21.317 0.214 10 HG SER 2 HG SER 2 5.225 23.402 -0.025 11 H HIS 3 HN HIS 3 1.920 20.130 -2.198 12 HA HIS 3 HA HIS 3 3.336 17.570 -2.476 13 HB2 HIS 3 HB2 HIS 3 0.499 18.273 -1.800 14 HB3 HIS 3 HB1 HIS 3 0.860 16.709 -2.519 15 HD1 HIS 3 HD1 HIS 3 -0.137 15.892 -0.138 16 HD2 HIS 3 HD2 HIS 3 3.606 17.700 -0.098 17 HE1 HIS 3 HE1 HIS 3 0.919 15.220 2.048 18 HE2 HIS 3 HE2 HIS 3 3.271 16.130 1.925 19 H MET 4 HN MET 4 4.126 17.898 -4.555 20 HA MET 4 HA MET 4 2.151 18.513 -6.636 21 HB2 MET 4 HB2 MET 4 5.173 18.534 -6.739 22 HB3 MET 4 HB1 MET 4 4.121 18.923 -8.092 23 HG2 MET 4 HG2 MET 4 4.299 20.434 -5.493 24 HG3 MET 4 HG1 MET 4 4.981 20.931 -7.040 25 HE1 MET 4 HE1 MET 4 1.762 21.624 -9.166 26 HE2 MET 4 HE2 MET 4 2.717 20.143 -9.106 27 HE3 MET 4 HE3 MET 4 3.522 21.713 -9.126 28 H SER 5 HN SER 5 1.163 16.571 -6.992 29 HA SER 5 HA SER 5 2.580 14.160 -7.500 30 HB2 SER 5 HB2 SER 5 -0.206 14.952 -8.409 31 HB3 SER 5 HB1 SER 5 0.435 13.311 -8.304 32 HG SER 5 HG SER 5 -0.719 13.638 -6.452 33 H THR 6 HN THR 6 4.061 14.177 -9.068 34 HA THR 6 HA THR 6 4.081 15.852 -11.311 35 HB THR 6 HB THR 6 5.808 14.173 -12.194 36 HG1 THR 6 HG1 THR 6 5.429 13.094 -9.570 37 HG21 THR 6 HG21 THR 6 7.478 14.870 -10.528 38 HG22 THR 6 HG22 THR 6 6.180 15.387 -9.451 39 HG23 THR 6 HG23 THR 6 6.427 16.208 -10.994 40 H ASN 7 HN ASN 7 3.404 15.633 -13.384 41 HA ASN 7 HA ASN 7 1.706 13.307 -13.960 42 HB2 ASN 7 HB2 ASN 7 0.509 15.432 -14.015 43 HB3 ASN 7 HB1 ASN 7 1.695 16.098 -15.129 44 HD21 ASN 7 HD21 ASN 7 0.178 16.566 -16.686 45 HD22 ASN 7 HD22 ASN 7 -0.593 15.335 -17.626 46 HA PRO 8 HA PRO 8 4.869 12.649 -17.137 47 HB2 PRO 8 HB2 PRO 8 5.234 10.033 -16.706 48 HB3 PRO 8 HB1 PRO 8 5.951 11.249 -15.643 49 HG2 PRO 8 HG2 PRO 8 3.673 9.431 -15.155 50 HG3 PRO 8 HG1 PRO 8 4.774 10.197 -13.998 51 HD2 PRO 8 HD2 PRO 8 2.133 11.036 -14.757 52 HD3 PRO 8 HD1 PRO 8 3.238 11.807 -13.602 53 H PHE 9 HN PHE 9 1.686 11.930 -16.810 54 HA PHE 9 HA PHE 9 1.515 9.982 -18.978 55 HB2 PHE 9 HB2 PHE 9 -0.749 11.196 -17.382 56 HB3 PHE 9 HB1 PHE 9 -0.806 9.750 -18.383 57 HD1 PHE 9 HD2 PHE 9 0.900 7.863 -17.675 58 HD2 PHE 9 HD1 PHE 9 -0.528 10.947 -15.116 59 HE1 PHE 9 HE2 PHE 9 1.452 6.486 -15.710 60 HE2 PHE 9 HE1 PHE 9 0.022 9.579 -13.149 61 HZ PHE 9 HZ PHE 9 1.012 7.345 -13.444 62 H ASP 10 HN ASP 10 -0.170 13.008 -18.156 63 HA ASP 10 HA ASP 10 -0.626 13.524 -20.984 64 HB2 ASP 10 HB2 ASP 10 -1.494 15.039 -18.507 65 HB3 ASP 10 HB1 ASP 10 -1.904 15.510 -20.154 66 H ASP 11 HN ASP 11 -0.254 15.908 -21.674 67 HA ASP 11 HA ASP 11 2.530 16.501 -20.911 68 HB2 ASP 11 HB2 ASP 11 2.258 15.641 -23.214 69 HB3 ASP 11 HB1 ASP 11 1.191 16.992 -23.579 70 H ASP 12 HN ASP 12 2.169 18.018 -19.366 71 HA ASP 12 HA ASP 12 0.627 20.403 -19.992 72 HB2 ASP 12 HB2 ASP 12 2.227 19.576 -17.559 73 HB3 ASP 12 HB1 ASP 12 1.473 21.159 -17.720 74 H ASN 13 HN ASN 13 1.605 22.541 -19.961 75 HA ASN 13 HA ASN 13 4.465 22.471 -20.659 76 HB2 ASN 13 HB2 ASN 13 4.165 24.114 -22.364 77 HB3 ASN 13 HB1 ASN 13 2.962 22.862 -22.645 78 HD21 ASN 13 HD21 ASN 13 3.122 25.764 -23.357 79 HD22 ASN 13 HD22 ASN 13 1.625 26.439 -22.789 80 H GLY 14 HN GLY 14 5.568 24.561 -20.401 81 HA2 GLY 14 HA2 GLY 14 4.776 26.829 -19.182 82 HA3 GLY 14 HA1 GLY 14 4.900 25.704 -17.833 83 H ALA 15 HN ALA 15 6.572 27.370 -17.200 84 HA ALA 15 HA ALA 15 9.054 27.299 -18.649 85 HB1 ALA 15 HB1 ALA 15 8.454 28.422 -15.912 86 HB2 ALA 15 HB2 ALA 15 8.360 29.315 -17.433 87 HB3 ALA 15 HB3 ALA 15 9.917 28.709 -16.860 88 H PHE 16 HN PHE 16 10.927 26.272 -18.055 89 HA PHE 16 HA PHE 16 10.765 24.287 -15.899 90 HB2 PHE 16 HB2 PHE 16 12.197 22.872 -17.642 91 HB3 PHE 16 HB1 PHE 16 10.435 22.835 -17.663 92 HD1 PHE 16 HD1 PHE 16 13.243 24.822 -19.097 93 HD2 PHE 16 HD2 PHE 16 9.392 23.129 -19.710 94 HE1 PHE 16 HE1 PHE 16 13.257 25.635 -21.401 95 HE2 PHE 16 HE2 PHE 16 9.397 23.939 -22.028 96 HZ PHE 16 HZ PHE 16 11.338 25.201 -22.880 97 H PHE 17 HN PHE 17 12.706 23.840 -14.861 98 HA PHE 17 HA PHE 17 14.948 25.622 -15.577 99 HB2 PHE 17 HB2 PHE 17 13.840 24.740 -12.934 100 HB3 PHE 17 HB1 PHE 17 15.558 25.073 -13.053 101 HD1 PHE 17 HD2 PHE 17 13.678 27.144 -15.251 102 HD2 PHE 17 HD1 PHE 17 14.894 26.692 -11.203 103 HE1 PHE 17 HE2 PHE 17 13.245 29.532 -14.853 104 HE2 PHE 17 HE1 PHE 17 14.459 29.079 -10.798 105 HZ PHE 17 HZ PHE 17 13.633 30.503 -12.625 106 H VAL 18 HN VAL 18 17.101 24.817 -15.077 107 HA VAL 18 HA VAL 18 17.357 21.939 -15.464 108 HB VAL 18 HB VAL 18 19.527 24.045 -15.267 109 HG11 VAL 18 HG11 VAL 18 19.672 21.194 -16.235 110 HG12 VAL 18 HG12 VAL 18 20.293 21.789 -14.698 111 HG13 VAL 18 HG13 VAL 18 20.995 22.358 -16.212 112 HG21 VAL 18 HG21 VAL 18 19.691 23.848 -17.701 113 HG22 VAL 18 HG22 VAL 18 18.102 24.429 -17.202 114 HG23 VAL 18 HG23 VAL 18 18.310 22.751 -17.703 115 H LEU 19 HN LEU 19 16.920 20.909 -13.590 116 HA LEU 19 HA LEU 19 18.070 22.022 -11.121 117 HB2 LEU 19 HB2 LEU 19 15.569 21.958 -11.323 118 HB3 LEU 19 HB1 LEU 19 15.678 20.209 -11.385 119 HG LEU 19 HG LEU 19 16.690 20.215 -9.126 120 HD11 LEU 19 HD11 LEU 19 16.531 22.293 -7.789 121 HD12 LEU 19 HD12 LEU 19 16.141 23.173 -9.267 122 HD13 LEU 19 HD13 LEU 19 17.711 22.391 -9.097 123 HD21 LEU 19 HD21 LEU 19 14.289 19.886 -9.416 124 HD22 LEU 19 HD22 LEU 19 14.040 21.630 -9.329 125 HD23 LEU 19 HD23 LEU 19 14.641 20.756 -7.922 126 H VAL 20 HN VAL 20 19.532 20.878 -10.083 127 HA VAL 20 HA VAL 20 19.639 17.961 -10.507 128 HB VAL 20 HB VAL 20 21.946 19.838 -9.910 129 HG11 VAL 20 HG11 VAL 20 22.222 17.651 -8.836 130 HG12 VAL 20 HG12 VAL 20 23.387 17.896 -10.138 131 HG13 VAL 20 HG13 VAL 20 21.982 16.861 -10.396 132 HG21 VAL 20 HG21 VAL 20 22.764 19.210 -12.131 133 HG22 VAL 20 HG22 VAL 20 21.199 20.018 -12.211 134 HG23 VAL 20 HG23 VAL 20 21.298 18.267 -12.398 135 H ASN 21 HN ASN 21 19.927 16.695 -8.633 136 HA ASN 21 HA ASN 21 19.580 18.180 -6.104 137 HB2 ASN 21 HB2 ASN 21 18.264 15.595 -6.974 138 HB3 ASN 21 HB1 ASN 21 18.221 16.203 -5.321 139 HD21 ASN 21 HD21 ASN 21 17.106 16.656 -8.571 140 HD22 ASN 21 HD22 ASN 21 15.850 17.779 -8.198 141 H ASP 22 HN ASP 22 19.741 16.095 -4.344 142 HA ASP 22 HA ASP 22 22.537 15.757 -4.153 143 HB2 ASP 22 HB2 ASP 22 22.047 14.478 -2.121 144 HB3 ASP 22 HB1 ASP 22 21.110 15.963 -2.180 145 H GLU 23 HN GLU 23 19.917 13.450 -4.870 146 HA GLU 23 HA GLU 23 21.994 11.669 -5.966 147 HB2 GLU 23 HB2 GLU 23 19.253 11.016 -4.910 148 HB3 GLU 23 HB1 GLU 23 20.243 9.874 -5.806 149 HG2 GLU 23 HG2 GLU 23 22.018 10.500 -3.966 150 HG3 GLU 23 HG1 GLU 23 20.568 10.915 -3.050 151 H ASP 24 HN ASP 24 19.642 13.822 -6.875 152 HA ASP 24 HA ASP 24 18.889 12.347 -9.276 153 HB2 ASP 24 HB2 ASP 24 17.980 15.043 -8.240 154 HB3 ASP 24 HB1 ASP 24 17.385 14.282 -9.715 155 H GLN 25 HN GLN 25 20.275 12.390 -10.870 156 HA GLN 25 HA GLN 25 22.538 14.085 -10.838 157 HB2 GLN 25 HB2 GLN 25 21.597 12.343 -13.119 158 HB3 GLN 25 HB1 GLN 25 23.236 12.902 -12.815 159 HG2 GLN 25 HG2 GLN 25 21.681 11.022 -11.054 160 HG3 GLN 25 HG1 GLN 25 22.921 10.550 -12.212 161 HE21 GLN 25 HE21 GLN 25 22.772 10.181 -9.317 162 HE22 GLN 25 HE22 GLN 25 24.205 10.906 -8.673 163 H HIS 26 HN HIS 26 19.678 13.981 -12.947 164 HA HIS 26 HA HIS 26 19.913 16.800 -13.403 165 HB2 HIS 26 HB2 HIS 26 20.059 16.678 -15.870 166 HB3 HIS 26 HB1 HIS 26 21.509 16.082 -15.080 167 HD1 HIS 26 HD1 HIS 26 22.044 13.559 -15.336 168 HD2 HIS 26 HD2 HIS 26 18.647 14.791 -17.374 169 HE1 HIS 26 HE1 HIS 26 21.533 11.719 -16.961 170 HE2 HIS 26 HE2 HIS 26 19.685 12.650 -18.392 171 H SER 27 HN SER 27 17.939 17.635 -13.556 172 HA SER 27 HA SER 27 15.797 16.046 -14.753 173 HB2 SER 27 HB2 SER 27 15.608 17.299 -11.999 174 HB3 SER 27 HB1 SER 27 14.303 16.470 -12.848 175 HG SER 27 HG SER 27 16.378 14.837 -12.830 176 H LEU 28 HN LEU 28 14.445 17.225 -15.945 177 HA LEU 28 HA LEU 28 14.672 20.122 -15.913 178 HB2 LEU 28 HB2 LEU 28 13.435 18.122 -17.759 179 HB3 LEU 28 HB1 LEU 28 12.811 19.759 -17.766 180 HG LEU 28 HG LEU 28 14.498 19.386 -19.538 181 HD11 LEU 28 HD11 LEU 28 15.856 21.358 -19.065 182 HD12 LEU 28 HD12 LEU 28 15.361 21.298 -17.370 183 HD13 LEU 28 HD13 LEU 28 14.165 21.614 -18.631 184 HD21 LEU 28 HD21 LEU 28 16.855 19.124 -18.934 185 HD22 LEU 28 HD22 LEU 28 15.896 17.742 -18.409 186 HD23 LEU 28 HD23 LEU 28 16.407 18.956 -17.237 187 H TRP 29 HN TRP 29 13.600 21.072 -14.325 188 HA TRP 29 HA TRP 29 11.110 19.820 -13.381 189 HB2 TRP 29 HB2 TRP 29 12.983 19.875 -11.769 190 HB3 TRP 29 HB1 TRP 29 13.045 21.626 -11.910 191 HD1 TRP 29 HD1 TRP 29 11.558 22.976 -10.292 192 HE1 TRP 29 HE1 TRP 29 9.743 22.392 -8.557 193 HE3 TRP 29 HE3 TRP 29 11.006 18.007 -11.353 194 HZ2 TRP 29 HZ2 TRP 29 8.289 20.112 -7.739 195 HZ3 TRP 29 HZ3 TRP 29 9.392 16.693 -10.041 196 HH2 TRP 29 HH2 TRP 29 8.063 17.726 -8.272 197 HA PRO 30 HA PRO 30 8.972 23.405 -14.944 198 HB2 PRO 30 HB2 PRO 30 6.624 22.912 -13.598 199 HB3 PRO 30 HB1 PRO 30 7.071 22.163 -15.133 200 HG2 PRO 30 HG2 PRO 30 7.265 21.069 -12.363 201 HG3 PRO 30 HG1 PRO 30 6.802 20.250 -13.867 202 HD2 PRO 30 HD2 PRO 30 9.249 19.967 -12.764 203 HD3 PRO 30 HD1 PRO 30 8.993 19.937 -14.520 204 H VAL 31 HN VAL 31 8.970 25.408 -14.244 205 HA VAL 31 HA VAL 31 9.876 26.120 -11.672 206 HB VAL 31 HB VAL 31 8.493 27.898 -13.689 207 HG11 VAL 31 HG11 VAL 31 9.842 29.691 -12.716 208 HG12 VAL 31 HG12 VAL 31 10.463 28.562 -11.510 209 HG13 VAL 31 HG13 VAL 31 8.749 28.975 -11.533 210 HG21 VAL 31 HG21 VAL 31 10.727 28.369 -14.560 211 HG22 VAL 31 HG22 VAL 31 10.302 26.665 -14.736 212 HG23 VAL 31 HG23 VAL 31 11.408 27.173 -13.457 213 H PHE 32 HN PHE 32 6.709 25.595 -12.939 214 HA PHE 32 HA PHE 32 5.380 27.076 -10.834 215 HB2 PHE 32 HB2 PHE 32 4.247 25.360 -13.051 216 HB3 PHE 32 HB1 PHE 32 3.299 26.350 -11.946 217 HD1 PHE 32 HD2 PHE 32 3.500 28.815 -12.020 218 HD2 PHE 32 HD1 PHE 32 5.338 26.312 -14.926 219 HE1 PHE 32 HE2 PHE 32 3.760 30.751 -13.516 220 HE2 PHE 32 HE1 PHE 32 5.606 28.241 -16.427 221 HZ PHE 32 HZ PHE 32 4.816 30.465 -15.722 222 H ALA 33 HN ALA 33 6.950 24.290 -10.778 223 HA ALA 33 HA ALA 33 4.994 22.955 -9.035 224 HB1 ALA 33 HB1 ALA 33 6.354 20.935 -9.306 225 HB2 ALA 33 HB2 ALA 33 7.465 21.826 -10.350 226 HB3 ALA 33 HB3 ALA 33 5.797 21.554 -10.860 227 H ASP 34 HN ASP 34 5.385 22.793 -6.917 228 HA ASP 34 HA ASP 34 7.221 24.467 -5.667 229 HB2 ASP 34 HB2 ASP 34 5.766 22.054 -4.573 230 HB3 ASP 34 HB1 ASP 34 6.655 23.206 -3.583 231 H ILE 35 HN ILE 35 9.278 24.296 -5.124 232 HA ILE 35 HA ILE 35 10.691 21.858 -5.886 233 HB ILE 35 HB ILE 35 11.881 24.504 -5.036 234 HG12 ILE 35 HG12 ILE 35 11.238 23.521 -7.826 235 HG13 ILE 35 HG11 ILE 35 10.421 24.833 -6.985 236 HG21 ILE 35 HG21 ILE 35 13.029 22.212 -6.622 237 HG22 ILE 35 HG22 ILE 35 13.398 22.594 -4.940 238 HG23 ILE 35 HG23 ILE 35 13.861 23.716 -6.218 239 HD11 ILE 35 HD11 ILE 35 13.318 24.810 -7.795 240 HD12 ILE 35 HD12 ILE 35 12.474 26.131 -6.988 241 HD13 ILE 35 HD13 ILE 35 12.017 25.662 -8.627 242 HA PRO 36 HA PRO 36 11.073 20.614 -1.606 243 HB2 PRO 36 HB2 PRO 36 12.899 18.644 -2.002 244 HB3 PRO 36 HB1 PRO 36 11.210 18.480 -2.477 245 HG2 PRO 36 HG2 PRO 36 13.584 19.224 -4.150 246 HG3 PRO 36 HG1 PRO 36 12.295 18.056 -4.496 247 HD2 PRO 36 HD2 PRO 36 12.283 20.537 -5.532 248 HD3 PRO 36 HD1 PRO 36 10.783 19.698 -5.079 249 H ALA 37 HN ALA 37 13.597 19.570 -0.632 250 HA ALA 37 HA ALA 37 15.431 21.851 -0.984 251 HB1 ALA 37 HB1 ALA 37 14.879 20.390 1.598 252 HB2 ALA 37 HB2 ALA 37 14.339 22.020 1.198 253 HB3 ALA 37 HB3 ALA 37 16.060 21.679 1.369 254 H GLY 38 HN GLY 38 17.623 21.353 -1.096 255 HA2 GLY 38 HA2 GLY 38 19.440 19.747 -0.807 256 HA3 GLY 38 HA1 GLY 38 18.275 18.465 -1.113 257 H TRP 39 HN TRP 39 18.426 21.455 -2.913 258 HA TRP 39 HA TRP 39 19.172 19.901 -5.300 259 HB2 TRP 39 HB2 TRP 39 17.617 21.464 -6.544 260 HB3 TRP 39 HB1 TRP 39 16.835 20.305 -5.474 261 HD1 TRP 39 HD1 TRP 39 15.424 21.233 -3.494 262 HE1 TRP 39 HE1 TRP 39 14.696 23.583 -2.762 263 HE3 TRP 39 HE3 TRP 39 18.476 24.018 -6.516 264 HZ2 TRP 39 HZ2 TRP 39 15.318 26.254 -3.374 265 HZ3 TRP 39 HZ3 TRP 39 18.336 26.471 -6.374 266 HH2 TRP 39 HH2 TRP 39 16.788 27.564 -4.834 267 H ARG 40 HN ARG 40 19.772 21.340 -7.147 268 HA ARG 40 HA ARG 40 20.841 23.951 -6.446 269 HB2 ARG 40 HB2 ARG 40 22.711 22.429 -6.011 270 HB3 ARG 40 HB1 ARG 40 22.533 21.722 -7.605 271 HG2 ARG 40 HG2 ARG 40 22.994 24.638 -7.488 272 HG3 ARG 40 HG1 ARG 40 24.341 23.591 -7.042 273 HD2 ARG 40 HD2 ARG 40 24.133 22.414 -9.170 274 HD3 ARG 40 HD1 ARG 40 22.773 23.443 -9.615 275 HE ARG 40 HE ARG 40 24.358 25.333 -9.581 276 HH11 ARG 40 HH11 ARG 40 25.632 22.072 -9.898 277 HH12 ARG 40 HH12 ARG 40 27.109 22.596 -10.653 278 HH21 ARG 40 HH21 ARG 40 26.263 26.004 -10.592 279 HH22 ARG 40 HH22 ARG 40 27.479 24.840 -11.042 280 H VAL 41 HN VAL 41 20.334 25.340 -8.025 281 HA VAL 41 HA VAL 41 19.242 24.270 -10.503 282 HB VAL 41 HB VAL 41 19.335 27.121 -9.479 283 HG11 VAL 41 HG11 VAL 41 17.936 25.977 -11.895 284 HG12 VAL 41 HG12 VAL 41 19.317 27.075 -11.911 285 HG13 VAL 41 HG13 VAL 41 17.760 27.626 -11.291 286 HG21 VAL 41 HG21 VAL 41 16.936 26.838 -9.115 287 HG22 VAL 41 HG22 VAL 41 17.870 25.676 -8.173 288 HG23 VAL 41 HG23 VAL 41 17.049 25.160 -9.646 289 H VAL 42 HN VAL 42 20.628 23.858 -12.094 290 HA VAL 42 HA VAL 42 23.230 25.085 -12.157 291 HB VAL 42 HB VAL 42 21.955 23.317 -14.252 292 HG11 VAL 42 HG11 VAL 42 24.844 23.973 -13.689 293 HG12 VAL 42 HG12 VAL 42 23.893 24.539 -15.061 294 HG13 VAL 42 HG13 VAL 42 24.264 22.824 -14.897 295 HG21 VAL 42 HG21 VAL 42 21.949 22.179 -12.116 296 HG22 VAL 42 HG22 VAL 42 23.649 22.577 -11.866 297 HG23 VAL 42 HG23 VAL 42 23.180 21.476 -13.163 298 H HIS 43 HN HIS 43 20.228 25.360 -13.959 299 HA HIS 43 HA HIS 43 21.019 27.964 -14.920 300 HB2 HIS 43 HB2 HIS 43 20.857 25.607 -16.714 301 HB3 HIS 43 HB1 HIS 43 20.107 27.089 -17.295 302 HD1 HIS 43 HD1 HIS 43 23.404 25.485 -16.796 303 HD2 HIS 43 HD2 HIS 43 21.921 29.282 -17.598 304 HE1 HIS 43 HE1 HIS 43 25.378 26.831 -17.577 305 HE2 HIS 43 HE2 HIS 43 24.493 29.188 -17.777 306 H GLY 44 HN GLY 44 19.277 29.240 -15.584 307 HA2 GLY 44 HA2 GLY 44 16.769 28.553 -14.384 308 HA3 GLY 44 HA1 GLY 44 17.130 30.016 -15.285 309 H GLU 45 HN GLU 45 15.045 29.858 -16.264 310 HA GLU 45 HA GLU 45 14.432 27.508 -17.793 311 HB2 GLU 45 HB2 GLU 45 12.481 28.954 -18.621 312 HB3 GLU 45 HB1 GLU 45 12.511 28.495 -16.927 313 HG2 GLU 45 HG2 GLU 45 13.280 30.679 -16.294 314 HG3 GLU 45 HG1 GLU 45 13.443 31.146 -17.980 315 H ALA 46 HN ALA 46 15.827 27.168 -19.329 316 HA ALA 46 HA ALA 46 16.017 29.146 -21.504 317 HB1 ALA 46 HB1 ALA 46 18.186 28.156 -22.074 318 HB2 ALA 46 HB2 ALA 46 18.042 27.046 -20.712 319 HB3 ALA 46 HB3 ALA 46 18.187 28.780 -20.424 320 H SER 47 HN SER 47 16.394 28.041 -23.668 321 HA SER 47 HA SER 47 14.280 26.648 -24.543 322 HB2 SER 47 HB2 SER 47 17.099 26.153 -25.528 323 HB3 SER 47 HB1 SER 47 15.611 25.890 -26.439 324 HG SER 47 HG SER 47 16.718 28.347 -25.548 325 H ARG 48 HN ARG 48 13.408 24.686 -24.416 326 HA ARG 48 HA ARG 48 14.162 22.884 -22.431 327 HB2 ARG 48 HB2 ARG 48 11.886 22.979 -23.159 328 HB3 ARG 48 HB1 ARG 48 12.331 22.552 -24.809 329 HG2 ARG 48 HG2 ARG 48 11.341 20.650 -23.779 330 HG3 ARG 48 HG1 ARG 48 13.066 20.328 -23.967 331 HD2 ARG 48 HD2 ARG 48 13.091 19.798 -21.810 332 HD3 ARG 48 HD1 ARG 48 12.863 21.513 -21.473 333 HE ARG 48 HE ARG 48 10.393 20.965 -21.551 334 HH11 ARG 48 HH11 ARG 48 12.781 18.538 -20.742 335 HH12 ARG 48 HH12 ARG 48 11.719 17.645 -19.695 336 HH21 ARG 48 HH21 ARG 48 8.973 19.782 -20.170 337 HH22 ARG 48 HH22 ARG 48 9.566 18.349 -19.385 338 H ALA 49 HN ALA 49 14.632 22.672 -25.961 339 HA ALA 49 HA ALA 49 15.764 20.092 -25.992 340 HB1 ALA 49 HB1 ALA 49 16.211 22.381 -27.903 341 HB2 ALA 49 HB2 ALA 49 14.926 21.174 -28.007 342 HB3 ALA 49 HB3 ALA 49 16.610 20.691 -28.212 343 H ALA 50 HN ALA 50 17.230 23.293 -25.736 344 HA ALA 50 HA ALA 50 19.920 22.464 -25.793 345 HB1 ALA 50 HB1 ALA 50 20.433 24.672 -24.909 346 HB2 ALA 50 HB2 ALA 50 18.735 24.916 -24.498 347 HB3 ALA 50 HB3 ALA 50 19.222 24.776 -26.187 348 H CYS 51 HN CYS 51 17.623 22.908 -23.145 349 HA CYS 51 HA CYS 51 19.454 22.516 -21.041 350 HB2 CYS 51 HB2 CYS 51 16.468 22.086 -21.152 351 HB3 CYS 51 HB1 CYS 51 17.425 22.030 -19.676 352 HG CYS 51 HG CYS 51 16.366 24.681 -21.445 353 H LEU 52 HN LEU 52 17.285 20.223 -22.725 354 HA LEU 52 HA LEU 52 18.020 17.945 -21.268 355 HB2 LEU 52 HB2 LEU 52 16.820 18.439 -23.934 356 HB3 LEU 52 HB1 LEU 52 17.498 16.846 -23.656 357 HG LEU 52 HG LEU 52 15.095 16.887 -23.189 358 HD11 LEU 52 HD11 LEU 52 16.541 15.367 -21.916 359 HD12 LEU 52 HD12 LEU 52 15.141 15.890 -20.981 360 HD13 LEU 52 HD13 LEU 52 16.726 16.599 -20.670 361 HD21 LEU 52 HD21 LEU 52 14.899 19.237 -22.546 362 HD22 LEU 52 HD22 LEU 52 15.777 18.900 -21.054 363 HD23 LEU 52 HD23 LEU 52 14.198 18.169 -21.330 364 H ASP 53 HN ASP 53 19.386 19.253 -24.280 365 HA ASP 53 HA ASP 53 21.364 17.331 -24.708 366 HB2 ASP 53 HB2 ASP 53 20.738 19.168 -26.283 367 HB3 ASP 53 HB1 ASP 53 21.557 20.312 -25.230 368 H TYR 54 HN TYR 54 21.425 20.292 -22.824 369 HA TYR 54 HA TYR 54 24.073 20.246 -21.946 370 HB2 TYR 54 HB2 TYR 54 22.507 22.177 -21.834 371 HB3 TYR 54 HB1 TYR 54 21.639 21.366 -20.539 372 HD1 TYR 54 HD2 TYR 54 22.585 21.236 -18.300 373 HD2 TYR 54 HD1 TYR 54 24.660 23.204 -21.448 374 HE1 TYR 54 HE2 TYR 54 24.049 22.320 -16.650 375 HE2 TYR 54 HE1 TYR 54 26.128 24.300 -19.807 376 HH TYR 54 HH TYR 54 26.397 23.323 -16.644 377 H VAL 55 HN VAL 55 21.114 19.030 -20.328 378 HA VAL 55 HA VAL 55 22.494 18.250 -17.974 379 HB VAL 55 HB VAL 55 20.471 17.070 -17.297 380 HG11 VAL 55 HG11 VAL 55 20.596 19.484 -16.996 381 HG12 VAL 55 HG12 VAL 55 18.939 18.953 -17.293 382 HG13 VAL 55 HG13 VAL 55 19.864 19.719 -18.584 383 HG21 VAL 55 HG21 VAL 55 19.418 17.698 -20.053 384 HG22 VAL 55 HG22 VAL 55 18.490 17.003 -18.723 385 HG23 VAL 55 HG23 VAL 55 19.825 16.095 -19.437 386 H GLU 56 HN GLU 56 21.688 16.550 -20.933 387 HA GLU 56 HA GLU 56 22.349 13.959 -19.941 388 HB2 GLU 56 HB2 GLU 56 22.148 15.004 -22.769 389 HB3 GLU 56 HB1 GLU 56 22.308 13.307 -22.335 390 HG2 GLU 56 HG2 GLU 56 20.078 14.933 -21.207 391 HG3 GLU 56 HG1 GLU 56 19.966 14.301 -22.840 392 H LYS 57 HN LYS 57 24.100 16.359 -21.921 393 HA LYS 57 HA LYS 57 26.462 14.780 -22.123 394 HB2 LYS 57 HB2 LYS 57 25.923 17.705 -22.571 395 HB3 LYS 57 HB1 LYS 57 27.521 16.999 -22.777 396 HG2 LYS 57 HG2 LYS 57 26.752 15.574 -24.523 397 HG3 LYS 57 HG1 LYS 57 25.072 16.031 -24.232 398 HD2 LYS 57 HD2 LYS 57 25.562 18.316 -24.912 399 HD3 LYS 57 HD1 LYS 57 27.258 17.893 -25.156 400 HE2 LYS 57 HE2 LYS 57 26.772 16.544 -27.005 401 HE3 LYS 57 HE1 LYS 57 25.056 16.459 -26.602 402 HZ1 LYS 57 HZ1 LYS 57 26.482 18.903 -27.504 403 HZ2 LYS 57 HZ2 LYS 57 24.834 18.786 -27.138 404 HZ3 LYS 57 HZ3 LYS 57 25.465 17.945 -28.466 405 H ASN 58 HN ASN 58 25.247 16.915 -19.685 406 HA ASN 58 HA ASN 58 27.818 17.157 -18.357 407 HB2 ASN 58 HB2 ASN 58 25.066 18.214 -17.801 408 HB3 ASN 58 HB1 ASN 58 26.264 18.193 -16.513 409 HD21 ASN 58 HD21 ASN 58 27.074 18.686 -19.878 410 HD22 ASN 58 HD22 ASN 58 27.525 20.347 -19.723 411 H TRP 59 HN TRP 59 25.939 14.630 -18.721 412 HA TRP 59 HA TRP 59 26.252 13.698 -15.948 413 HB2 TRP 59 HB2 TRP 59 23.930 13.640 -16.700 414 HB3 TRP 59 HB1 TRP 59 24.392 12.710 -18.122 415 HD1 TRP 59 HD1 TRP 59 24.725 12.252 -14.273 416 HE1 TRP 59 HE1 TRP 59 24.222 9.784 -13.730 417 HE3 TRP 59 HE3 TRP 59 23.917 10.532 -19.018 418 HZ2 TRP 59 HZ2 TRP 59 23.576 7.426 -15.135 419 HZ3 TRP 59 HZ3 TRP 59 23.365 8.155 -19.332 420 HH2 TRP 59 HH2 TRP 59 23.198 6.635 -17.429 421 H THR 60 HN THR 60 26.034 12.120 -19.126 422 HA THR 60 HA THR 60 28.726 11.123 -18.983 423 HB THR 60 HB THR 60 26.432 9.145 -18.818 424 HG1 THR 60 HG1 THR 60 27.816 10.370 -16.887 425 HG21 THR 60 HG21 THR 60 28.231 8.333 -20.247 426 HG22 THR 60 HG22 THR 60 28.195 7.434 -18.731 427 HG23 THR 60 HG23 THR 60 29.413 8.683 -18.984 428 H ASP 61 HN ASP 61 29.461 10.891 -21.042 429 HA ASP 61 HA ASP 61 27.417 10.779 -23.164 430 HB2 ASP 61 HB2 ASP 61 28.516 12.429 -24.428 431 HB3 ASP 61 HB1 ASP 61 28.565 13.057 -22.783 432 H LEU 62 HN LEU 62 28.430 10.214 -25.305 433 HA LEU 62 HA LEU 62 30.760 8.461 -25.094 434 HB2 LEU 62 HB2 LEU 62 29.719 6.690 -26.341 435 HB3 LEU 62 HB1 LEU 62 28.743 7.021 -24.925 436 HG LEU 62 HG LEU 62 28.071 8.084 -27.673 437 HD11 LEU 62 HD11 LEU 62 27.053 5.595 -26.312 438 HD12 LEU 62 HD12 LEU 62 28.099 5.647 -27.732 439 HD13 LEU 62 HD13 LEU 62 26.449 6.267 -27.824 440 HD21 LEU 62 HD21 LEU 62 25.845 8.385 -26.726 441 HD22 LEU 62 HD22 LEU 62 27.045 9.281 -25.795 442 HD23 LEU 62 HD23 LEU 62 26.407 7.757 -25.176 443 H ARG 63 HN ARG 63 29.973 11.147 -26.157 444 HA ARG 63 HA ARG 63 31.302 11.077 -28.671 445 HB2 ARG 63 HB2 ARG 63 28.973 10.222 -29.237 446 HB3 ARG 63 HB1 ARG 63 28.369 11.803 -28.766 447 HG2 ARG 63 HG2 ARG 63 29.637 12.855 -30.534 448 HG3 ARG 63 HG1 ARG 63 30.356 11.300 -30.972 449 HD2 ARG 63 HD2 ARG 63 28.065 10.441 -31.428 450 HD3 ARG 63 HD1 ARG 63 27.446 12.068 -31.144 451 HE ARG 63 HE ARG 63 29.300 12.491 -33.039 452 HH11 ARG 63 HH11 ARG 63 26.683 10.181 -32.787 453 HH12 ARG 63 HH12 ARG 63 26.433 10.078 -34.501 454 HH21 ARG 63 HH21 ARG 63 28.983 12.356 -35.297 455 HH22 ARG 63 HH22 ARG 63 27.718 11.335 -35.927 456 HA PRO 64 HA PRO 64 31.553 14.881 -26.194 457 HB2 PRO 64 HB2 PRO 64 34.209 15.187 -27.342 458 HB3 PRO 64 HB1 PRO 64 33.745 14.913 -25.662 459 HG2 PRO 64 HG2 PRO 64 35.008 13.041 -27.164 460 HG3 PRO 64 HG1 PRO 64 33.886 12.635 -25.853 461 HD2 PRO 64 HD2 PRO 64 33.420 12.664 -28.808 462 HD3 PRO 64 HD1 PRO 64 32.869 11.493 -27.591 463 H LYS 65 HN LYS 65 30.074 16.037 -27.430 464 HA LYS 65 HA LYS 65 31.025 17.469 -29.771 465 HB2 LYS 65 HB2 LYS 65 28.653 16.687 -29.584 466 HB3 LYS 65 HB1 LYS 65 28.435 17.790 -28.232 467 HG2 LYS 65 HG2 LYS 65 27.516 18.806 -30.183 468 HG3 LYS 65 HG1 LYS 65 28.995 19.671 -29.762 469 HD2 LYS 65 HD2 LYS 65 30.220 18.514 -31.483 470 HD3 LYS 65 HD1 LYS 65 28.825 17.496 -31.844 471 HE2 LYS 65 HE2 LYS 65 28.991 19.213 -33.515 472 HE3 LYS 65 HE1 LYS 65 27.578 19.532 -32.511 473 HZ1 LYS 65 HZ1 LYS 65 30.220 20.863 -32.220 474 HZ2 LYS 65 HZ2 LYS 65 28.818 21.214 -31.327 475 HZ3 LYS 65 HZ3 LYS 65 28.867 21.535 -32.991 476 H SER 66 HN SER 66 32.161 19.285 -29.588 477 HA SER 66 HA SER 66 32.970 20.431 -27.214 478 HB2 SER 66 HB2 SER 66 32.729 21.930 -29.824 479 HB3 SER 66 HB1 SER 66 33.900 22.192 -28.534 480 HG SER 66 HG SER 66 35.009 20.993 -29.959 481 H LEU 67 HN LEU 67 31.747 21.339 -25.704 482 HA LEU 67 HA LEU 67 29.433 22.930 -26.555 483 HB2 LEU 67 HB2 LEU 67 28.467 22.520 -24.353 484 HB3 LEU 67 HB1 LEU 67 28.813 21.023 -25.190 485 HG LEU 67 HG LEU 67 30.664 22.143 -23.087 486 HD11 LEU 67 HD11 LEU 67 28.367 20.223 -22.723 487 HD12 LEU 67 HD12 LEU 67 28.465 21.862 -22.080 488 HD13 LEU 67 HD13 LEU 67 29.579 20.621 -21.506 489 HD21 LEU 67 HD21 LEU 67 31.573 20.417 -24.591 490 HD22 LEU 67 HD22 LEU 67 30.249 19.345 -24.140 491 HD23 LEU 67 HD23 LEU 67 31.431 19.842 -22.932 492 H ARG 68 HN ARG 68 29.966 24.987 -26.665 493 HA ARG 68 HA ARG 68 30.876 26.285 -24.232 494 HB2 ARG 68 HB2 ARG 68 32.975 25.931 -25.426 495 HB3 ARG 68 HB1 ARG 68 32.297 26.640 -26.883 496 HG2 ARG 68 HG2 ARG 68 32.224 28.804 -25.894 497 HG3 ARG 68 HG1 ARG 68 32.609 28.150 -24.303 498 HD2 ARG 68 HD2 ARG 68 34.453 28.025 -26.690 499 HD3 ARG 68 HD1 ARG 68 34.533 29.259 -25.434 500 HE ARG 68 HE ARG 68 34.969 26.375 -24.944 501 HH11 ARG 68 HH11 ARG 68 35.739 29.743 -24.346 502 HH12 ARG 68 HH12 ARG 68 36.885 29.386 -23.085 503 HH21 ARG 68 HH21 ARG 68 36.482 25.902 -23.328 504 HH22 ARG 68 HH22 ARG 68 37.309 27.194 -22.499 505 H ASP 69 HN ASP 69 29.365 27.719 -23.846 506 HA ASP 69 HA ASP 69 28.378 29.412 -26.030 507 HB2 ASP 69 HB2 ASP 69 26.828 27.381 -25.263 508 HB3 ASP 69 HB1 ASP 69 26.439 28.485 -23.949 509 H ALA 70 HN ALA 70 26.882 31.182 -24.845 510 HA ALA 70 HA ALA 70 28.641 32.543 -23.048 511 HB1 ALA 70 HB1 ALA 70 25.798 33.217 -23.806 512 HB2 ALA 70 HB2 ALA 70 27.243 33.760 -24.659 513 HB3 ALA 70 HB3 ALA 70 26.943 34.291 -23.004 514 H MET 71 HN MET 71 28.899 31.478 -21.156 515 HA MET 71 HA MET 71 26.492 30.683 -19.666 516 HB2 MET 71 HB2 MET 71 27.921 29.228 -18.366 517 HB3 MET 71 HB1 MET 71 28.203 28.931 -20.075 518 HG2 MET 71 HG2 MET 71 30.222 30.344 -19.951 519 HG3 MET 71 HG1 MET 71 29.952 30.531 -18.220 520 HE1 MET 71 HE1 MET 71 30.849 28.055 -21.121 521 HE2 MET 71 HE2 MET 71 29.391 27.332 -20.445 522 HE3 MET 71 HE3 MET 71 30.944 26.516 -20.268 523 H VAL 72 HN VAL 72 28.936 33.037 -19.763 524 HA VAL 72 HA VAL 72 28.603 33.669 -16.934 525 HB VAL 72 HB VAL 72 30.888 33.710 -17.727 526 HG11 VAL 72 HG11 VAL 72 30.546 34.197 -20.070 527 HG12 VAL 72 HG12 VAL 72 31.674 35.358 -19.369 528 HG13 VAL 72 HG13 VAL 72 30.002 35.827 -19.680 529 HG21 VAL 72 HG21 VAL 72 31.539 35.959 -17.002 530 HG22 VAL 72 HG22 VAL 72 30.298 35.262 -15.962 531 HG23 VAL 72 HG23 VAL 72 29.863 36.486 -17.154 532 H GLU 73 HN GLU 73 26.853 34.779 -16.465 533 HA GLU 73 HA GLU 73 26.263 37.149 -18.106 534 HB2 GLU 73 HB2 GLU 73 23.952 37.016 -17.409 535 HB3 GLU 73 HB1 GLU 73 24.427 35.472 -18.097 536 HG2 GLU 73 HG2 GLU 73 24.401 35.993 -15.139 537 HG3 GLU 73 HG1 GLU 73 22.993 35.406 -16.020 538 H ASP 74 HN ASP 74 25.215 38.923 -16.745 539 HA ASP 74 HA ASP 74 26.889 39.310 -14.397 540 HB2 ASP 74 HB2 ASP 74 25.010 41.208 -15.826 541 HB3 ASP 74 HB1 ASP 74 26.011 41.638 -14.445 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 -14.931 28.277 -3.974 2 H2 GLY 1 HT2 GLY 1 -13.714 27.689 -2.954 3 H3 GLY 1 HT3 GLY 1 -15.344 27.456 -2.548 4 HA2 GLY 1 HA1 GLY 1 -13.939 26.258 -4.873 5 HA3 GLY 1 HA2 GLY 1 -14.401 25.411 -3.401 6 H SER 2 HN SER 2 -15.718 27.248 -6.127 7 HA SER 2 HA SER 2 -18.379 26.227 -5.663 8 HB2 SER 2 HB2 SER 2 -17.349 27.798 -8.035 9 HB3 SER 2 HB1 SER 2 -19.026 27.628 -7.511 10 HG SER 2 HG SER 2 -18.717 29.062 -5.974 11 H HIS 3 HN HIS 3 -19.221 24.438 -6.550 12 HA HIS 3 HA HIS 3 -17.693 22.788 -8.301 13 HB2 HIS 3 HB2 HIS 3 -19.269 21.783 -6.737 14 HB3 HIS 3 HB1 HIS 3 -20.610 22.628 -7.501 15 HD1 HIS 3 HD1 HIS 3 -21.801 21.401 -9.299 16 HD2 HIS 3 HD2 HIS 3 -18.037 19.805 -8.528 17 HE1 HIS 3 HE1 HIS 3 -21.641 19.318 -10.714 18 HE2 HIS 3 HE2 HIS 3 -19.311 18.430 -10.313 19 H MET 4 HN MET 4 -17.242 24.243 -10.010 20 HA MET 4 HA MET 4 -19.465 24.464 -11.931 21 HB2 MET 4 HB2 MET 4 -17.157 26.377 -11.516 22 HB3 MET 4 HB1 MET 4 -18.290 26.471 -12.855 23 HG2 MET 4 HG2 MET 4 -20.115 26.878 -11.308 24 HG3 MET 4 HG1 MET 4 -19.014 26.711 -9.943 25 HE1 MET 4 HE1 MET 4 -19.870 30.543 -9.963 26 HE2 MET 4 HE2 MET 4 -19.848 29.066 -9.000 27 HE3 MET 4 HE3 MET 4 -20.943 29.206 -10.375 28 H SER 5 HN SER 5 -18.953 22.506 -12.890 29 HA SER 5 HA SER 5 -16.326 21.761 -13.627 30 HB2 SER 5 HB2 SER 5 -18.975 20.724 -14.665 31 HB3 SER 5 HB1 SER 5 -17.412 19.913 -14.807 32 HG SER 5 HG SER 5 -17.354 19.940 -12.453 33 H THR 6 HN THR 6 -15.318 23.194 -14.858 34 HA THR 6 HA THR 6 -15.956 23.348 -17.656 35 HB THR 6 HB THR 6 -15.640 25.989 -17.426 36 HG1 THR 6 HG1 THR 6 -16.354 25.130 -14.906 37 HG21 THR 6 HG21 THR 6 -17.502 24.926 -18.582 38 HG22 THR 6 HG22 THR 6 -18.074 26.256 -17.579 39 HG23 THR 6 HG23 THR 6 -18.287 24.592 -17.037 40 H ASN 7 HN ASN 7 -14.124 24.008 -18.874 41 HA ASN 7 HA ASN 7 -11.664 24.144 -17.256 42 HB2 ASN 7 HB2 ASN 7 -11.886 22.242 -18.878 43 HB3 ASN 7 HB1 ASN 7 -11.914 23.421 -20.186 44 HD21 ASN 7 HD21 ASN 7 -10.041 22.588 -21.102 45 HD22 ASN 7 HD22 ASN 7 -8.479 22.840 -20.394 46 HA PRO 8 HA PRO 8 -11.945 28.340 -18.854 47 HB2 PRO 8 HB2 PRO 8 -10.553 29.309 -16.587 48 HB3 PRO 8 HB1 PRO 8 -12.295 29.318 -16.855 49 HG2 PRO 8 HG2 PRO 8 -10.945 27.828 -14.919 50 HG3 PRO 8 HG1 PRO 8 -12.612 27.568 -15.455 51 HD2 PRO 8 HD2 PRO 8 -10.122 26.122 -16.231 52 HD3 PRO 8 HD1 PRO 8 -11.780 25.508 -16.049 53 H PHE 9 HN PHE 9 -9.135 26.505 -18.065 54 HA PHE 9 HA PHE 9 -7.432 28.621 -19.192 55 HB2 PHE 9 HB2 PHE 9 -5.566 27.650 -17.928 56 HB3 PHE 9 HB1 PHE 9 -6.874 28.155 -16.868 57 HD1 PHE 9 HD2 PHE 9 -8.219 26.518 -15.685 58 HD2 PHE 9 HD1 PHE 9 -4.992 25.317 -18.191 59 HE1 PHE 9 HE2 PHE 9 -8.263 24.280 -14.667 60 HE2 PHE 9 HE1 PHE 9 -5.033 23.079 -17.173 61 HZ PHE 9 HZ PHE 9 -6.668 22.557 -15.409 62 H ASP 10 HN ASP 10 -5.555 27.913 -20.392 63 HA ASP 10 HA ASP 10 -5.860 25.270 -21.654 64 HB2 ASP 10 HB2 ASP 10 -6.519 27.077 -23.233 65 HB3 ASP 10 HB1 ASP 10 -4.944 27.830 -23.005 66 H ASP 11 HN ASP 11 -3.845 24.282 -22.275 67 HA ASP 11 HA ASP 11 -1.742 24.682 -20.436 68 HB2 ASP 11 HB2 ASP 11 -2.020 22.494 -21.378 69 HB3 ASP 11 HB1 ASP 11 -1.867 23.110 -23.019 70 H ASP 12 HN ASP 12 -1.105 26.823 -20.529 71 HA ASP 12 HA ASP 12 0.140 27.853 -22.926 72 HB2 ASP 12 HB2 ASP 12 0.651 29.825 -21.614 73 HB3 ASP 12 HB1 ASP 12 -1.014 29.359 -21.283 74 H ASN 13 HN ASN 13 2.436 28.405 -22.987 75 HA ASN 13 HA ASN 13 3.956 26.143 -22.160 76 HB2 ASN 13 HB2 ASN 13 4.786 28.706 -23.515 77 HB3 ASN 13 HB1 ASN 13 5.893 27.380 -23.180 78 HD21 ASN 13 HD21 ASN 13 5.606 25.406 -24.279 79 HD22 ASN 13 HD22 ASN 13 4.723 25.324 -25.763 80 H GLY 14 HN GLY 14 3.956 26.074 -19.955 81 HA2 GLY 14 HA2 GLY 14 4.929 28.242 -18.356 82 HA3 GLY 14 HA1 GLY 14 4.643 26.591 -17.815 83 H ALA 15 HN ALA 15 6.950 28.738 -17.855 84 HA ALA 15 HA ALA 15 9.106 27.543 -19.209 85 HB1 ALA 15 HB1 ALA 15 10.521 29.042 -17.907 86 HB2 ALA 15 HB2 ALA 15 9.165 29.406 -16.844 87 HB3 ALA 15 HB3 ALA 15 9.110 29.889 -18.535 88 H PHE 16 HN PHE 16 11.018 26.612 -18.230 89 HA PHE 16 HA PHE 16 10.531 25.025 -15.814 90 HB2 PHE 16 HB2 PHE 16 11.804 23.173 -17.275 91 HB3 PHE 16 HB1 PHE 16 10.051 23.317 -17.296 92 HD1 PHE 16 HD1 PHE 16 12.943 24.933 -18.977 93 HD2 PHE 16 HD2 PHE 16 9.084 23.194 -19.382 94 HE1 PHE 16 HE1 PHE 16 13.013 25.362 -21.374 95 HE2 PHE 16 HE2 PHE 16 9.143 23.615 -21.806 96 HZ PHE 16 HZ PHE 16 11.110 24.704 -22.812 97 H PHE 17 HN PHE 17 12.446 24.406 -14.732 98 HA PHE 17 HA PHE 17 14.797 25.956 -15.602 99 HB2 PHE 17 HB2 PHE 17 13.703 25.354 -12.851 100 HB3 PHE 17 HB1 PHE 17 15.398 25.770 -13.069 101 HD1 PHE 17 HD2 PHE 17 12.535 27.221 -14.934 102 HD2 PHE 17 HD1 PHE 17 15.478 27.796 -11.915 103 HE1 PHE 17 HE2 PHE 17 11.956 29.610 -14.831 104 HE2 PHE 17 HE1 PHE 17 14.899 30.182 -11.802 105 HZ PHE 17 HZ PHE 17 13.139 31.095 -13.264 106 H VAL 18 HN VAL 18 16.896 25.070 -15.074 107 HA VAL 18 HA VAL 18 16.976 22.184 -15.393 108 HB VAL 18 HB VAL 18 19.332 24.036 -15.014 109 HG11 VAL 18 HG11 VAL 18 19.863 21.694 -14.719 110 HG12 VAL 18 HG12 VAL 18 20.553 22.275 -16.235 111 HG13 VAL 18 HG13 VAL 18 19.087 21.295 -16.253 112 HG21 VAL 18 HG21 VAL 18 19.507 24.095 -17.473 113 HG22 VAL 18 HG22 VAL 18 18.037 24.867 -16.881 114 HG23 VAL 18 HG23 VAL 18 17.962 23.253 -17.585 115 H LEU 19 HN LEU 19 16.414 21.165 -13.540 116 HA LEU 19 HA LEU 19 17.599 22.139 -11.030 117 HB2 LEU 19 HB2 LEU 19 15.099 22.138 -11.276 118 HB3 LEU 19 HB1 LEU 19 15.167 20.390 -11.376 119 HG LEU 19 HG LEU 19 16.212 20.377 -9.096 120 HD11 LEU 19 HD11 LEU 19 17.099 22.594 -8.986 121 HD12 LEU 19 HD12 LEU 19 15.863 22.436 -7.738 122 HD13 LEU 19 HD13 LEU 19 15.504 23.299 -9.228 123 HD21 LEU 19 HD21 LEU 19 13.854 19.889 -9.390 124 HD22 LEU 19 HD22 LEU 19 13.473 21.611 -9.361 125 HD23 LEU 19 HD23 LEU 19 14.104 20.821 -7.915 126 H VAL 20 HN VAL 20 19.050 20.884 -10.028 127 HA VAL 20 HA VAL 20 19.062 18.013 -10.699 128 HB VAL 20 HB VAL 20 21.405 19.753 -9.897 129 HG11 VAL 20 HG11 VAL 20 21.598 17.524 -8.919 130 HG12 VAL 20 HG12 VAL 20 22.780 17.749 -10.209 131 HG13 VAL 20 HG13 VAL 20 21.323 16.798 -10.503 132 HG21 VAL 20 HG21 VAL 20 20.770 18.326 -12.481 133 HG22 VAL 20 HG22 VAL 20 22.260 19.203 -12.132 134 HG23 VAL 20 HG23 VAL 20 20.726 20.070 -12.213 135 H ASN 21 HN ASN 21 18.755 16.642 -9.099 136 HA ASN 21 HA ASN 21 18.643 17.662 -6.346 137 HB2 ASN 21 HB2 ASN 21 16.624 16.504 -7.161 138 HB3 ASN 21 HB1 ASN 21 17.583 15.080 -7.540 139 HD21 ASN 21 HD21 ASN 21 16.422 13.738 -6.197 140 HD22 ASN 21 HD22 ASN 21 16.499 13.837 -4.472 141 H ASP 22 HN ASP 22 19.627 16.409 -4.639 142 HA ASP 22 HA ASP 22 22.290 15.743 -5.145 143 HB2 ASP 22 HB2 ASP 22 21.493 16.398 -2.923 144 HB3 ASP 22 HB1 ASP 22 20.576 14.899 -2.800 145 H GLU 23 HN GLU 23 19.455 13.664 -4.834 146 HA GLU 23 HA GLU 23 21.097 11.315 -5.463 147 HB2 GLU 23 HB2 GLU 23 18.200 11.475 -4.614 148 HB3 GLU 23 HB1 GLU 23 19.129 9.998 -4.830 149 HG2 GLU 23 HG2 GLU 23 20.631 10.707 -3.017 150 HG3 GLU 23 HG1 GLU 23 19.632 12.139 -2.775 151 H ASP 24 HN ASP 24 20.339 13.427 -7.412 152 HA ASP 24 HA ASP 24 19.113 11.650 -9.401 153 HB2 ASP 24 HB2 ASP 24 17.323 13.126 -8.718 154 HB3 ASP 24 HB1 ASP 24 18.364 14.534 -8.871 155 H GLN 25 HN GLN 25 19.497 12.579 -11.665 156 HA GLN 25 HA GLN 25 22.260 13.596 -11.740 157 HB2 GLN 25 HB2 GLN 25 20.825 12.150 -13.965 158 HB3 GLN 25 HB1 GLN 25 22.550 12.461 -13.816 159 HG2 GLN 25 HG2 GLN 25 22.520 10.994 -11.773 160 HG3 GLN 25 HG1 GLN 25 20.881 10.533 -12.225 161 HE21 GLN 25 HE21 GLN 25 24.238 10.332 -12.994 162 HE22 GLN 25 HE22 GLN 25 24.108 9.065 -14.173 163 H HIS 26 HN HIS 26 19.046 13.893 -13.174 164 HA HIS 26 HA HIS 26 19.447 16.637 -13.809 165 HB2 HIS 26 HB2 HIS 26 19.038 16.257 -16.327 166 HB3 HIS 26 HB1 HIS 26 20.666 16.025 -15.705 167 HD1 HIS 26 HD1 HIS 26 17.649 13.713 -16.151 168 HD2 HIS 26 HD2 HIS 26 21.750 13.828 -16.819 169 HE1 HIS 26 HE1 HIS 26 18.221 11.516 -17.230 170 HE2 HIS 26 HE2 HIS 26 20.688 11.647 -17.733 171 H SER 27 HN SER 27 17.546 17.605 -13.664 172 HA SER 27 HA SER 27 15.155 16.251 -14.656 173 HB2 SER 27 HB2 SER 27 15.445 17.460 -11.896 174 HB3 SER 27 HB1 SER 27 13.902 17.016 -12.622 175 HG SER 27 HG SER 27 16.058 15.331 -11.872 176 H LEU 28 HN LEU 28 13.645 17.590 -15.544 177 HA LEU 28 HA LEU 28 14.284 20.456 -15.585 178 HB2 LEU 28 HB2 LEU 28 12.995 18.640 -17.582 179 HB3 LEU 28 HB1 LEU 28 12.575 20.340 -17.584 180 HG LEU 28 HG LEU 28 14.297 19.920 -19.235 181 HD11 LEU 28 HD11 LEU 28 16.000 21.509 -18.457 182 HD12 LEU 28 HD12 LEU 28 15.352 21.381 -16.820 183 HD13 LEU 28 HD13 LEU 28 14.361 22.059 -18.114 184 HD21 LEU 28 HD21 LEU 28 15.959 18.872 -16.948 185 HD22 LEU 28 HD22 LEU 28 16.525 19.144 -18.597 186 HD23 LEU 28 HD23 LEU 28 15.297 17.919 -18.275 187 H TRP 29 HN TRP 29 13.174 21.442 -14.043 188 HA TRP 29 HA TRP 29 10.490 20.432 -13.382 189 HB2 TRP 29 HB2 TRP 29 12.381 20.363 -11.660 190 HB3 TRP 29 HB1 TRP 29 12.265 22.116 -11.615 191 HD1 TRP 29 HD1 TRP 29 10.871 22.925 -9.635 192 HE1 TRP 29 HE1 TRP 29 8.878 22.018 -8.273 193 HE3 TRP 29 HE3 TRP 29 10.090 18.547 -12.157 194 HZ2 TRP 29 HZ2 TRP 29 7.200 19.753 -8.277 195 HZ3 TRP 29 HZ3 TRP 29 8.275 17.065 -11.414 196 HH2 TRP 29 HH2 TRP 29 6.860 17.655 -9.514 197 HA PRO 30 HA PRO 30 8.808 24.167 -15.097 198 HB2 PRO 30 HB2 PRO 30 6.592 23.639 -13.194 199 HB3 PRO 30 HB1 PRO 30 6.548 23.847 -14.949 200 HG2 PRO 30 HG2 PRO 30 6.248 21.434 -13.861 201 HG3 PRO 30 HG1 PRO 30 7.170 21.655 -15.362 202 HD2 PRO 30 HD2 PRO 30 8.159 21.236 -12.568 203 HD3 PRO 30 HD1 PRO 30 8.772 20.569 -14.096 204 H VAL 31 HN VAL 31 8.541 26.294 -14.576 205 HA VAL 31 HA VAL 31 9.592 27.162 -12.046 206 HB VAL 31 HB VAL 31 10.083 28.337 -14.187 207 HG11 VAL 31 HG11 VAL 31 7.207 29.227 -14.027 208 HG12 VAL 31 HG12 VAL 31 7.914 28.162 -15.247 209 HG13 VAL 31 HG13 VAL 31 8.421 29.848 -15.148 210 HG21 VAL 31 HG21 VAL 31 9.883 30.611 -13.310 211 HG22 VAL 31 HG22 VAL 31 10.416 29.481 -12.066 212 HG23 VAL 31 HG23 VAL 31 8.744 30.041 -12.087 213 H PHE 32 HN PHE 32 8.509 28.421 -10.495 214 HA PHE 32 HA PHE 32 6.823 29.068 -9.139 215 HB2 PHE 32 HB2 PHE 32 5.144 28.788 -11.634 216 HB3 PHE 32 HB1 PHE 32 4.488 29.324 -10.091 217 HD1 PHE 32 HD1 PHE 32 5.422 31.404 -9.043 218 HD2 PHE 32 HD2 PHE 32 6.242 30.281 -13.064 219 HE1 PHE 32 HE1 PHE 32 6.078 33.720 -9.550 220 HE2 PHE 32 HE2 PHE 32 6.905 32.591 -13.581 221 HZ PHE 32 HZ PHE 32 6.825 34.314 -11.823 222 H ALA 33 HN ALA 33 7.306 26.098 -10.228 223 HA ALA 33 HA ALA 33 5.049 24.839 -8.890 224 HB1 ALA 33 HB1 ALA 33 5.882 23.830 -10.961 225 HB2 ALA 33 HB2 ALA 33 6.071 22.728 -9.597 226 HB3 ALA 33 HB3 ALA 33 7.466 23.608 -10.219 227 H ASP 34 HN ASP 34 5.438 23.300 -7.126 228 HA ASP 34 HA ASP 34 7.092 24.488 -5.136 229 HB2 ASP 34 HB2 ASP 34 4.914 23.343 -4.672 230 HB3 ASP 34 HB1 ASP 34 5.706 21.806 -5.009 231 H ILE 35 HN ILE 35 9.035 23.876 -4.352 232 HA ILE 35 HA ILE 35 10.379 21.654 -5.747 233 HB ILE 35 HB ILE 35 11.648 24.200 -4.704 234 HG12 ILE 35 HG12 ILE 35 11.107 23.337 -7.557 235 HG13 ILE 35 HG11 ILE 35 10.238 24.599 -6.692 236 HG21 ILE 35 HG21 ILE 35 13.666 23.427 -5.831 237 HG22 ILE 35 HG22 ILE 35 12.836 21.956 -6.333 238 HG23 ILE 35 HG23 ILE 35 13.136 22.257 -4.622 239 HD11 ILE 35 HD11 ILE 35 13.170 24.652 -7.366 240 HD12 ILE 35 HD12 ILE 35 12.261 25.930 -6.560 241 HD13 ILE 35 HD13 ILE 35 11.898 25.508 -8.236 242 HA PRO 36 HA PRO 36 10.887 19.985 -1.609 243 HB2 PRO 36 HB2 PRO 36 12.664 18.039 -2.298 244 HB3 PRO 36 HB1 PRO 36 10.925 17.897 -2.567 245 HG2 PRO 36 HG2 PRO 36 13.093 18.645 -4.485 246 HG3 PRO 36 HG1 PRO 36 11.682 17.601 -4.739 247 HD2 PRO 36 HD2 PRO 36 11.775 20.161 -5.604 248 HD3 PRO 36 HD1 PRO 36 10.266 19.384 -5.085 249 H ALA 37 HN ALA 37 13.193 18.877 -0.667 250 HA ALA 37 HA ALA 37 15.070 21.138 -0.690 251 HB1 ALA 37 HB1 ALA 37 14.768 18.924 1.340 252 HB2 ALA 37 HB2 ALA 37 14.118 20.557 1.493 253 HB3 ALA 37 HB3 ALA 37 15.862 20.302 1.455 254 H GLY 38 HN GLY 38 17.379 20.618 -0.557 255 HA2 GLY 38 HA2 GLY 38 19.275 19.364 -1.053 256 HA3 GLY 38 HA1 GLY 38 18.243 17.987 -1.415 257 H TRP 39 HN TRP 39 17.811 21.155 -2.819 258 HA TRP 39 HA TRP 39 18.203 19.929 -5.452 259 HB2 TRP 39 HB2 TRP 39 16.770 21.784 -6.279 260 HB3 TRP 39 HB1 TRP 39 15.959 20.773 -5.090 261 HD1 TRP 39 HD1 TRP 39 15.387 21.871 -2.720 262 HE1 TRP 39 HE1 TRP 39 15.258 24.323 -1.930 263 HE3 TRP 39 HE3 TRP 39 17.861 24.106 -6.603 264 HZ2 TRP 39 HZ2 TRP 39 16.099 26.857 -2.841 265 HZ3 TRP 39 HZ3 TRP 39 18.158 26.546 -6.561 266 HH2 TRP 39 HH2 TRP 39 17.295 27.893 -4.720 267 H ARG 40 HN ARG 40 19.094 21.236 -7.148 268 HA ARG 40 HA ARG 40 20.465 23.695 -6.422 269 HB2 ARG 40 HB2 ARG 40 22.197 22.063 -6.015 270 HB3 ARG 40 HB1 ARG 40 21.867 21.261 -7.542 271 HG2 ARG 40 HG2 ARG 40 23.901 22.560 -7.685 272 HG3 ARG 40 HG1 ARG 40 22.668 23.225 -8.752 273 HD2 ARG 40 HD2 ARG 40 22.213 25.008 -7.207 274 HD3 ARG 40 HD1 ARG 40 23.278 24.290 -5.998 275 HE ARG 40 HE ARG 40 24.909 24.657 -8.141 276 HH11 ARG 40 HH11 ARG 40 22.772 26.823 -6.372 277 HH12 ARG 40 HH12 ARG 40 23.757 28.227 -6.672 278 HH21 ARG 40 HH21 ARG 40 26.184 26.482 -8.514 279 HH22 ARG 40 HH22 ARG 40 25.717 28.035 -7.881 280 H VAL 41 HN VAL 41 19.809 25.113 -7.901 281 HA VAL 41 HA VAL 41 18.873 24.223 -10.492 282 HB VAL 41 HB VAL 41 19.053 27.006 -9.324 283 HG11 VAL 41 HG11 VAL 41 17.747 26.053 -11.875 284 HG12 VAL 41 HG12 VAL 41 19.150 27.118 -11.749 285 HG13 VAL 41 HG13 VAL 41 17.570 27.666 -11.183 286 HG21 VAL 41 HG21 VAL 41 16.604 26.818 -9.140 287 HG22 VAL 41 HG22 VAL 41 17.444 25.619 -8.156 288 HG23 VAL 41 HG23 VAL 41 16.709 25.145 -9.688 289 H VAL 42 HN VAL 42 20.181 23.974 -12.158 290 HA VAL 42 HA VAL 42 22.879 25.002 -12.099 291 HB VAL 42 HB VAL 42 21.494 23.548 -14.363 292 HG11 VAL 42 HG11 VAL 42 23.562 24.654 -15.009 293 HG12 VAL 42 HG12 VAL 42 23.758 22.899 -15.018 294 HG13 VAL 42 HG13 VAL 42 24.416 23.856 -13.688 295 HG21 VAL 42 HG21 VAL 42 21.304 22.194 -12.370 296 HG22 VAL 42 HG22 VAL 42 23.022 22.409 -12.021 297 HG23 VAL 42 HG23 VAL 42 22.520 21.495 -13.443 298 H HIS 43 HN HIS 43 19.897 25.633 -13.842 299 HA HIS 43 HA HIS 43 20.702 28.320 -14.423 300 HB2 HIS 43 HB2 HIS 43 21.802 27.164 -16.300 301 HB3 HIS 43 HB1 HIS 43 20.276 26.405 -16.740 302 HD1 HIS 43 HD1 HIS 43 21.924 29.825 -16.647 303 HD2 HIS 43 HD2 HIS 43 18.651 27.906 -18.358 304 HE1 HIS 43 HE1 HIS 43 20.965 31.456 -18.299 305 HE2 HIS 43 HE2 HIS 43 18.827 30.383 -19.094 306 H GLY 44 HN GLY 44 18.898 29.594 -15.216 307 HA2 GLY 44 HA2 GLY 44 16.415 28.780 -14.110 308 HA3 GLY 44 HA1 GLY 44 16.702 30.222 -15.068 309 H GLU 45 HN GLU 45 15.276 30.297 -16.654 310 HA GLU 45 HA GLU 45 14.235 27.778 -17.659 311 HB2 GLU 45 HB2 GLU 45 12.625 29.428 -18.928 312 HB3 GLU 45 HB1 GLU 45 12.365 29.013 -17.240 313 HG2 GLU 45 HG2 GLU 45 12.056 31.307 -17.321 314 HG3 GLU 45 HG1 GLU 45 13.686 31.095 -16.706 315 H ALA 46 HN ALA 46 15.622 27.014 -18.908 316 HA ALA 46 HA ALA 46 16.111 28.389 -21.475 317 HB1 ALA 46 HB1 ALA 46 18.197 27.994 -20.232 318 HB2 ALA 46 HB2 ALA 46 18.137 27.067 -21.730 319 HB3 ALA 46 HB3 ALA 46 17.834 26.269 -20.186 320 H SER 47 HN SER 47 16.001 27.049 -23.360 321 HA SER 47 HA SER 47 13.740 25.551 -23.588 322 HB2 SER 47 HB2 SER 47 16.250 25.211 -25.245 323 HB3 SER 47 HB1 SER 47 14.609 24.774 -25.731 324 HG SER 47 HG SER 47 14.360 27.219 -25.022 325 H ARG 48 HN ARG 48 13.092 23.545 -23.173 326 HA ARG 48 HA ARG 48 14.451 22.031 -21.260 327 HB2 ARG 48 HB2 ARG 48 11.968 22.101 -21.660 328 HB3 ARG 48 HB1 ARG 48 12.218 21.057 -23.049 329 HG2 ARG 48 HG2 ARG 48 13.256 20.193 -20.399 330 HG3 ARG 48 HG1 ARG 48 11.527 20.083 -20.721 331 HD2 ARG 48 HD2 ARG 48 13.647 18.897 -22.503 332 HD3 ARG 48 HD1 ARG 48 12.839 18.005 -21.216 333 HE ARG 48 HE ARG 48 10.711 18.561 -22.456 334 HH11 ARG 48 HH11 ARG 48 13.796 18.264 -24.085 335 HH12 ARG 48 HH12 ARG 48 13.111 17.778 -25.606 336 HH21 ARG 48 HH21 ARG 48 9.786 17.920 -24.439 337 HH22 ARG 48 HH22 ARG 48 10.798 17.577 -25.808 338 H ALA 49 HN ALA 49 14.196 21.655 -24.763 339 HA ALA 49 HA ALA 49 15.442 19.127 -24.940 340 HB1 ALA 49 HB1 ALA 49 15.371 21.340 -26.987 341 HB2 ALA 49 HB2 ALA 49 14.141 20.097 -26.768 342 HB3 ALA 49 HB3 ALA 49 15.762 19.649 -27.301 343 H ALA 50 HN ALA 50 16.755 22.419 -25.155 344 HA ALA 50 HA ALA 50 19.428 21.666 -25.624 345 HB1 ALA 50 HB1 ALA 50 18.388 24.185 -24.330 346 HB2 ALA 50 HB2 ALA 50 18.598 23.924 -26.060 347 HB3 ALA 50 HB3 ALA 50 20.004 23.953 -24.995 348 H CYS 51 HN CYS 51 17.568 22.082 -22.668 349 HA CYS 51 HA CYS 51 19.734 21.909 -20.858 350 HB2 CYS 51 HB2 CYS 51 16.843 21.108 -20.460 351 HB3 CYS 51 HB1 CYS 51 18.021 21.379 -19.179 352 HG CYS 51 HG CYS 51 16.543 23.688 -21.211 353 H LEU 52 HN LEU 52 17.483 19.431 -22.106 354 HA LEU 52 HA LEU 52 18.692 17.193 -20.936 355 HB2 LEU 52 HB2 LEU 52 17.282 17.481 -23.584 356 HB3 LEU 52 HB1 LEU 52 17.777 15.936 -22.921 357 HG LEU 52 HG LEU 52 15.767 17.837 -21.709 358 HD11 LEU 52 HD11 LEU 52 14.907 16.663 -23.645 359 HD12 LEU 52 HD12 LEU 52 14.182 16.018 -22.170 360 HD13 LEU 52 HD13 LEU 52 15.465 15.125 -22.987 361 HD21 LEU 52 HD21 LEU 52 17.051 16.700 -19.977 362 HD22 LEU 52 HD22 LEU 52 16.719 15.144 -20.741 363 HD23 LEU 52 HD23 LEU 52 15.398 16.084 -20.044 364 H ASP 53 HN ASP 53 19.374 18.789 -24.022 365 HA ASP 53 HA ASP 53 21.433 17.159 -24.922 366 HB2 ASP 53 HB2 ASP 53 20.496 18.913 -26.314 367 HB3 ASP 53 HB1 ASP 53 21.092 20.152 -25.214 368 H TYR 54 HN TYR 54 21.603 20.011 -22.825 369 HA TYR 54 HA TYR 54 24.353 20.111 -22.454 370 HB2 TYR 54 HB2 TYR 54 23.185 21.984 -21.698 371 HB3 TYR 54 HB1 TYR 54 22.005 21.018 -20.819 372 HD1 TYR 54 HD1 TYR 54 25.673 21.789 -20.774 373 HD2 TYR 54 HD2 TYR 54 22.172 20.920 -18.511 374 HE1 TYR 54 HE1 TYR 54 26.942 22.117 -18.690 375 HE2 TYR 54 HE2 TYR 54 23.431 21.242 -16.429 376 HH TYR 54 HH TYR 54 25.717 21.181 -15.637 377 H VAL 55 HN VAL 55 21.914 18.425 -20.449 378 HA VAL 55 HA VAL 55 23.851 17.564 -18.563 379 HB VAL 55 HB VAL 55 22.119 16.131 -17.614 380 HG11 VAL 55 HG11 VAL 55 22.143 18.493 -17.047 381 HG12 VAL 55 HG12 VAL 55 20.486 17.883 -17.092 382 HG13 VAL 55 HG13 VAL 55 21.111 18.847 -18.432 383 HG21 VAL 55 HG21 VAL 55 19.877 16.043 -18.585 384 HG22 VAL 55 HG22 VAL 55 21.069 15.332 -19.671 385 HG23 VAL 55 HG23 VAL 55 20.443 16.950 -19.986 386 H GLU 56 HN GLU 56 22.425 16.051 -21.403 387 HA GLU 56 HA GLU 56 23.530 13.473 -20.899 388 HB2 GLU 56 HB2 GLU 56 22.432 14.677 -23.443 389 HB3 GLU 56 HB1 GLU 56 22.782 12.970 -23.196 390 HG2 GLU 56 HG2 GLU 56 20.848 14.548 -21.520 391 HG3 GLU 56 HG1 GLU 56 20.371 13.613 -22.927 392 H LYS 57 HN LYS 57 24.622 16.317 -22.635 393 HA LYS 57 HA LYS 57 26.813 15.083 -23.956 394 HB2 LYS 57 HB2 LYS 57 26.075 17.898 -23.283 395 HB3 LYS 57 HB1 LYS 57 27.720 17.560 -23.791 396 HG2 LYS 57 HG2 LYS 57 26.852 16.573 -25.870 397 HG3 LYS 57 HG1 LYS 57 25.215 16.981 -25.355 398 HD2 LYS 57 HD2 LYS 57 25.574 19.271 -25.571 399 HD3 LYS 57 HD1 LYS 57 27.326 19.107 -25.476 400 HE2 LYS 57 HE2 LYS 57 26.590 19.689 -27.735 401 HE3 LYS 57 HE1 LYS 57 27.373 18.112 -27.691 402 HZ1 LYS 57 HZ1 LYS 57 25.317 17.022 -27.912 403 HZ2 LYS 57 HZ2 LYS 57 25.283 18.284 -29.043 404 HZ3 LYS 57 HZ3 LYS 57 24.425 18.430 -27.590 405 H ASN 58 HN ASN 58 26.322 16.143 -20.703 406 HA ASN 58 HA ASN 58 29.184 16.087 -20.135 407 HB2 ASN 58 HB2 ASN 58 26.780 16.920 -18.527 408 HB3 ASN 58 HB1 ASN 58 28.346 16.668 -17.766 409 HD21 ASN 58 HD21 ASN 58 26.517 18.637 -19.984 410 HD22 ASN 58 HD22 ASN 58 27.649 19.944 -20.051 411 H TRP 59 HN TRP 59 26.215 14.406 -19.217 412 HA TRP 59 HA TRP 59 25.822 12.241 -18.681 413 HB2 TRP 59 HB2 TRP 59 27.512 11.599 -20.327 414 HB3 TRP 59 HB1 TRP 59 28.787 11.834 -19.136 415 HD1 TRP 59 HD1 TRP 59 25.844 9.477 -19.919 416 HE1 TRP 59 HE1 TRP 59 26.272 7.221 -18.744 417 HE3 TRP 59 HE3 TRP 59 30.041 10.728 -17.282 418 HZ2 TRP 59 HZ2 TRP 59 28.155 6.126 -16.940 419 HZ3 TRP 59 HZ3 TRP 59 31.093 9.024 -15.856 420 HH2 TRP 59 HH2 TRP 59 30.168 6.770 -15.686 421 H THR 60 HN THR 60 28.784 13.468 -17.157 422 HA THR 60 HA THR 60 28.447 11.858 -14.821 423 HB THR 60 HB THR 60 30.679 12.588 -15.557 424 HG1 THR 60 HG1 THR 60 30.060 12.186 -13.252 425 HG21 THR 60 HG21 THR 60 31.416 14.899 -15.151 426 HG22 THR 60 HG22 THR 60 29.767 15.344 -14.713 427 HG23 THR 60 HG23 THR 60 30.134 14.827 -16.357 428 H ASP 61 HN ASP 61 27.923 12.519 -12.739 429 HA ASP 61 HA ASP 61 25.713 14.326 -12.621 430 HB2 ASP 61 HB2 ASP 61 27.132 13.095 -10.260 431 HB3 ASP 61 HB1 ASP 61 25.453 13.609 -10.362 432 H LEU 62 HN LEU 62 29.091 14.550 -11.898 433 HA LEU 62 HA LEU 62 28.649 17.073 -10.461 434 HB2 LEU 62 HB2 LEU 62 29.888 15.311 -9.242 435 HB3 LEU 62 HB1 LEU 62 31.108 15.321 -10.499 436 HG LEU 62 HG LEU 62 31.662 17.654 -9.940 437 HD11 LEU 62 HD11 LEU 62 30.755 18.665 -7.909 438 HD12 LEU 62 HD12 LEU 62 29.671 17.290 -7.703 439 HD13 LEU 62 HD13 LEU 62 29.488 18.356 -9.095 440 HD21 LEU 62 HD21 LEU 62 32.749 17.189 -7.807 441 HD22 LEU 62 HD22 LEU 62 32.891 15.815 -8.900 442 HD23 LEU 62 HD23 LEU 62 31.722 15.775 -7.581 443 H ARG 63 HN ARG 63 28.687 18.697 -11.839 444 HA ARG 63 HA ARG 63 31.045 18.924 -13.579 445 HB2 ARG 63 HB2 ARG 63 28.845 18.478 -14.799 446 HB3 ARG 63 HB1 ARG 63 28.349 20.082 -14.278 447 HG2 ARG 63 HG2 ARG 63 29.231 20.074 -16.564 448 HG3 ARG 63 HG1 ARG 63 30.200 21.078 -15.481 449 HD2 ARG 63 HD2 ARG 63 31.893 19.416 -15.319 450 HD3 ARG 63 HD1 ARG 63 30.882 18.216 -16.123 451 HE ARG 63 HE ARG 63 31.327 20.456 -17.810 452 HH11 ARG 63 HH11 ARG 63 32.925 17.645 -16.483 453 HH12 ARG 63 HH12 ARG 63 33.949 17.398 -17.859 454 HH21 ARG 63 HH21 ARG 63 32.675 20.132 -19.661 455 HH22 ARG 63 HH22 ARG 63 33.807 18.810 -19.665 456 HA PRO 64 HA PRO 64 31.234 22.348 -10.646 457 HB2 PRO 64 HB2 PRO 64 34.006 22.567 -11.556 458 HB3 PRO 64 HB1 PRO 64 33.387 22.204 -9.944 459 HG2 PRO 64 HG2 PRO 64 34.633 20.363 -11.475 460 HG3 PRO 64 HG1 PRO 64 33.355 19.941 -10.322 461 HD2 PRO 64 HD2 PRO 64 33.201 20.246 -13.298 462 HD3 PRO 64 HD1 PRO 64 32.426 19.041 -12.247 463 H LYS 65 HN LYS 65 30.378 24.205 -11.295 464 HA LYS 65 HA LYS 65 31.629 25.581 -13.576 465 HB2 LYS 65 HB2 LYS 65 28.765 25.672 -12.628 466 HB3 LYS 65 HB1 LYS 65 29.437 26.814 -13.781 467 HG2 LYS 65 HG2 LYS 65 30.000 24.867 -15.248 468 HG3 LYS 65 HG1 LYS 65 29.089 23.850 -14.129 469 HD2 LYS 65 HD2 LYS 65 27.080 25.096 -14.547 470 HD3 LYS 65 HD1 LYS 65 27.964 26.269 -15.527 471 HE2 LYS 65 HE2 LYS 65 27.509 23.358 -16.158 472 HE3 LYS 65 HE1 LYS 65 26.778 24.740 -16.968 473 HZ1 LYS 65 HZ1 LYS 65 29.247 25.373 -17.408 474 HZ2 LYS 65 HZ2 LYS 65 28.483 24.219 -18.388 475 HZ3 LYS 65 HZ3 LYS 65 29.531 23.722 -17.156 476 H SER 66 HN SER 66 33.162 26.582 -12.279 477 HA SER 66 HA SER 66 32.125 28.480 -10.292 478 HB2 SER 66 HB2 SER 66 34.954 27.454 -10.629 479 HB3 SER 66 HB1 SER 66 34.362 28.482 -9.322 480 HG SER 66 HG SER 66 32.755 26.433 -9.348 481 H LEU 67 HN LEU 67 31.634 30.266 -11.442 482 HA LEU 67 HA LEU 67 33.857 31.574 -12.843 483 HB2 LEU 67 HB2 LEU 67 32.172 30.349 -14.381 484 HB3 LEU 67 HB1 LEU 67 31.056 31.622 -13.943 485 HG LEU 67 HG LEU 67 32.206 31.958 -16.134 486 HD11 LEU 67 HD11 LEU 67 31.261 33.856 -14.916 487 HD12 LEU 67 HD12 LEU 67 32.715 34.313 -15.803 488 HD13 LEU 67 HD13 LEU 67 32.790 34.065 -14.059 489 HD21 LEU 67 HD21 LEU 67 34.643 32.347 -14.404 490 HD22 LEU 67 HD22 LEU 67 34.539 32.693 -16.130 491 HD23 LEU 67 HD23 LEU 67 34.380 31.036 -15.550 492 H ARG 68 HN ARG 68 30.456 32.025 -11.885 493 HA ARG 68 HA ARG 68 31.131 34.245 -10.184 494 HB2 ARG 68 HB2 ARG 68 31.036 35.229 -12.519 495 HB3 ARG 68 HB1 ARG 68 29.333 34.798 -12.550 496 HG2 ARG 68 HG2 ARG 68 29.611 37.135 -11.982 497 HG3 ARG 68 HG1 ARG 68 28.937 36.248 -10.613 498 HD2 ARG 68 HD2 ARG 68 30.738 37.875 -10.009 499 HD3 ARG 68 HD1 ARG 68 31.047 36.217 -9.496 500 HE ARG 68 HE ARG 68 32.188 36.954 -12.053 501 HH11 ARG 68 HH11 ARG 68 32.710 36.820 -8.589 502 HH12 ARG 68 HH12 ARG 68 34.430 36.650 -8.736 503 HH21 ARG 68 HH21 ARG 68 34.441 36.739 -12.239 504 HH22 ARG 68 HH22 ARG 68 35.414 36.593 -10.799 505 H ASP 69 HN ASP 69 30.146 32.917 -8.637 506 HA ASP 69 HA ASP 69 27.265 32.420 -9.004 507 HB2 ASP 69 HB2 ASP 69 28.843 30.486 -8.456 508 HB3 ASP 69 HB1 ASP 69 29.034 31.219 -6.867 509 H ALA 70 HN ALA 70 26.289 34.238 -8.344 510 HA ALA 70 HA ALA 70 26.435 34.951 -5.554 511 HB1 ALA 70 HB1 ALA 70 28.283 36.266 -6.463 512 HB2 ALA 70 HB2 ALA 70 26.957 37.312 -5.958 513 HB3 ALA 70 HB3 ALA 70 27.204 36.964 -7.669 514 H MET 71 HN MET 71 24.883 36.895 -5.182 515 HA MET 71 HA MET 71 22.422 36.253 -6.577 516 HB2 MET 71 HB2 MET 71 22.971 38.141 -4.274 517 HB3 MET 71 HB1 MET 71 21.375 37.775 -4.914 518 HG2 MET 71 HG2 MET 71 21.641 35.440 -4.281 519 HG3 MET 71 HG1 MET 71 23.255 35.781 -3.661 520 HE1 MET 71 HE1 MET 71 22.894 38.581 -2.232 521 HE2 MET 71 HE2 MET 71 23.740 37.221 -1.489 522 HE3 MET 71 HE3 MET 71 22.491 38.080 -0.589 523 H VAL 72 HN VAL 72 22.238 37.161 -8.515 524 HA VAL 72 HA VAL 72 23.395 39.707 -9.151 525 HB VAL 72 HB VAL 72 21.469 38.031 -10.773 526 HG11 VAL 72 HG11 VAL 72 23.283 40.292 -11.608 527 HG12 VAL 72 HG12 VAL 72 21.525 40.358 -11.493 528 HG13 VAL 72 HG13 VAL 72 22.291 39.312 -12.689 529 HG21 VAL 72 HG21 VAL 72 23.457 37.241 -11.964 530 HG22 VAL 72 HG22 VAL 72 23.515 36.814 -10.254 531 HG23 VAL 72 HG23 VAL 72 24.484 38.157 -10.857 532 H GLU 73 HN GLU 73 20.039 38.488 -9.074 533 HA GLU 73 HA GLU 73 19.116 41.258 -8.773 534 HB2 GLU 73 HB2 GLU 73 17.582 38.716 -9.345 535 HB3 GLU 73 HB1 GLU 73 16.848 40.301 -9.146 536 HG2 GLU 73 HG2 GLU 73 18.179 41.097 -11.080 537 HG3 GLU 73 HG1 GLU 73 18.745 39.441 -11.315 538 H ASP 74 HN ASP 74 18.378 42.000 -6.892 539 HA ASP 74 HA ASP 74 18.007 40.095 -4.695 540 HB2 ASP 74 HB2 ASP 74 18.468 43.085 -4.682 541 HB3 ASP 74 HB1 ASP 74 18.032 42.167 -3.245 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 12.601 18.060 4.003 2 H2 GLY 1 HT2 GLY 1 14.268 18.243 3.767 3 H3 GLY 1 HT3 GLY 1 13.697 17.266 5.023 4 HA2 GLY 1 HA1 GLY 1 14.477 15.904 3.191 5 HA3 GLY 1 HA2 GLY 1 12.747 15.712 3.439 6 H SER 2 HN SER 2 12.559 14.995 1.250 7 HA SER 2 HA SER 2 12.910 17.109 -0.753 8 HB2 SER 2 HB2 SER 2 12.414 14.138 -1.060 9 HB3 SER 2 HB1 SER 2 12.486 15.275 -2.408 10 HG SER 2 HG SER 2 14.555 14.649 -0.558 11 H HIS 3 HN HIS 3 11.204 18.313 -1.215 12 HA HIS 3 HA HIS 3 8.521 17.292 -0.636 13 HB2 HIS 3 HB2 HIS 3 9.069 19.513 0.257 14 HB3 HIS 3 HB1 HIS 3 9.439 20.088 -1.364 15 HD1 HIS 3 HD1 HIS 3 7.611 21.531 -2.206 16 HD2 HIS 3 HD2 HIS 3 6.170 18.434 0.171 17 HE1 HIS 3 HE1 HIS 3 5.116 21.804 -2.178 18 HE2 HIS 3 HE2 HIS 3 4.253 19.837 -0.858 19 H MET 4 HN MET 4 8.470 15.819 -2.367 20 HA MET 4 HA MET 4 8.696 16.787 -5.069 21 HB2 MET 4 HB2 MET 4 8.097 14.483 -5.719 22 HB3 MET 4 HB1 MET 4 9.433 14.524 -4.583 23 HG2 MET 4 HG2 MET 4 6.589 13.999 -3.770 24 HG3 MET 4 HG1 MET 4 7.727 12.728 -4.203 25 HE1 MET 4 HE1 MET 4 6.141 12.826 -1.444 26 HE2 MET 4 HE2 MET 4 7.415 12.380 -0.308 27 HE3 MET 4 HE3 MET 4 7.285 11.547 -1.857 28 H SER 5 HN SER 5 7.132 17.705 -6.185 29 HA SER 5 HA SER 5 4.401 17.618 -5.191 30 HB2 SER 5 HB2 SER 5 5.617 19.167 -7.498 31 HB3 SER 5 HB1 SER 5 3.967 19.348 -6.902 32 HG SER 5 HG SER 5 6.395 20.058 -5.660 33 H THR 6 HN THR 6 3.072 16.071 -5.861 34 HA THR 6 HA THR 6 3.712 14.375 -8.058 35 HB THR 6 HB THR 6 1.413 13.401 -7.601 36 HG1 THR 6 HG1 THR 6 0.636 15.416 -6.604 37 HG21 THR 6 HG21 THR 6 3.321 13.611 -5.273 38 HG22 THR 6 HG22 THR 6 3.459 12.479 -6.617 39 HG23 THR 6 HG23 THR 6 2.098 12.360 -5.500 40 H ASN 7 HN ASN 7 3.738 15.472 -9.952 41 HA ASN 7 HA ASN 7 1.304 16.866 -10.798 42 HB2 ASN 7 HB2 ASN 7 3.413 18.086 -11.106 43 HB3 ASN 7 HB1 ASN 7 4.055 16.759 -12.068 44 HD21 ASN 7 HD21 ASN 7 4.380 18.040 -13.860 45 HD22 ASN 7 HD22 ASN 7 3.084 18.643 -14.827 46 HA PRO 8 HA PRO 8 0.207 13.083 -12.941 47 HB2 PRO 8 HB2 PRO 8 -1.909 14.786 -14.092 48 HB3 PRO 8 HB1 PRO 8 -2.052 13.308 -13.137 49 HG2 PRO 8 HG2 PRO 8 -2.683 15.707 -12.115 50 HG3 PRO 8 HG1 PRO 8 -1.935 14.439 -11.126 51 HD2 PRO 8 HD2 PRO 8 -0.689 16.858 -12.375 52 HD3 PRO 8 HD1 PRO 8 -0.417 16.152 -10.767 53 H PHE 9 HN PHE 9 0.949 16.159 -14.325 54 HA PHE 9 HA PHE 9 0.929 15.085 -17.044 55 HB2 PHE 9 HB2 PHE 9 1.463 17.904 -16.077 56 HB3 PHE 9 HB1 PHE 9 1.291 17.403 -17.756 57 HD1 PHE 9 HD2 PHE 9 -0.952 16.344 -18.431 58 HD2 PHE 9 HD1 PHE 9 -0.385 18.601 -14.868 59 HE1 PHE 9 HE2 PHE 9 -3.376 16.729 -18.294 60 HE2 PHE 9 HE1 PHE 9 -2.808 18.990 -14.725 61 HZ PHE 9 HZ PHE 9 -4.309 18.053 -16.439 62 H ASP 10 HN ASP 10 2.849 15.829 -18.422 63 HA ASP 10 HA ASP 10 5.320 15.230 -16.926 64 HB2 ASP 10 HB2 ASP 10 4.590 13.436 -18.460 65 HB3 ASP 10 HB1 ASP 10 4.623 14.578 -19.799 66 H ASP 11 HN ASP 11 3.690 17.534 -18.716 67 HA ASP 11 HA ASP 11 6.134 18.790 -19.745 68 HB2 ASP 11 HB2 ASP 11 4.500 20.146 -21.125 69 HB3 ASP 11 HB1 ASP 11 4.569 18.426 -21.495 70 H ASP 12 HN ASP 12 6.051 21.216 -19.814 71 HA ASP 12 HA ASP 12 5.305 22.207 -17.153 72 HB2 ASP 12 HB2 ASP 12 7.602 22.536 -17.417 73 HB3 ASP 12 HB1 ASP 12 7.449 22.958 -19.119 74 H ASN 13 HN ASN 13 4.413 24.309 -16.917 75 HA ASN 13 HA ASN 13 2.626 24.993 -19.147 76 HB2 ASN 13 HB2 ASN 13 1.545 24.326 -17.041 77 HB3 ASN 13 HB1 ASN 13 2.393 25.612 -16.191 78 HD21 ASN 13 HD21 ASN 13 1.694 27.733 -16.414 79 HD22 ASN 13 HD22 ASN 13 0.183 28.134 -17.168 80 H GLY 14 HN GLY 14 5.267 26.197 -17.273 81 HA2 GLY 14 HA2 GLY 14 4.770 28.914 -18.314 82 HA3 GLY 14 HA1 GLY 14 5.280 28.652 -16.665 83 H ALA 15 HN ALA 15 7.333 27.796 -16.302 84 HA ALA 15 HA ALA 15 9.244 27.913 -18.505 85 HB1 ALA 15 HB1 ALA 15 9.229 30.174 -17.573 86 HB2 ALA 15 HB2 ALA 15 10.761 29.360 -17.252 87 HB3 ALA 15 HB3 ALA 15 9.562 29.521 -15.969 88 H PHE 16 HN PHE 16 11.179 26.765 -18.077 89 HA PHE 16 HA PHE 16 10.989 24.940 -15.775 90 HB2 PHE 16 HB2 PHE 16 12.337 23.409 -17.471 91 HB3 PHE 16 HB1 PHE 16 10.582 23.485 -17.523 92 HD1 PHE 16 HD1 PHE 16 13.602 25.063 -19.006 93 HD2 PHE 16 HD2 PHE 16 9.509 24.015 -19.502 94 HE1 PHE 16 HE1 PHE 16 13.696 25.815 -21.335 95 HE2 PHE 16 HE2 PHE 16 9.597 24.764 -21.842 96 HZ PHE 16 HZ PHE 16 11.693 25.668 -22.764 97 H PHE 17 HN PHE 17 12.868 24.399 -14.708 98 HA PHE 17 HA PHE 17 15.292 25.886 -15.492 99 HB2 PHE 17 HB2 PHE 17 13.990 25.465 -12.837 100 HB3 PHE 17 HB1 PHE 17 15.745 25.488 -12.886 101 HD1 PHE 17 HD2 PHE 17 13.202 27.530 -14.715 102 HD2 PHE 17 HD1 PHE 17 16.437 27.448 -11.957 103 HE1 PHE 17 HE2 PHE 17 13.171 29.985 -14.613 104 HE2 PHE 17 HE1 PHE 17 16.416 29.902 -11.851 105 HZ PHE 17 HZ PHE 17 14.782 31.177 -13.181 106 H VAL 18 HN VAL 18 17.318 24.849 -15.003 107 HA VAL 18 HA VAL 18 17.168 21.938 -15.084 108 HB VAL 18 HB VAL 18 19.584 23.756 -15.219 109 HG11 VAL 18 HG11 VAL 18 19.350 20.790 -15.728 110 HG12 VAL 18 HG12 VAL 18 20.162 21.553 -14.360 111 HG13 VAL 18 HG13 VAL 18 20.792 21.772 -15.991 112 HG21 VAL 18 HG21 VAL 18 19.611 23.175 -17.607 113 HG22 VAL 18 HG22 VAL 18 18.155 24.055 -17.147 114 HG23 VAL 18 HG23 VAL 18 18.089 22.312 -17.401 115 H LEU 19 HN LEU 19 16.798 21.065 -13.153 116 HA LEU 19 HA LEU 19 18.125 22.237 -10.803 117 HB2 LEU 19 HB2 LEU 19 15.531 22.121 -11.074 118 HB3 LEU 19 HB1 LEU 19 15.739 20.427 -10.681 119 HG LEU 19 HG LEU 19 16.854 21.127 -8.555 120 HD11 LEU 19 HD11 LEU 19 15.892 23.846 -9.425 121 HD12 LEU 19 HD12 LEU 19 17.566 23.341 -9.188 122 HD13 LEU 19 HD13 LEU 19 16.473 23.447 -7.810 123 HD21 LEU 19 HD21 LEU 19 14.036 22.105 -8.986 124 HD22 LEU 19 HD22 LEU 19 14.774 21.726 -7.429 125 HD23 LEU 19 HD23 LEU 19 14.515 20.447 -8.615 126 H VAL 20 HN VAL 20 19.377 20.990 -9.540 127 HA VAL 20 HA VAL 20 19.588 18.129 -10.198 128 HB VAL 20 HB VAL 20 21.583 19.942 -8.820 129 HG11 VAL 20 HG11 VAL 20 23.109 18.018 -8.872 130 HG12 VAL 20 HG12 VAL 20 21.796 17.004 -9.470 131 HG13 VAL 20 HG13 VAL 20 21.700 17.711 -7.857 132 HG21 VAL 20 HG21 VAL 20 22.974 19.493 -10.787 133 HG22 VAL 20 HG22 VAL 20 21.462 20.294 -11.216 134 HG23 VAL 20 HG23 VAL 20 21.653 18.563 -11.497 135 H ASN 21 HN ASN 21 19.365 16.614 -8.603 136 HA ASN 21 HA ASN 21 18.144 17.594 -6.116 137 HB2 ASN 21 HB2 ASN 21 16.668 16.182 -7.442 138 HB3 ASN 21 HB1 ASN 21 17.895 14.924 -7.525 139 HD21 ASN 21 HD21 ASN 21 15.558 16.518 -5.486 140 HD22 ASN 21 HD22 ASN 21 15.536 15.317 -4.244 141 H ASP 22 HN ASP 22 18.597 16.389 -4.147 142 HA ASP 22 HA ASP 22 21.237 16.167 -3.460 143 HB2 ASP 22 HB2 ASP 22 19.627 16.305 -1.729 144 HB3 ASP 22 HB1 ASP 22 18.775 14.877 -2.305 145 H GLU 23 HN GLU 23 19.111 13.513 -4.572 146 HA GLU 23 HA GLU 23 21.521 11.812 -4.632 147 HB2 GLU 23 HB2 GLU 23 20.020 9.878 -4.408 148 HB3 GLU 23 HB1 GLU 23 19.889 10.985 -3.049 149 HG2 GLU 23 HG2 GLU 23 17.836 11.895 -3.946 150 HG3 GLU 23 HG1 GLU 23 17.984 10.872 -5.373 151 H ASP 24 HN ASP 24 19.431 13.432 -6.681 152 HA ASP 24 HA ASP 24 19.748 11.366 -8.753 153 HB2 ASP 24 HB2 ASP 24 17.385 12.088 -8.119 154 HB3 ASP 24 HB1 ASP 24 17.758 13.624 -8.901 155 H GLN 25 HN GLN 25 20.220 12.064 -10.918 156 HA GLN 25 HA GLN 25 22.481 13.792 -10.812 157 HB2 GLN 25 HB2 GLN 25 21.187 12.477 -13.201 158 HB3 GLN 25 HB1 GLN 25 22.803 13.165 -13.146 159 HG2 GLN 25 HG2 GLN 25 23.493 11.502 -11.534 160 HG3 GLN 25 HG1 GLN 25 21.860 10.837 -11.491 161 HE21 GLN 25 HE21 GLN 25 22.535 8.814 -12.153 162 HE22 GLN 25 HE22 GLN 25 23.054 8.498 -13.775 163 H HIS 26 HN HIS 26 19.385 13.955 -12.597 164 HA HIS 26 HA HIS 26 19.557 16.831 -12.704 165 HB2 HIS 26 HB2 HIS 26 19.520 16.935 -15.197 166 HB3 HIS 26 HB1 HIS 26 21.037 16.334 -14.542 167 HD1 HIS 26 HD1 HIS 26 21.721 13.944 -15.153 168 HD2 HIS 26 HD2 HIS 26 17.966 14.997 -16.590 169 HE1 HIS 26 HE1 HIS 26 21.092 12.141 -16.786 170 HE2 HIS 26 HE2 HIS 26 18.910 12.903 -17.787 171 H SER 27 HN SER 27 17.600 17.763 -12.925 172 HA SER 27 HA SER 27 15.439 16.297 -14.220 173 HB2 SER 27 HB2 SER 27 15.195 17.424 -11.418 174 HB3 SER 27 HB1 SER 27 13.888 16.701 -12.355 175 HG SER 27 HG SER 27 15.946 15.000 -12.294 176 H LEU 28 HN LEU 28 14.248 17.636 -15.471 177 HA LEU 28 HA LEU 28 14.713 20.490 -15.313 178 HB2 LEU 28 HB2 LEU 28 13.180 18.704 -17.172 179 HB3 LEU 28 HB1 LEU 28 12.851 20.425 -17.162 180 HG LEU 28 HG LEU 28 14.418 19.838 -18.949 181 HD11 LEU 28 HD11 LEU 28 14.590 22.038 -17.902 182 HD12 LEU 28 HD12 LEU 28 16.163 21.457 -18.444 183 HD13 LEU 28 HD13 LEU 28 15.741 21.393 -16.731 184 HD21 LEU 28 HD21 LEU 28 16.241 18.900 -16.733 185 HD22 LEU 28 HD22 LEU 28 16.671 19.036 -18.437 186 HD23 LEU 28 HD23 LEU 28 15.450 17.872 -17.926 187 H TRP 29 HN TRP 29 13.678 21.689 -13.907 188 HA TRP 29 HA TRP 29 11.158 20.660 -12.801 189 HB2 TRP 29 HB2 TRP 29 13.074 20.810 -11.242 190 HB3 TRP 29 HB1 TRP 29 13.182 22.536 -11.560 191 HD1 TRP 29 HD1 TRP 29 11.867 24.051 -9.953 192 HE1 TRP 29 HE1 TRP 29 10.036 23.694 -8.176 193 HE3 TRP 29 HE3 TRP 29 10.915 19.093 -10.753 194 HZ2 TRP 29 HZ2 TRP 29 8.425 21.588 -7.227 195 HZ3 TRP 29 HZ3 TRP 29 9.221 17.977 -9.358 196 HH2 TRP 29 HH2 TRP 29 8.001 19.201 -7.629 197 HA PRO 30 HA PRO 30 9.363 24.257 -14.788 198 HB2 PRO 30 HB2 PRO 30 6.882 23.247 -13.608 199 HB3 PRO 30 HB1 PRO 30 7.303 23.456 -15.309 200 HG2 PRO 30 HG2 PRO 30 7.052 21.023 -14.172 201 HG3 PRO 30 HG1 PRO 30 8.208 21.345 -15.477 202 HD2 PRO 30 HD2 PRO 30 8.688 21.129 -12.531 203 HD3 PRO 30 HD1 PRO 30 9.664 20.513 -13.882 204 H VAL 31 HN VAL 31 8.949 26.243 -14.011 205 HA VAL 31 HA VAL 31 9.053 26.750 -11.198 206 HB VAL 31 HB VAL 31 8.752 29.095 -11.738 207 HG11 VAL 31 HG11 VAL 31 10.623 29.421 -13.300 208 HG12 VAL 31 HG12 VAL 31 10.550 27.708 -13.719 209 HG13 VAL 31 HG13 VAL 31 10.967 28.196 -12.078 210 HG21 VAL 31 HG21 VAL 31 8.329 29.860 -14.020 211 HG22 VAL 31 HG22 VAL 31 6.992 28.886 -13.410 212 HG23 VAL 31 HG23 VAL 31 8.145 28.188 -14.550 213 H PHE 32 HN PHE 32 6.630 25.630 -13.097 214 HA PHE 32 HA PHE 32 4.335 26.937 -12.116 215 HB2 PHE 32 HB2 PHE 32 4.307 25.500 -14.105 216 HB3 PHE 32 HB1 PHE 32 4.695 24.099 -13.115 217 HD1 PHE 32 HD1 PHE 32 2.119 26.755 -13.521 218 HD2 PHE 32 HD2 PHE 32 2.992 22.777 -12.287 219 HE1 PHE 32 HE1 PHE 32 -0.284 26.338 -13.179 220 HE2 PHE 32 HE2 PHE 32 0.595 22.350 -11.947 221 HZ PHE 32 HZ PHE 32 -1.047 24.133 -12.389 222 H ALA 33 HN ALA 33 6.470 24.564 -10.782 223 HA ALA 33 HA ALA 33 4.679 24.229 -8.466 224 HB1 ALA 33 HB1 ALA 33 6.921 22.437 -9.408 225 HB2 ALA 33 HB2 ALA 33 5.192 22.110 -9.543 226 HB3 ALA 33 HB3 ALA 33 5.954 22.185 -7.954 227 H ASP 34 HN ASP 34 5.764 24.161 -6.344 228 HA ASP 34 HA ASP 34 7.540 26.402 -6.135 229 HB2 ASP 34 HB2 ASP 34 7.305 26.191 -3.752 230 HB3 ASP 34 HB1 ASP 34 5.724 25.955 -4.484 231 H ILE 35 HN ILE 35 9.644 26.477 -5.487 232 HA ILE 35 HA ILE 35 11.198 24.061 -5.856 233 HB ILE 35 HB ILE 35 12.131 26.835 -5.084 234 HG12 ILE 35 HG12 ILE 35 12.014 25.469 -7.781 235 HG13 ILE 35 HG11 ILE 35 11.025 26.830 -7.263 236 HG21 ILE 35 HG21 ILE 35 13.660 24.440 -6.093 237 HG22 ILE 35 HG22 ILE 35 13.736 25.119 -4.468 238 HG23 ILE 35 HG23 ILE 35 14.334 26.048 -5.841 239 HD11 ILE 35 HD11 ILE 35 12.990 28.235 -7.127 240 HD12 ILE 35 HD12 ILE 35 12.849 27.515 -8.732 241 HD13 ILE 35 HD13 ILE 35 14.015 26.870 -7.576 242 HA PRO 36 HA PRO 36 10.739 23.295 -1.517 243 HB2 PRO 36 HB2 PRO 36 11.472 20.736 -1.523 244 HB3 PRO 36 HB1 PRO 36 10.008 21.267 -2.353 245 HG2 PRO 36 HG2 PRO 36 12.702 20.642 -3.504 246 HG3 PRO 36 HG1 PRO 36 11.096 20.204 -4.115 247 HD2 PRO 36 HD2 PRO 36 12.597 22.355 -5.008 248 HD3 PRO 36 HD1 PRO 36 10.836 22.203 -5.179 249 H ALA 37 HN ALA 37 13.246 20.990 -1.649 250 HA ALA 37 HA ALA 37 15.310 22.790 -0.686 251 HB1 ALA 37 HB1 ALA 37 14.007 22.384 1.322 252 HB2 ALA 37 HB2 ALA 37 15.563 21.559 1.436 253 HB3 ALA 37 HB3 ALA 37 14.105 20.644 1.057 254 H GLY 38 HN GLY 38 17.370 21.584 -0.284 255 HA2 GLY 38 HA2 GLY 38 18.973 20.074 -0.972 256 HA3 GLY 38 HA1 GLY 38 17.679 18.909 -1.234 257 H TRP 39 HN TRP 39 17.777 22.052 -2.697 258 HA TRP 39 HA TRP 39 17.846 20.757 -5.327 259 HB2 TRP 39 HB2 TRP 39 16.717 22.856 -6.110 260 HB3 TRP 39 HB1 TRP 39 15.775 21.914 -4.962 261 HD1 TRP 39 HD1 TRP 39 15.275 23.000 -2.600 262 HE1 TRP 39 HE1 TRP 39 15.473 25.399 -1.700 263 HE3 TRP 39 HE3 TRP 39 18.191 25.015 -6.291 264 HZ2 TRP 39 HZ2 TRP 39 16.699 27.828 -2.457 265 HZ3 TRP 39 HZ3 TRP 39 18.829 27.382 -6.126 266 HH2 TRP 39 HH2 TRP 39 18.096 28.760 -4.244 267 H ARG 40 HN ARG 40 19.117 21.559 -6.958 268 HA ARG 40 HA ARG 40 20.914 23.791 -6.319 269 HB2 ARG 40 HB2 ARG 40 21.986 21.485 -6.030 270 HB3 ARG 40 HB1 ARG 40 21.829 21.307 -7.772 271 HG2 ARG 40 HG2 ARG 40 23.206 23.324 -8.075 272 HG3 ARG 40 HG1 ARG 40 23.406 23.424 -6.325 273 HD2 ARG 40 HD2 ARG 40 24.384 21.125 -6.389 274 HD3 ARG 40 HD1 ARG 40 24.330 21.214 -8.147 275 HE ARG 40 HE ARG 40 25.987 22.931 -6.412 276 HH11 ARG 40 HH11 ARG 40 25.293 21.471 -9.509 277 HH12 ARG 40 HH12 ARG 40 26.782 21.975 -10.244 278 HH21 ARG 40 HH21 ARG 40 27.957 23.628 -7.374 279 HH22 ARG 40 HH22 ARG 40 28.302 23.202 -9.026 280 H VAL 41 HN VAL 41 20.496 25.324 -7.789 281 HA VAL 41 HA VAL 41 19.314 24.613 -10.347 282 HB VAL 41 HB VAL 41 19.956 27.349 -9.225 283 HG11 VAL 41 HG11 VAL 41 18.523 28.209 -10.997 284 HG12 VAL 41 HG12 VAL 41 18.278 26.572 -11.610 285 HG13 VAL 41 HG13 VAL 41 19.879 27.308 -11.677 286 HG21 VAL 41 HG21 VAL 41 17.337 25.859 -9.377 287 HG22 VAL 41 HG22 VAL 41 17.550 27.517 -8.812 288 HG23 VAL 41 HG23 VAL 41 18.263 26.179 -7.911 289 H VAL 42 HN VAL 42 20.609 24.056 -11.952 290 HA VAL 42 HA VAL 42 23.343 25.072 -12.055 291 HB VAL 42 HB VAL 42 21.968 23.022 -13.802 292 HG11 VAL 42 HG11 VAL 42 24.209 22.430 -14.562 293 HG12 VAL 42 HG12 VAL 42 24.894 23.719 -13.573 294 HG13 VAL 42 HG13 VAL 42 23.847 24.117 -14.935 295 HG21 VAL 42 HG21 VAL 42 23.881 22.669 -11.501 296 HG22 VAL 42 HG22 VAL 42 23.257 21.380 -12.530 297 HG23 VAL 42 HG23 VAL 42 22.159 22.286 -11.490 298 H HIS 43 HN HIS 43 20.296 25.320 -13.747 299 HA HIS 43 HA HIS 43 21.316 27.523 -15.334 300 HB2 HIS 43 HB2 HIS 43 21.792 25.322 -16.571 301 HB3 HIS 43 HB1 HIS 43 20.050 25.189 -16.770 302 HD1 HIS 43 HD1 HIS 43 18.913 26.865 -18.405 303 HD2 HIS 43 HD2 HIS 43 23.052 27.200 -18.179 304 HE1 HIS 43 HE1 HIS 43 19.592 28.285 -20.369 305 HE2 HIS 43 HE2 HIS 43 22.108 28.351 -20.296 306 H GLY 44 HN GLY 44 19.677 28.890 -16.064 307 HA2 GLY 44 HA2 GLY 44 17.127 28.529 -14.715 308 HA3 GLY 44 HA1 GLY 44 17.654 29.963 -15.573 309 H GLU 45 HN GLU 45 15.755 30.211 -16.742 310 HA GLU 45 HA GLU 45 14.747 27.899 -18.181 311 HB2 GLU 45 HB2 GLU 45 12.947 29.765 -18.838 312 HB3 GLU 45 HB1 GLU 45 12.857 28.805 -17.369 313 HG2 GLU 45 HG2 GLU 45 12.446 31.005 -16.712 314 HG3 GLU 45 HG1 GLU 45 14.100 30.646 -16.242 315 H ALA 46 HN ALA 46 15.957 27.551 -19.743 316 HA ALA 46 HA ALA 46 15.806 29.362 -22.042 317 HB1 ALA 46 HB1 ALA 46 18.274 27.819 -21.236 318 HB2 ALA 46 HB2 ALA 46 18.085 29.571 -21.215 319 HB3 ALA 46 HB3 ALA 46 18.072 28.703 -22.749 320 H SER 47 HN SER 47 16.284 28.065 -24.097 321 HA SER 47 HA SER 47 14.297 26.446 -24.715 322 HB2 SER 47 HB2 SER 47 17.104 25.895 -25.692 323 HB3 SER 47 HB1 SER 47 15.594 25.579 -26.552 324 HG SER 47 HG SER 47 17.014 27.918 -26.266 325 H ARG 48 HN ARG 48 13.505 24.499 -24.322 326 HA ARG 48 HA ARG 48 14.477 23.009 -22.133 327 HB2 ARG 48 HB2 ARG 48 12.093 23.221 -22.783 328 HB3 ARG 48 HB1 ARG 48 12.408 22.224 -24.192 329 HG2 ARG 48 HG2 ARG 48 13.096 21.107 -21.531 330 HG3 ARG 48 HG1 ARG 48 11.390 21.250 -21.955 331 HD2 ARG 48 HD2 ARG 48 13.503 19.812 -23.555 332 HD3 ARG 48 HD1 ARG 48 12.277 19.050 -22.543 333 HE ARG 48 HE ARG 48 11.269 20.777 -24.651 334 HH11 ARG 48 HH11 ARG 48 12.038 17.517 -23.623 335 HH12 ARG 48 HH12 ARG 48 11.110 16.755 -24.882 336 HH21 ARG 48 HH21 ARG 48 10.015 19.799 -26.279 337 HH22 ARG 48 HH22 ARG 48 9.966 18.065 -26.410 338 H ALA 49 HN ALA 49 14.680 22.543 -25.620 339 HA ALA 49 HA ALA 49 15.754 19.927 -25.572 340 HB1 ALA 49 HB1 ALA 49 16.129 22.080 -27.650 341 HB2 ALA 49 HB2 ALA 49 14.789 20.935 -27.589 342 HB3 ALA 49 HB3 ALA 49 16.430 20.358 -27.874 343 H ALA 50 HN ALA 50 17.203 23.127 -25.364 344 HA ALA 50 HA ALA 50 19.903 22.262 -25.570 345 HB1 ALA 50 HB1 ALA 50 20.475 24.492 -24.762 346 HB2 ALA 50 HB2 ALA 50 18.789 24.773 -24.321 347 HB3 ALA 50 HB3 ALA 50 19.237 24.573 -26.017 348 H CYS 51 HN CYS 51 17.738 22.931 -22.852 349 HA CYS 51 HA CYS 51 19.585 22.475 -20.788 350 HB2 CYS 51 HB2 CYS 51 16.589 22.069 -20.828 351 HB3 CYS 51 HB1 CYS 51 17.582 22.100 -19.374 352 HG CYS 51 HG CYS 51 16.472 24.653 -21.260 353 H LEU 52 HN LEU 52 17.191 20.260 -22.229 354 HA LEU 52 HA LEU 52 17.880 17.936 -20.884 355 HB2 LEU 52 HB2 LEU 52 16.584 18.568 -23.451 356 HB3 LEU 52 HB1 LEU 52 17.287 16.967 -23.351 357 HG LEU 52 HG LEU 52 15.936 16.510 -21.339 358 HD11 LEU 52 HD11 LEU 52 14.089 18.023 -20.771 359 HD12 LEU 52 HD12 LEU 52 14.732 19.210 -21.907 360 HD13 LEU 52 HD13 LEU 52 15.670 18.751 -20.485 361 HD21 LEU 52 HD21 LEU 52 14.334 17.431 -23.719 362 HD22 LEU 52 HD22 LEU 52 13.805 16.290 -22.484 363 HD23 LEU 52 HD23 LEU 52 15.140 15.869 -23.558 364 H ASP 53 HN ASP 53 19.213 19.168 -23.944 365 HA ASP 53 HA ASP 53 20.977 17.028 -24.386 366 HB2 ASP 53 HB2 ASP 53 20.326 18.782 -26.059 367 HB3 ASP 53 HB1 ASP 53 21.399 19.904 -25.225 368 H TYR 54 HN TYR 54 21.381 20.079 -22.673 369 HA TYR 54 HA TYR 54 24.112 19.918 -22.121 370 HB2 TYR 54 HB2 TYR 54 22.735 21.945 -21.775 371 HB3 TYR 54 HB1 TYR 54 21.935 21.157 -20.422 372 HD1 TYR 54 HD1 TYR 54 25.273 22.291 -21.603 373 HD2 TYR 54 HD2 TYR 54 22.809 21.354 -18.266 374 HE1 TYR 54 HE1 TYR 54 26.995 23.184 -20.093 375 HE2 TYR 54 HE2 TYR 54 24.526 22.238 -16.743 376 HH TYR 54 HH TYR 54 27.161 24.104 -17.833 377 H VAL 55 HN VAL 55 21.316 18.715 -20.238 378 HA VAL 55 HA VAL 55 23.011 17.651 -18.193 379 HB VAL 55 HB VAL 55 21.034 16.535 -17.284 380 HG11 VAL 55 HG11 VAL 55 20.527 19.381 -18.133 381 HG12 VAL 55 HG12 VAL 55 21.450 18.860 -16.725 382 HG13 VAL 55 HG13 VAL 55 19.718 18.544 -16.809 383 HG21 VAL 55 HG21 VAL 55 19.622 17.573 -19.736 384 HG22 VAL 55 HG22 VAL 55 18.829 16.869 -18.328 385 HG23 VAL 55 HG23 VAL 55 19.903 15.883 -19.321 386 H GLU 56 HN GLU 56 21.586 16.325 -21.134 387 HA GLU 56 HA GLU 56 22.183 13.610 -20.591 388 HB2 GLU 56 HB2 GLU 56 21.747 15.067 -23.193 389 HB3 GLU 56 HB1 GLU 56 22.010 13.332 -23.101 390 HG2 GLU 56 HG2 GLU 56 20.014 13.209 -21.588 391 HG3 GLU 56 HG1 GLU 56 19.717 14.906 -21.963 392 H LYS 57 HN LYS 57 24.115 16.234 -21.897 393 HA LYS 57 HA LYS 57 26.213 14.416 -22.722 394 HB2 LYS 57 HB2 LYS 57 25.936 17.402 -22.731 395 HB3 LYS 57 HB1 LYS 57 27.484 16.633 -23.060 396 HG2 LYS 57 HG2 LYS 57 26.447 15.387 -24.909 397 HG3 LYS 57 HG1 LYS 57 24.926 16.229 -24.600 398 HD2 LYS 57 HD2 LYS 57 25.880 18.332 -25.181 399 HD3 LYS 57 HD1 LYS 57 27.509 17.649 -25.213 400 HE2 LYS 57 HE2 LYS 57 26.651 17.986 -27.470 401 HE3 LYS 57 HE1 LYS 57 26.902 16.275 -27.131 402 HZ1 LYS 57 HZ1 LYS 57 24.557 15.996 -26.785 403 HZ2 LYS 57 HZ2 LYS 57 24.794 16.746 -28.286 404 HZ3 LYS 57 HZ3 LYS 57 24.278 17.660 -26.954 405 H ASN 58 HN ASN 58 25.392 15.743 -19.704 406 HA ASN 58 HA ASN 58 28.230 15.934 -18.967 407 HB2 ASN 58 HB2 ASN 58 25.896 17.588 -18.140 408 HB3 ASN 58 HB1 ASN 58 27.277 17.435 -17.055 409 HD21 ASN 58 HD21 ASN 58 26.082 18.782 -19.989 410 HD22 ASN 58 HD22 ASN 58 27.486 19.724 -20.373 411 H TRP 59 HN TRP 59 26.138 13.598 -18.618 412 HA TRP 59 HA TRP 59 26.192 13.201 -15.772 413 HB2 TRP 59 HB2 TRP 59 25.476 10.867 -16.304 414 HB3 TRP 59 HB1 TRP 59 24.441 12.107 -16.999 415 HD1 TRP 59 HD1 TRP 59 24.201 12.176 -19.585 416 HE1 TRP 59 HE1 TRP 59 25.008 10.667 -21.499 417 HE3 TRP 59 HE3 TRP 59 27.535 9.293 -17.001 418 HZ2 TRP 59 HZ2 TRP 59 26.813 8.529 -21.872 419 HZ3 TRP 59 HZ3 TRP 59 28.756 7.533 -18.209 420 HH2 TRP 59 HH2 TRP 59 28.402 7.158 -20.594 421 H THR 60 HN THR 60 28.684 13.433 -17.682 422 HA THR 60 HA THR 60 30.171 11.107 -17.678 423 HB THR 60 HB THR 60 31.451 13.800 -17.316 424 HG1 THR 60 HG1 THR 60 30.079 12.808 -19.616 425 HG21 THR 60 HG21 THR 60 32.091 11.427 -19.076 426 HG22 THR 60 HG22 THR 60 32.909 11.842 -17.569 427 HG23 THR 60 HG23 THR 60 33.034 12.914 -18.966 428 H ASP 61 HN ASP 61 29.748 13.454 -15.096 429 HA ASP 61 HA ASP 61 31.962 12.421 -13.557 430 HB2 ASP 61 HB2 ASP 61 29.869 14.514 -12.996 431 HB3 ASP 61 HB1 ASP 61 31.039 14.005 -11.786 432 H LEU 62 HN LEU 62 28.868 11.335 -14.062 433 HA LEU 62 HA LEU 62 28.387 10.514 -11.320 434 HB2 LEU 62 HB2 LEU 62 26.796 10.263 -13.854 435 HB3 LEU 62 HB1 LEU 62 26.345 9.387 -12.406 436 HG LEU 62 HG LEU 62 25.005 11.351 -12.498 437 HD11 LEU 62 HD11 LEU 62 25.627 12.516 -10.445 438 HD12 LEU 62 HD12 LEU 62 27.230 11.785 -10.516 439 HD13 LEU 62 HD13 LEU 62 25.807 10.769 -10.283 440 HD21 LEU 62 HD21 LEU 62 27.553 12.927 -12.812 441 HD22 LEU 62 HD22 LEU 62 25.938 13.608 -12.615 442 HD23 LEU 62 HD23 LEU 62 26.328 12.664 -14.053 443 H ARG 63 HN ARG 63 28.181 8.649 -14.363 444 HA ARG 63 HA ARG 63 30.104 6.724 -13.475 445 HB2 ARG 63 HB2 ARG 63 28.267 5.995 -12.067 446 HB3 ARG 63 HB1 ARG 63 27.179 5.963 -13.448 447 HG2 ARG 63 HG2 ARG 63 28.349 4.122 -14.419 448 HG3 ARG 63 HG1 ARG 63 29.626 4.233 -13.208 449 HD2 ARG 63 HD2 ARG 63 28.096 2.397 -12.722 450 HD3 ARG 63 HD1 ARG 63 28.042 3.627 -11.462 451 HE ARG 63 HE ARG 63 25.991 4.414 -12.907 452 HH11 ARG 63 HH11 ARG 63 26.944 1.126 -12.163 453 HH12 ARG 63 HH12 ARG 63 25.311 0.531 -12.086 454 HH21 ARG 63 HH21 ARG 63 23.842 3.639 -12.820 455 HH22 ARG 63 HH22 ARG 63 23.547 1.959 -12.481 456 HA PRO 64 HA PRO 64 29.981 6.390 -17.934 457 HB2 PRO 64 HB2 PRO 64 32.366 4.769 -17.707 458 HB3 PRO 64 HB1 PRO 64 32.213 6.417 -18.315 459 HG2 PRO 64 HG2 PRO 64 33.506 5.767 -15.994 460 HG3 PRO 64 HG1 PRO 64 32.757 7.345 -16.298 461 HD2 PRO 64 HD2 PRO 64 31.715 5.017 -14.727 462 HD3 PRO 64 HD1 PRO 64 31.623 6.755 -14.363 463 H LYS 65 HN LYS 65 30.265 4.524 -19.492 464 HA LYS 65 HA LYS 65 29.637 2.515 -20.307 465 HB2 LYS 65 HB2 LYS 65 30.451 1.676 -17.542 466 HB3 LYS 65 HB1 LYS 65 29.771 0.518 -18.672 467 HG2 LYS 65 HG2 LYS 65 32.096 0.300 -18.845 468 HG3 LYS 65 HG1 LYS 65 31.596 1.198 -20.277 469 HD2 LYS 65 HD2 LYS 65 32.233 3.299 -19.119 470 HD3 LYS 65 HD1 LYS 65 32.835 2.332 -17.771 471 HE2 LYS 65 HE2 LYS 65 34.668 2.958 -19.221 472 HE3 LYS 65 HE1 LYS 65 34.406 1.216 -19.296 473 HZ1 LYS 65 HZ1 LYS 65 33.475 3.202 -21.300 474 HZ2 LYS 65 HZ2 LYS 65 33.191 1.533 -21.373 475 HZ3 LYS 65 HZ3 LYS 65 34.771 2.128 -21.494 476 H SER 66 HN SER 66 27.770 4.199 -18.292 477 HA SER 66 HA SER 66 25.676 2.154 -18.129 478 HB2 SER 66 HB2 SER 66 26.290 3.323 -16.019 479 HB3 SER 66 HB1 SER 66 25.785 4.847 -16.744 480 HG SER 66 HG SER 66 23.905 2.840 -16.921 481 H LEU 67 HN LEU 67 24.378 2.132 -19.795 482 HA LEU 67 HA LEU 67 22.869 4.434 -20.548 483 HB2 LEU 67 HB2 LEU 67 23.517 4.642 -22.828 484 HB3 LEU 67 HB1 LEU 67 24.987 4.729 -21.884 485 HG LEU 67 HG LEU 67 24.076 2.219 -23.300 486 HD11 LEU 67 HD11 LEU 67 26.031 4.325 -24.211 487 HD12 LEU 67 HD12 LEU 67 24.463 3.978 -24.936 488 HD13 LEU 67 HD13 LEU 67 25.749 2.774 -25.002 489 HD21 LEU 67 HD21 LEU 67 26.410 1.533 -23.008 490 HD22 LEU 67 HD22 LEU 67 25.630 1.835 -21.455 491 HD23 LEU 67 HD23 LEU 67 26.739 3.027 -22.132 492 H ARG 68 HN ARG 68 21.535 3.669 -22.680 493 HA ARG 68 HA ARG 68 21.082 0.793 -22.535 494 HB2 ARG 68 HB2 ARG 68 18.706 0.977 -22.337 495 HB3 ARG 68 HB1 ARG 68 19.421 1.906 -21.030 496 HG2 ARG 68 HG2 ARG 68 18.784 3.933 -21.944 497 HG3 ARG 68 HG1 ARG 68 18.624 3.265 -23.571 498 HD2 ARG 68 HD2 ARG 68 16.819 2.699 -21.218 499 HD3 ARG 68 HD1 ARG 68 16.432 3.711 -22.611 500 HE ARG 68 HE ARG 68 17.006 1.400 -23.808 501 HH11 ARG 68 HH11 ARG 68 14.976 2.079 -21.033 502 HH12 ARG 68 HH12 ARG 68 13.949 0.706 -21.294 503 HH21 ARG 68 HH21 ARG 68 15.692 -0.421 -24.131 504 HH22 ARG 68 HH22 ARG 68 14.362 -0.731 -23.043 505 H ASP 69 HN ASP 69 19.230 0.327 -24.285 506 HA ASP 69 HA ASP 69 20.447 1.025 -26.772 507 HB2 ASP 69 HB2 ASP 69 18.849 -0.461 -27.773 508 HB3 ASP 69 HB1 ASP 69 19.366 -1.195 -26.258 509 H ALA 70 HN ALA 70 19.515 2.134 -28.502 510 HA ALA 70 HA ALA 70 17.033 3.621 -27.940 511 HB1 ALA 70 HB1 ALA 70 17.831 5.380 -29.457 512 HB2 ALA 70 HB2 ALA 70 19.346 4.506 -29.674 513 HB3 ALA 70 HB3 ALA 70 18.931 5.169 -28.094 514 H MET 71 HN MET 71 15.964 1.739 -28.723 515 HA MET 71 HA MET 71 16.649 0.525 -31.189 516 HB2 MET 71 HB2 MET 71 15.527 -0.643 -29.305 517 HB3 MET 71 HB1 MET 71 14.071 0.285 -29.636 518 HG2 MET 71 HG2 MET 71 13.990 -1.986 -30.563 519 HG3 MET 71 HG1 MET 71 13.855 -0.741 -31.805 520 HE1 MET 71 HE1 MET 71 16.228 -3.319 -30.059 521 HE2 MET 71 HE2 MET 71 17.161 -1.826 -29.943 522 HE3 MET 71 HE3 MET 71 17.717 -3.137 -30.986 523 H VAL 72 HN VAL 72 15.636 0.555 -33.151 524 HA VAL 72 HA VAL 72 14.261 3.028 -33.796 525 HB VAL 72 HB VAL 72 14.501 2.288 -36.147 526 HG11 VAL 72 HG11 VAL 72 17.031 2.172 -34.505 527 HG12 VAL 72 HG12 VAL 72 16.261 3.622 -35.146 528 HG13 VAL 72 HG13 VAL 72 16.962 2.436 -36.247 529 HG21 VAL 72 HG21 VAL 72 15.858 0.301 -36.658 530 HG22 VAL 72 HG22 VAL 72 14.360 -0.119 -35.826 531 HG23 VAL 72 HG23 VAL 72 15.887 -0.108 -34.942 532 H GLU 73 HN GLU 73 12.240 3.077 -34.918 533 HA GLU 73 HA GLU 73 10.492 0.881 -34.108 534 HB2 GLU 73 HB2 GLU 73 10.131 3.554 -33.880 535 HB3 GLU 73 HB1 GLU 73 9.362 3.284 -35.437 536 HG2 GLU 73 HG2 GLU 73 8.640 2.040 -32.797 537 HG3 GLU 73 HG1 GLU 73 7.691 3.180 -33.746 538 H ASP 74 HN ASP 74 10.795 -0.693 -35.615 539 HA ASP 74 HA ASP 74 9.835 -0.057 -38.308 540 HB2 ASP 74 HB2 ASP 74 12.352 -0.299 -38.296 541 HB3 ASP 74 HB1 ASP 74 12.121 -1.967 -37.782
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