NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
612824 | 2nbo | 25986 | 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 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 HA2 GLY 1 1.571 0.650 -1.951 3 HA3 GLY 1 HA3 GLY 1 3.064 0.385 -1.062 4 HA PRO 2 HA PRO 2 1.352 -3.951 -2.432 5 HB2 PRO 2 HB2 PRO 2 -0.491 -3.886 -4.424 6 HB3 PRO 2 HB3 PRO 2 -0.927 -3.877 -2.711 7 HG2 PRO 2 HG2 PRO 2 -0.750 -1.588 -4.632 8 HG3 PRO 2 HG3 PRO 2 -1.988 -1.929 -3.410 9 HD2 PRO 2 HD2 PRO 2 -0.006 -0.128 -3.013 10 HD3 PRO 2 HD3 PRO 2 -0.702 -1.087 -1.692 11 H THR 3 H THR 3 1.204 -5.046 -4.816 12 HA THR 3 HA THR 3 3.650 -4.617 -6.032 13 HB THR 3 HB THR 3 2.917 -6.017 -7.838 14 HG1 THR 3 HG1 THR 3 0.897 -6.043 -8.503 15 HG21 THR 3 HG21 THR 3 1.417 -6.924 -5.382 16 HG22 THR 3 HG22 THR 3 3.167 -7.041 -5.562 17 HG23 THR 3 HG23 THR 3 2.107 -7.933 -6.652 18 H GLY 4 H GLY 4 4.299 -3.628 -7.974 19 HA2 GLY 4 HA2 GLY 4 3.399 -2.381 -9.989 20 HA3 GLY 4 HA3 GLY 4 2.541 -1.406 -8.806 21 H THR 5 H THR 5 3.779 -0.072 -7.362 22 HA THR 5 HA THR 5 6.268 0.838 -8.615 23 HB THR 5 HB THR 5 5.969 2.895 -7.266 24 HG1 THR 5 HG1 THR 5 4.772 2.341 -5.531 25 HG21 THR 5 HG21 THR 5 3.899 1.947 -9.191 26 HG22 THR 5 HG22 THR 5 5.092 3.234 -9.362 27 HG23 THR 5 HG23 THR 5 3.652 3.491 -8.377 28 H GLY 6 H GLY 6 7.609 -0.809 -7.724 29 HA2 GLY 6 HA2 GLY 6 7.838 -1.003 -4.835 30 HA3 GLY 6 HA3 GLY 6 8.751 -1.926 -6.020 31 H GLU 7 H GLU 7 8.373 1.549 -5.302 32 HA GLU 7 HA GLU 7 11.306 1.709 -5.081 33 HB2 GLU 7 HB2 GLU 7 10.004 2.747 -7.172 34 HB3 GLU 7 HB3 GLU 7 9.797 4.082 -6.047 35 HG2 GLU 7 HG2 GLU 7 12.000 4.621 -6.054 36 HG3 GLU 7 HG3 GLU 7 12.520 2.961 -6.339 37 H SER 8 H SER 8 11.908 3.936 -4.053 38 HA SER 8 HA SER 8 10.408 4.090 -1.550 39 HB2 SER 8 HB2 SER 8 12.349 4.819 -0.535 40 HB3 SER 8 HB3 SER 8 13.030 3.863 -1.851 41 HG SER 8 HG SER 8 13.845 5.616 -2.664 42 H LYS 9 H LYS 9 10.839 6.541 -0.610 43 HA LYS 9 HA LYS 9 9.524 8.300 -2.574 44 HB2 LYS 9 HB2 LYS 9 9.338 8.568 0.423 45 HB3 LYS 9 HB3 LYS 9 8.336 9.345 -0.795 46 HG2 LYS 9 HG2 LYS 9 6.902 7.717 -0.156 47 HG3 LYS 9 HG3 LYS 9 7.781 6.818 -1.395 48 HD2 LYS 9 HD2 LYS 9 9.359 6.266 0.668 49 HD3 LYS 9 HD3 LYS 9 7.869 6.570 1.566 50 HE2 LYS 9 HE2 LYS 9 7.875 4.752 -0.814 51 HE3 LYS 9 HE3 LYS 9 8.397 4.164 0.764 52 HZ1 LYS 9 HZ1 LYS 9 6.129 3.678 0.641 53 HZ2 LYS 9 HZ2 LYS 9 5.734 5.185 -0.017 54 HZ3 LYS 9 HZ3 LYS 9 6.201 5.066 1.605 55 H CYS 10 H CYS 10 11.280 8.746 0.498 56 HA CYS 10 HA CYS 10 12.287 11.264 -0.048 57 HB2 CYS 10 HB2 CYS 10 13.081 9.049 1.777 58 HB3 CYS 10 HB3 CYS 10 14.231 10.360 1.540 59 HG CYS 10 HG CYS 10 11.770 12.120 2.092 60 HA PRO 11 HA PRO 11 15.552 10.855 -2.946 61 HB2 PRO 11 HB2 PRO 11 17.427 12.556 -1.965 62 HB3 PRO 11 HB3 PRO 11 15.921 13.110 -2.708 63 HG2 PRO 11 HG2 PRO 11 16.611 12.824 0.191 64 HG3 PRO 11 HG3 PRO 11 15.752 14.140 -0.630 65 HD2 PRO 11 HD2 PRO 11 14.465 12.209 0.766 66 HD3 PRO 11 HD3 PRO 11 13.757 12.986 -0.664 67 H LEU 12 H LEU 12 16.487 10.530 0.445 68 HA LEU 12 HA LEU 12 18.266 8.339 -0.286 69 HB2 LEU 12 HB2 LEU 12 19.660 10.377 -0.230 70 HB3 LEU 12 HB3 LEU 12 19.164 10.642 1.440 71 HG LEU 12 HG LEU 12 21.469 9.614 1.012 72 HD11 LEU 12 HD11 LEU 12 20.188 7.730 2.808 73 HD12 LEU 12 HD12 LEU 12 19.659 9.389 3.085 74 HD13 LEU 12 HD13 LEU 12 21.376 8.989 3.146 75 HD21 LEU 12 HD21 LEU 12 21.660 7.380 0.434 76 HD22 LEU 12 HD22 LEU 12 20.388 7.945 -0.649 77 HD23 LEU 12 HD23 LEU 12 19.971 7.032 0.803 78 H MET 13 H MET 13 17.604 6.682 0.898 79 HA MET 13 HA MET 13 17.003 7.131 3.738 80 HB2 MET 13 HB2 MET 13 15.133 5.531 3.591 81 HB3 MET 13 HB3 MET 13 14.862 6.958 2.600 82 HG2 MET 13 HG2 MET 13 14.959 5.804 0.658 83 HG3 MET 13 HG3 MET 13 16.125 4.638 1.279 84 HE1 MET 13 HE1 MET 13 14.388 3.515 4.040 85 HE2 MET 13 HE2 MET 13 14.089 2.043 3.116 86 HE3 MET 13 HE3 MET 13 15.628 2.890 2.953 87 H VAL 14 H VAL 14 17.463 5.394 5.122 88 HA VAL 14 HA VAL 14 19.345 3.450 3.986 89 HB VAL 14 HB VAL 14 18.918 4.283 6.859 90 HG11 VAL 14 HG11 VAL 14 19.640 1.996 6.801 91 HG12 VAL 14 HG12 VAL 14 20.899 2.375 5.624 92 HG13 VAL 14 HG13 VAL 14 21.011 3.001 7.269 93 HG21 VAL 14 HG21 VAL 14 20.977 5.470 6.683 94 HG22 VAL 14 HG22 VAL 14 21.282 4.824 5.071 95 HG23 VAL 14 HG23 VAL 14 19.967 5.970 5.327 96 H LYS 15 H LYS 15 18.902 1.339 3.924 97 HA LYS 15 HA LYS 15 16.573 0.361 5.442 98 HB2 LYS 15 HB2 LYS 15 15.937 0.433 3.135 99 HB3 LYS 15 HB3 LYS 15 17.444 -0.322 2.634 100 HG2 LYS 15 HG2 LYS 15 15.680 -1.934 2.499 101 HG3 LYS 15 HG3 LYS 15 16.758 -2.381 3.823 102 HD2 LYS 15 HD2 LYS 15 14.535 -0.637 4.607 103 HD3 LYS 15 HD3 LYS 15 14.040 -2.220 4.003 104 HE2 LYS 15 HE2 LYS 15 16.072 -2.926 5.638 105 HE3 LYS 15 HE3 LYS 15 15.478 -1.490 6.470 106 HZ1 LYS 15 HZ1 LYS 15 13.189 -2.622 6.123 107 HZ2 LYS 15 HZ2 LYS 15 14.193 -3.138 7.382 108 HZ3 LYS 15 HZ3 LYS 15 14.102 -4.036 5.951 109 H VAL 16 H VAL 16 17.325 -0.868 7.041 110 HA VAL 16 HA VAL 16 19.427 -2.835 6.407 111 HB VAL 16 HB VAL 16 19.047 -1.391 9.034 112 HG11 VAL 16 HG11 VAL 16 20.187 -3.043 9.977 113 HG12 VAL 16 HG12 VAL 16 20.268 -3.890 8.430 114 HG13 VAL 16 HG13 VAL 16 21.530 -2.740 8.875 115 HG21 VAL 16 HG21 VAL 16 21.260 -0.415 8.538 116 HG22 VAL 16 HG22 VAL 16 21.214 -1.171 6.945 117 HG23 VAL 16 HG23 VAL 16 20.030 0.065 7.369 118 H LEU 17 H LEU 17 18.740 -4.855 6.579 119 HA LEU 17 HA LEU 17 16.814 -5.545 8.676 120 HB2 LEU 17 HB2 LEU 17 15.331 -6.623 7.264 121 HB3 LEU 17 HB3 LEU 17 15.742 -5.160 6.372 122 HG LEU 17 HG LEU 17 17.569 -7.043 5.465 123 HD11 LEU 17 HD11 LEU 17 16.631 -9.077 5.279 124 HD12 LEU 17 HD12 LEU 17 15.007 -8.427 5.064 125 HD13 LEU 17 HD13 LEU 17 15.694 -8.563 6.682 126 HD21 LEU 17 HD21 LEU 17 16.693 -6.528 3.431 127 HD22 LEU 17 HD22 LEU 17 15.973 -5.223 4.374 128 HD23 LEU 17 HD23 LEU 17 15.025 -6.661 3.988 129 H ASP 18 H ASP 18 16.906 -7.701 9.385 130 HA ASP 18 HA ASP 18 19.490 -8.941 9.002 131 HB2 ASP 18 HB2 ASP 18 17.228 -9.241 10.905 132 HB3 ASP 18 HB3 ASP 18 18.236 -10.660 10.636 133 H ALA 19 H ALA 19 19.813 -10.208 7.301 134 HA ALA 19 HA ALA 19 17.800 -11.391 5.744 135 HB1 ALA 19 HB1 ALA 19 20.453 -12.682 5.715 136 HB2 ALA 19 HB2 ALA 19 19.476 -12.058 4.385 137 HB3 ALA 19 HB3 ALA 19 20.425 -10.951 5.376 138 H VAL 20 H VAL 20 19.147 -12.340 8.728 139 HA VAL 20 HA VAL 20 19.072 -15.104 8.663 140 HB VAL 20 HB VAL 20 18.196 -13.396 10.994 141 HG11 VAL 20 HG11 VAL 20 19.286 -16.200 10.816 142 HG12 VAL 20 HG12 VAL 20 19.104 -15.298 12.322 143 HG13 VAL 20 HG13 VAL 20 17.683 -15.709 11.361 144 HG21 VAL 20 HG21 VAL 20 20.810 -13.780 9.732 145 HG22 VAL 20 HG22 VAL 20 20.254 -12.517 10.830 146 HG23 VAL 20 HG23 VAL 20 20.796 -14.067 11.472 147 H ARG 21 H ARG 21 16.424 -12.867 9.473 148 HA ARG 21 HA ARG 21 14.536 -15.085 9.020 149 HB2 ARG 21 HB2 ARG 21 13.875 -12.643 10.641 150 HB3 ARG 21 HB3 ARG 21 13.097 -14.220 10.657 151 HG2 ARG 21 HG2 ARG 21 14.258 -14.455 12.568 152 HG3 ARG 21 HG3 ARG 21 15.555 -14.925 11.467 153 HD2 ARG 21 HD2 ARG 21 16.190 -12.459 11.426 154 HD3 ARG 21 HD3 ARG 21 15.107 -12.270 12.804 155 HE ARG 21 HE ARG 21 16.962 -14.371 13.247 156 HH11 ARG 21 HH11 ARG 21 16.675 -10.902 13.194 157 HH12 ARG 21 HH12 ARG 21 17.964 -10.647 14.324 158 HH21 ARG 21 HH21 ARG 21 18.660 -14.049 14.736 159 HH22 ARG 21 HH22 ARG 21 19.093 -12.438 15.200 160 H GLY 22 H GLY 22 15.579 -11.999 8.013 161 HA2 GLY 22 HA2 GLY 22 14.938 -11.023 5.961 162 HA3 GLY 22 HA3 GLY 22 13.434 -11.930 6.025 163 H SER 23 H SER 23 13.970 -10.609 9.020 164 HA SER 23 HA SER 23 12.006 -8.515 8.503 165 HB2 SER 23 HB2 SER 23 12.747 -8.635 11.261 166 HB3 SER 23 HB3 SER 23 11.219 -9.102 10.515 167 HG SER 23 HG SER 23 12.598 -10.747 11.714 168 HA PRO 24 HA PRO 24 14.724 -5.092 8.864 169 HB2 PRO 24 HB2 PRO 24 13.298 -3.348 10.379 170 HB3 PRO 24 HB3 PRO 24 12.885 -3.725 8.702 171 HG2 PRO 24 HG2 PRO 24 11.700 -4.799 11.233 172 HG3 PRO 24 HG3 PRO 24 10.883 -4.279 9.748 173 HD2 PRO 24 HD2 PRO 24 11.340 -6.885 10.323 174 HD3 PRO 24 HD3 PRO 24 11.325 -6.263 8.660 175 H ALA 25 H ALA 25 16.249 -4.098 10.185 176 HA ALA 25 HA ALA 25 16.584 -5.334 12.814 177 HB1 ALA 25 HB1 ALA 25 18.882 -4.602 12.696 178 HB2 ALA 25 HB2 ALA 25 18.449 -5.433 11.201 179 HB3 ALA 25 HB3 ALA 25 18.543 -3.673 11.235 180 H ILE 26 H ILE 26 16.554 -4.224 14.696 181 HA ILE 26 HA ILE 26 15.836 -1.378 14.539 182 HB ILE 26 HB ILE 26 15.086 -3.571 16.385 183 HG12 ILE 26 HG12 ILE 26 13.684 -2.305 14.570 184 HG13 ILE 26 HG13 ILE 26 12.943 -2.729 16.109 185 HG21 ILE 26 HG21 ILE 26 14.467 -1.833 18.126 186 HG22 ILE 26 HG22 ILE 26 16.176 -2.250 18.002 187 HG23 ILE 26 HG23 ILE 26 15.581 -0.749 17.292 188 HD11 ILE 26 HD11 ILE 26 13.278 -0.477 16.921 189 HD12 ILE 26 HD12 ILE 26 14.104 -0.040 15.424 190 HD13 ILE 26 HD13 ILE 26 12.391 -0.456 15.397 191 H ASN 27 H ASN 27 16.988 0.164 15.598 192 HA ASN 27 HA ASN 27 18.730 1.169 16.658 193 HB2 ASN 27 HB2 ASN 27 19.033 -1.436 18.164 194 HB3 ASN 27 HB3 ASN 27 19.617 0.149 18.662 195 HD21 ASN 27 HD21 ASN 27 17.333 1.635 17.927 196 HD22 ASN 27 HD22 ASN 27 16.060 1.222 19.019 197 H VAL 28 H VAL 28 19.512 0.600 14.301 198 HA VAL 28 HA VAL 28 22.032 -0.914 14.524 199 HB VAL 28 HB VAL 28 20.420 -0.344 12.032 200 HG11 VAL 28 HG11 VAL 28 22.839 -0.443 11.630 201 HG12 VAL 28 HG12 VAL 28 22.895 -2.030 12.401 202 HG13 VAL 28 HG13 VAL 28 21.994 -1.808 10.900 203 HG21 VAL 28 HG21 VAL 28 20.652 -3.093 12.420 204 HG22 VAL 28 HG22 VAL 28 20.256 -2.441 14.009 205 HG23 VAL 28 HG23 VAL 28 19.204 -2.109 12.633 206 H ALA 29 H ALA 29 23.680 0.438 14.805 207 HA ALA 29 HA ALA 29 23.716 3.164 14.256 208 HB1 ALA 29 HB1 ALA 29 25.475 2.817 15.586 209 HB2 ALA 29 HB2 ALA 29 25.655 1.144 15.058 210 HB3 ALA 29 HB3 ALA 29 26.364 2.449 14.107 211 H VAL 30 H VAL 30 23.831 4.281 12.427 212 HA VAL 30 HA VAL 30 25.195 3.106 10.110 213 HB VAL 30 HB VAL 30 22.456 4.378 10.034 214 HG11 VAL 30 HG11 VAL 30 23.044 3.307 7.537 215 HG12 VAL 30 HG12 VAL 30 22.971 5.017 7.965 216 HG13 VAL 30 HG13 VAL 30 24.512 4.159 8.015 217 HG21 VAL 30 HG21 VAL 30 22.801 1.910 10.740 218 HG22 VAL 30 HG22 VAL 30 21.585 2.290 9.520 219 HG23 VAL 30 HG23 VAL 30 23.152 1.645 9.033 220 H HIS 31 H HIS 31 26.473 4.496 9.043 221 HA HIS 31 HA HIS 31 26.164 7.371 9.603 222 HB2 HIS 31 HB2 HIS 31 28.832 6.027 9.196 223 HB3 HIS 31 HB3 HIS 31 28.515 7.649 9.802 224 HD1 HIS 31 HD1 HIS 31 28.333 7.912 12.281 225 HD2 HIS 31 HD2 HIS 31 28.102 3.939 11.089 226 HE1 HIS 31 HE1 HIS 31 28.372 6.569 14.407 227 H VAL 32 H VAL 32 25.872 8.552 7.839 228 HA VAL 32 HA VAL 32 26.588 7.395 5.235 229 HB VAL 32 HB VAL 32 24.783 9.763 5.710 230 HG11 VAL 32 HG11 VAL 32 24.998 9.903 3.491 231 HG12 VAL 32 HG12 VAL 32 25.746 8.309 3.377 232 HG13 VAL 32 HG13 VAL 32 23.989 8.458 3.425 233 HG21 VAL 32 HG21 VAL 32 22.902 8.180 5.423 234 HG22 VAL 32 HG22 VAL 32 24.051 6.844 5.496 235 HG23 VAL 32 HG23 VAL 32 23.826 7.891 6.897 236 H PHE 33 H PHE 33 27.857 8.477 3.779 237 HA PHE 33 HA PHE 33 28.916 11.100 4.553 238 HB2 PHE 33 HB2 PHE 33 30.517 8.624 3.940 239 HB3 PHE 33 HB3 PHE 33 31.198 10.235 3.743 240 HD1 PHE 33 HD1 PHE 33 29.495 8.082 6.254 241 HD2 PHE 33 HD2 PHE 33 32.219 11.273 5.537 242 HE1 PHE 33 HE1 PHE 33 30.073 8.123 8.646 243 HE2 PHE 33 HE2 PHE 33 32.802 11.318 7.926 244 HZ PHE 33 HZ PHE 33 31.729 9.741 9.485 245 H ARG 34 H ARG 34 30.161 12.120 2.733 246 HA ARG 34 HA ARG 34 29.129 11.271 0.111 247 HB2 ARG 34 HB2 ARG 34 27.817 13.184 0.994 248 HB3 ARG 34 HB3 ARG 34 29.298 14.126 1.092 249 HG2 ARG 34 HG2 ARG 34 28.758 12.943 -1.539 250 HG3 ARG 34 HG3 ARG 34 27.593 14.157 -1.004 251 HD2 ARG 34 HD2 ARG 34 29.557 15.649 -0.492 252 HD3 ARG 34 HD3 ARG 34 30.572 14.465 -1.314 253 HE ARG 34 HE ARG 34 28.902 16.414 -2.534 254 HH11 ARG 34 HH11 ARG 34 30.115 13.173 -2.906 255 HH12 ARG 34 HH12 ARG 34 29.985 13.182 -4.633 256 HH21 ARG 34 HH21 ARG 34 28.725 16.439 -4.808 257 HH22 ARG 34 HH22 ARG 34 29.195 15.041 -5.714 258 H LYS 35 H LYS 35 30.435 11.758 -1.682 259 HA LYS 35 HA LYS 35 33.233 11.701 -1.163 260 HB2 LYS 35 HB2 LYS 35 32.629 10.537 -3.086 261 HB3 LYS 35 HB3 LYS 35 31.537 11.803 -3.632 262 HG2 LYS 35 HG2 LYS 35 33.484 11.705 -5.055 263 HG3 LYS 35 HG3 LYS 35 33.465 13.225 -4.157 264 HD2 LYS 35 HD2 LYS 35 35.699 12.404 -4.101 265 HD3 LYS 35 HD3 LYS 35 35.012 12.146 -2.496 266 HE2 LYS 35 HE2 LYS 35 35.783 10.054 -2.727 267 HE3 LYS 35 HE3 LYS 35 34.369 9.816 -3.752 268 HZ1 LYS 35 HZ1 LYS 35 37.156 10.362 -4.578 269 HZ2 LYS 35 HZ2 LYS 35 35.854 10.586 -5.635 270 HZ3 LYS 35 HZ3 LYS 35 36.173 9.051 -5.000 271 H ALA 36 H ALA 36 34.275 13.441 -0.438 272 HA ALA 36 HA ALA 36 33.437 16.114 -0.961 273 HB1 ALA 36 HB1 ALA 36 34.726 15.222 1.067 274 HB2 ALA 36 HB2 ALA 36 36.160 15.369 0.050 275 HB3 ALA 36 HB3 ALA 36 35.191 16.795 0.419 276 H ALA 37 H ALA 37 34.693 17.760 -2.041 277 HA ALA 37 HA ALA 37 35.428 17.069 -4.654 278 HB1 ALA 37 HB1 ALA 37 34.674 19.334 -3.749 279 HB2 ALA 37 HB2 ALA 37 36.361 19.575 -3.290 280 HB3 ALA 37 HB3 ALA 37 35.934 19.332 -4.984 281 H ASP 38 H ASP 38 37.208 16.962 -1.732 282 HA ASP 38 HA ASP 38 39.787 16.969 -3.103 283 HB2 ASP 38 HB2 ASP 38 38.892 17.226 -0.279 284 HB3 ASP 38 HB3 ASP 38 40.467 16.488 -0.556 285 H ASP 39 H ASP 39 37.594 14.804 -3.143 286 HA ASP 39 HA ASP 39 37.535 12.540 -3.363 287 HB2 ASP 39 HB2 ASP 39 40.506 12.395 -2.955 288 HB3 ASP 39 HB3 ASP 39 39.480 11.412 -3.996 289 H THR 40 H THR 40 37.205 13.722 -0.794 290 HA THR 40 HA THR 40 38.254 11.579 0.939 291 HB THR 40 HB THR 40 38.345 13.049 2.780 292 HG1 THR 40 HG1 THR 40 37.439 15.144 2.702 293 HG21 THR 40 HG21 THR 40 40.190 13.389 1.219 294 HG22 THR 40 HG22 THR 40 39.766 14.905 2.015 295 HG23 THR 40 HG23 THR 40 39.251 14.605 0.355 296 H TRP 41 H TRP 41 36.795 11.513 3.047 297 HA TRP 41 HA TRP 41 34.040 11.160 2.085 298 HB2 TRP 41 HB2 TRP 41 35.632 9.795 4.246 299 HB3 TRP 41 HB3 TRP 41 33.875 9.683 4.186 300 HD1 TRP 41 HD1 TRP 41 35.976 9.608 0.983 301 HE1 TRP 41 HE1 TRP 41 35.733 7.286 -0.101 302 HE3 TRP 41 HE3 TRP 41 33.368 7.248 4.693 303 HZ2 TRP 41 HZ2 TRP 41 34.587 4.786 0.532 304 HZ3 TRP 41 HZ3 TRP 41 32.737 4.891 4.375 305 HH2 TRP 41 HH2 TRP 41 33.334 3.687 2.337 306 H GLU 42 H GLU 42 32.850 12.900 2.561 307 HA GLU 42 HA GLU 42 33.287 14.311 5.081 308 HB2 GLU 42 HB2 GLU 42 31.743 14.959 2.581 309 HB3 GLU 42 HB3 GLU 42 31.529 15.887 4.059 310 HG2 GLU 42 HG2 GLU 42 34.308 15.504 3.156 311 HG3 GLU 42 HG3 GLU 42 33.288 16.524 2.144 312 HA PRO 43 HA PRO 43 29.817 12.581 7.141 313 HB2 PRO 43 HB2 PRO 43 29.064 14.672 8.701 314 HB3 PRO 43 HB3 PRO 43 30.521 13.719 9.008 315 HG2 PRO 43 HG2 PRO 43 30.245 16.375 7.655 316 HG3 PRO 43 HG3 PRO 43 31.453 15.843 8.838 317 HD2 PRO 43 HD2 PRO 43 31.961 15.939 6.180 318 HD3 PRO 43 HD3 PRO 43 32.703 14.733 7.251 319 H PHE 44 H PHE 44 27.998 12.167 6.047 320 HA PHE 44 HA PHE 44 26.457 14.397 4.928 321 HB2 PHE 44 HB2 PHE 44 27.065 12.569 3.388 322 HB3 PHE 44 HB3 PHE 44 26.207 11.425 4.416 323 HD1 PHE 44 HD2 PHE 44 23.728 11.641 4.673 324 HD2 PHE 44 HD1 PHE 44 25.932 13.858 1.785 325 HE1 PHE 44 HE2 PHE 44 21.650 12.085 3.432 326 HE2 PHE 44 HE1 PHE 44 23.858 14.306 0.540 327 HZ PHE 44 HZ PHE 44 21.713 13.418 1.362 328 H ALA 45 H ALA 45 26.122 11.538 6.987 329 HA ALA 45 HA ALA 45 24.183 12.764 8.644 330 HB1 ALA 45 HB1 ALA 45 22.933 12.114 6.444 331 HB2 ALA 45 HB2 ALA 45 22.966 10.493 7.139 332 HB3 ALA 45 HB3 ALA 45 22.186 11.811 8.013 333 H SER 46 H SER 46 23.084 10.976 10.070 334 HA SER 46 HA SER 46 24.375 8.479 10.363 335 HB2 SER 46 HB2 SER 46 26.289 9.252 11.316 336 HB3 SER 46 HB3 SER 46 25.561 10.795 11.764 337 HG SER 46 HG SER 46 25.180 10.022 13.676 338 H GLY 47 H GLY 47 23.501 7.224 12.068 339 HA2 GLY 47 HA2 GLY 47 21.936 8.012 14.173 340 HA3 GLY 47 HA3 GLY 47 20.839 8.000 12.800 341 H LYS 48 H LYS 48 19.666 6.339 13.927 342 HA LYS 48 HA LYS 48 20.891 3.688 13.559 343 HB2 LYS 48 HB2 LYS 48 19.549 4.838 15.941 344 HB3 LYS 48 HB3 LYS 48 19.150 3.171 15.546 345 HG2 LYS 48 HG2 LYS 48 21.506 2.569 15.636 346 HG3 LYS 48 HG3 LYS 48 21.929 4.246 15.991 347 HD2 LYS 48 HD2 LYS 48 20.148 2.521 17.710 348 HD3 LYS 48 HD3 LYS 48 21.866 2.798 18.005 349 HE2 LYS 48 HE2 LYS 48 21.073 5.334 17.821 350 HE3 LYS 48 HE3 LYS 48 19.551 4.621 18.353 351 HZ1 LYS 48 HZ1 LYS 48 20.709 3.669 20.253 352 HZ2 LYS 48 HZ2 LYS 48 20.870 5.353 20.230 353 HZ3 LYS 48 HZ3 LYS 48 22.162 4.373 19.746 354 H THR 49 H THR 49 19.705 2.246 12.452 355 HA THR 49 HA THR 49 17.495 3.011 10.945 356 HB THR 49 HB THR 49 17.235 0.696 10.324 357 HG1 THR 49 HG1 THR 49 17.350 -0.400 12.242 358 HG21 THR 49 HG21 THR 49 19.867 0.142 10.179 359 HG22 THR 49 HG22 THR 49 19.939 1.863 10.557 360 HG23 THR 49 HG23 THR 49 19.061 1.309 9.132 361 H SER 50 H SER 50 15.365 1.699 10.988 362 HA SER 50 HA SER 50 14.370 1.537 13.755 363 HB2 SER 50 HB2 SER 50 13.660 3.646 12.562 364 HB3 SER 50 HB3 SER 50 12.777 2.626 11.426 365 HG SER 50 HG SER 50 11.656 3.524 13.402 366 H GLU 51 H GLU 51 12.096 0.454 13.729 367 HA GLU 51 HA GLU 51 12.450 -2.176 12.725 368 HB2 GLU 51 HB2 GLU 51 10.061 -2.479 13.537 369 HB3 GLU 51 HB3 GLU 51 11.239 -1.980 14.743 370 HG2 GLU 51 HG2 GLU 51 10.037 -0.195 15.234 371 HG3 GLU 51 HG3 GLU 51 10.085 0.341 13.555 372 H SER 52 H SER 52 11.412 0.623 11.232 373 HA SER 52 HA SER 52 9.664 -0.787 9.346 374 HB2 SER 52 HB2 SER 52 8.719 1.266 10.202 375 HB3 SER 52 HB3 SER 52 10.176 2.164 9.778 376 HG SER 52 HG SER 52 8.319 2.283 8.278 377 H GLY 53 H GLY 53 12.851 -0.226 9.686 378 HA2 GLY 53 HA2 GLY 53 14.594 -0.491 8.199 379 HA3 GLY 53 HA3 GLY 53 13.407 -0.742 6.928 380 H GLU 54 H GLU 54 13.166 2.127 8.827 381 HA GLU 54 HA GLU 54 14.478 3.681 6.702 382 HB2 GLU 54 HB2 GLU 54 12.697 5.290 6.685 383 HB3 GLU 54 HB3 GLU 54 11.995 3.697 6.436 384 HG2 GLU 54 HG2 GLU 54 10.533 4.583 7.947 385 HG3 GLU 54 HG3 GLU 54 11.660 3.761 9.024 386 H LEU 55 H LEU 55 15.277 5.747 7.342 387 HA LEU 55 HA LEU 55 15.502 6.138 10.248 388 HB2 LEU 55 HB2 LEU 55 17.560 5.293 8.598 389 HB3 LEU 55 HB3 LEU 55 17.841 7.023 8.775 390 HG LEU 55 HG LEU 55 17.659 4.999 11.006 391 HD11 LEU 55 HD11 LEU 55 19.800 4.664 10.484 392 HD12 LEU 55 HD12 LEU 55 20.089 6.277 11.136 393 HD13 LEU 55 HD13 LEU 55 19.846 6.057 9.403 394 HD21 LEU 55 HD21 LEU 55 18.611 7.156 12.214 395 HD22 LEU 55 HD22 LEU 55 16.879 6.848 12.084 396 HD23 LEU 55 HD23 LEU 55 17.662 7.968 10.968 397 H HIS 56 H HIS 56 14.478 7.979 10.670 398 HA HIS 56 HA HIS 56 14.418 10.123 8.707 399 HB2 HIS 56 HB2 HIS 56 12.431 9.308 10.164 400 HB3 HIS 56 HB3 HIS 56 13.177 10.264 11.441 401 HD1 HIS 56 HD1 HIS 56 11.857 10.734 7.910 402 HD2 HIS 56 HD2 HIS 56 12.488 12.890 11.405 403 HE1 HIS 56 HE1 HIS 56 10.853 13.001 7.491 404 H GLY 57 H GLY 57 15.265 12.171 9.004 405 HA2 GLY 57 HA2 GLY 57 16.270 13.844 10.452 406 HA3 GLY 57 HA3 GLY 57 16.998 12.532 11.365 407 H LEU 58 H LEU 58 17.750 11.073 8.917 408 HA LEU 58 HA LEU 58 20.314 12.261 8.548 409 HB2 LEU 58 HB2 LEU 58 18.898 9.872 7.458 410 HB3 LEU 58 HB3 LEU 58 20.379 10.426 6.679 411 HG LEU 58 HG LEU 58 21.442 10.249 9.008 412 HD11 LEU 58 HD11 LEU 58 19.243 10.029 10.174 413 HD12 LEU 58 HD12 LEU 58 20.417 8.778 10.578 414 HD13 LEU 58 HD13 LEU 58 19.094 8.419 9.468 415 HD21 LEU 58 HD21 LEU 58 22.269 8.224 8.414 416 HD22 LEU 58 HD22 LEU 58 21.433 8.600 6.907 417 HD23 LEU 58 HD23 LEU 58 20.675 7.540 8.096 418 H THR 59 H THR 59 17.297 12.419 6.862 419 HA THR 59 HA THR 59 18.199 13.183 4.313 420 HB THR 59 HB THR 59 15.955 14.179 4.003 421 HG1 THR 59 HG1 THR 59 14.697 14.592 5.678 422 HG21 THR 59 HG21 THR 59 15.451 12.063 3.505 423 HG22 THR 59 HG22 THR 59 14.875 11.874 5.161 424 HG23 THR 59 HG23 THR 59 16.538 11.453 4.752 425 H THR 60 H THR 60 19.050 15.010 3.555 426 HA THR 60 HA THR 60 18.549 17.551 4.864 427 HB THR 60 HB THR 60 21.013 18.082 4.960 428 HG1 THR 60 HG1 THR 60 21.441 16.031 3.654 429 HG21 THR 60 HG21 THR 60 19.702 17.568 6.976 430 HG22 THR 60 HG22 THR 60 21.362 16.988 7.114 431 HG23 THR 60 HG23 THR 60 20.058 15.855 6.763 432 H GLU 61 H GLU 61 19.866 19.328 3.661 433 HA GLU 61 HA GLU 61 19.094 19.249 0.947 434 HB2 GLU 61 HB2 GLU 61 20.306 21.402 0.762 435 HB3 GLU 61 HB3 GLU 61 19.207 21.353 2.133 436 HG2 GLU 61 HG2 GLU 61 20.973 21.127 3.673 437 HG3 GLU 61 HG3 GLU 61 22.135 20.758 2.400 438 H GLU 62 H GLU 62 21.829 18.036 2.539 439 HA GLU 62 HA GLU 62 23.815 18.354 0.573 440 HB2 GLU 62 HB2 GLU 62 23.427 16.269 2.719 441 HB3 GLU 62 HB3 GLU 62 24.844 16.316 1.679 442 HG2 GLU 62 HG2 GLU 62 25.730 17.582 3.283 443 HG3 GLU 62 HG3 GLU 62 24.756 18.876 2.586 444 H GLU 63 H GLU 63 20.999 16.449 0.616 445 HA GLU 63 HA GLU 63 21.839 14.261 -0.964 446 HB2 GLU 63 HB2 GLU 63 19.511 13.787 -1.277 447 HB3 GLU 63 HB3 GLU 63 19.727 14.356 0.372 448 HG2 GLU 63 HG2 GLU 63 17.861 15.515 -0.236 449 HG3 GLU 63 HG3 GLU 63 19.117 16.675 -0.664 450 H PHE 64 H PHE 64 21.409 17.531 -1.709 451 HA PHE 64 HA PHE 64 20.719 17.133 -4.491 452 HB2 PHE 64 HB2 PHE 64 21.241 19.514 -2.750 453 HB3 PHE 64 HB3 PHE 64 21.298 19.694 -4.501 454 HD1 PHE 64 HD1 PHE 64 19.205 18.470 -5.702 455 HD2 PHE 64 HD2 PHE 64 19.259 20.049 -1.750 456 HE1 PHE 64 HE1 PHE 64 16.755 18.691 -5.760 457 HE2 PHE 64 HE2 PHE 64 16.809 20.272 -1.801 458 HZ PHE 64 HZ PHE 64 15.554 19.592 -3.808 459 H VAL 65 H VAL 65 22.866 15.653 -4.211 460 HA VAL 65 HA VAL 65 25.049 17.254 -5.379 461 HB VAL 65 HB VAL 65 26.639 15.588 -4.433 462 HG11 VAL 65 HG11 VAL 65 24.926 17.158 -2.517 463 HG12 VAL 65 HG12 VAL 65 26.461 16.410 -2.073 464 HG13 VAL 65 HG13 VAL 65 26.418 17.675 -3.302 465 HG21 VAL 65 HG21 VAL 65 26.019 13.821 -3.168 466 HG22 VAL 65 HG22 VAL 65 24.666 14.683 -2.434 467 HG23 VAL 65 HG23 VAL 65 24.502 13.998 -4.050 468 H GLU 66 H GLU 66 26.706 15.477 -6.370 469 HA GLU 66 HA GLU 66 25.613 14.615 -8.743 470 HB2 GLU 66 HB2 GLU 66 27.983 13.443 -7.277 471 HB3 GLU 66 HB3 GLU 66 27.611 13.171 -8.974 472 HG2 GLU 66 HG2 GLU 66 27.905 15.965 -7.997 473 HG3 GLU 66 HG3 GLU 66 29.349 14.984 -8.242 474 H GLY 67 H GLY 67 26.053 12.764 -5.750 475 HA2 GLY 67 HA2 GLY 67 23.974 11.264 -5.451 476 HA3 GLY 67 HA3 GLY 67 24.540 10.545 -6.951 477 H ILE 68 H ILE 68 27.304 11.373 -5.533 478 HA ILE 68 HA ILE 68 27.946 8.714 -4.766 479 HB ILE 68 HB ILE 68 29.525 11.207 -4.136 480 HG12 ILE 68 HG12 ILE 68 29.738 9.448 -6.586 481 HG13 ILE 68 HG13 ILE 68 28.914 11.003 -6.559 482 HG21 ILE 68 HG21 ILE 68 31.357 9.313 -4.576 483 HG22 ILE 68 HG22 ILE 68 30.658 9.618 -2.987 484 HG23 ILE 68 HG23 ILE 68 30.041 8.300 -3.982 485 HD11 ILE 68 HD11 ILE 68 31.025 11.447 -7.444 486 HD12 ILE 68 HD12 ILE 68 31.130 11.968 -5.762 487 HD13 ILE 68 HD13 ILE 68 31.837 10.429 -6.254 488 H TYR 69 H TYR 69 27.413 7.750 -2.932 489 HA TYR 69 HA TYR 69 27.515 9.273 -0.433 490 HB2 TYR 69 HB2 TYR 69 25.203 7.471 -1.179 491 HB3 TYR 69 HB3 TYR 69 25.393 8.354 0.332 492 HD1 TYR 69 HD2 TYR 69 25.916 11.005 -0.173 493 HD2 TYR 69 HD1 TYR 69 23.654 8.363 -2.623 494 HE1 TYR 69 HE2 TYR 69 24.731 12.929 -1.144 495 HE2 TYR 69 HE1 TYR 69 22.463 10.280 -3.601 496 HH TYR 69 HH TYR 69 22.812 12.690 -3.930 497 H LYS 70 H LYS 70 28.176 8.114 1.333 498 HA LYS 70 HA LYS 70 28.759 5.258 0.905 499 HB2 LYS 70 HB2 LYS 70 30.501 7.239 2.384 500 HB3 LYS 70 HB3 LYS 70 30.837 5.527 2.160 501 HG2 LYS 70 HG2 LYS 70 31.909 6.001 0.287 502 HG3 LYS 70 HG3 LYS 70 30.409 6.626 -0.403 503 HD2 LYS 70 HD2 LYS 70 30.987 8.782 0.908 504 HD3 LYS 70 HD3 LYS 70 32.615 8.105 0.986 505 HE2 LYS 70 HE2 LYS 70 31.236 8.180 -1.649 506 HE3 LYS 70 HE3 LYS 70 31.862 9.690 -0.991 507 HZ1 LYS 70 HZ1 LYS 70 34.025 8.459 -0.698 508 HZ2 LYS 70 HZ2 LYS 70 33.576 8.795 -2.293 509 HZ3 LYS 70 HZ3 LYS 70 33.372 7.236 -1.668 510 H VAL 71 H VAL 71 27.267 4.276 2.139 511 HA VAL 71 HA VAL 71 26.782 5.293 4.852 512 HB VAL 71 HB VAL 71 25.200 3.293 3.230 513 HG11 VAL 71 HG11 VAL 71 23.706 4.319 5.392 514 HG12 VAL 71 HG12 VAL 71 24.257 2.661 5.138 515 HG13 VAL 71 HG13 VAL 71 25.260 3.798 6.041 516 HG21 VAL 71 HG21 VAL 71 23.483 5.253 3.526 517 HG22 VAL 71 HG22 VAL 71 24.943 6.225 3.714 518 HG23 VAL 71 HG23 VAL 71 24.683 5.299 2.235 519 H GLU 72 H GLU 72 27.574 4.258 6.561 520 HA GLU 72 HA GLU 72 28.564 1.507 6.188 521 HB2 GLU 72 HB2 GLU 72 30.383 1.943 7.572 522 HB3 GLU 72 HB3 GLU 72 30.223 3.439 6.663 523 HG2 GLU 72 HG2 GLU 72 28.727 4.138 8.705 524 HG3 GLU 72 HG3 GLU 72 29.658 2.887 9.527 525 H ILE 73 H ILE 73 27.917 -0.047 7.576 526 HA ILE 73 HA ILE 73 26.115 0.776 9.759 527 HB ILE 73 HB ILE 73 26.054 -1.786 8.160 528 HG12 ILE 73 HG12 ILE 73 23.638 -0.210 8.115 529 HG13 ILE 73 HG13 ILE 73 25.003 0.759 7.572 530 HG21 ILE 73 HG21 ILE 73 23.692 -1.592 9.554 531 HG22 ILE 73 HG22 ILE 73 25.059 -2.621 9.975 532 HG23 ILE 73 HG23 ILE 73 24.892 -1.031 10.718 533 HD11 ILE 73 HD11 ILE 73 24.571 -1.973 6.455 534 HD12 ILE 73 HD12 ILE 73 23.639 -0.601 5.855 535 HD13 ILE 73 HD13 ILE 73 25.399 -0.587 5.745 536 H ASP 74 H ASP 74 26.486 0.033 11.774 537 HA ASP 74 HA ASP 74 28.862 -1.654 12.151 538 HB2 ASP 74 HB2 ASP 74 27.881 0.708 13.466 539 HB3 ASP 74 HB3 ASP 74 28.015 -0.605 14.633 540 H THR 75 H THR 75 28.172 -3.725 12.125 541 HA THR 75 HA THR 75 25.731 -4.503 13.480 542 HB THR 75 HB THR 75 26.043 -6.672 12.567 543 HG1 THR 75 HG1 THR 75 28.722 -5.897 12.502 544 HG21 THR 75 HG21 THR 75 27.181 -4.809 10.486 545 HG22 THR 75 HG22 THR 75 25.480 -4.824 10.954 546 HG23 THR 75 HG23 THR 75 26.206 -6.254 10.223 547 H LYS 76 H LYS 76 29.106 -4.374 14.144 548 HA LYS 76 HA LYS 76 29.485 -6.403 15.977 549 HB2 LYS 76 HB2 LYS 76 31.252 -5.015 16.948 550 HB3 LYS 76 HB3 LYS 76 31.290 -4.948 15.191 551 HG2 LYS 76 HG2 LYS 76 31.515 -2.741 15.595 552 HG3 LYS 76 HG3 LYS 76 29.752 -2.817 15.655 553 HD2 LYS 76 HD2 LYS 76 30.161 -1.704 17.611 554 HD3 LYS 76 HD3 LYS 76 30.215 -3.368 18.198 555 HE2 LYS 76 HE2 LYS 76 32.182 -2.709 19.082 556 HE3 LYS 76 HE3 LYS 76 32.785 -3.039 17.459 557 HZ1 LYS 76 HZ1 LYS 76 32.588 -0.551 18.848 558 HZ2 LYS 76 HZ2 LYS 76 31.853 -0.478 17.326 559 HZ3 LYS 76 HZ3 LYS 76 33.474 -0.941 17.460 560 H SER 77 H SER 77 27.986 -3.245 16.448 561 HA SER 77 HA SER 77 27.539 -3.790 19.273 562 HB2 SER 77 HB2 SER 77 26.285 -1.476 18.979 563 HB3 SER 77 HB3 SER 77 28.045 -1.547 19.062 564 HG SER 77 HG SER 77 26.387 -0.946 16.927 565 H TYR 78 H TYR 78 25.972 -4.295 16.324 566 HA TYR 78 HA TYR 78 23.270 -4.056 17.265 567 HB2 TYR 78 HB2 TYR 78 23.694 -3.726 14.915 568 HB3 TYR 78 HB3 TYR 78 24.446 -5.311 14.779 569 HD1 TYR 78 HD1 TYR 78 21.194 -3.841 15.907 570 HD2 TYR 78 HD2 TYR 78 23.176 -6.983 13.834 571 HE1 TYR 78 HE1 TYR 78 19.015 -4.815 15.312 572 HE2 TYR 78 HE2 TYR 78 21.003 -7.965 13.233 573 HH TYR 78 HH TYR 78 18.111 -7.058 14.687 574 H TRP 79 H TRP 79 25.580 -6.679 16.794 575 HA TRP 79 HA TRP 79 23.691 -8.724 17.524 576 HB2 TRP 79 HB2 TRP 79 25.431 -10.267 17.155 577 HB3 TRP 79 HB3 TRP 79 25.725 -8.987 15.981 578 HD1 TRP 79 HD1 TRP 79 28.003 -7.728 16.119 579 HE1 TRP 79 HE1 TRP 79 30.086 -7.953 17.613 580 HE3 TRP 79 HE3 TRP 79 26.116 -10.882 19.673 581 HZ2 TRP 79 HZ2 TRP 79 30.831 -9.290 19.985 582 HZ3 TRP 79 HZ3 TRP 79 27.579 -11.586 21.521 583 HH2 TRP 79 HH2 TRP 79 29.888 -10.806 21.672 584 H LYS 80 H LYS 80 25.909 -6.657 19.169 585 HA LYS 80 HA LYS 80 26.129 -8.273 21.537 586 HB2 LYS 80 HB2 LYS 80 27.562 -6.659 22.340 587 HB3 LYS 80 HB3 LYS 80 27.734 -6.410 20.608 588 HG2 LYS 80 HG2 LYS 80 27.404 -4.260 21.171 589 HG3 LYS 80 HG3 LYS 80 25.703 -4.728 21.107 590 HD2 LYS 80 HD2 LYS 80 25.791 -3.702 23.161 591 HD3 LYS 80 HD3 LYS 80 26.112 -5.377 23.617 592 HE2 LYS 80 HE2 LYS 80 28.550 -4.864 23.493 593 HE3 LYS 80 HE3 LYS 80 28.132 -3.172 23.226 594 HZ1 LYS 80 HZ1 LYS 80 28.591 -4.188 25.626 595 HZ2 LYS 80 HZ2 LYS 80 26.923 -4.453 25.542 596 HZ3 LYS 80 HZ3 LYS 80 27.540 -2.887 25.369 597 H ALA 81 H ALA 81 23.840 -6.073 20.279 598 HA ALA 81 HA ALA 81 22.733 -5.340 22.856 599 HB1 ALA 81 HB1 ALA 81 22.283 -4.559 20.046 600 HB2 ALA 81 HB2 ALA 81 20.880 -4.480 21.112 601 HB3 ALA 81 HB3 ALA 81 22.340 -3.572 21.506 602 H LEU 82 H LEU 82 21.801 -7.336 20.072 603 HA LEU 82 HA LEU 82 19.556 -8.414 21.618 604 HB2 LEU 82 HB2 LEU 82 20.258 -8.748 18.705 605 HB3 LEU 82 HB3 LEU 82 18.818 -9.391 19.493 606 HG LEU 82 HG LEU 82 18.033 -7.510 18.385 607 HD11 LEU 82 HD11 LEU 82 17.497 -7.564 20.838 608 HD12 LEU 82 HD12 LEU 82 17.359 -5.983 20.070 609 HD13 LEU 82 HD13 LEU 82 18.764 -6.359 21.067 610 HD21 LEU 82 HD21 LEU 82 19.156 -5.472 18.090 611 HD22 LEU 82 HD22 LEU 82 20.398 -6.707 17.882 612 HD23 LEU 82 HD23 LEU 82 20.291 -5.809 19.397 613 H GLY 83 H GLY 83 22.683 -9.058 21.437 614 HA2 GLY 83 HA2 GLY 83 23.986 -10.915 21.788 615 HA3 GLY 83 HA3 GLY 83 22.535 -11.645 22.461 616 H ILE 84 H ILE 84 23.286 -10.610 19.145 617 HA ILE 84 HA ILE 84 22.370 -13.197 18.173 618 HB ILE 84 HB ILE 84 23.310 -10.875 16.498 619 HG12 ILE 84 HG12 ILE 84 21.534 -10.107 18.017 620 HG13 ILE 84 HG13 ILE 84 20.967 -10.171 16.351 621 HG21 ILE 84 HG21 ILE 84 23.081 -12.510 14.964 622 HG22 ILE 84 HG22 ILE 84 22.025 -13.475 15.995 623 HG23 ILE 84 HG23 ILE 84 21.368 -12.109 15.093 624 HD11 ILE 84 HD11 ILE 84 20.416 -12.670 17.581 625 HD12 ILE 84 HD12 ILE 84 19.843 -11.378 18.637 626 HD13 ILE 84 HD13 ILE 84 19.288 -11.462 16.966 627 H SER 85 H SER 85 23.596 -14.449 16.656 628 HA SER 85 HA SER 85 26.154 -15.090 17.441 629 HB2 SER 85 HB2 SER 85 25.542 -16.774 16.079 630 HB3 SER 85 HB3 SER 85 24.421 -15.745 15.188 631 HG SER 85 HG SER 85 25.861 -15.546 13.679 632 HA PRO 86 HA PRO 86 28.955 -12.161 15.763 633 HB2 PRO 86 HB2 PRO 86 31.029 -13.726 14.976 634 HB3 PRO 86 HB3 PRO 86 30.655 -13.410 16.674 635 HG2 PRO 86 HG2 PRO 86 29.977 -15.796 14.998 636 HG3 PRO 86 HG3 PRO 86 30.572 -15.734 16.667 637 HD2 PRO 86 HD2 PRO 86 27.961 -16.126 16.065 638 HD3 PRO 86 HD3 PRO 86 28.486 -15.266 17.527 639 H MET 87 H MET 87 30.020 -11.405 13.824 640 HA MET 87 HA MET 87 28.898 -12.600 11.375 641 HB2 MET 87 HB2 MET 87 29.593 -9.701 11.882 642 HB3 MET 87 HB3 MET 87 28.916 -10.355 10.397 643 HG2 MET 87 HG2 MET 87 27.396 -10.885 12.866 644 HG3 MET 87 HG3 MET 87 27.451 -9.211 12.321 645 HE1 MET 87 HE1 MET 87 26.748 -12.709 11.780 646 HE2 MET 87 HE2 MET 87 25.046 -12.568 11.339 647 HE3 MET 87 HE3 MET 87 26.258 -12.873 10.094 648 H HIS 88 H HIS 88 30.292 -11.343 9.449 649 HA HIS 88 HA HIS 88 33.052 -12.234 9.948 650 HB2 HIS 88 HB2 HIS 88 31.854 -13.505 8.213 651 HB3 HIS 88 HB3 HIS 88 31.564 -12.014 7.322 652 HD1 HIS 88 HD1 HIS 88 33.400 -11.198 5.801 653 HD2 HIS 88 HD2 HIS 88 34.605 -14.337 8.242 654 HE1 HIS 88 HE1 HIS 88 35.663 -11.885 4.945 655 H GLU 89 H GLU 89 31.225 -9.836 8.043 656 HA GLU 89 HA GLU 89 33.072 -7.757 8.801 657 HB2 GLU 89 HB2 GLU 89 34.226 -8.869 6.896 658 HB3 GLU 89 HB3 GLU 89 32.836 -8.507 5.882 659 HG2 GLU 89 HG2 GLU 89 34.293 -6.807 5.354 660 HG3 GLU 89 HG3 GLU 89 33.266 -6.056 6.573 661 H HIS 90 H HIS 90 32.026 -5.873 8.939 662 HA HIS 90 HA HIS 90 29.295 -5.618 8.640 663 HB2 HIS 90 HB2 HIS 90 31.266 -3.342 8.385 664 HB3 HIS 90 HB3 HIS 90 29.593 -3.245 8.928 665 HD1 HIS 90 HD1 HIS 90 30.129 -5.947 10.759 666 HD2 HIS 90 HD2 HIS 90 32.054 -2.268 10.894 667 HE1 HIS 90 HE1 HIS 90 31.104 -5.783 13.072 668 H ALA 91 H ALA 91 27.982 -4.476 7.129 669 HA ALA 91 HA ALA 91 28.991 -4.692 4.383 670 HB1 ALA 91 HB1 ALA 91 26.278 -4.859 5.609 671 HB2 ALA 91 HB2 ALA 91 26.435 -4.383 3.918 672 HB3 ALA 91 HB3 ALA 91 27.063 -5.940 4.457 673 H GLU 92 H GLU 92 29.152 -2.972 3.054 674 HA GLU 92 HA GLU 92 28.108 -0.391 4.009 675 HB2 GLU 92 HB2 GLU 92 30.184 0.619 2.912 676 HB3 GLU 92 HB3 GLU 92 30.410 -0.209 4.446 677 HG2 GLU 92 HG2 GLU 92 32.191 -0.821 2.986 678 HG3 GLU 92 HG3 GLU 92 31.140 -2.220 3.197 679 H VAL 93 H VAL 93 27.905 1.243 2.270 680 HA VAL 93 HA VAL 93 27.458 0.035 -0.376 681 HB VAL 93 HB VAL 93 25.572 1.949 1.008 682 HG11 VAL 93 HG11 VAL 93 25.222 2.538 -1.155 683 HG12 VAL 93 HG12 VAL 93 25.828 1.006 -1.787 684 HG13 VAL 93 HG13 VAL 93 24.199 1.103 -1.118 685 HG21 VAL 93 HG21 VAL 93 24.990 -0.023 1.990 686 HG22 VAL 93 HG22 VAL 93 24.048 -0.165 0.506 687 HG23 VAL 93 HG23 VAL 93 25.595 -0.998 0.651 688 H VAL 94 H VAL 94 28.869 1.003 -1.680 689 HA VAL 94 HA VAL 94 29.076 3.939 -1.569 690 HB VAL 94 HB VAL 94 31.349 2.016 -2.086 691 HG11 VAL 94 HG11 VAL 94 32.224 3.698 -3.261 692 HG12 VAL 94 HG12 VAL 94 30.973 4.824 -2.730 693 HG13 VAL 94 HG13 VAL 94 32.396 4.546 -1.724 694 HG21 VAL 94 HG21 VAL 94 30.929 3.944 0.196 695 HG22 VAL 94 HG22 VAL 94 30.680 2.201 0.286 696 HG23 VAL 94 HG23 VAL 94 32.292 2.846 -0.018 697 H PHE 95 H PHE 95 28.081 4.638 -3.347 698 HA PHE 95 HA PHE 95 28.808 3.396 -5.913 699 HB2 PHE 95 HB2 PHE 95 26.093 4.058 -4.841 700 HB3 PHE 95 HB3 PHE 95 26.382 4.177 -6.574 701 HD1 PHE 95 HD2 PHE 95 26.968 2.177 -7.873 702 HD2 PHE 95 HD1 PHE 95 25.956 1.948 -3.745 703 HE1 PHE 95 HE2 PHE 95 26.608 -0.246 -8.099 704 HE2 PHE 95 HE1 PHE 95 25.596 -0.476 -3.964 705 HZ PHE 95 HZ PHE 95 25.920 -1.576 -6.143 706 H THR 96 H THR 96 28.890 4.787 -7.710 707 HA THR 96 HA THR 96 28.982 7.653 -7.019 708 HB THR 96 HB THR 96 31.221 6.955 -7.455 709 HG1 THR 96 HG1 THR 96 31.538 8.598 -8.750 710 HG21 THR 96 HG21 THR 96 31.626 6.000 -9.884 711 HG22 THR 96 HG22 THR 96 29.968 5.433 -9.689 712 HG23 THR 96 HG23 THR 96 31.211 4.934 -8.543 713 H ALA 97 H ALA 97 28.093 9.123 -8.428 714 HA ALA 97 HA ALA 97 26.098 8.095 -10.235 715 HB1 ALA 97 HB1 ALA 97 26.409 10.937 -10.429 716 HB2 ALA 97 HB2 ALA 97 25.070 10.003 -9.760 717 HB3 ALA 97 HB3 ALA 97 26.435 10.445 -8.735 718 H ASN 98 H ASN 98 25.881 8.814 -12.460 719 HA ASN 98 HA ASN 98 26.633 9.063 -14.592 720 HB2 ASN 98 HB2 ASN 98 29.099 10.425 -13.539 721 HB3 ASN 98 HB3 ASN 98 28.227 10.728 -15.039 722 HD21 ASN 98 HD21 ASN 98 29.027 12.399 -12.643 723 HD22 ASN 98 HD22 ASN 98 27.572 13.222 -12.205 724 H ASP 99 H ASP 99 27.297 6.696 -13.150 725 HA ASP 99 HA ASP 99 29.892 5.996 -14.359 726 HB2 ASP 99 HB2 ASP 99 29.967 5.761 -11.951 727 HB3 ASP 99 HB3 ASP 99 28.490 4.802 -11.961 728 H SER 100 H SER 100 26.938 4.283 -13.321 729 HA SER 100 HA SER 100 27.001 2.840 -15.891 730 HB2 SER 100 HB2 SER 100 27.472 1.220 -14.234 731 HB3 SER 100 HB3 SER 100 26.275 1.887 -13.124 732 HG SER 100 HG SER 100 24.970 0.477 -13.953 733 H GLY 101 H GLY 101 24.625 3.288 -13.267 734 HA2 GLY 101 HA2 GLY 101 22.849 5.015 -14.306 735 HA3 GLY 101 HA3 GLY 101 22.505 3.559 -15.228 736 HA PRO 102 HA PRO 102 21.470 2.572 -10.595 737 HB2 PRO 102 HB2 PRO 102 21.346 4.711 -8.926 738 HB3 PRO 102 HB3 PRO 102 22.823 3.774 -9.178 739 HG2 PRO 102 HG2 PRO 102 22.004 6.383 -10.396 740 HG3 PRO 102 HG3 PRO 102 23.584 5.894 -9.757 741 HD2 PRO 102 HD2 PRO 102 23.024 5.904 -12.406 742 HD3 PRO 102 HD3 PRO 102 24.141 4.736 -11.671 743 H ARG 103 H ARG 103 19.414 2.602 -9.602 744 HA ARG 103 HA ARG 103 17.475 4.407 -10.893 745 HB2 ARG 103 HB2 ARG 103 17.317 1.974 -11.511 746 HB3 ARG 103 HB3 ARG 103 16.921 1.635 -9.831 747 HG2 ARG 103 HG2 ARG 103 14.886 2.836 -9.973 748 HG3 ARG 103 HG3 ARG 103 15.324 3.522 -11.539 749 HD2 ARG 103 HD2 ARG 103 14.880 1.578 -12.670 750 HD3 ARG 103 HD3 ARG 103 15.208 0.562 -11.267 751 HE ARG 103 HE ARG 103 12.935 2.055 -10.693 752 HH11 ARG 103 HH11 ARG 103 13.939 -0.391 -12.957 753 HH12 ARG 103 HH12 ARG 103 12.352 -1.063 -13.135 754 HH21 ARG 103 HH21 ARG 103 10.841 1.179 -10.919 755 HH22 ARG 103 HH22 ARG 103 10.591 -0.169 -11.976 756 H ARG 104 H ARG 104 17.458 2.244 -8.059 757 HA ARG 104 HA ARG 104 15.876 4.127 -6.561 758 HB2 ARG 104 HB2 ARG 104 17.165 1.540 -5.674 759 HB3 ARG 104 HB3 ARG 104 15.957 2.450 -4.777 760 HG2 ARG 104 HG2 ARG 104 14.357 2.075 -6.618 761 HG3 ARG 104 HG3 ARG 104 15.569 1.080 -7.428 762 HD2 ARG 104 HD2 ARG 104 15.627 -0.339 -5.347 763 HD3 ARG 104 HD3 ARG 104 14.220 0.565 -4.786 764 HE ARG 104 HE ARG 104 13.581 -0.360 -7.305 765 HH11 ARG 104 HH11 ARG 104 14.463 -1.743 -4.235 766 HH12 ARG 104 HH12 ARG 104 13.559 -3.200 -4.484 767 HH21 ARG 104 HH21 ARG 104 12.387 -2.273 -7.645 768 HH22 ARG 104 HH22 ARG 104 12.380 -3.501 -6.425 769 H TYR 105 H TYR 105 16.482 5.138 -4.607 770 HA TYR 105 HA TYR 105 19.386 5.560 -4.348 771 HB2 TYR 105 HB2 TYR 105 17.127 7.433 -3.613 772 HB3 TYR 105 HB3 TYR 105 18.843 7.772 -3.419 773 HD1 TYR 105 HD2 TYR 105 20.274 8.077 -5.426 774 HD2 TYR 105 HD1 TYR 105 16.050 7.671 -5.727 775 HE1 TYR 105 HE2 TYR 105 20.354 8.997 -7.706 776 HE2 TYR 105 HE1 TYR 105 16.118 8.589 -8.008 777 HH TYR 105 HH TYR 105 18.420 8.649 -9.898 778 H THR 106 H THR 106 17.689 3.478 -3.075 779 HA THR 106 HA THR 106 17.910 4.255 -0.251 780 HB THR 106 HB THR 106 16.455 1.916 -1.500 781 HG1 THR 106 HG1 THR 106 15.292 3.773 -1.858 782 HG21 THR 106 HG21 THR 106 16.838 2.772 1.356 783 HG22 THR 106 HG22 THR 106 17.084 1.179 0.639 784 HG23 THR 106 HG23 THR 106 15.450 1.807 0.857 785 H ILE 107 H ILE 107 19.222 3.187 1.154 786 HA ILE 107 HA ILE 107 21.272 1.497 -0.011 787 HB ILE 107 HB ILE 107 20.964 2.608 2.779 788 HG12 ILE 107 HG12 ILE 107 23.230 3.693 1.751 789 HG13 ILE 107 HG13 ILE 107 22.264 3.529 0.288 790 HG21 ILE 107 HG21 ILE 107 23.611 1.841 2.377 791 HG22 ILE 107 HG22 ILE 107 22.425 1.064 3.425 792 HG23 ILE 107 HG23 ILE 107 22.646 0.494 1.771 793 HD11 ILE 107 HD11 ILE 107 20.981 4.748 2.665 794 HD12 ILE 107 HD12 ILE 107 22.181 5.695 1.785 795 HD13 ILE 107 HD13 ILE 107 20.751 5.088 0.950 796 H ALA 108 H ALA 108 20.769 -0.586 -0.256 797 HA ALA 108 HA ALA 108 19.087 -1.934 1.707 798 HB1 ALA 108 HB1 ALA 108 18.366 -2.603 -0.353 799 HB2 ALA 108 HB2 ALA 108 19.978 -2.528 -1.066 800 HB3 ALA 108 HB3 ALA 108 19.538 -3.878 -0.019 801 H ALA 109 H ALA 109 20.059 -2.733 3.449 802 HA ALA 109 HA ALA 109 22.632 -4.125 3.096 803 HB1 ALA 109 HB1 ALA 109 23.107 -2.071 4.230 804 HB2 ALA 109 HB2 ALA 109 21.799 -2.347 5.382 805 HB3 ALA 109 HB3 ALA 109 23.224 -3.387 5.399 806 H MET 110 H MET 110 22.436 -6.219 3.504 807 HA MET 110 HA MET 110 20.357 -7.101 5.392 808 HB2 MET 110 HB2 MET 110 21.613 -8.469 3.017 809 HB3 MET 110 HB3 MET 110 20.660 -9.340 4.211 810 HG2 MET 110 HG2 MET 110 18.804 -7.682 3.719 811 HG3 MET 110 HG3 MET 110 19.763 -7.190 2.325 812 HE1 MET 110 HE1 MET 110 18.322 -9.967 4.290 813 HE2 MET 110 HE2 MET 110 16.897 -9.980 3.251 814 HE3 MET 110 HE3 MET 110 18.054 -11.309 3.177 815 H LEU 111 H LEU 111 20.968 -8.002 7.246 816 HA LEU 111 HA LEU 111 23.784 -8.430 7.760 817 HB2 LEU 111 HB2 LEU 111 21.397 -8.791 9.566 818 HB3 LEU 111 HB3 LEU 111 23.087 -8.823 10.067 819 HG LEU 111 HG LEU 111 22.370 -6.711 10.710 820 HD11 LEU 111 HD11 LEU 111 24.433 -6.630 9.374 821 HD12 LEU 111 HD12 LEU 111 23.502 -5.137 9.264 822 HD13 LEU 111 HD13 LEU 111 23.471 -6.294 7.934 823 HD21 LEU 111 HD21 LEU 111 21.147 -6.006 8.089 824 HD22 LEU 111 HD22 LEU 111 20.762 -5.425 9.709 825 HD23 LEU 111 HD23 LEU 111 20.239 -7.031 9.200 826 H SER 112 H SER 112 23.557 -10.214 6.002 827 HA SER 112 HA SER 112 22.322 -12.655 6.532 828 HB2 SER 112 HB2 SER 112 24.560 -11.751 4.798 829 HB3 SER 112 HB3 SER 112 24.446 -13.483 5.110 830 HG SER 112 HG SER 112 23.081 -13.348 3.492 831 HA PRO 113 HA PRO 113 24.659 -14.647 9.663 832 HB2 PRO 113 HB2 PRO 113 24.748 -17.213 8.781 833 HB3 PRO 113 HB3 PRO 113 23.275 -16.463 9.407 834 HG2 PRO 113 HG2 PRO 113 24.130 -16.879 6.568 835 HG3 PRO 113 HG3 PRO 113 22.533 -17.118 7.302 836 HD2 PRO 113 HD2 PRO 113 23.157 -14.914 5.859 837 HD3 PRO 113 HD3 PRO 113 22.021 -14.872 7.222 838 H TYR 114 H TYR 114 26.613 -15.991 10.095 839 HA TYR 114 HA TYR 114 28.548 -16.270 7.976 840 HB2 TYR 114 HB2 TYR 114 28.746 -14.082 10.014 841 HB3 TYR 114 HB3 TYR 114 30.214 -14.840 9.406 842 HD1 TYR 114 HD2 TYR 114 30.221 -15.068 6.720 843 HD2 TYR 114 HD1 TYR 114 28.050 -12.165 8.948 844 HE1 TYR 114 HE2 TYR 114 30.163 -13.605 4.745 845 HE2 TYR 114 HE1 TYR 114 27.984 -10.694 6.978 846 HH TYR 114 HH TYR 114 28.906 -11.772 3.849 847 H SER 115 H SER 115 27.216 -17.935 9.977 848 HA SER 115 HA SER 115 29.516 -19.380 10.885 849 HB2 SER 115 HB2 SER 115 29.178 -17.566 12.641 850 HB3 SER 115 HB3 SER 115 27.665 -18.375 13.049 851 HG SER 115 HG SER 115 30.303 -19.213 13.437 852 H TYR 116 H TYR 116 28.439 -21.054 12.724 853 HA TYR 116 HA TYR 116 26.302 -22.357 11.185 854 HB2 TYR 116 HB2 TYR 116 27.026 -24.438 12.148 855 HB3 TYR 116 HB3 TYR 116 28.449 -23.597 11.541 856 HD1 TYR 116 HD2 TYR 116 26.614 -24.587 14.577 857 HD2 TYR 116 HD1 TYR 116 30.177 -22.855 13.025 858 HE1 TYR 116 HE2 TYR 116 27.671 -24.792 16.789 859 HE2 TYR 116 HE1 TYR 116 31.244 -23.056 15.232 860 HH TYR 116 HH TYR 116 30.687 -24.822 17.390 861 H SER 117 H SER 117 27.123 -21.058 14.305 862 HA SER 117 HA SER 117 25.243 -22.229 15.954 863 HB2 SER 117 HB2 SER 117 26.900 -20.747 16.876 864 HB3 SER 117 HB3 SER 117 26.283 -19.388 15.936 865 HG SER 117 HG SER 117 25.614 -19.894 18.331 866 H THR 118 H THR 118 23.095 -22.142 16.164 867 HA THR 118 HA THR 118 21.630 -20.206 14.491 868 HB THR 118 HB THR 118 20.648 -22.915 15.405 869 HG1 THR 118 HG1 THR 118 20.899 -23.255 12.996 870 HG21 THR 118 HG21 THR 118 18.927 -22.508 13.629 871 HG22 THR 118 HG22 THR 118 19.528 -20.854 13.507 872 HG23 THR 118 HG23 THR 118 18.813 -21.424 15.015 873 H THR 119 H THR 119 21.084 -22.227 17.384 874 HA THR 119 HA THR 119 18.996 -20.797 18.482 875 HB THR 119 HB THR 119 21.172 -22.076 20.138 876 HG1 THR 119 HG1 THR 119 19.991 -24.017 19.838 877 HG21 THR 119 HG21 THR 119 19.806 -21.595 21.832 878 HG22 THR 119 HG22 THR 119 18.582 -22.632 21.099 879 HG23 THR 119 HG23 THR 119 18.620 -20.909 20.723 880 H ALA 120 H ALA 120 18.780 -18.867 19.419 881 HA ALA 120 HA ALA 120 20.867 -16.979 19.445 882 HB1 ALA 120 HB1 ALA 120 19.274 -15.472 19.982 883 HB2 ALA 120 HB2 ALA 120 18.190 -16.792 19.542 884 HB3 ALA 120 HB3 ALA 120 18.574 -16.495 21.238 885 H VAL 121 H VAL 121 22.625 -17.486 20.661 886 HA VAL 121 HA VAL 121 22.180 -17.828 23.556 887 HB VAL 121 HB VAL 121 24.471 -18.957 21.942 888 HG11 VAL 121 HG11 VAL 121 24.577 -20.279 24.256 889 HG12 VAL 121 HG12 VAL 121 25.435 -18.760 23.989 890 HG13 VAL 121 HG13 VAL 121 23.889 -18.764 24.840 891 HG21 VAL 121 HG21 VAL 121 21.830 -20.021 22.667 892 HG22 VAL 121 HG22 VAL 121 22.930 -20.496 21.373 893 HG23 VAL 121 HG23 VAL 121 23.187 -21.094 23.012 894 H VAL 122 H VAL 122 22.751 -16.049 24.607 895 HA VAL 122 HA VAL 122 24.260 -13.943 23.572 896 HB VAL 122 HB VAL 122 24.501 -13.207 25.971 897 HG11 VAL 122 HG11 VAL 122 22.084 -12.805 26.274 898 HG12 VAL 122 HG12 VAL 122 22.627 -12.475 24.628 899 HG13 VAL 122 HG13 VAL 122 21.751 -13.964 24.988 900 HG21 VAL 122 HG21 VAL 122 24.543 -15.497 26.926 901 HG22 VAL 122 HG22 VAL 122 23.365 -14.438 27.701 902 HG23 VAL 122 HG23 VAL 122 22.829 -15.652 26.540 903 H THR 123 H THR 123 26.383 -13.349 23.706 904 HA THR 123 HA THR 123 28.248 -15.138 25.091 905 HB THR 123 HB THR 123 29.030 -14.159 22.380 906 HG1 THR 123 HG1 THR 123 27.757 -16.664 22.646 907 HG21 THR 123 HG21 THR 123 30.805 -15.206 23.443 908 HG22 THR 123 HG22 THR 123 30.113 -16.526 22.500 909 HG23 THR 123 HG23 THR 123 29.767 -16.398 24.224 910 H ASN 124 H ASN 124 30.411 -14.195 25.350 911 HA ASN 124 HA ASN 124 30.202 -11.342 25.885 912 HB2 ASN 124 HB2 ASN 124 31.926 -13.566 26.831 913 HB3 ASN 124 HB3 ASN 124 32.656 -11.964 26.792 914 HD21 ASN 124 HD21 ASN 124 32.780 -11.660 28.962 915 HD22 ASN 124 HD22 ASN 124 31.399 -11.502 29.988 916 HA PRO 125 HA PRO 125 32.686 -9.925 22.559 917 HB2 PRO 125 HB2 PRO 125 34.189 -7.993 23.734 918 HB3 PRO 125 HB3 PRO 125 32.460 -7.806 23.417 919 HG2 PRO 125 HG2 PRO 125 33.851 -8.548 25.963 920 HG3 PRO 125 HG3 PRO 125 32.495 -7.432 25.712 921 HD2 PRO 125 HD2 PRO 125 32.153 -9.959 26.622 922 HD3 PRO 125 HD3 PRO 125 30.947 -9.136 25.612 923 H LYS 126 H LYS 126 35.118 -9.196 22.134 924 HA LYS 126 HA LYS 126 36.696 -11.521 22.411 925 HB2 LYS 126 HB2 LYS 126 38.307 -10.417 21.131 926 HB3 LYS 126 HB3 LYS 126 36.800 -9.676 20.610 927 HG2 LYS 126 HG2 LYS 126 38.633 -8.491 22.681 928 HG3 LYS 126 HG3 LYS 126 38.663 -8.073 20.967 929 HD2 LYS 126 HD2 LYS 126 36.296 -7.754 22.812 930 HD3 LYS 126 HD3 LYS 126 37.367 -6.455 22.283 931 HE2 LYS 126 HE2 LYS 126 35.540 -8.131 20.569 932 HE3 LYS 126 HE3 LYS 126 35.379 -6.414 20.936 933 HZ1 LYS 126 HZ1 LYS 126 36.336 -6.388 18.862 934 HZ2 LYS 126 HZ2 LYS 126 37.291 -7.754 19.147 935 HZ3 LYS 126 HZ3 LYS 126 37.705 -6.272 19.849 936 H GLU 127 H GLU 127 36.213 -8.818 24.453 937 HA GLU 127 HA GLU 127 38.422 -9.733 26.169 938 HB2 GLU 127 HB2 GLU 127 38.710 -7.366 26.904 939 HB3 GLU 127 HB3 GLU 127 39.140 -7.646 25.223 940 HG2 GLU 127 HG2 GLU 127 37.016 -6.714 24.504 941 HG3 GLU 127 HG3 GLU 127 36.539 -6.474 26.184 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -1.671 -4.314 -3.888 2 HA2 GLY 1 HA2 GLY 1 -0.002 -5.981 -5.661 3 HA3 GLY 1 HA3 GLY 1 -0.647 -4.401 -6.084 4 HA PRO 2 HA PRO 2 3.775 -4.159 -4.394 5 HB2 PRO 2 HB2 PRO 2 5.010 -3.499 -6.720 6 HB3 PRO 2 HB3 PRO 2 4.802 -5.170 -6.183 7 HG2 PRO 2 HG2 PRO 2 3.192 -3.603 -8.162 8 HG3 PRO 2 HG3 PRO 2 3.761 -5.280 -8.260 9 HD2 PRO 2 HD2 PRO 2 1.223 -4.640 -7.565 10 HD3 PRO 2 HD3 PRO 2 2.059 -6.068 -6.920 11 H THR 3 H THR 3 5.337 -2.180 -5.121 12 HA THR 3 HA THR 3 4.123 0.145 -4.225 13 HB THR 3 HB THR 3 6.098 1.336 -4.875 14 HG1 THR 3 HG1 THR 3 6.600 -0.883 -6.596 15 HG21 THR 3 HG21 THR 3 7.810 0.019 -3.855 16 HG22 THR 3 HG22 THR 3 6.987 -1.483 -4.276 17 HG23 THR 3 HG23 THR 3 6.290 -0.404 -3.070 18 H GLY 4 H GLY 4 3.674 2.158 -5.323 19 HA2 GLY 4 HA2 GLY 4 2.495 1.680 -7.977 20 HA3 GLY 4 HA3 GLY 4 2.006 2.942 -6.856 21 H THR 5 H THR 5 2.490 3.528 -9.496 22 HA THR 5 HA THR 5 5.147 4.777 -9.531 23 HB THR 5 HB THR 5 4.948 4.980 -11.897 24 HG1 THR 5 HG1 THR 5 3.061 5.072 -12.872 25 HG21 THR 5 HG21 THR 5 4.680 2.685 -12.607 26 HG22 THR 5 HG22 THR 5 3.756 2.307 -11.153 27 HG23 THR 5 HG23 THR 5 5.468 2.713 -11.030 28 H GLY 6 H GLY 6 2.827 5.786 -7.993 29 HA2 GLY 6 HA2 GLY 6 2.402 8.353 -9.389 30 HA3 GLY 6 HA3 GLY 6 1.308 7.678 -8.191 31 H GLU 7 H GLU 7 3.585 6.867 -6.463 32 HA GLU 7 HA GLU 7 4.509 9.511 -5.571 33 HB2 GLU 7 HB2 GLU 7 4.007 8.987 -3.271 34 HB3 GLU 7 HB3 GLU 7 2.544 8.803 -4.228 35 HG2 GLU 7 HG2 GLU 7 2.691 6.440 -4.163 36 HG3 GLU 7 HG3 GLU 7 4.322 6.495 -3.496 37 H SER 8 H SER 8 5.990 8.866 -3.426 38 HA SER 8 HA SER 8 7.600 6.567 -3.655 39 HB2 SER 8 HB2 SER 8 9.550 7.335 -4.736 40 HB3 SER 8 HB3 SER 8 8.235 7.908 -5.761 41 HG SER 8 HG SER 8 10.110 9.370 -4.808 42 H LYS 9 H LYS 9 9.293 6.507 -2.100 43 HA LYS 9 HA LYS 9 8.765 8.123 0.203 44 HB2 LYS 9 HB2 LYS 9 10.694 5.909 -0.425 45 HB3 LYS 9 HB3 LYS 9 10.853 6.832 1.065 46 HG2 LYS 9 HG2 LYS 9 9.610 4.902 1.597 47 HG3 LYS 9 HG3 LYS 9 8.457 6.237 1.556 48 HD2 LYS 9 HD2 LYS 9 7.547 4.272 0.438 49 HD3 LYS 9 HD3 LYS 9 7.793 5.588 -0.713 50 HE2 LYS 9 HE2 LYS 9 9.135 4.316 -1.944 51 HE3 LYS 9 HE3 LYS 9 10.167 3.993 -0.552 52 HZ1 LYS 9 HZ1 LYS 9 8.081 2.392 -0.057 53 HZ2 LYS 9 HZ2 LYS 9 9.481 1.897 -0.864 54 HZ3 LYS 9 HZ3 LYS 9 8.112 2.346 -1.748 55 H CYS 10 H CYS 10 10.974 8.789 1.432 56 HA CYS 10 HA CYS 10 11.826 11.155 0.303 57 HB2 CYS 10 HB2 CYS 10 12.850 9.396 2.473 58 HB3 CYS 10 HB3 CYS 10 13.929 10.652 1.877 59 HG CYS 10 HG CYS 10 11.485 10.909 4.025 60 HA PRO 11 HA PRO 11 14.891 10.278 -2.707 61 HB2 PRO 11 HB2 PRO 11 16.744 12.207 -2.242 62 HB3 PRO 11 HB3 PRO 11 15.164 12.546 -2.956 63 HG2 PRO 11 HG2 PRO 11 16.075 12.880 -0.124 64 HG3 PRO 11 HG3 PRO 11 15.094 13.971 -1.120 65 HD2 PRO 11 HD2 PRO 11 14.009 12.322 0.735 66 HD3 PRO 11 HD3 PRO 11 13.162 12.767 -0.760 67 H LEU 12 H LEU 12 15.883 10.422 0.635 68 HA LEU 12 HA LEU 12 17.943 8.421 0.077 69 HB2 LEU 12 HB2 LEU 12 18.920 10.765 0.227 70 HB3 LEU 12 HB3 LEU 12 18.470 10.727 1.931 71 HG LEU 12 HG LEU 12 20.870 10.201 1.444 72 HD11 LEU 12 HD11 LEU 12 19.961 7.722 2.667 73 HD12 LEU 12 HD12 LEU 12 19.158 9.150 3.317 74 HD13 LEU 12 HD13 LEU 12 20.917 9.039 3.346 75 HD21 LEU 12 HD21 LEU 12 21.509 8.513 0.118 76 HD22 LEU 12 HD22 LEU 12 19.879 8.621 -0.544 77 HD23 LEU 12 HD23 LEU 12 20.244 7.438 0.712 78 H MET 13 H MET 13 17.409 6.708 1.249 79 HA MET 13 HA MET 13 16.680 7.089 4.060 80 HB2 MET 13 HB2 MET 13 14.872 5.441 3.882 81 HB3 MET 13 HB3 MET 13 14.565 6.842 2.865 82 HG2 MET 13 HG2 MET 13 14.786 5.668 0.933 83 HG3 MET 13 HG3 MET 13 15.929 4.522 1.629 84 HE1 MET 13 HE1 MET 13 13.614 2.860 4.181 85 HE2 MET 13 HE2 MET 13 14.508 1.878 3.021 86 HE3 MET 13 HE3 MET 13 15.253 3.318 3.719 87 H VAL 14 H VAL 14 17.193 5.346 5.419 88 HA VAL 14 HA VAL 14 19.178 3.510 4.276 89 HB VAL 14 HB VAL 14 18.663 4.244 7.163 90 HG11 VAL 14 HG11 VAL 14 20.748 3.044 7.629 91 HG12 VAL 14 HG12 VAL 14 19.521 1.973 6.946 92 HG13 VAL 14 HG13 VAL 14 20.844 2.558 5.936 93 HG21 VAL 14 HG21 VAL 14 19.604 6.105 5.953 94 HG22 VAL 14 HG22 VAL 14 20.850 5.397 6.981 95 HG23 VAL 14 HG23 VAL 14 20.845 5.068 5.249 96 H LYS 15 H LYS 15 18.731 1.426 4.034 97 HA LYS 15 HA LYS 15 16.459 0.296 5.535 98 HB2 LYS 15 HB2 LYS 15 15.856 0.414 3.221 99 HB3 LYS 15 HB3 LYS 15 17.399 -0.268 2.723 100 HG2 LYS 15 HG2 LYS 15 15.687 -1.935 2.515 101 HG3 LYS 15 HG3 LYS 15 16.780 -2.389 3.823 102 HD2 LYS 15 HD2 LYS 15 14.506 -0.760 4.683 103 HD3 LYS 15 HD3 LYS 15 14.050 -2.320 3.994 104 HE2 LYS 15 HE2 LYS 15 16.089 -3.074 5.589 105 HE3 LYS 15 HE3 LYS 15 15.482 -1.689 6.495 106 HZ1 LYS 15 HZ1 LYS 15 14.130 -4.220 5.852 107 HZ2 LYS 15 HZ2 LYS 15 13.205 -2.827 6.106 108 HZ3 LYS 15 HZ3 LYS 15 14.224 -3.400 7.329 109 H VAL 16 H VAL 16 17.241 -0.944 7.112 110 HA VAL 16 HA VAL 16 19.430 -2.807 6.453 111 HB VAL 16 HB VAL 16 18.943 -1.471 9.119 112 HG11 VAL 16 HG11 VAL 16 21.075 -2.552 9.763 113 HG12 VAL 16 HG12 VAL 16 19.787 -3.710 9.428 114 HG13 VAL 16 HG13 VAL 16 21.057 -3.432 8.236 115 HG21 VAL 16 HG21 VAL 16 19.911 -0.032 7.299 116 HG22 VAL 16 HG22 VAL 16 20.925 -0.213 8.730 117 HG23 VAL 16 HG23 VAL 16 21.293 -1.127 7.268 118 H LEU 17 H LEU 17 18.817 -4.856 6.540 119 HA LEU 17 HA LEU 17 16.880 -5.689 8.575 120 HB2 LEU 17 HB2 LEU 17 15.476 -6.780 7.101 121 HB3 LEU 17 HB3 LEU 17 15.857 -5.286 6.249 122 HG LEU 17 HG LEU 17 17.774 -7.073 5.349 123 HD11 LEU 17 HD11 LEU 17 16.988 -9.151 5.275 124 HD12 LEU 17 HD12 LEU 17 15.395 -8.613 4.747 125 HD13 LEU 17 HD13 LEU 17 15.790 -8.642 6.464 126 HD21 LEU 17 HD21 LEU 17 15.239 -6.774 3.833 127 HD22 LEU 17 HD22 LEU 17 16.909 -6.574 3.301 128 HD23 LEU 17 HD23 LEU 17 16.127 -5.310 4.251 129 H ASP 18 H ASP 18 17.035 -7.873 9.208 130 HA ASP 18 HA ASP 18 19.685 -8.969 8.938 131 HB2 ASP 18 HB2 ASP 18 17.236 -9.883 10.452 132 HB3 ASP 18 HB3 ASP 18 18.765 -10.759 10.468 133 H ALA 19 H ALA 19 20.322 -10.434 7.505 134 HA ALA 19 HA ALA 19 18.433 -11.566 5.648 135 HB1 ALA 19 HB1 ALA 19 20.978 -12.731 5.280 136 HB2 ALA 19 HB2 ALA 19 20.206 -11.469 4.320 137 HB3 ALA 19 HB3 ALA 19 21.234 -11.033 5.685 138 H VAL 20 H VAL 20 19.260 -12.414 8.691 139 HA VAL 20 HA VAL 20 19.488 -15.277 8.289 140 HB VAL 20 HB VAL 20 19.224 -13.708 10.858 141 HG11 VAL 20 HG11 VAL 20 18.518 -16.041 11.077 142 HG12 VAL 20 HG12 VAL 20 20.056 -16.570 10.391 143 HG13 VAL 20 HG13 VAL 20 20.022 -15.738 11.947 144 HG21 VAL 20 HG21 VAL 20 21.587 -13.850 11.072 145 HG22 VAL 20 HG22 VAL 20 21.716 -14.914 9.672 146 HG23 VAL 20 HG23 VAL 20 21.257 -13.225 9.456 147 H ARG 21 H ARG 21 17.086 -12.942 9.374 148 HA ARG 21 HA ARG 21 15.105 -15.122 9.489 149 HB2 ARG 21 HB2 ARG 21 14.788 -12.458 10.855 150 HB3 ARG 21 HB3 ARG 21 13.913 -13.953 11.159 151 HG2 ARG 21 HG2 ARG 21 15.302 -14.045 12.930 152 HG3 ARG 21 HG3 ARG 21 16.385 -14.780 11.747 153 HD2 ARG 21 HD2 ARG 21 17.526 -12.718 11.397 154 HD3 ARG 21 HD3 ARG 21 16.321 -11.825 12.325 155 HE ARG 21 HE ARG 21 18.576 -13.237 13.355 156 HH11 ARG 21 HH11 ARG 21 15.303 -12.280 14.060 157 HH12 ARG 21 HH12 ARG 21 15.525 -12.316 15.778 158 HH21 ARG 21 HH21 ARG 21 18.880 -13.286 15.615 159 HH22 ARG 21 HH22 ARG 21 17.559 -12.887 16.662 160 H GLY 22 H GLY 22 15.960 -12.057 8.124 161 HA2 GLY 22 HA2 GLY 22 15.105 -11.262 6.073 162 HA3 GLY 22 HA3 GLY 22 13.683 -12.268 6.303 163 H SER 23 H SER 23 14.343 -10.703 9.159 164 HA SER 23 HA SER 23 12.249 -8.727 8.608 165 HB2 SER 23 HB2 SER 23 12.711 -8.631 11.324 166 HB3 SER 23 HB3 SER 23 11.463 -9.595 10.535 167 HG SER 23 HG SER 23 13.043 -10.674 12.027 168 HA PRO 24 HA PRO 24 14.874 -5.230 8.954 169 HB2 PRO 24 HB2 PRO 24 13.386 -3.504 10.429 170 HB3 PRO 24 HB3 PRO 24 13.001 -3.913 8.753 171 HG2 PRO 24 HG2 PRO 24 11.816 -4.985 11.285 172 HG3 PRO 24 HG3 PRO 24 11.003 -4.506 9.784 173 HD2 PRO 24 HD2 PRO 24 11.519 -7.091 10.398 174 HD3 PRO 24 HD3 PRO 24 11.508 -6.491 8.728 175 H ALA 25 H ALA 25 16.335 -4.147 10.289 176 HA ALA 25 HA ALA 25 16.693 -5.361 12.926 177 HB1 ALA 25 HB1 ALA 25 18.953 -4.737 12.807 178 HB2 ALA 25 HB2 ALA 25 18.539 -5.267 11.177 179 HB3 ALA 25 HB3 ALA 25 18.645 -3.545 11.544 180 H ILE 26 H ILE 26 16.571 -4.250 14.801 181 HA ILE 26 HA ILE 26 15.765 -1.429 14.622 182 HB ILE 26 HB ILE 26 15.036 -3.644 16.452 183 HG12 ILE 26 HG12 ILE 26 13.646 -2.430 14.590 184 HG13 ILE 26 HG13 ILE 26 12.874 -2.882 16.107 185 HG21 ILE 26 HG21 ILE 26 16.033 -2.277 18.093 186 HG22 ILE 26 HG22 ILE 26 15.405 -0.803 17.359 187 HG23 ILE 26 HG23 ILE 26 14.307 -1.922 18.167 188 HD11 ILE 26 HD11 ILE 26 13.958 -0.152 15.457 189 HD12 ILE 26 HD12 ILE 26 12.262 -0.630 15.380 190 HD13 ILE 26 HD13 ILE 26 13.106 -0.618 16.928 191 H ASN 27 H ASN 27 16.836 0.146 15.720 192 HA ASN 27 HA ASN 27 18.520 1.204 16.823 193 HB2 ASN 27 HB2 ASN 27 18.854 -1.389 18.343 194 HB3 ASN 27 HB3 ASN 27 19.377 0.212 18.854 195 HD21 ASN 27 HD21 ASN 27 17.073 1.630 18.049 196 HD22 ASN 27 HD22 ASN 27 15.781 1.181 19.105 197 H VAL 28 H VAL 28 19.378 0.637 14.485 198 HA VAL 28 HA VAL 28 21.956 -0.759 14.803 199 HB VAL 28 HB VAL 28 20.308 -0.400 12.296 200 HG11 VAL 28 HG11 VAL 28 23.080 -1.447 12.748 201 HG12 VAL 28 HG12 VAL 28 22.106 -1.998 11.383 202 HG13 VAL 28 HG13 VAL 28 22.512 -0.290 11.547 203 HG21 VAL 28 HG21 VAL 28 19.281 -2.151 13.364 204 HG22 VAL 28 HG22 VAL 28 20.533 -3.012 12.469 205 HG23 VAL 28 HG23 VAL 28 20.757 -2.663 14.183 206 H ALA 29 H ALA 29 23.530 0.683 15.053 207 HA ALA 29 HA ALA 29 23.436 3.387 14.404 208 HB1 ALA 29 HB1 ALA 29 25.651 1.482 15.010 209 HB2 ALA 29 HB2 ALA 29 26.035 3.113 14.456 210 HB3 ALA 29 HB3 ALA 29 25.086 2.881 15.925 211 H VAL 30 H VAL 30 23.620 4.483 12.562 212 HA VAL 30 HA VAL 30 25.028 3.267 10.295 213 HB VAL 30 HB VAL 30 22.273 4.494 10.109 214 HG11 VAL 30 HG11 VAL 30 22.741 3.369 7.693 215 HG12 VAL 30 HG12 VAL 30 23.012 5.074 8.062 216 HG13 VAL 30 HG13 VAL 30 24.358 3.934 8.112 217 HG21 VAL 30 HG21 VAL 30 21.675 2.405 10.697 218 HG22 VAL 30 HG22 VAL 30 22.081 2.016 9.026 219 HG23 VAL 30 HG23 VAL 30 23.258 1.731 10.307 220 H HIS 31 H HIS 31 26.343 4.652 9.288 221 HA HIS 31 HA HIS 31 25.925 7.536 9.725 222 HB2 HIS 31 HB2 HIS 31 28.639 6.268 9.399 223 HB3 HIS 31 HB3 HIS 31 28.255 7.885 9.983 224 HD1 HIS 31 HD1 HIS 31 28.002 4.266 11.066 225 HD2 HIS 31 HD2 HIS 31 27.960 8.089 12.693 226 HE1 HIS 31 HE1 HIS 31 28.049 3.937 13.558 227 H VAL 32 H VAL 32 25.603 8.636 7.916 228 HA VAL 32 HA VAL 32 26.401 7.429 5.363 229 HB VAL 32 HB VAL 32 24.545 9.773 5.761 230 HG11 VAL 32 HG11 VAL 32 25.559 8.274 3.459 231 HG12 VAL 32 HG12 VAL 32 23.808 8.495 3.469 232 HG13 VAL 32 HG13 VAL 32 24.875 9.896 3.546 233 HG21 VAL 32 HG21 VAL 32 23.643 7.843 6.941 234 HG22 VAL 32 HG22 VAL 32 22.697 8.183 5.492 235 HG23 VAL 32 HG23 VAL 32 23.849 6.849 5.499 236 H PHE 33 H PHE 33 27.724 8.451 3.930 237 HA PHE 33 HA PHE 33 28.709 11.127 4.617 238 HB2 PHE 33 HB2 PHE 33 30.367 8.655 4.163 239 HB3 PHE 33 HB3 PHE 33 31.028 10.267 3.913 240 HD1 PHE 33 HD1 PHE 33 29.345 8.151 6.459 241 HD2 PHE 33 HD2 PHE 33 31.918 11.454 5.695 242 HE1 PHE 33 HE1 PHE 33 29.849 8.309 8.862 243 HE2 PHE 33 HE2 PHE 33 32.427 11.617 8.097 244 HZ PHE 33 HZ PHE 33 31.393 10.043 9.684 245 H ARG 34 H ARG 34 29.986 12.096 2.794 246 HA ARG 34 HA ARG 34 29.071 11.109 0.179 247 HB2 ARG 34 HB2 ARG 34 27.655 13.001 0.916 248 HB3 ARG 34 HB3 ARG 34 29.095 14.002 1.057 249 HG2 ARG 34 HG2 ARG 34 28.707 12.710 -1.556 250 HG3 ARG 34 HG3 ARG 34 27.508 13.928 -1.117 251 HD2 ARG 34 HD2 ARG 34 29.426 15.464 -0.578 252 HD3 ARG 34 HD3 ARG 34 30.495 14.262 -1.300 253 HE ARG 34 HE ARG 34 28.870 16.139 -2.680 254 HH11 ARG 34 HH11 ARG 34 30.115 12.894 -2.857 255 HH12 ARG 34 HH12 ARG 34 30.064 12.829 -4.588 256 HH21 ARG 34 HH21 ARG 34 28.798 16.067 -4.959 257 HH22 ARG 34 HH22 ARG 34 29.316 14.636 -5.782 258 H LYS 35 H LYS 35 30.446 11.486 -1.563 259 HA LYS 35 HA LYS 35 33.212 11.572 -0.955 260 HB2 LYS 35 HB2 LYS 35 32.710 10.321 -2.853 261 HB3 LYS 35 HB3 LYS 35 31.607 11.535 -3.485 262 HG2 LYS 35 HG2 LYS 35 33.607 11.440 -4.832 263 HG3 LYS 35 HG3 LYS 35 33.516 12.990 -3.991 264 HD2 LYS 35 HD2 LYS 35 35.766 12.233 -3.824 265 HD3 LYS 35 HD3 LYS 35 35.027 12.010 -2.236 266 HE2 LYS 35 HE2 LYS 35 35.856 9.932 -2.365 267 HE3 LYS 35 HE3 LYS 35 34.493 9.623 -3.441 268 HZ1 LYS 35 HZ1 LYS 35 37.322 9.942 -4.069 269 HZ2 LYS 35 HZ2 LYS 35 36.222 10.579 -5.184 270 HZ3 LYS 35 HZ3 LYS 35 36.162 8.937 -4.781 271 H ALA 36 H ALA 36 34.177 13.367 -0.258 272 HA ALA 36 HA ALA 36 33.284 15.994 -0.915 273 HB1 ALA 36 HB1 ALA 36 36.001 15.429 0.200 274 HB2 ALA 36 HB2 ALA 36 34.907 16.769 0.542 275 HB3 ALA 36 HB3 ALA 36 34.561 15.162 1.182 276 H ALA 37 H ALA 37 34.512 17.629 -2.025 277 HA ALA 37 HA ALA 37 35.374 16.866 -4.574 278 HB1 ALA 37 HB1 ALA 37 35.836 19.129 -4.970 279 HB2 ALA 37 HB2 ALA 37 34.526 19.139 -3.789 280 HB3 ALA 37 HB3 ALA 37 36.182 19.446 -3.269 281 H ASP 38 H ASP 38 37.051 16.947 -1.583 282 HA ASP 38 HA ASP 38 39.676 16.965 -2.861 283 HB2 ASP 38 HB2 ASP 38 38.663 17.342 -0.099 284 HB3 ASP 38 HB3 ASP 38 40.248 16.589 -0.256 285 H ASP 39 H ASP 39 37.548 14.737 -2.890 286 HA ASP 39 HA ASP 39 37.560 12.465 -3.019 287 HB2 ASP 39 HB2 ASP 39 40.510 12.393 -2.490 288 HB3 ASP 39 HB3 ASP 39 39.546 11.381 -3.563 289 H THR 40 H THR 40 37.104 13.739 -0.514 290 HA THR 40 HA THR 40 38.144 11.698 1.341 291 HB THR 40 HB THR 40 38.131 13.242 3.123 292 HG1 THR 40 HG1 THR 40 36.668 14.760 3.176 293 HG21 THR 40 HG21 THR 40 39.531 15.104 2.333 294 HG22 THR 40 HG22 THR 40 39.083 14.727 0.670 295 HG23 THR 40 HG23 THR 40 40.021 13.570 1.614 296 H TRP 41 H TRP 41 36.602 11.726 3.413 297 HA TRP 41 HA TRP 41 33.901 11.230 2.364 298 HB2 TRP 41 HB2 TRP 41 35.425 10.042 4.677 299 HB3 TRP 41 HB3 TRP 41 33.682 9.851 4.514 300 HD1 TRP 41 HD1 TRP 41 36.111 9.664 1.534 301 HE1 TRP 41 HE1 TRP 41 35.982 7.295 0.535 302 HE3 TRP 41 HE3 TRP 41 33.068 7.478 5.013 303 HZ2 TRP 41 HZ2 TRP 41 34.754 4.827 1.141 304 HZ3 TRP 41 HZ3 TRP 41 32.464 5.110 4.730 305 HH2 TRP 41 HH2 TRP 41 33.291 3.813 2.834 306 H GLU 42 H GLU 42 32.646 12.957 2.698 307 HA GLU 42 HA GLU 42 32.944 14.519 5.147 308 HB2 GLU 42 HB2 GLU 42 31.496 14.973 2.551 309 HB3 GLU 42 HB3 GLU 42 31.156 15.961 3.964 310 HG2 GLU 42 HG2 GLU 42 33.973 15.629 3.051 311 HG3 GLU 42 HG3 GLU 42 32.901 16.735 2.194 312 HA PRO 43 HA PRO 43 29.462 12.776 7.180 313 HB2 PRO 43 HB2 PRO 43 28.614 14.912 8.625 314 HB3 PRO 43 HB3 PRO 43 30.084 14.010 9.016 315 HG2 PRO 43 HG2 PRO 43 29.785 16.597 7.541 316 HG3 PRO 43 HG3 PRO 43 30.970 16.146 8.781 317 HD2 PRO 43 HD2 PRO 43 31.555 16.142 6.137 318 HD3 PRO 43 HD3 PRO 43 32.292 15.002 7.279 319 H PHE 44 H PHE 44 27.693 12.270 6.043 320 HA PHE 44 HA PHE 44 26.126 14.416 4.801 321 HB2 PHE 44 HB2 PHE 44 26.842 12.558 3.342 322 HB3 PHE 44 HB3 PHE 44 25.975 11.424 4.373 323 HD1 PHE 44 HD2 PHE 44 23.478 11.617 4.553 324 HD2 PHE 44 HD1 PHE 44 25.744 13.734 1.638 325 HE1 PHE 44 HE2 PHE 44 21.436 11.967 3.226 326 HE2 PHE 44 HE1 PHE 44 23.706 14.088 0.307 327 HZ PHE 44 HZ PHE 44 21.549 13.205 1.099 328 H ALA 45 H ALA 45 25.819 11.622 6.947 329 HA ALA 45 HA ALA 45 23.785 12.833 8.495 330 HB1 ALA 45 HB1 ALA 45 22.618 12.086 6.293 331 HB2 ALA 45 HB2 ALA 45 22.706 10.477 7.010 332 HB3 ALA 45 HB3 ALA 45 21.844 11.768 7.846 333 H SER 46 H SER 46 22.696 11.054 9.944 334 HA SER 46 HA SER 46 24.074 8.618 10.366 335 HB2 SER 46 HB2 SER 46 25.907 9.491 11.381 336 HB3 SER 46 HB3 SER 46 25.109 11.024 11.727 337 HG SER 46 HG SER 46 24.947 10.301 13.685 338 H GLY 47 H GLY 47 23.260 7.431 12.198 339 HA2 GLY 47 HA2 GLY 47 21.560 8.188 14.169 340 HA3 GLY 47 HA3 GLY 47 20.511 8.108 12.762 341 H LYS 48 H LYS 48 19.345 6.428 13.844 342 HA LYS 48 HA LYS 48 20.664 3.813 13.572 343 HB2 LYS 48 HB2 LYS 48 19.283 4.969 15.923 344 HB3 LYS 48 HB3 LYS 48 18.896 3.295 15.549 345 HG2 LYS 48 HG2 LYS 48 21.274 2.728 15.640 346 HG3 LYS 48 HG3 LYS 48 21.654 4.407 16.028 347 HD2 LYS 48 HD2 LYS 48 19.863 2.637 17.689 348 HD3 LYS 48 HD3 LYS 48 21.579 2.901 18.011 349 HE2 LYS 48 HE2 LYS 48 20.697 5.455 17.805 350 HE3 LYS 48 HE3 LYS 48 19.267 4.664 18.469 351 HZ1 LYS 48 HZ1 LYS 48 21.565 5.455 19.824 352 HZ2 LYS 48 HZ2 LYS 48 21.548 3.764 19.847 353 HZ3 LYS 48 HZ3 LYS 48 20.225 4.631 20.449 354 H THR 49 H THR 49 19.525 2.302 12.501 355 HA THR 49 HA THR 49 17.303 2.988 10.957 356 HB THR 49 HB THR 49 17.147 0.674 10.329 357 HG1 THR 49 HG1 THR 49 18.277 -0.929 11.520 358 HG21 THR 49 HG21 THR 49 19.012 1.003 9.153 359 HG22 THR 49 HG22 THR 49 19.941 0.364 10.510 360 HG23 THR 49 HG23 THR 49 19.636 2.097 10.387 361 H SER 50 H SER 50 15.220 1.617 10.994 362 HA SER 50 HA SER 50 14.222 1.411 13.758 363 HB2 SER 50 HB2 SER 50 12.564 2.416 11.442 364 HB3 SER 50 HB3 SER 50 12.166 2.465 13.160 365 HG SER 50 HG SER 50 12.895 4.466 12.750 366 H GLU 51 H GLU 51 11.971 0.261 13.704 367 HA GLU 51 HA GLU 51 12.427 -2.360 12.712 368 HB2 GLU 51 HB2 GLU 51 10.043 -2.745 13.501 369 HB3 GLU 51 HB3 GLU 51 11.187 -2.196 14.719 370 HG2 GLU 51 HG2 GLU 51 9.930 -0.440 15.178 371 HG3 GLU 51 HG3 GLU 51 9.948 0.068 13.490 372 H SER 52 H SER 52 11.340 0.394 11.188 373 HA SER 52 HA SER 52 9.656 -1.077 9.287 374 HB2 SER 52 HB2 SER 52 8.903 1.129 10.368 375 HB3 SER 52 HB3 SER 52 10.084 1.908 9.314 376 HG SER 52 HG SER 52 7.682 1.416 8.658 377 H GLY 53 H GLY 53 12.809 -0.482 9.659 378 HA2 GLY 53 HA2 GLY 53 14.584 -0.639 8.202 379 HA3 GLY 53 HA3 GLY 53 13.426 -0.959 6.920 380 H GLU 54 H GLU 54 13.100 1.922 8.814 381 HA GLU 54 HA GLU 54 14.314 3.502 6.650 382 HB2 GLU 54 HB2 GLU 54 12.486 5.048 6.651 383 HB3 GLU 54 HB3 GLU 54 11.820 3.433 6.455 384 HG2 GLU 54 HG2 GLU 54 11.409 3.447 8.950 385 HG3 GLU 54 HG3 GLU 54 11.780 5.170 8.901 386 H LEU 55 H LEU 55 15.084 5.582 7.257 387 HA LEU 55 HA LEU 55 15.340 6.019 10.154 388 HB2 LEU 55 HB2 LEU 55 17.392 5.160 8.518 389 HB3 LEU 55 HB3 LEU 55 17.650 6.900 8.623 390 HG LEU 55 HG LEU 55 17.518 4.971 10.939 391 HD11 LEU 55 HD11 LEU 55 19.939 6.126 11.073 392 HD12 LEU 55 HD12 LEU 55 19.705 6.114 9.325 393 HD13 LEU 55 HD13 LEU 55 19.629 4.605 10.236 394 HD21 LEU 55 HD21 LEU 55 17.429 7.918 10.765 395 HD22 LEU 55 HD22 LEU 55 18.511 7.235 11.979 396 HD23 LEU 55 HD23 LEU 55 16.793 6.832 12.000 397 H HIS 56 H HIS 56 14.297 7.854 10.555 398 HA HIS 56 HA HIS 56 14.217 9.972 8.557 399 HB2 HIS 56 HB2 HIS 56 12.556 11.017 10.010 400 HB3 HIS 56 HB3 HIS 56 12.137 9.331 9.714 401 HD1 HIS 56 HD1 HIS 56 13.450 11.603 12.413 402 HD2 HIS 56 HD2 HIS 56 12.013 7.731 11.962 403 HE1 HIS 56 HE1 HIS 56 13.135 10.727 14.749 404 H GLY 57 H GLY 57 15.000 12.051 8.868 405 HA2 GLY 57 HA2 GLY 57 15.960 13.749 10.304 406 HA3 GLY 57 HA3 GLY 57 16.686 12.461 11.253 407 H LEU 58 H LEU 58 17.399 11.058 8.672 408 HA LEU 58 HA LEU 58 19.987 12.289 8.383 409 HB2 LEU 58 HB2 LEU 58 18.683 9.806 7.352 410 HB3 LEU 58 HB3 LEU 58 20.175 10.383 6.610 411 HG LEU 58 HG LEU 58 21.100 10.346 9.036 412 HD11 LEU 58 HD11 LEU 58 18.799 8.414 9.288 413 HD12 LEU 58 HD12 LEU 58 18.934 9.964 10.119 414 HD13 LEU 58 HD13 LEU 58 20.083 8.673 10.469 415 HD21 LEU 58 HD21 LEU 58 22.073 8.317 8.584 416 HD22 LEU 58 HD22 LEU 58 21.498 8.772 6.980 417 HD23 LEU 58 HD23 LEU 58 20.582 7.618 7.951 418 H THR 59 H THR 59 16.990 12.263 6.660 419 HA THR 59 HA THR 59 17.932 12.984 4.098 420 HB THR 59 HB THR 59 15.645 13.735 3.640 421 HG1 THR 59 HG1 THR 59 14.891 14.681 5.445 422 HG21 THR 59 HG21 THR 59 15.425 11.528 3.303 423 HG22 THR 59 HG22 THR 59 14.598 11.501 4.861 424 HG23 THR 59 HG23 THR 59 16.319 11.130 4.769 425 H THR 60 H THR 60 18.726 14.836 3.352 426 HA THR 60 HA THR 60 17.937 17.376 4.511 427 HB THR 60 HB THR 60 20.338 18.102 4.768 428 HG1 THR 60 HG1 THR 60 21.725 16.145 5.230 429 HG21 THR 60 HG21 THR 60 20.591 17.152 6.988 430 HG22 THR 60 HG22 THR 60 19.450 15.866 6.595 431 HG23 THR 60 HG23 THR 60 18.896 17.537 6.693 432 H GLU 61 H GLU 61 19.232 19.200 3.338 433 HA GLU 61 HA GLU 61 18.674 18.961 0.577 434 HB2 GLU 61 HB2 GLU 61 19.732 21.195 0.393 435 HB3 GLU 61 HB3 GLU 61 18.526 21.110 1.671 436 HG2 GLU 61 HG2 GLU 61 20.088 21.264 3.346 437 HG3 GLU 61 HG3 GLU 61 21.391 20.637 2.338 438 H GLU 62 H GLU 62 21.348 18.010 2.420 439 HA GLU 62 HA GLU 62 23.458 18.421 0.602 440 HB2 GLU 62 HB2 GLU 62 23.000 16.749 3.003 441 HB3 GLU 62 HB3 GLU 62 24.273 16.210 1.916 442 HG2 GLU 62 HG2 GLU 62 25.497 18.197 2.193 443 HG3 GLU 62 HG3 GLU 62 24.135 19.023 2.947 444 H GLU 63 H GLU 63 20.796 16.319 0.495 445 HA GLU 63 HA GLU 63 21.914 14.132 -0.903 446 HB2 GLU 63 HB2 GLU 63 19.653 13.499 -1.413 447 HB3 GLU 63 HB3 GLU 63 19.697 14.114 0.233 448 HG2 GLU 63 HG2 GLU 63 17.822 15.146 -0.547 449 HG3 GLU 63 HG3 GLU 63 19.035 16.369 -0.917 450 H PHE 64 H PHE 64 21.345 17.332 -1.835 451 HA PHE 64 HA PHE 64 20.905 16.795 -4.637 452 HB2 PHE 64 HB2 PHE 64 20.071 18.836 -3.293 453 HB3 PHE 64 HB3 PHE 64 21.707 19.458 -3.488 454 HD1 PHE 64 HD2 PHE 64 19.081 17.875 -5.622 455 HD2 PHE 64 HD1 PHE 64 22.014 20.931 -5.208 456 HE1 PHE 64 HE2 PHE 64 18.477 18.750 -7.840 457 HE2 PHE 64 HE1 PHE 64 21.413 21.812 -7.425 458 HZ PHE 64 HZ PHE 64 19.644 20.720 -8.745 459 H VAL 65 H VAL 65 23.052 15.395 -4.201 460 HA VAL 65 HA VAL 65 25.306 17.046 -5.146 461 HB VAL 65 HB VAL 65 26.806 15.301 -4.190 462 HG11 VAL 65 HG11 VAL 65 24.981 16.906 -2.437 463 HG12 VAL 65 HG12 VAL 65 26.282 15.932 -1.749 464 HG13 VAL 65 HG13 VAL 65 26.656 17.226 -2.888 465 HG21 VAL 65 HG21 VAL 65 24.773 13.642 -4.131 466 HG22 VAL 65 HG22 VAL 65 26.065 13.526 -2.937 467 HG23 VAL 65 HG23 VAL 65 24.545 14.316 -2.518 468 H GLU 66 H GLU 66 27.033 15.328 -6.118 469 HA GLU 66 HA GLU 66 26.139 14.638 -8.625 470 HB2 GLU 66 HB2 GLU 66 28.383 13.405 -7.019 471 HB3 GLU 66 HB3 GLU 66 28.134 13.128 -8.738 472 HG2 GLU 66 HG2 GLU 66 28.290 15.942 -7.850 473 HG3 GLU 66 HG3 GLU 66 29.776 14.996 -7.784 474 H GLY 67 H GLY 67 26.415 12.520 -5.780 475 HA2 GLY 67 HA2 GLY 67 24.240 11.052 -5.803 476 HA3 GLY 67 HA3 GLY 67 25.015 10.399 -7.238 477 H ILE 68 H ILE 68 27.619 11.073 -5.598 478 HA ILE 68 HA ILE 68 28.070 8.404 -4.745 479 HB ILE 68 HB ILE 68 29.682 10.892 -4.166 480 HG12 ILE 68 HG12 ILE 68 30.507 8.822 -6.146 481 HG13 ILE 68 HG13 ILE 68 29.223 9.933 -6.611 482 HG21 ILE 68 HG21 ILE 68 31.528 9.095 -3.947 483 HG22 ILE 68 HG22 ILE 68 30.427 9.357 -2.595 484 HG23 ILE 68 HG23 ILE 68 30.186 7.984 -3.674 485 HD11 ILE 68 HD11 ILE 68 30.715 11.821 -6.119 486 HD12 ILE 68 HD12 ILE 68 32.003 10.677 -5.737 487 HD13 ILE 68 HD13 ILE 68 31.350 10.757 -7.374 488 H TYR 69 H TYR 69 27.616 7.462 -2.871 489 HA TYR 69 HA TYR 69 27.443 9.070 -0.437 490 HB2 TYR 69 HB2 TYR 69 25.246 7.199 -1.344 491 HB3 TYR 69 HB3 TYR 69 25.309 8.026 0.207 492 HD1 TYR 69 HD2 TYR 69 25.760 10.704 -0.135 493 HD2 TYR 69 HD1 TYR 69 23.801 8.110 -2.881 494 HE1 TYR 69 HE2 TYR 69 24.587 12.632 -1.112 495 HE2 TYR 69 HE1 TYR 69 22.624 10.032 -3.866 496 HH TYR 69 HH TYR 69 21.959 12.517 -2.819 497 H LYS 70 H LYS 70 28.498 8.116 1.169 498 HA LYS 70 HA LYS 70 28.981 5.214 0.997 499 HB2 LYS 70 HB2 LYS 70 30.699 7.378 2.225 500 HB3 LYS 70 HB3 LYS 70 31.040 5.656 2.324 501 HG2 LYS 70 HG2 LYS 70 32.368 6.228 0.566 502 HG3 LYS 70 HG3 LYS 70 30.886 5.805 -0.295 503 HD2 LYS 70 HD2 LYS 70 31.127 7.818 -1.262 504 HD3 LYS 70 HD3 LYS 70 30.463 8.440 0.252 505 HE2 LYS 70 HE2 LYS 70 32.361 9.715 0.059 506 HE3 LYS 70 HE3 LYS 70 32.969 8.367 1.018 507 HZ1 LYS 70 HZ1 LYS 70 34.298 7.692 -0.631 508 HZ2 LYS 70 HZ2 LYS 70 34.092 9.250 -1.255 509 HZ3 LYS 70 HZ3 LYS 70 33.144 7.975 -1.836 510 H VAL 71 H VAL 71 27.512 4.290 2.302 511 HA VAL 71 HA VAL 71 27.035 5.469 4.950 512 HB VAL 71 HB VAL 71 25.466 3.348 3.474 513 HG11 VAL 71 HG11 VAL 71 25.261 4.487 6.220 514 HG12 VAL 71 HG12 VAL 71 23.781 4.054 5.361 515 HG13 VAL 71 HG13 VAL 71 25.017 2.831 5.663 516 HG21 VAL 71 HG21 VAL 71 23.714 5.228 3.541 517 HG22 VAL 71 HG22 VAL 71 25.080 6.299 3.857 518 HG23 VAL 71 HG23 VAL 71 25.025 5.356 2.367 519 H GLU 72 H GLU 72 27.439 4.366 6.817 520 HA GLU 72 HA GLU 72 28.654 1.697 6.556 521 HB2 GLU 72 HB2 GLU 72 30.409 2.236 7.960 522 HB3 GLU 72 HB3 GLU 72 30.199 3.740 7.076 523 HG2 GLU 72 HG2 GLU 72 28.611 4.330 9.075 524 HG3 GLU 72 HG3 GLU 72 29.559 3.099 9.908 525 H ILE 73 H ILE 73 28.047 0.174 8.017 526 HA ILE 73 HA ILE 73 26.093 1.005 10.062 527 HB ILE 73 HB ILE 73 26.176 -1.603 8.540 528 HG12 ILE 73 HG12 ILE 73 23.743 -0.009 8.381 529 HG13 ILE 73 HG13 ILE 73 25.142 0.857 7.757 530 HG21 ILE 73 HG21 ILE 73 23.994 -2.008 9.697 531 HG22 ILE 73 HG22 ILE 73 25.405 -2.033 10.754 532 HG23 ILE 73 HG23 ILE 73 24.351 -0.619 10.724 533 HD11 ILE 73 HD11 ILE 73 25.371 -0.520 5.982 534 HD12 ILE 73 HD12 ILE 73 24.792 -1.935 6.861 535 HD13 ILE 73 HD13 ILE 73 23.643 -0.741 6.257 536 H ASP 74 H ASP 74 26.329 0.250 12.109 537 HA ASP 74 HA ASP 74 28.765 -1.300 12.654 538 HB2 ASP 74 HB2 ASP 74 28.091 1.088 13.690 539 HB3 ASP 74 HB3 ASP 74 27.317 0.036 14.873 540 H THR 75 H THR 75 27.762 -3.323 12.197 541 HA THR 75 HA THR 75 25.700 -4.162 14.116 542 HB THR 75 HB THR 75 25.366 -6.116 12.609 543 HG1 THR 75 HG1 THR 75 26.655 -6.410 10.947 544 HG21 THR 75 HG21 THR 75 24.654 -3.391 12.147 545 HG22 THR 75 HG22 THR 75 23.747 -4.851 11.751 546 HG23 THR 75 HG23 THR 75 24.896 -4.184 10.591 547 H LYS 76 H LYS 76 28.844 -4.029 14.188 548 HA LYS 76 HA LYS 76 29.500 -6.790 14.768 549 HB2 LYS 76 HB2 LYS 76 31.749 -5.898 15.279 550 HB3 LYS 76 HB3 LYS 76 31.182 -5.423 13.684 551 HG2 LYS 76 HG2 LYS 76 31.895 -3.394 14.317 552 HG3 LYS 76 HG3 LYS 76 30.336 -3.319 15.142 553 HD2 LYS 76 HD2 LYS 76 31.736 -2.743 16.862 554 HD3 LYS 76 HD3 LYS 76 31.683 -4.493 17.077 555 HE2 LYS 76 HE2 LYS 76 33.949 -4.048 17.197 556 HE3 LYS 76 HE3 LYS 76 33.743 -4.498 15.505 557 HZ1 LYS 76 HZ1 LYS 76 33.850 -1.718 16.546 558 HZ2 LYS 76 HZ2 LYS 76 33.676 -2.158 14.923 559 HZ3 LYS 76 HZ3 LYS 76 35.109 -2.516 15.747 560 H SER 77 H SER 77 29.114 -3.755 16.549 561 HA SER 77 HA SER 77 29.534 -5.118 19.086 562 HB2 SER 77 HB2 SER 77 29.083 -2.758 19.999 563 HB3 SER 77 HB3 SER 77 30.545 -2.983 19.038 564 HG SER 77 HG SER 77 29.178 -1.107 18.514 565 H TYR 78 H TYR 78 26.966 -3.258 17.474 566 HA TYR 78 HA TYR 78 25.001 -3.428 19.404 567 HB2 TYR 78 HB2 TYR 78 24.969 -3.198 16.430 568 HB3 TYR 78 HB3 TYR 78 23.450 -3.534 17.252 569 HD1 TYR 78 HD2 TYR 78 22.439 -1.879 18.729 570 HD2 TYR 78 HD1 TYR 78 26.083 -1.061 16.689 571 HE1 TYR 78 HE2 TYR 78 22.177 0.513 19.233 572 HE2 TYR 78 HE1 TYR 78 25.831 1.334 17.189 573 HH TYR 78 HH TYR 78 24.091 2.570 19.437 574 H TRP 79 H TRP 79 26.215 -5.896 17.296 575 HA TRP 79 HA TRP 79 24.022 -7.691 17.496 576 HB2 TRP 79 HB2 TRP 79 26.690 -7.695 16.344 577 HB3 TRP 79 HB3 TRP 79 26.298 -9.246 17.081 578 HD1 TRP 79 HD1 TRP 79 25.915 -10.624 14.898 579 HE1 TRP 79 HE1 TRP 79 24.176 -10.524 13.003 580 HE3 TRP 79 HE3 TRP 79 23.764 -6.120 16.006 581 HZ2 TRP 79 HZ2 TRP 79 22.159 -8.768 12.098 582 HZ3 TRP 79 HZ3 TRP 79 21.937 -5.302 14.576 583 HH2 TRP 79 HH2 TRP 79 21.152 -6.601 12.662 584 H LYS 80 H LYS 80 26.930 -7.166 19.402 585 HA LYS 80 HA LYS 80 26.656 -9.494 21.017 586 HB2 LYS 80 HB2 LYS 80 28.492 -8.717 22.204 587 HB3 LYS 80 HB3 LYS 80 28.730 -7.973 20.629 588 HG2 LYS 80 HG2 LYS 80 28.983 -6.068 21.747 589 HG3 LYS 80 HG3 LYS 80 27.230 -6.099 21.959 590 HD2 LYS 80 HD2 LYS 80 28.069 -5.790 24.122 591 HD3 LYS 80 HD3 LYS 80 27.699 -7.514 24.044 592 HE2 LYS 80 HE2 LYS 80 29.909 -8.125 24.024 593 HE3 LYS 80 HE3 LYS 80 30.433 -6.611 23.288 594 HZ1 LYS 80 HZ1 LYS 80 31.160 -6.291 25.399 595 HZ2 LYS 80 HZ2 LYS 80 29.950 -7.242 26.101 596 HZ3 LYS 80 HZ3 LYS 80 29.597 -5.671 25.583 597 H ALA 81 H ALA 81 25.066 -6.478 20.960 598 HA ALA 81 HA ALA 81 24.381 -6.319 23.729 599 HB1 ALA 81 HB1 ALA 81 22.489 -4.991 22.005 600 HB2 ALA 81 HB2 ALA 81 23.632 -4.306 23.161 601 HB3 ALA 81 HB3 ALA 81 24.147 -4.651 21.509 602 H LEU 82 H LEU 82 22.730 -7.516 20.829 603 HA LEU 82 HA LEU 82 20.483 -8.444 22.435 604 HB2 LEU 82 HB2 LEU 82 20.969 -8.608 19.465 605 HB3 LEU 82 HB3 LEU 82 19.479 -9.064 20.289 606 HG LEU 82 HG LEU 82 18.987 -6.978 19.399 607 HD11 LEU 82 HD11 LEU 82 18.653 -7.207 21.916 608 HD12 LEU 82 HD12 LEU 82 18.605 -5.581 21.238 609 HD13 LEU 82 HD13 LEU 82 20.049 -6.142 22.079 610 HD21 LEU 82 HD21 LEU 82 21.437 -6.558 18.819 611 HD22 LEU 82 HD22 LEU 82 21.557 -5.791 20.403 612 HD23 LEU 82 HD23 LEU 82 20.442 -5.152 19.195 613 H GLY 83 H GLY 83 23.364 -9.593 22.281 614 HA2 GLY 83 HA2 GLY 83 24.326 -11.669 22.460 615 HA3 GLY 83 HA3 GLY 83 22.716 -12.248 22.863 616 H ILE 84 H ILE 84 23.979 -10.856 19.848 617 HA ILE 84 HA ILE 84 22.832 -13.095 18.382 618 HB ILE 84 HB ILE 84 24.245 -10.691 17.233 619 HG12 ILE 84 HG12 ILE 84 22.361 -9.987 18.672 620 HG13 ILE 84 HG13 ILE 84 22.052 -9.658 16.971 621 HG21 ILE 84 HG21 ILE 84 22.539 -11.330 15.350 622 HG22 ILE 84 HG22 ILE 84 24.071 -12.190 15.504 623 HG23 ILE 84 HG23 ILE 84 22.589 -12.909 16.131 624 HD11 ILE 84 HD11 ILE 84 21.074 -12.258 17.866 625 HD12 ILE 84 HD12 ILE 84 20.327 -10.882 18.678 626 HD13 ILE 84 HD13 ILE 84 20.275 -11.002 16.920 627 H SER 85 H SER 85 24.014 -14.362 16.897 628 HA SER 85 HA SER 85 26.412 -15.396 17.780 629 HB2 SER 85 HB2 SER 85 24.975 -15.469 15.160 630 HB3 SER 85 HB3 SER 85 26.620 -16.098 15.234 631 HG SER 85 HG SER 85 25.832 -17.378 17.070 632 HA PRO 86 HA PRO 86 29.660 -12.723 16.537 633 HB2 PRO 86 HB2 PRO 86 31.576 -14.472 15.740 634 HB3 PRO 86 HB3 PRO 86 31.126 -14.248 17.434 635 HG2 PRO 86 HG2 PRO 86 30.279 -16.386 15.516 636 HG3 PRO 86 HG3 PRO 86 30.760 -16.534 17.217 637 HD2 PRO 86 HD2 PRO 86 28.170 -16.539 16.428 638 HD3 PRO 86 HD3 PRO 86 28.692 -15.874 17.989 639 H MET 87 H MET 87 28.280 -11.982 14.686 640 HA MET 87 HA MET 87 28.984 -13.078 12.086 641 HB2 MET 87 HB2 MET 87 27.204 -10.721 12.724 642 HB3 MET 87 HB3 MET 87 27.312 -11.575 11.191 643 HG2 MET 87 HG2 MET 87 26.332 -12.764 13.776 644 HG3 MET 87 HG3 MET 87 25.309 -12.169 12.469 645 HE1 MET 87 HE1 MET 87 28.506 -14.941 12.627 646 HE2 MET 87 HE2 MET 87 27.411 -14.689 13.987 647 HE3 MET 87 HE3 MET 87 27.266 -16.142 12.995 648 H HIS 88 H HIS 88 28.801 -9.726 13.291 649 HA HIS 88 HA HIS 88 30.048 -7.881 12.806 650 HB2 HIS 88 HB2 HIS 88 32.421 -9.733 12.679 651 HB3 HIS 88 HB3 HIS 88 32.367 -8.062 13.234 652 HD1 HIS 88 HD1 HIS 88 32.001 -11.538 14.385 653 HD2 HIS 88 HD2 HIS 88 31.180 -7.730 15.829 654 HE1 HIS 88 HE1 HIS 88 31.614 -11.825 16.853 655 H GLU 89 H GLU 89 28.810 -8.788 10.578 656 HA GLU 89 HA GLU 89 30.851 -8.408 8.487 657 HB2 GLU 89 HB2 GLU 89 29.581 -10.719 8.736 658 HB3 GLU 89 HB3 GLU 89 28.315 -9.856 7.871 659 HG2 GLU 89 HG2 GLU 89 31.072 -9.745 6.782 660 HG3 GLU 89 HG3 GLU 89 30.167 -11.249 6.615 661 H HIS 90 H HIS 90 29.611 -6.255 9.677 662 HA HIS 90 HA HIS 90 27.237 -5.332 8.615 663 HB2 HIS 90 HB2 HIS 90 28.107 -3.057 9.035 664 HB3 HIS 90 HB3 HIS 90 28.417 -4.145 10.385 665 HD1 HIS 90 HD1 HIS 90 30.914 -4.951 10.686 666 HD2 HIS 90 HD2 HIS 90 30.345 -1.953 7.865 667 HE1 HIS 90 HE1 HIS 90 33.202 -4.009 10.235 668 H ALA 91 H ALA 91 26.573 -4.822 6.639 669 HA ALA 91 HA ALA 91 28.506 -4.751 4.464 670 HB1 ALA 91 HB1 ALA 91 25.600 -5.216 4.697 671 HB2 ALA 91 HB2 ALA 91 26.157 -4.448 3.210 672 HB3 ALA 91 HB3 ALA 91 26.803 -6.018 3.687 673 H GLU 92 H GLU 92 28.660 -3.050 2.961 674 HA GLU 92 HA GLU 92 27.517 -0.485 3.846 675 HB2 GLU 92 HB2 GLU 92 29.685 0.535 2.941 676 HB3 GLU 92 HB3 GLU 92 29.765 -0.295 4.489 677 HG2 GLU 92 HG2 GLU 92 31.677 -0.888 3.176 678 HG3 GLU 92 HG3 GLU 92 30.628 -2.295 3.336 679 H VAL 93 H VAL 93 27.364 1.148 2.145 680 HA VAL 93 HA VAL 93 27.115 -0.044 -0.540 681 HB VAL 93 HB VAL 93 25.275 1.994 0.722 682 HG11 VAL 93 HG11 VAL 93 23.998 1.302 -1.507 683 HG12 VAL 93 HG12 VAL 93 25.148 2.639 -1.457 684 HG13 VAL 93 HG13 VAL 93 25.652 1.064 -2.068 685 HG21 VAL 93 HG21 VAL 93 24.720 -0.111 1.618 686 HG22 VAL 93 HG22 VAL 93 23.579 0.144 0.296 687 HG23 VAL 93 HG23 VAL 93 24.963 -0.925 0.072 688 H VAL 94 H VAL 94 28.685 0.804 -1.746 689 HA VAL 94 HA VAL 94 29.068 3.722 -1.672 690 HB VAL 94 HB VAL 94 31.258 1.661 -1.975 691 HG11 VAL 94 HG11 VAL 94 31.097 4.437 -2.736 692 HG12 VAL 94 HG12 VAL 94 32.359 4.185 -1.529 693 HG13 VAL 94 HG13 VAL 94 32.380 3.263 -3.033 694 HG21 VAL 94 HG21 VAL 94 30.489 1.845 0.325 695 HG22 VAL 94 HG22 VAL 94 32.092 2.561 0.154 696 HG23 VAL 94 HG23 VAL 94 30.671 3.599 0.263 697 H PHE 95 H PHE 95 28.258 4.430 -3.538 698 HA PHE 95 HA PHE 95 29.237 3.218 -6.017 699 HB2 PHE 95 HB2 PHE 95 26.335 3.811 -5.407 700 HB3 PHE 95 HB3 PHE 95 26.951 3.445 -7.015 701 HD1 PHE 95 HD2 PHE 95 28.625 1.234 -6.845 702 HD2 PHE 95 HD1 PHE 95 25.195 2.071 -4.469 703 HE1 PHE 95 HE2 PHE 95 28.349 -1.170 -6.403 704 HE2 PHE 95 HE1 PHE 95 24.913 -0.332 -4.022 705 HZ PHE 95 HZ PHE 95 26.490 -1.956 -4.992 706 H THR 96 H THR 96 29.576 4.642 -7.680 707 HA THR 96 HA THR 96 29.299 7.482 -6.987 708 HB THR 96 HB THR 96 31.578 6.914 -7.438 709 HG1 THR 96 HG1 THR 96 31.811 8.629 -8.656 710 HG21 THR 96 HG21 THR 96 31.817 5.016 -8.650 711 HG22 THR 96 HG22 THR 96 31.909 6.140 -10.006 712 HG23 THR 96 HG23 THR 96 30.386 5.336 -9.627 713 H ALA 97 H ALA 97 28.203 8.894 -8.263 714 HA ALA 97 HA ALA 97 26.379 7.777 -10.199 715 HB1 ALA 97 HB1 ALA 97 25.153 9.392 -9.276 716 HB2 ALA 97 HB2 ALA 97 26.574 10.217 -8.633 717 HB3 ALA 97 HB3 ALA 97 26.057 10.514 -10.293 718 H ASN 98 H ASN 98 26.109 8.641 -12.359 719 HA ASN 98 HA ASN 98 26.877 9.103 -14.449 720 HB2 ASN 98 HB2 ASN 98 28.414 11.042 -12.754 721 HB3 ASN 98 HB3 ASN 98 28.769 10.917 -14.475 722 HD21 ASN 98 HD21 ASN 98 27.913 12.656 -15.373 723 HD22 ASN 98 HD22 ASN 98 26.286 13.200 -15.167 724 H ASP 99 H ASP 99 28.034 6.885 -12.994 725 HA ASP 99 HA ASP 99 30.734 6.801 -14.168 726 HB2 ASP 99 HB2 ASP 99 30.771 6.470 -11.764 727 HB3 ASP 99 HB3 ASP 99 29.554 5.203 -11.886 728 H SER 100 H SER 100 28.168 4.464 -13.331 729 HA SER 100 HA SER 100 27.861 3.562 -16.012 730 HB2 SER 100 HB2 SER 100 29.939 2.441 -15.769 731 HB3 SER 100 HB3 SER 100 29.552 1.916 -14.130 732 HG SER 100 HG SER 100 28.355 0.328 -14.903 733 H GLY 101 H GLY 101 25.908 2.649 -16.222 734 HA2 GLY 101 HA2 GLY 101 24.027 1.400 -15.656 735 HA3 GLY 101 HA3 GLY 101 24.727 1.114 -14.070 736 HA PRO 102 HA PRO 102 21.216 4.218 -13.807 737 HB2 PRO 102 HB2 PRO 102 19.690 2.784 -12.079 738 HB3 PRO 102 HB3 PRO 102 19.566 2.621 -13.834 739 HG2 PRO 102 HG2 PRO 102 21.022 0.894 -11.870 740 HG3 PRO 102 HG3 PRO 102 20.021 0.416 -13.253 741 HD2 PRO 102 HD2 PRO 102 22.727 0.436 -13.352 742 HD3 PRO 102 HD3 PRO 102 21.718 0.784 -14.770 743 H ARG 103 H ARG 103 20.108 4.745 -11.481 744 HA ARG 103 HA ARG 103 22.322 4.893 -9.541 745 HB2 ARG 103 HB2 ARG 103 20.209 7.017 -9.883 746 HB3 ARG 103 HB3 ARG 103 21.708 7.119 -8.970 747 HG2 ARG 103 HG2 ARG 103 22.747 6.657 -11.371 748 HG3 ARG 103 HG3 ARG 103 21.230 7.406 -11.875 749 HD2 ARG 103 HD2 ARG 103 22.161 9.003 -9.792 750 HD3 ARG 103 HD3 ARG 103 23.597 8.612 -10.737 751 HE ARG 103 HE ARG 103 22.829 10.008 -12.365 752 HH11 ARG 103 HH11 ARG 103 20.142 9.053 -10.369 753 HH12 ARG 103 HH12 ARG 103 19.010 10.093 -11.167 754 HH21 ARG 103 HH21 ARG 103 21.350 11.382 -13.424 755 HH22 ARG 103 HH22 ARG 103 19.698 11.417 -12.906 756 H ARG 104 H ARG 104 21.687 5.068 -7.298 757 HA ARG 104 HA ARG 104 19.037 3.886 -6.776 758 HB2 ARG 104 HB2 ARG 104 21.707 3.343 -5.491 759 HB3 ARG 104 HB3 ARG 104 20.194 2.926 -4.696 760 HG2 ARG 104 HG2 ARG 104 19.630 1.621 -6.805 761 HG3 ARG 104 HG3 ARG 104 21.326 1.824 -7.245 762 HD2 ARG 104 HD2 ARG 104 21.146 -0.278 -6.160 763 HD3 ARG 104 HD3 ARG 104 21.913 0.822 -5.015 764 HE ARG 104 HE ARG 104 20.133 0.526 -3.622 765 HH11 ARG 104 HH11 ARG 104 19.196 -0.409 -6.842 766 HH12 ARG 104 HH12 ARG 104 17.644 -1.007 -6.357 767 HH21 ARG 104 HH21 ARG 104 18.092 -0.258 -2.971 768 HH22 ARG 104 HH22 ARG 104 17.016 -0.920 -4.155 769 H TYR 105 H TYR 105 18.308 4.257 -4.464 770 HA TYR 105 HA TYR 105 19.148 6.899 -3.485 771 HB2 TYR 105 HB2 TYR 105 16.677 7.289 -2.953 772 HB3 TYR 105 HB3 TYR 105 17.157 7.419 -4.641 773 HD1 TYR 105 HD2 TYR 105 16.539 5.655 -6.244 774 HD2 TYR 105 HD1 TYR 105 15.194 5.553 -2.209 775 HE1 TYR 105 HE2 TYR 105 14.829 3.998 -6.862 776 HE2 TYR 105 HE1 TYR 105 13.482 3.895 -2.815 777 HH TYR 105 HH TYR 105 13.172 2.710 -6.152 778 H THR 106 H THR 106 17.405 3.898 -2.785 779 HA THR 106 HA THR 106 17.657 4.360 0.083 780 HB THR 106 HB THR 106 16.343 2.089 -1.422 781 HG1 THR 106 HG1 THR 106 14.448 3.163 -0.949 782 HG21 THR 106 HG21 THR 106 15.245 1.825 0.925 783 HG22 THR 106 HG22 THR 106 16.684 2.669 1.495 784 HG23 THR 106 HG23 THR 106 16.843 1.140 0.633 785 H ILE 107 H ILE 107 19.072 3.344 1.385 786 HA ILE 107 HA ILE 107 21.142 1.736 0.143 787 HB ILE 107 HB ILE 107 20.857 2.762 2.969 788 HG12 ILE 107 HG12 ILE 107 22.973 4.057 2.087 789 HG13 ILE 107 HG13 ILE 107 22.272 3.718 0.509 790 HG21 ILE 107 HG21 ILE 107 23.523 2.070 2.428 791 HG22 ILE 107 HG22 ILE 107 22.415 1.297 3.560 792 HG23 ILE 107 HG23 ILE 107 22.541 0.703 1.904 793 HD11 ILE 107 HD11 ILE 107 20.409 4.830 2.482 794 HD12 ILE 107 HD12 ILE 107 21.721 5.901 1.988 795 HD13 ILE 107 HD13 ILE 107 20.635 5.221 0.777 796 H ALA 108 H ALA 108 20.714 -0.358 -0.132 797 HA ALA 108 HA ALA 108 19.084 -1.796 1.810 798 HB1 ALA 108 HB1 ALA 108 19.822 -3.637 -0.081 799 HB2 ALA 108 HB2 ALA 108 18.348 -2.670 -0.110 800 HB3 ALA 108 HB3 ALA 108 19.770 -2.135 -1.004 801 H ALA 109 H ALA 109 20.090 -2.595 3.532 802 HA ALA 109 HA ALA 109 22.711 -3.887 3.141 803 HB1 ALA 109 HB1 ALA 109 23.027 -1.806 4.345 804 HB2 ALA 109 HB2 ALA 109 21.814 -2.283 5.533 805 HB3 ALA 109 HB3 ALA 109 23.329 -3.178 5.411 806 H MET 110 H MET 110 22.621 -5.995 3.510 807 HA MET 110 HA MET 110 20.556 -7.021 5.340 808 HB2 MET 110 HB2 MET 110 21.891 -8.242 2.934 809 HB3 MET 110 HB3 MET 110 21.016 -9.219 4.104 810 HG2 MET 110 HG2 MET 110 19.047 -7.661 3.683 811 HG3 MET 110 HG3 MET 110 19.952 -7.092 2.283 812 HE1 MET 110 HE1 MET 110 17.175 -9.884 3.141 813 HE2 MET 110 HE2 MET 110 18.287 -11.250 3.061 814 HE3 MET 110 HE3 MET 110 18.581 -9.941 4.206 815 H LEU 111 H LEU 111 21.183 -7.938 7.182 816 HA LEU 111 HA LEU 111 24.002 -8.233 7.742 817 HB2 LEU 111 HB2 LEU 111 21.594 -8.790 9.469 818 HB3 LEU 111 HB3 LEU 111 23.269 -8.773 10.016 819 HG LEU 111 HG LEU 111 22.431 -6.724 10.727 820 HD11 LEU 111 HD11 LEU 111 23.627 -6.148 8.021 821 HD12 LEU 111 HD12 LEU 111 24.540 -6.496 9.488 822 HD13 LEU 111 HD13 LEU 111 23.549 -5.040 9.392 823 HD21 LEU 111 HD21 LEU 111 20.831 -5.438 9.697 824 HD22 LEU 111 HD22 LEU 111 20.367 -7.051 9.154 825 HD23 LEU 111 HD23 LEU 111 21.274 -5.984 8.080 826 H SER 112 H SER 112 23.937 -9.958 5.920 827 HA SER 112 HA SER 112 22.830 -12.472 6.240 828 HB2 SER 112 HB2 SER 112 25.512 -12.672 5.162 829 HB3 SER 112 HB3 SER 112 23.963 -12.894 4.350 830 HG SER 112 HG SER 112 24.688 -11.144 3.357 831 HA PRO 113 HA PRO 113 24.914 -14.505 9.521 832 HB2 PRO 113 HB2 PRO 113 25.219 -17.020 8.547 833 HB3 PRO 113 HB3 PRO 113 23.654 -16.364 9.040 834 HG2 PRO 113 HG2 PRO 113 24.824 -16.610 6.296 835 HG3 PRO 113 HG3 PRO 113 23.172 -16.953 6.843 836 HD2 PRO 113 HD2 PRO 113 23.840 -14.658 5.568 837 HD3 PRO 113 HD3 PRO 113 22.564 -14.729 6.801 838 H TYR 114 H TYR 114 26.784 -16.376 9.694 839 HA TYR 114 HA TYR 114 29.166 -15.014 8.855 840 HB2 TYR 114 HB2 TYR 114 28.683 -16.394 11.043 841 HB3 TYR 114 HB3 TYR 114 29.219 -17.752 10.059 842 HD1 TYR 114 HD1 TYR 114 30.243 -14.514 11.506 843 HD2 TYR 114 HD2 TYR 114 31.522 -18.062 9.537 844 HE1 TYR 114 HE1 TYR 114 32.583 -13.934 11.992 845 HE2 TYR 114 HE2 TYR 114 33.866 -17.492 10.019 846 HH TYR 114 HH TYR 114 35.057 -14.904 10.550 847 H SER 115 H SER 115 28.298 -15.398 6.517 848 HA SER 115 HA SER 115 29.254 -17.976 5.487 849 HB2 SER 115 HB2 SER 115 28.028 -17.413 3.434 850 HB3 SER 115 HB3 SER 115 26.968 -17.332 4.840 851 HG SER 115 HG SER 115 26.563 -15.482 3.776 852 H TYR 116 H TYR 116 31.466 -17.099 5.950 853 HA TYR 116 HA TYR 116 32.522 -15.915 3.513 854 HB2 TYR 116 HB2 TYR 116 32.538 -14.573 6.167 855 HB3 TYR 116 HB3 TYR 116 34.007 -14.469 5.205 856 HD1 TYR 116 HD2 TYR 116 30.455 -13.551 5.377 857 HD2 TYR 116 HD1 TYR 116 34.073 -13.172 3.173 858 HE1 TYR 116 HE2 TYR 116 29.465 -11.711 4.080 859 HE2 TYR 116 HE1 TYR 116 33.095 -11.330 1.870 860 HH TYR 116 HH TYR 116 31.080 -9.551 2.427 861 H SER 117 H SER 117 33.849 -17.520 2.939 862 HA SER 117 HA SER 117 35.112 -19.334 4.633 863 HB2 SER 117 HB2 SER 117 36.725 -19.575 2.590 864 HB3 SER 117 HB3 SER 117 35.028 -20.018 2.407 865 HG SER 117 HG SER 117 35.616 -18.716 0.687 866 H THR 118 H THR 118 36.154 -16.190 3.471 867 HA THR 118 HA THR 118 38.852 -16.349 4.267 868 HB THR 118 HB THR 118 37.338 -13.759 4.311 869 HG1 THR 118 HG1 THR 118 36.824 -14.001 2.280 870 HG21 THR 118 HG21 THR 118 40.100 -14.615 4.181 871 HG22 THR 118 HG22 THR 118 39.435 -13.013 4.499 872 HG23 THR 118 HG23 THR 118 39.691 -13.547 2.839 873 H THR 119 H THR 119 39.909 -15.431 6.080 874 HA THR 119 HA THR 119 38.733 -16.012 8.559 875 HB THR 119 HB THR 119 40.694 -14.652 9.497 876 HG1 THR 119 HG1 THR 119 42.340 -14.431 7.702 877 HG21 THR 119 HG21 THR 119 42.145 -16.446 9.229 878 HG22 THR 119 HG22 THR 119 41.625 -16.750 7.572 879 HG23 THR 119 HG23 THR 119 40.572 -17.180 8.920 880 H ALA 120 H ALA 120 38.894 -13.057 6.696 881 HA ALA 120 HA ALA 120 37.957 -11.001 6.972 882 HB1 ALA 120 HB1 ALA 120 35.788 -10.901 7.884 883 HB2 ALA 120 HB2 ALA 120 35.941 -12.522 7.205 884 HB3 ALA 120 HB3 ALA 120 36.084 -12.279 8.947 885 H VAL 121 H VAL 121 40.199 -11.628 8.611 886 HA VAL 121 HA VAL 121 39.830 -10.855 11.303 887 HB VAL 121 HB VAL 121 42.338 -10.611 9.635 888 HG11 VAL 121 HG11 VAL 121 41.777 -10.433 12.568 889 HG12 VAL 121 HG12 VAL 121 43.347 -10.996 11.991 890 HG13 VAL 121 HG13 VAL 121 42.771 -9.387 11.554 891 HG21 VAL 121 HG21 VAL 121 41.635 -12.873 9.517 892 HG22 VAL 121 HG22 VAL 121 42.904 -12.808 10.740 893 HG23 VAL 121 HG23 VAL 121 41.212 -12.904 11.229 894 H VAL 122 H VAL 122 39.529 -8.921 12.193 895 HA VAL 122 HA VAL 122 40.114 -6.528 10.571 896 HB VAL 122 HB VAL 122 37.893 -6.862 12.592 897 HG11 VAL 122 HG11 VAL 122 38.860 -4.532 10.975 898 HG12 VAL 122 HG12 VAL 122 37.182 -4.635 11.515 899 HG13 VAL 122 HG13 VAL 122 38.491 -4.613 12.697 900 HG21 VAL 122 HG21 VAL 122 36.921 -7.919 10.855 901 HG22 VAL 122 HG22 VAL 122 36.668 -6.280 10.257 902 HG23 VAL 122 HG23 VAL 122 38.034 -7.230 9.674 903 H THR 123 H THR 123 41.269 -4.921 11.492 904 HA THR 123 HA THR 123 42.769 -5.447 13.828 905 HB THR 123 HB THR 123 43.511 -3.058 13.619 906 HG1 THR 123 HG1 THR 123 42.334 -1.766 12.441 907 HG21 THR 123 HG21 THR 123 44.949 -3.540 11.896 908 HG22 THR 123 HG22 THR 123 43.682 -4.245 10.891 909 HG23 THR 123 HG23 THR 123 44.343 -5.158 12.247 910 H ASN 124 H ASN 124 42.122 -5.313 15.866 911 HA ASN 124 HA ASN 124 39.684 -4.392 16.763 912 HB2 ASN 124 HB2 ASN 124 40.958 -4.151 19.027 913 HB3 ASN 124 HB3 ASN 124 40.811 -5.742 18.286 914 HD21 ASN 124 HD21 ASN 124 42.599 -6.878 18.187 915 HD22 ASN 124 HD22 ASN 124 44.209 -6.252 18.185 916 HA PRO 125 HA PRO 125 39.826 -0.012 16.974 917 HB2 PRO 125 HB2 PRO 125 38.491 0.489 19.286 918 HB3 PRO 125 HB3 PRO 125 37.690 -0.086 17.818 919 HG2 PRO 125 HG2 PRO 125 38.555 -1.631 20.232 920 HG3 PRO 125 HG3 PRO 125 37.045 -1.750 19.309 921 HD2 PRO 125 HD2 PRO 125 39.087 -3.501 18.995 922 HD3 PRO 125 HD3 PRO 125 38.007 -3.043 17.662 923 H LYS 126 H LYS 126 40.178 1.821 18.739 924 HA LYS 126 HA LYS 126 42.867 1.518 19.641 925 HB2 LYS 126 HB2 LYS 126 42.815 3.790 20.119 926 HB3 LYS 126 HB3 LYS 126 41.622 3.653 18.834 927 HG2 LYS 126 HG2 LYS 126 40.981 3.722 21.776 928 HG3 LYS 126 HG3 LYS 126 40.893 5.106 20.682 929 HD2 LYS 126 HD2 LYS 126 39.322 2.546 20.381 930 HD3 LYS 126 HD3 LYS 126 38.694 4.051 21.058 931 HE2 LYS 126 HE2 LYS 126 39.182 5.177 18.916 932 HE3 LYS 126 HE3 LYS 126 39.723 3.637 18.252 933 HZ1 LYS 126 HZ1 LYS 126 37.605 3.479 17.587 934 HZ2 LYS 126 HZ2 LYS 126 37.039 4.606 18.715 935 HZ3 LYS 126 HZ3 LYS 126 37.295 3.000 19.180 936 H GLU 127 H GLU 127 39.857 0.782 21.014 937 HA GLU 127 HA GLU 127 41.132 0.415 23.635 938 HB2 GLU 127 HB2 GLU 127 38.926 1.018 24.687 939 HB3 GLU 127 HB3 GLU 127 39.791 2.357 23.946 940 HG2 GLU 127 HG2 GLU 127 38.153 2.757 22.496 941 HG3 GLU 127 HG3 GLU 127 37.952 1.048 22.114 Start of MODEL 3 1 H1 GLY 1 H GLY 1 1.321 -6.088 7.009 2 HA2 GLY 1 HA2 GLY 1 0.008 -8.507 6.280 3 HA3 GLY 1 HA3 GLY 1 -0.559 -7.169 5.292 4 HA PRO 2 HA PRO 2 3.271 -9.049 3.384 5 HB2 PRO 2 HB2 PRO 2 2.159 -9.508 0.952 6 HB3 PRO 2 HB3 PRO 2 2.088 -10.677 2.275 7 HG2 PRO 2 HG2 PRO 2 0.010 -8.727 1.358 8 HG3 PRO 2 HG3 PRO 2 -0.181 -10.423 1.838 9 HD2 PRO 2 HD2 PRO 2 -0.769 -8.365 3.497 10 HD3 PRO 2 HD3 PRO 2 -0.152 -9.921 4.088 11 H THR 3 H THR 3 3.945 -8.433 0.918 12 HA THR 3 HA THR 3 4.575 -5.718 0.961 13 HB THR 3 HB THR 3 5.465 -5.979 -1.238 14 HG1 THR 3 HG1 THR 3 4.753 -7.484 -2.652 15 HG21 THR 3 HG21 THR 3 5.692 -8.682 0.083 16 HG22 THR 3 HG22 THR 3 6.579 -7.250 0.603 17 HG23 THR 3 HG23 THR 3 6.855 -7.925 -1.003 18 H GLY 4 H GLY 4 3.953 -4.025 -0.552 19 HA2 GLY 4 HA2 GLY 4 1.997 -3.849 -2.363 20 HA3 GLY 4 HA3 GLY 4 1.063 -3.961 -0.878 21 H THR 5 H THR 5 3.113 -2.492 0.657 22 HA THR 5 HA THR 5 2.676 0.200 -0.464 23 HB THR 5 HB THR 5 2.642 0.944 1.999 24 HG1 THR 5 HG1 THR 5 1.721 -0.815 3.337 25 HG21 THR 5 HG21 THR 5 0.677 0.997 0.528 26 HG22 THR 5 HG22 THR 5 0.236 0.555 2.178 27 HG23 THR 5 HG23 THR 5 0.335 -0.686 0.929 28 H GLY 6 H GLY 6 4.882 -0.334 -1.357 29 HA2 GLY 6 HA2 GLY 6 7.000 0.018 0.657 30 HA3 GLY 6 HA3 GLY 6 7.234 -0.619 -0.964 31 H GLU 7 H GLU 7 5.877 2.349 0.484 32 HA GLU 7 HA GLU 7 7.422 3.882 -1.502 33 HB2 GLU 7 HB2 GLU 7 4.729 3.902 -1.211 34 HB3 GLU 7 HB3 GLU 7 5.170 5.205 -0.118 35 HG2 GLU 7 HG2 GLU 7 5.951 6.543 -1.797 36 HG3 GLU 7 HG3 GLU 7 6.355 5.182 -2.842 37 H SER 8 H SER 8 7.728 6.254 -0.672 38 HA SER 8 HA SER 8 8.210 6.469 2.170 39 HB2 SER 8 HB2 SER 8 10.395 5.976 0.221 40 HB3 SER 8 HB3 SER 8 10.687 7.225 1.431 41 HG SER 8 HG SER 8 10.028 5.593 3.007 42 H LYS 9 H LYS 9 9.552 8.651 2.501 43 HA LYS 9 HA LYS 9 8.264 10.657 0.768 44 HB2 LYS 9 HB2 LYS 9 9.144 11.108 3.617 45 HB3 LYS 9 HB3 LYS 9 8.086 12.117 2.640 46 HG2 LYS 9 HG2 LYS 9 6.519 11.090 3.911 47 HG3 LYS 9 HG3 LYS 9 6.628 9.903 2.608 48 HD2 LYS 9 HD2 LYS 9 8.570 8.975 4.202 49 HD3 LYS 9 HD3 LYS 9 7.544 9.737 5.421 50 HE2 LYS 9 HE2 LYS 9 6.720 7.637 3.417 51 HE3 LYS 9 HE3 LYS 9 6.918 7.417 5.155 52 HZ1 LYS 9 HZ1 LYS 9 5.107 8.989 5.512 53 HZ2 LYS 9 HZ2 LYS 9 4.597 7.673 4.581 54 HZ3 LYS 9 HZ3 LYS 9 4.907 9.162 3.841 55 H CYS 10 H CYS 10 10.963 10.630 3.100 56 HA CYS 10 HA CYS 10 12.455 12.643 1.949 57 HB2 CYS 10 HB2 CYS 10 14.439 11.518 3.051 58 HB3 CYS 10 HB3 CYS 10 13.075 11.860 4.108 59 HG CYS 10 HG CYS 10 12.548 9.422 4.812 60 HA PRO 11 HA PRO 11 14.195 11.111 -1.775 61 HB2 PRO 11 HB2 PRO 11 16.640 12.290 -1.757 62 HB3 PRO 11 HB3 PRO 11 15.144 13.185 -2.052 63 HG2 PRO 11 HG2 PRO 11 16.738 12.936 0.470 64 HG3 PRO 11 HG3 PRO 11 15.977 14.375 -0.235 65 HD2 PRO 11 HD2 PRO 11 14.861 12.990 1.806 66 HD3 PRO 11 HD3 PRO 11 13.891 13.823 0.575 67 H LEU 12 H LEU 12 16.222 10.823 1.111 68 HA LEU 12 HA LEU 12 17.290 8.305 0.018 69 HB2 LEU 12 HB2 LEU 12 19.122 9.762 0.005 70 HB3 LEU 12 HB3 LEU 12 18.668 10.485 1.546 71 HG LEU 12 HG LEU 12 19.202 8.157 2.535 72 HD11 LEU 12 HD11 LEU 12 20.126 7.893 -0.252 73 HD12 LEU 12 HD12 LEU 12 19.616 6.661 0.900 74 HD13 LEU 12 HD13 LEU 12 21.243 7.332 0.992 75 HD21 LEU 12 HD21 LEU 12 20.938 9.275 3.340 76 HD22 LEU 12 HD22 LEU 12 20.720 10.487 2.077 77 HD23 LEU 12 HD23 LEU 12 21.793 9.113 1.806 78 H MET 13 H MET 13 17.216 6.544 1.312 79 HA MET 13 HA MET 13 16.562 6.885 4.144 80 HB2 MET 13 HB2 MET 13 14.770 5.220 4.019 81 HB3 MET 13 HB3 MET 13 14.410 6.616 3.011 82 HG2 MET 13 HG2 MET 13 14.527 5.436 1.089 83 HG3 MET 13 HG3 MET 13 15.782 4.359 1.697 84 HE1 MET 13 HE1 MET 13 15.375 3.042 3.739 85 HE2 MET 13 HE2 MET 13 13.796 2.701 4.448 86 HE3 MET 13 HE3 MET 13 14.481 1.602 3.250 87 H VAL 14 H VAL 14 17.158 5.142 5.467 88 HA VAL 14 HA VAL 14 19.111 3.336 4.228 89 HB VAL 14 HB VAL 14 18.736 4.052 7.140 90 HG11 VAL 14 HG11 VAL 14 19.637 1.828 6.933 91 HG12 VAL 14 HG12 VAL 14 20.832 2.380 5.758 92 HG13 VAL 14 HG13 VAL 14 20.924 2.924 7.433 93 HG21 VAL 14 HG21 VAL 14 20.633 5.448 6.946 94 HG22 VAL 14 HG22 VAL 14 21.013 4.838 5.336 95 HG23 VAL 14 HG23 VAL 14 19.594 5.856 5.580 96 H LYS 15 H LYS 15 18.859 1.179 4.229 97 HA LYS 15 HA LYS 15 16.600 0.056 5.752 98 HB2 LYS 15 HB2 LYS 15 15.921 0.092 3.458 99 HB3 LYS 15 HB3 LYS 15 17.469 -0.551 2.926 100 HG2 LYS 15 HG2 LYS 15 15.801 -2.274 2.811 101 HG3 LYS 15 HG3 LYS 15 16.955 -2.665 4.088 102 HD2 LYS 15 HD2 LYS 15 14.681 -1.088 5.020 103 HD3 LYS 15 HD3 LYS 15 14.219 -2.652 4.345 104 HE2 LYS 15 HE2 LYS 15 16.336 -3.373 5.862 105 HE3 LYS 15 HE3 LYS 15 15.722 -2.009 6.797 106 HZ1 LYS 15 HZ1 LYS 15 13.465 -3.198 6.481 107 HZ2 LYS 15 HZ2 LYS 15 14.541 -3.766 7.655 108 HZ3 LYS 15 HZ3 LYS 15 14.410 -4.566 6.169 109 H VAL 16 H VAL 16 17.453 -1.130 7.333 110 HA VAL 16 HA VAL 16 19.638 -2.984 6.649 111 HB VAL 16 HB VAL 16 19.299 -1.493 9.256 112 HG11 VAL 16 HG11 VAL 16 20.832 -3.881 8.508 113 HG12 VAL 16 HG12 VAL 16 21.759 -2.638 9.349 114 HG13 VAL 16 HG13 VAL 16 20.311 -3.315 10.094 115 HG21 VAL 16 HG21 VAL 16 21.349 -0.362 8.686 116 HG22 VAL 16 HG22 VAL 16 21.502 -1.305 7.204 117 HG23 VAL 16 HG23 VAL 16 20.188 -0.142 7.378 118 H LEU 17 H LEU 17 19.067 -5.035 6.894 119 HA LEU 17 HA LEU 17 17.256 -5.774 9.074 120 HB2 LEU 17 HB2 LEU 17 15.776 -6.952 7.740 121 HB3 LEU 17 HB3 LEU 17 16.080 -5.488 6.807 122 HG LEU 17 HG LEU 17 17.961 -7.277 5.848 123 HD11 LEU 17 HD11 LEU 17 15.588 -8.894 5.479 124 HD12 LEU 17 HD12 LEU 17 16.093 -8.837 7.167 125 HD13 LEU 17 HD13 LEU 17 17.225 -9.373 5.925 126 HD21 LEU 17 HD21 LEU 17 16.164 -5.603 4.813 127 HD22 LEU 17 HD22 LEU 17 15.335 -7.126 4.486 128 HD23 LEU 17 HD23 LEU 17 16.960 -6.854 3.856 129 H ASP 18 H ASP 18 17.473 -7.916 9.807 130 HA ASP 18 HA ASP 18 20.107 -9.009 9.447 131 HB2 ASP 18 HB2 ASP 18 17.747 -9.692 11.170 132 HB3 ASP 18 HB3 ASP 18 19.086 -10.828 11.016 133 H ALA 19 H ALA 19 20.677 -10.419 7.942 134 HA ALA 19 HA ALA 19 18.729 -11.669 6.248 135 HB1 ALA 19 HB1 ALA 19 21.091 -12.848 5.577 136 HB2 ALA 19 HB2 ALA 19 20.499 -11.323 4.919 137 HB3 ALA 19 HB3 ALA 19 21.636 -11.319 6.267 138 H VAL 20 H VAL 20 19.852 -12.433 9.259 139 HA VAL 20 HA VAL 20 20.137 -15.275 8.969 140 HB VAL 20 HB VAL 20 19.717 -13.638 11.474 141 HG11 VAL 20 HG11 VAL 20 20.735 -16.457 11.134 142 HG12 VAL 20 HG12 VAL 20 20.602 -15.575 12.656 143 HG13 VAL 20 HG13 VAL 20 19.148 -16.006 11.755 144 HG21 VAL 20 HG21 VAL 20 22.255 -14.205 11.660 145 HG22 VAL 20 HG22 VAL 20 22.149 -14.390 9.909 146 HG23 VAL 20 HG23 VAL 20 21.729 -12.850 10.661 147 H ARG 21 H ARG 21 17.573 -13.065 9.946 148 HA ARG 21 HA ARG 21 15.725 -15.358 10.057 149 HB2 ARG 21 HB2 ARG 21 15.213 -12.715 11.399 150 HB3 ARG 21 HB3 ARG 21 14.447 -14.267 11.709 151 HG2 ARG 21 HG2 ARG 21 15.820 -14.230 13.497 152 HG3 ARG 21 HG3 ARG 21 16.960 -14.911 12.334 153 HD2 ARG 21 HD2 ARG 21 17.883 -12.710 11.908 154 HD3 ARG 21 HD3 ARG 21 16.693 -11.978 12.983 155 HE ARG 21 HE ARG 21 19.117 -13.317 13.739 156 HH11 ARG 21 HH11 ARG 21 15.910 -12.423 14.762 157 HH12 ARG 21 HH12 ARG 21 16.295 -12.473 16.451 158 HH21 ARG 21 HH21 ARG 21 19.634 -13.386 15.960 159 HH22 ARG 21 HH22 ARG 21 18.413 -13.020 17.131 160 H GLY 22 H GLY 22 16.456 -12.307 8.631 161 HA2 GLY 22 HA2 GLY 22 15.573 -11.598 6.559 162 HA3 GLY 22 HA3 GLY 22 14.177 -12.630 6.828 163 H SER 23 H SER 23 14.772 -10.996 9.644 164 HA SER 23 HA SER 23 12.639 -9.082 9.042 165 HB2 SER 23 HB2 SER 23 13.234 -8.941 11.777 166 HB3 SER 23 HB3 SER 23 11.877 -9.786 11.031 167 HG SER 23 HG SER 23 13.476 -10.989 12.449 168 HA PRO 24 HA PRO 24 15.159 -5.499 9.261 169 HB2 PRO 24 HB2 PRO 24 13.646 -3.779 10.718 170 HB3 PRO 24 HB3 PRO 24 13.246 -4.243 9.060 171 HG2 PRO 24 HG2 PRO 24 12.136 -5.283 11.640 172 HG3 PRO 24 HG3 PRO 24 11.283 -4.867 10.142 173 HD2 PRO 24 HD2 PRO 24 11.887 -7.420 10.812 174 HD3 PRO 24 HD3 PRO 24 11.828 -6.864 9.127 175 H ALA 25 H ALA 25 16.623 -4.359 10.536 176 HA ALA 25 HA ALA 25 17.057 -5.486 13.198 177 HB1 ALA 25 HB1 ALA 25 18.923 -5.524 11.611 178 HB2 ALA 25 HB2 ALA 25 18.877 -3.762 11.521 179 HB3 ALA 25 HB3 ALA 25 19.296 -4.557 13.037 180 H ILE 26 H ILE 26 16.934 -4.332 15.046 181 HA ILE 26 HA ILE 26 16.050 -1.537 14.810 182 HB ILE 26 HB ILE 26 15.402 -3.726 16.700 183 HG12 ILE 26 HG12 ILE 26 13.955 -2.575 14.840 184 HG13 ILE 26 HG13 ILE 26 13.220 -3.016 16.378 185 HG21 ILE 26 HG21 ILE 26 15.725 -0.860 17.546 186 HG22 ILE 26 HG22 ILE 26 14.669 -1.988 18.394 187 HG23 ILE 26 HG23 ILE 26 16.401 -2.306 18.295 188 HD11 ILE 26 HD11 ILE 26 13.416 -0.734 17.154 189 HD12 ILE 26 HD12 ILE 26 14.230 -0.276 15.658 190 HD13 ILE 26 HD13 ILE 26 12.545 -0.792 15.623 191 H ASN 27 H ASN 27 17.096 0.092 15.846 192 HA ASN 27 HA ASN 27 18.768 1.221 16.897 193 HB2 ASN 27 HB2 ASN 27 19.195 -1.322 18.477 194 HB3 ASN 27 HB3 ASN 27 19.681 0.307 18.939 195 HD21 ASN 27 HD21 ASN 27 17.328 1.640 18.135 196 HD22 ASN 27 HD22 ASN 27 16.064 1.183 19.221 197 H VAL 28 H VAL 28 19.581 0.560 14.543 198 HA VAL 28 HA VAL 28 22.194 -0.769 14.850 199 HB VAL 28 HB VAL 28 20.543 -0.413 12.345 200 HG11 VAL 28 HG11 VAL 28 23.189 -1.803 12.759 201 HG12 VAL 28 HG12 VAL 28 22.243 -1.815 11.268 202 HG13 VAL 28 HG13 VAL 28 22.928 -0.304 11.867 203 HG21 VAL 28 HG21 VAL 28 20.979 -3.106 12.757 204 HG22 VAL 28 HG22 VAL 28 20.657 -2.489 14.377 205 HG23 VAL 28 HG23 VAL 28 19.483 -2.233 13.087 206 H ALA 29 H ALA 29 23.757 0.688 15.085 207 HA ALA 29 HA ALA 29 23.633 3.390 14.424 208 HB1 ALA 29 HB1 ALA 29 25.669 3.508 15.352 209 HB2 ALA 29 HB2 ALA 29 25.405 1.812 15.760 210 HB3 ALA 29 HB3 ALA 29 26.324 2.240 14.316 211 H VAL 30 H VAL 30 23.765 4.465 12.568 212 HA VAL 30 HA VAL 30 25.181 3.254 10.301 213 HB VAL 30 HB VAL 30 22.399 4.420 10.161 214 HG11 VAL 30 HG11 VAL 30 23.092 3.264 7.710 215 HG12 VAL 30 HG12 VAL 30 22.867 4.978 8.061 216 HG13 VAL 30 HG13 VAL 30 24.472 4.257 8.175 217 HG21 VAL 30 HG21 VAL 30 22.812 1.999 10.960 218 HG22 VAL 30 HG22 VAL 30 21.614 2.282 9.698 219 HG23 VAL 30 HG23 VAL 30 23.216 1.679 9.273 220 H HIS 31 H HIS 31 26.461 4.646 9.255 221 HA HIS 31 HA HIS 31 26.035 7.527 9.700 222 HB2 HIS 31 HB2 HIS 31 28.750 6.280 9.311 223 HB3 HIS 31 HB3 HIS 31 28.365 7.890 9.912 224 HD1 HIS 31 HD1 HIS 31 28.214 4.266 10.978 225 HD2 HIS 31 HD2 HIS 31 28.081 8.075 12.631 226 HE1 HIS 31 HE1 HIS 31 28.308 3.922 13.467 227 H VAL 32 H VAL 32 25.670 8.628 7.899 228 HA VAL 32 HA VAL 32 26.408 7.422 5.328 229 HB VAL 32 HB VAL 32 24.577 9.780 5.761 230 HG11 VAL 32 HG11 VAL 32 23.767 8.478 3.505 231 HG12 VAL 32 HG12 VAL 32 24.843 9.877 3.535 232 HG13 VAL 32 HG13 VAL 32 25.515 8.248 3.449 233 HG21 VAL 32 HG21 VAL 32 23.580 7.996 6.973 234 HG22 VAL 32 HG22 VAL 32 22.734 8.098 5.429 235 HG23 VAL 32 HG23 VAL 32 23.939 6.837 5.693 236 H PHE 33 H PHE 33 27.734 8.415 3.890 237 HA PHE 33 HA PHE 33 28.750 11.088 4.562 238 HB2 PHE 33 HB2 PHE 33 30.359 8.604 3.999 239 HB3 PHE 33 HB3 PHE 33 31.030 10.214 3.758 240 HD1 PHE 33 HD1 PHE 33 29.333 8.135 6.339 241 HD2 PHE 33 HD2 PHE 33 32.082 11.279 5.514 242 HE1 PHE 33 HE1 PHE 33 29.928 8.237 8.724 243 HE2 PHE 33 HE2 PHE 33 32.682 11.386 7.897 244 HZ PHE 33 HZ PHE 33 31.604 9.863 9.506 245 H ARG 34 H ARG 34 29.970 12.072 2.710 246 HA ARG 34 HA ARG 34 28.921 11.153 0.118 247 HB2 ARG 34 HB2 ARG 34 27.607 13.080 0.945 248 HB3 ARG 34 HB3 ARG 34 29.085 14.027 1.043 249 HG2 ARG 34 HG2 ARG 34 28.518 12.796 -1.572 250 HG3 ARG 34 HG3 ARG 34 27.416 14.074 -1.056 251 HD2 ARG 34 HD2 ARG 34 29.436 15.492 -0.598 252 HD3 ARG 34 HD3 ARG 34 30.408 14.238 -1.366 253 HE ARG 34 HE ARG 34 28.838 16.213 -2.672 254 HH11 ARG 34 HH11 ARG 34 29.897 12.905 -2.915 255 HH12 ARG 34 HH12 ARG 34 29.777 12.857 -4.644 256 HH21 ARG 34 HH21 ARG 34 28.677 16.162 -4.948 257 HH22 ARG 34 HH22 ARG 34 29.084 14.711 -5.798 258 H LYS 35 H LYS 35 30.251 11.436 -1.654 259 HA LYS 35 HA LYS 35 33.033 11.440 -1.174 260 HB2 LYS 35 HB2 LYS 35 32.405 10.234 -3.063 261 HB3 LYS 35 HB3 LYS 35 31.322 11.497 -3.632 262 HG2 LYS 35 HG2 LYS 35 33.258 11.345 -5.065 263 HG3 LYS 35 HG3 LYS 35 33.261 12.886 -4.204 264 HD2 LYS 35 HD2 LYS 35 35.487 12.038 -4.146 265 HD3 LYS 35 HD3 LYS 35 34.809 11.837 -2.529 266 HE2 LYS 35 HE2 LYS 35 35.540 9.726 -2.697 267 HE3 LYS 35 HE3 LYS 35 34.129 9.480 -3.726 268 HZ1 LYS 35 HZ1 LYS 35 36.045 10.502 -5.394 269 HZ2 LYS 35 HZ2 LYS 35 35.557 8.885 -5.299 270 HZ3 LYS 35 HZ3 LYS 35 36.894 9.417 -4.411 271 H ALA 36 H ALA 36 34.089 13.191 -0.494 272 HA ALA 36 HA ALA 36 33.270 15.857 -1.071 273 HB1 ALA 36 HB1 ALA 36 34.967 14.644 0.765 274 HB2 ALA 36 HB2 ALA 36 36.026 15.649 -0.224 275 HB3 ALA 36 HB3 ALA 36 34.644 16.370 0.601 276 H ALA 37 H ALA 37 34.506 17.466 -2.216 277 HA ALA 37 HA ALA 37 35.205 16.709 -4.819 278 HB1 ALA 37 HB1 ALA 37 36.167 19.244 -3.531 279 HB2 ALA 37 HB2 ALA 37 35.710 18.962 -5.212 280 HB3 ALA 37 HB3 ALA 37 34.472 18.999 -3.956 281 H ASP 38 H ASP 38 37.029 16.682 -1.919 282 HA ASP 38 HA ASP 38 39.585 16.629 -3.334 283 HB2 ASP 38 HB2 ASP 38 38.739 17.009 -0.511 284 HB3 ASP 38 HB3 ASP 38 40.300 16.239 -0.778 285 H ASP 39 H ASP 39 37.384 14.475 -3.254 286 HA ASP 39 HA ASP 39 37.309 12.205 -3.380 287 HB2 ASP 39 HB2 ASP 39 40.283 12.041 -3.024 288 HB3 ASP 39 HB3 ASP 39 39.227 11.050 -4.028 289 H THR 40 H THR 40 36.951 13.420 -0.876 290 HA THR 40 HA THR 40 38.055 11.362 0.924 291 HB THR 40 HB THR 40 38.181 12.897 2.712 292 HG1 THR 40 HG1 THR 40 37.299 15.000 2.562 293 HG21 THR 40 HG21 THR 40 40.011 13.157 1.122 294 HG22 THR 40 HG22 THR 40 39.610 14.710 1.856 295 HG23 THR 40 HG23 THR 40 39.075 14.344 0.216 296 H TRP 41 H TRP 41 36.636 11.367 3.053 297 HA TRP 41 HA TRP 41 33.867 10.980 2.153 298 HB2 TRP 41 HB2 TRP 41 35.471 9.753 4.391 299 HB3 TRP 41 HB3 TRP 41 33.717 9.610 4.313 300 HD1 TRP 41 HD1 TRP 41 35.808 9.408 1.120 301 HE1 TRP 41 HE1 TRP 41 35.638 7.021 0.173 302 HE3 TRP 41 HE3 TRP 41 33.318 7.177 4.987 303 HZ2 TRP 41 HZ2 TRP 41 34.587 4.522 0.961 304 HZ3 TRP 41 HZ3 TRP 41 32.768 4.785 4.812 305 HH2 TRP 41 HH2 TRP 41 33.389 3.488 2.840 306 H GLU 42 H GLU 42 32.679 12.742 2.543 307 HA GLU 42 HA GLU 42 33.133 14.280 4.987 308 HB2 GLU 42 HB2 GLU 42 31.509 14.833 2.504 309 HB3 GLU 42 HB3 GLU 42 31.480 15.873 3.923 310 HG2 GLU 42 HG2 GLU 42 34.094 15.197 2.668 311 HG3 GLU 42 HG3 GLU 42 33.054 16.402 1.911 312 HA PRO 43 HA PRO 43 29.649 12.657 7.111 313 HB2 PRO 43 HB2 PRO 43 28.947 14.806 8.615 314 HB3 PRO 43 HB3 PRO 43 30.386 13.833 8.943 315 HG2 PRO 43 HG2 PRO 43 30.156 16.454 7.516 316 HG3 PRO 43 HG3 PRO 43 31.360 15.932 8.709 317 HD2 PRO 43 HD2 PRO 43 31.856 15.943 6.047 318 HD3 PRO 43 HD3 PRO 43 32.579 14.752 7.148 319 H PHE 44 H PHE 44 27.803 12.250 6.067 320 HA PHE 44 HA PHE 44 26.299 14.484 4.898 321 HB2 PHE 44 HB2 PHE 44 26.874 12.630 3.379 322 HB3 PHE 44 HB3 PHE 44 26.013 11.509 4.427 323 HD1 PHE 44 HD2 PHE 44 23.535 11.765 4.705 324 HD2 PHE 44 HD1 PHE 44 25.746 13.898 1.758 325 HE1 PHE 44 HE2 PHE 44 21.454 12.211 3.472 326 HE2 PHE 44 HE1 PHE 44 23.667 14.348 0.520 327 HZ PHE 44 HZ PHE 44 21.518 13.504 1.376 328 H ALA 45 H ALA 45 25.913 11.637 6.969 329 HA ALA 45 HA ALA 45 24.011 12.913 8.636 330 HB1 ALA 45 HB1 ALA 45 22.837 10.741 6.913 331 HB2 ALA 45 HB2 ALA 45 22.007 11.757 8.091 332 HB3 ALA 45 HB3 ALA 45 22.619 12.463 6.596 333 H SER 46 H SER 46 22.871 11.145 10.062 334 HA SER 46 HA SER 46 24.169 8.636 10.355 335 HB2 SER 46 HB2 SER 46 26.026 9.418 11.403 336 HB3 SER 46 HB3 SER 46 25.267 10.955 11.814 337 HG SER 46 HG SER 46 25.738 9.585 13.642 338 H GLY 47 H GLY 47 23.338 7.399 12.152 339 HA2 GLY 47 HA2 GLY 47 21.614 8.182 14.126 340 HA3 GLY 47 HA3 GLY 47 20.594 8.044 12.701 341 H LYS 48 H LYS 48 19.453 6.365 13.821 342 HA LYS 48 HA LYS 48 20.821 3.773 13.595 343 HB2 LYS 48 HB2 LYS 48 19.456 4.943 15.948 344 HB3 LYS 48 HB3 LYS 48 19.105 3.253 15.613 345 HG2 LYS 48 HG2 LYS 48 21.502 2.751 15.668 346 HG3 LYS 48 HG3 LYS 48 21.841 4.445 16.029 347 HD2 LYS 48 HD2 LYS 48 20.129 2.643 17.740 348 HD3 LYS 48 HD3 LYS 48 21.839 2.968 18.033 349 HE2 LYS 48 HE2 LYS 48 20.648 5.476 17.716 350 HE3 LYS 48 HE3 LYS 48 19.525 4.550 18.710 351 HZ1 LYS 48 HZ1 LYS 48 21.053 5.622 20.149 352 HZ2 LYS 48 HZ2 LYS 48 22.389 5.084 19.263 353 HZ3 LYS 48 HZ3 LYS 48 21.459 3.980 20.145 354 H THR 49 H THR 49 19.703 2.242 12.540 355 HA THR 49 HA THR 49 17.436 2.853 11.040 356 HB THR 49 HB THR 49 17.311 0.522 10.455 357 HG1 THR 49 HG1 THR 49 18.517 -1.031 11.643 358 HG21 THR 49 HG21 THR 49 19.128 0.912 9.223 359 HG22 THR 49 HG22 THR 49 20.101 0.258 10.541 360 HG23 THR 49 HG23 THR 49 19.786 1.991 10.453 361 H SER 50 H SER 50 15.387 1.420 11.137 362 HA SER 50 HA SER 50 14.440 1.254 13.921 363 HB2 SER 50 HB2 SER 50 13.590 3.288 12.677 364 HB3 SER 50 HB3 SER 50 12.743 2.182 11.597 365 HG SER 50 HG SER 50 11.336 2.775 13.218 366 H GLU 51 H GLU 51 12.215 0.048 13.926 367 HA GLU 51 HA GLU 51 12.724 -2.584 12.995 368 HB2 GLU 51 HB2 GLU 51 10.364 -3.010 13.824 369 HB3 GLU 51 HB3 GLU 51 11.504 -2.393 15.012 370 HG2 GLU 51 HG2 GLU 51 10.170 -0.690 15.449 371 HG3 GLU 51 HG3 GLU 51 10.215 -0.188 13.760 372 H SER 52 H SER 52 11.536 0.105 11.423 373 HA SER 52 HA SER 52 9.873 -1.456 9.578 374 HB2 SER 52 HB2 SER 52 8.887 0.618 10.479 375 HB3 SER 52 HB3 SER 52 10.222 1.545 9.796 376 HG SER 52 HG SER 52 8.016 0.429 8.556 377 H GLY 53 H GLY 53 13.013 -0.792 9.891 378 HA2 GLY 53 HA2 GLY 53 14.776 -0.928 8.419 379 HA3 GLY 53 HA3 GLY 53 13.612 -1.317 7.161 380 H GLU 54 H GLU 54 13.263 1.610 8.991 381 HA GLU 54 HA GLU 54 14.380 3.156 6.752 382 HB2 GLU 54 HB2 GLU 54 12.518 4.637 6.722 383 HB3 GLU 54 HB3 GLU 54 11.863 3.006 6.671 384 HG2 GLU 54 HG2 GLU 54 11.710 3.284 9.254 385 HG3 GLU 54 HG3 GLU 54 11.799 5.005 8.880 386 H LEU 55 H LEU 55 15.114 5.272 7.283 387 HA LEU 55 HA LEU 55 15.404 5.826 10.153 388 HB2 LEU 55 HB2 LEU 55 17.452 4.864 8.567 389 HB3 LEU 55 HB3 LEU 55 17.729 6.605 8.589 390 HG LEU 55 HG LEU 55 17.504 4.849 11.034 391 HD11 LEU 55 HD11 LEU 55 19.832 5.830 9.437 392 HD12 LEU 55 HD12 LEU 55 19.537 4.235 10.129 393 HD13 LEU 55 HD13 LEU 55 19.987 5.580 11.177 394 HD21 LEU 55 HD21 LEU 55 17.155 6.765 12.105 395 HD22 LEU 55 HD22 LEU 55 17.413 7.708 10.637 396 HD23 LEU 55 HD23 LEU 55 18.788 7.243 11.639 397 H HIS 56 H HIS 56 14.600 7.764 10.570 398 HA HIS 56 HA HIS 56 14.558 9.780 8.436 399 HB2 HIS 56 HB2 HIS 56 12.904 9.400 10.924 400 HB3 HIS 56 HB3 HIS 56 12.908 10.924 10.042 401 HD1 HIS 56 HD1 HIS 56 13.122 9.148 7.242 402 HD2 HIS 56 HD2 HIS 56 10.172 9.112 10.167 403 HE1 HIS 56 HE1 HIS 56 11.059 8.270 6.104 404 H GLY 57 H GLY 57 15.006 12.017 8.995 405 HA2 GLY 57 HA2 GLY 57 15.938 13.663 10.455 406 HA3 GLY 57 HA3 GLY 57 16.673 12.370 11.390 407 H LEU 58 H LEU 58 17.666 10.986 9.001 408 HA LEU 58 HA LEU 58 20.204 12.197 8.838 409 HB2 LEU 58 HB2 LEU 58 18.828 9.971 7.412 410 HB3 LEU 58 HB3 LEU 58 20.348 10.586 6.767 411 HG LEU 58 HG LEU 58 21.348 10.118 9.050 412 HD11 LEU 58 HD11 LEU 58 19.234 9.957 10.277 413 HD12 LEU 58 HD12 LEU 58 20.202 8.494 10.446 414 HD13 LEU 58 HD13 LEU 58 18.815 8.511 9.357 415 HD21 LEU 58 HD21 LEU 58 21.407 8.672 6.885 416 HD22 LEU 58 HD22 LEU 58 20.358 7.591 7.802 417 HD23 LEU 58 HD23 LEU 58 21.964 7.989 8.413 418 H THR 59 H THR 59 17.306 12.595 6.988 419 HA THR 59 HA THR 59 18.229 13.537 4.565 420 HB THR 59 HB THR 59 16.157 14.793 4.357 421 HG1 THR 59 HG1 THR 59 14.775 14.602 6.410 422 HG21 THR 59 HG21 THR 59 15.974 12.400 4.074 423 HG22 THR 59 HG22 THR 59 14.538 12.994 4.909 424 HG23 THR 59 HG23 THR 59 15.809 12.172 5.815 425 H THR 60 H THR 60 19.188 15.348 3.845 426 HA THR 60 HA THR 60 19.218 17.763 5.455 427 HB THR 60 HB THR 60 21.729 17.940 5.288 428 HG1 THR 60 HG1 THR 60 21.511 15.142 4.776 429 HG21 THR 60 HG21 THR 60 20.508 17.323 7.376 430 HG22 THR 60 HG22 THR 60 22.140 16.663 7.284 431 HG23 THR 60 HG23 THR 60 20.751 15.627 6.962 432 H GLU 61 H GLU 61 20.438 19.541 4.297 433 HA GLU 61 HA GLU 61 19.467 19.761 1.652 434 HB2 GLU 61 HB2 GLU 61 20.668 21.893 1.589 435 HB3 GLU 61 HB3 GLU 61 19.777 21.712 3.093 436 HG2 GLU 61 HG2 GLU 61 21.802 21.144 4.273 437 HG3 GLU 61 HG3 GLU 61 22.722 21.184 2.771 438 H GLU 62 H GLU 62 22.241 18.286 2.907 439 HA GLU 62 HA GLU 62 24.018 18.724 0.720 440 HB2 GLU 62 HB2 GLU 62 24.000 17.153 3.195 441 HB3 GLU 62 HB3 GLU 62 24.858 16.376 1.872 442 HG2 GLU 62 HG2 GLU 62 25.396 19.100 3.028 443 HG3 GLU 62 HG3 GLU 62 26.405 17.661 3.172 444 H GLU 63 H GLU 63 21.204 16.953 0.985 445 HA GLU 63 HA GLU 63 21.834 14.627 -0.492 446 HB2 GLU 63 HB2 GLU 63 19.469 14.304 -0.707 447 HB3 GLU 63 HB3 GLU 63 19.782 14.944 0.900 448 HG2 GLU 63 HG2 GLU 63 18.003 16.227 0.313 449 HG3 GLU 63 HG3 GLU 63 19.312 17.244 -0.289 450 H PHE 64 H PHE 64 21.604 17.874 -1.412 451 HA PHE 64 HA PHE 64 20.838 17.332 -4.159 452 HB2 PHE 64 HB2 PHE 64 20.290 19.452 -2.717 453 HB3 PHE 64 HB3 PHE 64 21.892 19.976 -3.224 454 HD1 PHE 64 HD2 PHE 64 18.894 18.410 -4.810 455 HD2 PHE 64 HD1 PHE 64 21.932 21.383 -5.024 456 HE1 PHE 64 HE2 PHE 64 17.952 19.215 -6.935 457 HE2 PHE 64 HE1 PHE 64 20.995 22.193 -7.149 458 HZ PHE 64 HZ PHE 64 19.002 21.110 -8.107 459 H VAL 65 H VAL 65 23.004 15.854 -3.710 460 HA VAL 65 HA VAL 65 25.245 17.363 -4.891 461 HB VAL 65 HB VAL 65 26.705 15.535 -4.034 462 HG11 VAL 65 HG11 VAL 65 25.120 17.299 -2.218 463 HG12 VAL 65 HG12 VAL 65 26.315 16.189 -1.542 464 HG13 VAL 65 HG13 VAL 65 26.810 17.418 -2.706 465 HG21 VAL 65 HG21 VAL 65 25.947 13.745 -2.885 466 HG22 VAL 65 HG22 VAL 65 24.652 14.656 -2.107 467 HG23 VAL 65 HG23 VAL 65 24.455 14.082 -3.763 468 H GLU 66 H GLU 66 26.802 15.548 -5.970 469 HA GLU 66 HA GLU 66 25.700 14.909 -8.408 470 HB2 GLU 66 HB2 GLU 66 27.979 13.556 -6.957 471 HB3 GLU 66 HB3 GLU 66 27.598 13.294 -8.653 472 HG2 GLU 66 HG2 GLU 66 27.991 16.089 -7.756 473 HG3 GLU 66 HG3 GLU 66 29.412 15.050 -7.856 474 H GLY 67 H GLY 67 26.122 12.735 -5.618 475 HA2 GLY 67 HA2 GLY 67 23.857 11.399 -5.460 476 HA3 GLY 67 HA3 GLY 67 24.479 10.716 -6.955 477 H ILE 68 H ILE 68 27.238 11.235 -5.532 478 HA ILE 68 HA ILE 68 27.620 8.542 -4.733 479 HB ILE 68 HB ILE 68 29.400 10.924 -4.201 480 HG12 ILE 68 HG12 ILE 68 29.795 8.911 -6.394 481 HG13 ILE 68 HG13 ILE 68 28.724 10.288 -6.638 482 HG21 ILE 68 HG21 ILE 68 31.178 9.116 -4.168 483 HG22 ILE 68 HG22 ILE 68 30.095 9.182 -2.777 484 HG23 ILE 68 HG23 ILE 68 29.854 7.959 -4.024 485 HD11 ILE 68 HD11 ILE 68 30.725 11.039 -7.492 486 HD12 ILE 68 HD12 ILE 68 30.755 11.683 -5.850 487 HD13 ILE 68 HD13 ILE 68 31.680 10.235 -6.247 488 H TYR 69 H TYR 69 27.187 7.603 -2.856 489 HA TYR 69 HA TYR 69 27.301 9.175 -0.391 490 HB2 TYR 69 HB2 TYR 69 24.945 7.437 -1.152 491 HB3 TYR 69 HB3 TYR 69 25.161 8.257 0.390 492 HD1 TYR 69 HD2 TYR 69 25.777 10.911 -0.030 493 HD2 TYR 69 HD1 TYR 69 23.404 8.427 -2.540 494 HE1 TYR 69 HE2 TYR 69 24.648 12.904 -0.925 495 HE2 TYR 69 HE1 TYR 69 22.269 10.414 -3.443 496 HH TYR 69 HH TYR 69 21.849 12.671 -2.962 497 H LYS 70 H LYS 70 28.458 8.143 1.086 498 HA LYS 70 HA LYS 70 28.758 5.222 0.846 499 HB2 LYS 70 HB2 LYS 70 30.648 7.294 1.974 500 HB3 LYS 70 HB3 LYS 70 30.906 5.558 2.092 501 HG2 LYS 70 HG2 LYS 70 32.153 5.993 0.248 502 HG3 LYS 70 HG3 LYS 70 30.596 5.700 -0.531 503 HD2 LYS 70 HD2 LYS 70 31.454 7.680 -1.500 504 HD3 LYS 70 HD3 LYS 70 30.196 8.194 -0.373 505 HE2 LYS 70 HE2 LYS 70 32.918 8.006 0.741 506 HE3 LYS 70 HE3 LYS 70 32.675 9.263 -0.470 507 HZ1 LYS 70 HZ1 LYS 70 30.540 9.663 1.031 508 HZ2 LYS 70 HZ2 LYS 70 32.023 10.412 1.343 509 HZ3 LYS 70 HZ3 LYS 70 31.572 9.034 2.215 510 H VAL 71 H VAL 71 27.341 4.326 2.222 511 HA VAL 71 HA VAL 71 27.018 5.484 4.896 512 HB VAL 71 HB VAL 71 25.398 3.349 3.501 513 HG11 VAL 71 HG11 VAL 71 25.265 2.916 5.822 514 HG12 VAL 71 HG12 VAL 71 25.121 4.632 6.208 515 HG13 VAL 71 HG13 VAL 71 23.794 3.794 5.402 516 HG21 VAL 71 HG21 VAL 71 25.012 5.462 2.459 517 HG22 VAL 71 HG22 VAL 71 23.635 5.128 3.507 518 HG23 VAL 71 HG23 VAL 71 24.875 6.272 4.019 519 H GLU 72 H GLU 72 27.395 4.325 6.764 520 HA GLU 72 HA GLU 72 28.658 1.686 6.449 521 HB2 GLU 72 HB2 GLU 72 30.464 2.230 7.798 522 HB3 GLU 72 HB3 GLU 72 30.233 3.714 6.881 523 HG2 GLU 72 HG2 GLU 72 28.717 4.360 8.923 524 HG3 GLU 72 HG3 GLU 72 29.700 3.154 9.751 525 H ILE 73 H ILE 73 28.088 0.162 7.913 526 HA ILE 73 HA ILE 73 26.229 0.995 10.043 527 HB ILE 73 HB ILE 73 26.274 -1.600 8.499 528 HG12 ILE 73 HG12 ILE 73 23.770 -0.181 8.493 529 HG13 ILE 73 HG13 ILE 73 25.058 0.887 7.944 530 HG21 ILE 73 HG21 ILE 73 24.921 -0.782 11.008 531 HG22 ILE 73 HG22 ILE 73 23.997 -1.750 9.860 532 HG23 ILE 73 HG23 ILE 73 25.519 -2.363 10.505 533 HD11 ILE 73 HD11 ILE 73 24.841 -1.855 6.802 534 HD12 ILE 73 HD12 ILE 73 23.755 -0.583 6.245 535 HD13 ILE 73 HD13 ILE 73 25.500 -0.384 6.087 536 H ASP 74 H ASP 74 26.608 0.335 12.087 537 HA ASP 74 HA ASP 74 29.061 -1.209 12.548 538 HB2 ASP 74 HB2 ASP 74 27.961 1.128 13.757 539 HB3 ASP 74 HB3 ASP 74 28.019 -0.142 14.976 540 H THR 75 H THR 75 28.479 -3.319 12.508 541 HA THR 75 HA THR 75 26.086 -4.216 13.887 542 HB THR 75 HB THR 75 26.446 -6.344 12.925 543 HG1 THR 75 HG1 THR 75 28.563 -6.640 11.747 544 HG21 THR 75 HG21 THR 75 27.601 -4.561 10.803 545 HG22 THR 75 HG22 THR 75 25.937 -4.368 11.353 546 HG23 THR 75 HG23 THR 75 26.455 -5.890 10.631 547 H LYS 76 H LYS 76 29.500 -4.033 14.424 548 HA LYS 76 HA LYS 76 29.962 -6.039 16.257 549 HB2 LYS 76 HB2 LYS 76 31.710 -4.547 17.209 550 HB3 LYS 76 HB3 LYS 76 31.764 -4.654 15.453 551 HG2 LYS 76 HG2 LYS 76 31.947 -2.420 15.603 552 HG3 LYS 76 HG3 LYS 76 30.188 -2.497 15.731 553 HD2 LYS 76 HD2 LYS 76 30.708 -1.162 17.533 554 HD3 LYS 76 HD3 LYS 76 30.683 -2.757 18.288 555 HE2 LYS 76 HE2 LYS 76 32.644 -1.773 19.090 556 HE3 LYS 76 HE3 LYS 76 33.193 -2.826 17.788 557 HZ1 LYS 76 HZ1 LYS 76 32.889 -0.656 16.391 558 HZ2 LYS 76 HZ2 LYS 76 34.300 -0.912 17.289 559 HZ3 LYS 76 HZ3 LYS 76 33.087 0.102 17.890 560 H SER 77 H SER 77 28.496 -2.869 16.786 561 HA SER 77 HA SER 77 28.149 -3.406 19.622 562 HB2 SER 77 HB2 SER 77 28.041 -1.052 17.885 563 HB3 SER 77 HB3 SER 77 26.745 -1.090 19.081 564 HG SER 77 HG SER 77 28.298 -1.270 20.700 565 H TYR 78 H TYR 78 26.466 -3.944 16.741 566 HA TYR 78 HA TYR 78 23.804 -3.744 17.808 567 HB2 TYR 78 HB2 TYR 78 24.144 -3.384 15.437 568 HB3 TYR 78 HB3 TYR 78 24.861 -4.981 15.258 569 HD1 TYR 78 HD1 TYR 78 21.717 -3.654 16.800 570 HD2 TYR 78 HD2 TYR 78 23.494 -6.434 14.113 571 HE1 TYR 78 HE1 TYR 78 19.496 -4.588 16.307 572 HE2 TYR 78 HE2 TYR 78 21.278 -7.374 13.611 573 HH TYR 78 HH TYR 78 19.112 -7.447 14.290 574 H TRP 79 H TRP 79 26.190 -6.272 17.353 575 HA TRP 79 HA TRP 79 24.384 -8.412 18.001 576 HB2 TRP 79 HB2 TRP 79 27.406 -8.472 17.993 577 HB3 TRP 79 HB3 TRP 79 26.313 -9.848 17.873 578 HD1 TRP 79 HD1 TRP 79 28.565 -8.284 15.718 579 HE1 TRP 79 HE1 TRP 79 27.802 -8.253 13.260 580 HE3 TRP 79 HE3 TRP 79 23.592 -9.251 16.401 581 HZ2 TRP 79 HZ2 TRP 79 25.408 -8.593 11.804 582 HZ3 TRP 79 HZ3 TRP 79 22.134 -9.381 14.424 583 HH2 TRP 79 HH2 TRP 79 23.025 -9.058 12.173 584 H LYS 80 H LYS 80 26.408 -6.236 19.755 585 HA LYS 80 HA LYS 80 26.495 -7.857 22.148 586 HB2 LYS 80 HB2 LYS 80 27.895 -6.235 23.045 587 HB3 LYS 80 HB3 LYS 80 28.252 -6.125 21.327 588 HG2 LYS 80 HG2 LYS 80 27.929 -3.937 21.592 589 HG3 LYS 80 HG3 LYS 80 26.210 -4.333 21.599 590 HD2 LYS 80 HD2 LYS 80 26.598 -2.976 23.504 591 HD3 LYS 80 HD3 LYS 80 26.408 -4.628 24.096 592 HE2 LYS 80 HE2 LYS 80 28.947 -4.782 23.996 593 HE3 LYS 80 HE3 LYS 80 28.938 -3.032 23.786 594 HZ1 LYS 80 HZ1 LYS 80 27.597 -2.945 25.888 595 HZ2 LYS 80 HZ2 LYS 80 29.205 -3.436 26.077 596 HZ3 LYS 80 HZ3 LYS 80 27.959 -4.582 26.114 597 H ALA 81 H ALA 81 24.352 -5.622 20.723 598 HA ALA 81 HA ALA 81 23.148 -4.735 23.196 599 HB1 ALA 81 HB1 ALA 81 21.429 -3.749 21.604 600 HB2 ALA 81 HB2 ALA 81 23.079 -3.142 21.469 601 HB3 ALA 81 HB3 ALA 81 22.473 -4.314 20.299 602 H LEU 82 H LEU 82 22.337 -6.965 20.563 603 HA LEU 82 HA LEU 82 19.997 -7.879 22.072 604 HB2 LEU 82 HB2 LEU 82 20.860 -8.470 19.245 605 HB3 LEU 82 HB3 LEU 82 19.384 -9.062 20.005 606 HG LEU 82 HG LEU 82 18.640 -7.294 18.703 607 HD11 LEU 82 HD11 LEU 82 17.981 -7.133 21.119 608 HD12 LEU 82 HD12 LEU 82 17.881 -5.625 20.210 609 HD13 LEU 82 HD13 LEU 82 19.234 -5.906 21.307 610 HD21 LEU 82 HD21 LEU 82 20.879 -5.528 19.664 611 HD22 LEU 82 HD22 LEU 82 19.760 -5.243 18.331 612 HD23 LEU 82 HD23 LEU 82 20.986 -6.505 18.199 613 H GLY 83 H GLY 83 23.125 -8.551 22.124 614 HA2 GLY 83 HA2 GLY 83 24.389 -10.373 22.717 615 HA3 GLY 83 HA3 GLY 83 22.899 -11.025 23.382 616 H ILE 84 H ILE 84 23.857 -10.330 20.029 617 HA ILE 84 HA ILE 84 22.925 -12.971 19.249 618 HB ILE 84 HB ILE 84 24.084 -10.869 17.428 619 HG12 ILE 84 HG12 ILE 84 22.273 -9.831 18.681 620 HG13 ILE 84 HG13 ILE 84 21.752 -10.138 17.027 621 HG21 ILE 84 HG21 ILE 84 22.377 -12.056 15.876 622 HG22 ILE 84 HG22 ILE 84 23.922 -12.833 16.219 623 HG23 ILE 84 HG23 ILE 84 22.466 -13.355 17.066 624 HD11 ILE 84 HD11 ILE 84 19.938 -10.748 18.360 625 HD12 ILE 84 HD12 ILE 84 20.713 -12.276 17.936 626 HD13 ILE 84 HD13 ILE 84 20.964 -11.574 19.534 627 H SER 85 H SER 85 24.218 -14.353 17.855 628 HA SER 85 HA SER 85 26.635 -15.101 18.910 629 HB2 SER 85 HB2 SER 85 25.328 -15.552 16.262 630 HB3 SER 85 HB3 SER 85 27.010 -16.044 16.458 631 HG SER 85 HG SER 85 26.380 -17.351 18.184 632 HA PRO 86 HA PRO 86 29.669 -12.212 17.594 633 HB2 PRO 86 HB2 PRO 86 31.856 -13.816 17.484 634 HB3 PRO 86 HB3 PRO 86 31.121 -13.298 19.005 635 HG2 PRO 86 HG2 PRO 86 30.813 -15.890 17.539 636 HG3 PRO 86 HG3 PRO 86 31.030 -15.606 19.277 637 HD2 PRO 86 HD2 PRO 86 28.611 -16.128 18.175 638 HD3 PRO 86 HD3 PRO 86 28.808 -15.080 19.595 639 H MET 87 H MET 87 29.791 -11.374 15.613 640 HA MET 87 HA MET 87 31.180 -12.571 13.497 641 HB2 MET 87 HB2 MET 87 29.306 -14.060 13.248 642 HB3 MET 87 HB3 MET 87 28.170 -12.718 13.295 643 HG2 MET 87 HG2 MET 87 28.527 -13.629 11.032 644 HG3 MET 87 HG3 MET 87 28.929 -11.919 11.173 645 HE1 MET 87 HE1 MET 87 32.308 -15.027 11.478 646 HE2 MET 87 HE2 MET 87 31.323 -14.443 12.820 647 HE3 MET 87 HE3 MET 87 30.609 -15.489 11.591 648 H HIS 88 H HIS 88 32.120 -10.549 13.379 649 HA HIS 88 HA HIS 88 30.584 -8.153 13.091 650 HB2 HIS 88 HB2 HIS 88 33.513 -8.790 12.786 651 HB3 HIS 88 HB3 HIS 88 32.870 -7.187 12.445 652 HD1 HIS 88 HD1 HIS 88 31.762 -9.349 15.334 653 HD2 HIS 88 HD2 HIS 88 33.952 -5.892 14.615 654 HE1 HIS 88 HE1 HIS 88 32.201 -8.347 17.599 655 H GLU 89 H GLU 89 29.219 -8.476 11.321 656 HA GLU 89 HA GLU 89 30.543 -8.714 8.704 657 HB2 GLU 89 HB2 GLU 89 28.675 -10.350 9.497 658 HB3 GLU 89 HB3 GLU 89 27.587 -9.023 9.116 659 HG2 GLU 89 HG2 GLU 89 27.679 -9.465 6.949 660 HG3 GLU 89 HG3 GLU 89 29.441 -9.486 6.960 661 H HIS 90 H HIS 90 30.998 -6.323 9.372 662 HA HIS 90 HA HIS 90 28.903 -4.428 9.156 663 HB2 HIS 90 HB2 HIS 90 31.797 -3.880 8.513 664 HB3 HIS 90 HB3 HIS 90 30.597 -2.767 9.165 665 HD1 HIS 90 HD1 HIS 90 29.618 -4.837 11.412 666 HD2 HIS 90 HD2 HIS 90 33.518 -3.606 10.679 667 HE1 HIS 90 HE1 HIS 90 30.855 -5.201 13.571 668 H ALA 91 H ALA 91 27.684 -4.303 7.381 669 HA ALA 91 HA ALA 91 28.957 -4.549 4.750 670 HB1 ALA 91 HB1 ALA 91 26.054 -4.664 5.555 671 HB2 ALA 91 HB2 ALA 91 26.643 -4.783 3.896 672 HB3 ALA 91 HB3 ALA 91 27.079 -6.018 5.077 673 H GLU 92 H GLU 92 29.500 -2.738 3.739 674 HA GLU 92 HA GLU 92 28.071 -0.258 4.396 675 HB2 GLU 92 HB2 GLU 92 30.007 0.920 3.501 676 HB3 GLU 92 HB3 GLU 92 30.505 -0.229 4.734 677 HG2 GLU 92 HG2 GLU 92 30.555 -1.053 1.873 678 HG3 GLU 92 HG3 GLU 92 31.832 -0.012 2.501 679 H VAL 93 H VAL 93 28.007 1.337 2.493 680 HA VAL 93 HA VAL 93 27.440 -0.030 -0.040 681 HB VAL 93 HB VAL 93 25.569 2.020 1.148 682 HG11 VAL 93 HG11 VAL 93 25.781 1.724 -1.380 683 HG12 VAL 93 HG12 VAL 93 25.035 0.144 -1.136 684 HG13 VAL 93 HG13 VAL 93 24.164 1.610 -0.683 685 HG21 VAL 93 HG21 VAL 93 25.725 -0.886 1.516 686 HG22 VAL 93 HG22 VAL 93 24.908 0.340 2.485 687 HG23 VAL 93 HG23 VAL 93 24.138 -0.292 1.030 688 H VAL 94 H VAL 94 28.628 0.905 -1.557 689 HA VAL 94 HA VAL 94 28.951 3.830 -1.496 690 HB VAL 94 HB VAL 94 31.090 1.834 -2.249 691 HG11 VAL 94 HG11 VAL 94 32.055 3.475 -3.391 692 HG12 VAL 94 HG12 VAL 94 30.717 4.557 -3.000 693 HG13 VAL 94 HG13 VAL 94 32.111 4.451 -1.925 694 HG21 VAL 94 HG21 VAL 94 31.225 1.780 0.023 695 HG22 VAL 94 HG22 VAL 94 32.200 3.218 -0.273 696 HG23 VAL 94 HG23 VAL 94 30.514 3.382 0.217 697 H PHE 95 H PHE 95 27.792 4.551 -3.163 698 HA PHE 95 HA PHE 95 28.134 3.212 -5.764 699 HB2 PHE 95 HB2 PHE 95 25.655 4.188 -4.408 700 HB3 PHE 95 HB3 PHE 95 25.748 4.272 -6.165 701 HD1 PHE 95 HD2 PHE 95 26.293 2.120 -7.423 702 HD2 PHE 95 HD1 PHE 95 25.072 2.207 -3.346 703 HE1 PHE 95 HE2 PHE 95 25.642 -0.248 -7.570 704 HE2 PHE 95 HE1 PHE 95 24.421 -0.161 -3.487 705 HZ PHE 95 HZ PHE 95 24.704 -1.392 -5.601 706 H THR 96 H THR 96 28.052 4.567 -7.624 707 HA THR 96 HA THR 96 28.686 7.385 -7.035 708 HB THR 96 HB THR 96 30.619 6.171 -7.923 709 HG1 THR 96 HG1 THR 96 31.112 7.868 -9.105 710 HG21 THR 96 HG21 THR 96 28.644 5.052 -9.687 711 HG22 THR 96 HG22 THR 96 30.313 4.550 -9.421 712 HG23 THR 96 HG23 THR 96 29.946 5.787 -10.622 713 H ALA 97 H ALA 97 27.825 8.993 -8.338 714 HA ALA 97 HA ALA 97 25.327 8.331 -9.613 715 HB1 ALA 97 HB1 ALA 97 26.462 11.071 -9.786 716 HB2 ALA 97 HB2 ALA 97 24.809 10.546 -9.461 717 HB3 ALA 97 HB3 ALA 97 26.030 10.450 -8.193 718 H ASN 98 H ASN 98 24.761 9.064 -11.779 719 HA ASN 98 HA ASN 98 25.059 9.142 -14.033 720 HB2 ASN 98 HB2 ASN 98 26.583 11.083 -13.272 721 HB3 ASN 98 HB3 ASN 98 27.916 9.976 -13.585 722 HD21 ASN 98 HD21 ASN 98 28.572 9.642 -15.627 723 HD22 ASN 98 HD22 ASN 98 27.854 10.374 -17.018 724 H ASP 99 H ASP 99 25.657 6.724 -12.525 725 HA ASP 99 HA ASP 99 27.877 5.486 -13.926 726 HB2 ASP 99 HB2 ASP 99 26.923 5.103 -11.436 727 HB3 ASP 99 HB3 ASP 99 26.045 3.833 -12.282 728 H SER 100 H SER 100 27.076 2.942 -14.367 729 HA SER 100 HA SER 100 24.947 3.241 -16.384 730 HB2 SER 100 HB2 SER 100 27.252 2.892 -17.309 731 HB3 SER 100 HB3 SER 100 27.288 1.326 -16.500 732 HG SER 100 HG SER 100 26.544 1.489 -18.817 733 H GLY 101 H GLY 101 23.584 2.673 -14.450 734 HA2 GLY 101 HA2 GLY 101 22.229 0.434 -14.542 735 HA3 GLY 101 HA3 GLY 101 23.678 -0.175 -13.757 736 HA PRO 102 HA PRO 102 21.641 2.958 -10.671 737 HB2 PRO 102 HB2 PRO 102 19.123 3.769 -11.281 738 HB3 PRO 102 HB3 PRO 102 20.568 4.644 -11.803 739 HG2 PRO 102 HG2 PRO 102 18.867 2.714 -13.333 740 HG3 PRO 102 HG3 PRO 102 19.563 4.257 -13.864 741 HD2 PRO 102 HD2 PRO 102 20.665 1.866 -14.499 742 HD3 PRO 102 HD3 PRO 102 21.637 3.331 -14.253 743 H ARG 103 H ARG 103 20.288 2.466 -8.904 744 HA ARG 103 HA ARG 103 18.660 0.031 -9.223 745 HB2 ARG 103 HB2 ARG 103 20.662 0.761 -7.110 746 HB3 ARG 103 HB3 ARG 103 19.344 -0.340 -6.738 747 HG2 ARG 103 HG2 ARG 103 20.090 -1.778 -8.620 748 HG3 ARG 103 HG3 ARG 103 21.481 -0.711 -8.821 749 HD2 ARG 103 HD2 ARG 103 22.305 -2.441 -7.496 750 HD3 ARG 103 HD3 ARG 103 21.931 -1.169 -6.334 751 HE ARG 103 HE ARG 103 19.667 -2.620 -6.350 752 HH11 ARG 103 HH11 ARG 103 23.021 -3.498 -6.022 753 HH12 ARG 103 HH12 ARG 103 22.696 -4.878 -5.025 754 HH21 ARG 103 HH21 ARG 103 19.228 -4.433 -5.038 755 HH22 ARG 103 HH22 ARG 103 20.540 -5.409 -4.467 756 H ARG 104 H ARG 104 19.232 2.269 -6.518 757 HA ARG 104 HA ARG 104 16.661 3.490 -6.709 758 HB2 ARG 104 HB2 ARG 104 17.012 1.104 -4.999 759 HB3 ARG 104 HB3 ARG 104 16.214 2.474 -4.238 760 HG2 ARG 104 HG2 ARG 104 14.757 2.467 -6.400 761 HG3 ARG 104 HG3 ARG 104 15.324 0.801 -6.537 762 HD2 ARG 104 HD2 ARG 104 14.467 0.313 -4.309 763 HD3 ARG 104 HD3 ARG 104 13.940 1.986 -4.133 764 HE ARG 104 HE ARG 104 12.109 1.514 -5.429 765 HH11 ARG 104 HH11 ARG 104 14.428 -1.065 -5.725 766 HH12 ARG 104 HH12 ARG 104 13.354 -2.106 -6.598 767 HH21 ARG 104 HH21 ARG 104 10.685 0.152 -6.578 768 HH22 ARG 104 HH22 ARG 104 11.225 -1.413 -7.084 769 H TYR 105 H TYR 105 16.194 4.597 -4.422 770 HA TYR 105 HA TYR 105 18.703 5.948 -3.720 771 HB2 TYR 105 HB2 TYR 105 17.148 7.704 -2.768 772 HB3 TYR 105 HB3 TYR 105 17.079 7.496 -4.514 773 HD1 TYR 105 HD1 TYR 105 15.364 6.488 -1.368 774 HD2 TYR 105 HD2 TYR 105 15.035 7.088 -5.567 775 HE1 TYR 105 HE1 TYR 105 12.935 6.133 -1.222 776 HE2 TYR 105 HE2 TYR 105 12.605 6.737 -5.432 777 HH TYR 105 HH TYR 105 11.082 5.278 -3.144 778 H THR 106 H THR 106 17.729 3.347 -2.629 779 HA THR 106 HA THR 106 17.676 4.112 0.218 780 HB THR 106 HB THR 106 16.378 1.679 -1.026 781 HG1 THR 106 HG1 THR 106 14.736 2.984 -1.248 782 HG21 THR 106 HG21 THR 106 17.007 1.001 1.117 783 HG22 THR 106 HG22 THR 106 15.359 1.584 1.346 784 HG23 THR 106 HG23 THR 106 16.726 2.597 1.808 785 H ILE 107 H ILE 107 19.054 3.070 1.590 786 HA ILE 107 HA ILE 107 21.210 1.573 0.354 787 HB ILE 107 HB ILE 107 20.830 2.585 3.172 788 HG12 ILE 107 HG12 ILE 107 23.078 3.759 2.160 789 HG13 ILE 107 HG13 ILE 107 22.082 3.621 0.714 790 HG21 ILE 107 HG21 ILE 107 22.321 1.052 3.793 791 HG22 ILE 107 HG22 ILE 107 22.646 0.585 2.124 792 HG23 ILE 107 HG23 ILE 107 23.504 1.948 2.840 793 HD11 ILE 107 HD11 ILE 107 21.041 4.826 3.253 794 HD12 ILE 107 HD12 ILE 107 21.910 5.770 2.042 795 HD13 ILE 107 HD13 ILE 107 20.396 4.971 1.618 796 H ALA 108 H ALA 108 20.948 -0.541 0.073 797 HA ALA 108 HA ALA 108 19.305 -2.080 1.926 798 HB1 ALA 108 HB1 ALA 108 20.634 -2.890 -0.659 799 HB2 ALA 108 HB2 ALA 108 19.552 -3.902 0.299 800 HB3 ALA 108 HB3 ALA 108 18.944 -2.425 -0.452 801 H ALA 109 H ALA 109 20.264 -2.827 3.698 802 HA ALA 109 HA ALA 109 22.942 -4.024 3.435 803 HB1 ALA 109 HB1 ALA 109 22.096 -1.844 5.154 804 HB2 ALA 109 HB2 ALA 109 22.809 -3.179 6.062 805 HB3 ALA 109 HB3 ALA 109 23.720 -2.413 4.761 806 H MET 110 H MET 110 22.850 -6.125 3.848 807 HA MET 110 HA MET 110 20.823 -7.102 5.748 808 HB2 MET 110 HB2 MET 110 22.066 -8.402 3.330 809 HB3 MET 110 HB3 MET 110 21.180 -9.319 4.540 810 HG2 MET 110 HG2 MET 110 19.261 -7.691 4.110 811 HG3 MET 110 HG3 MET 110 20.159 -7.215 2.670 812 HE1 MET 110 HE1 MET 110 17.398 -9.903 3.841 813 HE2 MET 110 HE2 MET 110 18.412 -11.327 3.604 814 HE3 MET 110 HE3 MET 110 18.908 -10.069 4.737 815 H LEU 111 H LEU 111 21.502 -8.033 7.568 816 HA LEU 111 HA LEU 111 24.345 -8.343 8.019 817 HB2 LEU 111 HB2 LEU 111 22.030 -8.860 9.879 818 HB3 LEU 111 HB3 LEU 111 23.731 -8.772 10.330 819 HG LEU 111 HG LEU 111 22.902 -6.721 11.010 820 HD11 LEU 111 HD11 LEU 111 23.861 -5.064 9.550 821 HD12 LEU 111 HD12 LEU 111 23.814 -6.183 8.188 822 HD13 LEU 111 HD13 LEU 111 24.886 -6.499 9.552 823 HD21 LEU 111 HD21 LEU 111 21.457 -6.265 8.421 824 HD22 LEU 111 HD22 LEU 111 21.232 -5.457 9.973 825 HD23 LEU 111 HD23 LEU 111 20.703 -7.127 9.762 826 H SER 112 H SER 112 24.329 -10.105 6.312 827 HA SER 112 HA SER 112 23.143 -12.578 6.607 828 HB2 SER 112 HB2 SER 112 25.583 -13.266 5.588 829 HB3 SER 112 HB3 SER 112 24.255 -12.606 4.634 830 HG SER 112 HG SER 112 26.537 -11.575 4.693 831 HA PRO 113 HA PRO 113 24.964 -14.633 10.027 832 HB2 PRO 113 HB2 PRO 113 25.290 -17.162 9.093 833 HB3 PRO 113 HB3 PRO 113 23.706 -16.474 9.474 834 HG2 PRO 113 HG2 PRO 113 25.058 -16.763 6.818 835 HG3 PRO 113 HG3 PRO 113 23.366 -17.071 7.252 836 HD2 PRO 113 HD2 PRO 113 24.162 -14.800 6.012 837 HD3 PRO 113 HD3 PRO 113 22.803 -14.838 7.154 838 H TYR 114 H TYR 114 26.766 -16.650 10.217 839 HA TYR 114 HA TYR 114 29.223 -15.447 10.164 840 HB2 TYR 114 HB2 TYR 114 28.834 -18.410 9.728 841 HB3 TYR 114 HB3 TYR 114 30.198 -17.609 10.500 842 HD1 TYR 114 HD2 TYR 114 28.748 -15.706 12.277 843 HD2 TYR 114 HD1 TYR 114 28.022 -19.810 11.420 844 HE1 TYR 114 HE2 TYR 114 27.663 -15.965 14.469 845 HE2 TYR 114 HE1 TYR 114 26.934 -20.080 13.609 846 HH TYR 114 HH TYR 114 26.069 -18.970 15.386 847 H SER 115 H SER 115 30.896 -15.231 8.751 848 HA SER 115 HA SER 115 30.401 -15.052 6.028 849 HB2 SER 115 HB2 SER 115 32.938 -15.044 5.812 850 HB3 SER 115 HB3 SER 115 32.255 -13.849 6.915 851 HG SER 115 HG SER 115 33.157 -14.835 8.556 852 H TYR 116 H TYR 116 30.003 -16.581 4.586 853 HA TYR 116 HA TYR 116 31.265 -19.219 4.944 854 HB2 TYR 116 HB2 TYR 116 28.564 -18.459 3.845 855 HB3 TYR 116 HB3 TYR 116 29.292 -20.029 3.521 856 HD1 TYR 116 HD1 TYR 116 30.461 -20.850 6.003 857 HD2 TYR 116 HD2 TYR 116 26.838 -18.715 5.355 858 HE1 TYR 116 HE1 TYR 116 29.584 -21.700 8.138 859 HE2 TYR 116 HE2 TYR 116 25.952 -19.559 7.489 860 HH TYR 116 HH TYR 116 27.095 -22.104 9.076 861 H SER 117 H SER 117 32.290 -16.834 3.522 862 HA SER 117 HA SER 117 32.212 -17.709 0.730 863 HB2 SER 117 HB2 SER 117 31.847 -15.311 1.203 864 HB3 SER 117 HB3 SER 117 33.444 -15.222 1.945 865 HG SER 117 HG SER 117 32.991 -14.729 -0.492 866 H THR 118 H THR 118 33.650 -19.157 2.874 867 HA THR 118 HA THR 118 36.442 -18.798 2.050 868 HB THR 118 HB THR 118 37.058 -20.173 3.944 869 HG1 THR 118 HG1 THR 118 35.643 -21.403 4.971 870 HG21 THR 118 HG21 THR 118 36.243 -18.779 5.778 871 HG22 THR 118 HG22 THR 118 34.954 -18.158 4.746 872 HG23 THR 118 HG23 THR 118 36.638 -17.792 4.372 873 H THR 119 H THR 119 37.650 -21.057 2.125 874 HA THR 119 HA THR 119 36.522 -22.584 -0.045 875 HB THR 119 HB THR 119 38.632 -23.925 0.137 876 HG1 THR 119 HG1 THR 119 40.257 -22.943 1.544 877 HG21 THR 119 HG21 THR 119 38.378 -21.097 -0.513 878 HG22 THR 119 HG22 THR 119 39.176 -22.393 -1.404 879 HG23 THR 119 HG23 THR 119 40.031 -21.556 -0.109 880 H ALA 120 H ALA 120 36.220 -24.882 -0.016 881 HA ALA 120 HA ALA 120 34.668 -25.824 2.097 882 HB1 ALA 120 HB1 ALA 120 35.611 -26.822 -0.423 883 HB2 ALA 120 HB2 ALA 120 35.693 -28.087 0.803 884 HB3 ALA 120 HB3 ALA 120 34.166 -27.265 0.486 885 H VAL 121 H VAL 121 35.060 -27.024 3.891 886 HA VAL 121 HA VAL 121 36.223 -27.830 5.677 887 HB VAL 121 HB VAL 121 38.058 -28.874 3.517 888 HG11 VAL 121 HG11 VAL 121 38.098 -30.642 5.635 889 HG12 VAL 121 HG12 VAL 121 39.363 -29.483 5.222 890 HG13 VAL 121 HG13 VAL 121 38.134 -29.061 6.415 891 HG21 VAL 121 HG21 VAL 121 35.882 -29.705 3.097 892 HG22 VAL 121 HG22 VAL 121 36.748 -30.998 3.924 893 HG23 VAL 121 HG23 VAL 121 35.588 -30.007 4.809 894 H VAL 122 H VAL 122 36.763 -25.684 6.379 895 HA VAL 122 HA VAL 122 39.470 -24.763 5.758 896 HB VAL 122 HB VAL 122 37.613 -23.126 5.657 897 HG11 VAL 122 HG11 VAL 122 37.476 -23.222 8.647 898 HG12 VAL 122 HG12 VAL 122 36.349 -22.493 7.503 899 HG13 VAL 122 HG13 VAL 122 36.436 -24.248 7.660 900 HG21 VAL 122 HG21 VAL 122 39.455 -22.406 7.917 901 HG22 VAL 122 HG22 VAL 122 40.026 -22.563 6.257 902 HG23 VAL 122 HG23 VAL 122 38.799 -21.361 6.657 903 H THR 123 H THR 123 41.035 -24.414 7.330 904 HA THR 123 HA THR 123 40.497 -25.646 9.955 905 HB THR 123 HB THR 123 41.924 -27.168 8.808 906 HG1 THR 123 HG1 THR 123 42.571 -26.650 10.971 907 HG21 THR 123 HG21 THR 123 44.288 -25.912 8.189 908 HG22 THR 123 HG22 THR 123 43.080 -24.724 7.702 909 HG23 THR 123 HG23 THR 123 43.031 -26.355 7.036 910 H ASN 124 H ASN 124 39.952 -23.294 10.375 911 HA ASN 124 HA ASN 124 42.398 -21.782 11.010 912 HB2 ASN 124 HB2 ASN 124 39.732 -20.944 9.997 913 HB3 ASN 124 HB3 ASN 124 40.523 -19.871 11.147 914 HD21 ASN 124 HD21 ASN 124 39.923 -19.674 8.224 915 HD22 ASN 124 HD22 ASN 124 41.436 -19.263 7.495 916 HA PRO 125 HA PRO 125 41.461 -21.867 15.296 917 HB2 PRO 125 HB2 PRO 125 42.133 -19.361 16.095 918 HB3 PRO 125 HB3 PRO 125 43.331 -20.577 15.636 919 HG2 PRO 125 HG2 PRO 125 42.221 -18.310 14.027 920 HG3 PRO 125 HG3 PRO 125 43.898 -18.872 14.159 921 HD2 PRO 125 HD2 PRO 125 42.311 -19.503 12.058 922 HD3 PRO 125 HD3 PRO 125 43.570 -20.597 12.666 923 H LYS 126 H LYS 126 40.318 -20.555 17.082 924 HA LYS 126 HA LYS 126 37.627 -20.320 16.510 925 HB2 LYS 126 HB2 LYS 126 37.347 -19.415 18.681 926 HB3 LYS 126 HB3 LYS 126 38.729 -20.497 18.788 927 HG2 LYS 126 HG2 LYS 126 38.992 -17.529 18.393 928 HG3 LYS 126 HG3 LYS 126 38.966 -18.303 19.980 929 HD2 LYS 126 HD2 LYS 126 40.846 -19.802 18.841 930 HD3 LYS 126 HD3 LYS 126 41.058 -18.343 17.870 931 HE2 LYS 126 HE2 LYS 126 41.039 -18.380 20.885 932 HE3 LYS 126 HE3 LYS 126 42.504 -18.462 19.907 933 HZ1 LYS 126 HZ1 LYS 126 41.777 -16.321 18.884 934 HZ2 LYS 126 HZ2 LYS 126 42.187 -16.214 20.521 935 HZ3 LYS 126 HZ3 LYS 126 40.560 -16.229 20.057 936 H GLU 127 H GLU 127 40.163 -17.957 16.167 937 HA GLU 127 HA GLU 127 38.312 -15.766 15.754 938 HB2 GLU 127 HB2 GLU 127 41.287 -16.050 15.839 939 HB3 GLU 127 HB3 GLU 127 40.591 -14.645 15.046 940 HG2 GLU 127 HG2 GLU 127 39.842 -15.430 17.841 941 HG3 GLU 127 HG3 GLU 127 41.233 -14.408 17.488 Start of MODEL 4 1 H1 GLY 1 H GLY 1 1.150 7.354 7.919 2 HA2 GLY 1 HA2 GLY 1 -0.856 6.329 9.824 3 HA3 GLY 1 HA3 GLY 1 -0.986 7.956 9.174 4 HA PRO 2 HA PRO 2 -3.198 4.773 6.464 5 HB2 PRO 2 HB2 PRO 2 -5.730 5.634 6.927 6 HB3 PRO 2 HB3 PRO 2 -4.944 4.390 7.906 7 HG2 PRO 2 HG2 PRO 2 -5.289 7.309 8.472 8 HG3 PRO 2 HG3 PRO 2 -5.489 5.927 9.565 9 HD2 PRO 2 HD2 PRO 2 -3.261 7.465 9.555 10 HD3 PRO 2 HD3 PRO 2 -3.223 5.730 9.935 11 H THR 3 H THR 3 -2.944 8.145 6.854 12 HA THR 3 HA THR 3 -3.873 8.560 4.088 13 HB THR 3 HB THR 3 -4.553 10.841 4.696 14 HG1 THR 3 HG1 THR 3 -3.433 11.418 6.465 15 HG21 THR 3 HG21 THR 3 -5.905 9.013 6.654 16 HG22 THR 3 HG22 THR 3 -6.074 8.760 4.916 17 HG23 THR 3 HG23 THR 3 -6.607 10.275 5.643 18 H GLY 4 H GLY 4 -2.662 9.938 2.791 19 HA2 GLY 4 HA2 GLY 4 -0.895 11.748 2.875 20 HA3 GLY 4 HA3 GLY 4 -0.005 10.618 3.885 21 H THR 5 H THR 5 1.261 11.538 1.717 22 HA THR 5 HA THR 5 0.902 10.222 -0.708 23 HB THR 5 HB THR 5 3.235 10.732 -1.202 24 HG1 THR 5 HG1 THR 5 3.537 11.662 1.459 25 HG21 THR 5 HG21 THR 5 2.932 13.209 0.103 26 HG22 THR 5 HG22 THR 5 1.305 12.634 -0.262 27 HG23 THR 5 HG23 THR 5 2.491 12.802 -1.554 28 H GLY 6 H GLY 6 0.548 8.058 -0.704 29 HA2 GLY 6 HA2 GLY 6 2.527 6.353 0.662 30 HA3 GLY 6 HA3 GLY 6 0.890 5.862 0.252 31 H GLU 7 H GLU 7 2.702 7.654 -2.080 32 HA GLU 7 HA GLU 7 3.283 5.173 -3.553 33 HB2 GLU 7 HB2 GLU 7 1.243 6.508 -4.362 34 HB3 GLU 7 HB3 GLU 7 2.402 7.711 -4.910 35 HG2 GLU 7 HG2 GLU 7 3.399 6.174 -6.427 36 HG3 GLU 7 HG3 GLU 7 2.481 4.828 -5.756 37 H SER 8 H SER 8 4.929 7.021 -1.881 38 HA SER 8 HA SER 8 7.211 7.109 -3.588 39 HB2 SER 8 HB2 SER 8 5.670 9.612 -3.087 40 HB3 SER 8 HB3 SER 8 7.430 9.711 -3.049 41 HG SER 8 HG SER 8 7.516 9.318 -5.139 42 H LYS 9 H LYS 9 9.025 8.452 -2.380 43 HA LYS 9 HA LYS 9 8.790 8.534 0.479 44 HB2 LYS 9 HB2 LYS 9 10.615 6.845 0.855 45 HB3 LYS 9 HB3 LYS 9 9.077 6.169 0.332 46 HG2 LYS 9 HG2 LYS 9 11.074 6.813 -1.761 47 HG3 LYS 9 HG3 LYS 9 11.386 5.421 -0.723 48 HD2 LYS 9 HD2 LYS 9 9.941 4.204 -1.894 49 HD3 LYS 9 HD3 LYS 9 8.655 5.357 -1.532 50 HE2 LYS 9 HE2 LYS 9 8.614 5.682 -3.752 51 HE3 LYS 9 HE3 LYS 9 10.038 6.680 -3.465 52 HZ1 LYS 9 HZ1 LYS 9 11.040 4.160 -3.668 53 HZ2 LYS 9 HZ2 LYS 9 11.055 5.329 -4.890 54 HZ3 LYS 9 HZ3 LYS 9 9.817 4.177 -4.838 55 H CYS 10 H CYS 10 11.029 8.960 1.476 56 HA CYS 10 HA CYS 10 12.104 11.266 0.405 57 HB2 CYS 10 HB2 CYS 10 13.023 9.295 2.443 58 HB3 CYS 10 HB3 CYS 10 14.191 10.475 1.860 59 HG CYS 10 HG CYS 10 11.707 12.326 2.462 60 HA PRO 11 HA PRO 11 14.911 10.167 -2.780 61 HB2 PRO 11 HB2 PRO 11 16.996 11.848 -2.333 62 HB3 PRO 11 HB3 PRO 11 15.436 12.397 -2.958 63 HG2 PRO 11 HG2 PRO 11 16.501 12.504 -0.162 64 HG3 PRO 11 HG3 PRO 11 15.613 13.742 -1.069 65 HD2 PRO 11 HD2 PRO 11 14.424 12.153 0.773 66 HD3 PRO 11 HD3 PRO 11 13.570 12.754 -0.664 67 H LEU 12 H LEU 12 15.979 9.970 0.517 68 HA LEU 12 HA LEU 12 17.771 7.786 -0.205 69 HB2 LEU 12 HB2 LEU 12 19.085 9.933 -0.082 70 HB3 LEU 12 HB3 LEU 12 18.676 9.993 1.631 71 HG LEU 12 HG LEU 12 20.970 9.116 1.069 72 HD11 LEU 12 HD11 LEU 12 20.914 8.094 3.045 73 HD12 LEU 12 HD12 LEU 12 19.803 6.855 2.461 74 HD13 LEU 12 HD13 LEU 12 19.176 8.397 3.044 75 HD21 LEU 12 HD21 LEU 12 21.290 7.098 0.021 76 HD22 LEU 12 HD22 LEU 12 19.904 7.719 -0.875 77 HD23 LEU 12 HD23 LEU 12 19.668 6.519 0.397 78 H MET 13 H MET 13 17.183 6.112 0.991 79 HA MET 13 HA MET 13 16.474 6.564 3.807 80 HB2 MET 13 HB2 MET 13 14.659 4.946 3.649 81 HB3 MET 13 HB3 MET 13 14.398 6.271 2.522 82 HG2 MET 13 HG2 MET 13 14.591 4.952 0.709 83 HG3 MET 13 HG3 MET 13 15.827 3.935 1.446 84 HE1 MET 13 HE1 MET 13 14.122 1.261 3.297 85 HE2 MET 13 HE2 MET 13 15.449 2.424 3.292 86 HE3 MET 13 HE3 MET 13 14.003 2.739 4.253 87 H VAL 14 H VAL 14 16.965 4.864 5.226 88 HA VAL 14 HA VAL 14 18.975 3.000 4.179 89 HB VAL 14 HB VAL 14 18.409 3.863 7.018 90 HG11 VAL 14 HG11 VAL 14 20.432 1.941 5.889 91 HG12 VAL 14 HG12 VAL 14 20.574 2.666 7.491 92 HG13 VAL 14 HG13 VAL 14 19.201 1.626 7.111 93 HG21 VAL 14 HG21 VAL 14 21.035 4.386 5.832 94 HG22 VAL 14 HG22 VAL 14 19.707 5.260 5.067 95 HG23 VAL 14 HG23 VAL 14 19.996 5.434 6.799 96 H LYS 15 H LYS 15 18.800 0.818 4.397 97 HA LYS 15 HA LYS 15 16.433 -0.242 5.778 98 HB2 LYS 15 HB2 LYS 15 15.804 -0.222 3.469 99 HB3 LYS 15 HB3 LYS 15 17.352 -0.897 2.979 100 HG2 LYS 15 HG2 LYS 15 15.683 -2.605 2.847 101 HG3 LYS 15 HG3 LYS 15 16.774 -2.982 4.183 102 HD2 LYS 15 HD2 LYS 15 14.446 -1.359 4.928 103 HD3 LYS 15 HD3 LYS 15 14.054 -2.978 4.344 104 HE2 LYS 15 HE2 LYS 15 16.105 -3.544 6.003 105 HE3 LYS 15 HE3 LYS 15 15.436 -2.124 6.808 106 HZ1 LYS 15 HZ1 LYS 15 13.211 -3.457 6.364 107 HZ2 LYS 15 HZ2 LYS 15 14.148 -3.708 7.749 108 HZ3 LYS 15 HZ3 LYS 15 14.271 -4.773 6.440 109 H VAL 16 H VAL 16 17.242 -1.416 7.390 110 HA VAL 16 HA VAL 16 19.450 -3.272 6.783 111 HB VAL 16 HB VAL 16 18.967 -1.823 9.390 112 HG11 VAL 16 HG11 VAL 16 19.795 -4.087 9.752 113 HG12 VAL 16 HG12 VAL 16 21.122 -3.790 8.627 114 HG13 VAL 16 HG13 VAL 16 21.033 -2.894 10.144 115 HG21 VAL 16 HG21 VAL 16 21.205 -0.825 8.895 116 HG22 VAL 16 HG22 VAL 16 21.101 -1.529 7.281 117 HG23 VAL 16 HG23 VAL 16 19.923 -0.320 7.793 118 H LEU 17 H LEU 17 18.889 -5.330 6.974 119 HA LEU 17 HA LEU 17 16.970 -6.111 9.045 120 HB2 LEU 17 HB2 LEU 17 15.566 -7.266 7.625 121 HB3 LEU 17 HB3 LEU 17 15.935 -5.812 6.701 122 HG LEU 17 HG LEU 17 17.855 -7.554 5.823 123 HD11 LEU 17 HD11 LEU 17 15.564 -9.097 6.837 124 HD12 LEU 17 HD12 LEU 17 17.230 -9.591 6.545 125 HD13 LEU 17 HD13 LEU 17 16.093 -9.495 5.202 126 HD21 LEU 17 HD21 LEU 17 16.796 -7.374 3.787 127 HD22 LEU 17 HD22 LEU 17 16.113 -6.000 4.657 128 HD23 LEU 17 HD23 LEU 17 15.184 -7.491 4.492 129 H ASP 18 H ASP 18 17.159 -8.270 9.755 130 HA ASP 18 HA ASP 18 19.825 -9.337 9.503 131 HB2 ASP 18 HB2 ASP 18 17.821 -9.408 11.461 132 HB3 ASP 18 HB3 ASP 18 17.984 -11.071 10.909 133 H ALA 19 H ALA 19 20.466 -10.857 8.131 134 HA ALA 19 HA ALA 19 18.575 -12.083 6.337 135 HB1 ALA 19 HB1 ALA 19 20.359 -11.920 5.022 136 HB2 ALA 19 HB2 ALA 19 21.421 -11.613 6.397 137 HB3 ALA 19 HB3 ALA 19 21.058 -13.270 5.915 138 H VAL 20 H VAL 20 19.440 -12.796 9.408 139 HA VAL 20 HA VAL 20 19.734 -15.659 9.156 140 HB VAL 20 HB VAL 20 19.325 -13.952 11.616 141 HG11 VAL 20 HG11 VAL 20 19.494 -16.855 11.201 142 HG12 VAL 20 HG12 VAL 20 20.542 -16.219 12.471 143 HG13 VAL 20 HG13 VAL 20 18.802 -15.935 12.537 144 HG21 VAL 20 HG21 VAL 20 21.811 -14.642 11.898 145 HG22 VAL 20 HG22 VAL 20 21.752 -14.916 10.157 146 HG23 VAL 20 HG23 VAL 20 21.401 -13.317 10.809 147 H ARG 21 H ARG 21 17.215 -13.380 10.127 148 HA ARG 21 HA ARG 21 15.299 -15.620 10.157 149 HB2 ARG 21 HB2 ARG 21 14.854 -12.997 11.561 150 HB3 ARG 21 HB3 ARG 21 14.031 -14.529 11.818 151 HG2 ARG 21 HG2 ARG 21 15.378 -14.681 13.599 152 HG3 ARG 21 HG3 ARG 21 16.578 -15.215 12.420 153 HD2 ARG 21 HD2 ARG 21 17.848 -13.521 13.110 154 HD3 ARG 21 HD3 ARG 21 16.700 -12.448 12.310 155 HE ARG 21 HE ARG 21 16.031 -11.740 14.367 156 HH11 ARG 21 HH11 ARG 21 17.532 -14.863 14.710 157 HH12 ARG 21 HH12 ARG 21 17.431 -14.867 16.440 158 HH21 ARG 21 HH21 ARG 21 15.893 -11.733 16.645 159 HH22 ARG 21 HH22 ARG 21 16.498 -13.086 17.539 160 H GLY 22 H GLY 22 16.127 -12.541 8.834 161 HA2 GLY 22 HA2 GLY 22 15.295 -11.746 6.774 162 HA3 GLY 22 HA3 GLY 22 13.876 -12.762 6.981 163 H SER 23 H SER 23 14.543 -11.157 9.835 164 HA SER 23 HA SER 23 12.387 -9.250 9.300 165 HB2 SER 23 HB2 SER 23 13.018 -9.086 12.007 166 HB3 SER 23 HB3 SER 23 11.692 -10.009 11.299 167 HG SER 23 HG SER 23 12.899 -11.418 12.510 168 HA PRO 24 HA PRO 24 14.904 -5.662 9.444 169 HB2 PRO 24 HB2 PRO 24 13.424 -3.944 10.937 170 HB3 PRO 24 HB3 PRO 24 12.982 -4.412 9.291 171 HG2 PRO 24 HG2 PRO 24 11.943 -5.449 11.900 172 HG3 PRO 24 HG3 PRO 24 11.050 -5.039 10.424 173 HD2 PRO 24 HD2 PRO 24 11.679 -7.589 11.083 174 HD3 PRO 24 HD3 PRO 24 11.574 -7.035 9.400 175 H ALA 25 H ALA 25 16.404 -4.525 10.673 176 HA ALA 25 HA ALA 25 16.896 -5.635 13.335 177 HB1 ALA 25 HB1 ALA 25 19.139 -4.663 13.103 178 HB2 ALA 25 HB2 ALA 25 18.741 -5.737 11.761 179 HB3 ALA 25 HB3 ALA 25 18.676 -3.988 11.541 180 H ILE 26 H ILE 26 16.852 -4.456 15.172 181 HA ILE 26 HA ILE 26 15.969 -1.662 14.931 182 HB ILE 26 HB ILE 26 15.392 -3.820 16.878 183 HG12 ILE 26 HG12 ILE 26 13.878 -2.700 15.051 184 HG13 ILE 26 HG13 ILE 26 13.199 -3.123 16.620 185 HG21 ILE 26 HG21 ILE 26 14.719 -2.056 18.569 186 HG22 ILE 26 HG22 ILE 26 16.445 -2.371 18.409 187 HG23 ILE 26 HG23 ILE 26 15.738 -0.940 17.662 188 HD11 ILE 26 HD11 ILE 26 14.174 -0.389 15.825 189 HD12 ILE 26 HD12 ILE 26 12.490 -0.911 15.862 190 HD13 ILE 26 HD13 ILE 26 13.420 -0.829 17.358 191 H ASN 27 H ASN 27 17.050 -0.020 15.918 192 HA ASN 27 HA ASN 27 18.757 1.119 16.898 193 HB2 ASN 27 HB2 ASN 27 19.257 -1.422 18.463 194 HB3 ASN 27 HB3 ASN 27 19.769 0.207 18.898 195 HD21 ASN 27 HD21 ASN 27 17.385 1.545 18.200 196 HD22 ASN 27 HD22 ASN 27 16.171 1.095 19.345 197 H VAL 28 H VAL 28 19.502 0.530 14.534 198 HA VAL 28 HA VAL 28 22.111 -0.830 14.713 199 HB VAL 28 HB VAL 28 20.377 -0.413 12.275 200 HG11 VAL 28 HG11 VAL 28 22.343 -0.545 11.201 201 HG12 VAL 28 HG12 VAL 28 23.187 -1.171 12.618 202 HG13 VAL 28 HG13 VAL 28 22.256 -2.262 11.592 203 HG21 VAL 28 HG21 VAL 28 20.357 -2.426 14.290 204 HG22 VAL 28 HG22 VAL 28 19.368 -2.311 12.835 205 HG23 VAL 28 HG23 VAL 28 20.922 -3.143 12.781 206 H ALA 29 H ALA 29 23.686 0.620 14.926 207 HA ALA 29 HA ALA 29 23.553 3.332 14.323 208 HB1 ALA 29 HB1 ALA 29 26.237 2.726 14.100 209 HB2 ALA 29 HB2 ALA 29 25.379 3.138 15.585 210 HB3 ALA 29 HB3 ALA 29 25.605 1.448 15.138 211 H VAL 30 H VAL 30 23.689 4.471 12.499 212 HA VAL 30 HA VAL 30 24.972 3.276 10.148 213 HB VAL 30 HB VAL 30 22.250 4.587 10.084 214 HG11 VAL 30 HG11 VAL 30 24.224 4.347 8.082 215 HG12 VAL 30 HG12 VAL 30 22.943 3.197 7.690 216 HG13 VAL 30 HG13 VAL 30 22.559 4.905 7.910 217 HG21 VAL 30 HG21 VAL 30 21.929 2.100 9.040 218 HG22 VAL 30 HG22 VAL 30 23.125 1.792 10.298 219 HG23 VAL 30 HG23 VAL 30 21.580 2.534 10.713 220 H HIS 31 H HIS 31 26.249 4.658 9.085 221 HA HIS 31 HA HIS 31 25.894 7.542 9.568 222 HB2 HIS 31 HB2 HIS 31 28.589 6.235 9.228 223 HB3 HIS 31 HB3 HIS 31 28.236 7.864 9.795 224 HD1 HIS 31 HD1 HIS 31 27.928 4.264 10.923 225 HD2 HIS 31 HD2 HIS 31 27.967 8.106 12.505 226 HE1 HIS 31 HE1 HIS 31 27.989 3.962 13.418 227 H VAL 32 H VAL 32 25.527 8.619 7.755 228 HA VAL 32 HA VAL 32 26.321 7.417 5.200 229 HB VAL 32 HB VAL 32 24.453 9.750 5.618 230 HG11 VAL 32 HG11 VAL 32 25.519 8.352 3.302 231 HG12 VAL 32 HG12 VAL 32 23.755 8.413 3.310 232 HG13 VAL 32 HG13 VAL 32 24.692 9.906 3.404 233 HG21 VAL 32 HG21 VAL 32 23.718 6.850 5.238 234 HG22 VAL 32 HG22 VAL 32 23.643 7.713 6.774 235 HG23 VAL 32 HG23 VAL 32 22.608 8.206 5.432 236 H PHE 33 H PHE 33 27.880 8.273 3.984 237 HA PHE 33 HA PHE 33 28.807 10.997 4.617 238 HB2 PHE 33 HB2 PHE 33 30.402 8.506 4.049 239 HB3 PHE 33 HB3 PHE 33 31.092 10.111 3.832 240 HD1 PHE 33 HD1 PHE 33 29.369 8.000 6.365 241 HD2 PHE 33 HD2 PHE 33 32.101 11.176 5.616 242 HE1 PHE 33 HE1 PHE 33 29.932 8.074 8.757 243 HE2 PHE 33 HE2 PHE 33 32.669 11.256 8.010 244 HZ PHE 33 HZ PHE 33 31.583 9.704 9.583 245 H ARG 34 H ARG 34 29.986 12.052 2.816 246 HA ARG 34 HA ARG 34 29.017 11.151 0.186 247 HB2 ARG 34 HB2 ARG 34 27.645 13.029 0.986 248 HB3 ARG 34 HB3 ARG 34 29.098 14.000 1.195 249 HG2 ARG 34 HG2 ARG 34 28.681 12.859 -1.491 250 HG3 ARG 34 HG3 ARG 34 27.540 14.105 -0.982 251 HD2 ARG 34 HD2 ARG 34 29.535 15.513 -0.358 252 HD3 ARG 34 HD3 ARG 34 30.538 14.308 -1.165 253 HE ARG 34 HE ARG 34 28.999 16.345 -2.408 254 HH11 ARG 34 HH11 ARG 34 30.076 13.058 -2.799 255 HH12 ARG 34 HH12 ARG 34 30.007 13.104 -4.530 256 HH21 ARG 34 HH21 ARG 34 28.904 16.418 -4.686 257 HH22 ARG 34 HH22 ARG 34 29.341 15.017 -5.602 258 H LYS 35 H LYS 35 30.391 11.432 -1.539 259 HA LYS 35 HA LYS 35 33.149 11.450 -1.035 260 HB2 LYS 35 HB2 LYS 35 32.537 10.356 -2.998 261 HB3 LYS 35 HB3 LYS 35 31.478 11.662 -3.514 262 HG2 LYS 35 HG2 LYS 35 33.445 11.559 -4.916 263 HG3 LYS 35 HG3 LYS 35 33.438 13.057 -3.981 264 HD2 LYS 35 HD2 LYS 35 35.656 12.199 -3.914 265 HD3 LYS 35 HD3 LYS 35 34.941 11.911 -2.325 266 HE2 LYS 35 HE2 LYS 35 35.711 9.820 -2.612 267 HE3 LYS 35 HE3 LYS 35 34.279 9.621 -3.620 268 HZ1 LYS 35 HZ1 LYS 35 35.507 9.856 -5.553 269 HZ2 LYS 35 HZ2 LYS 35 36.541 8.947 -4.571 270 HZ3 LYS 35 HZ3 LYS 35 36.809 10.605 -4.773 271 H ALA 36 H ALA 36 34.192 13.156 -0.228 272 HA ALA 36 HA ALA 36 33.402 15.852 -0.658 273 HB1 ALA 36 HB1 ALA 36 34.915 16.368 0.929 274 HB2 ALA 36 HB2 ALA 36 34.921 14.625 1.205 275 HB3 ALA 36 HB3 ALA 36 36.173 15.364 0.207 276 H ALA 37 H ALA 37 34.633 17.519 -1.710 277 HA ALA 37 HA ALA 37 35.355 16.908 -4.345 278 HB1 ALA 37 HB1 ALA 37 36.494 19.300 -4.077 279 HB2 ALA 37 HB2 ALA 37 34.747 19.090 -4.201 280 HB3 ALA 37 HB3 ALA 37 35.498 19.310 -2.621 281 H ASP 38 H ASP 38 37.154 16.722 -1.439 282 HA ASP 38 HA ASP 38 39.721 16.766 -2.834 283 HB2 ASP 38 HB2 ASP 38 38.903 17.524 -0.252 284 HB3 ASP 38 HB3 ASP 38 39.914 16.098 -0.032 285 H ASP 39 H ASP 39 37.532 14.598 -2.882 286 HA ASP 39 HA ASP 39 37.474 12.337 -3.134 287 HB2 ASP 39 HB2 ASP 39 40.442 12.163 -2.746 288 HB3 ASP 39 HB3 ASP 39 39.404 11.232 -3.822 289 H THR 40 H THR 40 37.013 13.364 -0.595 290 HA THR 40 HA THR 40 38.106 11.222 1.108 291 HB THR 40 HB THR 40 38.239 12.653 2.983 292 HG1 THR 40 HG1 THR 40 37.438 14.819 2.887 293 HG21 THR 40 HG21 THR 40 39.721 14.475 2.243 294 HG22 THR 40 HG22 THR 40 39.202 14.208 0.579 295 HG23 THR 40 HG23 THR 40 40.097 12.953 1.436 296 H TRP 41 H TRP 41 36.650 11.270 3.271 297 HA TRP 41 HA TRP 41 33.891 10.922 2.313 298 HB2 TRP 41 HB2 TRP 41 35.442 9.595 4.532 299 HB3 TRP 41 HB3 TRP 41 33.688 9.482 4.418 300 HD1 TRP 41 HD1 TRP 41 36.055 9.276 1.384 301 HE1 TRP 41 HE1 TRP 41 35.781 6.955 0.305 302 HE3 TRP 41 HE3 TRP 41 32.935 7.143 4.826 303 HZ2 TRP 41 HZ2 TRP 41 34.422 4.541 0.841 304 HZ3 TRP 41 HZ3 TRP 41 32.193 4.824 4.468 305 HH2 TRP 41 HH2 TRP 41 32.923 3.551 2.517 306 H GLU 42 H GLU 42 32.732 12.693 2.745 307 HA GLU 42 HA GLU 42 33.166 14.113 5.269 308 HB2 GLU 42 HB2 GLU 42 31.752 14.838 2.712 309 HB3 GLU 42 HB3 GLU 42 31.541 15.778 4.183 310 HG2 GLU 42 HG2 GLU 42 34.303 15.220 3.244 311 HG3 GLU 42 HG3 GLU 42 33.343 16.422 2.384 312 HA PRO 43 HA PRO 43 29.534 12.541 7.174 313 HB2 PRO 43 HB2 PRO 43 28.839 14.651 8.734 314 HB3 PRO 43 HB3 PRO 43 30.229 13.616 9.082 315 HG2 PRO 43 HG2 PRO 43 30.151 16.299 7.757 316 HG3 PRO 43 HG3 PRO 43 31.282 15.685 8.977 317 HD2 PRO 43 HD2 PRO 43 31.895 15.785 6.341 318 HD3 PRO 43 HD3 PRO 43 32.528 14.527 7.422 319 H PHE 44 H PHE 44 27.689 12.245 6.099 320 HA PHE 44 HA PHE 44 26.311 14.584 4.969 321 HB2 PHE 44 HB2 PHE 44 26.946 12.794 3.373 322 HB3 PHE 44 HB3 PHE 44 25.951 11.660 4.281 323 HD1 PHE 44 HD2 PHE 44 23.502 11.902 4.298 324 HD2 PHE 44 HD1 PHE 44 25.983 14.355 1.862 325 HE1 PHE 44 HE2 PHE 44 21.543 12.540 2.953 326 HE2 PHE 44 HE1 PHE 44 24.029 14.999 0.513 327 HZ PHE 44 HZ PHE 44 21.805 14.091 1.058 328 H ALA 45 H ALA 45 25.822 11.657 6.885 329 HA ALA 45 HA ALA 45 23.809 12.863 8.477 330 HB1 ALA 45 HB1 ALA 45 22.784 10.701 6.648 331 HB2 ALA 45 HB2 ALA 45 21.865 11.671 7.799 332 HB3 ALA 45 HB3 ALA 45 22.542 12.424 6.356 333 H SER 46 H SER 46 22.628 11.035 9.797 334 HA SER 46 HA SER 46 23.927 8.542 10.115 335 HB2 SER 46 HB2 SER 46 25.753 9.276 11.237 336 HB3 SER 46 HB3 SER 46 25.016 10.835 11.607 337 HG SER 46 HG SER 46 24.514 10.097 13.500 338 H GLY 47 H GLY 47 23.107 7.331 11.982 339 HA2 GLY 47 HA2 GLY 47 21.295 8.120 13.864 340 HA3 GLY 47 HA3 GLY 47 20.326 7.919 12.411 341 H LYS 48 H LYS 48 19.242 6.279 13.754 342 HA LYS 48 HA LYS 48 20.634 3.696 13.525 343 HB2 LYS 48 HB2 LYS 48 19.304 4.913 15.876 344 HB3 LYS 48 HB3 LYS 48 18.977 3.208 15.598 345 HG2 LYS 48 HG2 LYS 48 21.381 2.749 15.612 346 HG3 LYS 48 HG3 LYS 48 21.698 4.460 15.912 347 HD2 LYS 48 HD2 LYS 48 20.062 2.683 17.720 348 HD3 LYS 48 HD3 LYS 48 21.772 3.049 17.961 349 HE2 LYS 48 HE2 LYS 48 20.676 5.538 17.645 350 HE3 LYS 48 HE3 LYS 48 19.402 4.675 18.504 351 HZ1 LYS 48 HZ1 LYS 48 21.233 3.955 20.078 352 HZ2 LYS 48 HZ2 LYS 48 20.757 5.575 20.159 353 HZ3 LYS 48 HZ3 LYS 48 22.190 5.154 19.365 354 H THR 49 H THR 49 19.516 2.117 12.543 355 HA THR 49 HA THR 49 17.208 2.646 11.076 356 HB THR 49 HB THR 49 17.100 0.296 10.574 357 HG1 THR 49 HG1 THR 49 18.348 0.080 13.043 358 HG21 THR 49 HG21 THR 49 19.774 -0.083 10.412 359 HG22 THR 49 HG22 THR 49 19.712 1.662 10.664 360 HG23 THR 49 HG23 THR 49 18.856 0.936 9.303 361 H SER 50 H SER 50 15.169 1.233 11.261 362 HA SER 50 HA SER 50 14.289 1.121 14.070 363 HB2 SER 50 HB2 SER 50 13.426 3.127 12.730 364 HB3 SER 50 HB3 SER 50 12.480 1.959 11.806 365 HG SER 50 HG SER 50 11.124 2.449 13.397 366 H GLU 51 H GLU 51 12.081 -0.093 14.170 367 HA GLU 51 HA GLU 51 12.560 -2.738 13.262 368 HB2 GLU 51 HB2 GLU 51 10.218 -3.144 14.164 369 HB3 GLU 51 HB3 GLU 51 11.401 -2.527 15.309 370 HG2 GLU 51 HG2 GLU 51 10.110 -0.798 15.769 371 HG3 GLU 51 HG3 GLU 51 10.080 -0.327 14.072 372 H SER 52 H SER 52 11.306 -0.071 11.692 373 HA SER 52 HA SER 52 9.605 -1.670 9.915 374 HB2 SER 52 HB2 SER 52 8.764 0.507 10.927 375 HB3 SER 52 HB3 SER 52 9.924 1.334 9.888 376 HG SER 52 HG SER 52 7.609 0.895 9.147 377 H GLY 53 H GLY 53 12.743 -0.981 10.125 378 HA2 GLY 53 HA2 GLY 53 14.461 -1.108 8.601 379 HA3 GLY 53 HA3 GLY 53 13.264 -1.519 7.383 380 H GLU 54 H GLU 54 12.823 1.408 9.147 381 HA GLU 54 HA GLU 54 13.948 2.961 6.916 382 HB2 GLU 54 HB2 GLU 54 12.027 4.446 6.941 383 HB3 GLU 54 HB3 GLU 54 11.500 2.793 6.654 384 HG2 GLU 54 HG2 GLU 54 11.223 2.837 9.294 385 HG3 GLU 54 HG3 GLU 54 11.028 4.561 8.977 386 H LEU 55 H LEU 55 15.207 4.609 7.515 387 HA LEU 55 HA LEU 55 15.385 5.231 10.371 388 HB2 LEU 55 HB2 LEU 55 17.297 4.800 8.386 389 HB3 LEU 55 HB3 LEU 55 17.352 6.532 8.705 390 HG LEU 55 HG LEU 55 17.461 4.626 11.000 391 HD11 LEU 55 HD11 LEU 55 19.577 5.058 8.952 392 HD12 LEU 55 HD12 LEU 55 19.166 3.606 9.866 393 HD13 LEU 55 HD13 LEU 55 20.046 4.920 10.647 394 HD21 LEU 55 HD21 LEU 55 17.796 6.527 12.088 395 HD22 LEU 55 HD22 LEU 55 17.740 7.427 10.573 396 HD23 LEU 55 HD23 LEU 55 19.275 6.790 11.164 397 H HIS 56 H HIS 56 15.851 7.527 10.948 398 HA HIS 56 HA HIS 56 13.771 9.208 10.209 399 HB2 HIS 56 HB2 HIS 56 16.428 9.717 11.519 400 HB3 HIS 56 HB3 HIS 56 15.326 11.046 11.172 401 HD1 HIS 56 HD1 HIS 56 14.829 7.607 12.747 402 HD2 HIS 56 HD2 HIS 56 13.962 11.614 13.421 403 HE1 HIS 56 HE1 HIS 56 13.521 7.660 14.893 404 H GLY 57 H GLY 57 14.418 11.619 9.460 405 HA2 GLY 57 HA2 GLY 57 15.049 11.341 6.681 406 HA3 GLY 57 HA3 GLY 57 14.689 12.841 7.522 407 H LEU 58 H LEU 58 17.266 10.394 7.280 408 HA LEU 58 HA LEU 58 19.346 11.962 8.265 409 HB2 LEU 58 HB2 LEU 58 19.082 9.501 6.707 410 HB3 LEU 58 HB3 LEU 58 20.573 10.386 6.389 411 HG LEU 58 HG LEU 58 20.831 10.382 8.972 412 HD11 LEU 58 HD11 LEU 58 19.813 8.508 10.096 413 HD12 LEU 58 HD12 LEU 58 18.996 8.017 8.612 414 HD13 LEU 58 HD13 LEU 58 18.554 9.530 9.404 415 HD21 LEU 58 HD21 LEU 58 22.477 9.208 7.924 416 HD22 LEU 58 HD22 LEU 58 21.343 8.219 7.003 417 HD23 LEU 58 HD23 LEU 58 21.636 7.871 8.708 418 H THR 59 H THR 59 17.809 11.947 5.147 419 HA THR 59 HA THR 59 19.710 13.097 3.517 420 HB THR 59 HB THR 59 17.933 13.928 2.138 421 HG1 THR 59 HG1 THR 59 16.094 14.605 2.957 422 HG21 THR 59 HG21 THR 59 16.355 11.685 3.073 423 HG22 THR 59 HG22 THR 59 18.074 11.295 3.029 424 HG23 THR 59 HG23 THR 59 17.264 11.873 1.573 425 H THR 60 H THR 60 20.021 15.302 2.816 426 HA THR 60 HA THR 60 19.138 17.423 4.591 427 HB THR 60 HB THR 60 21.500 18.258 4.887 428 HG1 THR 60 HG1 THR 60 23.168 16.928 4.407 429 HG21 THR 60 HG21 THR 60 22.008 16.731 6.757 430 HG22 THR 60 HG22 THR 60 20.784 15.612 6.156 431 HG23 THR 60 HG23 THR 60 20.312 17.211 6.730 432 H GLU 61 H GLU 61 20.486 19.532 3.823 433 HA GLU 61 HA GLU 61 19.557 20.108 1.246 434 HB2 GLU 61 HB2 GLU 61 21.006 22.158 1.441 435 HB3 GLU 61 HB3 GLU 61 19.882 21.910 2.770 436 HG2 GLU 61 HG2 GLU 61 21.607 21.170 4.212 437 HG3 GLU 61 HG3 GLU 61 22.759 21.054 2.882 438 H GLU 62 H GLU 62 22.402 18.524 2.286 439 HA GLU 62 HA GLU 62 23.973 19.125 -0.052 440 HB2 GLU 62 HB2 GLU 62 24.319 17.252 2.277 441 HB3 GLU 62 HB3 GLU 62 25.411 17.212 0.902 442 HG2 GLU 62 HG2 GLU 62 26.043 19.511 1.290 443 HG3 GLU 62 HG3 GLU 62 24.879 19.633 2.608 444 H GLU 63 H GLU 63 21.300 17.293 0.376 445 HA GLU 63 HA GLU 63 21.949 14.872 -0.932 446 HB2 GLU 63 HB2 GLU 63 19.612 14.466 -1.041 447 HB3 GLU 63 HB3 GLU 63 19.894 15.330 0.464 448 HG2 GLU 63 HG2 GLU 63 19.143 17.401 -0.566 449 HG3 GLU 63 HG3 GLU 63 18.894 16.560 -2.095 450 H PHE 64 H PHE 64 21.619 18.046 -2.081 451 HA PHE 64 HA PHE 64 20.854 17.286 -4.774 452 HB2 PHE 64 HB2 PHE 64 21.436 19.895 -3.404 453 HB3 PHE 64 HB3 PHE 64 21.359 19.809 -5.160 454 HD1 PHE 64 HD2 PHE 64 19.380 18.723 -2.189 455 HD2 PHE 64 HD1 PHE 64 19.347 20.259 -6.159 456 HE1 PHE 64 HE2 PHE 64 16.930 18.926 -2.086 457 HE2 PHE 64 HE1 PHE 64 16.897 20.466 -6.061 458 HZ PHE 64 HZ PHE 64 15.685 19.800 -4.023 459 H VAL 65 H VAL 65 23.045 15.887 -4.268 460 HA VAL 65 HA VAL 65 25.234 17.355 -5.589 461 HB VAL 65 HB VAL 65 26.764 15.663 -4.591 462 HG11 VAL 65 HG11 VAL 65 26.796 17.671 -3.443 463 HG12 VAL 65 HG12 VAL 65 25.128 17.502 -2.892 464 HG13 VAL 65 HG13 VAL 65 26.402 16.518 -2.169 465 HG21 VAL 65 HG21 VAL 65 26.082 14.053 -3.084 466 HG22 VAL 65 HG22 VAL 65 24.582 14.897 -2.698 467 HG23 VAL 65 HG23 VAL 65 24.745 14.050 -4.236 468 H GLU 66 H GLU 66 26.833 15.489 -6.518 469 HA GLU 66 HA GLU 66 25.734 14.606 -8.876 470 HB2 GLU 66 HB2 GLU 66 27.984 13.231 -7.400 471 HB3 GLU 66 HB3 GLU 66 27.676 13.181 -9.131 472 HG2 GLU 66 HG2 GLU 66 28.018 15.681 -9.136 473 HG3 GLU 66 HG3 GLU 66 28.613 15.511 -7.487 474 H GLY 67 H GLY 67 26.079 12.796 -5.840 475 HA2 GLY 67 HA2 GLY 67 23.920 11.410 -5.519 476 HA3 GLY 67 HA3 GLY 67 24.458 10.632 -7.001 477 H ILE 68 H ILE 68 27.251 11.360 -5.579 478 HA ILE 68 HA ILE 68 27.799 8.698 -4.789 479 HB ILE 68 HB ILE 68 29.406 11.151 -4.081 480 HG12 ILE 68 HG12 ILE 68 29.656 9.401 -6.535 481 HG13 ILE 68 HG13 ILE 68 28.888 10.985 -6.523 482 HG21 ILE 68 HG21 ILE 68 30.003 8.214 -4.174 483 HG22 ILE 68 HG22 ILE 68 31.283 9.422 -4.271 484 HG23 ILE 68 HG23 ILE 68 30.245 9.349 -2.847 485 HD11 ILE 68 HD11 ILE 68 31.042 11.953 -5.764 486 HD12 ILE 68 HD12 ILE 68 31.776 10.362 -5.970 487 HD13 ILE 68 HD13 ILE 68 31.107 11.212 -7.363 488 H TYR 69 H TYR 69 27.249 7.715 -2.971 489 HA TYR 69 HA TYR 69 27.298 9.196 -0.453 490 HB2 TYR 69 HB2 TYR 69 24.923 7.565 -1.373 491 HB3 TYR 69 HB3 TYR 69 25.115 8.269 0.228 492 HD1 TYR 69 HD2 TYR 69 25.779 10.922 0.045 493 HD2 TYR 69 HD1 TYR 69 23.486 8.696 -2.764 494 HE1 TYR 69 HE2 TYR 69 24.732 13.004 -0.741 495 HE2 TYR 69 HE1 TYR 69 22.433 10.772 -3.559 496 HH TYR 69 HH TYR 69 22.089 12.972 -3.054 497 H LYS 70 H LYS 70 28.370 8.082 1.030 498 HA LYS 70 HA LYS 70 28.561 5.158 0.721 499 HB2 LYS 70 HB2 LYS 70 30.721 5.576 2.155 500 HB3 LYS 70 HB3 LYS 70 30.746 5.826 0.414 501 HG2 LYS 70 HG2 LYS 70 30.047 8.144 2.124 502 HG3 LYS 70 HG3 LYS 70 31.726 7.601 2.114 503 HD2 LYS 70 HD2 LYS 70 30.977 7.605 -0.564 504 HD3 LYS 70 HD3 LYS 70 30.241 9.065 0.103 505 HE2 LYS 70 HE2 LYS 70 32.223 10.080 0.358 506 HE3 LYS 70 HE3 LYS 70 32.988 8.624 0.993 507 HZ1 LYS 70 HZ1 LYS 70 32.369 8.772 -1.873 508 HZ2 LYS 70 HZ2 LYS 70 33.604 7.929 -1.084 509 HZ3 LYS 70 HZ3 LYS 70 33.720 9.605 -1.286 510 H VAL 71 H VAL 71 27.128 4.320 2.118 511 HA VAL 71 HA VAL 71 26.880 5.482 4.794 512 HB VAL 71 HB VAL 71 25.212 3.318 3.505 513 HG11 VAL 71 HG11 VAL 71 25.133 4.704 6.143 514 HG12 VAL 71 HG12 VAL 71 23.617 4.208 5.386 515 HG13 VAL 71 HG13 VAL 71 24.856 3.008 5.752 516 HG21 VAL 71 HG21 VAL 71 24.522 5.074 2.253 517 HG22 VAL 71 HG22 VAL 71 23.552 5.417 3.684 518 HG23 VAL 71 HG23 VAL 71 25.073 6.270 3.426 519 H GLU 72 H GLU 72 27.258 4.329 6.665 520 HA GLU 72 HA GLU 72 28.513 1.684 6.342 521 HB2 GLU 72 HB2 GLU 72 30.300 2.225 7.697 522 HB3 GLU 72 HB3 GLU 72 30.042 3.746 6.853 523 HG2 GLU 72 HG2 GLU 72 28.521 4.295 8.897 524 HG3 GLU 72 HG3 GLU 72 29.462 3.029 9.685 525 H ILE 73 H ILE 73 27.955 0.140 7.800 526 HA ILE 73 HA ILE 73 26.005 0.922 9.868 527 HB ILE 73 HB ILE 73 26.204 -1.729 8.432 528 HG12 ILE 73 HG12 ILE 73 23.721 -0.264 8.118 529 HG13 ILE 73 HG13 ILE 73 25.091 0.679 7.541 530 HG21 ILE 73 HG21 ILE 73 24.840 -0.874 10.847 531 HG22 ILE 73 HG22 ILE 73 23.734 -1.547 9.652 532 HG23 ILE 73 HG23 ILE 73 25.108 -2.498 10.215 533 HD11 ILE 73 HD11 ILE 73 25.586 -0.815 5.871 534 HD12 ILE 73 HD12 ILE 73 24.806 -2.164 6.700 535 HD13 ILE 73 HD13 ILE 73 23.826 -0.915 5.932 536 H ASP 74 H ASP 74 26.514 0.513 11.916 537 HA ASP 74 HA ASP 74 28.925 -1.052 12.469 538 HB2 ASP 74 HB2 ASP 74 27.819 1.336 13.555 539 HB3 ASP 74 HB3 ASP 74 27.845 0.125 14.835 540 H THR 75 H THR 75 28.199 -3.158 12.363 541 HA THR 75 HA THR 75 25.878 -3.974 13.902 542 HB THR 75 HB THR 75 26.126 -6.126 12.933 543 HG1 THR 75 HG1 THR 75 28.779 -5.279 12.428 544 HG21 THR 75 HG21 THR 75 25.985 -5.672 10.628 545 HG22 THR 75 HG22 THR 75 27.108 -4.316 10.741 546 HG23 THR 75 HG23 THR 75 25.483 -4.174 11.410 547 H LYS 76 H LYS 76 29.317 -3.888 14.235 548 HA LYS 76 HA LYS 76 29.837 -5.921 16.025 549 HB2 LYS 76 HB2 LYS 76 31.676 -4.481 16.878 550 HB3 LYS 76 HB3 LYS 76 31.622 -4.573 15.122 551 HG2 LYS 76 HG2 LYS 76 31.878 -2.344 15.289 552 HG3 LYS 76 HG3 LYS 76 30.126 -2.381 15.499 553 HD2 LYS 76 HD2 LYS 76 30.736 -1.089 17.295 554 HD3 LYS 76 HD3 LYS 76 30.762 -2.693 18.031 555 HE2 LYS 76 HE2 LYS 76 32.768 -1.741 18.729 556 HE3 LYS 76 HE3 LYS 76 33.242 -2.734 17.351 557 HZ1 LYS 76 HZ1 LYS 76 33.923 -0.951 16.240 558 HZ2 LYS 76 HZ2 LYS 76 33.797 -0.089 17.689 559 HZ3 LYS 76 HZ3 LYS 76 32.517 -0.077 16.584 560 H SER 77 H SER 77 28.463 -2.730 16.650 561 HA SER 77 HA SER 77 28.284 -3.265 19.501 562 HB2 SER 77 HB2 SER 77 28.131 -0.907 17.783 563 HB3 SER 77 HB3 SER 77 26.882 -0.924 19.028 564 HG SER 77 HG SER 77 28.381 -0.346 20.362 565 H TYR 78 H TYR 78 26.417 -3.764 16.726 566 HA TYR 78 HA TYR 78 23.832 -3.532 17.965 567 HB2 TYR 78 HB2 TYR 78 23.995 -3.146 15.590 568 HB3 TYR 78 HB3 TYR 78 24.717 -4.732 15.335 569 HD1 TYR 78 HD1 TYR 78 21.742 -3.756 17.362 570 HD2 TYR 78 HD2 TYR 78 23.218 -5.895 13.992 571 HE1 TYR 78 HE1 TYR 78 19.506 -4.709 16.995 572 HE2 TYR 78 HE2 TYR 78 20.984 -6.853 13.616 573 HH TYR 78 HH TYR 78 18.493 -6.667 15.913 574 H TRP 79 H TRP 79 26.168 -6.068 17.391 575 HA TRP 79 HA TRP 79 24.365 -8.195 18.120 576 HB2 TRP 79 HB2 TRP 79 27.376 -8.303 17.893 577 HB3 TRP 79 HB3 TRP 79 26.257 -9.662 17.846 578 HD1 TRP 79 HD1 TRP 79 28.370 -8.119 15.542 579 HE1 TRP 79 HE1 TRP 79 27.431 -8.058 13.146 580 HE3 TRP 79 HE3 TRP 79 23.444 -9.008 16.579 581 HZ2 TRP 79 HZ2 TRP 79 24.932 -8.347 11.866 582 HZ3 TRP 79 HZ3 TRP 79 21.844 -9.099 14.712 583 HH2 TRP 79 HH2 TRP 79 22.574 -8.775 12.405 584 H LYS 80 H LYS 80 26.642 -6.123 19.722 585 HA LYS 80 HA LYS 80 26.932 -7.731 22.072 586 HB2 LYS 80 HB2 LYS 80 28.253 -6.006 22.923 587 HB3 LYS 80 HB3 LYS 80 28.505 -5.884 21.187 588 HG2 LYS 80 HG2 LYS 80 28.028 -3.726 21.426 589 HG3 LYS 80 HG3 LYS 80 26.348 -4.236 21.606 590 HD2 LYS 80 HD2 LYS 80 26.723 -2.883 23.471 591 HD3 LYS 80 HD3 LYS 80 26.917 -4.521 24.097 592 HE2 LYS 80 HE2 LYS 80 29.416 -4.194 23.584 593 HE3 LYS 80 HE3 LYS 80 29.025 -2.478 23.473 594 HZ1 LYS 80 HZ1 LYS 80 29.728 -2.914 25.678 595 HZ2 LYS 80 HZ2 LYS 80 28.700 -4.248 25.830 596 HZ3 LYS 80 HZ3 LYS 80 28.053 -2.688 25.745 597 H ALA 81 H ALA 81 24.524 -5.626 20.894 598 HA ALA 81 HA ALA 81 23.466 -4.900 23.484 599 HB1 ALA 81 HB1 ALA 81 21.489 -4.270 21.736 600 HB2 ALA 81 HB2 ALA 81 22.845 -3.214 22.139 601 HB3 ALA 81 HB3 ALA 81 22.907 -4.214 20.686 602 H LEU 82 H LEU 82 22.552 -7.060 20.820 603 HA LEU 82 HA LEU 82 20.434 -8.206 22.488 604 HB2 LEU 82 HB2 LEU 82 21.075 -8.643 19.574 605 HB3 LEU 82 HB3 LEU 82 19.700 -9.329 20.438 606 HG LEU 82 HG LEU 82 18.769 -7.560 19.262 607 HD11 LEU 82 HD11 LEU 82 18.056 -5.986 20.889 608 HD12 LEU 82 HD12 LEU 82 19.505 -6.235 21.862 609 HD13 LEU 82 HD13 LEU 82 18.303 -7.518 21.727 610 HD21 LEU 82 HD21 LEU 82 21.066 -6.644 18.646 611 HD22 LEU 82 HD22 LEU 82 20.949 -5.677 20.117 612 HD23 LEU 82 HD23 LEU 82 19.758 -5.476 18.831 613 H GLY 83 H GLY 83 23.585 -8.659 22.261 614 HA2 GLY 83 HA2 GLY 83 25.013 -10.410 22.663 615 HA3 GLY 83 HA3 GLY 83 23.629 -11.199 23.403 616 H ILE 84 H ILE 84 24.236 -10.274 20.026 617 HA ILE 84 HA ILE 84 23.479 -12.962 19.197 618 HB ILE 84 HB ILE 84 24.206 -10.661 17.392 619 HG12 ILE 84 HG12 ILE 84 22.422 -9.949 18.931 620 HG13 ILE 84 HG13 ILE 84 21.819 -10.123 17.287 621 HG21 ILE 84 HG21 ILE 84 22.533 -11.938 15.917 622 HG22 ILE 84 HG22 ILE 84 24.144 -12.621 16.133 623 HG23 ILE 84 HG23 ILE 84 22.780 -13.274 17.042 624 HD11 ILE 84 HD11 ILE 84 21.451 -12.603 18.577 625 HD12 ILE 84 HD12 ILE 84 20.881 -11.343 19.672 626 HD13 ILE 84 HD13 ILE 84 20.227 -11.453 18.038 627 H SER 85 H SER 85 24.751 -14.155 17.642 628 HA SER 85 HA SER 85 27.346 -14.640 18.391 629 HB2 SER 85 HB2 SER 85 25.746 -15.242 15.958 630 HB3 SER 85 HB3 SER 85 27.493 -15.460 15.842 631 HG SER 85 HG SER 85 27.340 -16.808 17.708 632 HA PRO 86 HA PRO 86 29.959 -11.543 16.712 633 HB2 PRO 86 HB2 PRO 86 32.117 -12.979 15.908 634 HB3 PRO 86 HB3 PRO 86 31.734 -12.692 17.609 635 HG2 PRO 86 HG2 PRO 86 31.190 -15.108 15.928 636 HG3 PRO 86 HG3 PRO 86 31.789 -15.016 17.594 637 HD2 PRO 86 HD2 PRO 86 29.203 -15.561 17.004 638 HD3 PRO 86 HD3 PRO 86 29.683 -14.676 18.467 639 H MET 87 H MET 87 31.208 -10.887 14.743 640 HA MET 87 HA MET 87 30.266 -12.188 12.289 641 HB2 MET 87 HB2 MET 87 28.967 -10.020 13.124 642 HB3 MET 87 HB3 MET 87 30.318 -9.210 12.341 643 HG2 MET 87 HG2 MET 87 29.027 -9.326 10.522 644 HG3 MET 87 HG3 MET 87 29.626 -10.981 10.427 645 HE1 MET 87 HE1 MET 87 26.809 -13.204 10.936 646 HE2 MET 87 HE2 MET 87 28.542 -12.929 10.765 647 HE3 MET 87 HE3 MET 87 27.800 -12.908 12.365 648 H HIS 88 H HIS 88 31.558 -11.772 10.427 649 HA HIS 88 HA HIS 88 34.345 -11.423 11.064 650 HB2 HIS 88 HB2 HIS 88 34.789 -12.150 8.842 651 HB3 HIS 88 HB3 HIS 88 33.427 -13.111 9.409 652 HD1 HIS 88 HD1 HIS 88 34.441 -11.714 6.441 653 HD2 HIS 88 HD2 HIS 88 30.904 -11.382 8.595 654 HE1 HIS 88 HE1 HIS 88 32.704 -10.987 4.774 655 H GLU 89 H GLU 89 31.809 -9.551 9.568 656 HA GLU 89 HA GLU 89 33.198 -7.118 9.863 657 HB2 GLU 89 HB2 GLU 89 34.452 -8.099 7.917 658 HB3 GLU 89 HB3 GLU 89 32.956 -8.033 6.996 659 HG2 GLU 89 HG2 GLU 89 32.904 -5.664 7.085 660 HG3 GLU 89 HG3 GLU 89 34.214 -5.618 8.263 661 H HIS 90 H HIS 90 31.942 -5.288 9.229 662 HA HIS 90 HA HIS 90 29.106 -5.846 9.232 663 HB2 HIS 90 HB2 HIS 90 28.807 -3.500 9.626 664 HB3 HIS 90 HB3 HIS 90 30.160 -4.034 10.618 665 HD1 HIS 90 HD1 HIS 90 32.566 -3.306 9.803 666 HD2 HIS 90 HD2 HIS 90 29.395 -1.538 7.783 667 HE1 HIS 90 HE1 HIS 90 33.558 -1.349 8.574 668 H ALA 91 H ALA 91 27.692 -4.419 7.782 669 HA ALA 91 HA ALA 91 28.652 -4.743 5.029 670 HB1 ALA 91 HB1 ALA 91 26.398 -4.890 4.345 671 HB2 ALA 91 HB2 ALA 91 26.522 -5.858 5.814 672 HB3 ALA 91 HB3 ALA 91 25.812 -4.244 5.877 673 H GLU 92 H GLU 92 28.487 -3.092 3.507 674 HA GLU 92 HA GLU 92 27.676 -0.445 4.450 675 HB2 GLU 92 HB2 GLU 92 29.737 0.564 3.508 676 HB3 GLU 92 HB3 GLU 92 30.053 -0.485 4.883 677 HG2 GLU 92 HG2 GLU 92 30.949 -2.176 3.530 678 HG3 GLU 92 HG3 GLU 92 30.290 -1.463 2.059 679 H VAL 93 H VAL 93 27.761 1.165 2.569 680 HA VAL 93 HA VAL 93 27.243 -0.114 -0.014 681 HB VAL 93 HB VAL 93 25.331 1.821 1.300 682 HG11 VAL 93 HG11 VAL 93 24.017 0.939 -0.864 683 HG12 VAL 93 HG12 VAL 93 25.008 2.400 -0.866 684 HG13 VAL 93 HG13 VAL 93 25.667 0.884 -1.482 685 HG21 VAL 93 HG21 VAL 93 25.311 -1.132 0.889 686 HG22 VAL 93 HG22 VAL 93 24.794 -0.186 2.285 687 HG23 VAL 93 HG23 VAL 93 23.786 -0.247 0.840 688 H VAL 94 H VAL 94 28.516 0.856 -1.437 689 HA VAL 94 HA VAL 94 28.908 3.770 -1.222 690 HB VAL 94 HB VAL 94 30.955 1.725 -2.092 691 HG11 VAL 94 HG11 VAL 94 32.090 4.285 -1.691 692 HG12 VAL 94 HG12 VAL 94 31.978 3.361 -3.190 693 HG13 VAL 94 HG13 VAL 94 30.693 4.486 -2.747 694 HG21 VAL 94 HG21 VAL 94 32.140 2.997 -0.083 695 HG22 VAL 94 HG22 VAL 94 30.466 3.210 0.431 696 HG23 VAL 94 HG23 VAL 94 31.110 1.589 0.177 697 H PHE 95 H PHE 95 27.805 4.667 -2.837 698 HA PHE 95 HA PHE 95 27.960 3.408 -5.497 699 HB2 PHE 95 HB2 PHE 95 25.698 4.777 -4.088 700 HB3 PHE 95 HB3 PHE 95 25.772 4.810 -5.847 701 HD1 PHE 95 HD2 PHE 95 26.109 2.488 -6.997 702 HD2 PHE 95 HD1 PHE 95 24.640 3.025 -3.039 703 HE1 PHE 95 HE2 PHE 95 25.078 0.256 -7.081 704 HE2 PHE 95 HE1 PHE 95 23.605 0.793 -3.116 705 HZ PHE 95 HZ PHE 95 23.822 -0.594 -5.140 706 H THR 96 H THR 96 28.195 4.761 -7.303 707 HA THR 96 HA THR 96 29.082 7.504 -6.679 708 HB THR 96 HB THR 96 31.023 6.198 -7.269 709 HG1 THR 96 HG1 THR 96 30.591 8.380 -8.266 710 HG21 THR 96 HG21 THR 96 30.689 4.385 -8.544 711 HG22 THR 96 HG22 THR 96 30.762 5.482 -9.922 712 HG23 THR 96 HG23 THR 96 29.203 5.041 -9.227 713 H ALA 97 H ALA 97 28.540 9.137 -8.116 714 HA ALA 97 HA ALA 97 26.176 8.652 -9.690 715 HB1 ALA 97 HB1 ALA 97 26.391 10.674 -8.325 716 HB2 ALA 97 HB2 ALA 97 27.755 11.194 -9.315 717 HB3 ALA 97 HB3 ALA 97 26.147 11.061 -10.029 718 H ASN 98 H ASN 98 25.957 9.355 -11.927 719 HA ASN 98 HA ASN 98 26.544 9.329 -14.124 720 HB2 ASN 98 HB2 ASN 98 29.396 9.908 -13.381 721 HB3 ASN 98 HB3 ASN 98 28.484 10.458 -14.783 722 HD21 ASN 98 HD21 ASN 98 26.440 11.751 -14.073 723 HD22 ASN 98 HD22 ASN 98 26.746 12.996 -12.915 724 H ASP 99 H ASP 99 26.517 6.892 -12.770 725 HA ASP 99 HA ASP 99 28.354 5.369 -14.443 726 HB2 ASP 99 HB2 ASP 99 29.617 5.531 -12.401 727 HB3 ASP 99 HB3 ASP 99 28.210 5.092 -11.437 728 H SER 100 H SER 100 26.772 4.441 -15.637 729 HA SER 100 HA SER 100 25.098 3.007 -16.201 730 HB2 SER 100 HB2 SER 100 25.114 1.897 -13.405 731 HB3 SER 100 HB3 SER 100 24.808 1.059 -14.928 732 HG SER 100 HG SER 100 26.836 0.528 -14.772 733 H GLY 101 H GLY 101 24.576 5.619 -14.866 734 HA2 GLY 101 HA2 GLY 101 22.718 6.838 -14.287 735 HA3 GLY 101 HA3 GLY 101 21.757 5.446 -14.763 736 HA PRO 102 HA PRO 102 21.809 6.154 -10.058 737 HB2 PRO 102 HB2 PRO 102 19.306 7.171 -9.791 738 HB3 PRO 102 HB3 PRO 102 20.733 8.184 -10.040 739 HG2 PRO 102 HG2 PRO 102 18.691 7.266 -12.027 740 HG3 PRO 102 HG3 PRO 102 19.431 8.866 -11.842 741 HD2 PRO 102 HD2 PRO 102 20.240 7.096 -13.725 742 HD3 PRO 102 HD3 PRO 102 21.352 8.246 -12.954 743 H ARG 103 H ARG 103 21.176 4.476 -8.839 744 HA ARG 103 HA ARG 103 18.670 3.145 -9.200 745 HB2 ARG 103 HB2 ARG 103 21.142 2.004 -10.375 746 HB3 ARG 103 HB3 ARG 103 20.112 0.891 -9.487 747 HG2 ARG 103 HG2 ARG 103 18.228 1.978 -10.970 748 HG3 ARG 103 HG3 ARG 103 19.595 2.344 -12.024 749 HD2 ARG 103 HD2 ARG 103 20.201 -0.152 -11.690 750 HD3 ARG 103 HD3 ARG 103 18.528 -0.317 -11.159 751 HE ARG 103 HE ARG 103 18.306 0.976 -13.527 752 HH11 ARG 103 HH11 ARG 103 19.926 -1.939 -12.528 753 HH12 ARG 103 HH12 ARG 103 19.758 -2.716 -14.067 754 HH21 ARG 103 HH21 ARG 103 18.078 -0.037 -15.559 755 HH22 ARG 103 HH22 ARG 103 18.706 -1.633 -15.791 756 H ARG 104 H ARG 104 18.193 1.690 -7.513 757 HA ARG 104 HA ARG 104 18.255 0.892 -5.383 758 HB2 ARG 104 HB2 ARG 104 20.469 -0.064 -6.408 759 HB3 ARG 104 HB3 ARG 104 21.242 1.103 -5.345 760 HG2 ARG 104 HG2 ARG 104 21.223 -0.816 -4.066 761 HG3 ARG 104 HG3 ARG 104 19.786 0.035 -3.499 762 HD2 ARG 104 HD2 ARG 104 18.964 -2.093 -3.806 763 HD3 ARG 104 HD3 ARG 104 18.582 -1.343 -5.356 764 HE ARG 104 HE ARG 104 21.131 -2.640 -5.359 765 HH11 ARG 104 HH11 ARG 104 17.703 -3.149 -5.681 766 HH12 ARG 104 HH12 ARG 104 17.874 -4.585 -6.636 767 HH21 ARG 104 HH21 ARG 104 21.370 -4.530 -6.614 768 HH22 ARG 104 HH22 ARG 104 19.960 -5.369 -7.164 769 H TYR 105 H TYR 105 17.601 3.423 -5.393 770 HA TYR 105 HA TYR 105 19.267 5.279 -4.136 771 HB2 TYR 105 HB2 TYR 105 17.307 6.588 -3.760 772 HB3 TYR 105 HB3 TYR 105 17.065 5.743 -5.285 773 HD1 TYR 105 HD2 TYR 105 15.653 3.611 -5.249 774 HD2 TYR 105 HD1 TYR 105 15.743 6.390 -2.029 775 HE1 TYR 105 HE2 TYR 105 13.526 2.703 -4.414 776 HE2 TYR 105 HE1 TYR 105 13.617 5.488 -1.184 777 HH TYR 105 HH TYR 105 12.305 2.576 -2.244 778 H THR 106 H THR 106 17.313 2.696 -2.836 779 HA THR 106 HA THR 106 17.658 3.597 -0.096 780 HB THR 106 HB THR 106 16.372 1.089 -1.194 781 HG1 THR 106 HG1 THR 106 14.461 2.181 -0.825 782 HG21 THR 106 HG21 THR 106 17.019 0.520 0.986 783 HG22 THR 106 HG22 THR 106 15.354 1.073 1.165 784 HG23 THR 106 HG23 THR 106 16.690 2.139 1.603 785 H ILE 107 H ILE 107 18.925 2.617 1.447 786 HA ILE 107 HA ILE 107 21.170 1.086 0.434 787 HB ILE 107 HB ILE 107 20.618 2.155 3.204 788 HG12 ILE 107 HG12 ILE 107 22.771 3.518 2.284 789 HG13 ILE 107 HG13 ILE 107 21.902 3.255 0.776 790 HG21 ILE 107 HG21 ILE 107 22.278 0.873 3.924 791 HG22 ILE 107 HG22 ILE 107 22.498 0.211 2.306 792 HG23 ILE 107 HG23 ILE 107 23.367 1.667 2.788 793 HD11 ILE 107 HD11 ILE 107 21.471 5.396 2.166 794 HD12 ILE 107 HD12 ILE 107 20.113 4.541 1.434 795 HD13 ILE 107 HD13 ILE 107 20.461 4.337 3.150 796 H ALA 108 H ALA 108 20.779 -1.027 0.158 797 HA ALA 108 HA ALA 108 19.146 -2.483 2.084 798 HB1 ALA 108 HB1 ALA 108 20.400 -3.969 -0.121 799 HB2 ALA 108 HB2 ALA 108 18.729 -3.967 0.446 800 HB3 ALA 108 HB3 ALA 108 19.304 -2.675 -0.608 801 H ALA 109 H ALA 109 20.127 -3.213 3.850 802 HA ALA 109 HA ALA 109 22.789 -4.443 3.560 803 HB1 ALA 109 HB1 ALA 109 21.809 -2.639 5.760 804 HB2 ALA 109 HB2 ALA 109 23.243 -3.656 5.908 805 HB3 ALA 109 HB3 ALA 109 23.182 -2.391 4.680 806 H MET 110 H MET 110 22.625 -6.553 3.906 807 HA MET 110 HA MET 110 20.611 -7.524 5.818 808 HB2 MET 110 HB2 MET 110 21.901 -8.798 3.416 809 HB3 MET 110 HB3 MET 110 21.065 -9.756 4.631 810 HG2 MET 110 HG2 MET 110 19.071 -8.231 4.225 811 HG3 MET 110 HG3 MET 110 19.934 -7.679 2.791 812 HE1 MET 110 HE1 MET 110 18.520 -11.870 3.762 813 HE2 MET 110 HE2 MET 110 18.649 -10.459 4.815 814 HE3 MET 110 HE3 MET 110 17.252 -10.643 3.753 815 H LEU 111 H LEU 111 21.278 -8.349 7.685 816 HA LEU 111 HA LEU 111 24.107 -8.666 8.189 817 HB2 LEU 111 HB2 LEU 111 21.742 -9.118 10.003 818 HB3 LEU 111 HB3 LEU 111 23.432 -9.078 10.500 819 HG LEU 111 HG LEU 111 22.637 -6.994 11.133 820 HD11 LEU 111 HD11 LEU 111 23.736 -5.396 9.733 821 HD12 LEU 111 HD12 LEU 111 23.656 -6.481 8.345 822 HD13 LEU 111 HD13 LEU 111 24.683 -6.884 9.720 823 HD21 LEU 111 HD21 LEU 111 20.500 -7.396 9.684 824 HD22 LEU 111 HD22 LEU 111 21.353 -6.396 8.507 825 HD23 LEU 111 HD23 LEU 111 20.990 -5.755 10.109 826 H SER 112 H SER 112 23.952 -10.469 6.442 827 HA SER 112 HA SER 112 22.871 -12.985 7.189 828 HB2 SER 112 HB2 SER 112 25.150 -13.092 5.352 829 HB3 SER 112 HB3 SER 112 23.483 -13.613 5.110 830 HG SER 112 HG SER 112 24.690 -11.393 4.228 831 HA PRO 113 HA PRO 113 25.927 -14.721 9.812 832 HB2 PRO 113 HB2 PRO 113 26.035 -17.296 8.957 833 HB3 PRO 113 HB3 PRO 113 24.662 -16.639 9.856 834 HG2 PRO 113 HG2 PRO 113 24.967 -17.065 6.909 835 HG3 PRO 113 HG3 PRO 113 23.571 -17.400 7.949 836 HD2 PRO 113 HD2 PRO 113 23.726 -15.194 6.386 837 HD3 PRO 113 HD3 PRO 113 22.883 -15.200 7.949 838 H TYR 114 H TYR 114 27.667 -13.411 8.895 839 HA TYR 114 HA TYR 114 29.785 -13.167 8.103 840 HB2 TYR 114 HB2 TYR 114 29.827 -16.175 7.821 841 HB3 TYR 114 HB3 TYR 114 31.211 -15.099 7.979 842 HD1 TYR 114 HD2 TYR 114 31.346 -13.721 10.182 843 HD2 TYR 114 HD1 TYR 114 28.952 -17.208 9.709 844 HE1 TYR 114 HE2 TYR 114 31.299 -14.013 12.623 845 HE2 TYR 114 HE1 TYR 114 28.898 -17.508 12.150 846 HH TYR 114 HH TYR 114 30.121 -16.879 14.110 847 H SER 115 H SER 115 27.425 -13.326 6.301 848 HA SER 115 HA SER 115 28.911 -13.778 3.802 849 HB2 SER 115 HB2 SER 115 27.094 -15.555 4.469 850 HB3 SER 115 HB3 SER 115 25.965 -14.322 3.910 851 HG SER 115 HG SER 115 26.377 -15.206 2.036 852 H TYR 116 H TYR 116 27.492 -12.800 1.911 853 HA TYR 116 HA TYR 116 26.258 -10.282 2.750 854 HB2 TYR 116 HB2 TYR 116 27.594 -9.135 0.892 855 HB3 TYR 116 HB3 TYR 116 28.459 -9.522 2.376 856 HD1 TYR 116 HD2 TYR 116 27.750 -10.935 -1.007 857 HD2 TYR 116 HD1 TYR 116 30.489 -10.631 2.235 858 HE1 TYR 116 HE2 TYR 116 29.426 -12.170 -2.315 859 HE2 TYR 116 HE1 TYR 116 32.173 -11.865 0.935 860 HH TYR 116 HH TYR 116 31.822 -13.709 -1.251 861 H SER 117 H SER 117 25.309 -9.123 0.792 862 HA SER 117 HA SER 117 23.621 -10.973 -0.588 863 HB2 SER 117 HB2 SER 117 22.540 -9.012 -1.518 864 HB3 SER 117 HB3 SER 117 22.865 -8.724 0.190 865 HG SER 117 HG SER 117 23.438 -7.007 -1.399 866 H THR 118 H THR 118 23.356 -11.091 -2.904 867 HA THR 118 HA THR 118 25.830 -11.458 -4.257 868 HB THR 118 HB THR 118 23.266 -11.317 -5.780 869 HG1 THR 118 HG1 THR 118 23.847 -13.072 -3.663 870 HG21 THR 118 HG21 THR 118 25.890 -12.496 -6.061 871 HG22 THR 118 HG22 THR 118 24.622 -12.280 -7.269 872 HG23 THR 118 HG23 THR 118 24.624 -13.711 -6.239 873 H THR 119 H THR 119 27.035 -9.857 -5.022 874 HA THR 119 HA THR 119 25.922 -7.915 -6.826 875 HB THR 119 HB THR 119 25.457 -6.845 -4.642 876 HG1 THR 119 HG1 THR 119 26.148 -5.659 -6.624 877 HG21 THR 119 HG21 THR 119 27.365 -7.831 -3.409 878 HG22 THR 119 HG22 THR 119 27.276 -6.078 -3.234 879 HG23 THR 119 HG23 THR 119 28.460 -6.796 -4.324 880 H ALA 120 H ALA 120 27.677 -6.381 -7.607 881 HA ALA 120 HA ALA 120 30.262 -7.800 -7.646 882 HB1 ALA 120 HB1 ALA 120 29.764 -8.031 -9.827 883 HB2 ALA 120 HB2 ALA 120 28.600 -6.707 -9.812 884 HB3 ALA 120 HB3 ALA 120 30.325 -6.362 -9.933 885 H VAL 121 H VAL 121 30.931 -6.518 -5.823 886 HA VAL 121 HA VAL 121 31.685 -3.774 -6.590 887 HB VAL 121 HB VAL 121 31.551 -3.160 -4.187 888 HG11 VAL 121 HG11 VAL 121 29.073 -3.071 -4.087 889 HG12 VAL 121 HG12 VAL 121 29.733 -2.551 -5.638 890 HG13 VAL 121 HG13 VAL 121 29.014 -4.153 -5.477 891 HG21 VAL 121 HG21 VAL 121 30.280 -4.617 -2.666 892 HG22 VAL 121 HG22 VAL 121 30.241 -5.864 -3.912 893 HG23 VAL 121 HG23 VAL 121 31.780 -5.370 -3.207 894 H VAL 122 H VAL 122 33.736 -3.090 -6.063 895 HA VAL 122 HA VAL 122 35.487 -4.938 -4.616 896 HB VAL 122 HB VAL 122 37.269 -4.621 -6.338 897 HG11 VAL 122 HG11 VAL 122 36.076 -6.140 -8.068 898 HG12 VAL 122 HG12 VAL 122 36.298 -6.724 -6.417 899 HG13 VAL 122 HG13 VAL 122 34.731 -6.092 -6.929 900 HG21 VAL 122 HG21 VAL 122 36.978 -3.452 -8.240 901 HG22 VAL 122 HG22 VAL 122 35.303 -3.970 -8.427 902 HG23 VAL 122 HG23 VAL 122 35.699 -2.650 -7.327 903 H THR 123 H THR 123 37.320 -3.972 -3.689 904 HA THR 123 HA THR 123 37.429 -1.035 -3.822 905 HB THR 123 HB THR 123 37.744 -2.617 -1.267 906 HG1 THR 123 HG1 THR 123 35.524 -2.301 -2.394 907 HG21 THR 123 HG21 THR 123 38.983 -0.548 -1.228 908 HG22 THR 123 HG22 THR 123 37.542 -0.365 -0.228 909 HG23 THR 123 HG23 THR 123 37.590 0.342 -1.842 910 H ASN 124 H ASN 124 39.355 -0.460 -4.564 911 HA ASN 124 HA ASN 124 41.764 -1.486 -3.368 912 HB2 ASN 124 HB2 ASN 124 42.635 -1.944 -5.832 913 HB3 ASN 124 HB3 ASN 124 41.828 -3.200 -4.898 914 HD21 ASN 124 HD21 ASN 124 39.874 -3.956 -5.547 915 HD22 ASN 124 HD22 ASN 124 39.098 -3.475 -7.014 916 HA PRO 125 HA PRO 125 43.310 2.492 -4.379 917 HB2 PRO 125 HB2 PRO 125 45.939 1.994 -4.838 918 HB3 PRO 125 HB3 PRO 125 45.218 1.939 -3.226 919 HG2 PRO 125 HG2 PRO 125 45.853 -0.311 -5.095 920 HG3 PRO 125 HG3 PRO 125 46.112 -0.205 -3.344 921 HD2 PRO 125 HD2 PRO 125 44.024 -1.543 -4.430 922 HD3 PRO 125 HD3 PRO 125 43.917 -0.717 -2.862 923 H LYS 126 H LYS 126 44.888 3.600 -6.044 924 HA LYS 126 HA LYS 126 43.735 3.287 -8.600 925 HB2 LYS 126 HB2 LYS 126 45.000 5.120 -9.242 926 HB3 LYS 126 HB3 LYS 126 44.892 5.350 -7.502 927 HG2 LYS 126 HG2 LYS 126 47.223 4.084 -8.929 928 HG3 LYS 126 HG3 LYS 126 47.147 5.766 -8.399 929 HD2 LYS 126 HD2 LYS 126 46.852 3.398 -6.555 930 HD3 LYS 126 HD3 LYS 126 48.374 4.243 -6.842 931 HE2 LYS 126 HE2 LYS 126 47.800 5.959 -5.520 932 HE3 LYS 126 HE3 LYS 126 46.159 6.021 -6.162 933 HZ1 LYS 126 HZ1 LYS 126 46.783 3.762 -4.440 934 HZ2 LYS 126 HZ2 LYS 126 45.376 4.697 -4.535 935 HZ3 LYS 126 HZ3 LYS 126 46.719 5.275 -3.684 936 H GLU 127 H GLU 127 46.254 1.620 -7.055 937 HA GLU 127 HA GLU 127 47.347 0.686 -9.621 938 HB2 GLU 127 HB2 GLU 127 48.470 0.908 -6.864 939 HB3 GLU 127 HB3 GLU 127 49.077 -0.367 -7.913 940 HG2 GLU 127 HG2 GLU 127 49.037 2.552 -8.638 941 HG3 GLU 127 HG3 GLU 127 50.427 1.709 -7.957 Start of MODEL 5 1 H1 GLY 1 H GLY 1 10.423 16.294 2.888 2 HA2 GLY 1 HA2 GLY 1 7.864 17.371 2.167 3 HA3 GLY 1 HA3 GLY 1 8.213 15.867 1.326 4 HA PRO 2 HA PRO 2 6.469 15.190 5.700 5 HB2 PRO 2 HB2 PRO 2 3.968 14.402 4.999 6 HB3 PRO 2 HB3 PRO 2 4.384 16.086 5.337 7 HG2 PRO 2 HG2 PRO 2 4.102 14.698 2.700 8 HG3 PRO 2 HG3 PRO 2 3.530 16.305 3.186 9 HD2 PRO 2 HD2 PRO 2 5.784 15.939 1.729 10 HD3 PRO 2 HD3 PRO 2 5.603 17.270 2.890 11 H THR 3 H THR 3 5.004 13.053 6.189 12 HA THR 3 HA THR 3 6.668 10.872 5.633 13 HB THR 3 HB THR 3 5.071 9.492 6.734 14 HG1 THR 3 HG1 THR 3 3.123 9.881 5.870 15 HG21 THR 3 HG21 THR 3 4.732 12.233 7.950 16 HG22 THR 3 HG22 THR 3 6.195 11.261 8.111 17 HG23 THR 3 HG23 THR 3 4.671 10.677 8.777 18 H GLY 4 H GLY 4 3.528 11.784 4.231 19 HA2 GLY 4 HA2 GLY 4 4.138 10.807 1.669 20 HA3 GLY 4 HA3 GLY 4 3.248 9.563 2.533 21 H THR 5 H THR 5 2.986 13.113 2.315 22 HA THR 5 HA THR 5 0.287 12.807 1.225 23 HB THR 5 HB THR 5 -0.669 14.410 2.796 24 HG1 THR 5 HG1 THR 5 0.532 15.250 4.462 25 HG21 THR 5 HG21 THR 5 -0.913 12.973 4.644 26 HG22 THR 5 HG22 THR 5 0.708 12.305 4.444 27 HG23 THR 5 HG23 THR 5 -0.561 11.903 3.287 28 H GLY 6 H GLY 6 0.310 13.937 -0.604 29 HA2 GLY 6 HA2 GLY 6 0.275 15.970 -1.798 30 HA3 GLY 6 HA3 GLY 6 1.266 16.698 -0.542 31 H GLU 7 H GLU 7 3.293 14.697 -0.475 32 HA GLU 7 HA GLU 7 4.420 14.769 -3.179 33 HB2 GLU 7 HB2 GLU 7 5.177 16.723 -1.620 34 HB3 GLU 7 HB3 GLU 7 6.159 15.489 -0.845 35 HG2 GLU 7 HG2 GLU 7 7.504 15.202 -2.690 36 HG3 GLU 7 HG3 GLU 7 6.287 15.825 -3.804 37 H SER 8 H SER 8 6.392 13.393 -3.361 38 HA SER 8 HA SER 8 5.874 10.818 -2.302 39 HB2 SER 8 HB2 SER 8 7.022 10.401 -4.191 40 HB3 SER 8 HB3 SER 8 7.727 12.017 -4.207 41 HG SER 8 HG SER 8 9.478 11.250 -3.326 42 H LYS 9 H LYS 9 7.483 9.501 -1.116 43 HA LYS 9 HA LYS 9 8.056 10.554 1.387 44 HB2 LYS 9 HB2 LYS 9 9.187 8.167 -0.069 45 HB3 LYS 9 HB3 LYS 9 9.611 8.545 1.596 46 HG2 LYS 9 HG2 LYS 9 7.906 7.111 1.988 47 HG3 LYS 9 HG3 LYS 9 6.971 8.602 1.854 48 HD2 LYS 9 HD2 LYS 9 7.426 7.364 -0.731 49 HD3 LYS 9 HD3 LYS 9 6.599 6.277 0.387 50 HE2 LYS 9 HE2 LYS 9 5.250 8.579 0.832 51 HE3 LYS 9 HE3 LYS 9 5.677 8.777 -0.868 52 HZ1 LYS 9 HZ1 LYS 9 4.597 6.188 -0.085 53 HZ2 LYS 9 HZ2 LYS 9 4.341 7.086 -1.495 54 HZ3 LYS 9 HZ3 LYS 9 3.514 7.487 -0.075 55 H CYS 10 H CYS 10 10.432 10.338 2.310 56 HA CYS 10 HA CYS 10 11.875 12.534 1.475 57 HB2 CYS 10 HB2 CYS 10 12.662 10.082 3.027 58 HB3 CYS 10 HB3 CYS 10 13.839 11.339 2.668 59 HG CYS 10 HG CYS 10 11.929 11.197 5.207 60 HA PRO 11 HA PRO 11 14.165 11.426 -2.098 61 HB2 PRO 11 HB2 PRO 11 16.519 12.711 -1.674 62 HB3 PRO 11 HB3 PRO 11 15.022 13.559 -2.078 63 HG2 PRO 11 HG2 PRO 11 16.309 13.158 0.594 64 HG3 PRO 11 HG3 PRO 11 15.559 14.618 -0.080 65 HD2 PRO 11 HD2 PRO 11 14.284 13.005 1.683 66 HD3 PRO 11 HD3 PRO 11 13.425 13.900 0.413 67 H LEU 12 H LEU 12 15.839 10.974 0.987 68 HA LEU 12 HA LEU 12 17.076 8.549 -0.124 69 HB2 LEU 12 HB2 LEU 12 18.885 10.024 -0.061 70 HB3 LEU 12 HB3 LEU 12 18.356 10.750 1.455 71 HG LEU 12 HG LEU 12 18.884 8.418 2.465 72 HD11 LEU 12 HD11 LEU 12 21.063 7.755 0.956 73 HD12 LEU 12 HD12 LEU 12 19.866 8.161 -0.273 74 HD13 LEU 12 HD13 LEU 12 19.510 6.921 0.929 75 HD21 LEU 12 HD21 LEU 12 21.453 9.586 1.778 76 HD22 LEU 12 HD22 LEU 12 20.651 9.455 3.344 77 HD23 LEU 12 HD23 LEU 12 20.268 10.798 2.264 78 H MET 13 H MET 13 16.995 6.772 1.150 79 HA MET 13 HA MET 13 16.242 7.070 3.960 80 HB2 MET 13 HB2 MET 13 14.486 5.374 3.760 81 HB3 MET 13 HB3 MET 13 14.132 6.775 2.760 82 HG2 MET 13 HG2 MET 13 14.336 5.626 0.826 83 HG3 MET 13 HG3 MET 13 15.584 4.557 1.463 84 HE1 MET 13 HE1 MET 13 15.209 2.743 3.107 85 HE2 MET 13 HE2 MET 13 13.945 3.309 4.198 86 HE3 MET 13 HE3 MET 13 13.722 1.813 3.290 87 H VAL 14 H VAL 14 16.865 5.355 5.289 88 HA VAL 14 HA VAL 14 18.857 3.570 4.081 89 HB VAL 14 HB VAL 14 18.443 4.349 6.971 90 HG11 VAL 14 HG11 VAL 14 20.440 2.510 5.668 91 HG12 VAL 14 HG12 VAL 14 20.667 3.202 7.276 92 HG13 VAL 14 HG13 VAL 14 19.298 2.135 6.958 93 HG21 VAL 14 HG21 VAL 14 19.815 6.059 6.605 94 HG22 VAL 14 HG22 VAL 14 21.007 5.005 5.842 95 HG23 VAL 14 HG23 VAL 14 19.710 5.712 4.879 96 H LYS 15 H LYS 15 18.323 1.525 3.747 97 HA LYS 15 HA LYS 15 16.166 0.344 5.368 98 HB2 LYS 15 HB2 LYS 15 15.544 0.421 3.050 99 HB3 LYS 15 HB3 LYS 15 17.085 -0.267 2.557 100 HG2 LYS 15 HG2 LYS 15 15.392 -1.951 2.401 101 HG3 LYS 15 HG3 LYS 15 16.479 -2.359 3.731 102 HD2 LYS 15 HD2 LYS 15 14.194 -0.713 4.527 103 HD3 LYS 15 HD3 LYS 15 13.745 -2.292 3.878 104 HE2 LYS 15 HE2 LYS 15 15.769 -3.006 5.505 105 HE3 LYS 15 HE3 LYS 15 15.169 -1.592 6.368 106 HZ1 LYS 15 HZ1 LYS 15 13.892 -3.260 7.250 107 HZ2 LYS 15 HZ2 LYS 15 13.810 -4.136 5.806 108 HZ3 LYS 15 HZ3 LYS 15 12.884 -2.733 5.997 109 H VAL 16 H VAL 16 16.993 -0.858 6.951 110 HA VAL 16 HA VAL 16 19.178 -2.718 6.283 111 HB VAL 16 HB VAL 16 18.821 -1.245 8.896 112 HG11 VAL 16 HG11 VAL 16 20.114 -3.716 8.300 113 HG12 VAL 16 HG12 VAL 16 21.337 -2.515 8.720 114 HG13 VAL 16 HG13 VAL 16 20.017 -2.860 9.838 115 HG21 VAL 16 HG21 VAL 16 20.942 -0.169 8.339 116 HG22 VAL 16 HG22 VAL 16 20.977 -1.022 6.796 117 HG23 VAL 16 HG23 VAL 16 19.717 0.170 7.116 118 H LEU 17 H LEU 17 18.541 -4.754 6.460 119 HA LEU 17 HA LEU 17 16.745 -5.510 8.647 120 HB2 LEU 17 HB2 LEU 17 15.237 -6.647 7.301 121 HB3 LEU 17 HB3 LEU 17 15.535 -5.151 6.419 122 HG LEU 17 HG LEU 17 17.389 -6.964 5.396 123 HD11 LEU 17 HD11 LEU 17 14.902 -8.410 4.951 124 HD12 LEU 17 HD12 LEU 17 15.472 -8.505 6.617 125 HD13 LEU 17 HD13 LEU 17 16.522 -9.016 5.295 126 HD21 LEU 17 HD21 LEU 17 16.423 -6.423 3.404 127 HD22 LEU 17 HD22 LEU 17 15.748 -5.138 4.407 128 HD23 LEU 17 HD23 LEU 17 14.781 -6.565 4.032 129 H ASP 18 H ASP 18 16.891 -7.705 9.286 130 HA ASP 18 HA ASP 18 19.508 -8.849 8.803 131 HB2 ASP 18 HB2 ASP 18 17.333 -9.240 10.786 132 HB3 ASP 18 HB3 ASP 18 18.362 -10.630 10.453 133 H ALA 19 H ALA 19 19.806 -10.081 7.071 134 HA ALA 19 HA ALA 19 17.752 -11.323 5.599 135 HB1 ALA 19 HB1 ALA 19 19.362 -11.727 4.102 136 HB2 ALA 19 HB2 ALA 19 20.399 -10.777 5.166 137 HB3 ALA 19 HB3 ALA 19 20.388 -12.536 5.286 138 H VAL 20 H VAL 20 19.287 -12.234 8.486 139 HA VAL 20 HA VAL 20 19.345 -15.017 8.327 140 HB VAL 20 HB VAL 20 18.745 -13.301 10.740 141 HG11 VAL 20 HG11 VAL 20 19.584 -15.265 12.019 142 HG12 VAL 20 HG12 VAL 20 18.055 -15.555 11.186 143 HG13 VAL 20 HG13 VAL 20 19.557 -16.196 10.520 144 HG21 VAL 20 HG21 VAL 20 21.206 -13.987 9.286 145 HG22 VAL 20 HG22 VAL 20 20.851 -12.613 10.331 146 HG23 VAL 20 HG23 VAL 20 21.293 -14.167 11.037 147 H ARG 21 H ARG 21 16.721 -12.873 9.405 148 HA ARG 21 HA ARG 21 14.875 -15.158 9.177 149 HB2 ARG 21 HB2 ARG 21 14.276 -12.662 10.740 150 HB3 ARG 21 HB3 ARG 21 13.544 -14.254 10.886 151 HG2 ARG 21 HG2 ARG 21 14.862 -14.335 12.717 152 HG3 ARG 21 HG3 ARG 21 16.049 -14.893 11.535 153 HD2 ARG 21 HD2 ARG 21 16.950 -12.659 11.330 154 HD3 ARG 21 HD3 ARG 21 15.699 -12.026 12.400 155 HE ARG 21 HE ARG 21 18.126 -13.319 13.170 156 HH11 ARG 21 HH11 ARG 21 14.813 -12.777 14.093 157 HH12 ARG 21 HH12 ARG 21 15.112 -12.997 15.785 158 HH21 ARG 21 HH21 ARG 21 18.532 -13.610 15.397 159 HH22 ARG 21 HH22 ARG 21 17.227 -13.470 16.526 160 H GLY 22 H GLY 22 15.705 -12.064 7.982 161 HA2 GLY 22 HA2 GLY 22 14.872 -11.194 5.951 162 HA3 GLY 22 HA3 GLY 22 13.425 -12.171 6.154 163 H SER 23 H SER 23 14.084 -10.732 9.061 164 HA SER 23 HA SER 23 12.023 -8.713 8.589 165 HB2 SER 23 HB2 SER 23 12.646 -8.653 11.295 166 HB3 SER 23 HB3 SER 23 11.308 -9.534 10.557 167 HG SER 23 HG SER 23 12.280 -11.250 11.260 168 HA PRO 24 HA PRO 24 14.655 -5.216 8.851 169 HB2 PRO 24 HB2 PRO 24 13.240 -3.506 10.414 170 HB3 PRO 24 HB3 PRO 24 12.776 -3.898 8.754 171 HG2 PRO 24 HG2 PRO 24 11.714 -4.996 11.329 172 HG3 PRO 24 HG3 PRO 24 10.829 -4.502 9.873 173 HD2 PRO 24 HD2 PRO 24 11.376 -7.093 10.436 174 HD3 PRO 24 HD3 PRO 24 11.283 -6.477 8.774 175 H ALA 25 H ALA 25 16.207 -4.189 10.109 176 HA ALA 25 HA ALA 25 16.681 -5.413 12.719 177 HB1 ALA 25 HB1 ALA 25 18.493 -5.445 11.065 178 HB2 ALA 25 HB2 ALA 25 18.503 -3.681 11.052 179 HB3 ALA 25 HB3 ALA 25 18.943 -4.555 12.519 180 H ILE 26 H ILE 26 16.638 -4.326 14.609 181 HA ILE 26 HA ILE 26 15.840 -1.499 14.500 182 HB ILE 26 HB ILE 26 15.180 -3.734 16.329 183 HG12 ILE 26 HG12 ILE 26 13.716 -2.469 14.556 184 HG13 ILE 26 HG13 ILE 26 13.011 -2.948 16.096 185 HG21 ILE 26 HG21 ILE 26 16.269 -2.406 17.942 186 HG22 ILE 26 HG22 ILE 26 15.617 -0.913 17.266 187 HG23 ILE 26 HG23 ILE 26 14.552 -2.040 18.107 188 HD11 ILE 26 HD11 ILE 26 12.384 -0.678 15.450 189 HD12 ILE 26 HD12 ILE 26 13.307 -0.704 16.952 190 HD13 ILE 26 HD13 ILE 26 14.085 -0.214 15.448 191 H ASN 27 H ASN 27 16.965 0.059 15.566 192 HA ASN 27 HA ASN 27 18.700 1.096 16.608 193 HB2 ASN 27 HB2 ASN 27 19.099 -1.520 18.072 194 HB3 ASN 27 HB3 ASN 27 19.651 0.073 18.581 195 HD21 ASN 27 HD21 ASN 27 17.315 1.507 17.906 196 HD22 ASN 27 HD22 ASN 27 16.073 1.046 19.015 197 H VAL 28 H VAL 28 19.420 0.507 14.205 198 HA VAL 28 HA VAL 28 21.999 -0.908 14.375 199 HB VAL 28 HB VAL 28 20.295 -0.393 11.933 200 HG11 VAL 28 HG11 VAL 28 21.905 -1.786 10.744 201 HG12 VAL 28 HG12 VAL 28 22.691 -0.363 11.431 202 HG13 VAL 28 HG13 VAL 28 22.874 -1.935 12.211 203 HG21 VAL 28 HG21 VAL 28 19.202 -2.234 12.529 204 HG22 VAL 28 HG22 VAL 28 20.702 -3.136 12.312 205 HG23 VAL 28 HG23 VAL 28 20.282 -2.494 13.900 206 H ALA 29 H ALA 29 23.601 0.504 14.641 207 HA ALA 29 HA ALA 29 23.538 3.228 14.078 208 HB1 ALA 29 HB1 ALA 29 25.294 1.552 15.318 209 HB2 ALA 29 HB2 ALA 29 26.196 2.020 13.876 210 HB3 ALA 29 HB3 ALA 29 25.589 3.257 14.977 211 H VAL 30 H VAL 30 23.719 4.384 12.271 212 HA VAL 30 HA VAL 30 25.029 3.200 9.929 213 HB VAL 30 HB VAL 30 22.336 4.566 9.817 214 HG11 VAL 30 HG11 VAL 30 24.347 4.245 7.855 215 HG12 VAL 30 HG12 VAL 30 23.024 3.154 7.441 216 HG13 VAL 30 HG13 VAL 30 22.714 4.878 7.653 217 HG21 VAL 30 HG21 VAL 30 21.967 2.087 8.778 218 HG22 VAL 30 HG22 VAL 30 23.135 1.750 10.056 219 HG23 VAL 30 HG23 VAL 30 21.604 2.534 10.445 220 H HIS 31 H HIS 31 26.337 4.578 8.894 221 HA HIS 31 HA HIS 31 26.022 7.460 9.419 222 HB2 HIS 31 HB2 HIS 31 28.702 6.121 9.083 223 HB3 HIS 31 HB3 HIS 31 28.362 7.741 9.685 224 HD1 HIS 31 HD1 HIS 31 28.104 7.999 12.159 225 HD2 HIS 31 HD2 HIS 31 27.959 4.025 10.955 226 HE1 HIS 31 HE1 HIS 31 28.105 6.652 14.283 227 H VAL 32 H VAL 32 25.655 8.548 7.614 228 HA VAL 32 HA VAL 32 26.487 7.386 5.052 229 HB VAL 32 HB VAL 32 24.624 9.723 5.455 230 HG11 VAL 32 HG11 VAL 32 24.058 8.165 3.153 231 HG12 VAL 32 HG12 VAL 32 24.636 9.830 3.238 232 HG13 VAL 32 HG13 VAL 32 25.790 8.497 3.172 233 HG21 VAL 32 HG21 VAL 32 23.645 7.881 6.632 234 HG22 VAL 32 HG22 VAL 32 22.793 8.066 5.098 235 HG23 VAL 32 HG23 VAL 32 23.985 6.781 5.296 236 H PHE 33 H PHE 33 27.780 8.458 3.615 237 HA PHE 33 HA PHE 33 28.782 11.108 4.382 238 HB2 PHE 33 HB2 PHE 33 30.421 8.653 3.781 239 HB3 PHE 33 HB3 PHE 33 31.082 10.274 3.597 240 HD1 PHE 33 HD1 PHE 33 29.346 8.123 6.091 241 HD2 PHE 33 HD2 PHE 33 32.108 11.286 5.396 242 HE1 PHE 33 HE1 PHE 33 29.899 8.163 8.489 243 HE2 PHE 33 HE2 PHE 33 32.666 11.331 7.792 244 HZ PHE 33 HZ PHE 33 31.561 9.767 9.341 245 H ARG 34 H ARG 34 30.023 12.147 2.574 246 HA ARG 34 HA ARG 34 29.047 11.272 -0.060 247 HB2 ARG 34 HB2 ARG 34 27.654 13.136 0.799 248 HB3 ARG 34 HB3 ARG 34 29.099 14.129 0.926 249 HG2 ARG 34 HG2 ARG 34 28.598 12.922 -1.714 250 HG3 ARG 34 HG3 ARG 34 27.450 14.154 -1.188 251 HD2 ARG 34 HD2 ARG 34 29.393 15.647 -0.706 252 HD3 ARG 34 HD3 ARG 34 30.441 14.431 -1.435 253 HE ARG 34 HE ARG 34 28.831 16.331 -2.803 254 HH11 ARG 34 HH11 ARG 34 30.043 13.073 -2.992 255 HH12 ARG 34 HH12 ARG 34 29.984 13.013 -4.723 256 HH21 ARG 34 HH21 ARG 34 28.747 16.264 -5.081 257 HH22 ARG 34 HH22 ARG 34 29.248 14.829 -5.910 258 H LYS 35 H LYS 35 30.429 11.574 -1.770 259 HA LYS 35 HA LYS 35 33.188 11.684 -1.228 260 HB2 LYS 35 HB2 LYS 35 32.701 10.513 -3.161 261 HB3 LYS 35 HB3 LYS 35 31.519 11.696 -3.706 262 HG2 LYS 35 HG2 LYS 35 33.513 11.686 -5.112 263 HG3 LYS 35 HG3 LYS 35 33.296 13.237 -4.299 264 HD2 LYS 35 HD2 LYS 35 35.642 12.473 -4.275 265 HD3 LYS 35 HD3 LYS 35 34.971 12.649 -2.652 266 HE2 LYS 35 HE2 LYS 35 34.549 9.987 -3.718 267 HE3 LYS 35 HE3 LYS 35 36.259 10.418 -3.690 268 HZ1 LYS 35 HZ1 LYS 35 35.947 9.550 -1.604 269 HZ2 LYS 35 HZ2 LYS 35 34.375 10.155 -1.449 270 HZ3 LYS 35 HZ3 LYS 35 35.700 11.195 -1.298 271 H ALA 36 H ALA 36 34.242 13.431 -0.555 272 HA ALA 36 HA ALA 36 33.332 16.091 -1.054 273 HB1 ALA 36 HB1 ALA 36 36.081 15.424 -0.067 274 HB2 ALA 36 HB2 ALA 36 35.055 16.803 0.337 275 HB3 ALA 36 HB3 ALA 36 34.665 15.200 0.961 276 H ALA 37 H ALA 37 34.588 17.769 -2.112 277 HA ALA 37 HA ALA 37 35.302 17.114 -4.740 278 HB1 ALA 37 HB1 ALA 37 35.832 19.386 -5.036 279 HB2 ALA 37 HB2 ALA 37 34.540 19.360 -3.836 280 HB3 ALA 37 HB3 ALA 37 36.211 19.605 -3.327 281 H ASP 38 H ASP 38 37.117 17.018 -1.829 282 HA ASP 38 HA ASP 38 39.677 17.019 -3.234 283 HB2 ASP 38 HB2 ASP 38 38.822 17.285 -0.396 284 HB3 ASP 38 HB3 ASP 38 40.403 16.570 -0.702 285 H ASP 39 H ASP 39 37.515 14.851 -3.280 286 HA ASP 39 HA ASP 39 37.445 12.583 -3.452 287 HB2 ASP 39 HB2 ASP 39 39.571 12.967 -4.714 288 HB3 ASP 39 HB3 ASP 39 40.457 12.706 -3.215 289 H THR 40 H THR 40 36.997 13.640 -0.937 290 HA THR 40 HA THR 40 38.156 11.561 0.803 291 HB THR 40 HB THR 40 38.222 13.041 2.656 292 HG1 THR 40 HG1 THR 40 37.255 15.036 2.653 293 HG21 THR 40 HG21 THR 40 39.705 14.841 1.895 294 HG22 THR 40 HG22 THR 40 39.200 14.553 0.231 295 HG23 THR 40 HG23 THR 40 40.094 13.313 1.108 296 H TRP 41 H TRP 41 36.724 11.516 2.942 297 HA TRP 41 HA TRP 41 33.967 11.107 2.014 298 HB2 TRP 41 HB2 TRP 41 35.573 9.836 4.226 299 HB3 TRP 41 HB3 TRP 41 33.822 9.668 4.126 300 HD1 TRP 41 HD1 TRP 41 36.083 9.557 1.021 301 HE1 TRP 41 HE1 TRP 41 35.908 7.213 -0.028 302 HE3 TRP 41 HE3 TRP 41 33.268 7.264 4.620 303 HZ2 TRP 41 HZ2 TRP 41 34.733 4.722 0.589 304 HZ3 TRP 41 HZ3 TRP 41 32.661 4.900 4.314 305 HH2 TRP 41 HH2 TRP 41 33.378 3.657 2.340 306 H GLU 42 H GLU 42 32.747 12.834 2.457 307 HA GLU 42 HA GLU 42 33.167 14.291 4.961 308 HB2 GLU 42 HB2 GLU 42 31.752 14.927 2.391 309 HB3 GLU 42 HB3 GLU 42 31.392 15.834 3.853 310 HG2 GLU 42 HG2 GLU 42 34.241 15.535 3.122 311 HG3 GLU 42 HG3 GLU 42 33.251 16.582 2.108 312 HA PRO 43 HA PRO 43 29.640 12.602 6.956 313 HB2 PRO 43 HB2 PRO 43 28.878 14.707 8.492 314 HB3 PRO 43 HB3 PRO 43 30.318 13.741 8.833 315 HG2 PRO 43 HG2 PRO 43 30.099 16.393 7.463 316 HG3 PRO 43 HG3 PRO 43 31.277 15.853 8.674 317 HD2 PRO 43 HD2 PRO 43 31.839 15.933 6.026 318 HD3 PRO 43 HD3 PRO 43 32.546 14.722 7.116 319 H PHE 44 H PHE 44 27.805 12.204 5.891 320 HA PHE 44 HA PHE 44 26.319 14.446 4.718 321 HB2 PHE 44 HB2 PHE 44 26.928 12.635 3.173 322 HB3 PHE 44 HB3 PHE 44 26.079 11.477 4.191 323 HD1 PHE 44 HD2 PHE 44 23.603 11.637 4.423 324 HD2 PHE 44 HD1 PHE 44 25.782 13.947 1.589 325 HE1 PHE 44 HE2 PHE 44 21.524 12.063 3.178 326 HE2 PHE 44 HE1 PHE 44 23.708 14.378 0.340 327 HZ PHE 44 HZ PHE 44 21.574 13.436 1.133 328 H ALA 45 H ALA 45 25.789 11.460 6.576 329 HA ALA 45 HA ALA 45 23.832 12.749 8.235 330 HB1 ALA 45 HB1 ALA 45 22.609 12.118 6.086 331 HB2 ALA 45 HB2 ALA 45 22.798 10.446 6.612 332 HB3 ALA 45 HB3 ALA 45 21.897 11.586 7.610 333 H SER 46 H SER 46 22.719 10.958 9.655 334 HA SER 46 HA SER 46 24.087 8.513 10.064 335 HB2 SER 46 HB2 SER 46 25.910 9.362 11.114 336 HB3 SER 46 HB3 SER 46 25.120 10.902 11.454 337 HG SER 46 HG SER 46 24.550 10.184 13.352 338 H GLY 47 H GLY 47 23.176 7.260 11.751 339 HA2 GLY 47 HA2 GLY 47 21.493 7.985 13.767 340 HA3 GLY 47 HA3 GLY 47 20.454 7.980 12.349 341 H LYS 48 H LYS 48 19.558 6.309 14.049 342 HA LYS 48 HA LYS 48 20.706 3.669 13.425 343 HB2 LYS 48 HB2 LYS 48 19.472 4.814 15.852 344 HB3 LYS 48 HB3 LYS 48 18.996 3.165 15.470 345 HG2 LYS 48 HG2 LYS 48 21.305 2.454 15.490 346 HG3 LYS 48 HG3 LYS 48 21.838 4.115 15.762 347 HD2 LYS 48 HD2 LYS 48 20.093 2.515 17.634 348 HD3 LYS 48 HD3 LYS 48 21.827 2.776 17.831 349 HE2 LYS 48 HE2 LYS 48 20.875 5.325 17.501 350 HE3 LYS 48 HE3 LYS 48 19.576 4.550 18.407 351 HZ1 LYS 48 HZ1 LYS 48 21.326 5.601 19.799 352 HZ2 LYS 48 HZ2 LYS 48 22.428 4.457 19.219 353 HZ3 LYS 48 HZ3 LYS 48 21.089 3.958 20.124 354 H THR 49 H THR 49 19.537 2.259 12.282 355 HA THR 49 HA THR 49 17.255 2.973 10.877 356 HB THR 49 HB THR 49 17.028 0.658 10.238 357 HG1 THR 49 HG1 THR 49 17.685 -0.943 11.488 358 HG21 THR 49 HG21 THR 49 19.763 0.257 10.139 359 HG22 THR 49 HG22 THR 49 19.605 2.009 10.264 360 HG23 THR 49 HG23 THR 49 18.799 1.142 8.958 361 H SER 50 H SER 50 15.161 1.604 10.971 362 HA SER 50 HA SER 50 14.259 1.388 13.766 363 HB2 SER 50 HB2 SER 50 12.675 2.546 11.459 364 HB3 SER 50 HB3 SER 50 12.098 2.350 13.114 365 HG SER 50 HG SER 50 14.408 3.858 12.496 366 H GLU 51 H GLU 51 12.019 0.240 13.805 367 HA GLU 51 HA GLU 51 12.412 -2.370 12.764 368 HB2 GLU 51 HB2 GLU 51 10.061 -2.747 13.648 369 HB3 GLU 51 HB3 GLU 51 11.261 -2.224 14.821 370 HG2 GLU 51 HG2 GLU 51 10.043 -0.461 15.356 371 HG3 GLU 51 HG3 GLU 51 9.987 0.065 13.674 372 H SER 52 H SER 52 11.249 0.411 11.331 373 HA SER 52 HA SER 52 9.501 -1.042 9.475 374 HB2 SER 52 HB2 SER 52 8.483 0.944 10.400 375 HB3 SER 52 HB3 SER 52 9.882 1.922 9.954 376 HG SER 52 HG SER 52 8.014 0.674 8.225 377 H GLY 53 H GLY 53 12.650 -0.517 9.709 378 HA2 GLY 53 HA2 GLY 53 14.358 -0.629 8.172 379 HA3 GLY 53 HA3 GLY 53 13.139 -0.873 6.930 380 H GLU 54 H GLU 54 12.757 1.926 8.864 381 HA GLU 54 HA GLU 54 14.060 3.588 6.818 382 HB2 GLU 54 HB2 GLU 54 12.191 5.130 6.825 383 HB3 GLU 54 HB3 GLU 54 11.626 3.520 6.407 384 HG2 GLU 54 HG2 GLU 54 10.902 3.226 8.765 385 HG3 GLU 54 HG3 GLU 54 11.335 4.909 9.058 386 H LEU 55 H LEU 55 14.764 5.655 7.525 387 HA LEU 55 HA LEU 55 14.922 5.945 10.452 388 HB2 LEU 55 HB2 LEU 55 17.023 5.580 8.588 389 HB3 LEU 55 HB3 LEU 55 17.123 7.236 9.184 390 HG LEU 55 HG LEU 55 16.897 4.959 11.113 391 HD11 LEU 55 HD11 LEU 55 19.232 5.674 9.427 392 HD12 LEU 55 HD12 LEU 55 18.740 4.112 10.081 393 HD13 LEU 55 HD13 LEU 55 19.522 5.299 11.127 394 HD21 LEU 55 HD21 LEU 55 17.489 7.820 11.170 395 HD22 LEU 55 HD22 LEU 55 18.620 6.838 12.101 396 HD23 LEU 55 HD23 LEU 55 16.892 6.757 12.444 397 H HIS 56 H HIS 56 14.920 8.057 11.282 398 HA HIS 56 HA HIS 56 13.956 10.097 9.387 399 HB2 HIS 56 HB2 HIS 56 12.835 11.114 11.407 400 HB3 HIS 56 HB3 HIS 56 12.187 9.558 10.897 401 HD1 HIS 56 HD1 HIS 56 12.957 7.459 12.377 402 HD2 HIS 56 HD2 HIS 56 13.704 11.211 13.997 403 HE1 HIS 56 HE1 HIS 56 13.392 7.061 14.822 404 H GLY 57 H GLY 57 15.161 11.865 9.139 405 HA2 GLY 57 HA2 GLY 57 16.342 13.723 10.194 406 HA3 GLY 57 HA3 GLY 57 17.077 12.551 11.279 407 H LEU 58 H LEU 58 17.414 10.690 8.918 408 HA LEU 58 HA LEU 58 20.079 11.256 8.341 409 HB2 LEU 58 HB2 LEU 58 18.014 9.466 7.169 410 HB3 LEU 58 HB3 LEU 58 19.511 9.711 6.273 411 HG LEU 58 HG LEU 58 19.416 7.664 7.742 412 HD11 LEU 58 HD11 LEU 58 21.702 7.872 8.447 413 HD12 LEU 58 HD12 LEU 58 21.606 9.631 8.384 414 HD13 LEU 58 HD13 LEU 58 21.508 8.689 6.896 415 HD21 LEU 58 HD21 LEU 58 19.982 9.476 10.044 416 HD22 LEU 58 HD22 LEU 58 19.428 7.801 10.040 417 HD23 LEU 58 HD23 LEU 58 18.312 9.102 9.620 418 H THR 59 H THR 59 17.177 12.452 6.904 419 HA THR 59 HA THR 59 18.197 13.230 4.389 420 HB THR 59 HB THR 59 16.259 14.671 4.196 421 HG1 THR 59 HG1 THR 59 15.974 15.662 6.108 422 HG21 THR 59 HG21 THR 59 14.896 12.919 3.924 423 HG22 THR 59 HG22 THR 59 14.867 12.583 5.655 424 HG23 THR 59 HG23 THR 59 16.166 11.936 4.653 425 H THR 60 H THR 60 19.106 15.118 3.670 426 HA THR 60 HA THR 60 19.505 17.341 5.493 427 HB THR 60 HB THR 60 21.987 17.366 5.049 428 HG1 THR 60 HG1 THR 60 21.318 14.825 4.002 429 HG21 THR 60 HG21 THR 60 21.290 14.871 6.548 430 HG22 THR 60 HG22 THR 60 20.745 16.439 7.144 431 HG23 THR 60 HG23 THR 60 22.468 16.121 6.945 432 H GLU 61 H GLU 61 20.705 19.153 4.383 433 HA GLU 61 HA GLU 61 19.515 19.611 1.830 434 HB2 GLU 61 HB2 GLU 61 20.756 21.769 1.916 435 HB3 GLU 61 HB3 GLU 61 19.771 21.465 3.341 436 HG2 GLU 61 HG2 GLU 61 21.645 20.978 4.666 437 HG3 GLU 61 HG3 GLU 61 22.697 20.815 3.262 438 H GLU 62 H GLU 62 22.381 18.119 2.820 439 HA GLU 62 HA GLU 62 23.990 18.812 0.545 440 HB2 GLU 62 HB2 GLU 62 24.273 17.123 2.945 441 HB3 GLU 62 HB3 GLU 62 25.153 16.560 1.531 442 HG2 GLU 62 HG2 GLU 62 25.401 19.244 2.865 443 HG3 GLU 62 HG3 GLU 62 26.588 17.941 2.867 444 H GLU 63 H GLU 63 21.302 16.948 0.844 445 HA GLU 63 HA GLU 63 21.964 14.627 -0.627 446 HB2 GLU 63 HB2 GLU 63 19.580 14.300 -0.869 447 HB3 GLU 63 HB3 GLU 63 19.928 14.850 0.763 448 HG2 GLU 63 HG2 GLU 63 19.395 17.199 -0.160 449 HG3 GLU 63 HG3 GLU 63 18.626 16.325 -1.484 450 H PHE 64 H PHE 64 21.662 17.865 -1.559 451 HA PHE 64 HA PHE 64 20.890 17.294 -4.299 452 HB2 PHE 64 HB2 PHE 64 20.407 19.442 -2.777 453 HB3 PHE 64 HB3 PHE 64 21.912 19.976 -3.518 454 HD1 PHE 64 HD1 PHE 64 21.723 18.893 -6.214 455 HD2 PHE 64 HD2 PHE 64 18.727 20.672 -3.769 456 HE1 PHE 64 HE1 PHE 64 20.489 19.576 -8.230 457 HE2 PHE 64 HE2 PHE 64 17.487 21.357 -5.781 458 HZ PHE 64 HZ PHE 64 18.367 20.808 -8.015 459 H VAL 65 H VAL 65 23.091 15.865 -3.856 460 HA VAL 65 HA VAL 65 25.289 17.416 -5.060 461 HB VAL 65 HB VAL 65 26.796 15.625 -4.202 462 HG11 VAL 65 HG11 VAL 65 25.185 17.368 -2.388 463 HG12 VAL 65 HG12 VAL 65 26.404 16.287 -1.710 464 HG13 VAL 65 HG13 VAL 65 26.871 17.517 -2.884 465 HG21 VAL 65 HG21 VAL 65 24.787 14.714 -2.250 466 HG22 VAL 65 HG22 VAL 65 24.567 14.132 -3.900 467 HG23 VAL 65 HG23 VAL 65 26.080 13.821 -3.050 468 H GLU 66 H GLU 66 26.879 15.625 -6.136 469 HA GLU 66 HA GLU 66 25.782 14.950 -8.565 470 HB2 GLU 66 HB2 GLU 66 28.110 13.724 -7.088 471 HB3 GLU 66 HB3 GLU 66 27.703 13.303 -8.745 472 HG2 GLU 66 HG2 GLU 66 27.775 16.014 -8.886 473 HG3 GLU 66 HG3 GLU 66 29.012 15.689 -7.672 474 H GLY 67 H GLY 67 26.202 12.832 -5.736 475 HA2 GLY 67 HA2 GLY 67 23.976 11.451 -5.574 476 HA3 GLY 67 HA3 GLY 67 24.606 10.765 -7.065 477 H ILE 68 H ILE 68 27.355 11.347 -5.633 478 HA ILE 68 HA ILE 68 27.804 8.669 -4.839 479 HB ILE 68 HB ILE 68 29.513 11.072 -4.193 480 HG12 ILE 68 HG12 ILE 68 29.736 9.220 -6.572 481 HG13 ILE 68 HG13 ILE 68 28.950 10.794 -6.635 482 HG21 ILE 68 HG21 ILE 68 31.334 9.328 -4.257 483 HG22 ILE 68 HG22 ILE 68 30.220 9.227 -2.894 484 HG23 ILE 68 HG23 ILE 68 30.054 8.114 -4.252 485 HD11 ILE 68 HD11 ILE 68 31.089 11.184 -7.450 486 HD12 ILE 68 HD12 ILE 68 31.174 11.719 -5.771 487 HD13 ILE 68 HD13 ILE 68 31.844 10.154 -6.233 488 H TYR 69 H TYR 69 27.273 7.710 -3.000 489 HA TYR 69 HA TYR 69 27.350 9.239 -0.505 490 HB2 TYR 69 HB2 TYR 69 25.009 7.515 -1.346 491 HB3 TYR 69 HB3 TYR 69 25.195 8.302 0.218 492 HD1 TYR 69 HD2 TYR 69 25.860 10.968 -0.176 493 HD2 TYR 69 HD1 TYR 69 23.458 8.530 -2.703 494 HE1 TYR 69 HE2 TYR 69 24.748 12.980 -1.052 495 HE2 TYR 69 HE1 TYR 69 22.340 10.534 -3.587 496 HH TYR 69 HH TYR 69 22.872 13.695 -2.201 497 H LYS 70 H LYS 70 28.457 8.180 0.994 498 HA LYS 70 HA LYS 70 28.791 5.268 0.695 499 HB2 LYS 70 HB2 LYS 70 30.614 7.363 1.877 500 HB3 LYS 70 HB3 LYS 70 30.873 5.636 2.095 501 HG2 LYS 70 HG2 LYS 70 32.235 6.080 0.306 502 HG3 LYS 70 HG3 LYS 70 30.753 5.575 -0.508 503 HD2 LYS 70 HD2 LYS 70 30.895 7.493 -1.645 504 HD3 LYS 70 HD3 LYS 70 30.394 8.287 -0.149 505 HE2 LYS 70 HE2 LYS 70 32.318 9.445 -0.689 506 HE3 LYS 70 HE3 LYS 70 32.926 8.221 0.425 507 HZ1 LYS 70 HZ1 LYS 70 33.056 7.038 -2.036 508 HZ2 LYS 70 HZ2 LYS 70 34.354 7.691 -1.172 509 HZ3 LYS 70 HZ3 LYS 70 33.551 8.629 -2.328 510 H VAL 71 H VAL 71 27.325 4.327 1.990 511 HA VAL 71 HA VAL 71 26.914 5.401 4.689 512 HB VAL 71 HB VAL 71 25.313 3.349 3.156 513 HG11 VAL 71 HG11 VAL 71 25.153 4.367 5.954 514 HG12 VAL 71 HG12 VAL 71 23.663 3.958 5.101 515 HG13 VAL 71 HG13 VAL 71 24.912 2.734 5.334 516 HG21 VAL 71 HG21 VAL 71 23.684 5.494 3.706 517 HG22 VAL 71 HG22 VAL 71 25.225 6.258 3.313 518 HG23 VAL 71 HG23 VAL 71 24.464 5.162 2.159 519 H GLU 72 H GLU 72 27.379 4.254 6.505 520 HA GLU 72 HA GLU 72 28.549 1.576 6.142 521 HB2 GLU 72 HB2 GLU 72 30.336 2.052 7.543 522 HB3 GLU 72 HB3 GLU 72 30.152 3.557 6.653 523 HG2 GLU 72 HG2 GLU 72 28.615 4.204 8.672 524 HG3 GLU 72 HG3 GLU 72 29.538 2.949 9.499 525 H ILE 73 H ILE 73 27.919 0.019 7.543 526 HA ILE 73 HA ILE 73 26.001 0.814 9.633 527 HB ILE 73 HB ILE 73 26.169 -1.831 8.184 528 HG12 ILE 73 HG12 ILE 73 23.712 -0.327 7.857 529 HG13 ILE 73 HG13 ILE 73 25.100 0.598 7.295 530 HG21 ILE 73 HG21 ILE 73 24.702 -0.900 10.547 531 HG22 ILE 73 HG22 ILE 73 23.717 -1.733 9.345 532 HG23 ILE 73 HG23 ILE 73 25.123 -2.536 10.041 533 HD11 ILE 73 HD11 ILE 73 23.954 -0.806 5.568 534 HD12 ILE 73 HD12 ILE 73 25.688 -1.077 5.732 535 HD13 ILE 73 HD13 ILE 73 24.547 -2.224 6.431 536 H ASP 74 H ASP 74 26.457 0.337 11.686 537 HA ASP 74 HA ASP 74 28.876 -1.212 12.240 538 HB2 ASP 74 HB2 ASP 74 27.910 1.165 13.287 539 HB3 ASP 74 HB3 ASP 74 27.547 -0.013 14.545 540 H THR 75 H THR 75 28.285 -3.332 12.154 541 HA THR 75 HA THR 75 25.886 -4.267 13.474 542 HB THR 75 HB THR 75 26.416 -6.441 12.628 543 HG1 THR 75 HG1 THR 75 28.547 -6.758 12.913 544 HG21 THR 75 HG21 THR 75 25.710 -4.571 11.012 545 HG22 THR 75 HG22 THR 75 26.373 -6.050 10.315 546 HG23 THR 75 HG23 THR 75 27.381 -4.609 10.451 547 H LYS 76 H LYS 76 29.207 -3.855 14.242 548 HA LYS 76 HA LYS 76 29.727 -5.834 16.086 549 HB2 LYS 76 HB2 LYS 76 31.281 -4.251 17.147 550 HB3 LYS 76 HB3 LYS 76 31.404 -4.204 15.394 551 HG2 LYS 76 HG2 LYS 76 31.365 -1.982 15.759 552 HG3 LYS 76 HG3 LYS 76 29.620 -2.246 15.746 553 HD2 LYS 76 HD2 LYS 76 29.874 -1.030 17.685 554 HD3 LYS 76 HD3 LYS 76 29.967 -2.681 18.303 555 HE2 LYS 76 HE2 LYS 76 31.791 -1.752 19.330 556 HE3 LYS 76 HE3 LYS 76 32.535 -2.360 17.852 557 HZ1 LYS 76 HZ1 LYS 76 32.617 0.216 18.780 558 HZ2 LYS 76 HZ2 LYS 76 31.509 0.274 17.503 559 HZ3 LYS 76 HZ3 LYS 76 33.073 -0.311 17.238 560 H SER 77 H SER 77 27.912 -2.837 16.537 561 HA SER 77 HA SER 77 27.395 -3.487 19.327 562 HB2 SER 77 HB2 SER 77 27.306 -1.085 17.683 563 HB3 SER 77 HB3 SER 77 25.859 -1.259 18.678 564 HG SER 77 HG SER 77 27.198 -0.321 20.061 565 H TYR 78 H TYR 78 26.008 -4.059 16.303 566 HA TYR 78 HA TYR 78 23.258 -4.085 17.133 567 HB2 TYR 78 HB2 TYR 78 23.817 -3.647 14.802 568 HB3 TYR 78 HB3 TYR 78 24.603 -5.216 14.670 569 HD1 TYR 78 HD1 TYR 78 21.280 -3.870 15.754 570 HD2 TYR 78 HD2 TYR 78 23.404 -6.846 13.576 571 HE1 TYR 78 HE1 TYR 78 19.147 -4.874 15.055 572 HE2 TYR 78 HE2 TYR 78 21.275 -7.856 12.869 573 HH TYR 78 HH TYR 78 18.268 -6.963 14.257 574 H TRP 79 H TRP 79 25.786 -6.500 16.612 575 HA TRP 79 HA TRP 79 24.082 -8.725 17.203 576 HB2 TRP 79 HB2 TRP 79 25.981 -10.079 16.900 577 HB3 TRP 79 HB3 TRP 79 26.234 -8.728 15.797 578 HD1 TRP 79 HD1 TRP 79 28.370 -7.278 16.143 579 HE1 TRP 79 HE1 TRP 79 30.355 -7.371 17.779 580 HE3 TRP 79 HE3 TRP 79 26.540 -10.729 19.442 581 HZ2 TRP 79 HZ2 TRP 79 31.053 -8.730 20.154 582 HZ3 TRP 79 HZ3 TRP 79 27.930 -11.370 21.369 583 HH2 TRP 79 HH2 TRP 79 30.139 -10.391 21.715 584 H LYS 80 H LYS 80 25.975 -6.516 19.056 585 HA LYS 80 HA LYS 80 26.178 -8.194 21.387 586 HB2 LYS 80 HB2 LYS 80 27.422 -6.501 22.332 587 HB3 LYS 80 HB3 LYS 80 27.692 -6.187 20.623 588 HG2 LYS 80 HG2 LYS 80 27.155 -4.086 21.206 589 HG3 LYS 80 HG3 LYS 80 25.503 -4.681 21.026 590 HD2 LYS 80 HD2 LYS 80 25.412 -3.683 23.105 591 HD3 LYS 80 HD3 LYS 80 25.776 -5.356 23.534 592 HE2 LYS 80 HE2 LYS 80 28.228 -4.657 23.479 593 HE3 LYS 80 HE3 LYS 80 27.637 -2.996 23.452 594 HZ1 LYS 80 HZ1 LYS 80 26.749 -4.901 25.526 595 HZ2 LYS 80 HZ2 LYS 80 26.716 -3.210 25.560 596 HZ3 LYS 80 HZ3 LYS 80 28.189 -4.030 25.700 597 H ALA 81 H ALA 81 23.827 -6.102 20.043 598 HA ALA 81 HA ALA 81 22.480 -5.620 22.575 599 HB1 ALA 81 HB1 ALA 81 22.439 -4.439 19.948 600 HB2 ALA 81 HB2 ALA 81 20.803 -4.801 20.502 601 HB3 ALA 81 HB3 ALA 81 21.862 -3.787 21.482 602 H LEU 82 H LEU 82 21.891 -7.376 19.545 603 HA LEU 82 HA LEU 82 19.557 -8.667 20.749 604 HB2 LEU 82 HB2 LEU 82 20.615 -8.775 17.928 605 HB3 LEU 82 HB3 LEU 82 19.121 -9.523 18.493 606 HG LEU 82 HG LEU 82 18.361 -7.613 17.442 607 HD11 LEU 82 HD11 LEU 82 17.534 -7.771 19.764 608 HD12 LEU 82 HD12 LEU 82 17.566 -6.117 19.155 609 HD13 LEU 82 HD13 LEU 82 18.817 -6.671 20.268 610 HD21 LEU 82 HD21 LEU 82 20.682 -6.695 17.126 611 HD22 LEU 82 HD22 LEU 82 20.524 -5.951 18.717 612 HD23 LEU 82 HD23 LEU 82 19.426 -5.492 17.415 613 H GLY 83 H GLY 83 22.726 -9.176 20.865 614 HA2 GLY 83 HA2 GLY 83 24.053 -11.002 21.279 615 HA3 GLY 83 HA3 GLY 83 22.566 -11.836 21.706 616 H ILE 84 H ILE 84 23.701 -10.531 18.599 617 HA ILE 84 HA ILE 84 23.015 -13.055 17.326 618 HB ILE 84 HB ILE 84 24.127 -10.606 15.969 619 HG12 ILE 84 HG12 ILE 84 22.158 -9.934 17.255 620 HG13 ILE 84 HG13 ILE 84 21.793 -9.942 15.533 621 HG21 ILE 84 HG21 ILE 84 22.944 -13.169 15.112 622 HG22 ILE 84 HG22 ILE 84 22.434 -11.739 14.216 623 HG23 ILE 84 HG23 ILE 84 24.146 -12.151 14.321 624 HD11 ILE 84 HD11 ILE 84 20.599 -12.006 15.739 625 HD12 ILE 84 HD12 ILE 84 21.089 -12.169 17.426 626 HD13 ILE 84 HD13 ILE 84 19.994 -10.872 16.947 627 H SER 85 H SER 85 24.491 -14.109 15.841 628 HA SER 85 HA SER 85 26.891 -14.855 16.937 629 HB2 SER 85 HB2 SER 85 26.918 -16.263 15.189 630 HB3 SER 85 HB3 SER 85 25.480 -15.441 14.585 631 HG SER 85 HG SER 85 26.651 -14.439 13.132 632 HA PRO 86 HA PRO 86 29.800 -11.636 16.271 633 HB2 PRO 86 HB2 PRO 86 32.084 -13.068 15.958 634 HB3 PRO 86 HB3 PRO 86 31.274 -12.882 17.517 635 HG2 PRO 86 HG2 PRO 86 31.171 -15.170 15.589 636 HG3 PRO 86 HG3 PRO 86 31.318 -15.202 17.357 637 HD2 PRO 86 HD2 PRO 86 28.971 -15.645 16.081 638 HD3 PRO 86 HD3 PRO 86 29.059 -14.869 17.675 639 H MET 87 H MET 87 31.053 -10.589 14.689 640 HA MET 87 HA MET 87 31.891 -11.685 12.262 641 HB2 MET 87 HB2 MET 87 29.620 -12.030 11.643 642 HB3 MET 87 HB3 MET 87 29.149 -10.432 12.208 643 HG2 MET 87 HG2 MET 87 29.248 -10.621 9.751 644 HG3 MET 87 HG3 MET 87 30.315 -9.381 10.406 645 HE1 MET 87 HE1 MET 87 31.288 -13.069 10.939 646 HE2 MET 87 HE2 MET 87 30.315 -13.242 9.479 647 HE3 MET 87 HE3 MET 87 32.055 -13.525 9.419 648 H HIS 88 H HIS 88 33.367 -10.332 11.468 649 HA HIS 88 HA HIS 88 33.207 -7.497 12.250 650 HB2 HIS 88 HB2 HIS 88 35.588 -9.278 11.732 651 HB3 HIS 88 HB3 HIS 88 35.716 -7.525 11.849 652 HD1 HIS 88 HD1 HIS 88 35.426 -6.468 14.190 653 HD2 HIS 88 HD2 HIS 88 35.169 -10.615 14.154 654 HE1 HIS 88 HE1 HIS 88 35.573 -7.172 16.600 655 H GLU 89 H GLU 89 31.706 -7.735 10.202 656 HA GLU 89 HA GLU 89 33.307 -6.772 7.948 657 HB2 GLU 89 HB2 GLU 89 31.243 -8.966 7.833 658 HB3 GLU 89 HB3 GLU 89 31.731 -8.056 6.412 659 HG2 GLU 89 HG2 GLU 89 33.995 -8.827 6.629 660 HG3 GLU 89 HG3 GLU 89 33.615 -9.626 8.153 661 H HIS 90 H HIS 90 32.341 -4.845 9.197 662 HA HIS 90 HA HIS 90 29.663 -4.183 9.202 663 HB2 HIS 90 HB2 HIS 90 30.437 -1.800 9.119 664 HB3 HIS 90 HB3 HIS 90 31.255 -2.780 10.332 665 HD1 HIS 90 HD1 HIS 90 33.748 -3.457 9.804 666 HD2 HIS 90 HD2 HIS 90 32.069 -0.709 7.181 667 HE1 HIS 90 HE1 HIS 90 35.683 -2.467 8.540 668 H ALA 91 H ALA 91 28.278 -4.274 7.566 669 HA ALA 91 HA ALA 91 29.040 -4.139 4.836 670 HB1 ALA 91 HB1 ALA 91 26.798 -4.512 4.324 671 HB2 ALA 91 HB2 ALA 91 27.007 -5.307 5.885 672 HB3 ALA 91 HB3 ALA 91 26.232 -3.725 5.797 673 H GLU 92 H GLU 92 28.749 -2.525 3.316 674 HA GLU 92 HA GLU 92 27.768 0.076 4.209 675 HB2 GLU 92 HB2 GLU 92 29.805 1.144 3.098 676 HB3 GLU 92 HB3 GLU 92 30.052 0.401 4.671 677 HG2 GLU 92 HG2 GLU 92 30.956 -1.596 3.577 678 HG3 GLU 92 HG3 GLU 92 30.735 -0.824 2.008 679 H VAL 93 H VAL 93 27.582 1.624 2.360 680 HA VAL 93 HA VAL 93 27.138 0.220 -0.190 681 HB VAL 93 HB VAL 93 25.317 2.289 1.048 682 HG11 VAL 93 HG11 VAL 93 24.910 2.780 -1.110 683 HG12 VAL 93 HG12 VAL 93 25.609 1.269 -1.695 684 HG13 VAL 93 HG13 VAL 93 23.960 1.295 -1.071 685 HG21 VAL 93 HG21 VAL 93 24.608 0.422 2.121 686 HG22 VAL 93 HG22 VAL 93 23.740 0.171 0.606 687 HG23 VAL 93 HG23 VAL 93 25.266 -0.664 0.898 688 H VAL 94 H VAL 94 28.593 1.023 -1.558 689 HA VAL 94 HA VAL 94 28.996 3.944 -1.605 690 HB VAL 94 HB VAL 94 31.018 1.821 -2.336 691 HG11 VAL 94 HG11 VAL 94 30.819 4.558 -3.068 692 HG12 VAL 94 HG12 VAL 94 32.172 4.383 -1.948 693 HG13 VAL 94 HG13 VAL 94 32.115 3.415 -3.421 694 HG21 VAL 94 HG21 VAL 94 30.669 1.916 0.065 695 HG22 VAL 94 HG22 VAL 94 32.238 2.604 -0.349 696 HG23 VAL 94 HG23 VAL 94 30.888 3.665 0.048 697 H PHE 95 H PHE 95 27.914 4.720 -3.297 698 HA PHE 95 HA PHE 95 28.227 3.349 -5.884 699 HB2 PHE 95 HB2 PHE 95 25.756 4.358 -4.550 700 HB3 PHE 95 HB3 PHE 95 25.871 4.500 -6.301 701 HD1 PHE 95 HD2 PHE 95 26.135 2.459 -7.685 702 HD2 PHE 95 HD1 PHE 95 25.361 2.277 -3.503 703 HE1 PHE 95 HE2 PHE 95 25.431 0.114 -7.921 704 HE2 PHE 95 HE1 PHE 95 24.657 -0.069 -3.733 705 HZ PHE 95 HZ PHE 95 24.690 -1.154 -5.944 706 H THR 96 H THR 96 28.172 4.712 -7.751 707 HA THR 96 HA THR 96 28.825 7.527 -7.158 708 HB THR 96 HB THR 96 30.826 6.373 -7.895 709 HG1 THR 96 HG1 THR 96 31.125 8.228 -8.868 710 HG21 THR 96 HG21 THR 96 30.362 5.757 -10.580 711 HG22 THR 96 HG22 THR 96 28.985 5.083 -9.708 712 HG23 THR 96 HG23 THR 96 30.626 4.620 -9.259 713 H ALA 97 H ALA 97 27.985 9.109 -8.477 714 HA ALA 97 HA ALA 97 25.611 8.396 -9.948 715 HB1 ALA 97 HB1 ALA 97 24.969 10.445 -9.396 716 HB2 ALA 97 HB2 ALA 97 26.516 10.671 -8.579 717 HB3 ALA 97 HB3 ALA 97 26.332 11.151 -10.266 718 H ASN 98 H ASN 98 25.186 9.140 -12.139 719 HA ASN 98 HA ASN 98 25.650 9.258 -14.362 720 HB2 ASN 98 HB2 ASN 98 27.070 11.230 -13.416 721 HB3 ASN 98 HB3 ASN 98 28.442 10.176 -13.749 722 HD21 ASN 98 HD21 ASN 98 29.373 11.096 -15.455 723 HD22 ASN 98 HD22 ASN 98 28.585 11.440 -16.955 724 H ASP 99 H ASP 99 26.070 6.806 -13.026 725 HA ASP 99 HA ASP 99 28.343 5.685 -14.531 726 HB2 ASP 99 HB2 ASP 99 28.715 5.365 -12.186 727 HB3 ASP 99 HB3 ASP 99 27.069 4.782 -11.946 728 H SER 100 H SER 100 25.125 4.785 -13.281 729 HA SER 100 HA SER 100 24.655 3.335 -15.796 730 HB2 SER 100 HB2 SER 100 24.058 2.374 -12.993 731 HB3 SER 100 HB3 SER 100 23.383 1.629 -14.441 732 HG SER 100 HG SER 100 25.246 0.722 -14.840 733 H GLY 101 H GLY 101 22.824 4.093 -12.827 734 HA2 GLY 101 HA2 GLY 101 21.232 6.114 -13.473 735 HA3 GLY 101 HA3 GLY 101 20.536 4.846 -14.471 736 HA PRO 102 HA PRO 102 19.877 3.463 -9.879 737 HB2 PRO 102 HB2 PRO 102 20.448 5.307 -7.968 738 HB3 PRO 102 HB3 PRO 102 21.634 4.136 -8.558 739 HG2 PRO 102 HG2 PRO 102 21.270 7.010 -9.313 740 HG3 PRO 102 HG3 PRO 102 22.769 6.119 -8.992 741 HD2 PRO 102 HD2 PRO 102 21.894 6.642 -11.501 742 HD3 PRO 102 HD3 PRO 102 22.806 5.173 -11.093 743 H ARG 103 H ARG 103 17.707 3.520 -10.070 744 HA ARG 103 HA ARG 103 16.207 5.928 -10.336 745 HB2 ARG 103 HB2 ARG 103 15.219 3.165 -9.609 746 HB3 ARG 103 HB3 ARG 103 14.244 4.497 -10.217 747 HG2 ARG 103 HG2 ARG 103 15.670 4.427 -12.298 748 HG3 ARG 103 HG3 ARG 103 16.328 2.909 -11.685 749 HD2 ARG 103 HD2 ARG 103 14.622 2.082 -12.946 750 HD3 ARG 103 HD3 ARG 103 13.756 2.329 -11.430 751 HE ARG 103 HE ARG 103 13.577 4.667 -12.969 752 HH11 ARG 103 HH11 ARG 103 12.449 1.373 -12.969 753 HH12 ARG 103 HH12 ARG 103 10.994 1.735 -13.835 754 HH21 ARG 103 HH21 ARG 103 11.663 5.155 -14.111 755 HH22 ARG 103 HH22 ARG 103 10.547 3.885 -14.485 756 H ARG 104 H ARG 104 16.264 3.485 -7.732 757 HA ARG 104 HA ARG 104 15.117 5.439 -5.897 758 HB2 ARG 104 HB2 ARG 104 14.487 2.889 -6.159 759 HB3 ARG 104 HB3 ARG 104 15.847 2.664 -5.067 760 HG2 ARG 104 HG2 ARG 104 13.972 2.763 -3.680 761 HG3 ARG 104 HG3 ARG 104 14.706 4.363 -3.554 762 HD2 ARG 104 HD2 ARG 104 12.460 4.858 -3.829 763 HD3 ARG 104 HD3 ARG 104 13.088 4.993 -5.471 764 HE ARG 104 HE ARG 104 12.125 2.371 -4.939 765 HH11 ARG 104 HH11 ARG 104 11.100 5.610 -5.697 766 HH12 ARG 104 HH12 ARG 104 9.624 5.107 -6.452 767 HH21 ARG 104 HH21 ARG 104 10.186 1.695 -5.932 768 HH22 ARG 104 HH22 ARG 104 9.105 2.880 -6.585 769 H TYR 105 H TYR 105 16.164 6.308 -4.174 770 HA TYR 105 HA TYR 105 19.058 5.850 -4.050 771 HB2 TYR 105 HB2 TYR 105 17.283 8.145 -3.292 772 HB3 TYR 105 HB3 TYR 105 18.876 7.992 -2.561 773 HD1 TYR 105 HD2 TYR 105 20.771 7.408 -4.434 774 HD2 TYR 105 HD1 TYR 105 17.155 9.546 -5.111 775 HE1 TYR 105 HE2 TYR 105 21.782 8.484 -6.402 776 HE2 TYR 105 HE1 TYR 105 18.155 10.627 -7.081 777 HH TYR 105 HH TYR 105 20.745 9.563 -8.644 778 H THR 106 H THR 106 17.232 3.964 -2.884 779 HA THR 106 HA THR 106 17.425 4.416 -0.009 780 HB THR 106 HB THR 106 16.170 2.133 -1.546 781 HG1 THR 106 HG1 THR 106 15.226 4.406 -1.499 782 HG21 THR 106 HG21 THR 106 16.702 1.214 0.537 783 HG22 THR 106 HG22 THR 106 15.047 1.787 0.752 784 HG23 THR 106 HG23 THR 106 16.397 2.727 1.387 785 H ILE 107 H ILE 107 18.781 3.349 1.334 786 HA ILE 107 HA ILE 107 20.937 1.835 0.117 787 HB ILE 107 HB ILE 107 20.510 2.752 2.962 788 HG12 ILE 107 HG12 ILE 107 22.759 3.986 2.044 789 HG13 ILE 107 HG13 ILE 107 21.804 3.893 0.568 790 HG21 ILE 107 HG21 ILE 107 22.025 1.236 3.553 791 HG22 ILE 107 HG22 ILE 107 22.311 0.781 1.874 792 HG23 ILE 107 HG23 ILE 107 23.199 2.128 2.586 793 HD11 ILE 107 HD11 ILE 107 21.509 6.000 1.821 794 HD12 ILE 107 HD12 ILE 107 20.007 5.103 1.593 795 HD13 ILE 107 HD13 ILE 107 20.825 5.072 3.155 796 H ALA 108 H ALA 108 20.615 -0.262 -0.234 797 HA ALA 108 HA ALA 108 18.908 -1.810 1.552 798 HB1 ALA 108 HB1 ALA 108 19.939 -2.147 -1.201 799 HB2 ALA 108 HB2 ALA 108 19.653 -3.616 -0.266 800 HB3 ALA 108 HB3 ALA 108 18.337 -2.475 -0.538 801 H ALA 109 H ALA 109 19.829 -2.632 3.311 802 HA ALA 109 HA ALA 109 22.468 -3.906 3.036 803 HB1 ALA 109 HB1 ALA 109 22.775 -3.195 5.502 804 HB2 ALA 109 HB2 ALA 109 23.039 -2.002 4.230 805 HB3 ALA 109 HB3 ALA 109 21.530 -1.999 5.142 806 H MET 110 H MET 110 22.253 -6.016 3.354 807 HA MET 110 HA MET 110 20.199 -6.958 5.240 808 HB2 MET 110 HB2 MET 110 21.427 -8.260 2.813 809 HB3 MET 110 HB3 MET 110 20.480 -9.159 3.991 810 HG2 MET 110 HG2 MET 110 18.637 -7.456 3.557 811 HG3 MET 110 HG3 MET 110 19.582 -6.971 2.151 812 HE1 MET 110 HE1 MET 110 18.110 -9.747 4.116 813 HE2 MET 110 HE2 MET 110 16.666 -9.648 3.107 814 HE3 MET 110 HE3 MET 110 17.737 -11.045 2.981 815 H LEU 111 H LEU 111 20.861 -7.845 7.079 816 HA LEU 111 HA LEU 111 23.685 -8.355 7.490 817 HB2 LEU 111 HB2 LEU 111 21.380 -8.627 9.411 818 HB3 LEU 111 HB3 LEU 111 23.092 -8.655 9.824 819 HG LEU 111 HG LEU 111 22.436 -6.525 10.450 820 HD11 LEU 111 HD11 LEU 111 23.341 -6.176 7.597 821 HD12 LEU 111 HD12 LEU 111 24.403 -6.485 8.971 822 HD13 LEU 111 HD13 LEU 111 23.470 -4.989 8.896 823 HD21 LEU 111 HD21 LEU 111 20.792 -5.227 9.489 824 HD22 LEU 111 HD22 LEU 111 20.197 -6.853 9.157 825 HD23 LEU 111 HD23 LEU 111 21.015 -5.937 7.890 826 H SER 112 H SER 112 23.562 -10.166 5.878 827 HA SER 112 HA SER 112 22.171 -12.517 6.196 828 HB2 SER 112 HB2 SER 112 24.812 -11.818 5.007 829 HB3 SER 112 HB3 SER 112 24.459 -13.527 5.257 830 HG SER 112 HG SER 112 23.787 -12.705 3.187 831 HA PRO 113 HA PRO 113 23.638 -14.605 9.763 832 HB2 PRO 113 HB2 PRO 113 23.765 -17.183 8.925 833 HB3 PRO 113 HB3 PRO 113 22.237 -16.340 9.208 834 HG2 PRO 113 HG2 PRO 113 23.673 -16.846 6.631 835 HG3 PRO 113 HG3 PRO 113 21.942 -16.981 6.993 836 HD2 PRO 113 HD2 PRO 113 23.001 -14.838 5.721 837 HD3 PRO 113 HD3 PRO 113 21.595 -14.711 6.799 838 H TYR 114 H TYR 114 25.457 -15.501 10.760 839 HA TYR 114 HA TYR 114 27.799 -15.978 9.051 840 HB2 TYR 114 HB2 TYR 114 27.956 -14.408 11.622 841 HB3 TYR 114 HB3 TYR 114 29.212 -14.622 10.409 842 HD1 TYR 114 HD2 TYR 114 28.385 -13.817 7.952 843 HD2 TYR 114 HD1 TYR 114 26.941 -12.346 11.674 844 HE1 TYR 114 HE2 TYR 114 27.677 -11.735 6.849 845 HE2 TYR 114 HE1 TYR 114 26.228 -10.261 10.581 846 HH TYR 114 HH TYR 114 26.283 -9.057 8.701 847 H SER 115 H SER 115 27.434 -18.212 9.436 848 HA SER 115 HA SER 115 27.110 -19.469 11.873 849 HB2 SER 115 HB2 SER 115 28.534 -20.379 9.371 850 HB3 SER 115 HB3 SER 115 28.280 -21.437 10.759 851 HG SER 115 HG SER 115 26.499 -21.813 9.637 852 H TYR 116 H TYR 116 28.801 -20.934 12.921 853 HA TYR 116 HA TYR 116 31.135 -19.274 13.543 854 HB2 TYR 116 HB2 TYR 116 30.193 -21.708 15.057 855 HB3 TYR 116 HB3 TYR 116 31.275 -20.438 15.617 856 HD1 TYR 116 HD2 TYR 116 27.770 -21.268 14.841 857 HD2 TYR 116 HD1 TYR 116 30.421 -18.384 16.503 858 HE1 TYR 116 HE2 TYR 116 25.851 -20.069 15.806 859 HE2 TYR 116 HE1 TYR 116 28.510 -17.178 17.473 860 HH TYR 116 HH TYR 116 26.141 -17.746 18.179 861 H SER 117 H SER 117 30.885 -21.010 11.147 862 HA SER 117 HA SER 117 32.324 -23.377 11.357 863 HB2 SER 117 HB2 SER 117 32.156 -21.400 9.075 864 HB3 SER 117 HB3 SER 117 32.898 -22.994 8.935 865 HG SER 117 HG SER 117 30.979 -23.914 9.011 866 H THR 118 H THR 118 34.548 -23.695 10.303 867 HA THR 118 HA THR 118 36.412 -21.914 11.680 868 HB THR 118 HB THR 118 36.586 -24.369 12.049 869 HG1 THR 118 HG1 THR 118 38.445 -22.761 11.992 870 HG21 THR 118 HG21 THR 118 35.978 -24.991 9.695 871 HG22 THR 118 HG22 THR 118 37.394 -25.826 10.332 872 HG23 THR 118 HG23 THR 118 37.596 -24.482 9.209 873 H THR 119 H THR 119 35.066 -21.225 9.120 874 HA THR 119 HA THR 119 37.502 -20.599 7.608 875 HB THR 119 HB THR 119 36.189 -20.920 5.475 876 HG1 THR 119 HG1 THR 119 34.110 -21.176 5.958 877 HG21 THR 119 HG21 THR 119 36.922 -23.222 7.263 878 HG22 THR 119 HG22 THR 119 37.816 -22.554 5.898 879 HG23 THR 119 HG23 THR 119 36.343 -23.481 5.618 880 H ALA 120 H ALA 120 37.043 -18.873 5.920 881 HA ALA 120 HA ALA 120 36.498 -16.696 5.524 882 HB1 ALA 120 HB1 ALA 120 34.276 -16.303 5.102 883 HB2 ALA 120 HB2 ALA 120 34.309 -18.066 5.102 884 HB3 ALA 120 HB3 ALA 120 33.734 -17.196 6.524 885 H VAL 121 H VAL 121 37.447 -17.414 8.218 886 HA VAL 121 HA VAL 121 36.017 -15.785 10.097 887 HB VAL 121 HB VAL 121 37.356 -17.762 10.782 888 HG11 VAL 121 HG11 VAL 121 39.572 -17.971 10.442 889 HG12 VAL 121 HG12 VAL 121 39.292 -16.792 9.158 890 HG13 VAL 121 HG13 VAL 121 39.883 -16.260 10.733 891 HG21 VAL 121 HG21 VAL 121 38.563 -15.393 12.139 892 HG22 VAL 121 HG22 VAL 121 36.820 -15.647 12.219 893 HG23 VAL 121 HG23 VAL 121 37.919 -16.880 12.836 894 H VAL 122 H VAL 122 36.727 -13.842 11.052 895 HA VAL 122 HA VAL 122 37.599 -11.852 9.352 896 HB VAL 122 HB VAL 122 36.475 -11.393 11.483 897 HG11 VAL 122 HG11 VAL 122 39.088 -11.855 12.887 898 HG12 VAL 122 HG12 VAL 122 37.478 -11.649 13.582 899 HG13 VAL 122 HG13 VAL 122 37.885 -13.135 12.723 900 HG21 VAL 122 HG21 VAL 122 37.777 -9.633 10.342 901 HG22 VAL 122 HG22 VAL 122 37.723 -9.410 12.092 902 HG23 VAL 122 HG23 VAL 122 39.176 -10.057 11.330 903 H THR 123 H THR 123 39.522 -11.024 8.739 904 HA THR 123 HA THR 123 41.890 -12.593 9.271 905 HB THR 123 HB THR 123 41.557 -11.818 7.007 906 HG1 THR 123 HG1 THR 123 43.667 -11.712 7.031 907 HG21 THR 123 HG21 THR 123 42.089 -9.072 7.090 908 HG22 THR 123 HG22 THR 123 40.857 -9.350 8.322 909 HG23 THR 123 HG23 THR 123 40.568 -9.851 6.657 910 H ASN 124 H ASN 124 43.917 -11.647 9.967 911 HA ASN 124 HA ASN 124 43.525 -9.402 11.835 912 HB2 ASN 124 HB2 ASN 124 45.170 -11.912 12.097 913 HB3 ASN 124 HB3 ASN 124 45.496 -10.488 13.081 914 HD21 ASN 124 HD21 ASN 124 44.641 -10.620 15.013 915 HD22 ASN 124 HD22 ASN 124 43.141 -11.374 15.421 916 HA PRO 125 HA PRO 125 46.707 -8.221 8.634 917 HB2 PRO 125 HB2 PRO 125 45.607 -5.804 8.069 918 HB3 PRO 125 HB3 PRO 125 45.128 -7.293 7.246 919 HG2 PRO 125 HG2 PRO 125 43.788 -5.865 9.510 920 HG3 PRO 125 HG3 PRO 125 43.066 -6.604 8.069 921 HD2 PRO 125 HD2 PRO 125 43.071 -7.826 10.484 922 HD3 PRO 125 HD3 PRO 125 43.156 -8.728 8.957 923 H LYS 126 H LYS 126 47.904 -6.022 8.580 924 HA LYS 126 HA LYS 126 49.171 -5.591 10.995 925 HB2 LYS 126 HB2 LYS 126 50.241 -3.733 9.986 926 HB3 LYS 126 HB3 LYS 126 49.929 -4.871 8.683 927 HG2 LYS 126 HG2 LYS 126 48.125 -2.549 9.305 928 HG3 LYS 126 HG3 LYS 126 49.466 -2.462 8.161 929 HD2 LYS 126 HD2 LYS 126 48.286 -4.628 7.190 930 HD3 LYS 126 HD3 LYS 126 46.872 -3.901 7.954 931 HE2 LYS 126 HE2 LYS 126 48.684 -2.399 6.077 932 HE3 LYS 126 HE3 LYS 126 47.267 -3.294 5.532 933 HZ1 LYS 126 HZ1 LYS 126 46.296 -1.299 5.853 934 HZ2 LYS 126 HZ2 LYS 126 47.427 -0.787 7.000 935 HZ3 LYS 126 HZ3 LYS 126 46.180 -1.837 7.452 936 H GLU 127 H GLU 127 46.225 -4.189 9.773 937 HA GLU 127 HA GLU 127 46.102 -2.366 12.073 938 HB2 GLU 127 HB2 GLU 127 44.742 -2.408 9.399 939 HB3 GLU 127 HB3 GLU 127 44.022 -1.527 10.739 940 HG2 GLU 127 HG2 GLU 127 46.390 -0.458 10.940 941 HG3 GLU 127 HG3 GLU 127 46.559 -0.998 9.270 Start of MODEL 6 1 H1 GLY 1 H GLY 1 11.649 20.253 -8.555 2 HA2 GLY 1 HA2 GLY 1 12.592 17.893 -7.067 3 HA3 GLY 1 HA3 GLY 1 10.929 18.189 -7.551 4 HA PRO 2 HA PRO 2 13.400 16.776 -11.488 5 HB2 PRO 2 HB2 PRO 2 15.762 15.534 -10.983 6 HB3 PRO 2 HB3 PRO 2 15.634 17.273 -11.272 7 HG2 PRO 2 HG2 PRO 2 15.846 15.795 -8.678 8 HG3 PRO 2 HG3 PRO 2 16.664 17.283 -9.187 9 HD2 PRO 2 HD2 PRO 2 14.491 17.294 -7.571 10 HD3 PRO 2 HD3 PRO 2 14.827 18.598 -8.728 11 H THR 3 H THR 3 14.392 14.430 -12.123 12 HA THR 3 HA THR 3 12.426 12.567 -11.580 13 HB THR 3 HB THR 3 13.828 10.899 -12.587 14 HG1 THR 3 HG1 THR 3 15.940 10.928 -12.379 15 HG21 THR 3 HG21 THR 3 14.349 11.929 -14.659 16 HG22 THR 3 HG22 THR 3 14.627 13.493 -13.892 17 HG23 THR 3 HG23 THR 3 12.993 12.838 -13.992 18 H GLY 4 H GLY 4 12.152 10.912 -10.136 19 HA2 GLY 4 HA2 GLY 4 14.219 10.185 -8.262 20 HA3 GLY 4 HA3 GLY 4 12.920 11.121 -7.538 21 H THR 5 H THR 5 11.466 9.905 -6.554 22 HA THR 5 HA THR 5 10.405 7.546 -7.874 23 HB THR 5 HB THR 5 10.653 6.235 -5.677 24 HG1 THR 5 HG1 THR 5 11.899 7.071 -4.179 25 HG21 THR 5 HG21 THR 5 13.281 6.698 -7.046 26 HG22 THR 5 HG22 THR 5 11.935 5.951 -7.905 27 HG23 THR 5 HG23 THR 5 12.587 5.190 -6.453 28 H GLY 6 H GLY 6 8.344 6.977 -7.185 29 HA2 GLY 6 HA2 GLY 6 7.102 8.910 -5.331 30 HA3 GLY 6 HA3 GLY 6 6.268 8.149 -6.677 31 H GLU 7 H GLU 7 8.416 6.311 -4.650 32 HA GLU 7 HA GLU 7 6.075 4.902 -3.553 33 HB2 GLU 7 HB2 GLU 7 7.766 3.007 -3.223 34 HB3 GLU 7 HB3 GLU 7 7.256 3.357 -4.870 35 HG2 GLU 7 HG2 GLU 7 9.291 4.448 -5.369 36 HG3 GLU 7 HG3 GLU 7 9.770 4.480 -3.673 37 H SER 8 H SER 8 8.379 7.079 -2.710 38 HA SER 8 HA SER 8 8.134 6.375 0.120 39 HB2 SER 8 HB2 SER 8 10.753 7.041 -1.244 40 HB3 SER 8 HB3 SER 8 10.532 6.903 0.499 41 HG SER 8 HG SER 8 10.613 4.922 -1.453 42 H LYS 9 H LYS 9 9.383 8.310 1.371 43 HA LYS 9 HA LYS 9 8.141 10.765 0.331 44 HB2 LYS 9 HB2 LYS 9 9.010 10.256 3.175 45 HB3 LYS 9 HB3 LYS 9 7.955 11.532 2.584 46 HG2 LYS 9 HG2 LYS 9 6.356 10.159 3.377 47 HG3 LYS 9 HG3 LYS 9 6.540 9.405 1.792 48 HD2 LYS 9 HD2 LYS 9 8.428 8.054 3.085 49 HD3 LYS 9 HD3 LYS 9 7.406 8.452 4.468 50 HE2 LYS 9 HE2 LYS 9 6.478 7.085 1.943 51 HE3 LYS 9 HE3 LYS 9 6.834 6.276 3.469 52 HZ1 LYS 9 HZ1 LYS 9 4.967 8.469 3.680 53 HZ2 LYS 9 HZ2 LYS 9 4.895 6.917 4.349 54 HZ3 LYS 9 HZ3 LYS 9 4.409 7.170 2.749 55 H CYS 10 H CYS 10 10.843 10.043 2.544 56 HA CYS 10 HA CYS 10 12.276 12.381 1.823 57 HB2 CYS 10 HB2 CYS 10 13.062 9.887 3.329 58 HB3 CYS 10 HB3 CYS 10 14.173 11.227 3.070 59 HG CYS 10 HG CYS 10 12.153 13.015 4.301 60 HA PRO 11 HA PRO 11 14.512 11.167 -1.750 61 HB2 PRO 11 HB2 PRO 11 16.887 12.425 -1.360 62 HB3 PRO 11 HB3 PRO 11 15.400 13.287 -1.776 63 HG2 PRO 11 HG2 PRO 11 16.693 12.919 0.900 64 HG3 PRO 11 HG3 PRO 11 15.962 14.375 0.201 65 HD2 PRO 11 HD2 PRO 11 14.669 12.816 1.999 66 HD3 PRO 11 HD3 PRO 11 13.819 13.700 0.715 67 H LEU 12 H LEU 12 16.236 10.783 1.322 68 HA LEU 12 HA LEU 12 17.460 8.334 0.237 69 HB2 LEU 12 HB2 LEU 12 19.260 9.819 0.381 70 HB3 LEU 12 HB3 LEU 12 18.683 10.509 1.896 71 HG LEU 12 HG LEU 12 19.189 8.164 2.875 72 HD11 LEU 12 HD11 LEU 12 20.295 7.979 0.163 73 HD12 LEU 12 HD12 LEU 12 19.811 6.708 1.284 74 HD13 LEU 12 HD13 LEU 12 21.389 7.477 1.452 75 HD21 LEU 12 HD21 LEU 12 20.884 9.235 3.832 76 HD22 LEU 12 HD22 LEU 12 20.616 10.549 2.686 77 HD23 LEU 12 HD23 LEU 12 21.789 9.283 2.318 78 H MET 13 H MET 13 17.326 6.539 1.477 79 HA MET 13 HA MET 13 16.487 6.797 4.267 80 HB2 MET 13 HB2 MET 13 14.723 5.136 3.998 81 HB3 MET 13 HB3 MET 13 14.423 6.523 2.961 82 HG2 MET 13 HG2 MET 13 14.743 5.346 1.048 83 HG3 MET 13 HG3 MET 13 15.900 4.243 1.790 84 HE1 MET 13 HE1 MET 13 13.951 2.851 4.377 85 HE2 MET 13 HE2 MET 13 14.046 1.477 3.275 86 HE3 MET 13 HE3 MET 13 15.411 2.587 3.422 87 H VAL 14 H VAL 14 17.044 5.045 5.585 88 HA VAL 14 HA VAL 14 19.058 3.259 4.405 89 HB VAL 14 HB VAL 14 18.622 4.019 7.297 90 HG11 VAL 14 HG11 VAL 14 19.494 1.781 7.165 91 HG12 VAL 14 HG12 VAL 14 20.722 2.286 6.003 92 HG13 VAL 14 HG13 VAL 14 20.788 2.870 7.666 93 HG21 VAL 14 HG21 VAL 14 19.548 5.770 5.702 94 HG22 VAL 14 HG22 VAL 14 20.522 5.401 7.125 95 HG23 VAL 14 HG23 VAL 14 20.966 4.732 5.554 96 H LYS 15 H LYS 15 18.680 1.148 4.248 97 HA LYS 15 HA LYS 15 16.443 0.012 5.794 98 HB2 LYS 15 HB2 LYS 15 15.816 0.067 3.480 99 HB3 LYS 15 HB3 LYS 15 17.363 -0.605 2.986 100 HG2 LYS 15 HG2 LYS 15 15.683 -2.306 2.835 101 HG3 LYS 15 HG3 LYS 15 16.784 -2.704 4.156 102 HD2 LYS 15 HD2 LYS 15 14.476 -1.085 4.959 103 HD3 LYS 15 HD3 LYS 15 14.059 -2.682 4.332 104 HE2 LYS 15 HE2 LYS 15 16.109 -3.329 5.954 105 HE3 LYS 15 HE3 LYS 15 15.480 -1.918 6.803 106 HZ1 LYS 15 HZ1 LYS 15 13.221 -3.159 6.397 107 HZ2 LYS 15 HZ2 LYS 15 14.203 -3.543 7.718 108 HZ3 LYS 15 HZ3 LYS 15 14.225 -4.521 6.338 109 H VAL 16 H VAL 16 17.256 -1.187 7.384 110 HA VAL 16 HA VAL 16 19.465 -3.029 6.741 111 HB VAL 16 HB VAL 16 19.020 -1.599 9.367 112 HG11 VAL 16 HG11 VAL 16 20.407 -4.028 8.733 113 HG12 VAL 16 HG12 VAL 16 21.556 -2.803 9.276 114 HG13 VAL 16 HG13 VAL 16 20.187 -3.244 10.297 115 HG21 VAL 16 HG21 VAL 16 21.158 -0.500 8.874 116 HG22 VAL 16 HG22 VAL 16 21.203 -1.302 7.303 117 HG23 VAL 16 HG23 VAL 16 19.936 -0.127 7.657 118 H LEU 17 H LEU 17 18.868 -5.079 6.893 119 HA LEU 17 HA LEU 17 16.986 -5.870 8.998 120 HB2 LEU 17 HB2 LEU 17 15.572 -7.029 7.585 121 HB3 LEU 17 HB3 LEU 17 15.919 -5.559 6.677 122 HG LEU 17 HG LEU 17 17.845 -7.350 5.806 123 HD11 LEU 17 HD11 LEU 17 15.457 -8.932 5.319 124 HD12 LEU 17 HD12 LEU 17 15.932 -8.917 7.017 125 HD13 LEU 17 HD13 LEU 17 17.080 -9.441 5.784 126 HD21 LEU 17 HD21 LEU 17 15.286 -7.143 4.320 127 HD22 LEU 17 HD22 LEU 17 16.944 -6.929 3.759 128 HD23 LEU 17 HD23 LEU 17 16.151 -5.649 4.679 129 H ASP 18 H ASP 18 17.154 -8.055 9.665 130 HA ASP 18 HA ASP 18 19.824 -9.112 9.417 131 HB2 ASP 18 HB2 ASP 18 17.400 -9.842 11.031 132 HB3 ASP 18 HB3 ASP 18 18.762 -10.954 10.923 133 H ALA 19 H ALA 19 20.486 -10.646 8.064 134 HA ALA 19 HA ALA 19 18.619 -11.825 6.210 135 HB1 ALA 19 HB1 ALA 19 20.455 -11.537 4.970 136 HB2 ALA 19 HB2 ALA 19 21.510 -11.475 6.384 137 HB3 ALA 19 HB3 ALA 19 21.027 -13.032 5.712 138 H VAL 20 H VAL 20 19.391 -12.585 9.284 139 HA VAL 20 HA VAL 20 19.655 -15.454 8.977 140 HB VAL 20 HB VAL 20 19.304 -13.792 11.477 141 HG11 VAL 20 HG11 VAL 20 18.565 -16.033 11.893 142 HG12 VAL 20 HG12 VAL 20 19.989 -16.703 11.095 143 HG13 VAL 20 HG13 VAL 20 20.159 -15.834 12.620 144 HG21 VAL 20 HG21 VAL 20 21.765 -14.413 11.749 145 HG22 VAL 20 HG22 VAL 20 21.729 -14.830 10.036 146 HG23 VAL 20 HG23 VAL 20 21.373 -13.181 10.550 147 H ARG 21 H ARG 21 17.197 -13.125 9.963 148 HA ARG 21 HA ARG 21 15.232 -15.321 10.018 149 HB2 ARG 21 HB2 ARG 21 14.863 -12.678 11.409 150 HB3 ARG 21 HB3 ARG 21 13.989 -14.181 11.671 151 HG2 ARG 21 HG2 ARG 21 15.333 -14.295 13.474 152 HG3 ARG 21 HG3 ARG 21 16.455 -15.000 12.307 153 HD2 ARG 21 HD2 ARG 21 17.437 -12.773 11.943 154 HD3 ARG 21 HD3 ARG 21 16.341 -12.106 13.154 155 HE ARG 21 HE ARG 21 18.728 -13.651 13.628 156 HH11 ARG 21 HH11 ARG 21 15.688 -12.563 14.928 157 HH12 ARG 21 HH12 ARG 21 16.178 -12.750 16.579 158 HH21 ARG 21 HH21 ARG 21 19.386 -13.902 15.798 159 HH22 ARG 21 HH22 ARG 21 18.283 -13.510 17.073 160 H GLY 22 H GLY 22 16.115 -12.261 8.681 161 HA2 GLY 22 HA2 GLY 22 15.295 -11.457 6.621 162 HA3 GLY 22 HA3 GLY 22 13.861 -12.450 6.829 163 H SER 23 H SER 23 14.449 -10.927 9.707 164 HA SER 23 HA SER 23 12.369 -8.951 9.145 165 HB2 SER 23 HB2 SER 23 13.020 -8.871 11.880 166 HB3 SER 23 HB3 SER 23 11.614 -9.638 11.142 167 HG SER 23 HG SER 23 13.985 -10.766 12.064 168 HA PRO 24 HA PRO 24 14.954 -5.415 9.376 169 HB2 PRO 24 HB2 PRO 24 13.477 -3.682 10.854 170 HB3 PRO 24 HB3 PRO 24 13.061 -4.126 9.194 171 HG2 PRO 24 HG2 PRO 24 11.945 -5.168 11.769 172 HG3 PRO 24 HG3 PRO 24 11.093 -4.725 10.279 173 HD2 PRO 24 HD2 PRO 24 11.656 -7.293 10.926 174 HD3 PRO 24 HD3 PRO 24 11.601 -6.722 9.246 175 H ALA 25 H ALA 25 16.450 -4.319 10.650 176 HA ALA 25 HA ALA 25 16.856 -5.461 13.313 177 HB1 ALA 25 HB1 ALA 25 19.123 -4.754 13.143 178 HB2 ALA 25 HB2 ALA 25 18.687 -5.499 11.604 179 HB3 ALA 25 HB3 ALA 25 18.766 -3.742 11.743 180 H ILE 26 H ILE 26 16.811 -4.287 15.158 181 HA ILE 26 HA ILE 26 15.992 -1.475 14.913 182 HB ILE 26 HB ILE 26 15.341 -3.628 16.843 183 HG12 ILE 26 HG12 ILE 26 13.875 -2.479 15.001 184 HG13 ILE 26 HG13 ILE 26 13.165 -2.874 16.562 185 HG21 ILE 26 HG21 ILE 26 16.400 -2.210 18.399 186 HG22 ILE 26 HG22 ILE 26 15.741 -0.760 17.643 187 HG23 ILE 26 HG23 ILE 26 14.678 -1.853 18.528 188 HD11 ILE 26 HD11 ILE 26 12.524 -0.649 15.777 189 HD12 ILE 26 HD12 ILE 26 13.429 -0.584 17.289 190 HD13 ILE 26 HD13 ILE 26 14.221 -0.172 15.769 191 H ASN 27 H ASN 27 17.098 0.140 15.911 192 HA ASN 27 HA ASN 27 18.815 1.240 16.918 193 HB2 ASN 27 HB2 ASN 27 19.229 -1.306 18.498 194 HB3 ASN 27 HB3 ASN 27 19.766 0.312 18.940 195 HD21 ASN 27 HD21 ASN 27 17.422 1.697 18.193 196 HD22 ASN 27 HD22 ASN 27 16.178 1.274 19.315 197 H VAL 28 H VAL 28 19.563 0.577 14.554 198 HA VAL 28 HA VAL 28 22.138 -0.837 14.786 199 HB VAL 28 HB VAL 28 20.496 -0.339 12.298 200 HG11 VAL 28 HG11 VAL 28 22.926 -0.411 11.902 201 HG12 VAL 28 HG12 VAL 28 22.990 -1.996 12.674 202 HG13 VAL 28 HG13 VAL 28 22.088 -1.780 11.174 203 HG21 VAL 28 HG21 VAL 28 20.811 -3.087 12.782 204 HG22 VAL 28 HG22 VAL 28 20.323 -2.369 14.317 205 HG23 VAL 28 HG23 VAL 28 19.328 -2.138 12.879 206 H ALA 29 H ALA 29 23.758 0.556 15.027 207 HA ALA 29 HA ALA 29 23.729 3.273 14.451 208 HB1 ALA 29 HB1 ALA 29 25.560 3.039 15.691 209 HB2 ALA 29 HB2 ALA 29 25.682 1.323 15.302 210 HB3 ALA 29 HB3 ALA 29 26.396 2.523 14.226 211 H VAL 30 H VAL 30 23.896 4.423 12.639 212 HA VAL 30 HA VAL 30 25.166 3.220 10.284 213 HB VAL 30 HB VAL 30 22.486 4.614 10.209 214 HG11 VAL 30 HG11 VAL 30 23.149 3.205 7.818 215 HG12 VAL 30 HG12 VAL 30 22.825 4.926 8.038 216 HG13 VAL 30 HG13 VAL 30 24.467 4.306 8.221 217 HG21 VAL 30 HG21 VAL 30 21.740 2.587 10.826 218 HG22 VAL 30 HG22 VAL 30 22.091 2.139 9.157 219 HG23 VAL 30 HG23 VAL 30 23.263 1.794 10.428 220 H HIS 31 H HIS 31 26.471 4.581 9.222 221 HA HIS 31 HA HIS 31 26.213 7.465 9.767 222 HB2 HIS 31 HB2 HIS 31 28.859 6.086 9.342 223 HB3 HIS 31 HB3 HIS 31 28.563 7.706 9.966 224 HD1 HIS 31 HD1 HIS 31 28.179 4.082 10.986 225 HD2 HIS 31 HD2 HIS 31 28.344 7.868 12.688 226 HE1 HIS 31 HE1 HIS 31 28.275 3.699 13.469 227 H VAL 32 H VAL 32 25.840 8.590 7.985 228 HA VAL 32 HA VAL 32 26.582 7.432 5.391 229 HB VAL 32 HB VAL 32 24.724 9.758 5.885 230 HG11 VAL 32 HG11 VAL 32 25.008 9.960 3.671 231 HG12 VAL 32 HG12 VAL 32 25.719 8.352 3.519 232 HG13 VAL 32 HG13 VAL 32 23.965 8.542 3.562 233 HG21 VAL 32 HG21 VAL 32 22.929 8.022 5.398 234 HG22 VAL 32 HG22 VAL 32 24.162 6.808 5.743 235 HG23 VAL 32 HG23 VAL 32 23.685 7.958 6.992 236 H PHE 33 H PHE 33 27.904 8.465 3.976 237 HA PHE 33 HA PHE 33 28.902 11.130 4.708 238 HB2 PHE 33 HB2 PHE 33 30.531 8.666 4.117 239 HB3 PHE 33 HB3 PHE 33 31.194 10.284 3.904 240 HD1 PHE 33 HD1 PHE 33 29.548 8.110 6.432 241 HD2 PHE 33 HD2 PHE 33 32.172 11.378 5.693 242 HE1 PHE 33 HE1 PHE 33 30.125 8.182 8.822 243 HE2 PHE 33 HE2 PHE 33 32.755 11.455 8.082 244 HZ PHE 33 HZ PHE 33 31.731 9.857 9.651 245 H ARG 34 H ARG 34 30.138 12.147 2.880 246 HA ARG 34 HA ARG 34 29.120 11.266 0.264 247 HB2 ARG 34 HB2 ARG 34 27.780 13.166 1.127 248 HB3 ARG 34 HB3 ARG 34 29.248 14.129 1.225 249 HG2 ARG 34 HG2 ARG 34 28.736 12.923 -1.401 250 HG3 ARG 34 HG3 ARG 34 27.550 14.122 -0.879 251 HD2 ARG 34 HD2 ARG 34 29.490 15.646 -0.366 252 HD3 ARG 34 HD3 ARG 34 30.525 14.473 -1.179 253 HE ARG 34 HE ARG 34 28.831 16.392 -2.414 254 HH11 ARG 34 HH11 ARG 34 30.091 13.166 -2.766 255 HH12 ARG 34 HH12 ARG 34 29.964 13.165 -4.494 256 HH21 ARG 34 HH21 ARG 34 28.659 16.402 -4.688 257 HH22 ARG 34 HH22 ARG 34 29.151 15.007 -5.586 258 H LYS 35 H LYS 35 30.421 11.761 -1.531 259 HA LYS 35 HA LYS 35 33.218 11.740 -1.011 260 HB2 LYS 35 HB2 LYS 35 32.630 10.562 -2.931 261 HB3 LYS 35 HB3 LYS 35 31.524 11.814 -3.481 262 HG2 LYS 35 HG2 LYS 35 33.469 11.737 -4.904 263 HG3 LYS 35 HG3 LYS 35 33.439 13.257 -4.006 264 HD2 LYS 35 HD2 LYS 35 35.679 12.450 -3.957 265 HD3 LYS 35 HD3 LYS 35 34.998 12.199 -2.348 266 HE2 LYS 35 HE2 LYS 35 35.769 10.106 -2.561 267 HE3 LYS 35 HE3 LYS 35 34.368 9.857 -3.603 268 HZ1 LYS 35 HZ1 LYS 35 37.131 9.841 -4.274 269 HZ2 LYS 35 HZ2 LYS 35 36.291 10.959 -5.224 270 HZ3 LYS 35 HZ3 LYS 35 35.803 9.340 -5.195 271 H ALA 36 H ALA 36 34.237 13.496 -0.288 272 HA ALA 36 HA ALA 36 33.369 16.157 -0.824 273 HB1 ALA 36 HB1 ALA 36 34.657 15.296 1.213 274 HB2 ALA 36 HB2 ALA 36 36.094 15.437 0.200 275 HB3 ALA 36 HB3 ALA 36 35.120 16.865 0.550 276 H ALA 37 H ALA 37 34.644 17.817 -1.885 277 HA ALA 37 HA ALA 37 35.378 17.129 -4.503 278 HB1 ALA 37 HB1 ALA 37 34.616 19.394 -3.581 279 HB2 ALA 37 HB2 ALA 37 36.308 19.640 -3.149 280 HB3 ALA 37 HB3 ALA 37 35.856 19.393 -4.836 281 H ASP 38 H ASP 38 37.155 17.042 -1.576 282 HA ASP 38 HA ASP 38 39.735 17.057 -2.943 283 HB2 ASP 38 HB2 ASP 38 38.833 17.316 -0.123 284 HB3 ASP 38 HB3 ASP 38 40.411 16.581 -0.394 285 H ASP 39 H ASP 39 37.553 14.880 -2.983 286 HA ASP 39 HA ASP 39 37.504 12.615 -3.196 287 HB2 ASP 39 HB2 ASP 39 40.472 12.463 -2.788 288 HB3 ASP 39 HB3 ASP 39 39.444 11.505 -3.851 289 H THR 40 H THR 40 37.108 13.750 -0.648 290 HA THR 40 HA THR 40 38.188 11.628 1.092 291 HB THR 40 HB THR 40 38.272 13.100 2.938 292 HG1 THR 40 HG1 THR 40 36.490 14.340 2.861 293 HG21 THR 40 HG21 THR 40 39.205 14.641 0.512 294 HG22 THR 40 HG22 THR 40 40.131 13.422 1.391 295 HG23 THR 40 HG23 THR 40 39.709 14.945 2.174 296 H TRP 41 H TRP 41 36.725 11.602 3.215 297 HA TRP 41 HA TRP 41 33.972 11.233 2.250 298 HB2 TRP 41 HB2 TRP 41 35.561 9.880 4.422 299 HB3 TRP 41 HB3 TRP 41 33.804 9.765 4.357 300 HD1 TRP 41 HD1 TRP 41 36.009 9.644 1.209 301 HE1 TRP 41 HE1 TRP 41 35.738 7.329 0.117 302 HE3 TRP 41 HE3 TRP 41 33.171 7.378 4.807 303 HZ2 TRP 41 HZ2 TRP 41 34.485 4.868 0.703 304 HZ3 TRP 41 HZ3 TRP 41 32.477 5.042 4.464 305 HH2 TRP 41 HH2 TRP 41 33.122 3.815 2.454 306 H GLU 42 H GLU 42 32.779 12.971 2.719 307 HA GLU 42 HA GLU 42 33.215 14.393 5.234 308 HB2 GLU 42 HB2 GLU 42 31.694 15.040 2.722 309 HB3 GLU 42 HB3 GLU 42 31.460 15.968 4.196 310 HG2 GLU 42 HG2 GLU 42 34.244 15.578 3.280 311 HG3 GLU 42 HG3 GLU 42 33.220 16.646 2.323 312 HA PRO 43 HA PRO 43 29.727 12.683 7.282 313 HB2 PRO 43 HB2 PRO 43 28.972 14.782 8.830 314 HB3 PRO 43 HB3 PRO 43 30.424 13.827 9.149 315 HG2 PRO 43 HG2 PRO 43 30.163 16.478 7.783 316 HG3 PRO 43 HG3 PRO 43 31.364 15.947 8.976 317 HD2 PRO 43 HD2 PRO 43 31.887 16.031 6.320 318 HD3 PRO 43 HD3 PRO 43 32.619 14.827 7.400 319 H PHE 44 H PHE 44 27.906 12.270 6.194 320 HA PHE 44 HA PHE 44 26.378 14.502 5.059 321 HB2 PHE 44 HB2 PHE 44 27.004 12.662 3.529 322 HB3 PHE 44 HB3 PHE 44 26.110 11.533 4.542 323 HD1 PHE 44 HD2 PHE 44 23.629 11.799 4.763 324 HD2 PHE 44 HD1 PHE 44 25.921 13.955 1.897 325 HE1 PHE 44 HE2 PHE 44 21.580 12.273 3.485 326 HE2 PHE 44 HE1 PHE 44 23.877 14.434 0.616 327 HZ PHE 44 HZ PHE 44 21.702 13.593 1.410 328 H ALA 45 H ALA 45 25.952 11.563 7.006 329 HA ALA 45 HA ALA 45 24.008 12.816 8.677 330 HB1 ALA 45 HB1 ALA 45 22.054 11.628 8.092 331 HB2 ALA 45 HB2 ALA 45 22.703 12.266 6.580 332 HB3 ALA 45 HB3 ALA 45 22.937 10.566 6.993 333 H SER 46 H SER 46 22.920 11.032 10.109 334 HA SER 46 HA SER 46 24.239 8.554 10.446 335 HB2 SER 46 HB2 SER 46 26.130 9.354 11.418 336 HB3 SER 46 HB3 SER 46 25.387 10.901 11.826 337 HG SER 46 HG SER 46 24.937 10.159 13.740 338 H GLY 47 H GLY 47 23.369 7.313 12.166 339 HA2 GLY 47 HA2 GLY 47 21.743 8.143 14.225 340 HA3 GLY 47 HA3 GLY 47 20.680 8.020 12.831 341 H LYS 48 H LYS 48 19.514 6.346 13.861 342 HA LYS 48 HA LYS 48 20.850 3.739 13.663 343 HB2 LYS 48 HB2 LYS 48 19.513 4.930 16.024 344 HB3 LYS 48 HB3 LYS 48 19.142 3.242 15.691 345 HG2 LYS 48 HG2 LYS 48 21.516 2.697 15.754 346 HG3 LYS 48 HG3 LYS 48 21.902 4.392 16.064 347 HD2 LYS 48 HD2 LYS 48 20.187 2.663 17.847 348 HD3 LYS 48 HD3 LYS 48 21.901 2.995 18.112 349 HE2 LYS 48 HE2 LYS 48 20.983 5.506 17.845 350 HE3 LYS 48 HE3 LYS 48 19.541 4.731 18.501 351 HZ1 LYS 48 HZ1 LYS 48 22.238 4.849 19.725 352 HZ2 LYS 48 HZ2 LYS 48 21.005 3.844 20.300 353 HZ3 LYS 48 HZ3 LYS 48 20.805 5.523 20.319 354 H THR 49 H THR 49 19.696 2.214 12.634 355 HA THR 49 HA THR 49 17.442 2.853 11.129 356 HB THR 49 HB THR 49 17.258 0.512 10.587 357 HG1 THR 49 HG1 THR 49 17.912 -1.031 11.914 358 HG21 THR 49 HG21 THR 49 19.910 0.048 10.431 359 HG22 THR 49 HG22 THR 49 19.918 1.783 10.743 360 HG23 THR 49 HG23 THR 49 19.047 1.143 9.350 361 H SER 50 H SER 50 15.363 1.460 11.248 362 HA SER 50 HA SER 50 14.413 1.359 14.033 363 HB2 SER 50 HB2 SER 50 13.633 3.387 12.651 364 HB3 SER 50 HB3 SER 50 12.653 2.232 11.747 365 HG SER 50 HG SER 50 11.426 3.059 13.425 366 H GLU 51 H GLU 51 12.182 0.191 14.081 367 HA GLU 51 HA GLU 51 12.621 -2.457 13.162 368 HB2 GLU 51 HB2 GLU 51 10.259 -2.822 14.019 369 HB3 GLU 51 HB3 GLU 51 11.431 -2.234 15.190 370 HG2 GLU 51 HG2 GLU 51 10.164 -0.482 15.636 371 HG3 GLU 51 HG3 GLU 51 10.174 -0.002 13.940 372 H SER 52 H SER 52 11.445 0.250 11.595 373 HA SER 52 HA SER 52 9.733 -1.292 9.782 374 HB2 SER 52 HB2 SER 52 8.919 0.890 10.761 375 HB3 SER 52 HB3 SER 52 10.161 1.702 9.809 376 HG SER 52 HG SER 52 8.645 1.710 8.342 377 H GLY 53 H GLY 53 12.896 -0.645 10.050 378 HA2 GLY 53 HA2 GLY 53 14.635 -0.844 8.555 379 HA3 GLY 53 HA3 GLY 53 13.447 -1.233 7.319 380 H GLU 54 H GLU 54 13.122 1.722 9.092 381 HA GLU 54 HA GLU 54 14.267 3.223 6.836 382 HB2 GLU 54 HB2 GLU 54 12.406 4.800 6.926 383 HB3 GLU 54 HB3 GLU 54 11.826 3.174 6.593 384 HG2 GLU 54 HG2 GLU 54 11.488 3.080 9.180 385 HG3 GLU 54 HG3 GLU 54 11.505 4.837 9.041 386 H LEU 55 H LEU 55 15.148 5.246 7.333 387 HA LEU 55 HA LEU 55 15.360 5.891 10.195 388 HB2 LEU 55 HB2 LEU 55 17.409 4.849 8.664 389 HB3 LEU 55 HB3 LEU 55 17.726 6.582 8.652 390 HG LEU 55 HG LEU 55 17.459 4.851 11.110 391 HD11 LEU 55 HD11 LEU 55 19.769 5.810 9.504 392 HD12 LEU 55 HD12 LEU 55 19.534 4.281 10.350 393 HD13 LEU 55 HD13 LEU 55 19.935 5.739 11.258 394 HD21 LEU 55 HD21 LEU 55 17.519 7.761 10.683 395 HD22 LEU 55 HD22 LEU 55 18.612 7.154 11.926 396 HD23 LEU 55 HD23 LEU 55 16.883 6.821 12.032 397 H HIS 56 H HIS 56 14.484 7.821 10.504 398 HA HIS 56 HA HIS 56 14.551 9.797 8.341 399 HB2 HIS 56 HB2 HIS 56 12.803 10.965 9.594 400 HB3 HIS 56 HB3 HIS 56 12.355 9.284 9.321 401 HD1 HIS 56 HD1 HIS 56 13.645 11.546 12.064 402 HD2 HIS 56 HD2 HIS 56 11.809 7.849 11.588 403 HE1 HIS 56 HE1 HIS 56 13.043 10.790 14.386 404 H GLY 57 H GLY 57 15.031 12.042 8.850 405 HA2 GLY 57 HA2 GLY 57 15.986 13.712 10.257 406 HA3 GLY 57 HA3 GLY 57 16.664 12.438 11.258 407 H LEU 58 H LEU 58 17.672 10.938 8.944 408 HA LEU 58 HA LEU 58 20.244 12.088 8.794 409 HB2 LEU 58 HB2 LEU 58 18.856 9.799 7.506 410 HB3 LEU 58 HB3 LEU 58 20.357 10.370 6.779 411 HG LEU 58 HG LEU 58 21.357 10.078 9.138 412 HD11 LEU 58 HD11 LEU 58 19.100 9.768 10.194 413 HD12 LEU 58 HD12 LEU 58 20.293 8.534 10.592 414 HD13 LEU 58 HD13 LEU 58 19.030 8.189 9.412 415 HD21 LEU 58 HD21 LEU 58 22.129 7.985 8.547 416 HD22 LEU 58 HD22 LEU 58 21.587 8.624 6.994 417 HD23 LEU 58 HD23 LEU 58 20.574 7.483 7.880 418 H THR 59 H THR 59 17.391 12.492 6.893 419 HA THR 59 HA THR 59 18.358 13.260 4.429 420 HB THR 59 HB THR 59 16.354 14.715 4.232 421 HG1 THR 59 HG1 THR 59 16.205 15.477 6.359 422 HG21 THR 59 HG21 THR 59 15.297 12.300 5.578 423 HG22 THR 59 HG22 THR 59 16.442 12.032 4.264 424 HG23 THR 59 HG23 THR 59 14.961 12.941 3.970 425 H THR 60 H THR 60 19.215 15.091 3.547 426 HA THR 60 HA THR 60 19.480 17.507 5.132 427 HB THR 60 HB THR 60 21.965 17.603 4.722 428 HG1 THR 60 HG1 THR 60 22.933 15.462 4.447 429 HG21 THR 60 HG21 THR 60 22.454 16.618 6.751 430 HG22 THR 60 HG22 THR 60 21.395 15.239 6.456 431 HG23 THR 60 HG23 THR 60 20.706 16.806 6.876 432 H GLU 61 H GLU 61 20.466 19.288 3.875 433 HA GLU 61 HA GLU 61 19.336 19.433 1.286 434 HB2 GLU 61 HB2 GLU 61 20.561 21.612 1.144 435 HB3 GLU 61 HB3 GLU 61 19.544 21.442 2.569 436 HG2 GLU 61 HG2 GLU 61 21.428 21.042 3.963 437 HG3 GLU 61 HG3 GLU 61 22.502 20.913 2.572 438 H GLU 62 H GLU 62 22.246 18.117 2.395 439 HA GLU 62 HA GLU 62 23.826 18.615 0.051 440 HB2 GLU 62 HB2 GLU 62 24.160 17.207 2.610 441 HB3 GLU 62 HB3 GLU 62 25.012 16.470 1.260 442 HG2 GLU 62 HG2 GLU 62 25.287 19.303 2.235 443 HG3 GLU 62 HG3 GLU 62 26.467 18.004 2.403 444 H GLU 63 H GLU 63 21.182 16.720 0.564 445 HA GLU 63 HA GLU 63 21.890 14.293 -0.700 446 HB2 GLU 63 HB2 GLU 63 19.499 13.898 -0.893 447 HB3 GLU 63 HB3 GLU 63 19.876 14.553 0.695 448 HG2 GLU 63 HG2 GLU 63 18.032 15.780 0.167 449 HG3 GLU 63 HG3 GLU 63 19.301 16.835 -0.449 450 H PHE 64 H PHE 64 21.244 17.439 -1.908 451 HA PHE 64 HA PHE 64 20.580 16.549 -4.582 452 HB2 PHE 64 HB2 PHE 64 19.809 18.728 -3.316 453 HB3 PHE 64 HB3 PHE 64 21.318 19.378 -3.951 454 HD1 PHE 64 HD2 PHE 64 18.310 17.493 -5.093 455 HD2 PHE 64 HD1 PHE 64 21.293 20.387 -6.015 456 HE1 PHE 64 HE2 PHE 64 17.203 17.945 -7.244 457 HE2 PHE 64 HE1 PHE 64 20.190 20.842 -8.167 458 HZ PHE 64 HZ PHE 64 18.142 19.622 -8.783 459 H VAL 65 H VAL 65 22.800 15.313 -4.289 460 HA VAL 65 HA VAL 65 24.873 16.983 -5.557 461 HB VAL 65 HB VAL 65 26.557 15.437 -4.570 462 HG11 VAL 65 HG11 VAL 65 24.778 17.100 -2.821 463 HG12 VAL 65 HG12 VAL 65 26.198 16.282 -2.165 464 HG13 VAL 65 HG13 VAL 65 26.383 17.474 -3.452 465 HG21 VAL 65 HG21 VAL 65 24.437 14.490 -2.681 466 HG22 VAL 65 HG22 VAL 65 24.736 13.636 -4.194 467 HG23 VAL 65 HG23 VAL 65 26.029 13.805 -3.007 468 H GLU 66 H GLU 66 26.618 15.261 -6.498 469 HA GLU 66 HA GLU 66 25.579 14.275 -8.839 470 HB2 GLU 66 HB2 GLU 66 27.971 13.220 -7.321 471 HB3 GLU 66 HB3 GLU 66 27.627 12.900 -9.015 472 HG2 GLU 66 HG2 GLU 66 27.814 15.723 -8.105 473 HG3 GLU 66 HG3 GLU 66 29.295 14.788 -8.296 474 H GLY 67 H GLY 67 25.935 12.602 -5.748 475 HA2 GLY 67 HA2 GLY 67 23.956 11.024 -5.418 476 HA3 GLY 67 HA3 GLY 67 24.529 10.281 -6.904 477 H ILE 68 H ILE 68 27.232 11.295 -5.373 478 HA ILE 68 HA ILE 68 27.975 8.644 -4.605 479 HB ILE 68 HB ILE 68 29.468 11.196 -4.003 480 HG12 ILE 68 HG12 ILE 68 29.746 9.419 -6.434 481 HG13 ILE 68 HG13 ILE 68 28.873 10.947 -6.426 482 HG21 ILE 68 HG21 ILE 68 31.353 9.339 -4.431 483 HG22 ILE 68 HG22 ILE 68 30.664 9.669 -2.842 484 HG23 ILE 68 HG23 ILE 68 30.066 8.312 -3.797 485 HD11 ILE 68 HD11 ILE 68 30.983 12.069 -5.744 486 HD12 ILE 68 HD12 ILE 68 31.813 10.527 -5.964 487 HD13 ILE 68 HD13 ILE 68 31.040 11.318 -7.339 488 H TYR 69 H TYR 69 27.434 7.701 -2.762 489 HA TYR 69 HA TYR 69 27.512 9.252 -0.283 490 HB2 TYR 69 HB2 TYR 69 25.198 7.426 -0.954 491 HB3 TYR 69 HB3 TYR 69 25.378 8.435 0.478 492 HD1 TYR 69 HD2 TYR 69 25.751 11.027 -0.106 493 HD2 TYR 69 HD1 TYR 69 23.802 8.198 -2.615 494 HE1 TYR 69 HE2 TYR 69 24.569 12.860 -1.243 495 HE2 TYR 69 HE1 TYR 69 22.615 10.022 -3.761 496 HH TYR 69 HH TYR 69 22.890 12.433 -4.158 497 H LYS 70 H LYS 70 28.221 8.126 1.469 498 HA LYS 70 HA LYS 70 28.756 5.253 1.086 499 HB2 LYS 70 HB2 LYS 70 30.518 7.209 2.573 500 HB3 LYS 70 HB3 LYS 70 30.847 5.505 2.291 501 HG2 LYS 70 HG2 LYS 70 31.956 6.093 0.470 502 HG3 LYS 70 HG3 LYS 70 30.421 6.597 -0.241 503 HD2 LYS 70 HD2 LYS 70 30.789 8.815 0.968 504 HD3 LYS 70 HD3 LYS 70 32.449 8.268 1.222 505 HE2 LYS 70 HE2 LYS 70 31.218 8.260 -1.511 506 HE3 LYS 70 HE3 LYS 70 31.919 9.731 -0.839 507 HZ1 LYS 70 HZ1 LYS 70 33.588 8.651 -2.103 508 HZ2 LYS 70 HZ2 LYS 70 33.298 7.158 -1.363 509 HZ3 LYS 70 HZ3 LYS 70 33.992 8.422 -0.477 510 H VAL 71 H VAL 71 27.251 4.306 2.334 511 HA VAL 71 HA VAL 71 26.796 5.353 5.041 512 HB VAL 71 HB VAL 71 25.164 3.395 3.419 513 HG11 VAL 71 HG11 VAL 71 23.694 4.388 5.603 514 HG12 VAL 71 HG12 VAL 71 24.252 2.735 5.334 515 HG13 VAL 71 HG13 VAL 71 25.253 3.868 6.242 516 HG21 VAL 71 HG21 VAL 71 23.485 5.385 3.783 517 HG22 VAL 71 HG22 VAL 71 24.970 6.320 3.951 518 HG23 VAL 71 HG23 VAL 71 24.659 5.420 2.466 519 H GLU 72 H GLU 72 27.609 4.323 6.740 520 HA GLU 72 HA GLU 72 28.553 1.556 6.375 521 HB2 GLU 72 HB2 GLU 72 30.358 1.972 7.779 522 HB3 GLU 72 HB3 GLU 72 30.213 3.480 6.887 523 HG2 GLU 72 HG2 GLU 72 28.710 4.182 8.907 524 HG3 GLU 72 HG3 GLU 72 29.584 2.895 9.735 525 H ILE 73 H ILE 73 27.889 -0.003 7.753 526 HA ILE 73 HA ILE 73 26.036 0.814 9.894 527 HB ILE 73 HB ILE 73 26.052 -1.761 8.314 528 HG12 ILE 73 HG12 ILE 73 23.594 -0.320 8.159 529 HG13 ILE 73 HG13 ILE 73 24.904 0.791 7.771 530 HG21 ILE 73 HG21 ILE 73 24.723 -0.943 10.807 531 HG22 ILE 73 HG22 ILE 73 23.681 -1.713 9.611 532 HG23 ILE 73 HG23 ILE 73 25.115 -2.553 10.201 533 HD11 ILE 73 HD11 ILE 73 23.742 -0.664 5.924 534 HD12 ILE 73 HD12 ILE 73 25.473 -0.330 5.873 535 HD13 ILE 73 HD13 ILE 73 24.892 -1.881 6.479 536 H ASP 74 H ASP 74 26.316 0.029 11.922 537 HA ASP 74 HA ASP 74 28.744 -1.560 12.384 538 HB2 ASP 74 HB2 ASP 74 27.445 0.654 13.800 539 HB3 ASP 74 HB3 ASP 74 27.936 -0.666 14.858 540 H THR 75 H THR 75 28.265 -3.665 12.449 541 HA THR 75 HA THR 75 25.762 -4.572 13.628 542 HB THR 75 HB THR 75 26.324 -6.770 12.789 543 HG1 THR 75 HG1 THR 75 28.864 -5.615 12.530 544 HG21 THR 75 HG21 THR 75 26.460 -6.303 10.393 545 HG22 THR 75 HG22 THR 75 26.987 -4.655 10.736 546 HG23 THR 75 HG23 THR 75 25.365 -5.175 11.191 547 H LYS 76 H LYS 76 29.169 -4.475 14.339 548 HA LYS 76 HA LYS 76 29.300 -6.443 16.330 549 HB2 LYS 76 HB2 LYS 76 31.281 -5.146 17.156 550 HB3 LYS 76 HB3 LYS 76 31.330 -5.541 15.443 551 HG2 LYS 76 HG2 LYS 76 31.917 -3.380 15.253 552 HG3 LYS 76 HG3 LYS 76 30.172 -3.125 15.313 553 HD2 LYS 76 HD2 LYS 76 30.608 -3.078 17.912 554 HD3 LYS 76 HD3 LYS 76 32.241 -2.639 17.401 555 HE2 LYS 76 HE2 LYS 76 31.192 -0.838 15.989 556 HE3 LYS 76 HE3 LYS 76 29.665 -1.201 16.792 557 HZ1 LYS 76 HZ1 LYS 76 31.022 0.675 17.751 558 HZ2 LYS 76 HZ2 LYS 76 32.114 -0.495 18.297 559 HZ3 LYS 76 HZ3 LYS 76 30.516 -0.508 18.851 560 H SER 77 H SER 77 28.104 -3.171 16.385 561 HA SER 77 HA SER 77 27.911 -3.133 19.286 562 HB2 SER 77 HB2 SER 77 27.696 -1.156 17.116 563 HB3 SER 77 HB3 SER 77 26.559 -0.909 18.441 564 HG SER 77 HG SER 77 28.182 -0.528 19.791 565 H TYR 78 H TYR 78 25.950 -3.836 16.533 566 HA TYR 78 HA TYR 78 23.436 -3.554 17.918 567 HB2 TYR 78 HB2 TYR 78 23.401 -3.132 15.566 568 HB3 TYR 78 HB3 TYR 78 24.180 -4.671 15.214 569 HD1 TYR 78 HD1 TYR 78 21.217 -3.725 17.292 570 HD2 TYR 78 HD2 TYR 78 22.730 -6.047 14.064 571 HE1 TYR 78 HE1 TYR 78 19.010 -4.773 17.019 572 HE2 TYR 78 HE2 TYR 78 20.526 -7.101 13.782 573 HH TYR 78 HH TYR 78 18.019 -6.765 16.092 574 H TRP 79 H TRP 79 25.763 -6.057 17.323 575 HA TRP 79 HA TRP 79 23.956 -8.191 18.091 576 HB2 TRP 79 HB2 TRP 79 26.899 -8.148 17.406 577 HB3 TRP 79 HB3 TRP 79 26.037 -9.607 17.887 578 HD1 TRP 79 HD1 TRP 79 23.353 -8.921 16.157 579 HE1 TRP 79 HE1 TRP 79 23.446 -9.272 13.609 580 HE3 TRP 79 HE3 TRP 79 28.422 -8.805 15.507 581 HZ2 TRP 79 HZ2 TRP 79 25.409 -9.475 11.590 582 HZ3 TRP 79 HZ3 TRP 79 29.327 -9.086 13.236 583 HH2 TRP 79 HH2 TRP 79 27.849 -9.414 11.320 584 H LYS 80 H LYS 80 26.029 -5.985 19.633 585 HA LYS 80 HA LYS 80 26.574 -7.666 21.931 586 HB2 LYS 80 HB2 LYS 80 27.933 -5.934 22.720 587 HB3 LYS 80 HB3 LYS 80 28.113 -5.835 20.974 588 HG2 LYS 80 HG2 LYS 80 27.647 -3.675 21.191 589 HG3 LYS 80 HG3 LYS 80 25.978 -4.172 21.478 590 HD2 LYS 80 HD2 LYS 80 26.578 -2.722 23.260 591 HD3 LYS 80 HD3 LYS 80 26.571 -4.359 23.919 592 HE2 LYS 80 HE2 LYS 80 29.092 -4.343 23.347 593 HE3 LYS 80 HE3 LYS 80 28.902 -2.594 23.258 594 HZ1 LYS 80 HZ1 LYS 80 28.096 -4.197 25.619 595 HZ2 LYS 80 HZ2 LYS 80 28.226 -2.515 25.512 596 HZ3 LYS 80 HZ3 LYS 80 29.619 -3.475 25.466 597 H ALA 81 H ALA 81 24.120 -5.540 20.881 598 HA ALA 81 HA ALA 81 23.197 -4.833 23.530 599 HB1 ALA 81 HB1 ALA 81 21.150 -4.141 21.900 600 HB2 ALA 81 HB2 ALA 81 22.550 -3.118 22.227 601 HB3 ALA 81 HB3 ALA 81 22.502 -4.108 20.768 602 H LEU 82 H LEU 82 22.126 -6.934 20.876 603 HA LEU 82 HA LEU 82 20.052 -8.063 22.602 604 HB2 LEU 82 HB2 LEU 82 20.639 -8.534 19.682 605 HB3 LEU 82 HB3 LEU 82 19.272 -9.198 20.574 606 HG LEU 82 HG LEU 82 18.337 -7.430 19.401 607 HD11 LEU 82 HD11 LEU 82 17.734 -5.771 21.032 608 HD12 LEU 82 HD12 LEU 82 19.147 -6.162 22.012 609 HD13 LEU 82 HD13 LEU 82 17.849 -7.341 21.828 610 HD21 LEU 82 HD21 LEU 82 20.630 -6.546 18.730 611 HD22 LEU 82 HD22 LEU 82 20.556 -5.565 20.193 612 HD23 LEU 82 HD23 LEU 82 19.340 -5.359 18.931 613 H GLY 83 H GLY 83 23.203 -8.558 22.280 614 HA2 GLY 83 HA2 GLY 83 24.617 -10.322 22.676 615 HA3 GLY 83 HA3 GLY 83 23.244 -11.080 23.468 616 H ILE 84 H ILE 84 23.768 -10.216 20.060 617 HA ILE 84 HA ILE 84 22.947 -12.904 19.295 618 HB ILE 84 HB ILE 84 23.651 -10.625 17.451 619 HG12 ILE 84 HG12 ILE 84 21.882 -9.936 19.037 620 HG13 ILE 84 HG13 ILE 84 21.278 -10.069 17.388 621 HG21 ILE 84 HG21 ILE 84 21.764 -12.053 16.183 622 HG22 ILE 84 HG22 ILE 84 23.492 -12.369 16.027 623 HG23 ILE 84 HG23 ILE 84 22.516 -13.329 17.139 624 HD11 ILE 84 HD11 ILE 84 20.993 -12.512 18.964 625 HD12 ILE 84 HD12 ILE 84 20.086 -11.131 19.582 626 HD13 ILE 84 HD13 ILE 84 19.835 -11.682 17.926 627 H SER 85 H SER 85 24.167 -14.217 17.858 628 HA SER 85 HA SER 85 26.807 -14.619 18.511 629 HB2 SER 85 HB2 SER 85 25.203 -15.382 16.084 630 HB3 SER 85 HB3 SER 85 26.907 -15.816 16.210 631 HG SER 85 HG SER 85 25.985 -17.495 17.165 632 HA PRO 86 HA PRO 86 28.575 -11.015 16.488 633 HB2 PRO 86 HB2 PRO 86 31.029 -11.307 17.610 634 HB3 PRO 86 HB3 PRO 86 29.660 -10.591 18.468 635 HG2 PRO 86 HG2 PRO 86 30.744 -13.378 18.620 636 HG3 PRO 86 HG3 PRO 86 30.199 -12.315 19.932 637 HD2 PRO 86 HD2 PRO 86 28.657 -14.302 18.933 638 HD3 PRO 86 HD3 PRO 86 27.975 -12.790 19.563 639 H MET 87 H MET 87 29.687 -10.824 14.616 640 HA MET 87 HA MET 87 31.121 -13.208 13.646 641 HB2 MET 87 HB2 MET 87 29.525 -11.150 12.117 642 HB3 MET 87 HB3 MET 87 30.557 -12.348 11.347 643 HG2 MET 87 HG2 MET 87 29.203 -14.131 12.071 644 HG3 MET 87 HG3 MET 87 28.328 -13.105 13.206 645 HE1 MET 87 HE1 MET 87 29.120 -11.532 9.711 646 HE2 MET 87 HE2 MET 87 29.314 -13.263 9.434 647 HE3 MET 87 HE3 MET 87 27.985 -12.392 8.669 648 H HIS 88 H HIS 88 31.270 -9.834 14.289 649 HA HIS 88 HA HIS 88 32.972 -8.324 14.220 650 HB2 HIS 88 HB2 HIS 88 34.211 -10.367 15.155 651 HB3 HIS 88 HB3 HIS 88 34.843 -10.583 13.526 652 HD1 HIS 88 HD1 HIS 88 37.102 -9.634 13.317 653 HD2 HIS 88 HD2 HIS 88 34.756 -7.434 15.948 654 HE1 HIS 88 HE1 HIS 88 38.574 -7.762 14.127 655 H GLU 89 H GLU 89 31.495 -8.348 11.995 656 HA GLU 89 HA GLU 89 33.244 -7.298 10.035 657 HB2 GLU 89 HB2 GLU 89 33.691 -9.657 9.574 658 HB3 GLU 89 HB3 GLU 89 31.970 -9.963 9.390 659 HG2 GLU 89 HG2 GLU 89 32.035 -8.251 7.508 660 HG3 GLU 89 HG3 GLU 89 33.790 -8.401 7.593 661 H HIS 90 H HIS 90 32.048 -5.582 9.544 662 HA HIS 90 HA HIS 90 29.167 -5.960 9.066 663 HB2 HIS 90 HB2 HIS 90 28.869 -3.620 9.599 664 HB3 HIS 90 HB3 HIS 90 29.789 -4.383 10.892 665 HD1 HIS 90 HD1 HIS 90 32.200 -3.601 11.251 666 HD2 HIS 90 HD2 HIS 90 30.307 -1.755 8.045 667 HE1 HIS 90 HE1 HIS 90 33.695 -1.687 10.599 668 H ALA 91 H ALA 91 28.187 -4.874 7.289 669 HA ALA 91 HA ALA 91 30.032 -4.516 5.036 670 HB1 ALA 91 HB1 ALA 91 27.458 -4.496 4.015 671 HB2 ALA 91 HB2 ALA 91 28.570 -5.866 4.036 672 HB3 ALA 91 HB3 ALA 91 27.389 -5.669 5.331 673 H GLU 92 H GLU 92 29.356 -2.861 3.389 674 HA GLU 92 HA GLU 92 27.986 -0.545 4.524 675 HB2 GLU 92 HB2 GLU 92 29.866 0.930 3.680 676 HB3 GLU 92 HB3 GLU 92 30.213 -0.011 5.123 677 HG2 GLU 92 HG2 GLU 92 31.472 -1.608 3.841 678 HG3 GLU 92 HG3 GLU 92 31.030 -0.801 2.338 679 H VAL 93 H VAL 93 27.783 1.224 2.813 680 HA VAL 93 HA VAL 93 27.427 -0.001 0.154 681 HB VAL 93 HB VAL 93 25.614 2.036 1.457 682 HG11 VAL 93 HG11 VAL 93 25.909 1.058 -1.302 683 HG12 VAL 93 HG12 VAL 93 24.256 1.104 -0.685 684 HG13 VAL 93 HG13 VAL 93 25.236 2.572 -0.698 685 HG21 VAL 93 HG21 VAL 93 25.527 -0.915 1.232 686 HG22 VAL 93 HG22 VAL 93 24.900 0.146 2.495 687 HG23 VAL 93 HG23 VAL 93 24.014 -0.045 0.982 688 H VAL 94 H VAL 94 28.903 0.869 -1.147 689 HA VAL 94 HA VAL 94 29.244 3.795 -1.101 690 HB VAL 94 HB VAL 94 31.443 1.787 -1.610 691 HG11 VAL 94 HG11 VAL 94 31.296 4.771 -1.741 692 HG12 VAL 94 HG12 VAL 94 32.817 3.970 -1.337 693 HG13 VAL 94 HG13 VAL 94 32.023 3.635 -2.877 694 HG21 VAL 94 HG21 VAL 94 32.392 2.775 0.510 695 HG22 VAL 94 HG22 VAL 94 30.805 3.493 0.787 696 HG23 VAL 94 HG23 VAL 94 30.979 1.739 0.714 697 H PHE 95 H PHE 95 28.311 4.507 -2.907 698 HA PHE 95 HA PHE 95 29.085 3.260 -5.447 699 HB2 PHE 95 HB2 PHE 95 26.774 3.518 -6.291 700 HB3 PHE 95 HB3 PHE 95 26.868 2.392 -4.942 701 HD1 PHE 95 HD1 PHE 95 25.723 5.693 -6.032 702 HD2 PHE 95 HD2 PHE 95 25.855 2.901 -2.822 703 HE1 PHE 95 HE1 PHE 95 23.991 6.978 -4.847 704 HE2 PHE 95 HE2 PHE 95 24.123 4.180 -1.633 705 HZ PHE 95 HZ PHE 95 23.188 6.222 -2.645 706 H THR 96 H THR 96 29.411 4.659 -7.122 707 HA THR 96 HA THR 96 29.117 7.523 -6.491 708 HB THR 96 HB THR 96 31.438 7.061 -6.688 709 HG1 THR 96 HG1 THR 96 30.793 7.958 -9.298 710 HG21 THR 96 HG21 THR 96 30.553 5.123 -8.647 711 HG22 THR 96 HG22 THR 96 32.071 5.204 -7.753 712 HG23 THR 96 HG23 THR 96 31.887 6.096 -9.262 713 H ALA 97 H ALA 97 28.325 8.922 -8.052 714 HA ALA 97 HA ALA 97 26.569 7.725 -9.998 715 HB1 ALA 97 HB1 ALA 97 25.403 9.592 -9.726 716 HB2 ALA 97 HB2 ALA 97 26.610 10.119 -8.553 717 HB3 ALA 97 HB3 ALA 97 26.767 10.581 -10.248 718 H ASN 98 H ASN 98 26.525 8.378 -12.259 719 HA ASN 98 HA ASN 98 27.462 8.611 -14.318 720 HB2 ASN 98 HB2 ASN 98 28.240 10.810 -13.063 721 HB3 ASN 98 HB3 ASN 98 29.827 10.061 -13.206 722 HD21 ASN 98 HD21 ASN 98 29.585 12.363 -14.431 723 HD22 ASN 98 HD22 ASN 98 29.436 12.179 -16.142 724 H ASP 99 H ASP 99 28.053 6.292 -12.813 725 HA ASP 99 HA ASP 99 30.778 5.672 -13.750 726 HB2 ASP 99 HB2 ASP 99 30.114 5.561 -11.199 727 HB3 ASP 99 HB3 ASP 99 29.420 4.011 -11.667 728 H SER 100 H SER 100 28.186 5.537 -15.197 729 HA SER 100 HA SER 100 27.071 4.160 -16.626 730 HB2 SER 100 HB2 SER 100 29.585 3.788 -17.221 731 HB3 SER 100 HB3 SER 100 29.350 2.209 -16.473 732 HG SER 100 HG SER 100 27.957 1.654 -18.033 733 H GLY 101 H GLY 101 26.179 3.866 -14.105 734 HA2 GLY 101 HA2 GLY 101 25.572 0.989 -14.002 735 HA3 GLY 101 HA3 GLY 101 26.087 1.814 -12.538 736 HA PRO 102 HA PRO 102 21.415 1.970 -12.988 737 HB2 PRO 102 HB2 PRO 102 20.856 0.686 -10.663 738 HB3 PRO 102 HB3 PRO 102 21.087 -0.162 -12.196 739 HG2 PRO 102 HG2 PRO 102 23.017 0.238 -9.942 740 HG3 PRO 102 HG3 PRO 102 22.701 -1.221 -10.900 741 HD2 PRO 102 HD2 PRO 102 24.829 0.391 -11.358 742 HD3 PRO 102 HD3 PRO 102 24.012 -0.505 -12.655 743 H ARG 103 H ARG 103 19.925 2.531 -10.889 744 HA ARG 103 HA ARG 103 21.330 4.612 -9.357 745 HB2 ARG 103 HB2 ARG 103 18.627 4.901 -10.682 746 HB3 ARG 103 HB3 ARG 103 19.381 6.094 -9.633 747 HG2 ARG 103 HG2 ARG 103 19.973 6.967 -11.635 748 HG3 ARG 103 HG3 ARG 103 21.334 5.865 -11.416 749 HD2 ARG 103 HD2 ARG 103 20.459 4.300 -12.913 750 HD3 ARG 103 HD3 ARG 103 18.836 4.981 -12.817 751 HE ARG 103 HE ARG 103 20.452 6.957 -13.878 752 HH11 ARG 103 HH11 ARG 103 19.451 3.734 -14.730 753 HH12 ARG 103 HH12 ARG 103 19.564 4.010 -16.438 754 HH21 ARG 103 HH21 ARG 103 20.603 7.334 -16.123 755 HH22 ARG 103 HH22 ARG 103 20.219 6.057 -17.228 756 H ARG 104 H ARG 104 20.902 4.626 -7.235 757 HA ARG 104 HA ARG 104 18.451 3.388 -6.239 758 HB2 ARG 104 HB2 ARG 104 20.459 1.737 -6.340 759 HB3 ARG 104 HB3 ARG 104 21.061 2.645 -4.960 760 HG2 ARG 104 HG2 ARG 104 19.453 1.858 -3.558 761 HG3 ARG 104 HG3 ARG 104 18.264 1.668 -4.848 762 HD2 ARG 104 HD2 ARG 104 20.699 -0.076 -4.512 763 HD3 ARG 104 HD3 ARG 104 19.099 -0.479 -3.890 764 HE ARG 104 HE ARG 104 20.003 -0.728 -6.583 765 HH11 ARG 104 HH11 ARG 104 17.204 -0.100 -4.611 766 HH12 ARG 104 HH12 ARG 104 16.078 -0.673 -5.796 767 HH21 ARG 104 HH21 ARG 104 18.531 -1.485 -8.153 768 HH22 ARG 104 HH22 ARG 104 16.834 -1.461 -7.811 769 H TYR 105 H TYR 105 17.749 4.188 -4.277 770 HA TYR 105 HA TYR 105 19.316 6.435 -3.190 771 HB2 TYR 105 HB2 TYR 105 17.253 7.554 -2.647 772 HB3 TYR 105 HB3 TYR 105 17.198 7.089 -4.344 773 HD1 TYR 105 HD2 TYR 105 15.941 4.924 -4.929 774 HD2 TYR 105 HD1 TYR 105 15.530 6.930 -1.200 775 HE1 TYR 105 HE2 TYR 105 13.806 3.766 -4.548 776 HE2 TYR 105 HE1 TYR 105 13.393 5.776 -0.808 777 HH TYR 105 HH TYR 105 12.339 3.521 -1.644 778 H THR 106 H THR 106 17.399 3.602 -2.486 779 HA THR 106 HA THR 106 17.599 4.001 0.387 780 HB THR 106 HB THR 106 16.413 1.700 -1.176 781 HG1 THR 106 HG1 THR 106 14.439 2.705 -0.640 782 HG21 THR 106 HG21 THR 106 16.925 0.820 0.935 783 HG22 THR 106 HG22 THR 106 15.244 1.333 1.084 784 HG23 THR 106 HG23 THR 106 16.534 2.328 1.758 785 H ILE 107 H ILE 107 18.999 2.995 1.716 786 HA ILE 107 HA ILE 107 21.161 1.487 0.506 787 HB ILE 107 HB ILE 107 20.754 2.436 3.344 788 HG12 ILE 107 HG12 ILE 107 22.957 3.714 2.387 789 HG13 ILE 107 HG13 ILE 107 21.995 3.576 0.919 790 HG21 ILE 107 HG21 ILE 107 22.321 0.974 3.932 791 HG22 ILE 107 HG22 ILE 107 22.567 0.483 2.258 792 HG23 ILE 107 HG23 ILE 107 23.453 1.861 2.912 793 HD11 ILE 107 HD11 ILE 107 20.237 4.835 1.832 794 HD12 ILE 107 HD12 ILE 107 20.881 4.695 3.469 795 HD13 ILE 107 HD13 ILE 107 21.716 5.688 2.273 796 H ALA 108 H ALA 108 20.846 -0.618 0.186 797 HA ALA 108 HA ALA 108 19.182 -2.152 2.026 798 HB1 ALA 108 HB1 ALA 108 20.209 -2.559 -0.730 799 HB2 ALA 108 HB2 ALA 108 19.865 -3.989 0.243 800 HB3 ALA 108 HB3 ALA 108 18.592 -2.812 -0.074 801 H ALA 109 H ALA 109 20.136 -2.947 3.779 802 HA ALA 109 HA ALA 109 22.792 -4.184 3.483 803 HB1 ALA 109 HB1 ALA 109 21.826 -2.390 5.697 804 HB2 ALA 109 HB2 ALA 109 23.230 -3.447 5.860 805 HB3 ALA 109 HB3 ALA 109 23.224 -2.170 4.643 806 H MET 110 H MET 110 22.731 -6.278 3.931 807 HA MET 110 HA MET 110 20.647 -7.265 5.765 808 HB2 MET 110 HB2 MET 110 21.960 -8.533 3.368 809 HB3 MET 110 HB3 MET 110 21.094 -9.488 4.564 810 HG2 MET 110 HG2 MET 110 19.121 -7.945 4.135 811 HG3 MET 110 HG3 MET 110 20.014 -7.385 2.723 812 HE1 MET 110 HE1 MET 110 17.333 -10.356 3.663 813 HE2 MET 110 HE2 MET 110 18.585 -11.598 3.603 814 HE3 MET 110 HE3 MET 110 18.754 -10.228 4.701 815 H LEU 111 H LEU 111 21.295 -8.105 7.631 816 HA LEU 111 HA LEU 111 24.116 -8.432 8.162 817 HB2 LEU 111 HB2 LEU 111 21.728 -8.903 9.941 818 HB3 LEU 111 HB3 LEU 111 23.412 -8.876 10.461 819 HG LEU 111 HG LEU 111 22.614 -6.798 11.112 820 HD11 LEU 111 HD11 LEU 111 23.609 -6.136 8.357 821 HD12 LEU 111 HD12 LEU 111 24.672 -6.754 9.619 822 HD13 LEU 111 HD13 LEU 111 23.822 -5.227 9.853 823 HD21 LEU 111 HD21 LEU 111 20.494 -7.164 9.642 824 HD22 LEU 111 HD22 LEU 111 21.367 -6.178 8.469 825 HD23 LEU 111 HD23 LEU 111 20.999 -5.528 10.067 826 H SER 112 H SER 112 24.116 -10.211 6.454 827 HA SER 112 HA SER 112 22.955 -12.727 7.012 828 HB2 SER 112 HB2 SER 112 24.990 -13.452 5.450 829 HB3 SER 112 HB3 SER 112 23.579 -12.615 4.805 830 HG SER 112 HG SER 112 25.997 -11.838 4.526 831 HA PRO 113 HA PRO 113 25.605 -14.562 9.986 832 HB2 PRO 113 HB2 PRO 113 25.812 -17.116 9.090 833 HB3 PRO 113 HB3 PRO 113 24.333 -16.466 9.806 834 HG2 PRO 113 HG2 PRO 113 25.042 -16.824 6.919 835 HG3 PRO 113 HG3 PRO 113 23.511 -17.170 7.747 836 HD2 PRO 113 HD2 PRO 113 23.899 -14.929 6.278 837 HD3 PRO 113 HD3 PRO 113 22.847 -14.964 7.707 838 H TYR 114 H TYR 114 27.534 -16.366 9.950 839 HA TYR 114 HA TYR 114 29.679 -15.024 8.558 840 HB2 TYR 114 HB2 TYR 114 29.675 -16.040 10.971 841 HB3 TYR 114 HB3 TYR 114 30.048 -17.545 10.140 842 HD1 TYR 114 HD1 TYR 114 31.208 -14.011 10.407 843 HD2 TYR 114 HD2 TYR 114 32.260 -18.064 9.655 844 HE1 TYR 114 HE1 TYR 114 33.584 -13.375 10.339 845 HE2 TYR 114 HE2 TYR 114 34.637 -17.441 9.585 846 HH TYR 114 HH TYR 114 36.126 -15.809 9.969 847 H SER 115 H SER 115 27.800 -17.915 8.200 848 HA SER 115 HA SER 115 29.607 -19.313 6.497 849 HB2 SER 115 HB2 SER 115 26.611 -19.678 6.544 850 HB3 SER 115 HB3 SER 115 27.849 -20.876 6.164 851 HG SER 115 HG SER 115 26.756 -20.648 8.432 852 H TYR 116 H TYR 116 30.133 -18.797 4.490 853 HA TYR 116 HA TYR 116 28.161 -18.020 2.558 854 HB2 TYR 116 HB2 TYR 116 28.714 -15.870 3.778 855 HB3 TYR 116 HB3 TYR 116 30.345 -16.015 3.133 856 HD1 TYR 116 HD2 TYR 116 26.983 -16.564 1.595 857 HD2 TYR 116 HD1 TYR 116 30.647 -14.402 1.506 858 HE1 TYR 116 HE2 TYR 116 26.262 -15.438 -0.469 859 HE2 TYR 116 HE1 TYR 116 29.935 -13.269 -0.558 860 HH TYR 116 HH TYR 116 27.025 -14.208 -2.259 861 H SER 117 H SER 117 29.077 -17.816 0.385 862 HA SER 117 HA SER 117 31.152 -19.758 -0.024 863 HB2 SER 117 HB2 SER 117 30.758 -19.234 -2.458 864 HB3 SER 117 HB3 SER 117 29.320 -19.753 -1.578 865 HG SER 117 HG SER 117 28.601 -17.985 -2.555 866 H THR 118 H THR 118 32.920 -18.689 1.020 867 HA THR 118 HA THR 118 34.554 -17.217 -0.788 868 HB THR 118 HB THR 118 33.120 -15.363 -0.009 869 HG1 THR 118 HG1 THR 118 35.039 -14.157 0.979 870 HG21 THR 118 HG21 THR 118 32.568 -16.215 2.213 871 HG22 THR 118 HG22 THR 118 33.281 -14.606 2.322 872 HG23 THR 118 HG23 THR 118 34.247 -16.028 2.714 873 H THR 119 H THR 119 36.677 -16.661 0.185 874 HA THR 119 HA THR 119 37.282 -18.282 2.565 875 HB THR 119 HB THR 119 39.511 -18.809 1.430 876 HG1 THR 119 HG1 THR 119 39.603 -18.583 -0.767 877 HG21 THR 119 HG21 THR 119 36.961 -19.991 0.322 878 HG22 THR 119 HG22 THR 119 37.815 -20.513 1.774 879 HG23 THR 119 HG23 THR 119 38.559 -20.723 0.190 880 H ALA 120 H ALA 120 36.842 -15.565 2.686 881 HA ALA 120 HA ALA 120 39.318 -14.656 3.788 882 HB1 ALA 120 HB1 ALA 120 40.154 -13.537 2.067 883 HB2 ALA 120 HB2 ALA 120 38.773 -13.990 1.067 884 HB3 ALA 120 HB3 ALA 120 38.710 -12.524 2.046 885 H VAL 121 H VAL 121 39.096 -12.681 4.981 886 HA VAL 121 HA VAL 121 36.322 -12.188 5.778 887 HB VAL 121 HB VAL 121 37.984 -12.765 7.531 888 HG11 VAL 121 HG11 VAL 121 39.873 -11.580 7.945 889 HG12 VAL 121 HG12 VAL 121 39.730 -11.225 6.222 890 HG13 VAL 121 HG13 VAL 121 39.165 -10.055 7.415 891 HG21 VAL 121 HG21 VAL 121 37.059 -9.946 7.963 892 HG22 VAL 121 HG22 VAL 121 35.912 -11.280 7.850 893 HG23 VAL 121 HG23 VAL 121 37.137 -11.276 9.119 894 H VAL 122 H VAL 122 35.331 -10.248 5.578 895 HA VAL 122 HA VAL 122 36.646 -8.258 3.912 896 HB VAL 122 HB VAL 122 33.804 -8.256 4.931 897 HG11 VAL 122 HG11 VAL 122 34.168 -6.973 2.413 898 HG12 VAL 122 HG12 VAL 122 33.619 -6.278 3.939 899 HG13 VAL 122 HG13 VAL 122 35.341 -6.321 3.557 900 HG21 VAL 122 HG21 VAL 122 34.961 -9.384 2.387 901 HG22 VAL 122 HG22 VAL 122 34.111 -10.263 3.656 902 HG23 VAL 122 HG23 VAL 122 33.240 -9.105 2.651 903 H THR 123 H THR 123 38.138 -7.474 5.495 904 HA THR 123 HA THR 123 36.896 -5.561 7.351 905 HB THR 123 HB THR 123 39.278 -7.310 7.994 906 HG1 THR 123 HG1 THR 123 36.565 -7.309 8.802 907 HG21 THR 123 HG21 THR 123 38.985 -6.242 10.280 908 HG22 THR 123 HG22 THR 123 37.973 -5.040 9.481 909 HG23 THR 123 HG23 THR 123 39.666 -5.213 9.021 910 H ASN 124 H ASN 124 37.602 -3.554 7.049 911 HA ASN 124 HA ASN 124 40.296 -2.847 6.626 912 HB2 ASN 124 HB2 ASN 124 39.838 -1.847 4.269 913 HB3 ASN 124 HB3 ASN 124 40.230 -3.559 4.406 914 HD21 ASN 124 HD21 ASN 124 37.950 -1.257 3.396 915 HD22 ASN 124 HD22 ASN 124 36.718 -2.354 2.883 916 HA PRO 125 HA PRO 125 37.343 0.430 8.097 917 HB2 PRO 125 HB2 PRO 125 38.742 1.014 10.349 918 HB3 PRO 125 HB3 PRO 125 37.526 -0.267 10.278 919 HG2 PRO 125 HG2 PRO 125 40.507 -0.472 10.100 920 HG3 PRO 125 HG3 PRO 125 39.367 -1.493 10.995 921 HD2 PRO 125 HD2 PRO 125 40.418 -2.229 8.611 922 HD3 PRO 125 HD3 PRO 125 38.787 -2.705 9.122 923 H LYS 126 H LYS 126 38.179 2.678 9.079 924 HA LYS 126 HA LYS 126 39.466 4.041 7.052 925 HB2 LYS 126 HB2 LYS 126 39.539 5.918 8.497 926 HB3 LYS 126 HB3 LYS 126 38.108 5.008 8.963 927 HG2 LYS 126 HG2 LYS 126 40.750 4.752 10.375 928 HG3 LYS 126 HG3 LYS 126 39.500 5.906 10.850 929 HD2 LYS 126 HD2 LYS 126 37.924 3.936 11.011 930 HD3 LYS 126 HD3 LYS 126 39.341 2.897 10.838 931 HE2 LYS 126 HE2 LYS 126 40.176 3.466 12.898 932 HE3 LYS 126 HE3 LYS 126 39.388 5.042 12.903 933 HZ1 LYS 126 HZ1 LYS 126 37.244 3.596 13.011 934 HZ2 LYS 126 HZ2 LYS 126 38.132 3.904 14.418 935 HZ3 LYS 126 HZ3 LYS 126 38.291 2.417 13.626 936 H GLU 127 H GLU 127 40.827 2.284 9.734 937 HA GLU 127 HA GLU 127 43.496 3.336 9.250 938 HB2 GLU 127 HB2 GLU 127 42.229 1.629 11.337 939 HB3 GLU 127 HB3 GLU 127 43.957 1.450 11.070 940 HG2 GLU 127 HG2 GLU 127 43.931 4.068 11.261 941 HG3 GLU 127 HG3 GLU 127 42.431 3.766 12.135 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -1.734 15.531 8.614 2 HA2 GLY 1 HA2 GLY 1 -0.011 13.284 9.367 3 HA3 GLY 1 HA3 GLY 1 -1.040 13.367 7.946 4 HA PRO 2 HA PRO 2 2.974 15.949 7.037 5 HB2 PRO 2 HB2 PRO 2 5.073 15.436 8.681 6 HB3 PRO 2 HB3 PRO 2 3.903 16.727 8.988 7 HG2 PRO 2 HG2 PRO 2 4.046 13.979 10.168 8 HG3 PRO 2 HG3 PRO 2 3.712 15.524 10.970 9 HD2 PRO 2 HD2 PRO 2 1.754 13.781 10.294 10 HD3 PRO 2 HD3 PRO 2 1.507 15.539 10.299 11 H THR 3 H THR 3 2.667 12.668 7.889 12 HA THR 3 HA THR 3 4.567 11.928 5.777 13 HB THR 3 HB THR 3 5.377 10.020 7.074 14 HG1 THR 3 HG1 THR 3 4.059 9.441 8.638 15 HG21 THR 3 HG21 THR 3 7.011 11.260 7.972 16 HG22 THR 3 HG22 THR 3 5.902 12.061 9.085 17 HG23 THR 3 HG23 THR 3 6.087 12.663 7.437 18 H GLY 4 H GLY 4 4.285 9.460 5.302 19 HA2 GLY 4 HA2 GLY 4 2.396 7.734 5.637 20 HA3 GLY 4 HA3 GLY 4 1.391 9.025 4.998 21 H THR 5 H THR 5 0.790 7.615 3.276 22 HA THR 5 HA THR 5 2.914 7.122 1.299 23 HB THR 5 HB THR 5 1.496 5.434 0.312 24 HG1 THR 5 HG1 THR 5 -0.590 5.291 0.752 25 HG21 THR 5 HG21 THR 5 2.858 4.909 2.384 26 HG22 THR 5 HG22 THR 5 1.532 3.800 2.031 27 HG23 THR 5 HG23 THR 5 1.351 5.020 3.291 28 H GLY 6 H GLY 6 1.420 9.669 1.791 29 HA2 GLY 6 HA2 GLY 6 -0.420 10.043 -0.355 30 HA3 GLY 6 HA3 GLY 6 0.331 11.312 0.601 31 H GLU 7 H GLU 7 3.042 10.249 -0.095 32 HA GLU 7 HA GLU 7 3.277 10.562 -2.945 33 HB2 GLU 7 HB2 GLU 7 3.130 12.913 -1.584 34 HB3 GLU 7 HB3 GLU 7 4.863 12.624 -1.558 35 HG2 GLU 7 HG2 GLU 7 5.081 12.853 -3.817 36 HG3 GLU 7 HG3 GLU 7 3.429 12.333 -4.142 37 H SER 8 H SER 8 5.641 10.625 -3.598 38 HA SER 8 HA SER 8 6.985 8.430 -2.605 39 HB2 SER 8 HB2 SER 8 9.056 9.840 -3.613 40 HB3 SER 8 HB3 SER 8 7.882 8.995 -4.622 41 HG SER 8 HG SER 8 7.442 10.876 -5.422 42 H LYS 9 H LYS 9 8.865 8.179 -1.322 43 HA LYS 9 HA LYS 9 8.898 9.911 0.985 44 HB2 LYS 9 HB2 LYS 9 10.263 7.338 0.253 45 HB3 LYS 9 HB3 LYS 9 10.788 8.258 1.657 46 HG2 LYS 9 HG2 LYS 9 9.266 6.594 2.404 47 HG3 LYS 9 HG3 LYS 9 8.447 8.154 2.510 48 HD2 LYS 9 HD2 LYS 9 6.976 6.429 1.587 49 HD3 LYS 9 HD3 LYS 9 7.295 7.703 0.408 50 HE2 LYS 9 HE2 LYS 9 7.391 5.391 -0.525 51 HE3 LYS 9 HE3 LYS 9 8.865 6.329 -0.755 52 HZ1 LYS 9 HZ1 LYS 9 9.119 3.947 0.025 53 HZ2 LYS 9 HZ2 LYS 9 8.542 4.474 1.524 54 HZ3 LYS 9 HZ3 LYS 9 9.970 5.123 0.893 55 H CYS 10 H CYS 10 11.295 10.226 1.904 56 HA CYS 10 HA CYS 10 12.444 12.305 0.504 57 HB2 CYS 10 HB2 CYS 10 14.494 11.848 1.925 58 HB3 CYS 10 HB3 CYS 10 12.985 12.057 2.805 59 HG CYS 10 HG CYS 10 14.283 10.074 4.154 60 HA PRO 11 HA PRO 11 14.858 10.616 -2.746 61 HB2 PRO 11 HB2 PRO 11 16.985 12.304 -2.776 62 HB3 PRO 11 HB3 PRO 11 15.375 12.776 -3.332 63 HG2 PRO 11 HG2 PRO 11 16.705 13.310 -0.703 64 HG3 PRO 11 HG3 PRO 11 15.740 14.404 -1.712 65 HD2 PRO 11 HD2 PRO 11 14.727 13.157 0.468 66 HD3 PRO 11 HD3 PRO 11 13.741 13.537 -0.960 67 H LEU 12 H LEU 12 16.143 10.821 0.445 68 HA LEU 12 HA LEU 12 18.037 8.676 -0.195 69 HB2 LEU 12 HB2 LEU 12 19.141 10.961 -0.007 70 HB3 LEU 12 HB3 LEU 12 18.726 10.901 1.704 71 HG LEU 12 HG LEU 12 21.084 10.261 1.152 72 HD11 LEU 12 HD11 LEU 12 21.107 9.042 3.019 73 HD12 LEU 12 HD12 LEU 12 20.063 7.800 2.327 74 HD13 LEU 12 HD13 LEU 12 19.356 9.253 3.033 75 HD21 LEU 12 HD21 LEU 12 19.978 8.800 -0.860 76 HD22 LEU 12 HD22 LEU 12 20.277 7.556 0.354 77 HD23 LEU 12 HD23 LEU 12 21.605 8.565 -0.221 78 H MET 13 H MET 13 17.450 6.966 0.955 79 HA MET 13 HA MET 13 16.777 7.324 3.783 80 HB2 MET 13 HB2 MET 13 14.885 5.789 3.612 81 HB3 MET 13 HB3 MET 13 14.642 7.190 2.577 82 HG2 MET 13 HG2 MET 13 14.724 5.978 0.677 83 HG3 MET 13 HG3 MET 13 15.914 4.848 1.320 84 HE1 MET 13 HE1 MET 13 14.203 2.113 2.907 85 HE2 MET 13 HE2 MET 13 15.523 3.274 3.051 86 HE3 MET 13 HE3 MET 13 14.085 3.443 4.060 87 H VAL 14 H VAL 14 17.234 5.537 5.103 88 HA VAL 14 HA VAL 14 19.117 3.637 3.898 89 HB VAL 14 HB VAL 14 18.684 4.355 6.801 90 HG11 VAL 14 HG11 VAL 14 20.676 2.509 5.493 91 HG12 VAL 14 HG12 VAL 14 20.779 3.064 7.165 92 HG13 VAL 14 HG13 VAL 14 19.415 2.073 6.645 93 HG21 VAL 14 HG21 VAL 14 20.751 5.163 4.775 94 HG22 VAL 14 HG22 VAL 14 19.724 6.197 5.768 95 HG23 VAL 14 HG23 VAL 14 21.037 5.284 6.511 96 H LYS 15 H LYS 15 18.787 1.479 3.920 97 HA LYS 15 HA LYS 15 16.427 0.458 5.352 98 HB2 LYS 15 HB2 LYS 15 15.758 0.609 3.060 99 HB3 LYS 15 HB3 LYS 15 17.266 -0.110 2.509 100 HG2 LYS 15 HG2 LYS 15 15.508 -1.730 2.336 101 HG3 LYS 15 HG3 LYS 15 16.619 -2.223 3.615 102 HD2 LYS 15 HD2 LYS 15 14.409 -0.538 4.536 103 HD3 LYS 15 HD3 LYS 15 13.898 -2.083 3.853 104 HE2 LYS 15 HE2 LYS 15 15.972 -2.871 5.403 105 HE3 LYS 15 HE3 LYS 15 15.375 -1.497 6.331 106 HZ1 LYS 15 HZ1 LYS 15 14.106 -3.188 7.164 107 HZ2 LYS 15 HZ2 LYS 15 14.039 -4.032 5.700 108 HZ3 LYS 15 HZ3 LYS 15 13.092 -2.647 5.923 109 H VAL 16 H VAL 16 17.212 -0.818 6.898 110 HA VAL 16 HA VAL 16 19.320 -2.746 6.168 111 HB VAL 16 HB VAL 16 18.937 -1.468 8.878 112 HG11 VAL 16 HG11 VAL 16 21.196 -2.541 9.283 113 HG12 VAL 16 HG12 VAL 16 19.814 -3.636 9.200 114 HG13 VAL 16 HG13 VAL 16 20.904 -3.481 7.821 115 HG21 VAL 16 HG21 VAL 16 19.807 0.146 7.293 116 HG22 VAL 16 HG22 VAL 16 21.078 -0.340 8.414 117 HG23 VAL 16 HG23 VAL 16 21.049 -0.994 6.776 118 H LEU 17 H LEU 17 18.659 -4.780 6.264 119 HA LEU 17 HA LEU 17 16.743 -5.574 8.333 120 HB2 LEU 17 HB2 LEU 17 15.271 -6.613 6.881 121 HB3 LEU 17 HB3 LEU 17 15.664 -5.110 6.048 122 HG LEU 17 HG LEU 17 17.510 -6.942 5.070 123 HD11 LEU 17 HD11 LEU 17 15.515 -8.470 6.186 124 HD12 LEU 17 HD12 LEU 17 16.625 -8.981 4.914 125 HD13 LEU 17 HD13 LEU 17 15.032 -8.351 4.494 126 HD21 LEU 17 HD21 LEU 17 16.635 -6.351 3.051 127 HD22 LEU 17 HD22 LEU 17 15.926 -5.080 4.047 128 HD23 LEU 17 HD23 LEU 17 14.966 -6.494 3.606 129 H ASP 18 H ASP 18 16.861 -7.754 8.957 130 HA ASP 18 HA ASP 18 19.461 -8.934 8.598 131 HB2 ASP 18 HB2 ASP 18 17.070 -9.497 10.293 132 HB3 ASP 18 HB3 ASP 18 18.229 -10.797 10.031 133 H ALA 19 H ALA 19 20.019 -10.417 7.151 134 HA ALA 19 HA ALA 19 18.055 -11.459 5.318 135 HB1 ALA 19 HB1 ALA 19 20.406 -12.739 4.714 136 HB2 ALA 19 HB2 ALA 19 19.862 -11.207 4.030 137 HB3 ALA 19 HB3 ALA 19 20.958 -11.216 5.412 138 H VAL 20 H VAL 20 18.925 -12.369 8.336 139 HA VAL 20 HA VAL 20 19.068 -15.228 7.924 140 HB VAL 20 HB VAL 20 18.794 -13.666 10.496 141 HG11 VAL 20 HG11 VAL 20 19.499 -16.554 9.985 142 HG12 VAL 20 HG12 VAL 20 19.616 -15.746 11.550 143 HG13 VAL 20 HG13 VAL 20 18.044 -15.944 10.775 144 HG21 VAL 20 HG21 VAL 20 21.168 -14.598 8.922 145 HG22 VAL 20 HG22 VAL 20 20.852 -13.011 9.624 146 HG23 VAL 20 HG23 VAL 20 21.268 -14.370 10.668 147 H ARG 21 H ARG 21 16.695 -12.862 9.018 148 HA ARG 21 HA ARG 21 14.669 -15.001 9.047 149 HB2 ARG 21 HB2 ARG 21 14.388 -12.388 10.512 150 HB3 ARG 21 HB3 ARG 21 13.492 -13.882 10.756 151 HG2 ARG 21 HG2 ARG 21 14.871 -14.052 12.531 152 HG3 ARG 21 HG3 ARG 21 15.947 -14.764 11.327 153 HD2 ARG 21 HD2 ARG 21 17.107 -12.692 11.042 154 HD3 ARG 21 HD3 ARG 21 15.925 -11.836 12.031 155 HE ARG 21 HE ARG 21 18.146 -13.412 12.954 156 HH11 ARG 21 HH11 ARG 21 15.013 -12.125 13.756 157 HH12 ARG 21 HH12 ARG 21 15.287 -12.171 15.465 158 HH21 ARG 21 HH21 ARG 21 18.519 -13.479 15.203 159 HH22 ARG 21 HH22 ARG 21 17.281 -12.941 16.288 160 H GLY 22 H GLY 22 15.622 -11.934 7.777 161 HA2 GLY 22 HA2 GLY 22 14.794 -11.050 5.753 162 HA3 GLY 22 HA3 GLY 22 13.334 -12.007 5.959 163 H SER 23 H SER 23 14.041 -10.560 8.859 164 HA SER 23 HA SER 23 12.014 -8.504 8.379 165 HB2 SER 23 HB2 SER 23 12.589 -8.486 11.096 166 HB3 SER 23 HB3 SER 23 11.244 -9.328 10.326 167 HG SER 23 HG SER 23 12.186 -11.016 11.174 168 HA PRO 24 HA PRO 24 14.732 -5.079 8.718 169 HB2 PRO 24 HB2 PRO 24 13.329 -3.344 10.266 170 HB3 PRO 24 HB3 PRO 24 12.888 -3.713 8.594 171 HG2 PRO 24 HG2 PRO 24 11.747 -4.801 11.139 172 HG3 PRO 24 HG3 PRO 24 10.905 -4.274 9.670 173 HD2 PRO 24 HD2 PRO 24 11.373 -6.883 10.223 174 HD3 PRO 24 HD3 PRO 24 11.330 -6.251 8.565 175 H ALA 25 H ALA 25 16.265 -4.072 10.026 176 HA ALA 25 HA ALA 25 16.666 -5.341 12.629 177 HB1 ALA 25 HB1 ALA 25 18.594 -3.556 11.159 178 HB2 ALA 25 HB2 ALA 25 18.941 -4.683 12.472 179 HB3 ALA 25 HB3 ALA 25 18.478 -5.295 10.883 180 H ILE 26 H ILE 26 16.613 -4.273 14.529 181 HA ILE 26 HA ILE 26 15.869 -1.431 14.437 182 HB ILE 26 HB ILE 26 15.128 -3.671 16.229 183 HG12 ILE 26 HG12 ILE 26 13.727 -2.375 14.430 184 HG13 ILE 26 HG13 ILE 26 12.979 -2.853 15.950 185 HG21 ILE 26 HG21 ILE 26 15.583 -0.862 17.196 186 HG22 ILE 26 HG22 ILE 26 14.483 -1.978 18.002 187 HG23 ILE 26 HG23 ILE 26 16.198 -2.368 17.877 188 HD11 ILE 26 HD11 ILE 26 13.287 -0.618 16.829 189 HD12 ILE 26 HD12 ILE 26 14.104 -0.129 15.344 190 HD13 ILE 26 HD13 ILE 26 12.396 -0.571 15.307 191 H ASN 27 H ASN 27 16.994 0.092 15.558 192 HA ASN 27 HA ASN 27 18.722 1.081 16.657 193 HB2 ASN 27 HB2 ASN 27 19.048 -1.573 18.070 194 HB3 ASN 27 HB3 ASN 27 19.627 -0.005 18.622 195 HD21 ASN 27 HD21 ASN 27 17.337 1.498 17.948 196 HD22 ASN 27 HD22 ASN 27 16.067 1.041 19.026 197 H VAL 28 H VAL 28 19.462 0.506 14.245 198 HA VAL 28 HA VAL 28 22.037 -0.916 14.445 199 HB VAL 28 HB VAL 28 20.327 -0.425 12.002 200 HG11 VAL 28 HG11 VAL 28 22.348 -2.309 11.475 201 HG12 VAL 28 HG12 VAL 28 22.170 -0.692 10.792 202 HG13 VAL 28 HG13 VAL 28 23.134 -0.935 12.250 203 HG21 VAL 28 HG21 VAL 28 19.269 -2.232 12.827 204 HG22 VAL 28 HG22 VAL 28 20.658 -3.108 12.184 205 HG23 VAL 28 HG23 VAL 28 20.611 -2.662 13.889 206 H ALA 29 H ALA 29 23.635 0.496 14.723 207 HA ALA 29 HA ALA 29 23.573 3.220 14.148 208 HB1 ALA 29 HB1 ALA 29 26.264 2.303 13.978 209 HB2 ALA 29 HB2 ALA 29 25.463 3.145 15.305 210 HB3 ALA 29 HB3 ALA 29 25.428 1.383 15.231 211 H VAL 30 H VAL 30 23.778 4.363 12.335 212 HA VAL 30 HA VAL 30 25.137 3.168 10.026 213 HB VAL 30 HB VAL 30 22.401 4.444 9.927 214 HG11 VAL 30 HG11 VAL 30 22.922 5.070 7.857 215 HG12 VAL 30 HG12 VAL 30 24.469 4.225 7.924 216 HG13 VAL 30 HG13 VAL 30 23.011 3.360 7.437 217 HG21 VAL 30 HG21 VAL 30 21.544 2.349 9.364 218 HG22 VAL 30 HG22 VAL 30 23.135 1.695 8.976 219 HG23 VAL 30 HG23 VAL 30 22.690 1.996 10.656 220 H HIS 31 H HIS 31 26.437 4.549 8.979 221 HA HIS 31 HA HIS 31 26.132 7.427 9.528 222 HB2 HIS 31 HB2 HIS 31 28.800 6.099 9.096 223 HB3 HIS 31 HB3 HIS 31 28.470 7.699 9.756 224 HD1 HIS 31 HD1 HIS 31 28.238 7.880 12.244 225 HD2 HIS 31 HD2 HIS 31 28.150 3.943 10.920 226 HE1 HIS 31 HE1 HIS 31 28.309 6.469 14.324 227 H VAL 32 H VAL 32 25.806 8.592 7.761 228 HA VAL 32 HA VAL 32 26.514 7.439 5.156 229 HB VAL 32 HB VAL 32 24.755 9.842 5.618 230 HG11 VAL 32 HG11 VAL 32 25.001 9.912 3.391 231 HG12 VAL 32 HG12 VAL 32 25.613 8.259 3.308 232 HG13 VAL 32 HG13 VAL 32 23.875 8.556 3.381 233 HG21 VAL 32 HG21 VAL 32 22.854 8.214 5.307 234 HG22 VAL 32 HG22 VAL 32 24.019 6.922 5.593 235 HG23 VAL 32 HG23 VAL 32 23.697 8.113 6.853 236 H PHE 33 H PHE 33 27.795 8.500 3.698 237 HA PHE 33 HA PHE 33 28.889 11.111 4.463 238 HB2 PHE 33 HB2 PHE 33 30.457 8.613 3.851 239 HB3 PHE 33 HB3 PHE 33 31.158 10.215 3.647 240 HD1 PHE 33 HD1 PHE 33 29.414 8.116 6.178 241 HD2 PHE 33 HD2 PHE 33 32.223 11.224 5.426 242 HE1 PHE 33 HE1 PHE 33 30.002 8.158 8.567 243 HE2 PHE 33 HE2 PHE 33 32.816 11.271 7.813 244 HZ PHE 33 HZ PHE 33 31.703 9.737 9.388 245 H ARG 34 H ARG 34 30.133 12.117 2.639 246 HA ARG 34 HA ARG 34 29.089 11.273 0.020 247 HB2 ARG 34 HB2 ARG 34 27.796 13.200 0.908 248 HB3 ARG 34 HB3 ARG 34 29.287 14.129 0.992 249 HG2 ARG 34 HG2 ARG 34 28.733 12.943 -1.630 250 HG3 ARG 34 HG3 ARG 34 27.564 14.153 -1.097 251 HD2 ARG 34 HD2 ARG 34 29.512 15.661 -0.600 252 HD3 ARG 34 HD3 ARG 34 30.543 14.476 -1.400 253 HE ARG 34 HE ARG 34 28.871 16.399 -2.656 254 HH11 ARG 34 HH11 ARG 34 30.101 13.159 -2.979 255 HH12 ARG 34 HH12 ARG 34 29.981 13.146 -4.708 256 HH21 ARG 34 HH21 ARG 34 28.708 16.395 -4.931 257 HH22 ARG 34 HH22 ARG 34 29.190 14.988 -5.817 258 H LYS 35 H LYS 35 30.400 11.727 -1.772 259 HA LYS 35 HA LYS 35 33.194 11.646 -1.265 260 HB2 LYS 35 HB2 LYS 35 32.614 10.507 -3.196 261 HB3 LYS 35 HB3 LYS 35 31.477 11.746 -3.711 262 HG2 LYS 35 HG2 LYS 35 33.403 11.703 -5.171 263 HG3 LYS 35 HG3 LYS 35 33.349 13.223 -4.274 264 HD2 LYS 35 HD2 LYS 35 35.600 12.538 -4.198 265 HD3 LYS 35 HD3 LYS 35 34.936 12.117 -2.618 266 HE2 LYS 35 HE2 LYS 35 36.258 10.277 -3.381 267 HE3 LYS 35 HE3 LYS 35 34.562 9.804 -3.472 268 HZ1 LYS 35 HZ1 LYS 35 34.560 9.959 -5.772 269 HZ2 LYS 35 HZ2 LYS 35 36.071 9.272 -5.446 270 HZ3 LYS 35 HZ3 LYS 35 35.954 10.917 -5.824 271 H ALA 36 H ALA 36 34.305 13.354 -0.579 272 HA ALA 36 HA ALA 36 33.486 16.048 -1.075 273 HB1 ALA 36 HB1 ALA 36 36.245 15.630 -0.169 274 HB2 ALA 36 HB2 ALA 36 34.950 16.599 0.535 275 HB3 ALA 36 HB3 ALA 36 35.013 14.862 0.832 276 H ALA 37 H ALA 37 34.818 17.681 -2.118 277 HA ALA 37 HA ALA 37 35.510 17.010 -4.747 278 HB1 ALA 37 HB1 ALA 37 34.826 19.260 -4.067 279 HB2 ALA 37 HB2 ALA 37 36.336 19.448 -3.174 280 HB3 ALA 37 HB3 ALA 37 36.364 19.283 -4.930 281 H ASP 38 H ASP 38 37.312 16.806 -1.835 282 HA ASP 38 HA ASP 38 39.872 16.701 -3.237 283 HB2 ASP 38 HB2 ASP 38 39.018 17.026 -0.413 284 HB3 ASP 38 HB3 ASP 38 40.537 16.175 -0.682 285 H ASP 39 H ASP 39 37.611 14.636 -3.305 286 HA ASP 39 HA ASP 39 37.437 12.376 -3.497 287 HB2 ASP 39 HB2 ASP 39 39.589 12.680 -4.747 288 HB3 ASP 39 HB3 ASP 39 40.449 12.346 -3.246 289 H THR 40 H THR 40 37.175 13.537 -0.929 290 HA THR 40 HA THR 40 38.195 11.364 0.782 291 HB THR 40 HB THR 40 38.333 12.831 2.633 292 HG1 THR 40 HG1 THR 40 36.893 14.365 2.769 293 HG21 THR 40 HG21 THR 40 40.194 13.087 1.080 294 HG22 THR 40 HG22 THR 40 39.826 14.628 1.856 295 HG23 THR 40 HG23 THR 40 39.306 14.328 0.198 296 H TRP 41 H TRP 41 36.769 11.318 2.907 297 HA TRP 41 HA TRP 41 33.997 11.020 1.983 298 HB2 TRP 41 HB2 TRP 41 35.566 9.686 4.184 299 HB3 TRP 41 HB3 TRP 41 33.810 9.581 4.095 300 HD1 TRP 41 HD1 TRP 41 35.890 9.452 0.895 301 HE1 TRP 41 HE1 TRP 41 35.685 7.099 -0.130 302 HE3 TRP 41 HE3 TRP 41 33.387 7.127 4.698 303 HZ2 TRP 41 HZ2 TRP 41 34.603 4.591 0.580 304 HZ3 TRP 41 HZ3 TRP 41 32.803 4.750 4.445 305 HH2 TRP 41 HH2 TRP 41 33.399 3.510 2.428 306 H GLU 42 H GLU 42 32.839 12.789 2.430 307 HA GLU 42 HA GLU 42 33.325 14.258 4.906 308 HB2 GLU 42 HB2 GLU 42 31.677 14.859 2.451 309 HB3 GLU 42 HB3 GLU 42 31.626 15.859 3.897 310 HG2 GLU 42 HG2 GLU 42 34.279 15.271 2.706 311 HG3 GLU 42 HG3 GLU 42 33.222 16.407 1.870 312 HA PRO 43 HA PRO 43 29.880 12.598 7.065 313 HB2 PRO 43 HB2 PRO 43 29.203 14.720 8.618 314 HB3 PRO 43 HB3 PRO 43 30.649 13.744 8.902 315 HG2 PRO 43 HG2 PRO 43 30.390 16.389 7.525 316 HG3 PRO 43 HG3 PRO 43 31.617 15.848 8.686 317 HD2 PRO 43 HD2 PRO 43 32.064 15.905 6.016 318 HD3 PRO 43 HD3 PRO 43 32.807 14.696 7.083 319 H PHE 44 H PHE 44 28.038 12.206 5.999 320 HA PHE 44 HA PHE 44 26.507 14.455 4.907 321 HB2 PHE 44 HB2 PHE 44 27.063 12.603 3.367 322 HB3 PHE 44 HB3 PHE 44 26.188 11.487 4.410 323 HD1 PHE 44 HD2 PHE 44 23.713 11.817 4.726 324 HD2 PHE 44 HD1 PHE 44 25.951 13.864 1.739 325 HE1 PHE 44 HE2 PHE 44 21.632 12.308 3.507 326 HE2 PHE 44 HE1 PHE 44 23.875 14.358 0.516 327 HZ PHE 44 HZ PHE 44 21.711 13.581 1.401 328 H ALA 45 H ALA 45 26.191 11.626 7.003 329 HA ALA 45 HA ALA 45 24.326 12.865 8.712 330 HB1 ALA 45 HB1 ALA 45 22.275 12.024 8.114 331 HB2 ALA 45 HB2 ALA 45 22.994 12.307 6.529 332 HB3 ALA 45 HB3 ALA 45 22.968 10.680 7.207 333 H SER 46 H SER 46 23.193 11.089 10.128 334 HA SER 46 HA SER 46 24.404 8.538 10.326 335 HB2 SER 46 HB2 SER 46 26.369 9.294 11.222 336 HB3 SER 46 HB3 SER 46 25.642 10.781 11.833 337 HG SER 46 HG SER 46 26.239 9.296 13.502 338 H GLY 47 H GLY 47 23.410 7.237 11.868 339 HA2 GLY 47 HA2 GLY 47 21.911 8.073 14.057 340 HA3 GLY 47 HA3 GLY 47 20.818 8.040 12.682 341 H LYS 48 H LYS 48 19.594 6.373 13.623 342 HA LYS 48 HA LYS 48 20.836 3.728 13.344 343 HB2 LYS 48 HB2 LYS 48 19.553 4.890 15.747 344 HB3 LYS 48 HB3 LYS 48 19.101 3.235 15.356 345 HG2 LYS 48 HG2 LYS 48 21.466 2.595 15.372 346 HG3 LYS 48 HG3 LYS 48 21.903 4.252 15.792 347 HD2 LYS 48 HD2 LYS 48 20.127 2.459 17.447 348 HD3 LYS 48 HD3 LYS 48 21.843 2.741 17.751 349 HE2 LYS 48 HE2 LYS 48 20.877 5.287 17.579 350 HE3 LYS 48 HE3 LYS 48 19.518 4.437 18.315 351 HZ1 LYS 48 HZ1 LYS 48 21.494 3.479 19.779 352 HZ2 LYS 48 HZ2 LYS 48 20.676 4.904 20.179 353 HZ3 LYS 48 HZ3 LYS 48 22.170 4.980 19.389 354 H THR 49 H THR 49 19.618 2.263 12.292 355 HA THR 49 HA THR 49 17.373 3.053 10.822 356 HB THR 49 HB THR 49 17.143 0.764 10.134 357 HG1 THR 49 HG1 THR 49 18.169 -0.913 11.254 358 HG21 THR 49 HG21 THR 49 19.659 2.127 10.148 359 HG22 THR 49 HG22 THR 49 18.987 1.055 8.919 360 HG23 THR 49 HG23 THR 49 19.940 0.389 10.245 361 H SER 50 H SER 50 15.262 1.716 10.888 362 HA SER 50 HA SER 50 14.343 1.471 13.675 363 HB2 SER 50 HB2 SER 50 12.367 2.659 13.233 364 HB3 SER 50 HB3 SER 50 13.601 3.591 12.385 365 HG SER 50 HG SER 50 12.490 3.255 10.648 366 H GLU 51 H GLU 51 12.068 0.367 13.664 367 HA GLU 51 HA GLU 51 12.438 -2.240 12.602 368 HB2 GLU 51 HB2 GLU 51 10.075 -2.595 13.454 369 HB3 GLU 51 HB3 GLU 51 11.263 -2.092 14.649 370 HG2 GLU 51 HG2 GLU 51 10.026 -0.347 15.192 371 HG3 GLU 51 HG3 GLU 51 10.058 0.230 13.526 372 H SER 52 H SER 52 11.374 0.568 11.166 373 HA SER 52 HA SER 52 9.601 -0.824 9.287 374 HB2 SER 52 HB2 SER 52 8.629 1.188 10.196 375 HB3 SER 52 HB3 SER 52 10.069 2.123 9.789 376 HG SER 52 HG SER 52 8.133 1.019 8.053 377 H GLY 53 H GLY 53 12.766 -0.369 9.566 378 HA2 GLY 53 HA2 GLY 53 14.502 -0.492 8.064 379 HA3 GLY 53 HA3 GLY 53 13.303 -0.789 6.814 380 H GLU 54 H GLU 54 12.995 2.080 8.705 381 HA GLU 54 HA GLU 54 14.221 3.666 6.553 382 HB2 GLU 54 HB2 GLU 54 12.352 5.309 6.822 383 HB3 GLU 54 HB3 GLU 54 11.865 3.766 6.134 384 HG2 GLU 54 HG2 GLU 54 10.931 3.062 8.229 385 HG3 GLU 54 HG3 GLU 54 11.547 4.505 9.032 386 H LEU 55 H LEU 55 15.451 5.342 7.203 387 HA LEU 55 HA LEU 55 15.615 5.830 10.098 388 HB2 LEU 55 HB2 LEU 55 17.585 5.190 8.275 389 HB3 LEU 55 HB3 LEU 55 17.759 6.933 8.467 390 HG LEU 55 HG LEU 55 17.741 5.016 10.789 391 HD11 LEU 55 HD11 LEU 55 19.653 4.968 8.878 392 HD12 LEU 55 HD12 LEU 55 19.939 4.605 10.580 393 HD13 LEU 55 HD13 LEU 55 20.288 6.216 9.952 394 HD21 LEU 55 HD21 LEU 55 19.237 7.313 11.322 395 HD22 LEU 55 HD22 LEU 55 17.647 6.899 11.963 396 HD23 LEU 55 HD23 LEU 55 17.781 7.879 10.503 397 H HIS 56 H HIS 56 14.511 7.574 10.694 398 HA HIS 56 HA HIS 56 14.256 9.834 8.859 399 HB2 HIS 56 HB2 HIS 56 12.205 9.009 9.909 400 HB3 HIS 56 HB3 HIS 56 12.898 9.280 11.505 401 HD1 HIS 56 HD1 HIS 56 13.158 11.775 12.269 402 HD2 HIS 56 HD2 HIS 56 11.126 11.245 8.685 403 HE1 HIS 56 HE1 HIS 56 12.018 13.969 11.812 404 H GLY 57 H GLY 57 15.704 11.412 8.973 405 HA2 GLY 57 HA2 GLY 57 16.313 13.214 10.729 406 HA3 GLY 57 HA3 GLY 57 17.109 11.861 11.518 407 H LEU 58 H LEU 58 17.750 10.784 8.744 408 HA LEU 58 HA LEU 58 20.319 12.055 8.541 409 HB2 LEU 58 HB2 LEU 58 19.094 9.987 6.724 410 HB3 LEU 58 HB3 LEU 58 20.802 10.405 6.852 411 HG LEU 58 HG LEU 58 19.112 8.953 8.881 412 HD11 LEU 58 HD11 LEU 58 21.578 7.697 8.178 413 HD12 LEU 58 HD12 LEU 58 20.685 8.088 6.710 414 HD13 LEU 58 HD13 LEU 58 19.929 7.108 7.966 415 HD21 LEU 58 HD21 LEU 58 20.421 9.963 10.399 416 HD22 LEU 58 HD22 LEU 58 21.597 10.484 9.190 417 HD23 LEU 58 HD23 LEU 58 21.655 8.839 9.827 418 H THR 59 H THR 59 17.264 12.309 6.944 419 HA THR 59 HA THR 59 17.937 13.285 4.450 420 HB THR 59 HB THR 59 15.796 14.575 4.537 421 HG1 THR 59 HG1 THR 59 14.525 14.195 6.486 422 HG21 THR 59 HG21 THR 59 16.123 11.700 4.992 423 HG22 THR 59 HG22 THR 59 15.170 12.554 3.778 424 HG23 THR 59 HG23 THR 59 14.520 12.313 5.399 425 H THR 60 H THR 60 18.925 15.053 3.724 426 HA THR 60 HA THR 60 18.839 17.537 5.222 427 HB THR 60 HB THR 60 21.344 17.799 5.094 428 HG1 THR 60 HG1 THR 60 22.352 15.549 5.150 429 HG21 THR 60 HG21 THR 60 20.342 15.559 6.856 430 HG22 THR 60 HG22 THR 60 20.170 17.280 7.199 431 HG23 THR 60 HG23 THR 60 21.773 16.549 7.137 432 H GLU 61 H GLU 61 19.901 19.329 4.008 433 HA GLU 61 HA GLU 61 19.039 19.332 1.316 434 HB2 GLU 61 HB2 GLU 61 20.183 21.551 1.205 435 HB3 GLU 61 HB3 GLU 61 19.054 21.393 2.543 436 HG2 GLU 61 HG2 GLU 61 20.848 21.077 4.099 437 HG3 GLU 61 HG3 GLU 61 22.028 21.022 2.792 438 H GLU 62 H GLU 62 21.873 18.180 2.763 439 HA GLU 62 HA GLU 62 23.731 18.687 0.677 440 HB2 GLU 62 HB2 GLU 62 23.641 16.878 3.051 441 HB3 GLU 62 HB3 GLU 62 24.851 16.580 1.812 442 HG2 GLU 62 HG2 GLU 62 25.514 18.028 3.798 443 HG3 GLU 62 HG3 GLU 62 25.914 18.616 2.185 444 H GLU 63 H GLU 63 21.056 16.665 0.845 445 HA GLU 63 HA GLU 63 21.953 14.419 -0.615 446 HB2 GLU 63 HB2 GLU 63 19.599 13.931 -0.979 447 HB3 GLU 63 HB3 GLU 63 19.862 14.438 0.685 448 HG2 GLU 63 HG2 GLU 63 19.199 16.783 -0.181 449 HG3 GLU 63 HG3 GLU 63 18.514 15.900 -1.542 450 H PHE 64 H PHE 64 21.443 17.632 -1.538 451 HA PHE 64 HA PHE 64 20.796 17.049 -4.302 452 HB2 PHE 64 HB2 PHE 64 21.183 19.550 -2.696 453 HB3 PHE 64 HB3 PHE 64 21.238 19.628 -4.455 454 HD1 PHE 64 HD1 PHE 64 19.217 18.294 -5.612 455 HD2 PHE 64 HD2 PHE 64 19.168 19.980 -1.704 456 HE1 PHE 64 HE1 PHE 64 16.759 18.388 -5.686 457 HE2 PHE 64 HE2 PHE 64 16.711 20.075 -1.772 458 HZ PHE 64 HZ PHE 64 15.503 19.277 -3.764 459 H VAL 65 H VAL 65 23.026 15.705 -3.868 460 HA VAL 65 HA VAL 65 25.201 17.372 -4.950 461 HB VAL 65 HB VAL 65 26.743 15.596 -4.127 462 HG11 VAL 65 HG11 VAL 65 25.041 17.239 -2.316 463 HG12 VAL 65 HG12 VAL 65 26.217 16.129 -1.609 464 HG13 VAL 65 HG13 VAL 65 26.753 17.400 -2.709 465 HG21 VAL 65 HG21 VAL 65 26.051 13.808 -2.830 466 HG22 VAL 65 HG22 VAL 65 24.509 14.564 -2.424 467 HG23 VAL 65 HG23 VAL 65 24.771 13.905 -4.039 468 H GLU 66 H GLU 66 26.876 15.684 -6.058 469 HA GLU 66 HA GLU 66 25.862 15.078 -8.541 470 HB2 GLU 66 HB2 GLU 66 28.194 13.864 -7.059 471 HB3 GLU 66 HB3 GLU 66 27.845 13.510 -8.745 472 HG2 GLU 66 HG2 GLU 66 27.837 16.197 -8.823 473 HG3 GLU 66 HG3 GLU 66 28.983 15.926 -7.512 474 H GLY 67 H GLY 67 26.249 12.879 -5.774 475 HA2 GLY 67 HA2 GLY 67 24.072 11.415 -5.756 476 HA3 GLY 67 HA3 GLY 67 24.793 10.799 -7.236 477 H ILE 68 H ILE 68 27.453 11.432 -5.667 478 HA ILE 68 HA ILE 68 27.944 8.743 -4.915 479 HB ILE 68 HB ILE 68 29.584 11.162 -4.162 480 HG12 ILE 68 HG12 ILE 68 29.871 9.412 -6.612 481 HG13 ILE 68 HG13 ILE 68 29.094 10.991 -6.619 482 HG21 ILE 68 HG21 ILE 68 31.428 9.380 -4.347 483 HG22 ILE 68 HG22 ILE 68 30.392 9.365 -2.922 484 HG23 ILE 68 HG23 ILE 68 30.112 8.214 -4.228 485 HD11 ILE 68 HD11 ILE 68 31.345 11.199 -7.416 486 HD12 ILE 68 HD12 ILE 68 31.215 11.988 -5.843 487 HD13 ILE 68 HD13 ILE 68 31.971 10.400 -5.974 488 H TYR 69 H TYR 69 27.517 7.731 -3.074 489 HA TYR 69 HA TYR 69 27.422 9.239 -0.573 490 HB2 TYR 69 HB2 TYR 69 25.184 7.428 -1.504 491 HB3 TYR 69 HB3 TYR 69 25.296 8.178 0.085 492 HD1 TYR 69 HD2 TYR 69 25.777 10.868 -0.151 493 HD2 TYR 69 HD1 TYR 69 23.695 8.425 -2.942 494 HE1 TYR 69 HE2 TYR 69 24.598 12.852 -1.000 495 HE2 TYR 69 HE1 TYR 69 22.510 10.402 -3.800 496 HH TYR 69 HH TYR 69 22.152 12.582 -3.559 497 H LYS 70 H LYS 70 28.298 8.163 1.093 498 HA LYS 70 HA LYS 70 28.825 5.284 0.744 499 HB2 LYS 70 HB2 LYS 70 30.585 7.389 2.011 500 HB3 LYS 70 HB3 LYS 70 30.899 5.661 2.093 501 HG2 LYS 70 HG2 LYS 70 32.221 6.211 0.329 502 HG3 LYS 70 HG3 LYS 70 30.721 5.852 -0.531 503 HD2 LYS 70 HD2 LYS 70 31.110 7.872 -1.470 504 HD3 LYS 70 HD3 LYS 70 30.337 8.461 0.004 505 HE2 LYS 70 HE2 LYS 70 32.201 9.709 0.184 506 HE3 LYS 70 HE3 LYS 70 32.894 8.228 0.845 507 HZ1 LYS 70 HZ1 LYS 70 34.121 9.447 -1.039 508 HZ2 LYS 70 HZ2 LYS 70 32.971 8.738 -2.057 509 HZ3 LYS 70 HZ3 LYS 70 33.986 7.763 -1.118 510 H VAL 71 H VAL 71 27.356 4.327 2.026 511 HA VAL 71 HA VAL 71 26.919 5.399 4.724 512 HB VAL 71 HB VAL 71 25.319 3.358 3.174 513 HG11 VAL 71 HG11 VAL 71 23.677 4.062 5.145 514 HG12 VAL 71 HG12 VAL 71 24.817 2.724 5.302 515 HG13 VAL 71 HG13 VAL 71 25.211 4.303 5.983 516 HG21 VAL 71 HG21 VAL 71 25.143 6.292 3.496 517 HG22 VAL 71 HG22 VAL 71 24.649 5.266 2.150 518 HG23 VAL 71 HG23 VAL 71 23.626 5.396 3.581 519 H GLU 72 H GLU 72 27.478 4.293 6.517 520 HA GLU 72 HA GLU 72 28.579 1.583 6.159 521 HB2 GLU 72 HB2 GLU 72 30.408 2.047 7.498 522 HB3 GLU 72 HB3 GLU 72 30.210 3.563 6.629 523 HG2 GLU 72 HG2 GLU 72 28.725 4.182 8.705 524 HG3 GLU 72 HG3 GLU 72 29.688 2.929 9.485 525 H ILE 73 H ILE 73 27.989 0.051 7.612 526 HA ILE 73 HA ILE 73 26.123 0.892 9.733 527 HB ILE 73 HB ILE 73 26.187 -1.722 8.223 528 HG12 ILE 73 HG12 ILE 73 23.739 -0.120 8.182 529 HG13 ILE 73 HG13 ILE 73 25.111 0.701 7.445 530 HG21 ILE 73 HG21 ILE 73 23.834 -1.710 9.555 531 HG22 ILE 73 HG22 ILE 73 25.299 -2.498 10.138 532 HG23 ILE 73 HG23 ILE 73 24.875 -0.887 10.717 533 HD11 ILE 73 HD11 ILE 73 25.200 -0.730 5.701 534 HD12 ILE 73 HD12 ILE 73 24.658 -2.109 6.658 535 HD13 ILE 73 HD13 ILE 73 23.490 -0.914 6.094 536 H ASP 74 H ASP 74 26.515 0.283 11.783 537 HA ASP 74 HA ASP 74 28.926 -1.326 12.265 538 HB2 ASP 74 HB2 ASP 74 27.939 1.096 13.406 539 HB3 ASP 74 HB3 ASP 74 27.964 -0.133 14.668 540 H THR 75 H THR 75 28.126 -3.397 12.178 541 HA THR 75 HA THR 75 25.757 -4.149 13.643 542 HB THR 75 HB THR 75 26.324 -6.462 12.923 543 HG1 THR 75 HG1 THR 75 28.255 -6.872 12.166 544 HG21 THR 75 HG21 THR 75 26.397 -4.405 10.711 545 HG22 THR 75 HG22 THR 75 24.942 -5.014 11.503 546 HG23 THR 75 HG23 THR 75 25.940 -6.099 10.536 547 H LYS 76 H LYS 76 29.044 -3.775 14.366 548 HA LYS 76 HA LYS 76 29.649 -5.794 16.135 549 HB2 LYS 76 HB2 LYS 76 31.163 -4.208 17.233 550 HB3 LYS 76 HB3 LYS 76 31.250 -4.067 15.482 551 HG2 LYS 76 HG2 LYS 76 31.131 -1.868 15.954 552 HG3 LYS 76 HG3 LYS 76 29.397 -2.200 15.975 553 HD2 LYS 76 HD2 LYS 76 29.705 -1.045 17.959 554 HD3 LYS 76 HD3 LYS 76 29.790 -2.727 18.489 555 HE2 LYS 76 HE2 LYS 76 32.032 -2.621 18.909 556 HE3 LYS 76 HE3 LYS 76 32.319 -1.404 17.668 557 HZ1 LYS 76 HZ1 LYS 76 31.162 -0.983 20.366 558 HZ2 LYS 76 HZ2 LYS 76 31.157 0.201 19.158 559 HZ3 LYS 76 HZ3 LYS 76 32.624 -0.379 19.768 560 H SER 77 H SER 77 27.729 -2.885 16.710 561 HA SER 77 HA SER 77 27.261 -3.657 19.478 562 HB2 SER 77 HB2 SER 77 27.650 -1.299 19.060 563 HB3 SER 77 HB3 SER 77 26.342 -1.257 17.879 564 HG SER 77 HG SER 77 25.373 -0.553 19.670 565 H TYR 78 H TYR 78 25.859 -4.134 16.437 566 HA TYR 78 HA TYR 78 23.120 -4.287 17.281 567 HB2 TYR 78 HB2 TYR 78 23.658 -3.757 14.963 568 HB3 TYR 78 HB3 TYR 78 24.486 -5.300 14.777 569 HD1 TYR 78 HD1 TYR 78 21.135 -4.101 15.943 570 HD2 TYR 78 HD2 TYR 78 23.326 -6.907 13.613 571 HE1 TYR 78 HE1 TYR 78 19.026 -5.140 15.220 572 HE2 TYR 78 HE2 TYR 78 21.223 -7.953 12.882 573 HH TYR 78 HH TYR 78 18.808 -8.112 13.872 574 H TRP 79 H TRP 79 25.746 -6.582 16.751 575 HA TRP 79 HA TRP 79 24.096 -8.881 17.271 576 HB2 TRP 79 HB2 TRP 79 26.022 -10.175 16.885 577 HB3 TRP 79 HB3 TRP 79 26.215 -8.787 15.818 578 HD1 TRP 79 HD1 TRP 79 28.312 -7.278 16.171 579 HE1 TRP 79 HE1 TRP 79 30.340 -7.373 17.755 580 HE3 TRP 79 HE3 TRP 79 26.668 -10.904 19.377 581 HZ2 TRP 79 HZ2 TRP 79 31.135 -8.798 20.058 582 HZ3 TRP 79 HZ3 TRP 79 28.123 -11.576 21.245 583 HH2 TRP 79 HH2 TRP 79 30.310 -10.544 21.576 584 H LYS 80 H LYS 80 25.910 -6.647 19.150 585 HA LYS 80 HA LYS 80 26.166 -8.408 21.437 586 HB2 LYS 80 HB2 LYS 80 27.488 -6.778 22.392 587 HB3 LYS 80 HB3 LYS 80 27.750 -6.456 20.683 588 HG2 LYS 80 HG2 LYS 80 27.312 -4.342 21.304 589 HG3 LYS 80 HG3 LYS 80 25.634 -4.863 21.128 590 HD2 LYS 80 HD2 LYS 80 25.573 -3.916 23.221 591 HD3 LYS 80 HD3 LYS 80 25.930 -5.594 23.632 592 HE2 LYS 80 HE2 LYS 80 27.545 -4.585 24.872 593 HE3 LYS 80 HE3 LYS 80 28.425 -4.719 23.350 594 HZ1 LYS 80 HZ1 LYS 80 28.349 -2.507 23.008 595 HZ2 LYS 80 HZ2 LYS 80 28.187 -2.449 24.690 596 HZ3 LYS 80 HZ3 LYS 80 26.819 -2.321 23.704 597 H ALA 81 H ALA 81 23.856 -6.246 20.161 598 HA ALA 81 HA ALA 81 22.588 -5.707 22.720 599 HB1 ALA 81 HB1 ALA 81 22.113 -3.854 21.568 600 HB2 ALA 81 HB2 ALA 81 22.409 -4.634 20.013 601 HB3 ALA 81 HB3 ALA 81 20.844 -4.813 20.805 602 H LEU 82 H LEU 82 21.877 -7.487 19.731 603 HA LEU 82 HA LEU 82 19.536 -8.693 21.000 604 HB2 LEU 82 HB2 LEU 82 20.552 -8.888 18.169 605 HB3 LEU 82 HB3 LEU 82 19.054 -9.597 18.769 606 HG LEU 82 HG LEU 82 18.295 -7.701 17.705 607 HD11 LEU 82 HD11 LEU 82 17.554 -7.765 20.064 608 HD12 LEU 82 HD12 LEU 82 17.592 -6.135 19.391 609 HD13 LEU 82 HD13 LEU 82 18.874 -6.669 20.477 610 HD21 LEU 82 HD21 LEU 82 20.586 -6.837 17.237 611 HD22 LEU 82 HD22 LEU 82 20.581 -6.094 18.837 612 HD23 LEU 82 HD23 LEU 82 19.407 -5.583 17.623 613 H GLY 83 H GLY 83 22.801 -9.322 20.576 614 HA2 GLY 83 HA2 GLY 83 24.034 -11.163 21.230 615 HA3 GLY 83 HA3 GLY 83 22.529 -11.980 21.625 616 H ILE 84 H ILE 84 23.699 -10.640 18.548 617 HA ILE 84 HA ILE 84 23.001 -13.137 17.231 618 HB ILE 84 HB ILE 84 24.150 -10.678 15.924 619 HG12 ILE 84 HG12 ILE 84 22.170 -10.018 17.205 620 HG13 ILE 84 HG13 ILE 84 21.832 -9.981 15.478 621 HG21 ILE 84 HG21 ILE 84 24.203 -12.298 14.314 622 HG22 ILE 84 HG22 ILE 84 22.840 -13.181 15.001 623 HG23 ILE 84 HG23 ILE 84 22.559 -11.702 14.083 624 HD11 ILE 84 HD11 ILE 84 20.507 -11.429 17.556 625 HD12 ILE 84 HD12 ILE 84 20.057 -11.236 15.862 626 HD13 ILE 84 HD13 ILE 84 21.132 -12.548 16.345 627 H SER 85 H SER 85 24.477 -14.192 15.750 628 HA SER 85 HA SER 85 26.863 -14.972 16.856 629 HB2 SER 85 HB2 SER 85 26.355 -16.413 15.171 630 HB3 SER 85 HB3 SER 85 25.653 -15.147 14.164 631 HG SER 85 HG SER 85 28.099 -16.234 14.036 632 HA PRO 86 HA PRO 86 29.832 -11.805 16.212 633 HB2 PRO 86 HB2 PRO 86 32.084 -13.264 15.808 634 HB3 PRO 86 HB3 PRO 86 31.308 -13.114 17.389 635 HG2 PRO 86 HG2 PRO 86 31.128 -15.338 15.393 636 HG3 PRO 86 HG3 PRO 86 31.309 -15.427 17.155 637 HD2 PRO 86 HD2 PRO 86 28.930 -15.792 15.914 638 HD3 PRO 86 HD3 PRO 86 29.063 -15.068 17.529 639 H MET 87 H MET 87 29.102 -14.067 13.750 640 HA MET 87 HA MET 87 30.868 -13.497 11.720 641 HB2 MET 87 HB2 MET 87 27.901 -14.039 11.586 642 HB3 MET 87 HB3 MET 87 28.935 -13.972 10.165 643 HG2 MET 87 HG2 MET 87 29.297 -15.872 12.471 644 HG3 MET 87 HG3 MET 87 28.499 -16.263 10.949 645 HE1 MET 87 HE1 MET 87 29.980 -16.825 8.604 646 HE2 MET 87 HE2 MET 87 29.853 -15.074 8.782 647 HE3 MET 87 HE3 MET 87 31.408 -15.812 8.389 648 H HIS 88 H HIS 88 31.266 -11.822 10.399 649 HA HIS 88 HA HIS 88 30.177 -9.266 10.991 650 HB2 HIS 88 HB2 HIS 88 31.508 -8.535 8.986 651 HB3 HIS 88 HB3 HIS 88 32.440 -9.384 10.214 652 HD1 HIS 88 HD1 HIS 88 31.201 -9.696 6.710 653 HD2 HIS 88 HD2 HIS 88 33.434 -11.893 9.438 654 HE1 HIS 88 HE1 HIS 88 32.266 -11.543 5.375 655 H GLU 89 H GLU 89 28.284 -8.493 10.358 656 HA GLU 89 HA GLU 89 27.159 -9.445 7.806 657 HB2 GLU 89 HB2 GLU 89 25.522 -8.403 10.110 658 HB3 GLU 89 HB3 GLU 89 24.974 -9.314 8.709 659 HG2 GLU 89 HG2 GLU 89 26.225 -11.273 9.537 660 HG3 GLU 89 HG3 GLU 89 26.658 -10.351 10.976 661 H HIS 90 H HIS 90 28.240 -6.772 9.602 662 HA HIS 90 HA HIS 90 26.692 -4.660 8.729 663 HB2 HIS 90 HB2 HIS 90 28.873 -3.322 8.884 664 HB3 HIS 90 HB3 HIS 90 28.344 -4.170 10.335 665 HD1 HIS 90 HD1 HIS 90 29.847 -6.012 11.236 666 HD2 HIS 90 HD2 HIS 90 31.156 -4.447 7.616 667 HE1 HIS 90 HE1 HIS 90 32.161 -6.938 10.900 668 H ALA 91 H ALA 91 26.112 -4.117 6.740 669 HA ALA 91 HA ALA 91 27.924 -4.702 4.507 670 HB1 ALA 91 HB1 ALA 91 25.008 -4.602 4.822 671 HB2 ALA 91 HB2 ALA 91 25.620 -3.899 3.324 672 HB3 ALA 91 HB3 ALA 91 26.002 -5.571 3.735 673 H GLU 92 H GLU 92 27.842 -3.077 2.678 674 HA GLU 92 HA GLU 92 27.487 -0.321 3.572 675 HB2 GLU 92 HB2 GLU 92 29.769 0.210 2.525 676 HB3 GLU 92 HB3 GLU 92 29.757 -0.535 4.117 677 HG2 GLU 92 HG2 GLU 92 31.453 -1.572 2.798 678 HG3 GLU 92 HG3 GLU 92 30.147 -2.729 3.045 679 H VAL 93 H VAL 93 27.322 1.201 1.865 680 HA VAL 93 HA VAL 93 27.019 0.032 -0.820 681 HB VAL 93 HB VAL 93 25.152 2.044 0.443 682 HG11 VAL 93 HG11 VAL 93 25.518 1.056 -2.330 683 HG12 VAL 93 HG12 VAL 93 23.866 1.294 -1.759 684 HG13 VAL 93 HG13 VAL 93 25.005 2.640 -1.749 685 HG21 VAL 93 HG21 VAL 93 24.903 -0.895 -0.117 686 HG22 VAL 93 HG22 VAL 93 24.607 -0.030 1.392 687 HG23 VAL 93 HG23 VAL 93 23.486 0.144 0.041 688 H VAL 94 H VAL 94 28.536 0.933 -2.046 689 HA VAL 94 HA VAL 94 28.905 3.851 -1.888 690 HB VAL 94 HB VAL 94 31.102 1.821 -2.321 691 HG11 VAL 94 HG11 VAL 94 31.820 3.624 -3.553 692 HG12 VAL 94 HG12 VAL 94 30.986 4.794 -2.528 693 HG13 VAL 94 HG13 VAL 94 32.470 4.024 -1.963 694 HG21 VAL 94 HG21 VAL 94 30.614 1.763 -0.030 695 HG22 VAL 94 HG22 VAL 94 31.962 2.892 -0.163 696 HG23 VAL 94 HG23 VAL 94 30.320 3.502 0.043 697 H PHE 95 H PHE 95 28.052 4.616 -3.713 698 HA PHE 95 HA PHE 95 28.921 3.418 -6.250 699 HB2 PHE 95 HB2 PHE 95 26.120 3.996 -5.354 700 HB3 PHE 95 HB3 PHE 95 26.529 4.122 -7.062 701 HD1 PHE 95 HD1 PHE 95 26.606 1.799 -4.172 702 HD2 PHE 95 HD2 PHE 95 26.605 2.224 -8.407 703 HE1 PHE 95 HE1 PHE 95 26.324 -0.634 -4.413 704 HE2 PHE 95 HE2 PHE 95 26.322 -0.208 -8.655 705 HZ PHE 95 HZ PHE 95 26.180 -1.640 -6.657 706 H THR 96 H THR 96 28.936 4.867 -8.048 707 HA THR 96 HA THR 96 29.062 7.700 -7.241 708 HB THR 96 HB THR 96 31.265 6.902 -7.830 709 HG1 THR 96 HG1 THR 96 31.485 8.256 -9.874 710 HG21 THR 96 HG21 THR 96 31.795 5.935 -9.974 711 HG22 THR 96 HG22 THR 96 30.130 6.135 -10.520 712 HG23 THR 96 HG23 THR 96 30.505 4.991 -9.232 713 H ALA 97 H ALA 97 28.150 9.252 -8.555 714 HA ALA 97 HA ALA 97 26.047 8.332 -10.303 715 HB1 ALA 97 HB1 ALA 97 25.069 10.280 -9.833 716 HB2 ALA 97 HB2 ALA 97 26.364 10.521 -8.659 717 HB3 ALA 97 HB3 ALA 97 26.504 11.203 -10.279 718 H ASN 98 H ASN 98 25.742 9.120 -12.481 719 HA ASN 98 HA ASN 98 26.398 9.458 -14.633 720 HB2 ASN 98 HB2 ASN 98 28.889 10.801 -13.604 721 HB3 ASN 98 HB3 ASN 98 27.996 11.132 -15.086 722 HD21 ASN 98 HD21 ASN 98 28.715 12.396 -12.225 723 HD22 ASN 98 HD22 ASN 98 27.297 13.335 -11.920 724 H ASP 99 H ASP 99 26.878 6.986 -13.848 725 HA ASP 99 HA ASP 99 29.397 6.336 -15.183 726 HB2 ASP 99 HB2 ASP 99 29.707 6.303 -12.663 727 HB3 ASP 99 HB3 ASP 99 28.583 4.947 -12.630 728 H SER 100 H SER 100 29.479 4.151 -16.004 729 HA SER 100 HA SER 100 27.077 3.348 -17.226 730 HB2 SER 100 HB2 SER 100 29.768 2.023 -16.930 731 HB3 SER 100 HB3 SER 100 28.436 1.236 -17.777 732 HG SER 100 HG SER 100 28.955 2.406 -19.429 733 H GLY 101 H GLY 101 25.396 2.670 -16.035 734 HA2 GLY 101 HA2 GLY 101 25.009 0.208 -15.059 735 HA3 GLY 101 HA3 GLY 101 25.812 0.985 -13.704 736 HA PRO 102 HA PRO 102 21.142 1.727 -13.668 737 HB2 PRO 102 HB2 PRO 102 20.589 0.285 -11.436 738 HB3 PRO 102 HB3 PRO 102 20.560 -0.410 -13.060 739 HG2 PRO 102 HG2 PRO 102 22.709 -0.545 -10.981 740 HG3 PRO 102 HG3 PRO 102 22.095 -1.827 -12.040 741 HD2 PRO 102 HD2 PRO 102 24.397 -0.496 -12.547 742 HD3 PRO 102 HD3 PRO 102 23.347 -1.114 -13.838 743 H ARG 103 H ARG 103 19.900 2.592 -11.704 744 HA ARG 103 HA ARG 103 21.741 4.184 -10.042 745 HB2 ARG 103 HB2 ARG 103 19.227 4.882 -11.475 746 HB3 ARG 103 HB3 ARG 103 19.527 5.664 -9.929 747 HG2 ARG 103 HG2 ARG 103 20.446 7.160 -11.412 748 HG3 ARG 103 HG3 ARG 103 21.853 6.202 -10.943 749 HD2 ARG 103 HD2 ARG 103 21.987 6.376 -13.280 750 HD3 ARG 103 HD3 ARG 103 21.347 4.761 -12.979 751 HE ARG 103 HE ARG 103 19.388 5.381 -13.994 752 HH11 ARG 103 HH11 ARG 103 21.278 8.221 -13.301 753 HH12 ARG 103 HH12 ARG 103 20.247 9.286 -14.200 754 HH21 ARG 103 HH21 ARG 103 18.024 6.772 -15.181 755 HH22 ARG 103 HH22 ARG 103 18.396 8.460 -15.268 756 H ARG 104 H ARG 104 20.718 4.948 -7.961 757 HA ARG 104 HA ARG 104 18.584 3.400 -6.847 758 HB2 ARG 104 HB2 ARG 104 20.652 1.869 -6.830 759 HB3 ARG 104 HB3 ARG 104 21.275 2.941 -5.582 760 HG2 ARG 104 HG2 ARG 104 20.263 1.086 -4.502 761 HG3 ARG 104 HG3 ARG 104 19.205 2.478 -4.263 762 HD2 ARG 104 HD2 ARG 104 17.588 1.663 -5.681 763 HD3 ARG 104 HD3 ARG 104 18.734 0.686 -6.597 764 HE ARG 104 HE ARG 104 17.235 -0.130 -4.320 765 HH11 ARG 104 HH11 ARG 104 20.284 -0.554 -5.945 766 HH12 ARG 104 HH12 ARG 104 20.545 -2.147 -5.318 767 HH21 ARG 104 HH21 ARG 104 17.568 -2.227 -3.487 768 HH22 ARG 104 HH22 ARG 104 18.999 -3.099 -3.920 769 H TYR 105 H TYR 105 17.787 4.292 -4.973 770 HA TYR 105 HA TYR 105 19.167 6.720 -4.031 771 HB2 TYR 105 HB2 TYR 105 16.199 6.195 -3.864 772 HB3 TYR 105 HB3 TYR 105 17.039 7.716 -3.589 773 HD1 TYR 105 HD2 TYR 105 18.274 8.748 -5.604 774 HD2 TYR 105 HD1 TYR 105 15.330 5.699 -5.971 775 HE1 TYR 105 HE2 TYR 105 17.939 9.363 -7.962 776 HE2 TYR 105 HE1 TYR 105 14.987 6.305 -8.330 777 HH TYR 105 HH TYR 105 15.911 9.108 -9.661 778 H THR 106 H THR 106 17.189 3.956 -3.053 779 HA THR 106 HA THR 106 17.627 4.515 -0.238 780 HB THR 106 HB THR 106 16.196 2.211 -1.575 781 HG1 THR 106 HG1 THR 106 14.529 3.510 -1.572 782 HG21 THR 106 HG21 THR 106 15.198 2.001 0.780 783 HG22 THR 106 HG22 THR 106 16.579 2.962 1.310 784 HG23 THR 106 HG23 THR 106 16.836 1.400 0.533 785 H ILE 107 H ILE 107 18.986 3.437 1.102 786 HA ILE 107 HA ILE 107 21.029 1.794 -0.139 787 HB ILE 107 HB ILE 107 20.762 2.819 2.688 788 HG12 ILE 107 HG12 ILE 107 22.896 4.085 1.804 789 HG13 ILE 107 HG13 ILE 107 22.182 3.764 0.228 790 HG21 ILE 107 HG21 ILE 107 22.301 1.331 3.272 791 HG22 ILE 107 HG22 ILE 107 22.412 0.738 1.615 792 HG23 ILE 107 HG23 ILE 107 23.417 2.090 2.138 793 HD11 ILE 107 HD11 ILE 107 21.668 5.992 1.368 794 HD12 ILE 107 HD12 ILE 107 20.323 5.088 0.673 795 HD13 ILE 107 HD13 ILE 107 20.600 5.057 2.414 796 H ALA 108 H ALA 108 20.520 -0.283 -0.436 797 HA ALA 108 HA ALA 108 18.895 -1.695 1.530 798 HB1 ALA 108 HB1 ALA 108 18.140 -2.271 -0.561 799 HB2 ALA 108 HB2 ALA 108 19.754 -2.245 -1.271 800 HB3 ALA 108 HB3 ALA 108 19.266 -3.589 -0.239 801 H ALA 109 H ALA 109 19.915 -2.533 3.225 802 HA ALA 109 HA ALA 109 22.492 -3.888 2.772 803 HB1 ALA 109 HB1 ALA 109 21.698 -2.323 5.224 804 HB2 ALA 109 HB2 ALA 109 23.214 -3.195 4.994 805 HB3 ALA 109 HB3 ALA 109 22.841 -1.796 3.988 806 H MET 110 H MET 110 22.331 -5.999 3.105 807 HA MET 110 HA MET 110 20.287 -6.981 4.981 808 HB2 MET 110 HB2 MET 110 21.554 -8.241 2.553 809 HB3 MET 110 HB3 MET 110 20.634 -9.176 3.725 810 HG2 MET 110 HG2 MET 110 18.744 -7.519 3.306 811 HG3 MET 110 HG3 MET 110 19.673 -7.004 1.900 812 HE1 MET 110 HE1 MET 110 18.256 -9.821 3.852 813 HE2 MET 110 HE2 MET 110 16.814 -9.722 2.841 814 HE3 MET 110 HE3 MET 110 17.891 -11.113 2.707 815 H LEU 111 H LEU 111 20.926 -7.931 6.802 816 HA LEU 111 HA LEU 111 23.753 -8.325 7.285 817 HB2 LEU 111 HB2 LEU 111 21.386 -8.778 9.096 818 HB3 LEU 111 HB3 LEU 111 23.079 -8.794 9.584 819 HG LEU 111 HG LEU 111 22.330 -6.715 10.293 820 HD11 LEU 111 HD11 LEU 111 23.428 -5.081 8.890 821 HD12 LEU 111 HD12 LEU 111 23.404 -6.196 7.524 822 HD13 LEU 111 HD13 LEU 111 24.383 -6.563 8.944 823 HD21 LEU 111 HD21 LEU 111 21.079 -5.949 7.703 824 HD22 LEU 111 HD22 LEU 111 20.690 -5.433 9.345 825 HD23 LEU 111 HD23 LEU 111 20.196 -7.031 8.781 826 H SER 112 H SER 112 23.681 -10.062 5.539 827 HA SER 112 HA SER 112 22.437 -12.511 5.813 828 HB2 SER 112 HB2 SER 112 24.786 -13.289 4.733 829 HB3 SER 112 HB3 SER 112 23.532 -12.456 3.815 830 HG SER 112 HG SER 112 25.421 -10.932 5.212 831 HA PRO 113 HA PRO 113 24.233 -14.631 9.208 832 HB2 PRO 113 HB2 PRO 113 24.437 -17.168 8.263 833 HB3 PRO 113 HB3 PRO 113 22.891 -16.418 8.675 834 HG2 PRO 113 HG2 PRO 113 24.178 -16.754 5.994 835 HG3 PRO 113 HG3 PRO 113 22.484 -16.995 6.459 836 HD2 PRO 113 HD2 PRO 113 23.346 -14.754 5.208 837 HD3 PRO 113 HD3 PRO 113 22.009 -14.741 6.376 838 H TYR 114 H TYR 114 25.764 -15.643 6.147 839 HA TYR 114 HA TYR 114 28.381 -15.346 7.461 840 HB2 TYR 114 HB2 TYR 114 27.793 -17.498 5.432 841 HB3 TYR 114 HB3 TYR 114 29.208 -17.341 6.467 842 HD1 TYR 114 HD2 TYR 114 28.047 -16.879 9.102 843 HD2 TYR 114 HD1 TYR 114 26.778 -19.505 6.004 844 HE1 TYR 114 HE2 TYR 114 26.986 -18.334 10.778 845 HE2 TYR 114 HE1 TYR 114 25.714 -20.966 7.671 846 HH TYR 114 HH TYR 114 26.187 -21.374 10.329 847 H SER 115 H SER 115 30.034 -15.840 5.368 848 HA SER 115 HA SER 115 29.227 -13.871 3.329 849 HB2 SER 115 HB2 SER 115 30.841 -12.832 4.825 850 HB3 SER 115 HB3 SER 115 31.947 -14.191 4.624 851 HG SER 115 HG SER 115 31.059 -12.685 2.410 852 H TYR 116 H TYR 116 28.809 -15.137 1.611 853 HA TYR 116 HA TYR 116 30.344 -17.483 1.007 854 HB2 TYR 116 HB2 TYR 116 27.851 -16.977 0.461 855 HB3 TYR 116 HB3 TYR 116 28.498 -16.137 -0.944 856 HD1 TYR 116 HD2 TYR 116 28.379 -19.433 0.752 857 HD2 TYR 116 HD1 TYR 116 29.176 -17.329 -2.859 858 HE1 TYR 116 HE2 TYR 116 28.516 -21.570 -0.456 859 HE2 TYR 116 HE1 TYR 116 29.313 -19.461 -4.078 860 HH TYR 116 HH TYR 116 29.246 -21.673 -3.932 861 H SER 117 H SER 117 32.393 -16.129 1.060 862 HA SER 117 HA SER 117 33.377 -15.862 -1.579 863 HB2 SER 117 HB2 SER 117 32.005 -13.691 -1.164 864 HB3 SER 117 HB3 SER 117 33.359 -13.225 -0.135 865 HG SER 117 HG SER 117 33.239 -13.526 -2.902 866 H THR 118 H THR 118 35.627 -14.639 -1.460 867 HA THR 118 HA THR 118 37.003 -15.763 0.883 868 HB THR 118 HB THR 118 37.746 -16.642 -1.287 869 HG1 THR 118 HG1 THR 118 39.919 -16.384 -0.849 870 HG21 THR 118 HG21 THR 118 38.196 -15.369 -3.078 871 HG22 THR 118 HG22 THR 118 39.148 -14.226 -2.131 872 HG23 THR 118 HG23 THR 118 37.394 -14.067 -2.200 873 H THR 119 H THR 119 36.351 -12.825 -0.831 874 HA THR 119 HA THR 119 36.969 -10.651 -0.511 875 HB THR 119 HB THR 119 36.844 -9.836 1.705 876 HG1 THR 119 HG1 THR 119 37.959 -10.840 3.186 877 HG21 THR 119 HG21 THR 119 34.873 -11.305 0.724 878 HG22 THR 119 HG22 THR 119 34.796 -10.638 2.356 879 HG23 THR 119 HG23 THR 119 35.257 -12.323 2.112 880 H ALA 120 H ALA 120 39.109 -12.502 -1.166 881 HA ALA 120 HA ALA 120 41.405 -11.634 0.377 882 HB1 ALA 120 HB1 ALA 120 41.451 -13.904 -0.318 883 HB2 ALA 120 HB2 ALA 120 41.117 -13.466 -1.993 884 HB3 ALA 120 HB3 ALA 120 42.669 -13.052 -1.268 885 H VAL 121 H VAL 121 41.678 -9.460 0.014 886 HA VAL 121 HA VAL 121 42.158 -8.636 -2.775 887 HB VAL 121 HB VAL 121 41.793 -6.303 -1.950 888 HG11 VAL 121 HG11 VAL 121 39.811 -8.406 -2.268 889 HG12 VAL 121 HG12 VAL 121 39.215 -7.045 -1.314 890 HG13 VAL 121 HG13 VAL 121 39.848 -6.775 -2.938 891 HG21 VAL 121 HG21 VAL 121 42.244 -7.036 0.479 892 HG22 VAL 121 HG22 VAL 121 40.988 -5.833 0.186 893 HG23 VAL 121 HG23 VAL 121 40.546 -7.513 0.493 894 H VAL 122 H VAL 122 43.798 -6.878 -3.020 895 HA VAL 122 HA VAL 122 45.819 -6.620 -0.990 896 HB VAL 122 HB VAL 122 46.410 -8.815 -1.939 897 HG11 VAL 122 HG11 VAL 122 47.209 -8.975 -4.249 898 HG12 VAL 122 HG12 VAL 122 45.509 -8.507 -4.182 899 HG13 VAL 122 HG13 VAL 122 46.745 -7.297 -4.524 900 HG21 VAL 122 HG21 VAL 122 48.086 -6.939 -1.220 901 HG22 VAL 122 HG22 VAL 122 48.677 -8.414 -1.986 902 HG23 VAL 122 HG23 VAL 122 48.504 -6.936 -2.934 903 H THR 123 H THR 123 47.031 -4.814 -1.274 904 HA THR 123 HA THR 123 47.000 -3.486 -3.886 905 HB THR 123 HB THR 123 45.192 -2.377 -2.822 906 HG1 THR 123 HG1 THR 123 46.042 -0.530 -3.376 907 HG21 THR 123 HG21 THR 123 46.717 -2.887 -0.416 908 HG22 THR 123 HG22 THR 123 45.001 -2.525 -0.602 909 HG23 THR 123 HG23 THR 123 46.173 -1.212 -0.488 910 H ASN 124 H ASN 124 49.097 -3.361 -4.369 911 HA ASN 124 HA ASN 124 50.904 -2.172 -2.386 912 HB2 ASN 124 HB2 ASN 124 51.458 -4.637 -4.047 913 HB3 ASN 124 HB3 ASN 124 52.700 -3.744 -3.172 914 HD21 ASN 124 HD21 ASN 124 50.823 -6.378 -3.032 915 HD22 ASN 124 HD22 ASN 124 50.695 -6.578 -1.320 916 HA PRO 125 HA PRO 125 51.097 -0.080 -6.542 917 HB2 PRO 125 HB2 PRO 125 50.847 2.438 -5.557 918 HB3 PRO 125 HB3 PRO 125 49.458 1.424 -5.969 919 HG2 PRO 125 HG2 PRO 125 50.694 1.950 -3.293 920 HG3 PRO 125 HG3 PRO 125 48.979 1.884 -3.740 921 HD2 PRO 125 HD2 PRO 125 50.250 -0.180 -2.533 922 HD3 PRO 125 HD3 PRO 125 48.925 -0.420 -3.690 923 H LYS 126 H LYS 126 52.540 1.952 -7.018 924 HA LYS 126 HA LYS 126 55.183 1.286 -6.179 925 HB2 LYS 126 HB2 LYS 126 55.924 2.793 -7.783 926 HB3 LYS 126 HB3 LYS 126 54.368 2.291 -8.433 927 HG2 LYS 126 HG2 LYS 126 54.838 4.807 -6.848 928 HG3 LYS 126 HG3 LYS 126 54.757 4.715 -8.608 929 HD2 LYS 126 HD2 LYS 126 52.543 3.916 -6.719 930 HD3 LYS 126 HD3 LYS 126 52.628 5.444 -7.598 931 HE2 LYS 126 HE2 LYS 126 52.456 2.685 -8.806 932 HE3 LYS 126 HE3 LYS 126 51.163 3.882 -8.745 933 HZ1 LYS 126 HZ1 LYS 126 53.731 4.158 -10.214 934 HZ2 LYS 126 HZ2 LYS 126 52.532 5.347 -10.121 935 HZ3 LYS 126 HZ3 LYS 126 52.210 3.883 -10.904 936 H GLU 127 H GLU 127 52.762 3.278 -4.891 937 HA GLU 127 HA GLU 127 54.710 4.892 -3.398 938 HB2 GLU 127 HB2 GLU 127 51.774 5.252 -3.959 939 HB3 GLU 127 HB3 GLU 127 52.602 6.178 -2.714 940 HG2 GLU 127 HG2 GLU 127 53.550 6.117 -5.559 941 HG3 GLU 127 HG3 GLU 127 52.341 7.265 -4.988 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -4.094 -11.264 1.221 2 HA2 GLY 1 HA2 GLY 1 -5.480 -10.494 3.702 3 HA3 GLY 1 HA3 GLY 1 -3.786 -10.190 3.350 4 HA PRO 2 HA PRO 2 -6.452 -6.408 2.446 5 HB2 PRO 2 HB2 PRO 2 -5.349 -4.785 4.321 6 HB3 PRO 2 HB3 PRO 2 -6.746 -5.818 4.647 7 HG2 PRO 2 HG2 PRO 2 -3.860 -6.279 5.292 8 HG3 PRO 2 HG3 PRO 2 -5.292 -6.573 6.296 9 HD2 PRO 2 HD2 PRO 2 -4.022 -8.552 4.954 10 HD3 PRO 2 HD3 PRO 2 -5.772 -8.568 5.246 11 H THR 3 H THR 3 -5.337 -4.022 2.390 12 HA THR 3 HA THR 3 -3.530 -4.080 0.275 13 HB THR 3 HB THR 3 -3.283 -1.719 0.530 14 HG1 THR 3 HG1 THR 3 -4.312 -2.052 3.171 15 HG21 THR 3 HG21 THR 3 -6.034 -2.341 1.594 16 HG22 THR 3 HG22 THR 3 -5.558 -2.620 -0.081 17 HG23 THR 3 HG23 THR 3 -5.548 -0.984 0.579 18 H GLY 4 H GLY 4 -1.381 -2.659 0.513 19 HA2 GLY 4 HA2 GLY 4 0.145 -3.641 2.831 20 HA3 GLY 4 HA3 GLY 4 0.735 -3.962 1.208 21 H THR 5 H THR 5 2.147 -2.535 3.215 22 HA THR 5 HA THR 5 2.115 0.210 2.148 23 HB THR 5 HB THR 5 3.313 0.880 4.189 24 HG1 THR 5 HG1 THR 5 3.921 -0.570 5.673 25 HG21 THR 5 HG21 THR 5 0.882 -0.709 4.983 26 HG22 THR 5 HG22 THR 5 0.777 0.779 4.042 27 HG23 THR 5 HG23 THR 5 1.466 0.808 5.665 28 H GLY 6 H GLY 6 3.721 0.775 0.839 29 HA2 GLY 6 HA2 GLY 6 6.434 -0.015 1.317 30 HA3 GLY 6 HA3 GLY 6 5.739 -0.843 -0.069 31 H GLU 7 H GLU 7 5.075 2.466 0.976 32 HA GLU 7 HA GLU 7 5.981 3.393 -1.652 33 HB2 GLU 7 HB2 GLU 7 4.731 5.463 -1.106 34 HB3 GLU 7 HB3 GLU 7 3.720 4.026 -1.088 35 HG2 GLU 7 HG2 GLU 7 4.675 4.331 1.528 36 HG3 GLU 7 HG3 GLU 7 4.193 5.938 0.986 37 H SER 8 H SER 8 6.674 5.902 -1.386 38 HA SER 8 HA SER 8 8.749 5.998 0.700 39 HB2 SER 8 HB2 SER 8 10.356 6.860 -0.853 40 HB3 SER 8 HB3 SER 8 9.659 5.414 -1.585 41 HG SER 8 HG SER 8 9.693 7.911 -2.532 42 H LYS 9 H LYS 9 9.793 8.454 0.257 43 HA LYS 9 HA LYS 9 7.932 10.512 -0.238 44 HB2 LYS 9 HB2 LYS 9 7.316 11.236 1.922 45 HB3 LYS 9 HB3 LYS 9 7.028 9.501 1.920 46 HG2 LYS 9 HG2 LYS 9 9.548 10.736 2.991 47 HG3 LYS 9 HG3 LYS 9 8.118 10.441 3.983 48 HD2 LYS 9 HD2 LYS 9 9.659 8.351 2.444 49 HD3 LYS 9 HD3 LYS 9 9.746 8.622 4.186 50 HE2 LYS 9 HE2 LYS 9 7.393 7.655 2.575 51 HE3 LYS 9 HE3 LYS 9 8.275 6.786 3.830 52 HZ1 LYS 9 HZ1 LYS 9 7.495 8.822 5.259 53 HZ2 LYS 9 HZ2 LYS 9 6.478 7.496 5.006 54 HZ3 LYS 9 HZ3 LYS 9 6.272 8.905 4.093 55 H CYS 10 H CYS 10 10.844 9.424 1.374 56 HA CYS 10 HA CYS 10 12.004 12.108 1.176 57 HB2 CYS 10 HB2 CYS 10 12.418 9.799 2.924 58 HB3 CYS 10 HB3 CYS 10 13.923 10.491 2.329 59 HG CYS 10 HG CYS 10 13.030 11.430 4.952 60 HA PRO 11 HA PRO 11 14.533 11.177 -2.284 61 HB2 PRO 11 HB2 PRO 11 16.829 12.489 -1.674 62 HB3 PRO 11 HB3 PRO 11 15.341 13.323 -2.138 63 HG2 PRO 11 HG2 PRO 11 16.476 12.850 0.591 64 HG3 PRO 11 HG3 PRO 11 15.737 14.317 -0.075 65 HD2 PRO 11 HD2 PRO 11 14.393 12.619 1.550 66 HD3 PRO 11 HD3 PRO 11 13.593 13.543 0.263 67 H LEU 12 H LEU 12 16.047 10.658 0.874 68 HA LEU 12 HA LEU 12 17.347 8.263 -0.221 69 HB2 LEU 12 HB2 LEU 12 19.153 9.731 -0.131 70 HB3 LEU 12 HB3 LEU 12 18.588 10.482 1.361 71 HG LEU 12 HG LEU 12 19.096 8.157 2.412 72 HD11 LEU 12 HD11 LEU 12 20.180 7.898 -0.291 73 HD12 LEU 12 HD12 LEU 12 19.777 6.658 0.897 74 HD13 LEU 12 HD13 LEU 12 21.325 7.496 0.989 75 HD21 LEU 12 HD21 LEU 12 20.969 9.088 3.268 76 HD22 LEU 12 HD22 LEU 12 20.370 10.517 2.425 77 HD23 LEU 12 HD23 LEU 12 21.616 9.512 1.682 78 H MET 13 H MET 13 17.267 6.488 1.060 79 HA MET 13 HA MET 13 16.449 6.789 3.853 80 HB2 MET 13 HB2 MET 13 14.713 5.093 3.634 81 HB3 MET 13 HB3 MET 13 14.380 6.451 2.569 82 HG2 MET 13 HG2 MET 13 14.696 5.235 0.683 83 HG3 MET 13 HG3 MET 13 15.892 4.179 1.431 84 HE1 MET 13 HE1 MET 13 14.283 3.177 4.093 85 HE2 MET 13 HE2 MET 13 13.730 1.648 3.411 86 HE3 MET 13 HE3 MET 13 15.347 2.247 3.038 87 H VAL 14 H VAL 14 17.051 5.077 5.202 88 HA VAL 14 HA VAL 14 19.081 3.297 4.038 89 HB VAL 14 HB VAL 14 18.676 4.160 6.905 90 HG11 VAL 14 HG11 VAL 14 19.524 1.901 6.850 91 HG12 VAL 14 HG12 VAL 14 20.764 2.360 5.680 92 HG13 VAL 14 HG13 VAL 14 20.819 2.999 7.323 93 HG21 VAL 14 HG21 VAL 14 19.898 5.929 6.347 94 HG22 VAL 14 HG22 VAL 14 21.230 4.844 5.950 95 HG23 VAL 14 HG23 VAL 14 20.086 5.329 4.699 96 H LYS 15 H LYS 15 18.605 1.223 3.806 97 HA LYS 15 HA LYS 15 16.439 0.083 5.445 98 HB2 LYS 15 HB2 LYS 15 15.825 0.061 3.127 99 HB3 LYS 15 HB3 LYS 15 17.384 -0.610 2.662 100 HG2 LYS 15 HG2 LYS 15 15.725 -2.334 2.554 101 HG3 LYS 15 HG3 LYS 15 16.816 -2.676 3.899 102 HD2 LYS 15 HD2 LYS 15 14.484 -1.057 4.623 103 HD3 LYS 15 HD3 LYS 15 14.089 -2.678 4.047 104 HE2 LYS 15 HE2 LYS 15 16.121 -3.260 5.708 105 HE3 LYS 15 HE3 LYS 15 15.492 -1.816 6.500 106 HZ1 LYS 15 HZ1 LYS 15 14.222 -4.427 6.116 107 HZ2 LYS 15 HZ2 LYS 15 13.231 -3.058 6.145 108 HZ3 LYS 15 HZ3 LYS 15 14.217 -3.415 7.471 109 H VAL 16 H VAL 16 17.243 -1.075 7.068 110 HA VAL 16 HA VAL 16 19.480 -2.905 6.495 111 HB VAL 16 HB VAL 16 19.014 -1.401 9.076 112 HG11 VAL 16 HG11 VAL 16 20.216 -2.987 10.058 113 HG12 VAL 16 HG12 VAL 16 20.422 -3.832 8.522 114 HG13 VAL 16 HG13 VAL 16 21.568 -2.580 9.002 115 HG21 VAL 16 HG21 VAL 16 21.291 -1.153 7.115 116 HG22 VAL 16 HG22 VAL 16 19.922 -0.044 7.196 117 HG23 VAL 16 HG23 VAL 16 21.021 -0.188 8.566 118 H LEU 17 H LEU 17 18.899 -4.954 6.708 119 HA LEU 17 HA LEU 17 17.030 -5.699 8.840 120 HB2 LEU 17 HB2 LEU 17 15.619 -6.913 7.465 121 HB3 LEU 17 HB3 LEU 17 15.934 -5.452 6.531 122 HG LEU 17 HG LEU 17 17.876 -7.252 5.680 123 HD11 LEU 17 HD11 LEU 17 15.427 -8.794 5.254 124 HD12 LEU 17 HD12 LEU 17 16.021 -8.820 6.914 125 HD13 LEU 17 HD13 LEU 17 17.070 -9.338 5.595 126 HD21 LEU 17 HD21 LEU 17 16.188 -5.546 4.540 127 HD22 LEU 17 HD22 LEU 17 15.327 -7.042 4.178 128 HD23 LEU 17 HD23 LEU 17 16.989 -6.826 3.630 129 H ASP 18 H ASP 18 17.239 -7.840 9.592 130 HA ASP 18 HA ASP 18 19.902 -8.924 9.248 131 HB2 ASP 18 HB2 ASP 18 17.651 -9.343 11.153 132 HB3 ASP 18 HB3 ASP 18 18.799 -10.663 10.943 133 H ALA 19 H ALA 19 20.296 -10.214 7.577 134 HA ALA 19 HA ALA 19 18.362 -11.562 6.060 135 HB1 ALA 19 HB1 ALA 19 20.971 -10.990 5.700 136 HB2 ALA 19 HB2 ALA 19 21.071 -12.714 6.061 137 HB3 ALA 19 HB3 ALA 19 20.074 -12.151 4.720 138 H VAL 20 H VAL 20 19.763 -12.346 9.070 139 HA VAL 20 HA VAL 20 19.847 -15.106 9.095 140 HB VAL 20 HB VAL 20 18.909 -13.305 11.333 141 HG11 VAL 20 HG11 VAL 20 19.534 -16.206 11.177 142 HG12 VAL 20 HG12 VAL 20 20.034 -15.326 12.624 143 HG13 VAL 20 HG13 VAL 20 18.334 -15.356 12.152 144 HG21 VAL 20 HG21 VAL 20 21.006 -12.512 11.123 145 HG22 VAL 20 HG22 VAL 20 21.454 -14.008 11.944 146 HG23 VAL 20 HG23 VAL 20 21.550 -13.905 10.186 147 H ARG 21 H ARG 21 17.058 -13.014 9.814 148 HA ARG 21 HA ARG 21 15.315 -15.356 9.404 149 HB2 ARG 21 HB2 ARG 21 14.487 -12.928 10.966 150 HB3 ARG 21 HB3 ARG 21 13.815 -14.552 11.016 151 HG2 ARG 21 HG2 ARG 21 14.978 -14.670 12.936 152 HG3 ARG 21 HG3 ARG 21 16.313 -15.066 11.853 153 HD2 ARG 21 HD2 ARG 21 17.372 -13.364 12.854 154 HD3 ARG 21 HD3 ARG 21 16.364 -12.341 11.831 155 HE ARG 21 HE ARG 21 15.279 -11.638 13.708 156 HH11 ARG 21 HH11 ARG 21 16.848 -14.667 14.403 157 HH12 ARG 21 HH12 ARG 21 16.439 -14.643 16.086 158 HH21 ARG 21 HH21 ARG 21 14.734 -11.594 15.923 159 HH22 ARG 21 HH22 ARG 21 15.235 -12.894 16.949 160 H GLY 22 H GLY 22 16.181 -12.244 8.324 161 HA2 GLY 22 HA2 GLY 22 15.493 -11.358 6.248 162 HA3 GLY 22 HA3 GLY 22 14.043 -12.346 6.333 163 H SER 23 H SER 23 14.481 -10.930 9.295 164 HA SER 23 HA SER 23 12.413 -8.955 8.717 165 HB2 SER 23 HB2 SER 23 12.933 -8.851 11.444 166 HB3 SER 23 HB3 SER 23 11.645 -9.771 10.666 167 HG SER 23 HG SER 23 12.861 -11.152 11.946 168 HA PRO 24 HA PRO 24 14.940 -5.384 9.036 169 HB2 PRO 24 HB2 PRO 24 13.413 -3.692 10.513 170 HB3 PRO 24 HB3 PRO 24 13.030 -4.120 8.841 171 HG2 PRO 24 HG2 PRO 24 11.890 -5.213 11.385 172 HG3 PRO 24 HG3 PRO 24 11.055 -4.763 9.886 173 HD2 PRO 24 HD2 PRO 24 11.647 -7.331 10.509 174 HD3 PRO 24 HD3 PRO 24 11.609 -6.738 8.835 175 H ALA 25 H ALA 25 16.394 -4.277 10.350 176 HA ALA 25 HA ALA 25 16.777 -5.449 13.003 177 HB1 ALA 25 HB1 ALA 25 19.037 -4.572 12.882 178 HB2 ALA 25 HB2 ALA 25 18.664 -5.505 11.432 179 HB3 ALA 25 HB3 ALA 25 18.656 -3.742 11.374 180 H ILE 26 H ILE 26 16.668 -4.306 14.861 181 HA ILE 26 HA ILE 26 15.826 -1.498 14.639 182 HB ILE 26 HB ILE 26 15.148 -3.686 16.520 183 HG12 ILE 26 HG12 ILE 26 13.717 -2.534 14.655 184 HG13 ILE 26 HG13 ILE 26 12.971 -2.953 16.193 185 HG21 ILE 26 HG21 ILE 26 16.149 -2.275 18.121 186 HG22 ILE 26 HG22 ILE 26 15.488 -0.824 17.368 187 HG23 ILE 26 HG23 ILE 26 14.419 -1.945 18.212 188 HD11 ILE 26 HD11 ILE 26 12.325 -0.727 15.417 189 HD12 ILE 26 HD12 ILE 26 13.195 -0.666 16.950 190 HD13 ILE 26 HD13 ILE 26 14.016 -0.231 15.452 191 H ASN 27 H ASN 27 16.885 0.111 15.700 192 HA ASN 27 HA ASN 27 18.569 1.211 16.761 193 HB2 ASN 27 HB2 ASN 27 18.957 -1.350 18.324 194 HB3 ASN 27 HB3 ASN 27 19.466 0.268 18.799 195 HD21 ASN 27 HD21 ASN 27 17.135 1.643 18.001 196 HD22 ASN 27 HD22 ASN 27 15.862 1.196 19.079 197 H VAL 28 H VAL 28 19.372 0.535 14.399 198 HA VAL 28 HA VAL 28 21.967 -0.824 14.706 199 HB VAL 28 HB VAL 28 20.317 -0.426 12.206 200 HG11 VAL 28 HG11 VAL 28 22.228 -0.660 11.093 201 HG12 VAL 28 HG12 VAL 28 23.125 -0.983 12.578 202 HG13 VAL 28 HG13 VAL 28 22.320 -2.302 11.728 203 HG21 VAL 28 HG21 VAL 28 19.244 -2.200 13.105 204 HG22 VAL 28 HG22 VAL 28 20.622 -3.089 12.455 205 HG23 VAL 28 HG23 VAL 28 20.596 -2.623 14.155 206 H ALA 29 H ALA 29 23.547 0.612 14.967 207 HA ALA 29 HA ALA 29 23.469 3.318 14.333 208 HB1 ALA 29 HB1 ALA 29 25.186 1.756 15.699 209 HB2 ALA 29 HB2 ALA 29 26.129 2.056 14.238 210 HB3 ALA 29 HB3 ALA 29 25.546 3.410 15.205 211 H VAL 30 H VAL 30 23.721 4.449 12.515 212 HA VAL 30 HA VAL 30 25.060 3.205 10.221 213 HB VAL 30 HB VAL 30 22.406 4.631 9.999 214 HG11 VAL 30 HG11 VAL 30 23.898 3.076 7.897 215 HG12 VAL 30 HG12 VAL 30 22.466 4.086 7.685 216 HG13 VAL 30 HG13 VAL 30 24.018 4.825 8.080 217 HG21 VAL 30 HG21 VAL 30 21.971 2.108 9.093 218 HG22 VAL 30 HG22 VAL 30 23.093 1.807 10.419 219 HG23 VAL 30 HG23 VAL 30 21.582 2.666 10.720 220 H HIS 31 H HIS 31 26.344 4.560 9.105 221 HA HIS 31 HA HIS 31 26.103 7.445 9.643 222 HB2 HIS 31 HB2 HIS 31 28.745 6.055 9.226 223 HB3 HIS 31 HB3 HIS 31 28.454 7.679 9.843 224 HD1 HIS 31 HD1 HIS 31 28.231 7.932 12.327 225 HD2 HIS 31 HD2 HIS 31 28.056 3.964 11.108 226 HE1 HIS 31 HE1 HIS 31 28.278 6.575 14.445 227 H VAL 32 H VAL 32 25.832 8.616 7.868 228 HA VAL 32 HA VAL 32 26.526 7.420 5.274 229 HB VAL 32 HB VAL 32 24.730 9.800 5.723 230 HG11 VAL 32 HG11 VAL 32 24.979 9.904 3.500 231 HG12 VAL 32 HG12 VAL 32 25.660 8.279 3.406 232 HG13 VAL 32 HG13 VAL 32 23.911 8.502 3.458 233 HG21 VAL 32 HG21 VAL 32 24.155 6.882 5.903 234 HG22 VAL 32 HG22 VAL 32 23.502 8.220 6.848 235 HG23 VAL 32 HG23 VAL 32 22.940 7.949 5.199 236 H PHE 33 H PHE 33 27.940 8.374 3.916 237 HA PHE 33 HA PHE 33 28.985 11.026 4.649 238 HB2 PHE 33 HB2 PHE 33 30.523 8.526 3.981 239 HB3 PHE 33 HB3 PHE 33 31.235 10.123 3.780 240 HD1 PHE 33 HD1 PHE 33 29.595 7.938 6.299 241 HD2 PHE 33 HD2 PHE 33 32.257 11.179 5.573 242 HE1 PHE 33 HE1 PHE 33 30.223 7.951 8.678 243 HE2 PHE 33 HE2 PHE 33 32.889 11.196 7.950 244 HZ PHE 33 HZ PHE 33 31.871 9.582 9.507 245 H ARG 34 H ARG 34 30.218 12.049 2.824 246 HA ARG 34 HA ARG 34 29.134 11.256 0.206 247 HB2 ARG 34 HB2 ARG 34 27.853 13.168 1.135 248 HB3 ARG 34 HB3 ARG 34 29.347 14.093 1.228 249 HG2 ARG 34 HG2 ARG 34 28.723 12.950 -1.411 250 HG3 ARG 34 HG3 ARG 34 27.628 14.210 -0.836 251 HD2 ARG 34 HD2 ARG 34 29.653 15.616 -0.367 252 HD3 ARG 34 HD3 ARG 34 30.614 14.390 -1.192 253 HE ARG 34 HE ARG 34 29.012 16.398 -2.408 254 HH11 ARG 34 HH11 ARG 34 30.101 13.112 -2.775 255 HH12 ARG 34 HH12 ARG 34 29.959 13.119 -4.502 256 HH21 ARG 34 HH21 ARG 34 28.822 16.421 -4.681 257 HH22 ARG 34 HH22 ARG 34 29.232 15.003 -5.585 258 H LYS 35 H LYS 35 30.445 11.646 -1.575 259 HA LYS 35 HA LYS 35 33.239 11.593 -1.098 260 HB2 LYS 35 HB2 LYS 35 32.596 10.446 -3.019 261 HB3 LYS 35 HB3 LYS 35 31.517 11.731 -3.547 262 HG2 LYS 35 HG2 LYS 35 33.448 11.611 -4.991 263 HG3 LYS 35 HG3 LYS 35 33.460 13.127 -4.086 264 HD2 LYS 35 HD2 LYS 35 35.682 12.274 -4.058 265 HD3 LYS 35 HD3 LYS 35 35.008 12.021 -2.446 266 HE2 LYS 35 HE2 LYS 35 35.758 9.921 -2.695 267 HE3 LYS 35 HE3 LYS 35 34.318 9.703 -3.689 268 HZ1 LYS 35 HZ1 LYS 35 35.676 9.179 -5.342 269 HZ2 LYS 35 HZ2 LYS 35 37.048 9.617 -4.454 270 HZ3 LYS 35 HZ3 LYS 35 36.221 10.780 -5.362 271 H ALA 36 H ALA 36 34.307 13.319 -0.374 272 HA ALA 36 HA ALA 36 33.496 16.003 -0.864 273 HB1 ALA 36 HB1 ALA 36 36.238 15.241 0.070 274 HB2 ALA 36 HB2 ALA 36 35.267 16.651 0.498 275 HB3 ALA 36 HB3 ALA 36 34.833 15.059 1.122 276 H ALA 37 H ALA 37 34.719 17.640 -1.975 277 HA ALA 37 HA ALA 37 35.404 16.957 -4.602 278 HB1 ALA 37 HB1 ALA 37 34.682 19.225 -3.652 279 HB2 ALA 37 HB2 ALA 37 36.387 19.455 -3.264 280 HB3 ALA 37 HB3 ALA 37 35.889 19.217 -4.939 281 H ASP 38 H ASP 38 37.248 16.856 -1.714 282 HA ASP 38 HA ASP 38 39.795 16.845 -3.143 283 HB2 ASP 38 HB2 ASP 38 38.963 17.126 -0.304 284 HB3 ASP 38 HB3 ASP 38 40.526 16.373 -0.606 285 H ASP 39 H ASP 39 37.588 14.687 -3.109 286 HA ASP 39 HA ASP 39 37.514 12.421 -3.311 287 HB2 ASP 39 HB2 ASP 39 40.492 12.250 -2.991 288 HB3 ASP 39 HB3 ASP 39 39.426 11.289 -4.014 289 H THR 40 H THR 40 37.139 13.522 -0.777 290 HA THR 40 HA THR 40 38.283 11.422 0.949 291 HB THR 40 HB THR 40 38.397 12.899 2.791 292 HG1 THR 40 HG1 THR 40 37.552 15.055 2.635 293 HG21 THR 40 HG21 THR 40 40.236 13.213 1.231 294 HG22 THR 40 HG22 THR 40 39.815 14.751 1.984 295 HG23 THR 40 HG23 THR 40 39.298 14.407 0.334 296 H TRP 41 H TRP 41 36.861 11.438 3.119 297 HA TRP 41 HA TRP 41 34.092 11.037 2.211 298 HB2 TRP 41 HB2 TRP 41 35.697 9.737 4.411 299 HB3 TRP 41 HB3 TRP 41 33.947 9.571 4.294 300 HD1 TRP 41 HD1 TRP 41 36.463 9.397 1.357 301 HE1 TRP 41 HE1 TRP 41 36.208 7.099 0.227 302 HE3 TRP 41 HE3 TRP 41 33.075 7.290 4.555 303 HZ2 TRP 41 HZ2 TRP 41 34.763 4.709 0.636 304 HZ3 TRP 41 HZ3 TRP 41 32.307 4.995 4.113 305 HH2 TRP 41 HH2 TRP 41 33.135 3.732 2.194 306 H GLU 42 H GLU 42 32.897 12.773 2.684 307 HA GLU 42 HA GLU 42 33.364 14.203 5.194 308 HB2 GLU 42 HB2 GLU 42 31.831 14.885 2.693 309 HB3 GLU 42 HB3 GLU 42 31.678 15.831 4.167 310 HG2 GLU 42 HG2 GLU 42 34.418 15.323 3.180 311 HG3 GLU 42 HG3 GLU 42 33.412 16.421 2.237 312 HA PRO 43 HA PRO 43 29.845 12.513 7.207 313 HB2 PRO 43 HB2 PRO 43 29.162 14.589 8.818 314 HB3 PRO 43 HB3 PRO 43 30.585 13.581 9.103 315 HG2 PRO 43 HG2 PRO 43 30.402 16.276 7.815 316 HG3 PRO 43 HG3 PRO 43 31.590 15.674 8.986 317 HD2 PRO 43 HD2 PRO 43 32.105 15.819 6.332 318 HD3 PRO 43 HD3 PRO 43 32.802 14.561 7.373 319 H PHE 44 H PHE 44 27.995 12.188 6.143 320 HA PHE 44 HA PHE 44 26.542 14.494 5.057 321 HB2 PHE 44 HB2 PHE 44 27.085 12.651 3.497 322 HB3 PHE 44 HB3 PHE 44 26.151 11.546 4.501 323 HD1 PHE 44 HD2 PHE 44 23.683 11.921 4.746 324 HD2 PHE 44 HD1 PHE 44 26.049 14.004 1.886 325 HE1 PHE 44 HE2 PHE 44 21.649 12.497 3.490 326 HE2 PHE 44 HE1 PHE 44 24.018 14.586 0.625 327 HZ PHE 44 HZ PHE 44 21.814 13.831 1.426 328 H ALA 45 H ALA 45 26.122 11.637 7.096 329 HA ALA 45 HA ALA 45 24.250 12.894 8.788 330 HB1 ALA 45 HB1 ALA 45 22.198 12.104 8.139 331 HB2 ALA 45 HB2 ALA 45 22.955 12.376 6.568 332 HB3 ALA 45 HB3 ALA 45 22.880 10.747 7.240 333 H SER 46 H SER 46 23.060 11.120 10.161 334 HA SER 46 HA SER 46 24.228 8.549 10.353 335 HB2 SER 46 HB2 SER 46 26.183 9.275 11.298 336 HB3 SER 46 HB3 SER 46 25.455 10.754 11.925 337 HG SER 46 HG SER 46 25.925 9.372 13.633 338 H GLY 47 H GLY 47 23.193 7.246 11.873 339 HA2 GLY 47 HA2 GLY 47 21.620 8.132 14.009 340 HA3 GLY 47 HA3 GLY 47 20.579 8.017 12.598 341 H LYS 48 H LYS 48 19.372 6.363 13.606 342 HA LYS 48 HA LYS 48 20.678 3.737 13.445 343 HB2 LYS 48 HB2 LYS 48 19.307 4.954 15.774 344 HB3 LYS 48 HB3 LYS 48 18.924 3.270 15.439 345 HG2 LYS 48 HG2 LYS 48 21.301 2.709 15.541 346 HG3 LYS 48 HG3 LYS 48 21.681 4.400 15.883 347 HD2 LYS 48 HD2 LYS 48 19.899 2.670 17.597 348 HD3 LYS 48 HD3 LYS 48 21.615 2.948 17.906 349 HE2 LYS 48 HE2 LYS 48 20.394 5.473 17.514 350 HE3 LYS 48 HE3 LYS 48 19.378 4.561 18.629 351 HZ1 LYS 48 HZ1 LYS 48 22.252 4.497 19.112 352 HZ2 LYS 48 HZ2 LYS 48 20.970 4.543 20.214 353 HZ3 LYS 48 HZ3 LYS 48 21.462 5.959 19.429 354 H THR 49 H THR 49 19.524 2.220 12.404 355 HA THR 49 HA THR 49 17.283 2.902 10.874 356 HB THR 49 HB THR 49 17.126 0.584 10.256 357 HG1 THR 49 HG1 THR 49 18.027 -1.033 11.460 358 HG21 THR 49 HG21 THR 49 19.931 0.299 10.409 359 HG22 THR 49 HG22 THR 49 19.599 2.025 10.256 360 HG23 THR 49 HG23 THR 49 18.973 0.896 9.054 361 H SER 50 H SER 50 15.217 1.482 10.946 362 HA SER 50 HA SER 50 14.249 1.313 13.722 363 HB2 SER 50 HB2 SER 50 13.443 3.362 12.437 364 HB3 SER 50 HB3 SER 50 12.542 2.245 11.412 365 HG SER 50 HG SER 50 11.073 2.357 12.902 366 H GLU 51 H GLU 51 12.026 0.122 13.723 367 HA GLU 51 HA GLU 51 12.504 -2.506 12.770 368 HB2 GLU 51 HB2 GLU 51 10.137 -2.912 13.588 369 HB3 GLU 51 HB3 GLU 51 11.278 -2.316 14.784 370 HG2 GLU 51 HG2 GLU 51 9.973 -0.592 15.223 371 HG3 GLU 51 HG3 GLU 51 10.010 -0.093 13.534 372 H SER 52 H SER 52 11.315 0.215 11.230 373 HA SER 52 HA SER 52 9.680 -1.335 9.349 374 HB2 SER 52 HB2 SER 52 8.623 0.679 10.259 375 HB3 SER 52 HB3 SER 52 9.968 1.663 9.681 376 HG SER 52 HG SER 52 8.562 0.055 7.863 377 H GLY 53 H GLY 53 12.795 -0.756 9.670 378 HA2 GLY 53 HA2 GLY 53 14.553 -0.858 8.189 379 HA3 GLY 53 HA3 GLY 53 13.378 -1.112 6.907 380 H GLU 54 H GLU 54 12.934 1.684 8.842 381 HA GLU 54 HA GLU 54 14.273 3.357 6.828 382 HB2 GLU 54 HB2 GLU 54 12.324 4.965 7.097 383 HB3 GLU 54 HB3 GLU 54 12.003 3.493 6.191 384 HG2 GLU 54 HG2 GLU 54 10.736 2.564 7.902 385 HG3 GLU 54 HG3 GLU 54 11.405 3.652 9.117 386 H LEU 55 H LEU 55 15.191 5.247 7.567 387 HA LEU 55 HA LEU 55 15.556 5.394 10.457 388 HB2 LEU 55 HB2 LEU 55 17.256 5.731 8.298 389 HB3 LEU 55 HB3 LEU 55 16.982 7.372 8.881 390 HG LEU 55 HG LEU 55 17.671 5.385 10.948 391 HD11 LEU 55 HD11 LEU 55 19.412 5.931 8.613 392 HD12 LEU 55 HD12 LEU 55 19.300 4.500 9.638 393 HD13 LEU 55 HD13 LEU 55 20.163 5.927 10.209 394 HD21 LEU 55 HD21 LEU 55 18.239 7.232 12.050 395 HD22 LEU 55 HD22 LEU 55 17.549 8.146 10.707 396 HD23 LEU 55 HD23 LEU 55 19.276 7.784 10.733 397 H HIS 56 H HIS 56 15.588 7.549 11.497 398 HA HIS 56 HA HIS 56 13.162 8.851 11.332 399 HB2 HIS 56 HB2 HIS 56 15.789 10.010 12.284 400 HB3 HIS 56 HB3 HIS 56 14.191 10.647 12.662 401 HD1 HIS 56 HD1 HIS 56 12.757 8.032 13.413 402 HD2 HIS 56 HD2 HIS 56 16.567 9.060 14.713 403 HE1 HIS 56 HE1 HIS 56 13.125 6.713 15.521 404 H GLY 57 H GLY 57 16.205 10.467 10.418 405 HA2 GLY 57 HA2 GLY 57 15.240 11.233 7.838 406 HA3 GLY 57 HA3 GLY 57 15.110 12.551 8.994 407 H LEU 58 H LEU 58 17.280 10.520 7.180 408 HA LEU 58 HA LEU 58 19.591 12.042 8.149 409 HB2 LEU 58 HB2 LEU 58 19.413 9.539 6.479 410 HB3 LEU 58 HB3 LEU 58 20.919 10.342 6.919 411 HG LEU 58 HG LEU 58 18.981 8.958 8.767 412 HD11 LEU 58 HD11 LEU 58 20.364 7.390 7.637 413 HD12 LEU 58 HD12 LEU 58 21.022 7.591 9.259 414 HD13 LEU 58 HD13 LEU 58 21.801 8.381 7.888 415 HD21 LEU 58 HD21 LEU 58 21.340 10.725 9.341 416 HD22 LEU 58 HD22 LEU 58 20.793 9.495 10.482 417 HD23 LEU 58 HD23 LEU 58 19.710 10.807 10.011 418 H THR 59 H THR 59 17.366 12.653 6.010 419 HA THR 59 HA THR 59 19.063 13.220 3.707 420 HB THR 59 HB THR 59 17.059 13.816 2.526 421 HG1 THR 59 HG1 THR 59 15.479 14.678 3.625 422 HG21 THR 59 HG21 THR 59 17.555 11.374 2.977 423 HG22 THR 59 HG22 THR 59 15.887 11.751 2.545 424 HG23 THR 59 HG23 THR 59 16.315 11.444 4.227 425 H THR 60 H THR 60 19.601 15.246 3.003 426 HA THR 60 HA THR 60 18.545 17.594 4.339 427 HB THR 60 HB THR 60 20.853 18.459 4.844 428 HG1 THR 60 HG1 THR 60 21.851 16.713 3.508 429 HG21 THR 60 HG21 THR 60 20.114 15.964 6.373 430 HG22 THR 60 HG22 THR 60 19.312 17.523 6.570 431 HG23 THR 60 HG23 THR 60 21.020 17.353 6.972 432 H GLU 61 H GLU 61 20.023 19.572 3.477 433 HA GLU 61 HA GLU 61 19.454 19.803 0.752 434 HB2 GLU 61 HB2 GLU 61 20.884 21.843 0.834 435 HB3 GLU 61 HB3 GLU 61 19.676 21.773 2.109 436 HG2 GLU 61 HG2 GLU 61 21.382 21.014 3.685 437 HG3 GLU 61 HG3 GLU 61 22.593 21.093 2.408 438 H GLU 62 H GLU 62 22.147 18.402 2.365 439 HA GLU 62 HA GLU 62 24.078 18.661 0.306 440 HB2 GLU 62 HB2 GLU 62 23.787 16.875 2.698 441 HB3 GLU 62 HB3 GLU 62 25.058 16.574 1.522 442 HG2 GLU 62 HG2 GLU 62 25.991 18.760 1.901 443 HG3 GLU 62 HG3 GLU 62 24.660 19.175 2.981 444 H GLU 63 H GLU 63 21.251 16.839 0.514 445 HA GLU 63 HA GLU 63 22.009 14.497 -0.876 446 HB2 GLU 63 HB2 GLU 63 19.694 14.039 -1.086 447 HB3 GLU 63 HB3 GLU 63 19.885 14.860 0.456 448 HG2 GLU 63 HG2 GLU 63 19.337 16.993 -0.943 449 HG3 GLU 63 HG3 GLU 63 18.634 15.829 -2.065 450 H PHE 64 H PHE 64 21.373 17.728 -1.894 451 HA PHE 64 HA PHE 64 20.799 17.089 -4.634 452 HB2 PHE 64 HB2 PHE 64 21.275 19.604 -3.086 453 HB3 PHE 64 HB3 PHE 64 21.378 19.651 -4.844 454 HD1 PHE 64 HD1 PHE 64 19.355 18.632 -6.123 455 HD2 PHE 64 HD2 PHE 64 19.234 19.891 -2.059 456 HE1 PHE 64 HE1 PHE 64 16.906 18.829 -6.260 457 HE2 PHE 64 HE2 PHE 64 16.785 20.090 -2.189 458 HZ PHE 64 HZ PHE 64 15.619 19.560 -4.293 459 H VAL 65 H VAL 65 22.863 15.625 -4.451 460 HA VAL 65 HA VAL 65 25.075 17.154 -5.652 461 HB VAL 65 HB VAL 65 26.669 15.552 -4.609 462 HG11 VAL 65 HG11 VAL 65 26.533 16.535 -2.323 463 HG12 VAL 65 HG12 VAL 65 26.423 17.722 -3.623 464 HG13 VAL 65 HG13 VAL 65 24.968 17.219 -2.761 465 HG21 VAL 65 HG21 VAL 65 26.045 14.014 -2.974 466 HG22 VAL 65 HG22 VAL 65 24.475 14.776 -2.718 467 HG23 VAL 65 HG23 VAL 65 24.776 13.851 -4.189 468 H GLU 66 H GLU 66 26.724 15.311 -6.533 469 HA GLU 66 HA GLU 66 25.626 14.302 -8.842 470 HB2 GLU 66 HB2 GLU 66 27.974 13.166 -7.313 471 HB3 GLU 66 HB3 GLU 66 27.613 12.861 -9.006 472 HG2 GLU 66 HG2 GLU 66 27.728 15.452 -9.213 473 HG3 GLU 66 HG3 GLU 66 28.637 15.340 -7.707 474 H GLY 67 H GLY 67 25.960 12.704 -5.704 475 HA2 GLY 67 HA2 GLY 67 23.935 11.227 -5.271 476 HA3 GLY 67 HA3 GLY 67 24.404 10.433 -6.768 477 H ILE 68 H ILE 68 27.201 11.354 -5.310 478 HA ILE 68 HA ILE 68 27.868 8.674 -4.575 479 HB ILE 68 HB ILE 68 29.469 11.157 -3.969 480 HG12 ILE 68 HG12 ILE 68 29.589 9.447 -6.460 481 HG13 ILE 68 HG13 ILE 68 28.800 11.018 -6.375 482 HG21 ILE 68 HG21 ILE 68 31.358 9.469 -4.291 483 HG22 ILE 68 HG22 ILE 68 30.399 9.339 -2.818 484 HG23 ILE 68 HG23 ILE 68 30.110 8.231 -4.158 485 HD11 ILE 68 HD11 ILE 68 30.977 12.015 -5.747 486 HD12 ILE 68 HD12 ILE 68 31.726 10.439 -6.003 487 HD13 ILE 68 HD13 ILE 68 30.965 11.282 -7.351 488 H TYR 69 H TYR 69 27.213 7.761 -2.749 489 HA TYR 69 HA TYR 69 27.460 9.269 -0.250 490 HB2 TYR 69 HB2 TYR 69 25.035 7.575 -0.851 491 HB3 TYR 69 HB3 TYR 69 25.295 8.625 0.537 492 HD1 TYR 69 HD2 TYR 69 25.838 11.170 -0.194 493 HD2 TYR 69 HD1 TYR 69 23.608 8.357 -2.477 494 HE1 TYR 69 HE2 TYR 69 24.733 13.019 -1.380 495 HE2 TYR 69 HE1 TYR 69 22.497 10.198 -3.671 496 HH TYR 69 HH TYR 69 22.173 12.411 -3.750 497 H LYS 70 H LYS 70 28.430 8.136 1.306 498 HA LYS 70 HA LYS 70 28.707 5.228 0.926 499 HB2 LYS 70 HB2 LYS 70 30.559 7.047 2.471 500 HB3 LYS 70 HB3 LYS 70 30.825 5.355 2.072 501 HG2 LYS 70 HG2 LYS 70 31.967 6.073 0.313 502 HG3 LYS 70 HG3 LYS 70 30.419 6.558 -0.384 503 HD2 LYS 70 HD2 LYS 70 30.674 8.766 0.729 504 HD3 LYS 70 HD3 LYS 70 32.280 8.267 1.265 505 HE2 LYS 70 HE2 LYS 70 31.513 8.189 -1.632 506 HE3 LYS 70 HE3 LYS 70 32.078 9.680 -0.880 507 HZ1 LYS 70 HZ1 LYS 70 33.970 8.675 -1.784 508 HZ2 LYS 70 HZ2 LYS 70 33.549 7.137 -1.222 509 HZ3 LYS 70 HZ3 LYS 70 34.059 8.324 -0.132 510 H VAL 71 H VAL 71 27.197 4.292 2.171 511 HA VAL 71 HA VAL 71 26.741 5.318 4.879 512 HB VAL 71 HB VAL 71 25.166 3.292 3.285 513 HG11 VAL 71 HG11 VAL 71 24.585 4.530 5.974 514 HG12 VAL 71 HG12 VAL 71 23.498 3.474 5.070 515 HG13 VAL 71 HG13 VAL 71 25.033 2.850 5.677 516 HG21 VAL 71 HG21 VAL 71 24.781 6.217 3.843 517 HG22 VAL 71 HG22 VAL 71 24.773 5.379 2.291 518 HG23 VAL 71 HG23 VAL 71 23.429 5.169 3.413 519 H GLU 72 H GLU 72 27.427 4.267 6.636 520 HA GLU 72 HA GLU 72 28.462 1.530 6.291 521 HB2 GLU 72 HB2 GLU 72 30.292 1.986 7.631 522 HB3 GLU 72 HB3 GLU 72 30.096 3.507 6.771 523 HG2 GLU 72 HG2 GLU 72 28.622 4.137 8.837 524 HG3 GLU 72 HG3 GLU 72 29.544 2.855 9.621 525 H ILE 73 H ILE 73 27.878 -0.002 7.752 526 HA ILE 73 HA ILE 73 25.988 0.840 9.851 527 HB ILE 73 HB ILE 73 26.103 -1.804 8.393 528 HG12 ILE 73 HG12 ILE 73 23.601 -0.482 8.121 529 HG13 ILE 73 HG13 ILE 73 24.859 0.689 7.737 530 HG21 ILE 73 HG21 ILE 73 25.225 -2.474 10.376 531 HG22 ILE 73 HG22 ILE 73 24.632 -0.865 10.784 532 HG23 ILE 73 HG23 ILE 73 23.747 -1.865 9.632 533 HD11 ILE 73 HD11 ILE 73 25.771 -0.807 6.068 534 HD12 ILE 73 HD12 ILE 73 24.568 -2.029 6.481 535 HD13 ILE 73 HD13 ILE 73 24.063 -0.501 5.760 536 H ASP 74 H ASP 74 26.393 0.291 11.910 537 HA ASP 74 HA ASP 74 28.817 -1.277 12.438 538 HB2 ASP 74 HB2 ASP 74 27.909 1.155 13.471 539 HB3 ASP 74 HB3 ASP 74 27.642 -0.008 14.767 540 H THR 75 H THR 75 28.153 -3.376 12.430 541 HA THR 75 HA THR 75 25.782 -4.157 13.926 542 HB THR 75 HB THR 75 26.183 -6.407 13.054 543 HG1 THR 75 HG1 THR 75 28.500 -6.279 13.015 544 HG21 THR 75 HG21 THR 75 26.250 -5.706 10.524 545 HG22 THR 75 HG22 THR 75 26.142 -4.076 11.189 546 HG23 THR 75 HG23 THR 75 24.881 -5.256 11.540 547 H LYS 76 H LYS 76 28.819 -3.438 14.783 548 HA LYS 76 HA LYS 76 29.481 -5.691 16.432 549 HB2 LYS 76 HB2 LYS 76 31.265 -4.219 17.313 550 HB3 LYS 76 HB3 LYS 76 31.258 -4.296 15.557 551 HG2 LYS 76 HG2 LYS 76 31.444 -2.066 15.724 552 HG3 LYS 76 HG3 LYS 76 29.694 -2.139 15.939 553 HD2 LYS 76 HD2 LYS 76 30.210 -0.893 17.770 554 HD3 LYS 76 HD3 LYS 76 30.422 -2.497 18.476 555 HE2 LYS 76 HE2 LYS 76 32.368 -1.440 19.118 556 HE3 LYS 76 HE3 LYS 76 32.872 -2.243 17.632 557 HZ1 LYS 76 HZ1 LYS 76 32.778 0.539 18.236 558 HZ2 LYS 76 HZ2 LYS 76 31.912 0.192 16.826 559 HZ3 LYS 76 HZ3 LYS 76 33.539 -0.254 16.950 560 H SER 77 H SER 77 28.072 -2.490 16.963 561 HA SER 77 HA SER 77 27.752 -3.015 19.804 562 HB2 SER 77 HB2 SER 77 27.774 -0.667 18.099 563 HB3 SER 77 HB3 SER 77 26.377 -0.660 19.175 564 HG SER 77 HG SER 77 29.015 -1.162 20.077 565 H TYR 78 H TYR 78 25.989 -3.417 16.921 566 HA TYR 78 HA TYR 78 23.372 -3.261 18.132 567 HB2 TYR 78 HB2 TYR 78 23.448 -2.634 15.846 568 HB3 TYR 78 HB3 TYR 78 24.356 -4.074 15.400 569 HD1 TYR 78 HD1 TYR 78 21.196 -3.568 17.336 570 HD2 TYR 78 HD2 TYR 78 23.085 -5.373 13.977 571 HE1 TYR 78 HE1 TYR 78 19.092 -4.712 16.775 572 HE2 TYR 78 HE2 TYR 78 20.986 -6.521 13.407 573 HH TYR 78 HH TYR 78 18.690 -6.458 13.789 574 H TRP 79 H TRP 79 25.758 -5.696 17.456 575 HA TRP 79 HA TRP 79 23.926 -7.893 17.921 576 HB2 TRP 79 HB2 TRP 79 26.862 -7.708 17.292 577 HB3 TRP 79 HB3 TRP 79 26.130 -9.231 17.793 578 HD1 TRP 79 HD1 TRP 79 23.352 -8.594 16.087 579 HE1 TRP 79 HE1 TRP 79 23.430 -9.015 13.549 580 HE3 TRP 79 HE3 TRP 79 28.417 -8.491 15.402 581 HZ2 TRP 79 HZ2 TRP 79 25.380 -9.272 11.525 582 HZ3 TRP 79 HZ3 TRP 79 29.308 -8.834 13.134 583 HH2 TRP 79 HH2 TRP 79 27.819 -9.216 11.237 584 H LYS 80 H LYS 80 25.899 -5.837 19.773 585 HA LYS 80 HA LYS 80 26.322 -7.720 21.934 586 HB2 LYS 80 HB2 LYS 80 27.629 -6.071 22.951 587 HB3 LYS 80 HB3 LYS 80 27.902 -5.806 21.234 588 HG2 LYS 80 HG2 LYS 80 27.435 -3.674 21.664 589 HG3 LYS 80 HG3 LYS 80 25.750 -4.192 21.745 590 HD2 LYS 80 HD2 LYS 80 26.141 -2.963 23.723 591 HD3 LYS 80 HD3 LYS 80 26.158 -4.661 24.204 592 HE2 LYS 80 HE2 LYS 80 28.757 -4.348 23.681 593 HE3 LYS 80 HE3 LYS 80 28.363 -2.682 24.104 594 HZ1 LYS 80 HZ1 LYS 80 27.297 -4.656 25.920 595 HZ2 LYS 80 HZ2 LYS 80 28.108 -3.208 26.249 596 HZ3 LYS 80 HZ3 LYS 80 28.988 -4.605 25.876 597 H ALA 81 H ALA 81 23.919 -5.513 20.945 598 HA ALA 81 HA ALA 81 22.850 -5.017 23.582 599 HB1 ALA 81 HB1 ALA 81 22.090 -3.252 22.459 600 HB2 ALA 81 HB2 ALA 81 22.398 -4.018 20.900 601 HB3 ALA 81 HB3 ALA 81 20.887 -4.332 21.754 602 H LEU 82 H LEU 82 21.951 -6.962 20.751 603 HA LEU 82 HA LEU 82 19.800 -8.219 22.279 604 HB2 LEU 82 HB2 LEU 82 20.593 -8.533 19.388 605 HB3 LEU 82 HB3 LEU 82 19.183 -9.266 20.150 606 HG LEU 82 HG LEU 82 18.296 -7.456 19.001 607 HD11 LEU 82 HD11 LEU 82 18.887 -6.269 21.704 608 HD12 LEU 82 HD12 LEU 82 17.672 -7.514 21.414 609 HD13 LEU 82 HD13 LEU 82 17.508 -5.930 20.658 610 HD21 LEU 82 HD21 LEU 82 20.410 -5.595 20.044 611 HD22 LEU 82 HD22 LEU 82 19.283 -5.344 18.711 612 HD23 LEU 82 HD23 LEU 82 20.609 -6.495 18.540 613 H GLY 83 H GLY 83 22.969 -8.645 22.174 614 HA2 GLY 83 HA2 GLY 83 24.389 -10.403 22.577 615 HA3 GLY 83 HA3 GLY 83 22.977 -11.224 23.228 616 H ILE 84 H ILE 84 23.729 -10.178 19.915 617 HA ILE 84 HA ILE 84 23.015 -12.834 18.957 618 HB ILE 84 HB ILE 84 23.827 -10.469 17.276 619 HG12 ILE 84 HG12 ILE 84 21.963 -9.822 18.749 620 HG13 ILE 84 HG13 ILE 84 21.447 -9.931 17.069 621 HG21 ILE 84 HG21 ILE 84 22.720 -13.156 16.775 622 HG22 ILE 84 HG22 ILE 84 22.026 -11.840 15.828 623 HG23 ILE 84 HG23 ILE 84 23.762 -12.151 15.769 624 HD11 ILE 84 HD11 ILE 84 20.214 -11.087 19.238 625 HD12 ILE 84 HD12 ILE 84 19.939 -11.488 17.543 626 HD13 ILE 84 HD13 ILE 84 21.087 -12.428 18.496 627 H SER 85 H SER 85 24.358 -14.024 17.498 628 HA SER 85 HA SER 85 26.932 -14.481 18.340 629 HB2 SER 85 HB2 SER 85 25.431 -15.109 15.845 630 HB3 SER 85 HB3 SER 85 27.179 -15.342 15.824 631 HG SER 85 HG SER 85 27.011 -16.903 17.291 632 HA PRO 86 HA PRO 86 28.841 -10.707 16.811 633 HB2 PRO 86 HB2 PRO 86 31.184 -11.092 18.127 634 HB3 PRO 86 HB3 PRO 86 29.734 -10.455 18.913 635 HG2 PRO 86 HG2 PRO 86 30.826 -13.242 18.926 636 HG3 PRO 86 HG3 PRO 86 30.152 -12.297 20.267 637 HD2 PRO 86 HD2 PRO 86 28.728 -14.194 18.961 638 HD3 PRO 86 HD3 PRO 86 27.976 -12.743 19.653 639 H MET 87 H MET 87 29.314 -10.955 14.688 640 HA MET 87 HA MET 87 31.633 -12.645 14.019 641 HB2 MET 87 HB2 MET 87 29.314 -12.105 12.165 642 HB3 MET 87 HB3 MET 87 30.631 -13.246 11.931 643 HG2 MET 87 HG2 MET 87 28.433 -13.432 13.975 644 HG3 MET 87 HG3 MET 87 28.621 -14.422 12.529 645 HE1 MET 87 HE1 MET 87 32.122 -14.648 12.983 646 HE2 MET 87 HE2 MET 87 31.924 -16.362 13.345 647 HE3 MET 87 HE3 MET 87 30.958 -15.612 12.074 648 H HIS 88 H HIS 88 32.023 -11.912 11.425 649 HA HIS 88 HA HIS 88 32.512 -9.011 11.600 650 HB2 HIS 88 HB2 HIS 88 34.276 -10.992 10.156 651 HB3 HIS 88 HB3 HIS 88 34.617 -9.297 10.492 652 HD1 HIS 88 HD1 HIS 88 34.171 -9.058 13.436 653 HD2 HIS 88 HD2 HIS 88 35.973 -12.388 11.724 654 HE1 HIS 88 HE1 HIS 88 35.517 -10.116 15.278 655 H GLU 89 H GLU 89 30.713 -8.409 10.414 656 HA GLU 89 HA GLU 89 30.979 -8.690 7.554 657 HB2 GLU 89 HB2 GLU 89 29.530 -10.648 8.621 658 HB3 GLU 89 HB3 GLU 89 28.276 -9.417 8.577 659 HG2 GLU 89 HG2 GLU 89 29.883 -9.943 6.126 660 HG3 GLU 89 HG3 GLU 89 28.602 -11.064 6.581 661 H HIS 90 H HIS 90 31.235 -6.468 9.186 662 HA HIS 90 HA HIS 90 28.735 -4.974 8.938 663 HB2 HIS 90 HB2 HIS 90 30.000 -3.195 10.183 664 HB3 HIS 90 HB3 HIS 90 29.821 -4.711 11.060 665 HD1 HIS 90 HD1 HIS 90 31.970 -6.146 11.393 666 HD2 HIS 90 HD2 HIS 90 32.612 -2.477 9.552 667 HE1 HIS 90 HE1 HIS 90 34.455 -5.777 11.477 668 H ALA 91 H ALA 91 29.385 -5.428 6.484 669 HA ALA 91 HA ALA 91 31.328 -3.761 5.289 670 HB1 ALA 91 HB1 ALA 91 30.292 -5.790 4.251 671 HB2 ALA 91 HB2 ALA 91 28.840 -4.827 3.968 672 HB3 ALA 91 HB3 ALA 91 30.363 -4.375 3.199 673 H GLU 92 H GLU 92 30.232 -2.335 3.308 674 HA GLU 92 HA GLU 92 28.235 -0.538 4.453 675 HB2 GLU 92 HB2 GLU 92 29.697 1.424 3.701 676 HB3 GLU 92 HB3 GLU 92 30.157 0.598 5.184 677 HG2 GLU 92 HG2 GLU 92 31.969 -0.472 4.161 678 HG3 GLU 92 HG3 GLU 92 31.372 -0.119 2.541 679 H VAL 93 H VAL 93 27.660 1.214 2.786 680 HA VAL 93 HA VAL 93 27.551 -0.060 0.131 681 HB VAL 93 HB VAL 93 25.601 1.964 1.229 682 HG11 VAL 93 HG11 VAL 93 24.651 0.177 -0.834 683 HG12 VAL 93 HG12 VAL 93 24.646 1.941 -0.782 684 HG13 VAL 93 HG13 VAL 93 26.070 1.079 -1.364 685 HG21 VAL 93 HG21 VAL 93 25.815 -0.912 1.682 686 HG22 VAL 93 HG22 VAL 93 24.875 0.304 2.547 687 HG23 VAL 93 HG23 VAL 93 24.242 -0.408 1.063 688 H VAL 94 H VAL 94 28.893 0.871 -1.262 689 HA VAL 94 HA VAL 94 29.137 3.809 -1.220 690 HB VAL 94 HB VAL 94 31.308 1.823 -1.911 691 HG11 VAL 94 HG11 VAL 94 32.518 4.249 -1.664 692 HG12 VAL 94 HG12 VAL 94 32.040 3.514 -3.196 693 HG13 VAL 94 HG13 VAL 94 30.987 4.694 -2.415 694 HG21 VAL 94 HG21 VAL 94 30.474 2.822 0.585 695 HG22 VAL 94 HG22 VAL 94 31.929 1.894 0.222 696 HG23 VAL 94 HG23 VAL 94 31.975 3.656 0.185 697 H PHE 95 H PHE 95 28.030 4.534 -2.921 698 HA PHE 95 HA PHE 95 28.529 3.274 -5.531 699 HB2 PHE 95 HB2 PHE 95 25.885 4.150 -4.373 700 HB3 PHE 95 HB3 PHE 95 26.126 3.909 -6.100 701 HD1 PHE 95 HD2 PHE 95 27.379 1.559 -6.608 702 HD2 PHE 95 HD1 PHE 95 24.903 2.418 -3.255 703 HE1 PHE 95 HE2 PHE 95 26.916 -0.843 -6.339 704 HE2 PHE 95 HE1 PHE 95 24.436 0.019 -2.981 705 HZ PHE 95 HZ PHE 95 25.443 -1.617 -4.522 706 H THR 96 H THR 96 29.276 4.648 -6.999 707 HA THR 96 HA THR 96 29.035 7.528 -6.469 708 HB THR 96 HB THR 96 31.328 6.830 -6.656 709 HG1 THR 96 HG1 THR 96 31.921 8.320 -8.146 710 HG21 THR 96 HG21 THR 96 30.441 5.537 -9.229 711 HG22 THR 96 HG22 THR 96 31.196 4.774 -7.830 712 HG23 THR 96 HG23 THR 96 32.134 5.859 -8.856 713 H ALA 97 H ALA 97 28.213 8.930 -7.972 714 HA ALA 97 HA ALA 97 26.580 7.743 -10.061 715 HB1 ALA 97 HB1 ALA 97 26.476 10.129 -8.454 716 HB2 ALA 97 HB2 ALA 97 26.299 10.520 -10.165 717 HB3 ALA 97 HB3 ALA 97 25.206 9.362 -9.408 718 H ASN 98 H ASN 98 26.553 8.634 -12.241 719 HA ASN 98 HA ASN 98 27.541 9.186 -14.214 720 HB2 ASN 98 HB2 ASN 98 28.047 11.293 -12.659 721 HB3 ASN 98 HB3 ASN 98 29.705 10.742 -12.881 722 HD21 ASN 98 HD21 ASN 98 26.850 10.912 -14.982 723 HD22 ASN 98 HD22 ASN 98 27.627 11.791 -16.250 724 H ASP 99 H ASP 99 28.210 6.750 -13.373 725 HA ASP 99 HA ASP 99 30.983 6.499 -14.271 726 HB2 ASP 99 HB2 ASP 99 29.883 5.569 -11.659 727 HB3 ASP 99 HB3 ASP 99 31.051 4.537 -12.480 728 H SER 100 H SER 100 28.071 4.680 -13.325 729 HA SER 100 HA SER 100 28.299 3.149 -15.810 730 HB2 SER 100 HB2 SER 100 29.341 1.724 -14.144 731 HB3 SER 100 HB3 SER 100 27.966 1.930 -13.059 732 HG SER 100 HG SER 100 28.288 0.120 -14.972 733 H GLY 101 H GLY 101 26.310 3.687 -12.902 734 HA2 GLY 101 HA2 GLY 101 24.108 4.802 -13.517 735 HA3 GLY 101 HA3 GLY 101 23.916 3.437 -14.609 736 HA PRO 102 HA PRO 102 23.631 1.676 -10.102 737 HB2 PRO 102 HB2 PRO 102 23.360 3.513 -8.121 738 HB3 PRO 102 HB3 PRO 102 24.930 2.904 -8.657 739 HG2 PRO 102 HG2 PRO 102 23.545 5.458 -9.375 740 HG3 PRO 102 HG3 PRO 102 25.251 5.185 -8.975 741 HD2 PRO 102 HD2 PRO 102 24.375 5.447 -11.525 742 HD3 PRO 102 HD3 PRO 102 25.752 4.415 -11.090 743 H ARG 103 H ARG 103 21.977 4.827 -10.376 744 HA ARG 103 HA ARG 103 19.790 5.423 -10.145 745 HB2 ARG 103 HB2 ARG 103 19.578 2.730 -11.476 746 HB3 ARG 103 HB3 ARG 103 18.155 3.704 -11.129 747 HG2 ARG 103 HG2 ARG 103 18.594 4.322 -13.286 748 HG3 ARG 103 HG3 ARG 103 19.482 5.563 -12.399 749 HD2 ARG 103 HD2 ARG 103 21.525 4.688 -12.949 750 HD3 ARG 103 HD3 ARG 103 20.901 3.045 -13.096 751 HE ARG 103 HE ARG 103 20.589 3.432 -15.317 752 HH11 ARG 103 HH11 ARG 103 20.702 6.497 -13.669 753 HH12 ARG 103 HH12 ARG 103 20.621 7.431 -15.126 754 HH21 ARG 103 HH21 ARG 103 20.481 4.651 -17.242 755 HH22 ARG 103 HH22 ARG 103 20.493 6.380 -17.158 756 H ARG 104 H ARG 104 20.895 4.487 -7.789 757 HA ARG 104 HA ARG 104 18.579 3.161 -6.546 758 HB2 ARG 104 HB2 ARG 104 21.483 2.542 -6.306 759 HB3 ARG 104 HB3 ARG 104 20.489 2.383 -4.864 760 HG2 ARG 104 HG2 ARG 104 19.824 1.049 -7.474 761 HG3 ARG 104 HG3 ARG 104 20.799 0.292 -6.214 762 HD2 ARG 104 HD2 ARG 104 19.023 0.099 -4.765 763 HD3 ARG 104 HD3 ARG 104 18.149 1.447 -5.492 764 HE ARG 104 HE ARG 104 18.428 -0.846 -7.212 765 HH11 ARG 104 HH11 ARG 104 16.505 0.696 -4.754 766 HH12 ARG 104 HH12 ARG 104 15.047 -0.136 -5.188 767 HH21 ARG 104 HH21 ARG 104 16.516 -1.947 -7.794 768 HH22 ARG 104 HH22 ARG 104 15.056 -1.640 -6.917 769 H TYR 105 H TYR 105 17.843 4.023 -4.664 770 HA TYR 105 HA TYR 105 19.295 6.367 -3.622 771 HB2 TYR 105 HB2 TYR 105 16.300 5.984 -3.575 772 HB3 TYR 105 HB3 TYR 105 17.197 7.437 -3.150 773 HD1 TYR 105 HD2 TYR 105 19.026 7.860 -5.312 774 HD2 TYR 105 HD1 TYR 105 15.035 6.392 -5.462 775 HE1 TYR 105 HE2 TYR 105 18.821 8.668 -7.626 776 HE2 TYR 105 HE1 TYR 105 14.820 7.195 -7.776 777 HH TYR 105 HH TYR 105 17.251 7.902 -9.711 778 H THR 106 H THR 106 17.414 3.510 -2.882 779 HA THR 106 HA THR 106 17.602 3.966 -0.016 780 HB THR 106 HB THR 106 16.420 1.646 -1.555 781 HG1 THR 106 HG1 THR 106 14.788 2.969 -1.736 782 HG21 THR 106 HG21 THR 106 16.960 0.762 0.547 783 HG22 THR 106 HG22 THR 106 15.279 1.268 0.718 784 HG23 THR 106 HG23 THR 106 16.573 2.268 1.379 785 H ILE 107 H ILE 107 19.006 2.994 1.334 786 HA ILE 107 HA ILE 107 21.179 1.472 0.157 787 HB ILE 107 HB ILE 107 20.750 2.515 2.956 788 HG12 ILE 107 HG12 ILE 107 23.025 3.666 1.957 789 HG13 ILE 107 HG13 ILE 107 22.031 3.532 0.510 790 HG21 ILE 107 HG21 ILE 107 22.188 0.921 3.581 791 HG22 ILE 107 HG22 ILE 107 22.635 0.546 1.918 792 HG23 ILE 107 HG23 ILE 107 23.409 1.890 2.757 793 HD11 ILE 107 HD11 ILE 107 21.121 4.822 3.069 794 HD12 ILE 107 HD12 ILE 107 21.814 5.693 1.699 795 HD13 ILE 107 HD13 ILE 107 20.290 4.824 1.513 796 H ALA 108 H ALA 108 20.882 -0.641 -0.118 797 HA ALA 108 HA ALA 108 19.216 -2.148 1.740 798 HB1 ALA 108 HB1 ALA 108 20.102 -3.975 -0.075 799 HB2 ALA 108 HB2 ALA 108 18.629 -3.019 -0.241 800 HB3 ALA 108 HB3 ALA 108 20.116 -2.489 -1.027 801 H ALA 109 H ALA 109 20.161 -2.895 3.520 802 HA ALA 109 HA ALA 109 22.825 -4.125 3.272 803 HB1 ALA 109 HB1 ALA 109 23.254 -3.326 5.625 804 HB2 ALA 109 HB2 ALA 109 23.233 -2.074 4.382 805 HB3 ALA 109 HB3 ALA 109 21.840 -2.288 5.442 806 H MET 110 H MET 110 22.787 -6.204 3.795 807 HA MET 110 HA MET 110 20.690 -7.153 5.633 808 HB2 MET 110 HB2 MET 110 22.047 -8.513 3.308 809 HB3 MET 110 HB3 MET 110 21.108 -9.397 4.504 810 HG2 MET 110 HG2 MET 110 19.195 -7.828 3.939 811 HG3 MET 110 HG3 MET 110 20.160 -7.330 2.551 812 HE1 MET 110 HE1 MET 110 18.866 -10.183 4.554 813 HE2 MET 110 HE2 MET 110 17.415 -10.170 3.551 814 HE3 MET 110 HE3 MET 110 18.563 -11.504 3.426 815 H LEU 111 H LEU 111 21.321 -7.963 7.520 816 HA LEU 111 HA LEU 111 24.148 -8.271 8.067 817 HB2 LEU 111 HB2 LEU 111 21.770 -8.665 9.877 818 HB3 LEU 111 HB3 LEU 111 23.457 -8.592 10.380 819 HG LEU 111 HG LEU 111 22.649 -6.495 10.938 820 HD11 LEU 111 HD11 LEU 111 23.732 -4.938 9.488 821 HD12 LEU 111 HD12 LEU 111 23.642 -6.057 8.128 822 HD13 LEU 111 HD13 LEU 111 24.687 -6.420 9.503 823 HD21 LEU 111 HD21 LEU 111 21.343 -6.017 8.295 824 HD22 LEU 111 HD22 LEU 111 20.991 -5.303 9.869 825 HD23 LEU 111 HD23 LEU 111 20.507 -6.965 9.526 826 H SER 112 H SER 112 23.986 -10.120 6.367 827 HA SER 112 HA SER 112 22.849 -12.594 7.075 828 HB2 SER 112 HB2 SER 112 24.915 -11.685 5.126 829 HB3 SER 112 HB3 SER 112 24.829 -13.409 5.486 830 HG SER 112 HG SER 112 23.366 -13.260 3.938 831 HA PRO 113 HA PRO 113 25.559 -14.350 10.042 832 HB2 PRO 113 HB2 PRO 113 25.713 -16.938 9.238 833 HB3 PRO 113 HB3 PRO 113 24.261 -16.244 9.968 834 HG2 PRO 113 HG2 PRO 113 24.887 -16.719 7.080 835 HG3 PRO 113 HG3 PRO 113 23.376 -17.015 7.960 836 HD2 PRO 113 HD2 PRO 113 23.749 -14.835 6.397 837 HD3 PRO 113 HD3 PRO 113 22.735 -14.803 7.854 838 H TYR 114 H TYR 114 27.523 -15.985 10.155 839 HA TYR 114 HA TYR 114 29.321 -15.720 7.883 840 HB2 TYR 114 HB2 TYR 114 29.690 -13.653 9.170 841 HB3 TYR 114 HB3 TYR 114 30.023 -14.609 10.609 842 HD1 TYR 114 HD1 TYR 114 31.179 -15.322 7.158 843 HD2 TYR 114 HD2 TYR 114 32.253 -14.000 11.056 844 HE1 TYR 114 HE1 TYR 114 33.556 -15.427 6.532 845 HE2 TYR 114 HE2 TYR 114 34.632 -14.099 10.440 846 HH TYR 114 HH TYR 114 36.093 -15.024 8.881 847 H SER 115 H SER 115 28.657 -18.063 8.153 848 HA SER 115 HA SER 115 30.828 -19.543 9.149 849 HB2 SER 115 HB2 SER 115 29.406 -18.846 11.270 850 HB3 SER 115 HB3 SER 115 28.399 -20.203 10.764 851 HG SER 115 HG SER 115 30.601 -21.312 10.656 852 H TYR 116 H TYR 116 30.935 -21.195 7.795 853 HA TYR 116 HA TYR 116 30.363 -22.837 6.328 854 HB2 TYR 116 HB2 TYR 116 28.030 -22.967 8.232 855 HB3 TYR 116 HB3 TYR 116 28.204 -24.084 6.884 856 HD1 TYR 116 HD1 TYR 116 30.729 -25.105 6.765 857 HD2 TYR 116 HD2 TYR 116 28.733 -23.757 10.273 858 HE1 TYR 116 HE1 TYR 116 32.182 -26.540 8.137 859 HE2 TYR 116 HE2 TYR 116 30.182 -25.187 11.653 860 HH TYR 116 HH TYR 116 31.542 -27.248 11.369 861 H SER 117 H SER 117 29.510 -20.027 5.857 862 HA SER 117 HA SER 117 27.091 -20.388 4.254 863 HB2 SER 117 HB2 SER 117 27.436 -17.839 3.916 864 HB3 SER 117 HB3 SER 117 26.915 -18.411 5.501 865 HG SER 117 HG SER 117 28.896 -16.881 5.129 866 H THR 118 H THR 118 27.056 -20.328 2.071 867 HA THR 118 HA THR 118 29.324 -20.973 0.593 868 HB THR 118 HB THR 118 27.962 -20.402 -1.426 869 HG1 THR 118 HG1 THR 118 26.354 -19.066 -1.160 870 HG21 THR 118 HG21 THR 118 25.904 -21.896 -0.313 871 HG22 THR 118 HG22 THR 118 27.314 -22.311 0.663 872 HG23 THR 118 HG23 THR 118 27.358 -22.528 -1.086 873 H THR 119 H THR 119 27.788 -17.839 1.144 874 HA THR 119 HA THR 119 30.037 -16.551 -0.257 875 HB THR 119 HB THR 119 27.474 -15.132 0.405 876 HG1 THR 119 HG1 THR 119 28.003 -16.806 -1.837 877 HG21 THR 119 HG21 THR 119 28.136 -13.586 -1.197 878 HG22 THR 119 HG22 THR 119 29.198 -14.735 -2.011 879 HG23 THR 119 HG23 THR 119 29.671 -14.045 -0.460 880 H ALA 120 H ALA 120 31.389 -16.669 1.602 881 HA ALA 120 HA ALA 120 30.655 -14.735 3.703 882 HB1 ALA 120 HB1 ALA 120 31.467 -17.492 3.945 883 HB2 ALA 120 HB2 ALA 120 32.574 -16.425 4.808 884 HB3 ALA 120 HB3 ALA 120 30.850 -16.389 5.175 885 H VAL 121 H VAL 121 31.983 -13.056 3.906 886 HA VAL 121 HA VAL 121 34.623 -13.202 2.607 887 HB VAL 121 HB VAL 121 34.541 -10.770 2.406 888 HG11 VAL 121 HG11 VAL 121 31.898 -11.571 1.319 889 HG12 VAL 121 HG12 VAL 121 33.254 -10.764 0.528 890 HG13 VAL 121 HG13 VAL 121 33.307 -12.504 0.815 891 HG21 VAL 121 HG21 VAL 121 32.444 -9.563 2.930 892 HG22 VAL 121 HG22 VAL 121 31.821 -11.028 3.688 893 HG23 VAL 121 HG23 VAL 121 33.237 -10.218 4.361 894 H VAL 122 H VAL 122 36.272 -11.691 3.600 895 HA VAL 122 HA VAL 122 36.101 -11.851 6.540 896 HB VAL 122 HB VAL 122 38.614 -11.915 4.866 897 HG11 VAL 122 HG11 VAL 122 39.498 -12.815 7.123 898 HG12 VAL 122 HG12 VAL 122 39.243 -11.078 6.938 899 HG13 VAL 122 HG13 VAL 122 38.059 -12.058 7.804 900 HG21 VAL 122 HG21 VAL 122 38.139 -14.054 4.475 901 HG22 VAL 122 HG22 VAL 122 38.334 -14.340 6.205 902 HG23 VAL 122 HG23 VAL 122 36.735 -14.004 5.541 903 H THR 123 H THR 123 35.025 -9.702 6.251 904 HA THR 123 HA THR 123 36.651 -7.481 5.420 905 HB THR 123 HB THR 123 34.736 -6.128 6.460 906 HG1 THR 123 HG1 THR 123 33.830 -7.676 7.804 907 HG21 THR 123 HG21 THR 123 34.187 -8.089 4.230 908 HG22 THR 123 HG22 THR 123 34.889 -6.479 4.071 909 HG23 THR 123 HG23 THR 123 33.211 -6.663 4.579 910 H ASN 124 H ASN 124 38.470 -7.860 6.851 911 HA ASN 124 HA ASN 124 38.083 -6.517 9.416 912 HB2 ASN 124 HB2 ASN 124 39.222 -9.277 9.052 913 HB3 ASN 124 HB3 ASN 124 39.705 -8.271 10.414 914 HD21 ASN 124 HD21 ASN 124 38.176 -7.728 11.985 915 HD22 ASN 124 HD22 ASN 124 36.705 -8.618 12.166 916 HA PRO 125 HA PRO 125 41.787 -5.059 7.012 917 HB2 PRO 125 HB2 PRO 125 41.208 -2.419 7.268 918 HB3 PRO 125 HB3 PRO 125 40.563 -3.422 5.963 919 HG2 PRO 125 HG2 PRO 125 39.260 -2.573 8.520 920 HG3 PRO 125 HG3 PRO 125 38.580 -2.630 6.883 921 HD2 PRO 125 HD2 PRO 125 38.099 -4.553 8.729 922 HD3 PRO 125 HD3 PRO 125 38.189 -4.899 6.990 923 H LYS 126 H LYS 126 43.340 -3.233 7.772 924 HA LYS 126 HA LYS 126 44.409 -3.900 10.229 925 HB2 LYS 126 HB2 LYS 126 45.874 -2.054 9.979 926 HB3 LYS 126 HB3 LYS 126 45.508 -2.601 8.348 927 HG2 LYS 126 HG2 LYS 126 44.068 -0.324 9.682 928 HG3 LYS 126 HG3 LYS 126 45.514 -0.115 8.691 929 HD2 LYS 126 HD2 LYS 126 44.091 -1.553 6.977 930 HD3 LYS 126 HD3 LYS 126 42.749 -0.867 7.896 931 HE2 LYS 126 HE2 LYS 126 43.097 0.650 6.149 932 HE3 LYS 126 HE3 LYS 126 43.895 1.390 7.535 933 HZ1 LYS 126 HZ1 LYS 126 45.603 -0.332 5.980 934 HZ2 LYS 126 HZ2 LYS 126 45.885 1.230 6.564 935 HZ3 LYS 126 HZ3 LYS 126 45.031 1.008 5.121 936 H GLU 127 H GLU 127 41.881 -1.624 9.472 937 HA GLU 127 HA GLU 127 41.933 -0.301 12.018 938 HB2 GLU 127 HB2 GLU 127 40.093 -0.281 9.653 939 HB3 GLU 127 HB3 GLU 127 39.567 0.431 11.172 940 HG2 GLU 127 HG2 GLU 127 42.209 1.225 10.065 941 HG3 GLU 127 HG3 GLU 127 40.746 1.868 9.321 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -6.460 10.778 -0.018 2 HA2 GLY 1 HA2 GLY 1 -4.589 12.238 1.465 3 HA3 GLY 1 HA3 GLY 1 -4.712 10.486 1.439 4 HA PRO 2 HA PRO 2 -0.622 11.784 -0.386 5 HB2 PRO 2 HB2 PRO 2 0.886 10.174 1.196 6 HB3 PRO 2 HB3 PRO 2 0.417 11.813 1.662 7 HG2 PRO 2 HG2 PRO 2 -0.796 9.196 2.462 8 HG3 PRO 2 HG3 PRO 2 -0.443 10.618 3.461 9 HD2 PRO 2 HD2 PRO 2 -2.928 10.068 2.536 10 HD3 PRO 2 HD3 PRO 2 -2.344 11.727 2.777 11 H THR 3 H THR 3 1.243 9.989 -0.851 12 HA THR 3 HA THR 3 0.307 8.387 -2.894 13 HB THR 3 HB THR 3 2.442 7.299 -2.931 14 HG1 THR 3 HG1 THR 3 2.910 8.354 -0.324 15 HG21 THR 3 HG21 THR 3 2.356 9.735 -3.499 16 HG22 THR 3 HG22 THR 3 3.940 9.173 -2.967 17 HG23 THR 3 HG23 THR 3 2.909 10.081 -1.863 18 H GLY 4 H GLY 4 0.231 6.040 -3.091 19 HA2 GLY 4 HA2 GLY 4 -1.528 4.821 -1.344 20 HA3 GLY 4 HA3 GLY 4 -0.470 3.950 -2.446 21 H THR 5 H THR 5 -1.395 3.843 0.568 22 HA THR 5 HA THR 5 0.782 4.034 2.251 23 HB THR 5 HB THR 5 -0.305 2.450 3.716 24 HG1 THR 5 HG1 THR 5 -1.376 0.833 2.889 25 HG21 THR 5 HG21 THR 5 -1.335 4.758 3.212 26 HG22 THR 5 HG22 THR 5 -2.328 3.573 4.059 27 HG23 THR 5 HG23 THR 5 -2.570 3.856 2.335 28 H GLY 6 H GLY 6 2.295 2.503 3.055 29 HA2 GLY 6 HA2 GLY 6 3.615 0.581 2.983 30 HA3 GLY 6 HA3 GLY 6 2.659 0.005 1.626 31 H GLU 7 H GLU 7 4.258 3.139 1.841 32 HA GLU 7 HA GLU 7 6.344 2.252 0.002 33 HB2 GLU 7 HB2 GLU 7 4.181 3.225 -1.166 34 HB3 GLU 7 HB3 GLU 7 4.896 4.765 -0.710 35 HG2 GLU 7 HG2 GLU 7 6.702 4.499 -2.110 36 HG3 GLU 7 HG3 GLU 7 6.552 2.743 -2.142 37 H SER 8 H SER 8 7.886 4.142 -0.457 38 HA SER 8 HA SER 8 8.752 5.169 2.065 39 HB2 SER 8 HB2 SER 8 9.928 6.213 -0.464 40 HB3 SER 8 HB3 SER 8 10.729 5.669 1.010 41 HG SER 8 HG SER 8 10.462 4.324 -1.203 42 H LYS 9 H LYS 9 9.758 7.656 1.529 43 HA LYS 9 HA LYS 9 7.700 9.388 0.499 44 HB2 LYS 9 HB2 LYS 9 7.080 10.471 2.504 45 HB3 LYS 9 HB3 LYS 9 6.969 8.750 2.852 46 HG2 LYS 9 HG2 LYS 9 9.377 10.411 3.543 47 HG3 LYS 9 HG3 LYS 9 8.017 10.170 4.641 48 HD2 LYS 9 HD2 LYS 9 9.739 7.994 3.452 49 HD3 LYS 9 HD3 LYS 9 9.829 8.595 5.109 50 HE2 LYS 9 HE2 LYS 9 7.559 7.113 3.800 51 HE3 LYS 9 HE3 LYS 9 8.563 6.576 5.145 52 HZ1 LYS 9 HZ1 LYS 9 6.707 7.292 6.238 53 HZ2 LYS 9 HZ2 LYS 9 6.369 8.522 5.127 54 HZ3 LYS 9 HZ3 LYS 9 7.615 8.721 6.254 55 H CYS 10 H CYS 10 10.757 8.945 2.148 56 HA CYS 10 HA CYS 10 11.615 11.635 1.367 57 HB2 CYS 10 HB2 CYS 10 13.592 11.172 2.802 58 HB3 CYS 10 HB3 CYS 10 12.068 11.063 3.674 59 HG CYS 10 HG CYS 10 12.009 8.285 3.730 60 HA PRO 11 HA PRO 11 14.066 10.261 -2.002 61 HB2 PRO 11 HB2 PRO 11 16.157 11.989 -1.879 62 HB3 PRO 11 HB3 PRO 11 14.540 12.472 -2.407 63 HG2 PRO 11 HG2 PRO 11 15.844 12.817 0.266 64 HG3 PRO 11 HG3 PRO 11 14.861 13.970 -0.657 65 HD2 PRO 11 HD2 PRO 11 13.862 12.527 1.407 66 HD3 PRO 11 HD3 PRO 11 12.877 13.002 0.008 67 H LEU 12 H LEU 12 15.598 10.540 1.145 68 HA LEU 12 HA LEU 12 17.459 8.393 0.367 69 HB2 LEU 12 HB2 LEU 12 18.476 10.696 0.732 70 HB3 LEU 12 HB3 LEU 12 18.064 10.489 2.434 71 HG LEU 12 HG LEU 12 20.444 9.984 1.838 72 HD11 LEU 12 HD11 LEU 12 18.761 8.776 3.637 73 HD12 LEU 12 HD12 LEU 12 20.517 8.627 3.607 74 HD13 LEU 12 HD13 LEU 12 19.516 7.406 2.824 75 HD21 LEU 12 HD21 LEU 12 21.027 8.426 0.336 76 HD22 LEU 12 HD22 LEU 12 19.386 8.632 -0.277 77 HD23 LEU 12 HD23 LEU 12 19.751 7.318 0.842 78 H MET 13 H MET 13 17.100 6.577 1.441 79 HA MET 13 HA MET 13 16.291 6.711 4.253 80 HB2 MET 13 HB2 MET 13 14.572 5.017 3.939 81 HB3 MET 13 HB3 MET 13 14.229 6.421 2.938 82 HG2 MET 13 HG2 MET 13 14.593 5.304 0.993 83 HG3 MET 13 HG3 MET 13 15.763 4.202 1.715 84 HE1 MET 13 HE1 MET 13 15.220 2.743 3.532 85 HE2 MET 13 HE2 MET 13 13.606 2.339 4.118 86 HE3 MET 13 HE3 MET 13 14.354 1.365 2.851 87 H VAL 14 H VAL 14 16.938 4.956 5.509 88 HA VAL 14 HA VAL 14 18.970 3.250 4.243 89 HB VAL 14 HB VAL 14 18.590 3.986 7.149 90 HG11 VAL 14 HG11 VAL 14 20.747 2.819 7.493 91 HG12 VAL 14 HG12 VAL 14 19.442 1.736 7.004 92 HG13 VAL 14 HG13 VAL 14 20.662 2.235 5.831 93 HG21 VAL 14 HG21 VAL 14 20.818 4.706 5.249 94 HG22 VAL 14 HG22 VAL 14 19.478 5.774 5.667 95 HG23 VAL 14 HG23 VAL 14 20.618 5.259 6.911 96 H LYS 15 H LYS 15 18.595 1.151 4.004 97 HA LYS 15 HA LYS 15 16.412 -0.067 5.564 98 HB2 LYS 15 HB2 LYS 15 15.819 -0.038 3.244 99 HB3 LYS 15 HB3 LYS 15 17.397 -0.652 2.772 100 HG2 LYS 15 HG2 LYS 15 15.787 -2.415 2.593 101 HG3 LYS 15 HG3 LYS 15 16.875 -2.771 3.936 102 HD2 LYS 15 HD2 LYS 15 14.485 -1.241 4.677 103 HD3 LYS 15 HD3 LYS 15 14.155 -2.863 4.065 104 HE2 LYS 15 HE2 LYS 15 16.180 -3.418 5.731 105 HE3 LYS 15 HE3 LYS 15 15.519 -2.001 6.545 106 HZ1 LYS 15 HZ1 LYS 15 14.149 -4.553 5.936 107 HZ2 LYS 15 HZ2 LYS 15 13.303 -3.157 6.375 108 HZ3 LYS 15 HZ3 LYS 15 14.413 -3.846 7.450 109 H VAL 16 H VAL 16 17.247 -1.225 7.177 110 HA VAL 16 HA VAL 16 19.518 -3.003 6.575 111 HB VAL 16 HB VAL 16 18.979 -1.571 9.181 112 HG11 VAL 16 HG11 VAL 16 21.067 -2.591 9.950 113 HG12 VAL 16 HG12 VAL 16 19.862 -3.816 9.549 114 HG13 VAL 16 HG13 VAL 16 21.190 -3.486 8.435 115 HG21 VAL 16 HG21 VAL 16 19.926 -0.169 7.362 116 HG22 VAL 16 HG22 VAL 16 21.005 -0.348 8.745 117 HG23 VAL 16 HG23 VAL 16 21.298 -1.275 7.273 118 H LEU 17 H LEU 17 19.001 -5.075 6.736 119 HA LEU 17 HA LEU 17 17.112 -5.926 8.808 120 HB2 LEU 17 HB2 LEU 17 15.746 -7.127 7.376 121 HB3 LEU 17 HB3 LEU 17 16.043 -5.633 6.490 122 HG LEU 17 HG LEU 17 18.036 -7.343 5.602 123 HD11 LEU 17 HD11 LEU 17 17.344 -9.459 5.558 124 HD12 LEU 17 HD12 LEU 17 15.714 -9.001 5.068 125 HD13 LEU 17 HD13 LEU 17 16.157 -8.987 6.775 126 HD21 LEU 17 HD21 LEU 17 16.271 -5.686 4.499 127 HD22 LEU 17 HD22 LEU 17 15.487 -7.213 4.096 128 HD23 LEU 17 HD23 LEU 17 17.139 -6.902 3.562 129 H ASP 18 H ASP 18 17.347 -8.099 9.479 130 HA ASP 18 HA ASP 18 20.042 -9.081 9.249 131 HB2 ASP 18 HB2 ASP 18 17.615 -9.935 10.803 132 HB3 ASP 18 HB3 ASP 18 19.045 -10.960 10.730 133 H ALA 19 H ALA 19 20.775 -10.600 7.913 134 HA ALA 19 HA ALA 19 18.977 -11.803 6.003 135 HB1 ALA 19 HB1 ALA 19 21.355 -10.910 5.572 136 HB2 ALA 19 HB2 ALA 19 21.892 -12.457 6.228 137 HB3 ALA 19 HB3 ALA 19 20.866 -12.415 4.794 138 H VAL 20 H VAL 20 19.690 -12.571 9.086 139 HA VAL 20 HA VAL 20 20.007 -15.438 8.740 140 HB VAL 20 HB VAL 20 19.676 -13.809 11.263 141 HG11 VAL 20 HG11 VAL 20 18.962 -16.013 11.743 142 HG12 VAL 20 HG12 VAL 20 20.279 -16.721 10.806 143 HG13 VAL 20 HG13 VAL 20 20.622 -15.896 12.328 144 HG21 VAL 20 HG21 VAL 20 22.242 -15.097 10.782 145 HG22 VAL 20 HG22 VAL 20 21.840 -13.890 9.561 146 HG23 VAL 20 HG23 VAL 20 21.880 -13.439 11.266 147 H ARG 21 H ARG 21 17.537 -13.131 9.720 148 HA ARG 21 HA ARG 21 15.593 -15.344 9.820 149 HB2 ARG 21 HB2 ARG 21 15.193 -12.680 11.161 150 HB3 ARG 21 HB3 ARG 21 14.350 -14.194 11.461 151 HG2 ARG 21 HG2 ARG 21 15.705 -14.288 13.246 152 HG3 ARG 21 HG3 ARG 21 16.864 -14.926 12.079 153 HD2 ARG 21 HD2 ARG 21 17.830 -12.737 11.777 154 HD3 ARG 21 HD3 ARG 21 16.597 -12.013 12.808 155 HE ARG 21 HE ARG 21 18.961 -13.416 13.653 156 HH11 ARG 21 HH11 ARG 21 15.744 -12.421 14.538 157 HH12 ARG 21 HH12 ARG 21 16.052 -12.487 16.241 158 HH21 ARG 21 HH21 ARG 21 19.378 -13.506 15.894 159 HH22 ARG 21 HH22 ARG 21 18.120 -13.104 17.012 160 H GLY 22 H GLY 22 16.410 -12.254 8.477 161 HA2 GLY 22 HA2 GLY 22 15.591 -11.475 6.406 162 HA3 GLY 22 HA3 GLY 22 14.193 -12.525 6.591 163 H SER 23 H SER 23 14.781 -10.905 9.454 164 HA SER 23 HA SER 23 12.608 -9.026 8.870 165 HB2 SER 23 HB2 SER 23 13.160 -8.921 11.611 166 HB3 SER 23 HB3 SER 23 11.834 -9.787 10.835 167 HG SER 23 HG SER 23 12.776 -11.486 11.633 168 HA PRO 24 HA PRO 24 15.085 -5.421 9.173 169 HB2 PRO 24 HB2 PRO 24 13.527 -3.737 10.623 170 HB3 PRO 24 HB3 PRO 24 13.161 -4.185 8.953 171 HG2 PRO 24 HG2 PRO 24 12.018 -5.270 11.498 172 HG3 PRO 24 HG3 PRO 24 11.187 -4.844 9.991 173 HD2 PRO 24 HD2 PRO 24 11.809 -7.398 10.641 174 HD3 PRO 24 HD3 PRO 24 11.774 -6.821 8.962 175 H ALA 25 H ALA 25 16.494 -4.253 10.496 176 HA ALA 25 HA ALA 25 16.876 -5.402 13.164 177 HB1 ALA 25 HB1 ALA 25 18.776 -5.469 11.613 178 HB2 ALA 25 HB2 ALA 25 18.755 -3.707 11.521 179 HB3 ALA 25 HB3 ALA 25 19.131 -4.506 13.048 180 H ILE 26 H ILE 26 16.733 -4.233 15.002 181 HA ILE 26 HA ILE 26 15.885 -1.432 14.732 182 HB ILE 26 HB ILE 26 15.189 -3.595 16.641 183 HG12 ILE 26 HG12 ILE 26 13.791 -2.490 14.711 184 HG13 ILE 26 HG13 ILE 26 13.014 -2.916 16.233 185 HG21 ILE 26 HG21 ILE 26 14.400 -1.821 18.271 186 HG22 ILE 26 HG22 ILE 26 16.135 -2.127 18.225 187 HG23 ILE 26 HG23 ILE 26 15.469 -0.706 17.422 188 HD11 ILE 26 HD11 ILE 26 12.336 -0.713 15.430 189 HD12 ILE 26 HD12 ILE 26 13.174 -0.616 16.978 190 HD13 ILE 26 HD13 ILE 26 14.015 -0.176 15.491 191 H ASN 27 H ASN 27 16.903 0.192 15.824 192 HA ASN 27 HA ASN 27 18.556 1.306 16.919 193 HB2 ASN 27 HB2 ASN 27 18.958 -1.273 18.448 194 HB3 ASN 27 HB3 ASN 27 19.470 0.338 18.945 195 HD21 ASN 27 HD21 ASN 27 17.140 1.724 18.161 196 HD22 ASN 27 HD22 ASN 27 15.867 1.267 19.235 197 H VAL 28 H VAL 28 19.401 0.717 14.566 198 HA VAL 28 HA VAL 28 22.032 -0.575 14.884 199 HB VAL 28 HB VAL 28 20.358 -0.311 12.383 200 HG11 VAL 28 HG11 VAL 28 22.163 -1.807 11.422 201 HG12 VAL 28 HG12 VAL 28 22.612 -0.123 11.701 202 HG13 VAL 28 HG13 VAL 28 23.135 -1.375 12.829 203 HG21 VAL 28 HG21 VAL 28 19.389 -2.063 13.518 204 HG22 VAL 28 HG22 VAL 28 20.627 -2.905 12.587 205 HG23 VAL 28 HG23 VAL 28 20.900 -2.542 14.290 206 H ALA 29 H ALA 29 23.558 0.925 15.095 207 HA ALA 29 HA ALA 29 23.364 3.612 14.410 208 HB1 ALA 29 HB1 ALA 29 26.059 3.143 14.299 209 HB2 ALA 29 HB2 ALA 29 25.135 3.464 15.767 210 HB3 ALA 29 HB3 ALA 29 25.479 1.801 15.288 211 H VAL 30 H VAL 30 23.596 4.732 12.576 212 HA VAL 30 HA VAL 30 24.936 3.483 10.288 213 HB VAL 30 HB VAL 30 22.224 4.802 10.111 214 HG11 VAL 30 HG11 VAL 30 24.273 4.366 8.163 215 HG12 VAL 30 HG12 VAL 30 22.862 3.383 7.765 216 HG13 VAL 30 HG13 VAL 30 22.696 5.128 7.967 217 HG21 VAL 30 HG21 VAL 30 23.078 2.004 10.408 218 HG22 VAL 30 HG22 VAL 30 21.539 2.770 10.803 219 HG23 VAL 30 HG23 VAL 30 21.888 2.300 9.139 220 H HIS 31 H HIS 31 26.245 4.839 9.230 221 HA HIS 31 HA HIS 31 25.885 7.733 9.643 222 HB2 HIS 31 HB2 HIS 31 28.589 6.427 9.389 223 HB3 HIS 31 HB3 HIS 31 28.213 8.057 9.939 224 HD1 HIS 31 HD1 HIS 31 27.879 4.461 11.076 225 HD2 HIS 31 HD2 HIS 31 27.892 8.310 12.640 226 HE1 HIS 31 HE1 HIS 31 27.884 4.171 13.575 227 H VAL 32 H VAL 32 25.518 8.739 7.790 228 HA VAL 32 HA VAL 32 26.394 7.496 5.285 229 HB VAL 32 HB VAL 32 24.533 9.850 5.565 230 HG11 VAL 32 HG11 VAL 32 24.715 9.856 3.347 231 HG12 VAL 32 HG12 VAL 32 25.640 8.353 3.358 232 HG13 VAL 32 HG13 VAL 32 23.877 8.305 3.345 233 HG21 VAL 32 HG21 VAL 32 22.764 8.008 5.125 234 HG22 VAL 32 HG22 VAL 32 23.982 6.916 5.785 235 HG23 VAL 32 HG23 VAL 32 23.365 8.246 6.767 236 H PHE 33 H PHE 33 27.832 8.427 3.935 237 HA PHE 33 HA PHE 33 28.759 11.147 4.551 238 HB2 PHE 33 HB2 PHE 33 30.422 8.665 4.192 239 HB3 PHE 33 HB3 PHE 33 31.092 10.266 3.900 240 HD1 PHE 33 HD1 PHE 33 29.382 8.221 6.485 241 HD2 PHE 33 HD2 PHE 33 31.939 11.522 5.659 242 HE1 PHE 33 HE1 PHE 33 29.850 8.454 8.889 243 HE2 PHE 33 HE2 PHE 33 32.413 11.761 8.062 244 HZ PHE 33 HZ PHE 33 31.366 10.227 9.680 245 H ARG 34 H ARG 34 30.061 12.087 2.736 246 HA ARG 34 HA ARG 34 29.168 11.060 0.126 247 HB2 ARG 34 HB2 ARG 34 27.809 13.011 0.806 248 HB3 ARG 34 HB3 ARG 34 29.279 13.965 0.954 249 HG2 ARG 34 HG2 ARG 34 28.945 12.659 -1.644 250 HG3 ARG 34 HG3 ARG 34 27.707 13.855 -1.255 251 HD2 ARG 34 HD2 ARG 34 29.603 15.421 -0.655 252 HD3 ARG 34 HD3 ARG 34 30.687 14.243 -1.394 253 HE ARG 34 HE ARG 34 29.046 16.122 -2.747 254 HH11 ARG 34 HH11 ARG 34 30.308 12.885 -2.970 255 HH12 ARG 34 HH12 ARG 34 30.252 12.843 -4.702 256 HH21 ARG 34 HH21 ARG 34 28.969 16.079 -5.027 257 HH22 ARG 34 HH22 ARG 34 29.491 14.662 -5.870 258 H LYS 35 H LYS 35 30.534 11.535 -1.658 259 HA LYS 35 HA LYS 35 33.312 11.469 -1.015 260 HB2 LYS 35 HB2 LYS 35 32.779 10.226 -2.910 261 HB3 LYS 35 HB3 LYS 35 31.723 11.475 -3.555 262 HG2 LYS 35 HG2 LYS 35 33.730 11.303 -4.886 263 HG3 LYS 35 HG3 LYS 35 33.683 12.860 -4.057 264 HD2 LYS 35 HD2 LYS 35 35.906 12.028 -3.868 265 HD3 LYS 35 HD3 LYS 35 35.147 11.852 -2.284 266 HE2 LYS 35 HE2 LYS 35 35.921 9.749 -2.386 267 HE3 LYS 35 HE3 LYS 35 34.538 9.468 -3.444 268 HZ1 LYS 35 HZ1 LYS 35 37.151 9.051 -4.082 269 HZ2 LYS 35 HZ2 LYS 35 36.802 10.518 -4.846 270 HZ3 LYS 35 HZ3 LYS 35 35.868 9.148 -5.180 271 H ALA 36 H ALA 36 34.319 13.240 -0.310 272 HA ALA 36 HA ALA 36 33.516 15.888 -0.996 273 HB1 ALA 36 HB1 ALA 36 34.941 16.565 0.617 274 HB2 ALA 36 HB2 ALA 36 34.900 14.860 1.066 275 HB3 ALA 36 HB3 ALA 36 36.229 15.482 0.087 276 H ALA 37 H ALA 37 34.794 17.476 -2.110 277 HA ALA 37 HA ALA 37 35.672 16.671 -4.636 278 HB1 ALA 37 HB1 ALA 37 36.567 19.229 -3.348 279 HB2 ALA 37 HB2 ALA 37 36.193 18.913 -5.043 280 HB3 ALA 37 HB3 ALA 37 34.895 18.981 -3.852 281 H ASP 38 H ASP 38 37.318 16.736 -1.624 282 HA ASP 38 HA ASP 38 39.956 16.651 -2.868 283 HB2 ASP 38 HB2 ASP 38 38.913 17.139 -0.149 284 HB3 ASP 38 HB3 ASP 38 40.427 16.242 -0.221 285 H ASP 39 H ASP 39 37.760 14.493 -2.920 286 HA ASP 39 HA ASP 39 37.699 12.221 -3.035 287 HB2 ASP 39 HB2 ASP 39 40.643 12.077 -2.471 288 HB3 ASP 39 HB3 ASP 39 39.663 11.063 -3.527 289 H THR 40 H THR 40 37.241 13.516 -0.545 290 HA THR 40 HA THR 40 38.195 11.455 1.336 291 HB THR 40 HB THR 40 38.188 13.012 3.113 292 HG1 THR 40 HG1 THR 40 37.261 15.052 2.943 293 HG21 THR 40 HG21 THR 40 39.254 14.446 0.676 294 HG22 THR 40 HG22 THR 40 40.123 13.250 1.637 295 HG23 THR 40 HG23 THR 40 39.682 14.803 2.348 296 H TRP 41 H TRP 41 36.616 11.581 3.394 297 HA TRP 41 HA TRP 41 33.926 11.118 2.303 298 HB2 TRP 41 HB2 TRP 41 35.395 9.957 4.660 299 HB3 TRP 41 HB3 TRP 41 33.644 9.833 4.520 300 HD1 TRP 41 HD1 TRP 41 35.644 9.546 1.316 301 HE1 TRP 41 HE1 TRP 41 35.558 7.114 0.480 302 HE3 TRP 41 HE3 TRP 41 33.473 7.365 5.397 303 HZ2 TRP 41 HZ2 TRP 41 34.683 4.602 1.427 304 HZ3 TRP 41 HZ3 TRP 41 33.044 4.942 5.352 305 HH2 TRP 41 HH2 TRP 41 33.637 3.591 3.406 306 H GLU 42 H GLU 42 32.705 12.883 2.551 307 HA GLU 42 HA GLU 42 32.996 14.537 4.936 308 HB2 GLU 42 HB2 GLU 42 31.518 14.886 2.336 309 HB3 GLU 42 HB3 GLU 42 31.254 15.961 3.702 310 HG2 GLU 42 HG2 GLU 42 34.038 15.493 2.771 311 HG3 GLU 42 HG3 GLU 42 32.987 16.543 1.824 312 HA PRO 43 HA PRO 43 29.502 12.904 7.038 313 HB2 PRO 43 HB2 PRO 43 28.687 15.102 8.408 314 HB3 PRO 43 HB3 PRO 43 30.145 14.194 8.827 315 HG2 PRO 43 HG2 PRO 43 29.878 16.732 7.262 316 HG3 PRO 43 HG3 PRO 43 31.059 16.309 8.514 317 HD2 PRO 43 HD2 PRO 43 31.637 16.202 5.871 318 HD3 PRO 43 HD3 PRO 43 32.362 15.093 7.052 319 H PHE 44 H PHE 44 27.701 12.385 5.966 320 HA PHE 44 HA PHE 44 26.161 14.510 4.648 321 HB2 PHE 44 HB2 PHE 44 26.882 12.576 3.259 322 HB3 PHE 44 HB3 PHE 44 25.938 11.514 4.299 323 HD1 PHE 44 HD2 PHE 44 23.435 11.901 4.442 324 HD2 PHE 44 HD1 PHE 44 25.896 13.667 1.453 325 HE1 PHE 44 HE2 PHE 44 21.448 12.301 3.047 326 HE2 PHE 44 HE1 PHE 44 23.914 14.071 0.054 327 HZ PHE 44 HZ PHE 44 21.685 13.388 0.851 328 H ALA 45 H ALA 45 25.875 11.823 6.917 329 HA ALA 45 HA ALA 45 23.893 13.053 8.467 330 HB1 ALA 45 HB1 ALA 45 22.277 12.764 6.818 331 HB2 ALA 45 HB2 ALA 45 22.893 11.177 6.356 332 HB3 ALA 45 HB3 ALA 45 22.030 11.378 7.881 333 H SER 46 H SER 46 22.737 11.307 9.899 334 HA SER 46 HA SER 46 24.009 8.796 10.244 335 HB2 SER 46 HB2 SER 46 25.897 9.685 11.203 336 HB3 SER 46 HB3 SER 46 25.059 11.127 11.775 337 HG SER 46 HG SER 46 25.543 9.844 13.537 338 H GLY 47 H GLY 47 22.972 7.513 11.773 339 HA2 GLY 47 HA2 GLY 47 21.292 8.415 13.821 340 HA3 GLY 47 HA3 GLY 47 20.306 8.198 12.383 341 H LYS 48 H LYS 48 19.145 6.544 13.473 342 HA LYS 48 HA LYS 48 20.555 3.968 13.430 343 HB2 LYS 48 HB2 LYS 48 19.111 5.224 15.689 344 HB3 LYS 48 HB3 LYS 48 18.780 3.519 15.415 345 HG2 LYS 48 HG2 LYS 48 21.180 3.040 15.557 346 HG3 LYS 48 HG3 LYS 48 21.492 4.750 15.867 347 HD2 LYS 48 HD2 LYS 48 19.785 2.952 17.589 348 HD3 LYS 48 HD3 LYS 48 21.456 3.403 17.933 349 HE2 LYS 48 HE2 LYS 48 20.256 5.832 17.510 350 HE3 LYS 48 HE3 LYS 48 18.982 4.913 18.310 351 HZ1 LYS 48 HZ1 LYS 48 21.703 5.504 19.318 352 HZ2 LYS 48 HZ2 LYS 48 20.715 4.323 20.016 353 HZ3 LYS 48 HZ3 LYS 48 20.220 5.940 20.005 354 H THR 49 H THR 49 19.468 2.347 12.464 355 HA THR 49 HA THR 49 17.235 2.879 10.861 356 HB THR 49 HB THR 49 17.175 0.532 10.347 357 HG1 THR 49 HG1 THR 49 18.141 -0.994 11.635 358 HG21 THR 49 HG21 THR 49 19.988 0.363 10.570 359 HG22 THR 49 HG22 THR 49 19.589 2.063 10.318 360 HG23 THR 49 HG23 THR 49 19.036 0.848 9.167 361 H SER 50 H SER 50 15.201 1.453 10.957 362 HA SER 50 HA SER 50 14.204 1.326 13.726 363 HB2 SER 50 HB2 SER 50 12.674 2.312 11.305 364 HB3 SER 50 HB3 SER 50 12.025 2.151 12.938 365 HG SER 50 HG SER 50 14.189 3.826 12.174 366 H GLU 51 H GLU 51 11.999 0.095 13.724 367 HA GLU 51 HA GLU 51 12.546 -2.546 12.836 368 HB2 GLU 51 HB2 GLU 51 10.183 -2.985 13.650 369 HB3 GLU 51 HB3 GLU 51 11.307 -2.343 14.840 370 HG2 GLU 51 HG2 GLU 51 9.987 -0.616 15.229 371 HG3 GLU 51 HG3 GLU 51 9.979 -0.183 13.520 372 H SER 52 H SER 52 11.363 0.104 11.205 373 HA SER 52 HA SER 52 9.729 -1.502 9.370 374 HB2 SER 52 HB2 SER 52 8.617 0.500 10.136 375 HB3 SER 52 HB3 SER 52 10.007 1.493 9.700 376 HG SER 52 HG SER 52 7.986 0.491 8.122 377 H GLY 53 H GLY 53 12.858 -0.750 9.710 378 HA2 GLY 53 HA2 GLY 53 14.636 -0.892 8.256 379 HA3 GLY 53 HA3 GLY 53 13.492 -1.319 6.992 380 H GLU 54 H GLU 54 13.051 1.625 8.766 381 HA GLU 54 HA GLU 54 14.186 3.162 6.529 382 HB2 GLU 54 HB2 GLU 54 12.269 4.717 6.676 383 HB3 GLU 54 HB3 GLU 54 11.790 3.098 6.185 384 HG2 GLU 54 HG2 GLU 54 11.315 2.751 8.712 385 HG3 GLU 54 HG3 GLU 54 11.298 4.513 8.765 386 H LEU 55 H LEU 55 14.952 5.242 7.041 387 HA LEU 55 HA LEU 55 15.187 5.816 9.918 388 HB2 LEU 55 HB2 LEU 55 17.252 5.092 8.166 389 HB3 LEU 55 HB3 LEU 55 17.425 6.827 8.418 390 HG LEU 55 HG LEU 55 17.215 4.883 10.704 391 HD11 LEU 55 HD11 LEU 55 19.429 4.421 10.665 392 HD12 LEU 55 HD12 LEU 55 19.855 5.963 9.925 393 HD13 LEU 55 HD13 LEU 55 19.203 4.659 8.932 394 HD21 LEU 55 HD21 LEU 55 18.810 7.209 11.161 395 HD22 LEU 55 HD22 LEU 55 17.321 6.707 11.963 396 HD23 LEU 55 HD23 LEU 55 17.249 7.695 10.502 397 H HIS 56 H HIS 56 14.095 7.619 10.312 398 HA HIS 56 HA HIS 56 13.902 9.682 8.249 399 HB2 HIS 56 HB2 HIS 56 12.197 10.681 9.797 400 HB3 HIS 56 HB3 HIS 56 11.793 9.068 9.217 401 HD1 HIS 56 HD1 HIS 56 11.876 7.132 10.953 402 HD2 HIS 56 HD2 HIS 56 12.607 10.900 12.541 403 HE1 HIS 56 HE1 HIS 56 11.692 6.858 13.446 404 H GLY 57 H GLY 57 15.315 11.294 8.257 405 HA2 GLY 57 HA2 GLY 57 15.901 13.268 9.777 406 HA3 GLY 57 HA3 GLY 57 16.593 12.026 10.811 407 H LEU 58 H LEU 58 17.269 10.680 8.059 408 HA LEU 58 HA LEU 58 19.920 11.874 7.921 409 HB2 LEU 58 HB2 LEU 58 18.895 9.488 6.402 410 HB3 LEU 58 HB3 LEU 58 20.574 9.939 6.697 411 HG LEU 58 HG LEU 58 18.592 8.836 8.680 412 HD11 LEU 58 HD11 LEU 58 19.453 6.902 8.010 413 HD12 LEU 58 HD12 LEU 58 20.983 7.416 8.721 414 HD13 LEU 58 HD13 LEU 58 20.661 7.711 7.012 415 HD21 LEU 58 HD21 LEU 58 20.489 8.965 10.294 416 HD22 LEU 58 HD22 LEU 58 19.827 10.533 9.830 417 HD23 LEU 58 HD23 LEU 58 21.346 9.975 9.129 418 H THR 59 H THR 59 17.207 12.835 6.664 419 HA THR 59 HA THR 59 18.176 13.169 3.910 420 HB THR 59 HB THR 59 15.891 13.862 3.343 421 HG1 THR 59 HG1 THR 59 14.564 14.419 4.886 422 HG21 THR 59 HG21 THR 59 16.648 11.252 4.326 423 HG22 THR 59 HG22 THR 59 15.662 11.682 2.928 424 HG23 THR 59 HG23 THR 59 14.917 11.526 4.518 425 H THR 60 H THR 60 19.018 15.050 3.317 426 HA THR 60 HA THR 60 18.040 17.539 4.445 427 HB THR 60 HB THR 60 20.366 18.335 4.959 428 HG1 THR 60 HG1 THR 60 20.889 15.656 4.311 429 HG21 THR 60 HG21 THR 60 20.392 17.451 7.160 430 HG22 THR 60 HG22 THR 60 19.590 15.966 6.651 431 HG23 THR 60 HG23 THR 60 18.699 17.487 6.672 432 H GLU 61 H GLU 61 19.587 19.389 3.475 433 HA GLU 61 HA GLU 61 19.169 19.317 0.685 434 HB2 GLU 61 HB2 GLU 61 20.420 21.461 0.663 435 HB3 GLU 61 HB3 GLU 61 19.136 21.422 1.863 436 HG2 GLU 61 HG2 GLU 61 20.690 21.121 3.635 437 HG3 GLU 61 HG3 GLU 61 22.017 20.857 2.506 438 H GLU 62 H GLU 62 21.697 18.135 2.627 439 HA GLU 62 HA GLU 62 23.919 18.433 0.949 440 HB2 GLU 62 HB2 GLU 62 23.182 16.713 3.228 441 HB3 GLU 62 HB3 GLU 62 24.412 16.047 2.163 442 HG2 GLU 62 HG2 GLU 62 25.603 18.287 2.423 443 HG3 GLU 62 HG3 GLU 62 24.499 18.576 3.767 444 H GLU 63 H GLU 63 21.126 16.483 0.629 445 HA GLU 63 HA GLU 63 22.190 14.368 -0.918 446 HB2 GLU 63 HB2 GLU 63 19.922 13.835 -1.476 447 HB3 GLU 63 HB3 GLU 63 19.951 14.365 0.200 448 HG2 GLU 63 HG2 GLU 63 19.227 16.619 -0.574 449 HG3 GLU 63 HG3 GLU 63 19.035 15.941 -2.190 450 H PHE 64 H PHE 64 21.719 17.648 -1.609 451 HA PHE 64 HA PHE 64 21.258 17.373 -4.434 452 HB2 PHE 64 HB2 PHE 64 21.826 19.675 -2.595 453 HB3 PHE 64 HB3 PHE 64 21.926 19.894 -4.338 454 HD1 PHE 64 HD1 PHE 64 19.789 18.710 -5.573 455 HD2 PHE 64 HD2 PHE 64 19.865 20.363 -1.652 456 HE1 PHE 64 HE1 PHE 64 17.354 19.042 -5.670 457 HE2 PHE 64 HE2 PHE 64 17.430 20.698 -1.742 458 HZ PHE 64 HZ PHE 64 16.170 20.039 -3.753 459 H VAL 65 H VAL 65 23.249 15.779 -4.268 460 HA VAL 65 HA VAL 65 25.594 17.309 -5.183 461 HB VAL 65 HB VAL 65 27.043 15.516 -4.241 462 HG11 VAL 65 HG11 VAL 65 26.889 16.282 -1.905 463 HG12 VAL 65 HG12 VAL 65 26.784 17.615 -3.056 464 HG13 VAL 65 HG13 VAL 65 25.326 17.014 -2.265 465 HG21 VAL 65 HG21 VAL 65 24.802 14.040 -4.029 466 HG22 VAL 65 HG22 VAL 65 26.266 13.733 -3.094 467 HG23 VAL 65 HG23 VAL 65 24.934 14.640 -2.375 468 H GLU 66 H GLU 66 27.204 15.491 -6.174 469 HA GLU 66 HA GLU 66 26.189 14.796 -8.635 470 HB2 GLU 66 HB2 GLU 66 28.434 13.484 -7.094 471 HB3 GLU 66 HB3 GLU 66 28.117 13.218 -8.803 472 HG2 GLU 66 HG2 GLU 66 28.456 16.013 -7.880 473 HG3 GLU 66 HG3 GLU 66 29.886 14.986 -7.954 474 H GLY 67 H GLY 67 26.637 12.619 -5.843 475 HA2 GLY 67 HA2 GLY 67 24.353 11.272 -5.720 476 HA3 GLY 67 HA3 GLY 67 25.043 10.572 -7.176 477 H ILE 68 H ILE 68 27.755 11.124 -5.733 478 HA ILE 68 HA ILE 68 28.165 8.475 -4.860 479 HB ILE 68 HB ILE 68 29.855 10.891 -4.210 480 HG12 ILE 68 HG12 ILE 68 30.183 8.970 -6.518 481 HG13 ILE 68 HG13 ILE 68 29.367 10.522 -6.664 482 HG21 ILE 68 HG21 ILE 68 30.202 7.966 -3.885 483 HG22 ILE 68 HG22 ILE 68 31.608 8.903 -4.388 484 HG23 ILE 68 HG23 ILE 68 30.780 9.295 -2.881 485 HD11 ILE 68 HD11 ILE 68 31.432 11.148 -7.332 486 HD12 ILE 68 HD12 ILE 68 31.647 11.367 -5.594 487 HD13 ILE 68 HD13 ILE 68 32.241 9.903 -6.379 488 H TYR 69 H TYR 69 27.550 7.546 -3.033 489 HA TYR 69 HA TYR 69 27.552 9.112 -0.556 490 HB2 TYR 69 HB2 TYR 69 25.256 7.357 -1.456 491 HB3 TYR 69 HB3 TYR 69 25.383 8.151 0.110 492 HD1 TYR 69 HD2 TYR 69 26.118 10.829 -0.357 493 HD2 TYR 69 HD1 TYR 69 23.659 8.346 -2.783 494 HE1 TYR 69 HE2 TYR 69 25.019 12.828 -1.278 495 HE2 TYR 69 HE1 TYR 69 22.553 10.337 -3.711 496 HH TYR 69 HH TYR 69 22.533 12.561 -3.796 497 H LYS 70 H LYS 70 28.433 8.059 1.111 498 HA LYS 70 HA LYS 70 28.772 5.140 0.890 499 HB2 LYS 70 HB2 LYS 70 30.928 5.500 2.179 500 HB3 LYS 70 HB3 LYS 70 30.927 6.040 0.506 501 HG2 LYS 70 HG2 LYS 70 30.081 8.241 2.011 502 HG3 LYS 70 HG3 LYS 70 31.429 7.532 2.902 503 HD2 LYS 70 HD2 LYS 70 32.257 9.184 1.338 504 HD3 LYS 70 HD3 LYS 70 32.779 7.573 0.838 505 HE2 LYS 70 HE2 LYS 70 30.214 8.396 -0.299 506 HE3 LYS 70 HE3 LYS 70 31.564 9.427 -0.772 507 HZ1 LYS 70 HZ1 LYS 70 30.900 7.066 -1.928 508 HZ2 LYS 70 HZ2 LYS 70 32.177 6.626 -0.910 509 HZ3 LYS 70 HZ3 LYS 70 32.400 7.838 -2.069 510 H VAL 71 H VAL 71 27.323 4.357 2.303 511 HA VAL 71 HA VAL 71 27.064 5.628 4.934 512 HB VAL 71 HB VAL 71 25.344 3.502 3.647 513 HG11 VAL 71 HG11 VAL 71 25.332 3.326 6.071 514 HG12 VAL 71 HG12 VAL 71 24.966 5.047 6.210 515 HG13 VAL 71 HG13 VAL 71 23.788 3.949 5.491 516 HG21 VAL 71 HG21 VAL 71 23.890 5.859 4.095 517 HG22 VAL 71 HG22 VAL 71 25.412 6.359 3.355 518 HG23 VAL 71 HG23 VAL 71 24.382 5.177 2.545 519 H GLU 72 H GLU 72 27.377 4.510 6.843 520 HA GLU 72 HA GLU 72 28.608 1.845 6.599 521 HB2 GLU 72 HB2 GLU 72 30.352 2.395 8.003 522 HB3 GLU 72 HB3 GLU 72 30.127 3.911 7.143 523 HG2 GLU 72 HG2 GLU 72 28.535 4.468 9.136 524 HG3 GLU 72 HG3 GLU 72 29.460 3.213 9.959 525 H ILE 73 H ILE 73 27.997 0.321 8.060 526 HA ILE 73 HA ILE 73 25.978 1.137 10.046 527 HB ILE 73 HB ILE 73 26.214 -1.498 8.589 528 HG12 ILE 73 HG12 ILE 73 23.700 -0.069 8.350 529 HG13 ILE 73 HG13 ILE 73 25.047 0.910 7.779 530 HG21 ILE 73 HG21 ILE 73 23.744 -1.338 9.871 531 HG22 ILE 73 HG22 ILE 73 25.106 -2.368 10.309 532 HG23 ILE 73 HG23 ILE 73 24.919 -0.786 11.065 533 HD11 ILE 73 HD11 ILE 73 24.593 -1.911 6.867 534 HD12 ILE 73 HD12 ILE 73 23.887 -0.511 6.058 535 HD13 ILE 73 HD13 ILE 73 25.640 -0.685 6.153 536 H ASP 74 H ASP 74 26.283 0.598 12.125 537 HA ASP 74 HA ASP 74 28.689 -0.963 12.773 538 HB2 ASP 74 HB2 ASP 74 27.390 1.392 13.969 539 HB3 ASP 74 HB3 ASP 74 27.929 0.186 15.134 540 H THR 75 H THR 75 27.386 -2.913 12.319 541 HA THR 75 HA THR 75 25.492 -3.574 14.465 542 HB THR 75 HB THR 75 24.500 -3.976 12.345 543 HG1 THR 75 HG1 THR 75 24.498 -6.407 12.366 544 HG21 THR 75 HG21 THR 75 26.153 -4.013 10.740 545 HG22 THR 75 HG22 THR 75 25.733 -5.724 10.821 546 HG23 THR 75 HG23 THR 75 27.165 -5.127 11.657 547 H LYS 76 H LYS 76 28.688 -3.860 13.845 548 HA LYS 76 HA LYS 76 29.199 -6.586 14.456 549 HB2 LYS 76 HB2 LYS 76 31.525 -5.801 14.879 550 HB3 LYS 76 HB3 LYS 76 30.883 -5.293 13.322 551 HG2 LYS 76 HG2 LYS 76 31.694 -3.292 13.912 552 HG3 LYS 76 HG3 LYS 76 30.207 -3.172 14.856 553 HD2 LYS 76 HD2 LYS 76 31.742 -2.668 16.475 554 HD3 LYS 76 HD3 LYS 76 31.665 -4.421 16.668 555 HE2 LYS 76 HE2 LYS 76 33.923 -4.184 16.557 556 HE3 LYS 76 HE3 LYS 76 33.584 -4.314 14.833 557 HZ1 LYS 76 HZ1 LYS 76 33.929 -2.085 14.503 558 HZ2 LYS 76 HZ2 LYS 76 35.062 -2.398 15.718 559 HZ3 LYS 76 HZ3 LYS 76 33.588 -1.665 16.106 560 H SER 77 H SER 77 29.132 -3.627 16.407 561 HA SER 77 HA SER 77 29.652 -5.140 18.836 562 HB2 SER 77 HB2 SER 77 29.196 -2.680 19.776 563 HB3 SER 77 HB3 SER 77 30.745 -3.136 19.066 564 HG SER 77 HG SER 77 30.371 -1.540 17.755 565 H TYR 78 H TYR 78 27.049 -3.205 17.406 566 HA TYR 78 HA TYR 78 25.217 -3.266 19.472 567 HB2 TYR 78 HB2 TYR 78 25.123 -2.861 16.578 568 HB3 TYR 78 HB3 TYR 78 23.632 -3.537 17.226 569 HD1 TYR 78 HD2 TYR 78 22.453 -2.304 19.088 570 HD2 TYR 78 HD1 TYR 78 25.650 -0.581 16.871 571 HE1 TYR 78 HE2 TYR 78 21.760 -0.066 19.837 572 HE2 TYR 78 HE1 TYR 78 24.966 1.660 17.615 573 HH TYR 78 HH TYR 78 22.898 2.206 20.147 574 H TRP 79 H TRP 79 26.214 -5.818 17.351 575 HA TRP 79 HA TRP 79 23.988 -7.539 17.745 576 HB2 TRP 79 HB2 TRP 79 26.568 -7.652 16.409 577 HB3 TRP 79 HB3 TRP 79 26.177 -9.175 17.203 578 HD1 TRP 79 HD1 TRP 79 25.609 -10.569 15.068 579 HE1 TRP 79 HE1 TRP 79 23.741 -10.446 13.300 580 HE3 TRP 79 HE3 TRP 79 23.664 -5.994 16.259 581 HZ2 TRP 79 HZ2 TRP 79 21.713 -8.647 12.514 582 HZ3 TRP 79 HZ3 TRP 79 21.761 -5.144 14.950 583 HH2 TRP 79 HH2 TRP 79 20.808 -6.445 13.116 584 H LYS 80 H LYS 80 27.028 -7.046 19.435 585 HA LYS 80 HA LYS 80 26.830 -9.336 21.111 586 HB2 LYS 80 HB2 LYS 80 28.749 -8.563 22.159 587 HB3 LYS 80 HB3 LYS 80 28.888 -7.836 20.564 588 HG2 LYS 80 HG2 LYS 80 29.232 -5.924 21.648 589 HG3 LYS 80 HG3 LYS 80 27.495 -5.935 21.963 590 HD2 LYS 80 HD2 LYS 80 28.400 -5.636 24.080 591 HD3 LYS 80 HD3 LYS 80 28.121 -7.377 24.020 592 HE2 LYS 80 HE2 LYS 80 30.338 -7.868 23.973 593 HE3 LYS 80 HE3 LYS 80 30.752 -6.411 23.070 594 HZ1 LYS 80 HZ1 LYS 80 30.670 -5.117 25.017 595 HZ2 LYS 80 HZ2 LYS 80 31.546 -6.503 25.435 596 HZ3 LYS 80 HZ3 LYS 80 29.931 -6.346 25.916 597 H ALA 81 H ALA 81 25.259 -6.313 21.096 598 HA ALA 81 HA ALA 81 24.753 -6.109 23.904 599 HB1 ALA 81 HB1 ALA 81 24.093 -4.072 23.326 600 HB2 ALA 81 HB2 ALA 81 24.350 -4.490 21.632 601 HB3 ALA 81 HB3 ALA 81 22.768 -4.740 22.371 602 H LEU 82 H LEU 82 22.957 -7.358 21.122 603 HA LEU 82 HA LEU 82 20.761 -8.193 22.847 604 HB2 LEU 82 HB2 LEU 82 21.129 -8.447 19.866 605 HB3 LEU 82 HB3 LEU 82 19.672 -8.881 20.756 606 HG LEU 82 HG LEU 82 19.151 -6.817 19.829 607 HD11 LEU 82 HD11 LEU 82 20.291 -5.897 22.445 608 HD12 LEU 82 HD12 LEU 82 18.918 -7.001 22.373 609 HD13 LEU 82 HD13 LEU 82 18.800 -5.398 21.646 610 HD21 LEU 82 HD21 LEU 82 21.753 -5.613 20.726 611 HD22 LEU 82 HD22 LEU 82 20.596 -4.990 19.548 612 HD23 LEU 82 HD23 LEU 82 21.577 -6.405 19.160 613 H GLY 83 H GLY 83 23.616 -9.391 22.620 614 HA2 GLY 83 HA2 GLY 83 24.538 -11.476 22.887 615 HA3 GLY 83 HA3 GLY 83 22.916 -12.032 23.274 616 H ILE 84 H ILE 84 24.008 -10.619 20.227 617 HA ILE 84 HA ILE 84 23.019 -12.976 18.830 618 HB ILE 84 HB ILE 84 24.139 -10.475 17.578 619 HG12 ILE 84 HG12 ILE 84 22.314 -9.880 19.126 620 HG13 ILE 84 HG13 ILE 84 21.847 -9.633 17.446 621 HG21 ILE 84 HG21 ILE 84 22.476 -12.774 16.613 622 HG22 ILE 84 HG22 ILE 84 22.472 -11.224 15.773 623 HG23 ILE 84 HG23 ILE 84 23.976 -12.131 15.945 624 HD11 ILE 84 HD11 ILE 84 21.167 -12.273 18.494 625 HD12 ILE 84 HD12 ILE 84 20.364 -10.933 19.313 626 HD13 ILE 84 HD13 ILE 84 20.197 -11.128 17.569 627 H SER 85 H SER 85 24.264 -14.038 17.184 628 HA SER 85 HA SER 85 26.737 -14.941 17.961 629 HB2 SER 85 HB2 SER 85 25.285 -14.909 15.353 630 HB3 SER 85 HB3 SER 85 26.983 -15.385 15.352 631 HG SER 85 HG SER 85 24.976 -16.917 15.898 632 HA PRO 86 HA PRO 86 29.772 -11.937 16.962 633 HB2 PRO 86 HB2 PRO 86 31.810 -13.462 16.017 634 HB3 PRO 86 HB3 PRO 86 31.352 -13.422 17.724 635 HG2 PRO 86 HG2 PRO 86 30.657 -15.440 15.624 636 HG3 PRO 86 HG3 PRO 86 31.156 -15.701 17.305 637 HD2 PRO 86 HD2 PRO 86 28.569 -15.829 16.516 638 HD3 PRO 86 HD3 PRO 86 29.049 -15.266 18.130 639 H MET 87 H MET 87 30.150 -10.566 15.325 640 HA MET 87 HA MET 87 30.624 -11.431 12.643 641 HB2 MET 87 HB2 MET 87 27.910 -10.803 13.448 642 HB3 MET 87 HB3 MET 87 28.464 -9.728 12.171 643 HG2 MET 87 HG2 MET 87 28.860 -12.672 11.909 644 HG3 MET 87 HG3 MET 87 27.282 -11.961 11.579 645 HE1 MET 87 HE1 MET 87 31.268 -11.260 9.721 646 HE2 MET 87 HE2 MET 87 30.755 -12.462 10.905 647 HE3 MET 87 HE3 MET 87 30.591 -12.797 9.181 648 H HIS 88 H HIS 88 32.496 -10.174 13.009 649 HA HIS 88 HA HIS 88 32.112 -7.292 13.338 650 HB2 HIS 88 HB2 HIS 88 34.500 -9.107 13.571 651 HB3 HIS 88 HB3 HIS 88 34.695 -7.362 13.433 652 HD1 HIS 88 HD1 HIS 88 32.009 -9.073 15.466 653 HD2 HIS 88 HD2 HIS 88 35.475 -6.848 16.013 654 HE1 HIS 88 HE1 HIS 88 32.100 -8.564 17.927 655 H GLU 89 H GLU 89 31.114 -7.581 11.050 656 HA GLU 89 HA GLU 89 33.194 -6.807 9.141 657 HB2 GLU 89 HB2 GLU 89 31.057 -8.875 8.598 658 HB3 GLU 89 HB3 GLU 89 32.095 -8.166 7.369 659 HG2 GLU 89 HG2 GLU 89 33.171 -9.647 9.749 660 HG3 GLU 89 HG3 GLU 89 32.759 -10.440 8.229 661 H HIS 90 H HIS 90 31.973 -4.821 10.128 662 HA HIS 90 HA HIS 90 29.396 -4.121 9.435 663 HB2 HIS 90 HB2 HIS 90 30.308 -1.730 9.417 664 HB3 HIS 90 HB3 HIS 90 30.546 -2.664 10.892 665 HD1 HIS 90 HD1 HIS 90 32.960 -3.314 11.507 666 HD2 HIS 90 HD2 HIS 90 32.649 -1.125 7.990 667 HE1 HIS 90 HE1 HIS 90 35.308 -2.607 10.945 668 H ALA 91 H ALA 91 28.501 -4.306 7.488 669 HA ALA 91 HA ALA 91 30.059 -3.892 5.078 670 HB1 ALA 91 HB1 ALA 91 28.272 -4.837 3.901 671 HB2 ALA 91 HB2 ALA 91 28.298 -5.715 5.432 672 HB3 ALA 91 HB3 ALA 91 27.110 -4.439 5.167 673 H GLU 92 H GLU 92 30.166 -2.050 3.977 674 HA GLU 92 HA GLU 92 28.221 0.067 4.615 675 HB2 GLU 92 HB2 GLU 92 30.037 1.589 3.652 676 HB3 GLU 92 HB3 GLU 92 30.349 0.860 5.221 677 HG2 GLU 92 HG2 GLU 92 31.714 -0.864 4.130 678 HG3 GLU 92 HG3 GLU 92 31.434 -0.081 2.575 679 H VAL 93 H VAL 93 27.435 1.398 2.918 680 HA VAL 93 HA VAL 93 27.445 0.049 0.300 681 HB VAL 93 HB VAL 93 25.393 1.989 1.375 682 HG11 VAL 93 HG11 VAL 93 25.607 0.380 -1.149 683 HG12 VAL 93 HG12 VAL 93 24.050 0.940 -0.537 684 HG13 VAL 93 HG13 VAL 93 25.303 2.107 -0.961 685 HG21 VAL 93 HG21 VAL 93 24.137 -0.424 1.122 686 HG22 VAL 93 HG22 VAL 93 25.725 -0.897 1.723 687 HG23 VAL 93 HG23 VAL 93 24.745 0.251 2.634 688 H VAL 94 H VAL 94 28.844 0.984 -1.043 689 HA VAL 94 HA VAL 94 28.842 3.924 -1.219 690 HB VAL 94 HB VAL 94 31.261 2.162 -1.623 691 HG11 VAL 94 HG11 VAL 94 32.361 4.503 -1.418 692 HG12 VAL 94 HG12 VAL 94 31.624 4.026 -2.949 693 HG13 VAL 94 HG13 VAL 94 30.759 5.101 -1.851 694 HG21 VAL 94 HG21 VAL 94 30.107 3.304 0.778 695 HG22 VAL 94 HG22 VAL 94 31.421 2.140 0.601 696 HG23 VAL 94 HG23 VAL 94 31.754 3.869 0.502 697 H PHE 95 H PHE 95 28.172 4.605 -3.135 698 HA PHE 95 HA PHE 95 28.880 3.070 -5.530 699 HB2 PHE 95 HB2 PHE 95 26.126 3.838 -4.629 700 HB3 PHE 95 HB3 PHE 95 26.484 3.736 -6.350 701 HD1 PHE 95 HD1 PHE 95 26.747 1.767 -3.204 702 HD2 PHE 95 HD2 PHE 95 26.307 1.707 -7.437 703 HE1 PHE 95 HE1 PHE 95 26.390 -0.666 -3.128 704 HE2 PHE 95 HE2 PHE 95 25.949 -0.727 -7.368 705 HZ PHE 95 HZ PHE 95 25.992 -1.916 -5.213 706 H THR 96 H THR 96 28.846 4.299 -7.493 707 HA THR 96 HA THR 96 29.223 7.177 -7.011 708 HB THR 96 HB THR 96 31.225 6.085 -7.854 709 HG1 THR 96 HG1 THR 96 31.202 8.067 -8.705 710 HG21 THR 96 HG21 THR 96 29.364 5.094 -9.991 711 HG22 THR 96 HG22 THR 96 30.504 4.181 -9.002 712 HG23 THR 96 HG23 THR 96 31.097 5.235 -10.285 713 H ALA 97 H ALA 97 28.305 8.700 -8.387 714 HA ALA 97 HA ALA 97 25.827 7.892 -9.613 715 HB1 ALA 97 HB1 ALA 97 25.214 10.036 -9.386 716 HB2 ALA 97 HB2 ALA 97 26.652 10.172 -8.375 717 HB3 ALA 97 HB3 ALA 97 26.721 10.644 -10.072 718 H ASN 98 H ASN 98 25.249 8.109 -11.787 719 HA ASN 98 HA ASN 98 25.537 7.920 -14.034 720 HB2 ASN 98 HB2 ASN 98 27.609 9.944 -13.276 721 HB3 ASN 98 HB3 ASN 98 27.571 9.330 -14.926 722 HD21 ASN 98 HD21 ASN 98 26.987 11.311 -15.778 723 HD22 ASN 98 HD22 ASN 98 25.407 11.979 -15.573 724 H ASP 99 H ASP 99 26.797 5.981 -12.268 725 HA ASP 99 HA ASP 99 28.190 4.453 -14.141 726 HB2 ASP 99 HB2 ASP 99 29.826 6.447 -13.064 727 HB3 ASP 99 HB3 ASP 99 30.271 4.982 -12.193 728 H SER 100 H SER 100 29.141 2.471 -13.180 729 HA SER 100 HA SER 100 28.794 0.603 -11.917 730 HB2 SER 100 HB2 SER 100 29.420 0.792 -9.635 731 HB3 SER 100 HB3 SER 100 30.306 2.070 -10.469 732 HG SER 100 HG SER 100 28.567 2.291 -8.458 733 H GLY 101 H GLY 101 26.438 1.475 -12.940 734 HA2 GLY 101 HA2 GLY 101 24.176 1.152 -12.695 735 HA3 GLY 101 HA3 GLY 101 24.541 0.312 -11.195 736 HA PRO 102 HA PRO 102 23.968 5.021 -10.149 737 HB2 PRO 102 HB2 PRO 102 22.723 6.491 -12.061 738 HB3 PRO 102 HB3 PRO 102 24.480 6.329 -11.967 739 HG2 PRO 102 HG2 PRO 102 22.536 4.880 -13.723 740 HG3 PRO 102 HG3 PRO 102 24.119 5.567 -14.134 741 HD2 PRO 102 HD2 PRO 102 23.755 2.925 -13.665 742 HD3 PRO 102 HD3 PRO 102 25.267 3.766 -13.266 743 H ARG 103 H ARG 103 21.784 6.550 -10.287 744 HA ARG 103 HA ARG 103 19.585 6.714 -9.726 745 HB2 ARG 103 HB2 ARG 103 19.158 4.010 -10.985 746 HB3 ARG 103 HB3 ARG 103 17.996 5.317 -10.800 747 HG2 ARG 103 HG2 ARG 103 19.560 6.653 -12.335 748 HG3 ARG 103 HG3 ARG 103 20.275 5.087 -12.726 749 HD2 ARG 103 HD2 ARG 103 17.340 5.732 -12.972 750 HD3 ARG 103 HD3 ARG 103 18.492 5.819 -14.305 751 HE ARG 103 HE ARG 103 18.760 3.286 -13.289 752 HH11 ARG 103 HH11 ARG 103 16.159 5.189 -14.608 753 HH12 ARG 103 HH12 ARG 103 15.306 3.820 -15.243 754 HH21 ARG 103 HH21 ARG 103 17.646 1.478 -14.120 755 HH22 ARG 103 HH22 ARG 103 16.152 1.709 -14.964 756 H ARG 104 H ARG 104 20.413 6.442 -7.523 757 HA ARG 104 HA ARG 104 19.226 4.073 -6.269 758 HB2 ARG 104 HB2 ARG 104 21.871 5.184 -5.346 759 HB3 ARG 104 HB3 ARG 104 21.104 3.672 -4.878 760 HG2 ARG 104 HG2 ARG 104 22.507 2.752 -6.353 761 HG3 ARG 104 HG3 ARG 104 21.360 3.334 -7.562 762 HD2 ARG 104 HD2 ARG 104 23.661 3.948 -8.130 763 HD3 ARG 104 HD3 ARG 104 22.661 5.371 -7.838 764 HE ARG 104 HE ARG 104 24.146 4.456 -5.541 765 HH11 ARG 104 HH11 ARG 104 24.146 6.500 -8.358 766 HH12 ARG 104 HH12 ARG 104 25.359 7.572 -7.742 767 HH21 ARG 104 HH21 ARG 104 25.743 5.861 -4.716 768 HH22 ARG 104 HH22 ARG 104 26.267 7.207 -5.669 769 H TYR 105 H TYR 105 18.767 4.366 -3.973 770 HA TYR 105 HA TYR 105 18.852 7.044 -2.895 771 HB2 TYR 105 HB2 TYR 105 16.288 5.775 -3.816 772 HB3 TYR 105 HB3 TYR 105 16.296 6.931 -2.489 773 HD1 TYR 105 HD2 TYR 105 18.046 9.024 -3.222 774 HD2 TYR 105 HD1 TYR 105 15.507 6.735 -5.756 775 HE1 TYR 105 HE2 TYR 105 17.993 10.879 -4.835 776 HE2 TYR 105 HE1 TYR 105 15.447 8.584 -7.376 777 HH TYR 105 HH TYR 105 17.441 11.454 -6.963 778 H THR 106 H THR 106 17.237 3.889 -2.531 779 HA THR 106 HA THR 106 17.444 4.063 0.360 780 HB THR 106 HB THR 106 16.361 1.823 -1.361 781 HG1 THR 106 HG1 THR 106 15.092 3.686 -1.562 782 HG21 THR 106 HG21 THR 106 16.439 2.295 1.601 783 HG22 THR 106 HG22 THR 106 16.833 0.833 0.696 784 HG23 THR 106 HG23 THR 106 15.152 1.335 0.874 785 H ILE 107 H ILE 107 18.913 3.058 1.598 786 HA ILE 107 HA ILE 107 21.085 1.654 0.268 787 HB ILE 107 HB ILE 107 20.734 2.643 3.093 788 HG12 ILE 107 HG12 ILE 107 23.043 3.709 2.056 789 HG13 ILE 107 HG13 ILE 107 22.006 3.631 0.637 790 HG21 ILE 107 HG21 ILE 107 23.364 1.941 2.896 791 HG22 ILE 107 HG22 ILE 107 22.115 0.986 3.695 792 HG23 ILE 107 HG23 ILE 107 22.568 0.629 2.028 793 HD11 ILE 107 HD11 ILE 107 21.849 5.354 3.001 794 HD12 ILE 107 HD12 ILE 107 21.317 5.638 1.343 795 HD13 ILE 107 HD13 ILE 107 20.308 4.701 2.445 796 H ALA 108 H ALA 108 20.950 -0.466 -0.013 797 HA ALA 108 HA ALA 108 19.294 -2.082 1.760 798 HB1 ALA 108 HB1 ALA 108 19.143 -2.315 -0.715 799 HB2 ALA 108 HB2 ALA 108 20.787 -2.955 -0.708 800 HB3 ALA 108 HB3 ALA 108 19.499 -3.822 0.129 801 H ALA 109 H ALA 109 20.209 -2.830 3.554 802 HA ALA 109 HA ALA 109 22.927 -3.945 3.373 803 HB1 ALA 109 HB1 ALA 109 21.835 -2.004 5.354 804 HB2 ALA 109 HB2 ALA 109 23.045 -3.177 5.875 805 HB3 ALA 109 HB3 ALA 109 23.414 -2.049 4.571 806 H MET 110 H MET 110 22.872 -6.050 3.773 807 HA MET 110 HA MET 110 20.804 -7.087 5.595 808 HB2 MET 110 HB2 MET 110 22.147 -8.281 3.186 809 HB3 MET 110 HB3 MET 110 21.379 -9.305 4.391 810 HG2 MET 110 HG2 MET 110 19.293 -7.913 4.035 811 HG3 MET 110 HG3 MET 110 20.107 -7.242 2.625 812 HE1 MET 110 HE1 MET 110 17.627 -10.485 3.392 813 HE2 MET 110 HE2 MET 110 19.042 -11.534 3.476 814 HE3 MET 110 HE3 MET 110 18.929 -10.120 4.524 815 H LEU 111 H LEU 111 21.460 -7.877 7.479 816 HA LEU 111 HA LEU 111 24.282 -8.151 8.031 817 HB2 LEU 111 HB2 LEU 111 21.913 -8.686 9.816 818 HB3 LEU 111 HB3 LEU 111 23.594 -8.545 10.325 819 HG LEU 111 HG LEU 111 22.721 -6.497 10.930 820 HD11 LEU 111 HD11 LEU 111 23.481 -5.768 8.129 821 HD12 LEU 111 HD12 LEU 111 24.679 -6.409 9.252 822 HD13 LEU 111 HD13 LEU 111 23.819 -4.918 9.637 823 HD21 LEU 111 HD21 LEU 111 21.335 -5.915 8.374 824 HD22 LEU 111 HD22 LEU 111 20.916 -5.453 10.024 825 HD23 LEU 111 HD23 LEU 111 20.590 -7.091 9.457 826 H SER 112 H SER 112 25.056 -9.934 6.975 827 HA SER 112 HA SER 112 23.696 -12.468 7.080 828 HB2 SER 112 HB2 SER 112 25.117 -13.090 5.431 829 HB3 SER 112 HB3 SER 112 25.518 -11.374 5.356 830 HG SER 112 HG SER 112 27.207 -13.229 5.759 831 HA PRO 113 HA PRO 113 25.487 -14.242 10.670 832 HB2 PRO 113 HB2 PRO 113 25.953 -16.799 9.886 833 HB3 PRO 113 HB3 PRO 113 24.329 -16.165 10.180 834 HG2 PRO 113 HG2 PRO 113 25.778 -16.534 7.587 835 HG3 PRO 113 HG3 PRO 113 24.088 -16.894 7.985 836 HD2 PRO 113 HD2 PRO 113 24.825 -14.658 6.647 837 HD3 PRO 113 HD3 PRO 113 23.432 -14.698 7.747 838 H TYR 114 H TYR 114 27.379 -16.000 11.180 839 HA TYR 114 HA TYR 114 29.799 -14.656 10.338 840 HB2 TYR 114 HB2 TYR 114 29.325 -15.383 12.717 841 HB3 TYR 114 HB3 TYR 114 29.568 -17.040 12.178 842 HD1 TYR 114 HD1 TYR 114 31.260 -13.731 12.367 843 HD2 TYR 114 HD2 TYR 114 31.719 -17.953 12.109 844 HE1 TYR 114 HE1 TYR 114 33.681 -13.483 12.722 845 HE2 TYR 114 HE2 TYR 114 34.141 -17.717 12.466 846 HH TYR 114 HH TYR 114 35.803 -15.006 12.057 847 H SER 115 H SER 115 29.020 -15.627 8.083 848 HA SER 115 HA SER 115 30.044 -18.323 7.673 849 HB2 SER 115 HB2 SER 115 29.100 -18.183 5.465 850 HB3 SER 115 HB3 SER 115 27.912 -17.530 6.593 851 HG SER 115 HG SER 115 28.151 -15.601 5.747 852 H TYR 116 H TYR 116 31.194 -18.405 5.319 853 HA TYR 116 HA TYR 116 33.407 -16.463 5.426 854 HB2 TYR 116 HB2 TYR 116 34.976 -18.194 4.905 855 HB3 TYR 116 HB3 TYR 116 34.007 -18.760 6.261 856 HD1 TYR 116 HD1 TYR 116 32.143 -20.405 5.813 857 HD2 TYR 116 HD2 TYR 116 35.069 -19.411 2.888 858 HE1 TYR 116 HE1 TYR 116 31.580 -22.448 4.564 859 HE2 TYR 116 HE2 TYR 116 34.514 -21.451 1.630 860 HH TYR 116 HH TYR 116 32.280 -22.975 1.491 861 H SER 117 H SER 117 33.965 -15.502 3.562 862 HA SER 117 HA SER 117 33.197 -16.660 1.010 863 HB2 SER 117 HB2 SER 117 32.169 -13.968 1.939 864 HB3 SER 117 HB3 SER 117 32.077 -14.550 0.277 865 HG SER 117 HG SER 117 30.246 -15.354 0.942 866 H THR 118 H THR 118 33.836 -14.926 -0.781 867 HA THR 118 HA THR 118 36.627 -14.274 -0.218 868 HB THR 118 HB THR 118 35.430 -13.911 -2.929 869 HG1 THR 118 HG1 THR 118 36.235 -16.459 -1.955 870 HG21 THR 118 HG21 THR 118 37.577 -13.808 -3.520 871 HG22 THR 118 HG22 THR 118 37.898 -15.376 -2.779 872 HG23 THR 118 HG23 THR 118 38.009 -13.905 -1.813 873 H THR 119 H THR 119 34.692 -12.591 0.972 874 HA THR 119 HA THR 119 35.100 -10.094 -0.543 875 HB THR 119 HB THR 119 32.888 -10.537 1.461 876 HG1 THR 119 HG1 THR 119 31.548 -10.892 -0.365 877 HG21 THR 119 HG21 THR 119 32.982 -8.554 -0.796 878 HG22 THR 119 HG22 THR 119 33.704 -8.200 0.775 879 HG23 THR 119 HG23 THR 119 31.977 -8.532 0.652 880 H ALA 120 H ALA 120 36.926 -9.313 0.392 881 HA ALA 120 HA ALA 120 36.700 -8.277 3.068 882 HB1 ALA 120 HB1 ALA 120 39.039 -10.092 2.587 883 HB2 ALA 120 HB2 ALA 120 38.438 -9.437 4.112 884 HB3 ALA 120 HB3 ALA 120 37.528 -10.692 3.272 885 H VAL 121 H VAL 121 37.704 -6.370 3.175 886 HA VAL 121 HA VAL 121 40.031 -5.855 1.481 887 HB VAL 121 HB VAL 121 38.077 -5.075 0.193 888 HG11 VAL 121 HG11 VAL 121 36.614 -3.396 0.951 889 HG12 VAL 121 HG12 VAL 121 36.738 -4.540 2.290 890 HG13 VAL 121 HG13 VAL 121 37.633 -3.021 2.340 891 HG21 VAL 121 HG21 VAL 121 40.382 -3.906 0.292 892 HG22 VAL 121 HG22 VAL 121 39.036 -3.070 -0.482 893 HG23 VAL 121 HG23 VAL 121 39.519 -2.634 1.157 894 H VAL 122 H VAL 122 41.468 -4.382 2.314 895 HA VAL 122 HA VAL 122 40.733 -2.912 4.733 896 HB VAL 122 HB VAL 122 41.665 -5.025 5.551 897 HG11 VAL 122 HG11 VAL 122 43.215 -5.067 3.374 898 HG12 VAL 122 HG12 VAL 122 44.373 -4.411 4.533 899 HG13 VAL 122 HG13 VAL 122 43.601 -5.966 4.841 900 HG21 VAL 122 HG21 VAL 122 42.041 -3.043 6.877 901 HG22 VAL 122 HG22 VAL 122 43.470 -4.073 6.952 902 HG23 VAL 122 HG23 VAL 122 43.471 -2.638 5.927 903 H THR 123 H THR 123 41.548 -0.915 4.734 904 HA THR 123 HA THR 123 44.031 -0.339 3.319 905 HB THR 123 HB THR 123 42.263 0.016 1.634 906 HG1 THR 123 HG1 THR 123 43.882 1.390 1.241 907 HG21 THR 123 HG21 THR 123 40.489 1.495 1.899 908 HG22 THR 123 HG22 THR 123 41.257 2.330 3.249 909 HG23 THR 123 HG23 THR 123 40.578 0.720 3.480 910 H ASN 124 H ASN 124 44.916 1.767 3.838 911 HA ASN 124 HA ASN 124 43.738 3.462 5.784 912 HB2 ASN 124 HB2 ASN 124 44.483 1.323 7.075 913 HB3 ASN 124 HB3 ASN 124 46.106 1.978 6.881 914 HD21 ASN 124 HD21 ASN 124 43.707 1.742 8.997 915 HD22 ASN 124 HD22 ASN 124 43.912 3.209 9.887 916 HA PRO 125 HA PRO 125 47.251 5.129 3.221 917 HB2 PRO 125 HB2 PRO 125 45.842 7.221 2.216 918 HB3 PRO 125 HB3 PRO 125 45.857 5.622 1.463 919 HG2 PRO 125 HG2 PRO 125 43.804 6.849 3.263 920 HG3 PRO 125 HG3 PRO 125 43.570 5.898 1.786 921 HD2 PRO 125 HD2 PRO 125 43.297 4.836 4.261 922 HD3 PRO 125 HD3 PRO 125 43.886 3.893 2.878 923 H LYS 126 H LYS 126 48.089 7.431 3.260 924 HA LYS 126 HA LYS 126 48.556 8.274 5.857 925 HB2 LYS 126 HB2 LYS 126 49.656 10.152 4.937 926 HB3 LYS 126 HB3 LYS 126 49.849 8.871 3.748 927 HG2 LYS 126 HG2 LYS 126 47.708 10.977 3.584 928 HG3 LYS 126 HG3 LYS 126 49.290 11.120 2.812 929 HD2 LYS 126 HD2 LYS 126 48.606 8.715 1.889 930 HD3 LYS 126 HD3 LYS 126 46.988 9.375 2.134 931 HE2 LYS 126 HE2 LYS 126 47.613 9.880 -0.102 932 HE3 LYS 126 HE3 LYS 126 47.716 11.383 0.813 933 HZ1 LYS 126 HZ1 LYS 126 49.749 10.021 -0.618 934 HZ2 LYS 126 HZ2 LYS 126 50.205 10.210 1.000 935 HZ3 LYS 126 HZ3 LYS 126 49.785 11.564 0.077 936 H GLU 127 H GLU 127 45.921 9.029 3.724 937 HA GLU 127 HA GLU 127 44.725 10.660 5.855 938 HB2 GLU 127 HB2 GLU 127 43.751 12.153 4.139 939 HB3 GLU 127 HB3 GLU 127 45.507 12.222 4.178 940 HG2 GLU 127 HG2 GLU 127 45.269 10.386 2.298 941 HG3 GLU 127 HG3 GLU 127 43.694 11.149 2.091 Start of MODEL 10 1 H1 GLY 1 H GLY 1 -3.670 6.516 5.693 2 HA2 GLY 1 HA2 GLY 1 -3.549 4.348 3.692 3 HA3 GLY 1 HA3 GLY 1 -2.307 5.590 3.768 4 HA PRO 2 HA PRO 2 -1.215 1.879 6.463 5 HB2 PRO 2 HB2 PRO 2 1.007 1.136 5.091 6 HB3 PRO 2 HB3 PRO 2 -0.606 0.517 4.716 7 HG2 PRO 2 HG2 PRO 2 0.942 2.702 3.379 8 HG3 PRO 2 HG3 PRO 2 -0.022 1.406 2.648 9 HD2 PRO 2 HD2 PRO 2 -0.953 3.934 2.926 10 HD3 PRO 2 HD3 PRO 2 -2.012 2.511 3.008 11 H THR 3 H THR 3 1.293 1.456 7.133 12 HA THR 3 HA THR 3 2.055 3.581 8.721 13 HB THR 3 HB THR 3 4.154 2.458 9.091 14 HG1 THR 3 HG1 THR 3 3.510 1.004 6.725 15 HG21 THR 3 HG21 THR 3 2.056 1.416 9.974 16 HG22 THR 3 HG22 THR 3 3.387 0.282 9.750 17 HG23 THR 3 HG23 THR 3 2.069 0.338 8.581 18 H GLY 4 H GLY 4 3.393 2.646 5.554 19 HA2 GLY 4 HA2 GLY 4 3.744 4.676 4.079 20 HA3 GLY 4 HA3 GLY 4 4.684 5.298 5.428 21 H THR 5 H THR 5 4.519 2.714 3.026 22 HA THR 5 HA THR 5 7.434 2.714 2.896 23 HB THR 5 HB THR 5 7.680 0.345 3.090 24 HG1 THR 5 HG1 THR 5 5.968 -1.038 3.190 25 HG21 THR 5 HG21 THR 5 5.828 1.210 5.312 26 HG22 THR 5 HG22 THR 5 7.534 1.646 5.210 27 HG23 THR 5 HG23 THR 5 7.065 -0.045 5.387 28 H GLY 6 H GLY 6 8.278 1.793 0.945 29 HA2 GLY 6 HA2 GLY 6 7.975 0.778 -1.204 30 HA3 GLY 6 HA3 GLY 6 6.282 1.247 -1.147 31 H GLU 7 H GLU 7 6.344 3.884 -0.587 32 HA GLU 7 HA GLU 7 8.172 5.156 -2.476 33 HB2 GLU 7 HB2 GLU 7 5.845 4.425 -3.494 34 HB3 GLU 7 HB3 GLU 7 5.283 5.881 -2.686 35 HG2 GLU 7 HG2 GLU 7 5.806 6.799 -4.677 36 HG3 GLU 7 HG3 GLU 7 7.396 6.910 -3.926 37 H SER 8 H SER 8 8.622 7.280 -2.020 38 HA SER 8 HA SER 8 7.062 8.834 -0.194 39 HB2 SER 8 HB2 SER 8 8.660 8.983 1.621 40 HB3 SER 8 HB3 SER 8 8.248 7.287 1.367 41 HG SER 8 HG SER 8 10.212 6.906 0.581 42 H LYS 9 H LYS 9 8.885 10.668 0.660 43 HA LYS 9 HA LYS 9 9.616 11.950 -1.844 44 HB2 LYS 9 HB2 LYS 9 10.086 13.185 0.842 45 HB3 LYS 9 HB3 LYS 9 9.652 13.956 -0.679 46 HG2 LYS 9 HG2 LYS 9 7.827 12.271 1.025 47 HG3 LYS 9 HG3 LYS 9 7.817 14.033 0.919 48 HD2 LYS 9 HD2 LYS 9 7.079 13.992 -1.322 49 HD3 LYS 9 HD3 LYS 9 7.445 12.273 -1.492 50 HE2 LYS 9 HE2 LYS 9 5.634 11.665 -0.076 51 HE3 LYS 9 HE3 LYS 9 5.380 13.337 0.423 52 HZ1 LYS 9 HZ1 LYS 9 4.579 13.895 -1.721 53 HZ2 LYS 9 HZ2 LYS 9 3.770 12.485 -1.255 54 HZ3 LYS 9 HZ3 LYS 9 5.039 12.400 -2.370 55 H CYS 10 H CYS 10 11.248 11.477 1.298 56 HA CYS 10 HA CYS 10 13.803 12.158 0.539 57 HB2 CYS 10 HB2 CYS 10 14.550 10.563 2.366 58 HB3 CYS 10 HB3 CYS 10 13.376 11.783 2.845 59 HG CYS 10 HG CYS 10 12.220 8.736 1.913 60 HA PRO 11 HA PRO 11 14.488 8.932 -2.515 61 HB2 PRO 11 HB2 PRO 11 16.787 10.012 -3.474 62 HB3 PRO 11 HB3 PRO 11 15.185 10.598 -3.936 63 HG2 PRO 11 HG2 PRO 11 17.096 11.704 -1.914 64 HG3 PRO 11 HG3 PRO 11 16.115 12.564 -3.114 65 HD2 PRO 11 HD2 PRO 11 15.402 12.386 -0.507 66 HD3 PRO 11 HD3 PRO 11 14.210 12.454 -1.821 67 H LEU 12 H LEU 12 16.552 10.027 0.060 68 HA LEU 12 HA LEU 12 18.207 7.609 -0.192 69 HB2 LEU 12 HB2 LEU 12 19.250 9.935 -0.108 70 HB3 LEU 12 HB3 LEU 12 18.769 9.964 1.587 71 HG LEU 12 HG LEU 12 21.158 9.351 1.172 72 HD11 LEU 12 HD11 LEU 12 19.627 7.115 2.469 73 HD12 LEU 12 HD12 LEU 12 19.797 8.708 3.205 74 HD13 LEU 12 HD13 LEU 12 21.229 7.730 2.881 75 HD21 LEU 12 HD21 LEU 12 20.496 7.945 -0.882 76 HD22 LEU 12 HD22 LEU 12 20.142 6.674 0.288 77 HD23 LEU 12 HD23 LEU 12 21.772 7.340 0.175 78 H MET 13 H MET 13 17.623 5.969 1.055 79 HA MET 13 HA MET 13 16.793 6.507 3.811 80 HB2 MET 13 HB2 MET 13 14.960 4.901 3.659 81 HB3 MET 13 HB3 MET 13 14.728 6.217 2.515 82 HG2 MET 13 HG2 MET 13 14.950 4.877 0.714 83 HG3 MET 13 HG3 MET 13 16.131 3.831 1.500 84 HE1 MET 13 HE1 MET 13 14.477 2.899 4.235 85 HE2 MET 13 HE2 MET 13 14.040 1.351 3.512 86 HE3 MET 13 HE3 MET 13 15.621 2.062 3.185 87 H VAL 14 H VAL 14 17.233 4.837 5.282 88 HA VAL 14 HA VAL 14 19.230 2.916 4.314 89 HB VAL 14 HB VAL 14 18.631 3.847 7.125 90 HG11 VAL 14 HG11 VAL 14 19.404 1.574 7.197 91 HG12 VAL 14 HG12 VAL 14 20.723 1.941 6.084 92 HG13 VAL 14 HG13 VAL 14 20.719 2.632 7.707 93 HG21 VAL 14 HG21 VAL 14 21.289 4.349 6.077 94 HG22 VAL 14 HG22 VAL 14 20.036 5.128 5.110 95 HG23 VAL 14 HG23 VAL 14 20.148 5.458 6.839 96 H LYS 15 H LYS 15 18.885 0.781 4.351 97 HA LYS 15 HA LYS 15 16.499 -0.214 5.767 98 HB2 LYS 15 HB2 LYS 15 16.003 -0.251 3.419 99 HB3 LYS 15 HB3 LYS 15 17.553 -0.994 3.047 100 HG2 LYS 15 HG2 LYS 15 15.841 -2.655 2.885 101 HG3 LYS 15 HG3 LYS 15 16.835 -3.008 4.299 102 HD2 LYS 15 HD2 LYS 15 14.498 -1.289 4.797 103 HD3 LYS 15 HD3 LYS 15 14.127 -2.944 4.313 104 HE2 LYS 15 HE2 LYS 15 16.053 -3.411 6.131 105 HE3 LYS 15 HE3 LYS 15 15.380 -1.918 6.783 106 HZ1 LYS 15 HZ1 LYS 15 14.172 -4.562 6.562 107 HZ2 LYS 15 HZ2 LYS 15 13.148 -3.238 6.313 108 HZ3 LYS 15 HZ3 LYS 15 13.997 -3.389 7.769 109 H VAL 16 H VAL 16 17.208 -1.340 7.459 110 HA VAL 16 HA VAL 16 19.391 -3.273 7.021 111 HB VAL 16 HB VAL 16 18.866 -1.687 9.539 112 HG11 VAL 16 HG11 VAL 16 21.371 -3.018 9.569 113 HG12 VAL 16 HG12 VAL 16 19.990 -3.253 10.641 114 HG13 VAL 16 HG13 VAL 16 20.131 -4.204 9.162 115 HG21 VAL 16 HG21 VAL 16 19.918 -0.254 7.981 116 HG22 VAL 16 HG22 VAL 16 21.197 -0.829 9.050 117 HG23 VAL 16 HG23 VAL 16 21.016 -1.524 7.440 118 H LEU 17 H LEU 17 18.726 -5.295 7.250 119 HA LEU 17 HA LEU 17 16.751 -5.932 9.318 120 HB2 LEU 17 HB2 LEU 17 15.328 -7.094 7.913 121 HB3 LEU 17 HB3 LEU 17 15.743 -5.666 6.967 122 HG LEU 17 HG LEU 17 17.626 -7.507 6.163 123 HD11 LEU 17 HD11 LEU 17 15.790 -9.350 5.489 124 HD12 LEU 17 HD12 LEU 17 15.201 -8.903 7.089 125 HD13 LEU 17 HD13 LEU 17 16.852 -9.494 6.890 126 HD21 LEU 17 HD21 LEU 17 15.925 -5.865 4.969 127 HD22 LEU 17 HD22 LEU 17 15.047 -7.370 4.695 128 HD23 LEU 17 HD23 LEU 17 16.700 -7.192 4.104 129 H ASP 18 H ASP 18 16.910 -8.006 10.179 130 HA ASP 18 HA ASP 18 19.509 -9.230 9.887 131 HB2 ASP 18 HB2 ASP 18 17.222 -9.473 11.770 132 HB3 ASP 18 HB3 ASP 18 18.268 -10.879 11.597 133 H ALA 19 H ALA 19 19.829 -10.493 8.169 134 HA ALA 19 HA ALA 19 17.865 -11.830 6.700 135 HB1 ALA 19 HB1 ALA 19 20.647 -11.481 6.551 136 HB2 ALA 19 HB2 ALA 19 20.362 -13.222 6.511 137 HB3 ALA 19 HB3 ALA 19 19.576 -12.173 5.331 138 H VAL 20 H VAL 20 19.302 -12.625 9.701 139 HA VAL 20 HA VAL 20 19.285 -15.383 9.761 140 HB VAL 20 HB VAL 20 18.463 -13.512 11.987 141 HG11 VAL 20 HG11 VAL 20 19.109 -15.352 13.485 142 HG12 VAL 20 HG12 VAL 20 17.748 -15.785 12.451 143 HG13 VAL 20 HG13 VAL 20 19.364 -16.390 12.083 144 HG21 VAL 20 HG21 VAL 20 21.018 -14.146 10.755 145 HG22 VAL 20 HG22 VAL 20 20.594 -12.850 11.873 146 HG23 VAL 20 HG23 VAL 20 21.010 -14.448 12.493 147 H ARG 21 H ARG 21 16.580 -13.184 10.474 148 HA ARG 21 HA ARG 21 14.753 -15.475 10.159 149 HB2 ARG 21 HB2 ARG 21 14.029 -12.963 11.639 150 HB3 ARG 21 HB3 ARG 21 13.299 -14.559 11.753 151 HG2 ARG 21 HG2 ARG 21 14.475 -14.644 13.667 152 HG3 ARG 21 HG3 ARG 21 15.780 -15.140 12.588 153 HD2 ARG 21 HD2 ARG 21 16.888 -13.459 13.609 154 HD3 ARG 21 HD3 ARG 21 16.035 -12.469 12.424 155 HE ARG 21 HE ARG 21 14.334 -12.602 14.555 156 HH11 ARG 21 HH11 ARG 21 17.642 -11.613 14.099 157 HH12 ARG 21 HH12 ARG 21 17.603 -10.438 15.372 158 HH21 ARG 21 HH21 ARG 21 14.270 -11.058 16.233 159 HH22 ARG 21 HH22 ARG 21 15.685 -10.124 16.586 160 H GLY 22 H GLY 22 15.704 -12.423 8.971 161 HA2 GLY 22 HA2 GLY 22 15.029 -11.588 6.868 162 HA3 GLY 22 HA3 GLY 22 13.550 -12.529 6.995 163 H SER 23 H SER 23 14.059 -11.025 9.905 164 HA SER 23 HA SER 23 12.038 -9.018 9.279 165 HB2 SER 23 HB2 SER 23 12.575 -8.810 11.987 166 HB3 SER 23 HB3 SER 23 11.283 -9.768 11.264 167 HG SER 23 HG SER 23 12.487 -11.569 11.456 168 HA PRO 24 HA PRO 24 14.656 -5.502 9.427 169 HB2 PRO 24 HB2 PRO 24 13.199 -3.721 10.869 170 HB3 PRO 24 HB3 PRO 24 12.775 -4.198 9.221 171 HG2 PRO 24 HG2 PRO 24 11.656 -5.169 11.822 172 HG3 PRO 24 HG3 PRO 24 10.804 -4.752 10.323 173 HD2 PRO 24 HD2 PRO 24 11.343 -7.310 11.028 174 HD3 PRO 24 HD3 PRO 24 11.288 -6.777 9.336 175 H ALA 25 H ALA 25 16.176 -4.410 10.667 176 HA ALA 25 HA ALA 25 16.583 -5.495 13.350 177 HB1 ALA 25 HB1 ALA 25 18.538 -3.730 11.928 178 HB2 ALA 25 HB2 ALA 25 18.836 -4.990 13.126 179 HB3 ALA 25 HB3 ALA 25 18.369 -5.428 11.484 180 H ILE 26 H ILE 26 16.503 -4.304 15.175 181 HA ILE 26 HA ILE 26 15.722 -1.484 14.890 182 HB ILE 26 HB ILE 26 15.009 -3.611 16.828 183 HG12 ILE 26 HG12 ILE 26 13.597 -2.438 14.945 184 HG13 ILE 26 HG13 ILE 26 12.851 -2.847 16.486 185 HG21 ILE 26 HG21 ILE 26 16.065 -2.189 18.385 186 HG22 ILE 26 HG22 ILE 26 15.427 -0.739 17.609 187 HG23 ILE 26 HG23 ILE 26 14.343 -1.817 18.489 188 HD11 ILE 26 HD11 ILE 26 13.934 -0.141 15.741 189 HD12 ILE 26 HD12 ILE 26 12.235 -0.612 15.723 190 HD13 ILE 26 HD13 ILE 26 13.120 -0.564 17.247 191 H ASN 27 H ASN 27 16.822 0.127 15.909 192 HA ASN 27 HA ASN 27 18.526 1.214 16.952 193 HB2 ASN 27 HB2 ASN 27 18.909 -1.351 18.509 194 HB3 ASN 27 HB3 ASN 27 19.465 0.256 18.968 195 HD21 ASN 27 HD21 ASN 27 17.144 1.677 18.221 196 HD22 ASN 27 HD22 ASN 27 15.889 1.261 19.334 197 H VAL 28 H VAL 28 19.323 0.637 14.608 198 HA VAL 28 HA VAL 28 21.893 -0.787 14.848 199 HB VAL 28 HB VAL 28 20.239 -0.335 12.360 200 HG11 VAL 28 HG11 VAL 28 21.877 -1.794 11.263 201 HG12 VAL 28 HG12 VAL 28 22.624 -0.318 11.878 202 HG13 VAL 28 HG13 VAL 28 22.824 -1.838 12.750 203 HG21 VAL 28 HG21 VAL 28 20.250 -2.429 14.368 204 HG22 VAL 28 HG22 VAL 28 19.108 -2.128 13.057 205 HG23 VAL 28 HG23 VAL 28 20.577 -3.055 12.751 206 H ALA 29 H ALA 29 23.491 0.633 15.096 207 HA ALA 29 HA ALA 29 23.427 3.346 14.492 208 HB1 ALA 29 HB1 ALA 29 26.103 2.688 14.322 209 HB2 ALA 29 HB2 ALA 29 25.223 3.110 15.791 210 HB3 ALA 29 HB3 ALA 29 25.427 1.418 15.342 211 H VAL 30 H VAL 30 23.639 4.490 12.678 212 HA VAL 30 HA VAL 30 24.933 3.268 10.348 213 HB VAL 30 HB VAL 30 22.291 4.717 10.158 214 HG11 VAL 30 HG11 VAL 30 23.669 4.945 8.177 215 HG12 VAL 30 HG12 VAL 30 23.915 3.197 8.120 216 HG13 VAL 30 HG13 VAL 30 22.308 3.872 7.847 217 HG21 VAL 30 HG21 VAL 30 21.424 2.795 10.928 218 HG22 VAL 30 HG22 VAL 30 21.802 2.171 9.323 219 HG23 VAL 30 HG23 VAL 30 22.919 1.898 10.660 220 H HIS 31 H HIS 31 26.237 4.624 9.275 221 HA HIS 31 HA HIS 31 25.982 7.510 9.811 222 HB2 HIS 31 HB2 HIS 31 28.626 6.130 9.385 223 HB3 HIS 31 HB3 HIS 31 28.330 7.749 10.011 224 HD1 HIS 31 HD1 HIS 31 28.141 7.988 12.495 225 HD2 HIS 31 HD2 HIS 31 27.916 4.027 11.257 226 HE1 HIS 31 HE1 HIS 31 28.188 6.620 14.605 227 H VAL 32 H VAL 32 25.620 8.639 8.028 228 HA VAL 32 HA VAL 32 26.352 7.470 5.435 229 HB VAL 32 HB VAL 32 24.510 9.810 5.911 230 HG11 VAL 32 HG11 VAL 32 24.414 9.948 3.699 231 HG12 VAL 32 HG12 VAL 32 25.643 8.686 3.584 232 HG13 VAL 32 HG13 VAL 32 23.932 8.255 3.588 233 HG21 VAL 32 HG21 VAL 32 22.853 7.784 5.240 234 HG22 VAL 32 HG22 VAL 32 24.051 6.915 6.200 235 HG23 VAL 32 HG23 VAL 32 23.180 8.280 6.901 236 H PHE 33 H PHE 33 27.773 8.429 4.095 237 HA PHE 33 HA PHE 33 28.751 11.113 4.797 238 HB2 PHE 33 HB2 PHE 33 30.359 8.636 4.206 239 HB3 PHE 33 HB3 PHE 33 31.036 10.247 3.995 240 HD1 PHE 33 HD1 PHE 33 29.372 8.083 6.517 241 HD2 PHE 33 HD2 PHE 33 32.018 11.335 5.787 242 HE1 PHE 33 HE1 PHE 33 29.948 8.148 8.909 243 HE2 PHE 33 HE2 PHE 33 32.600 11.404 8.177 244 HZ PHE 33 HZ PHE 33 31.565 9.809 9.741 245 H ARG 34 H ARG 34 29.995 12.126 2.974 246 HA ARG 34 HA ARG 34 28.976 11.256 0.354 247 HB2 ARG 34 HB2 ARG 34 27.642 13.161 1.214 248 HB3 ARG 34 HB3 ARG 34 29.115 14.115 1.326 249 HG2 ARG 34 HG2 ARG 34 28.570 12.915 -1.306 250 HG3 ARG 34 HG3 ARG 34 27.445 14.168 -0.777 251 HD2 ARG 34 HD2 ARG 34 29.439 15.613 -0.289 252 HD3 ARG 34 HD3 ARG 34 30.435 14.387 -1.074 253 HE ARG 34 HE ARG 34 28.829 16.352 -2.355 254 HH11 ARG 34 HH11 ARG 34 29.968 13.074 -2.644 255 HH12 ARG 34 HH12 ARG 34 29.861 13.052 -4.374 256 HH21 ARG 34 HH21 ARG 34 28.684 16.335 -4.632 257 HH22 ARG 34 HH22 ARG 34 29.131 14.907 -5.503 258 H LYS 35 H LYS 35 30.313 11.626 -1.408 259 HA LYS 35 HA LYS 35 33.096 11.635 -0.884 260 HB2 LYS 35 HB2 LYS 35 32.503 10.443 -2.796 261 HB3 LYS 35 HB3 LYS 35 31.416 11.704 -3.366 262 HG2 LYS 35 HG2 LYS 35 33.377 11.583 -4.771 263 HG3 LYS 35 HG3 LYS 35 33.349 13.116 -3.897 264 HD2 LYS 35 HD2 LYS 35 35.583 12.295 -3.808 265 HD3 LYS 35 HD3 LYS 35 34.881 12.067 -2.205 266 HE2 LYS 35 HE2 LYS 35 35.662 9.973 -2.394 267 HE3 LYS 35 HE3 LYS 35 34.248 9.713 -3.414 268 HZ1 LYS 35 HZ1 LYS 35 35.542 9.387 -5.167 269 HZ2 LYS 35 HZ2 LYS 35 36.882 9.399 -4.136 270 HZ3 LYS 35 HZ3 LYS 35 36.395 10.824 -4.906 271 H ALA 36 H ALA 36 34.118 13.392 -0.166 272 HA ALA 36 HA ALA 36 33.273 16.052 -0.725 273 HB1 ALA 36 HB1 ALA 36 34.592 15.150 1.303 274 HB2 ALA 36 HB2 ALA 36 36.011 15.375 0.277 275 HB3 ALA 36 HB3 ALA 36 34.984 16.752 0.676 276 H ALA 37 H ALA 37 34.514 17.692 -1.827 277 HA ALA 37 HA ALA 37 35.259 16.974 -4.429 278 HB1 ALA 37 HB1 ALA 37 34.480 19.243 -3.558 279 HB2 ALA 37 HB2 ALA 37 36.162 19.507 -3.095 280 HB3 ALA 37 HB3 ALA 37 35.745 19.238 -4.788 281 H ASP 38 H ASP 38 37.033 16.921 -1.503 282 HA ASP 38 HA ASP 38 39.614 16.928 -2.875 283 HB2 ASP 38 HB2 ASP 38 38.713 17.266 -0.067 284 HB3 ASP 38 HB3 ASP 38 40.280 16.497 -0.304 285 H ASP 39 H ASP 39 37.439 14.744 -2.863 286 HA ASP 39 HA ASP 39 37.397 12.474 -3.028 287 HB2 ASP 39 HB2 ASP 39 40.366 12.346 -2.626 288 HB3 ASP 39 HB3 ASP 39 39.341 11.356 -3.661 289 H THR 40 H THR 40 36.956 13.623 -0.519 290 HA THR 40 HA THR 40 38.062 11.555 1.267 291 HB THR 40 HB THR 40 38.136 13.062 3.086 292 HG1 THR 40 HG1 THR 40 37.250 15.162 2.950 293 HG21 THR 40 HG21 THR 40 39.582 14.888 2.290 294 HG22 THR 40 HG22 THR 40 39.087 14.544 0.632 295 HG23 THR 40 HG23 THR 40 40.003 13.346 1.546 296 H TRP 41 H TRP 41 36.606 11.533 3.380 297 HA TRP 41 HA TRP 41 33.852 11.146 2.426 298 HB2 TRP 41 HB2 TRP 41 35.425 9.859 4.653 299 HB3 TRP 41 HB3 TRP 41 33.675 9.708 4.536 300 HD1 TRP 41 HD1 TRP 41 35.988 9.566 1.468 301 HE1 TRP 41 HE1 TRP 41 35.792 7.227 0.412 302 HE3 TRP 41 HE3 TRP 41 33.060 7.322 5.008 303 HZ2 TRP 41 HZ2 TRP 41 34.558 4.757 1.001 304 HZ3 TRP 41 HZ3 TRP 41 32.416 4.969 4.686 305 HH2 TRP 41 HH2 TRP 41 33.150 3.715 2.724 306 H GLU 42 H GLU 42 32.648 12.886 2.858 307 HA GLU 42 HA GLU 42 33.068 14.350 5.356 308 HB2 GLU 42 HB2 GLU 42 31.557 14.976 2.826 309 HB3 GLU 42 HB3 GLU 42 31.366 15.939 4.285 310 HG2 GLU 42 HG2 GLU 42 34.124 15.456 3.322 311 HG3 GLU 42 HG3 GLU 42 33.109 16.553 2.385 312 HA PRO 43 HA PRO 43 29.549 12.655 7.365 313 HB2 PRO 43 HB2 PRO 43 28.830 14.749 8.937 314 HB3 PRO 43 HB3 PRO 43 30.261 13.760 9.250 315 HG2 PRO 43 HG2 PRO 43 30.060 16.433 7.917 316 HG3 PRO 43 HG3 PRO 43 31.244 15.863 9.107 317 HD2 PRO 43 HD2 PRO 43 31.780 15.971 6.456 318 HD3 PRO 43 HD3 PRO 43 32.483 14.738 7.523 319 H PHE 44 H PHE 44 27.725 12.293 6.263 320 HA PHE 44 HA PHE 44 26.243 14.573 5.162 321 HB2 PHE 44 HB2 PHE 44 26.887 12.697 3.633 322 HB3 PHE 44 HB3 PHE 44 25.853 11.632 4.579 323 HD1 PHE 44 HD2 PHE 44 23.393 12.087 4.666 324 HD2 PHE 44 HD1 PHE 44 26.001 14.094 1.968 325 HE1 PHE 44 HE2 PHE 44 21.461 12.735 3.287 326 HE2 PHE 44 HE1 PHE 44 24.074 14.747 0.584 327 HZ PHE 44 HZ PHE 44 21.800 14.068 1.244 328 H ALA 45 H ALA 45 25.911 11.753 7.246 329 HA ALA 45 HA ALA 45 23.964 12.934 8.886 330 HB1 ALA 45 HB1 ALA 45 21.955 12.256 8.124 331 HB2 ALA 45 HB2 ALA 45 22.785 12.233 6.568 332 HB3 ALA 45 HB3 ALA 45 22.588 10.740 7.484 333 H SER 46 H SER 46 22.809 11.138 10.250 334 HA SER 46 HA SER 46 24.016 8.589 10.455 335 HB2 SER 46 HB2 SER 46 25.979 9.446 11.336 336 HB3 SER 46 HB3 SER 46 25.163 10.805 12.109 337 HG SER 46 HG SER 46 25.809 9.282 13.655 338 H GLY 47 H GLY 47 22.914 7.269 11.862 339 HA2 GLY 47 HA2 GLY 47 21.363 8.157 14.045 340 HA3 GLY 47 HA3 GLY 47 20.329 8.008 12.631 341 H LYS 48 H LYS 48 19.206 6.379 13.900 342 HA LYS 48 HA LYS 48 20.536 3.762 13.688 343 HB2 LYS 48 HB2 LYS 48 19.157 5.001 15.998 344 HB3 LYS 48 HB3 LYS 48 18.806 3.303 15.702 345 HG2 LYS 48 HG2 LYS 48 21.190 2.787 15.807 346 HG3 LYS 48 HG3 LYS 48 21.546 4.492 16.097 347 HD2 LYS 48 HD2 LYS 48 19.806 2.785 17.876 348 HD3 LYS 48 HD3 LYS 48 21.520 3.100 18.162 349 HE2 LYS 48 HE2 LYS 48 20.603 5.619 17.836 350 HE3 LYS 48 HE3 LYS 48 19.175 4.850 18.528 351 HZ1 LYS 48 HZ1 LYS 48 20.708 5.825 20.189 352 HZ2 LYS 48 HZ2 LYS 48 21.884 4.701 19.730 353 HZ3 LYS 48 HZ3 LYS 48 20.432 4.172 20.420 354 H THR 49 H THR 49 19.420 2.228 12.641 355 HA THR 49 HA THR 49 17.183 2.807 11.102 356 HB THR 49 HB THR 49 17.009 0.445 10.629 357 HG1 THR 49 HG1 THR 49 17.697 -1.058 11.994 358 HG21 THR 49 HG21 THR 49 19.669 1.731 10.775 359 HG22 THR 49 HG22 THR 49 18.799 1.080 9.386 360 HG23 THR 49 HG23 THR 49 19.655 -0.007 10.480 361 H SER 50 H SER 50 15.101 1.434 11.219 362 HA SER 50 HA SER 50 14.107 1.382 13.990 363 HB2 SER 50 HB2 SER 50 12.690 2.470 11.547 364 HB3 SER 50 HB3 SER 50 11.918 2.217 13.112 365 HG SER 50 HG SER 50 14.218 3.833 12.756 366 H GLU 51 H GLU 51 11.874 0.221 14.026 367 HA GLU 51 HA GLU 51 12.318 -2.443 13.155 368 HB2 GLU 51 HB2 GLU 51 9.937 -2.782 13.984 369 HB3 GLU 51 HB3 GLU 51 11.102 -2.192 15.162 370 HG2 GLU 51 HG2 GLU 51 9.855 -0.417 15.570 371 HG3 GLU 51 HG3 GLU 51 9.872 0.033 13.866 372 H SER 52 H SER 52 11.196 0.236 11.517 373 HA SER 52 HA SER 52 9.504 -1.334 9.705 374 HB2 SER 52 HB2 SER 52 8.659 0.852 10.647 375 HB3 SER 52 HB3 SER 52 9.911 1.664 9.705 376 HG SER 52 HG SER 52 8.762 1.388 7.964 377 H GLY 53 H GLY 53 12.655 -0.692 10.012 378 HA2 GLY 53 HA2 GLY 53 14.402 -0.954 8.529 379 HA3 GLY 53 HA3 GLY 53 13.219 -1.243 7.262 380 H GLU 54 H GLU 54 12.901 1.651 9.101 381 HA GLU 54 HA GLU 54 14.216 3.193 6.969 382 HB2 GLU 54 HB2 GLU 54 12.331 4.881 7.266 383 HB3 GLU 54 HB3 GLU 54 11.935 3.397 6.410 384 HG2 GLU 54 HG2 GLU 54 10.601 2.617 8.088 385 HG3 GLU 54 HG3 GLU 54 11.473 3.496 9.342 386 H LEU 55 H LEU 55 15.577 4.702 7.685 387 HA LEU 55 HA LEU 55 15.817 5.130 10.543 388 HB2 LEU 55 HB2 LEU 55 17.660 4.870 8.602 389 HB3 LEU 55 HB3 LEU 55 17.534 6.627 8.664 390 HG LEU 55 HG LEU 55 17.920 5.217 11.242 391 HD11 LEU 55 HD11 LEU 55 20.236 5.645 9.374 392 HD12 LEU 55 HD12 LEU 55 19.440 4.086 9.579 393 HD13 LEU 55 HD13 LEU 55 20.237 4.856 10.951 394 HD21 LEU 55 HD21 LEU 55 19.675 7.416 10.644 395 HD22 LEU 55 HD22 LEU 55 18.443 7.274 11.897 396 HD23 LEU 55 HD23 LEU 55 18.002 7.845 10.287 397 H HIS 56 H HIS 56 16.156 7.344 11.390 398 HA HIS 56 HA HIS 56 13.953 8.987 10.881 399 HB2 HIS 56 HB2 HIS 56 15.961 8.876 12.792 400 HB3 HIS 56 HB3 HIS 56 16.224 10.429 12.005 401 HD1 HIS 56 HD1 HIS 56 15.231 12.118 13.517 402 HD2 HIS 56 HD2 HIS 56 12.774 8.796 13.075 403 HE1 HIS 56 HE1 HIS 56 13.125 12.667 14.777 404 H GLY 57 H GLY 57 14.675 11.563 10.646 405 HA2 GLY 57 HA2 GLY 57 15.086 11.865 7.865 406 HA3 GLY 57 HA3 GLY 57 15.071 13.164 9.049 407 H LEU 58 H LEU 58 17.051 10.908 7.281 408 HA LEU 58 HA LEU 58 19.497 12.024 8.423 409 HB2 LEU 58 HB2 LEU 58 18.955 9.724 6.564 410 HB3 LEU 58 HB3 LEU 58 20.583 10.302 6.910 411 HG LEU 58 HG LEU 58 18.641 9.125 8.897 412 HD11 LEU 58 HD11 LEU 58 19.433 7.225 8.006 413 HD12 LEU 58 HD12 LEU 58 20.878 7.594 8.947 414 HD13 LEU 58 HD13 LEU 58 20.803 8.032 7.241 415 HD21 LEU 58 HD21 LEU 58 20.729 9.192 10.367 416 HD22 LEU 58 HD22 LEU 58 19.867 10.710 10.110 417 HD23 LEU 58 HD23 LEU 58 21.352 10.375 9.217 418 H THR 59 H THR 59 17.569 12.113 5.536 419 HA THR 59 HA THR 59 19.430 13.035 3.678 420 HB THR 59 HB THR 59 17.581 13.891 2.394 421 HG1 THR 59 HG1 THR 59 16.334 15.000 3.821 422 HG21 THR 59 HG21 THR 59 16.307 11.933 2.144 423 HG22 THR 59 HG22 THR 59 16.447 11.520 3.853 424 HG23 THR 59 HG23 THR 59 17.848 11.373 2.793 425 H THR 60 H THR 60 19.813 15.173 2.861 426 HA THR 60 HA THR 60 19.101 17.431 4.540 427 HB THR 60 HB THR 60 21.499 18.167 4.727 428 HG1 THR 60 HG1 THR 60 22.130 16.444 3.102 429 HG21 THR 60 HG21 THR 60 21.968 16.838 6.691 430 HG22 THR 60 HG22 THR 60 20.862 15.578 6.144 431 HG23 THR 60 HG23 THR 60 20.236 17.159 6.612 432 H GLU 61 H GLU 61 20.526 19.421 3.608 433 HA GLU 61 HA GLU 61 19.549 19.867 1.012 434 HB2 GLU 61 HB2 GLU 61 20.949 21.914 1.059 435 HB3 GLU 61 HB3 GLU 61 19.969 21.718 2.506 436 HG2 GLU 61 HG2 GLU 61 22.042 20.665 3.555 437 HG3 GLU 61 HG3 GLU 61 22.923 21.339 2.185 438 H GLU 62 H GLU 62 22.333 18.236 2.101 439 HA GLU 62 HA GLU 62 23.922 18.679 -0.261 440 HB2 GLU 62 HB2 GLU 62 24.195 16.976 2.190 441 HB3 GLU 62 HB3 GLU 62 25.225 16.675 0.798 442 HG2 GLU 62 HG2 GLU 62 25.029 19.220 2.389 443 HG3 GLU 62 HG3 GLU 62 26.381 18.088 2.347 444 H GLU 63 H GLU 63 21.177 16.978 0.242 445 HA GLU 63 HA GLU 63 21.723 14.481 -0.966 446 HB2 GLU 63 HB2 GLU 63 19.372 14.168 -1.057 447 HB3 GLU 63 HB3 GLU 63 19.690 15.082 0.411 448 HG2 GLU 63 HG2 GLU 63 19.092 17.154 -0.811 449 HG3 GLU 63 HG3 GLU 63 18.645 16.159 -2.196 450 H PHE 64 H PHE 64 21.234 17.649 -2.238 451 HA PHE 64 HA PHE 64 20.594 16.744 -4.908 452 HB2 PHE 64 HB2 PHE 64 19.719 18.888 -3.928 453 HB3 PHE 64 HB3 PHE 64 21.357 19.528 -4.015 454 HD1 PHE 64 HD2 PHE 64 18.842 17.862 -6.210 455 HD2 PHE 64 HD1 PHE 64 21.928 20.772 -5.853 456 HE1 PHE 64 HE2 PHE 64 18.437 18.571 -8.530 457 HE2 PHE 64 HE1 PHE 64 21.527 21.486 -8.173 458 HZ PHE 64 HZ PHE 64 19.781 20.384 -9.516 459 H VAL 65 H VAL 65 22.784 15.428 -4.454 460 HA VAL 65 HA VAL 65 24.930 16.952 -5.784 461 HB VAL 65 HB VAL 65 26.543 15.412 -4.676 462 HG11 VAL 65 HG11 VAL 65 26.233 16.423 -2.358 463 HG12 VAL 65 HG12 VAL 65 26.368 17.548 -3.712 464 HG13 VAL 65 HG13 VAL 65 24.787 17.193 -3.012 465 HG21 VAL 65 HG21 VAL 65 24.804 13.635 -4.240 466 HG22 VAL 65 HG22 VAL 65 25.894 13.985 -2.899 467 HG23 VAL 65 HG23 VAL 65 24.252 14.627 -2.890 468 H GLU 66 H GLU 66 26.632 15.124 -6.591 469 HA GLU 66 HA GLU 66 25.596 14.031 -8.888 470 HB2 GLU 66 HB2 GLU 66 27.936 12.988 -7.284 471 HB3 GLU 66 HB3 GLU 66 27.610 12.613 -8.969 472 HG2 GLU 66 HG2 GLU 66 27.724 15.138 -9.358 473 HG3 GLU 66 HG3 GLU 66 28.468 15.214 -7.762 474 H GLY 67 H GLY 67 25.887 12.529 -5.700 475 HA2 GLY 67 HA2 GLY 67 23.882 11.027 -5.269 476 HA3 GLY 67 HA3 GLY 67 24.394 10.201 -6.733 477 H ILE 68 H ILE 68 27.143 11.213 -5.240 478 HA ILE 68 HA ILE 68 27.844 8.566 -4.423 479 HB ILE 68 HB ILE 68 29.382 11.093 -3.835 480 HG12 ILE 68 HG12 ILE 68 29.598 9.336 -6.288 481 HG13 ILE 68 HG13 ILE 68 28.769 10.889 -6.254 482 HG21 ILE 68 HG21 ILE 68 30.564 9.536 -2.701 483 HG22 ILE 68 HG22 ILE 68 29.924 8.198 -3.655 484 HG23 ILE 68 HG23 ILE 68 31.225 9.197 -4.302 485 HD11 ILE 68 HD11 ILE 68 30.928 11.929 -5.559 486 HD12 ILE 68 HD12 ILE 68 31.700 10.368 -5.850 487 HD13 ILE 68 HD13 ILE 68 30.925 11.232 -7.179 488 H TYR 69 H TYR 69 27.148 7.686 -2.595 489 HA TYR 69 HA TYR 69 27.316 9.253 -0.126 490 HB2 TYR 69 HB2 TYR 69 24.927 7.514 -0.749 491 HB3 TYR 69 HB3 TYR 69 25.141 8.594 0.624 492 HD1 TYR 69 HD2 TYR 69 25.680 11.131 -0.153 493 HD2 TYR 69 HD1 TYR 69 23.521 8.246 -2.415 494 HE1 TYR 69 HE2 TYR 69 24.581 12.942 -1.403 495 HE2 TYR 69 HE1 TYR 69 22.416 10.048 -3.672 496 HH TYR 69 HH TYR 69 21.927 12.344 -3.552 497 H LYS 70 H LYS 70 28.398 8.182 1.383 498 HA LYS 70 HA LYS 70 28.670 5.265 1.109 499 HB2 LYS 70 HB2 LYS 70 30.476 7.233 2.526 500 HB3 LYS 70 HB3 LYS 70 30.748 5.501 2.406 501 HG2 LYS 70 HG2 LYS 70 32.102 6.272 0.734 502 HG3 LYS 70 HG3 LYS 70 30.616 5.958 -0.164 503 HD2 LYS 70 HD2 LYS 70 30.669 8.073 -0.855 504 HD3 LYS 70 HD3 LYS 70 30.364 8.568 0.811 505 HE2 LYS 70 HE2 LYS 70 32.305 9.729 0.101 506 HE3 LYS 70 HE3 LYS 70 32.849 8.450 1.186 507 HZ1 LYS 70 HZ1 LYS 70 33.738 8.931 -1.369 508 HZ2 LYS 70 HZ2 LYS 70 32.772 7.550 -1.509 509 HZ3 LYS 70 HZ3 LYS 70 34.070 7.568 -0.423 510 H VAL 71 H VAL 71 27.150 4.341 2.354 511 HA VAL 71 HA VAL 71 26.685 5.406 5.050 512 HB VAL 71 HB VAL 71 25.074 3.407 3.458 513 HG11 VAL 71 HG11 VAL 71 24.238 2.788 5.427 514 HG12 VAL 71 HG12 VAL 71 25.085 4.084 6.274 515 HG13 VAL 71 HG13 VAL 71 23.517 4.394 5.530 516 HG21 VAL 71 HG21 VAL 71 24.737 6.339 4.016 517 HG22 VAL 71 HG22 VAL 71 24.737 5.505 2.461 518 HG23 VAL 71 HG23 VAL 71 23.376 5.312 3.565 519 H GLU 72 H GLU 72 27.360 4.353 6.809 520 HA GLU 72 HA GLU 72 28.363 1.602 6.471 521 HB2 GLU 72 HB2 GLU 72 30.159 2.038 7.863 522 HB3 GLU 72 HB3 GLU 72 29.994 3.565 7.007 523 HG2 GLU 72 HG2 GLU 72 28.478 4.204 9.032 524 HG3 GLU 72 HG3 GLU 72 29.352 2.901 9.837 525 H ILE 73 H ILE 73 27.719 0.058 7.888 526 HA ILE 73 HA ILE 73 25.791 0.890 9.957 527 HB ILE 73 HB ILE 73 25.920 -1.711 8.428 528 HG12 ILE 73 HG12 ILE 73 23.405 -0.371 8.256 529 HG13 ILE 73 HG13 ILE 73 24.672 0.786 7.860 530 HG21 ILE 73 HG21 ILE 73 24.531 -0.924 10.902 531 HG22 ILE 73 HG22 ILE 73 23.549 -1.773 9.709 532 HG23 ILE 73 HG23 ILE 73 25.021 -2.519 10.331 533 HD11 ILE 73 HD11 ILE 73 25.314 -0.356 5.985 534 HD12 ILE 73 HD12 ILE 73 24.725 -1.904 6.592 535 HD13 ILE 73 HD13 ILE 73 23.584 -0.693 6.010 536 H ASP 74 H ASP 74 26.314 0.504 12.002 537 HA ASP 74 HA ASP 74 28.700 -1.046 12.593 538 HB2 ASP 74 HB2 ASP 74 27.260 1.132 13.842 539 HB3 ASP 74 HB3 ASP 74 27.572 -0.158 15.000 540 H THR 75 H THR 75 27.972 -3.158 12.175 541 HA THR 75 HA THR 75 25.701 -4.202 13.638 542 HB THR 75 HB THR 75 26.197 -6.331 12.532 543 HG1 THR 75 HG1 THR 75 28.636 -5.280 12.308 544 HG21 THR 75 HG21 THR 75 25.754 -5.659 10.260 545 HG22 THR 75 HG22 THR 75 26.396 -4.046 10.569 546 HG23 THR 75 HG23 THR 75 24.902 -4.565 11.349 547 H LYS 76 H LYS 76 29.129 -4.022 13.992 548 HA LYS 76 HA LYS 76 29.606 -6.235 15.640 549 HB2 LYS 76 HB2 LYS 76 31.650 -5.174 16.251 550 HB3 LYS 76 HB3 LYS 76 31.337 -4.749 14.573 551 HG2 LYS 76 HG2 LYS 76 31.855 -2.684 15.291 552 HG3 LYS 76 HG3 LYS 76 30.164 -2.665 15.797 553 HD2 LYS 76 HD2 LYS 76 31.166 -3.751 17.983 554 HD3 LYS 76 HD3 LYS 76 32.640 -2.953 17.430 555 HE2 LYS 76 HE2 LYS 76 30.470 -1.124 17.184 556 HE3 LYS 76 HE3 LYS 76 30.425 -1.828 18.800 557 HZ1 LYS 76 HZ1 LYS 76 33.070 -1.252 18.334 558 HZ2 LYS 76 HZ2 LYS 76 32.010 -0.393 19.334 559 HZ3 LYS 76 HZ3 LYS 76 32.231 0.087 17.726 560 H SER 77 H SER 77 28.318 -3.051 16.341 561 HA SER 77 HA SER 77 28.343 -3.546 19.208 562 HB2 SER 77 HB2 SER 77 28.512 -1.241 17.683 563 HB3 SER 77 HB3 SER 77 26.865 -1.190 18.311 564 HG SER 77 HG SER 77 28.911 -1.855 20.087 565 H TYR 78 H TYR 78 26.246 -3.923 16.536 566 HA TYR 78 HA TYR 78 23.782 -3.773 18.006 567 HB2 TYR 78 HB2 TYR 78 23.669 -3.255 15.679 568 HB3 TYR 78 HB3 TYR 78 24.471 -4.758 15.237 569 HD1 TYR 78 HD1 TYR 78 21.381 -3.517 16.924 570 HD2 TYR 78 HD2 TYR 78 23.186 -6.567 14.570 571 HE1 TYR 78 HE1 TYR 78 19.189 -4.599 16.658 572 HE2 TYR 78 HE2 TYR 78 20.998 -7.658 14.295 573 HH TYR 78 HH TYR 78 18.196 -6.630 16.083 574 H TRP 79 H TRP 79 26.086 -6.247 17.174 575 HA TRP 79 HA TRP 79 24.321 -8.408 17.961 576 HB2 TRP 79 HB2 TRP 79 27.220 -8.360 17.106 577 HB3 TRP 79 HB3 TRP 79 26.352 -9.830 17.540 578 HD1 TRP 79 HD1 TRP 79 23.657 -9.441 16.016 579 HE1 TRP 79 HE1 TRP 79 23.589 -9.455 13.443 580 HE3 TRP 79 HE3 TRP 79 28.548 -8.293 15.068 581 HZ2 TRP 79 HZ2 TRP 79 25.374 -9.037 11.296 582 HZ3 TRP 79 HZ3 TRP 79 29.287 -8.119 12.728 583 HH2 TRP 79 HH2 TRP 79 27.731 -8.484 10.882 584 H LYS 80 H LYS 80 26.634 -6.337 19.414 585 HA LYS 80 HA LYS 80 27.204 -8.120 21.629 586 HB2 LYS 80 HB2 LYS 80 28.780 -6.560 22.323 587 HB3 LYS 80 HB3 LYS 80 28.790 -6.351 20.577 588 HG2 LYS 80 HG2 LYS 80 28.598 -4.178 21.066 589 HG3 LYS 80 HG3 LYS 80 26.891 -4.558 21.299 590 HD2 LYS 80 HD2 LYS 80 27.642 -3.316 23.202 591 HD3 LYS 80 HD3 LYS 80 27.391 -4.989 23.706 592 HE2 LYS 80 HE2 LYS 80 29.739 -5.428 23.655 593 HE3 LYS 80 HE3 LYS 80 30.069 -3.870 22.897 594 HZ1 LYS 80 HZ1 LYS 80 29.524 -4.501 25.684 595 HZ2 LYS 80 HZ2 LYS 80 28.835 -3.072 25.101 596 HZ3 LYS 80 HZ3 LYS 80 30.509 -3.298 25.018 597 H ALA 81 H ALA 81 24.857 -5.790 20.801 598 HA ALA 81 HA ALA 81 24.188 -5.058 23.516 599 HB1 ALA 81 HB1 ALA 81 23.173 -4.351 20.811 600 HB2 ALA 81 HB2 ALA 81 22.112 -4.107 22.200 601 HB3 ALA 81 HB3 ALA 81 23.682 -3.306 22.139 602 H LEU 82 H LEU 82 22.770 -7.055 20.947 603 HA LEU 82 HA LEU 82 20.736 -8.034 22.798 604 HB2 LEU 82 HB2 LEU 82 21.161 -8.553 19.860 605 HB3 LEU 82 HB3 LEU 82 19.822 -9.186 20.816 606 HG LEU 82 HG LEU 82 18.854 -7.395 19.728 607 HD11 LEU 82 HD11 LEU 82 18.562 -7.241 22.179 608 HD12 LEU 82 HD12 LEU 82 18.457 -5.679 21.369 609 HD13 LEU 82 HD13 LEU 82 19.923 -6.122 22.243 610 HD21 LEU 82 HD21 LEU 82 20.998 -6.581 18.761 611 HD22 LEU 82 HD22 LEU 82 21.293 -5.706 20.263 612 HD23 LEU 82 HD23 LEU 82 19.903 -5.292 19.260 613 H GLY 83 H GLY 83 23.849 -8.801 21.994 614 HA2 GLY 83 HA2 GLY 83 25.156 -10.627 22.490 615 HA3 GLY 83 HA3 GLY 83 23.776 -11.290 23.352 616 H ILE 84 H ILE 84 24.212 -10.481 19.917 617 HA ILE 84 HA ILE 84 23.155 -13.098 19.204 618 HB ILE 84 HB ILE 84 23.996 -10.916 17.304 619 HG12 ILE 84 HG12 ILE 84 22.379 -10.012 18.929 620 HG13 ILE 84 HG13 ILE 84 21.675 -10.144 17.320 621 HG21 ILE 84 HG21 ILE 84 23.644 -12.753 15.992 622 HG22 ILE 84 HG22 ILE 84 22.468 -13.456 17.100 623 HG23 ILE 84 HG23 ILE 84 22.003 -12.112 16.059 624 HD11 ILE 84 HD11 ILE 84 20.070 -11.485 18.049 625 HD12 ILE 84 HD12 ILE 84 21.219 -12.529 18.886 626 HD13 ILE 84 HD13 ILE 84 20.599 -11.084 19.682 627 H SER 85 H SER 85 24.206 -14.461 17.637 628 HA SER 85 HA SER 85 26.787 -15.175 18.240 629 HB2 SER 85 HB2 SER 85 26.236 -16.863 16.877 630 HB3 SER 85 HB3 SER 85 24.827 -15.956 16.327 631 HG SER 85 HG SER 85 25.958 -16.225 14.508 632 HA PRO 86 HA PRO 86 29.572 -12.406 16.288 633 HB2 PRO 86 HB2 PRO 86 31.523 -14.075 15.403 634 HB3 PRO 86 HB3 PRO 86 31.282 -13.699 17.114 635 HG2 PRO 86 HG2 PRO 86 30.396 -16.098 15.558 636 HG3 PRO 86 HG3 PRO 86 31.110 -16.017 17.179 637 HD2 PRO 86 HD2 PRO 86 28.449 -16.318 16.773 638 HD3 PRO 86 HD3 PRO 86 29.110 -15.443 18.169 639 H MET 87 H MET 87 30.841 -12.040 14.205 640 HA MET 87 HA MET 87 30.170 -13.390 11.829 641 HB2 MET 87 HB2 MET 87 27.961 -12.242 12.480 642 HB3 MET 87 HB3 MET 87 28.760 -10.739 12.039 643 HG2 MET 87 HG2 MET 87 27.479 -11.475 10.177 644 HG3 MET 87 HG3 MET 87 29.185 -11.689 9.788 645 HE1 MET 87 HE1 MET 87 30.381 -14.189 9.667 646 HE2 MET 87 HE2 MET 87 29.365 -15.132 8.577 647 HE3 MET 87 HE3 MET 87 29.625 -13.413 8.275 648 H HIS 88 H HIS 88 31.024 -12.323 9.914 649 HA HIS 88 HA HIS 88 33.513 -11.138 10.337 650 HB2 HIS 88 HB2 HIS 88 32.268 -12.239 8.190 651 HB3 HIS 88 HB3 HIS 88 32.211 -10.533 7.755 652 HD1 HIS 88 HD1 HIS 88 34.008 -10.308 6.052 653 HD2 HIS 88 HD2 HIS 88 35.270 -12.443 9.386 654 HE1 HIS 88 HE1 HIS 88 36.468 -10.699 5.709 655 H GLU 89 H GLU 89 33.965 -8.984 8.907 656 HA GLU 89 HA GLU 89 33.091 -6.853 10.486 657 HB2 GLU 89 HB2 GLU 89 35.106 -7.080 8.813 658 HB3 GLU 89 HB3 GLU 89 33.967 -6.392 7.663 659 HG2 GLU 89 HG2 GLU 89 33.658 -4.459 9.131 660 HG3 GLU 89 HG3 GLU 89 34.817 -5.147 10.268 661 H HIS 90 H HIS 90 31.561 -5.262 10.221 662 HA HIS 90 HA HIS 90 29.105 -5.910 9.141 663 HB2 HIS 90 HB2 HIS 90 28.547 -3.506 9.353 664 HB3 HIS 90 HB3 HIS 90 29.359 -4.135 10.784 665 HD1 HIS 90 HD1 HIS 90 29.888 -1.843 7.862 666 HD2 HIS 90 HD2 HIS 90 31.833 -2.998 11.348 667 HE1 HIS 90 HE1 HIS 90 31.790 -0.222 8.139 668 H ALA 91 H ALA 91 27.920 -4.867 7.361 669 HA ALA 91 HA ALA 91 29.627 -4.690 4.981 670 HB1 ALA 91 HB1 ALA 91 27.865 -6.396 4.962 671 HB2 ALA 91 HB2 ALA 91 26.650 -5.134 5.165 672 HB3 ALA 91 HB3 ALA 91 27.627 -5.190 3.698 673 H GLU 92 H GLU 92 29.875 -2.838 3.903 674 HA GLU 92 HA GLU 92 28.173 -0.562 4.673 675 HB2 GLU 92 HB2 GLU 92 30.097 0.826 3.779 676 HB3 GLU 92 HB3 GLU 92 30.413 -0.070 5.258 677 HG2 GLU 92 HG2 GLU 92 31.760 -1.631 4.167 678 HG3 GLU 92 HG3 GLU 92 31.147 -1.180 2.577 679 H VAL 93 H VAL 93 27.704 1.027 2.991 680 HA VAL 93 HA VAL 93 27.543 -0.199 0.314 681 HB VAL 93 HB VAL 93 25.517 1.626 1.617 682 HG11 VAL 93 HG11 VAL 93 24.386 0.512 -0.643 683 HG12 VAL 93 HG12 VAL 93 24.972 2.168 -0.477 684 HG13 VAL 93 HG13 VAL 93 26.023 0.923 -1.154 685 HG21 VAL 93 HG21 VAL 93 25.640 -1.325 1.163 686 HG22 VAL 93 HG22 VAL 93 25.116 -0.430 2.590 687 HG23 VAL 93 HG23 VAL 93 24.080 -0.502 1.166 688 H VAL 94 H VAL 94 28.873 0.827 -1.022 689 HA VAL 94 HA VAL 94 28.969 3.768 -0.919 690 HB VAL 94 HB VAL 94 31.318 1.937 -1.434 691 HG11 VAL 94 HG11 VAL 94 32.296 4.477 -1.084 692 HG12 VAL 94 HG12 VAL 94 32.081 3.663 -2.635 693 HG13 VAL 94 HG13 VAL 94 30.832 4.752 -2.029 694 HG21 VAL 94 HG21 VAL 94 31.523 3.883 0.725 695 HG22 VAL 94 HG22 VAL 94 30.252 2.689 0.988 696 HG23 VAL 94 HG23 VAL 94 31.911 2.163 0.711 697 H PHE 95 H PHE 95 27.955 4.427 -2.701 698 HA PHE 95 HA PHE 95 28.704 3.176 -5.258 699 HB2 PHE 95 HB2 PHE 95 25.966 3.981 -4.288 700 HB3 PHE 95 HB3 PHE 95 26.327 3.783 -6.000 701 HD1 PHE 95 HD2 PHE 95 27.625 1.479 -6.509 702 HD2 PHE 95 HD1 PHE 95 25.005 2.197 -3.232 703 HE1 PHE 95 HE2 PHE 95 27.206 -0.938 -6.317 704 HE2 PHE 95 HE1 PHE 95 24.584 -0.218 -3.034 705 HZ PHE 95 HZ PHE 95 25.684 -1.790 -4.578 706 H THR 96 H THR 96 29.293 4.535 -6.845 707 HA THR 96 HA THR 96 29.065 7.419 -6.301 708 HB THR 96 HB THR 96 31.373 6.762 -6.404 709 HG1 THR 96 HG1 THR 96 31.021 7.815 -8.985 710 HG21 THR 96 HG21 THR 96 32.145 5.858 -8.752 711 HG22 THR 96 HG22 THR 96 30.487 5.262 -8.827 712 HG23 THR 96 HG23 THR 96 31.550 4.754 -7.514 713 H ALA 97 H ALA 97 28.335 8.811 -7.878 714 HA ALA 97 HA ALA 97 26.644 7.643 -9.900 715 HB1 ALA 97 HB1 ALA 97 26.884 10.493 -10.141 716 HB2 ALA 97 HB2 ALA 97 25.492 9.525 -9.656 717 HB3 ALA 97 HB3 ALA 97 26.668 10.041 -8.449 718 H ASN 98 H ASN 98 26.718 8.239 -12.157 719 HA ASN 98 HA ASN 98 27.747 8.449 -14.175 720 HB2 ASN 98 HB2 ASN 98 29.941 10.009 -12.823 721 HB3 ASN 98 HB3 ASN 98 29.339 10.168 -14.470 722 HD21 ASN 98 HD21 ASN 98 26.663 10.319 -14.133 723 HD22 ASN 98 HD22 ASN 98 26.251 11.731 -13.226 724 H ASP 99 H ASP 99 28.243 6.119 -12.793 725 HA ASP 99 HA ASP 99 30.716 5.288 -14.011 726 HB2 ASP 99 HB2 ASP 99 31.326 6.222 -11.709 727 HB3 ASP 99 HB3 ASP 99 30.463 4.841 -11.040 728 H SER 100 H SER 100 31.013 2.945 -13.914 729 HA SER 100 HA SER 100 28.662 1.546 -14.466 730 HB2 SER 100 HB2 SER 100 30.926 0.884 -15.260 731 HB3 SER 100 HB3 SER 100 31.321 0.367 -13.620 732 HG SER 100 HG SER 100 30.424 -1.451 -14.130 733 H GLY 101 H GLY 101 27.088 1.333 -12.989 734 HA2 GLY 101 HA2 GLY 101 27.401 -0.446 -10.810 735 HA3 GLY 101 HA3 GLY 101 27.389 1.209 -10.220 736 HA PRO 102 HA PRO 102 23.022 -0.537 -10.883 737 HB2 PRO 102 HB2 PRO 102 22.342 -0.839 -8.272 738 HB3 PRO 102 HB3 PRO 102 23.093 -2.126 -9.224 739 HG2 PRO 102 HG2 PRO 102 24.351 -0.228 -7.281 740 HG3 PRO 102 HG3 PRO 102 24.621 -1.969 -7.478 741 HD2 PRO 102 HD2 PRO 102 26.315 -0.109 -8.480 742 HD3 PRO 102 HD3 PRO 102 26.037 -1.673 -9.273 743 H ARG 103 H ARG 103 24.514 1.833 -8.797 744 HA ARG 103 HA ARG 103 23.891 3.911 -8.113 745 HB2 ARG 103 HB2 ARG 103 22.107 3.638 -10.536 746 HB3 ARG 103 HB3 ARG 103 22.284 5.131 -9.622 747 HG2 ARG 103 HG2 ARG 103 24.694 5.124 -10.124 748 HG3 ARG 103 HG3 ARG 103 24.463 3.671 -11.100 749 HD2 ARG 103 HD2 ARG 103 24.362 5.301 -12.714 750 HD3 ARG 103 HD3 ARG 103 22.656 5.132 -12.303 751 HE ARG 103 HE ARG 103 23.936 7.131 -10.726 752 HH11 ARG 103 HH11 ARG 103 22.551 6.500 -13.856 753 HH12 ARG 103 HH12 ARG 103 22.149 8.158 -14.157 754 HH21 ARG 103 HH21 ARG 103 23.414 9.318 -11.110 755 HH22 ARG 103 HH22 ARG 103 22.642 9.760 -12.595 756 H ARG 104 H ARG 104 22.770 1.930 -6.630 757 HA ARG 104 HA ARG 104 19.939 2.122 -6.417 758 HB2 ARG 104 HB2 ARG 104 21.495 0.235 -5.599 759 HB3 ARG 104 HB3 ARG 104 21.760 1.251 -4.188 760 HG2 ARG 104 HG2 ARG 104 20.063 -0.280 -3.607 761 HG3 ARG 104 HG3 ARG 104 19.264 1.272 -3.871 762 HD2 ARG 104 HD2 ARG 104 18.270 0.582 -5.826 763 HD3 ARG 104 HD3 ARG 104 19.506 -0.634 -6.148 764 HE ARG 104 HE ARG 104 18.193 -1.458 -3.866 765 HH11 ARG 104 HH11 ARG 104 17.368 -0.805 -7.184 766 HH12 ARG 104 HH12 ARG 104 16.076 -1.959 -7.226 767 HH21 ARG 104 HH21 ARG 104 16.496 -2.981 -3.908 768 HH22 ARG 104 HH22 ARG 104 15.581 -3.195 -5.362 769 H TYR 105 H TYR 105 18.717 3.067 -4.707 770 HA TYR 105 HA TYR 105 19.942 5.532 -3.688 771 HB2 TYR 105 HB2 TYR 105 16.999 4.865 -3.742 772 HB3 TYR 105 HB3 TYR 105 17.744 6.447 -3.539 773 HD1 TYR 105 HD2 TYR 105 19.291 7.185 -5.566 774 HD2 TYR 105 HD1 TYR 105 16.163 4.312 -5.821 775 HE1 TYR 105 HE2 TYR 105 19.144 7.569 -7.991 776 HE2 TYR 105 HE1 TYR 105 16.007 4.688 -8.247 777 HH TYR 105 HH TYR 105 17.256 7.282 -9.790 778 H THR 106 H THR 106 18.011 2.746 -2.679 779 HA THR 106 HA THR 106 18.177 3.537 0.115 780 HB THR 106 HB THR 106 16.913 1.102 -1.157 781 HG1 THR 106 HG1 THR 106 15.187 2.321 -1.336 782 HG21 THR 106 HG21 THR 106 17.318 0.413 1.022 783 HG22 THR 106 HG22 THR 106 15.710 1.127 1.152 784 HG23 THR 106 HG23 THR 106 17.126 2.037 1.679 785 H ILE 107 H ILE 107 19.351 2.503 1.681 786 HA ILE 107 HA ILE 107 21.593 0.916 0.746 787 HB ILE 107 HB ILE 107 20.948 1.946 3.511 788 HG12 ILE 107 HG12 ILE 107 23.116 3.326 2.790 789 HG13 ILE 107 HG13 ILE 107 22.458 3.033 1.184 790 HG21 ILE 107 HG21 ILE 107 22.810 -0.029 2.650 791 HG22 ILE 107 HG22 ILE 107 23.702 1.396 3.183 792 HG23 ILE 107 HG23 ILE 107 22.553 0.617 4.271 793 HD11 ILE 107 HD11 ILE 107 20.476 4.202 1.679 794 HD12 ILE 107 HD12 ILE 107 20.836 4.229 3.406 795 HD13 ILE 107 HD13 ILE 107 21.800 5.195 2.289 796 H ALA 108 H ALA 108 21.236 -1.192 0.464 797 HA ALA 108 HA ALA 108 19.408 -2.623 2.229 798 HB1 ALA 108 HB1 ALA 108 20.836 -3.450 -0.292 799 HB2 ALA 108 HB2 ALA 108 19.794 -4.517 0.650 800 HB3 ALA 108 HB3 ALA 108 19.123 -3.070 -0.102 801 H ALA 109 H ALA 109 20.216 -3.369 4.075 802 HA ALA 109 HA ALA 109 22.849 -4.685 4.015 803 HB1 ALA 109 HB1 ALA 109 21.799 -2.774 6.089 804 HB2 ALA 109 HB2 ALA 109 23.170 -3.848 6.370 805 HB3 ALA 109 HB3 ALA 109 23.255 -2.621 5.106 806 H MET 110 H MET 110 22.572 -6.774 4.409 807 HA MET 110 HA MET 110 20.405 -7.598 6.221 808 HB2 MET 110 HB2 MET 110 21.752 -9.024 3.933 809 HB3 MET 110 HB3 MET 110 20.742 -9.865 5.102 810 HG2 MET 110 HG2 MET 110 18.952 -8.128 4.487 811 HG3 MET 110 HG3 MET 110 19.961 -7.806 3.080 812 HE1 MET 110 HE1 MET 110 17.866 -11.656 4.236 813 HE2 MET 110 HE2 MET 110 18.163 -10.209 5.200 814 HE3 MET 110 HE3 MET 110 16.843 -10.233 4.028 815 H LEU 111 H LEU 111 20.925 -8.458 8.121 816 HA LEU 111 HA LEU 111 23.726 -9.006 8.700 817 HB2 LEU 111 HB2 LEU 111 21.379 -9.062 10.586 818 HB3 LEU 111 HB3 LEU 111 23.089 -9.010 11.012 819 HG LEU 111 HG LEU 111 22.409 -6.840 11.408 820 HD11 LEU 111 HD11 LEU 111 23.194 -6.665 8.508 821 HD12 LEU 111 HD12 LEU 111 24.335 -6.994 9.812 822 HD13 LEU 111 HD13 LEU 111 23.454 -5.466 9.775 823 HD21 LEU 111 HD21 LEU 111 20.937 -6.535 8.831 824 HD22 LEU 111 HD22 LEU 111 20.708 -5.694 10.365 825 HD23 LEU 111 HD23 LEU 111 20.160 -7.361 10.181 826 H SER 112 H SER 112 23.307 -10.919 7.119 827 HA SER 112 HA SER 112 21.849 -13.167 7.844 828 HB2 SER 112 HB2 SER 112 24.455 -13.763 6.616 829 HB3 SER 112 HB3 SER 112 22.828 -14.130 6.045 830 HG SER 112 HG SER 112 23.714 -12.647 4.648 831 HA PRO 113 HA PRO 113 23.878 -15.021 11.264 832 HB2 PRO 113 HB2 PRO 113 23.633 -17.664 10.692 833 HB3 PRO 113 HB3 PRO 113 22.268 -16.660 11.192 834 HG2 PRO 113 HG2 PRO 113 23.077 -17.520 8.442 835 HG3 PRO 113 HG3 PRO 113 21.459 -17.459 9.164 836 HD2 PRO 113 HD2 PRO 113 22.377 -15.543 7.486 837 HD3 PRO 113 HD3 PRO 113 21.247 -15.192 8.809 838 H TYR 114 H TYR 114 25.523 -16.866 11.775 839 HA TYR 114 HA TYR 114 27.765 -16.551 9.899 840 HB2 TYR 114 HB2 TYR 114 28.195 -15.644 12.120 841 HB3 TYR 114 HB3 TYR 114 27.767 -17.184 12.858 842 HD1 TYR 114 HD1 TYR 114 29.858 -16.611 9.839 843 HD2 TYR 114 HD2 TYR 114 29.761 -17.811 13.920 844 HE1 TYR 114 HE1 TYR 114 32.202 -17.335 9.675 845 HE2 TYR 114 HE2 TYR 114 32.106 -18.538 13.768 846 HH TYR 114 HH TYR 114 34.138 -17.674 11.258 847 H SER 115 H SER 115 28.781 -18.287 9.045 848 HA SER 115 HA SER 115 27.499 -20.711 8.751 849 HB2 SER 115 HB2 SER 115 29.982 -21.521 8.260 850 HB3 SER 115 HB3 SER 115 29.143 -20.423 7.164 851 HG SER 115 HG SER 115 30.895 -19.277 7.499 852 H TYR 116 H TYR 116 30.592 -20.491 10.492 853 HA TYR 116 HA TYR 116 30.014 -22.854 11.999 854 HB2 TYR 116 HB2 TYR 116 32.274 -20.874 11.969 855 HB3 TYR 116 HB3 TYR 116 32.172 -22.097 13.231 856 HD1 TYR 116 HD1 TYR 116 31.804 -24.563 12.331 857 HD2 TYR 116 HD2 TYR 116 33.460 -21.375 10.053 858 HE1 TYR 116 HE1 TYR 116 32.882 -26.196 10.842 859 HE2 TYR 116 HE2 TYR 116 34.542 -22.999 8.556 860 HH TYR 116 HH TYR 116 35.322 -25.423 8.725 861 H SER 117 H SER 117 30.723 -22.580 14.501 862 HA SER 117 HA SER 117 28.633 -20.889 15.624 863 HB2 SER 117 HB2 SER 117 29.437 -22.141 17.783 864 HB3 SER 117 HB3 SER 117 28.488 -23.007 16.574 865 HG SER 117 HG SER 117 30.261 -24.067 15.914 866 H THR 118 H THR 118 32.056 -21.586 16.348 867 HA THR 118 HA THR 118 32.644 -18.800 16.719 868 HB THR 118 HB THR 118 33.030 -20.507 19.167 869 HG1 THR 118 HG1 THR 118 31.111 -19.227 19.912 870 HG21 THR 118 HG21 THR 118 34.364 -18.629 19.372 871 HG22 THR 118 HG22 THR 118 32.872 -18.085 20.138 872 HG23 THR 118 HG23 THR 118 33.239 -17.604 18.482 873 H THR 119 H THR 119 34.631 -18.527 15.968 874 HA THR 119 HA THR 119 36.417 -20.815 15.749 875 HB THR 119 HB THR 119 36.946 -18.017 14.752 876 HG1 THR 119 HG1 THR 119 35.505 -18.367 13.251 877 HG21 THR 119 HG21 THR 119 38.850 -18.890 13.997 878 HG22 THR 119 HG22 THR 119 37.945 -20.094 13.081 879 HG23 THR 119 HG23 THR 119 38.434 -20.434 14.741 880 H ALA 120 H ALA 120 36.978 -17.399 16.614 881 HA ALA 120 HA ALA 120 38.084 -17.953 19.152 882 HB1 ALA 120 HB1 ALA 120 39.827 -18.560 17.071 883 HB2 ALA 120 HB2 ALA 120 40.369 -16.995 17.675 884 HB3 ALA 120 HB3 ALA 120 40.235 -18.366 18.776 885 H VAL 121 H VAL 121 38.461 -16.094 20.315 886 HA VAL 121 HA VAL 121 37.256 -13.719 19.423 887 HB VAL 121 HB VAL 121 37.414 -14.243 21.793 888 HG11 VAL 121 HG11 VAL 121 39.741 -15.258 21.547 889 HG12 VAL 121 HG12 VAL 121 40.347 -13.608 21.703 890 HG13 VAL 121 HG13 VAL 121 39.415 -14.335 23.013 891 HG21 VAL 121 HG21 VAL 121 39.070 -11.836 21.825 892 HG22 VAL 121 HG22 VAL 121 37.746 -11.771 20.662 893 HG23 VAL 121 HG23 VAL 121 37.408 -12.076 22.365 894 H VAL 122 H VAL 122 38.010 -11.956 18.407 895 HA VAL 122 HA VAL 122 40.810 -11.298 18.344 896 HB VAL 122 HB VAL 122 40.692 -13.027 16.584 897 HG11 VAL 122 HG11 VAL 122 38.241 -11.879 15.994 898 HG12 VAL 122 HG12 VAL 122 39.270 -11.421 14.635 899 HG13 VAL 122 HG13 VAL 122 39.070 -13.122 15.058 900 HG21 VAL 122 HG21 VAL 122 41.987 -10.667 16.500 901 HG22 VAL 122 HG22 VAL 122 42.164 -11.923 15.275 902 HG23 VAL 122 HG23 VAL 122 41.067 -10.570 14.997 903 H THR 123 H THR 123 41.201 -9.194 17.660 904 HA THR 123 HA THR 123 38.804 -7.604 17.012 905 HB THR 123 HB THR 123 41.116 -6.391 18.477 906 HG1 THR 123 HG1 THR 123 40.621 -8.077 19.831 907 HG21 THR 123 HG21 THR 123 38.485 -5.588 19.307 908 HG22 THR 123 HG22 THR 123 38.615 -5.504 17.550 909 HG23 THR 123 HG23 THR 123 39.760 -4.625 18.563 910 H ASN 124 H ASN 124 42.363 -7.296 17.008 911 HA ASN 124 HA ASN 124 43.801 -6.363 15.510 912 HB2 ASN 124 HB2 ASN 124 41.745 -7.627 13.712 913 HB3 ASN 124 HB3 ASN 124 43.137 -6.777 13.050 914 HD21 ASN 124 HD21 ASN 124 42.426 -9.582 12.851 915 HD22 ASN 124 HD22 ASN 124 43.751 -10.467 13.518 916 HA PRO 125 HA PRO 125 41.187 -2.534 15.181 917 HB2 PRO 125 HB2 PRO 125 42.888 -0.965 16.599 918 HB3 PRO 125 HB3 PRO 125 41.631 -1.947 17.358 919 HG2 PRO 125 HG2 PRO 125 44.553 -2.519 17.053 920 HG3 PRO 125 HG3 PRO 125 43.505 -2.767 18.463 921 HD2 PRO 125 HD2 PRO 125 44.208 -4.782 16.797 922 HD3 PRO 125 HD3 PRO 125 42.643 -4.736 17.631 923 H LYS 126 H LYS 126 42.141 -0.238 14.602 924 HA LYS 126 HA LYS 126 43.556 -0.567 12.147 925 HB2 LYS 126 HB2 LYS 126 43.096 1.672 11.743 926 HB3 LYS 126 HB3 LYS 126 41.772 1.207 12.803 927 HG2 LYS 126 HG2 LYS 126 44.286 2.598 13.701 928 HG3 LYS 126 HG3 LYS 126 42.746 3.395 13.372 929 HD2 LYS 126 HD2 LYS 126 43.183 1.234 15.434 930 HD3 LYS 126 HD3 LYS 126 43.095 2.963 15.775 931 HE2 LYS 126 HE2 LYS 126 40.909 1.253 14.592 932 HE3 LYS 126 HE3 LYS 126 40.962 1.895 16.233 933 HZ1 LYS 126 HZ1 LYS 126 40.600 3.377 13.701 934 HZ2 LYS 126 HZ2 LYS 126 41.068 4.157 15.126 935 HZ3 LYS 126 HZ3 LYS 126 39.586 3.344 15.055 936 H GLU 127 H GLU 127 44.536 -0.166 15.367 937 HA GLU 127 HA GLU 127 47.051 1.135 14.736 938 HB2 GLU 127 HB2 GLU 127 45.952 0.011 17.316 939 HB3 GLU 127 HB3 GLU 127 47.513 0.809 17.174 940 HG2 GLU 127 HG2 GLU 127 46.223 2.801 16.252 941 HG3 GLU 127 HG3 GLU 127 44.778 1.990 16.853 Start of MODEL 11 1 H1 GLY 1 H GLY 1 4.075 20.384 8.353 2 HA2 GLY 1 HA2 GLY 1 3.353 20.766 5.531 3 HA3 GLY 1 HA3 GLY 1 4.821 21.522 6.136 4 HA PRO 2 HA PRO 2 5.460 16.709 6.288 5 HB2 PRO 2 HB2 PRO 2 3.719 15.260 4.790 6 HB3 PRO 2 HB3 PRO 2 3.446 15.623 6.498 7 HG2 PRO 2 HG2 PRO 2 2.319 16.968 4.072 8 HG3 PRO 2 HG3 PRO 2 1.503 16.512 5.578 9 HD2 PRO 2 HD2 PRO 2 2.318 19.043 5.073 10 HD3 PRO 2 HD3 PRO 2 2.288 18.360 6.710 11 H THR 3 H THR 3 5.724 14.958 4.337 12 HA THR 3 HA THR 3 7.554 16.022 2.569 13 HB THR 3 HB THR 3 7.463 13.961 1.339 14 HG1 THR 3 HG1 THR 3 5.062 13.301 2.714 15 HG21 THR 3 HG21 THR 3 7.926 12.431 3.048 16 HG22 THR 3 HG22 THR 3 6.729 13.139 4.132 17 HG23 THR 3 HG23 THR 3 8.232 13.997 3.796 18 H GLY 4 H GLY 4 7.510 16.510 0.339 19 HA2 GLY 4 HA2 GLY 4 5.473 18.163 -0.537 20 HA3 GLY 4 HA3 GLY 4 6.642 17.390 -1.597 21 H THR 5 H THR 5 6.088 14.853 -1.719 22 HA THR 5 HA THR 5 3.222 14.684 -2.391 23 HB THR 5 HB THR 5 3.932 13.030 -4.172 24 HG1 THR 5 HG1 THR 5 6.062 12.937 -4.725 25 HG21 THR 5 HG21 THR 5 3.340 14.916 -5.260 26 HG22 THR 5 HG22 THR 5 5.076 15.095 -5.514 27 HG23 THR 5 HG23 THR 5 4.285 15.951 -4.190 28 H GLY 6 H GLY 6 2.108 12.972 -1.633 29 HA2 GLY 6 HA2 GLY 6 3.542 11.118 0.112 30 HA3 GLY 6 HA3 GLY 6 1.802 11.357 0.056 31 H GLU 7 H GLU 7 3.544 10.935 -2.906 32 HA GLU 7 HA GLU 7 2.461 8.202 -3.110 33 HB2 GLU 7 HB2 GLU 7 1.422 10.012 -4.581 34 HB3 GLU 7 HB3 GLU 7 2.953 10.045 -5.443 35 HG2 GLU 7 HG2 GLU 7 2.011 8.507 -6.753 36 HG3 GLU 7 HG3 GLU 7 2.401 7.388 -5.448 37 H SER 8 H SER 8 5.154 9.293 -2.253 38 HA SER 8 HA SER 8 6.733 7.336 -3.638 39 HB2 SER 8 HB2 SER 8 7.713 10.178 -3.857 40 HB3 SER 8 HB3 SER 8 8.309 8.745 -4.695 41 HG SER 8 HG SER 8 7.054 9.878 -6.131 42 H LYS 9 H LYS 9 8.699 6.882 -2.593 43 HA LYS 9 HA LYS 9 8.720 7.564 0.200 44 HB2 LYS 9 HB2 LYS 9 10.397 5.789 -1.549 45 HB3 LYS 9 HB3 LYS 9 10.889 6.146 0.101 46 HG2 LYS 9 HG2 LYS 9 9.731 4.097 0.179 47 HG3 LYS 9 HG3 LYS 9 8.628 5.311 0.835 48 HD2 LYS 9 HD2 LYS 9 7.467 3.795 -0.688 49 HD3 LYS 9 HD3 LYS 9 7.487 5.441 -1.325 50 HE2 LYS 9 HE2 LYS 9 8.541 4.775 -3.166 51 HE3 LYS 9 HE3 LYS 9 9.808 4.000 -2.216 52 HZ1 LYS 9 HZ1 LYS 9 7.772 2.788 -3.705 53 HZ2 LYS 9 HZ2 LYS 9 7.515 2.406 -2.078 54 HZ3 LYS 9 HZ3 LYS 9 8.998 2.044 -2.808 55 H CYS 10 H CYS 10 10.778 8.240 1.280 56 HA CYS 10 HA CYS 10 11.579 10.759 0.432 57 HB2 CYS 10 HB2 CYS 10 12.591 8.800 2.435 58 HB3 CYS 10 HB3 CYS 10 13.644 10.141 2.006 59 HG CYS 10 HG CYS 10 11.918 10.401 4.420 60 HA PRO 11 HA PRO 11 14.734 10.236 -2.569 61 HB2 PRO 11 HB2 PRO 11 16.539 12.138 -1.864 62 HB3 PRO 11 HB3 PRO 11 14.970 12.521 -2.582 63 HG2 PRO 11 HG2 PRO 11 15.802 12.584 0.293 64 HG3 PRO 11 HG3 PRO 11 14.827 13.754 -0.616 65 HD2 PRO 11 HD2 PRO 11 13.728 11.910 1.035 66 HD3 PRO 11 HD3 PRO 11 12.909 12.489 -0.431 67 H LEU 12 H LEU 12 15.684 10.126 0.800 68 HA LEU 12 HA LEU 12 17.694 8.119 0.145 69 HB2 LEU 12 HB2 LEU 12 18.826 10.344 0.230 70 HB3 LEU 12 HB3 LEU 12 18.333 10.471 1.916 71 HG LEU 12 HG LEU 12 20.725 9.753 1.464 72 HD11 LEU 12 HD11 LEU 12 19.761 7.554 3.056 73 HD12 LEU 12 HD12 LEU 12 18.905 9.044 3.452 74 HD13 LEU 12 HD13 LEU 12 20.664 8.987 3.546 75 HD21 LEU 12 HD21 LEU 12 19.882 8.121 -0.364 76 HD22 LEU 12 HD22 LEU 12 19.578 7.030 0.988 77 HD23 LEU 12 HD23 LEU 12 21.211 7.626 0.685 78 H MET 13 H MET 13 17.125 6.418 1.320 79 HA MET 13 HA MET 13 16.452 6.829 4.149 80 HB2 MET 13 HB2 MET 13 14.716 5.073 3.974 81 HB3 MET 13 HB3 MET 13 14.340 6.497 3.015 82 HG2 MET 13 HG2 MET 13 14.536 5.399 1.045 83 HG3 MET 13 HG3 MET 13 15.779 4.307 1.651 84 HE1 MET 13 HE1 MET 13 14.159 3.098 4.379 85 HE2 MET 13 HE2 MET 13 13.827 1.594 3.520 86 HE3 MET 13 HE3 MET 13 15.363 2.427 3.278 87 H VAL 14 H VAL 14 17.019 5.130 5.543 88 HA VAL 14 HA VAL 14 19.056 3.332 4.438 89 HB VAL 14 HB VAL 14 18.520 4.139 7.299 90 HG11 VAL 14 HG11 VAL 14 20.686 2.391 6.138 91 HG12 VAL 14 HG12 VAL 14 20.633 2.975 7.803 92 HG13 VAL 14 HG13 VAL 14 19.384 1.878 7.211 93 HG21 VAL 14 HG21 VAL 14 20.072 5.318 5.171 94 HG22 VAL 14 HG22 VAL 14 19.710 5.948 6.778 95 HG23 VAL 14 HG23 VAL 14 21.096 4.881 6.539 96 H LYS 15 H LYS 15 18.639 1.243 4.201 97 HA LYS 15 HA LYS 15 16.430 0.066 5.758 98 HB2 LYS 15 HB2 LYS 15 15.767 0.153 3.460 99 HB3 LYS 15 HB3 LYS 15 17.316 -0.485 2.925 100 HG2 LYS 15 HG2 LYS 15 15.654 -2.203 2.763 101 HG3 LYS 15 HG3 LYS 15 16.786 -2.617 4.052 102 HD2 LYS 15 HD2 LYS 15 14.480 -1.051 4.948 103 HD3 LYS 15 HD3 LYS 15 14.058 -2.629 4.277 104 HE2 LYS 15 HE2 LYS 15 16.131 -3.336 5.829 105 HE3 LYS 15 HE3 LYS 15 15.550 -1.939 6.735 106 HZ1 LYS 15 HZ1 LYS 15 14.338 -4.541 6.375 107 HZ2 LYS 15 HZ2 LYS 15 13.266 -3.240 6.231 108 HZ3 LYS 15 HZ3 LYS 15 14.174 -3.436 7.645 109 H VAL 16 H VAL 16 17.276 -1.148 7.321 110 HA VAL 16 HA VAL 16 19.496 -2.959 6.621 111 HB VAL 16 HB VAL 16 19.033 -1.639 9.299 112 HG11 VAL 16 HG11 VAL 16 21.476 -2.628 9.527 113 HG12 VAL 16 HG12 VAL 16 20.047 -3.589 9.915 114 HG13 VAL 16 HG13 VAL 16 20.853 -3.791 8.358 115 HG21 VAL 16 HG21 VAL 16 21.219 -1.181 7.271 116 HG22 VAL 16 HG22 VAL 16 19.876 -0.084 7.592 117 HG23 VAL 16 HG23 VAL 16 21.076 -0.401 8.846 118 H LEU 17 H LEU 17 18.958 -5.027 6.749 119 HA LEU 17 HA LEU 17 17.065 -5.893 8.812 120 HB2 LEU 17 HB2 LEU 17 15.685 -7.047 7.363 121 HB3 LEU 17 HB3 LEU 17 16.016 -5.555 6.486 122 HG LEU 17 HG LEU 17 17.978 -7.244 5.564 123 HD11 LEU 17 HD11 LEU 17 17.340 -9.308 6.202 124 HD12 LEU 17 HD12 LEU 17 16.236 -9.160 4.835 125 HD13 LEU 17 HD13 LEU 17 15.665 -8.827 6.470 126 HD21 LEU 17 HD21 LEU 17 15.359 -7.182 4.159 127 HD22 LEU 17 HD22 LEU 17 16.986 -6.912 3.534 128 HD23 LEU 17 HD23 LEU 17 16.180 -5.652 4.469 129 H ASP 18 H ASP 18 17.294 -8.060 9.474 130 HA ASP 18 HA ASP 18 19.975 -9.071 9.218 131 HB2 ASP 18 HB2 ASP 18 17.563 -9.805 10.828 132 HB3 ASP 18 HB3 ASP 18 18.862 -10.983 10.656 133 H ALA 19 H ALA 19 20.682 -10.578 7.855 134 HA ALA 19 HA ALA 19 18.862 -11.750 5.951 135 HB1 ALA 19 HB1 ALA 19 20.768 -11.272 4.829 136 HB2 ALA 19 HB2 ALA 19 21.795 -11.522 6.242 137 HB3 ALA 19 HB3 ALA 19 21.191 -12.909 5.334 138 H VAL 20 H VAL 20 19.578 -12.550 9.025 139 HA VAL 20 HA VAL 20 19.904 -15.407 8.685 140 HB VAL 20 HB VAL 20 19.393 -13.839 11.216 141 HG11 VAL 20 HG11 VAL 20 18.835 -16.232 11.358 142 HG12 VAL 20 HG12 VAL 20 20.474 -16.629 10.836 143 HG13 VAL 20 HG13 VAL 20 20.213 -15.803 12.373 144 HG21 VAL 20 HG21 VAL 20 21.432 -13.006 10.579 145 HG22 VAL 20 HG22 VAL 20 21.942 -14.446 11.459 146 HG23 VAL 20 HG23 VAL 20 21.877 -14.467 9.696 147 H ARG 21 H ARG 21 17.370 -13.152 9.668 148 HA ARG 21 HA ARG 21 15.447 -15.385 9.580 149 HB2 ARG 21 HB2 ARG 21 14.992 -12.813 11.076 150 HB3 ARG 21 HB3 ARG 21 14.141 -14.342 11.248 151 HG2 ARG 21 HG2 ARG 21 15.440 -14.562 13.062 152 HG3 ARG 21 HG3 ARG 21 16.644 -15.108 11.894 153 HD2 ARG 21 HD2 ARG 21 17.957 -13.478 12.652 154 HD3 ARG 21 HD3 ARG 21 16.865 -12.347 11.854 155 HE ARG 21 HE ARG 21 16.161 -11.670 13.912 156 HH11 ARG 21 HH11 ARG 21 17.599 -14.826 14.217 157 HH12 ARG 21 HH12 ARG 21 17.473 -14.859 15.944 158 HH21 ARG 21 HH21 ARG 21 15.990 -11.702 16.187 159 HH22 ARG 21 HH22 ARG 21 16.557 -13.083 17.064 160 H GLY 22 H GLY 22 16.311 -12.260 8.394 161 HA2 GLY 22 HA2 GLY 22 15.527 -11.384 6.348 162 HA3 GLY 22 HA3 GLY 22 14.102 -12.404 6.484 163 H SER 23 H SER 23 14.658 -10.951 9.424 164 HA SER 23 HA SER 23 12.529 -9.013 8.914 165 HB2 SER 23 HB2 SER 23 13.042 -8.908 11.620 166 HB3 SER 23 HB3 SER 23 11.819 -9.923 10.854 167 HG SER 23 HG SER 23 13.272 -11.080 12.248 168 HA PRO 24 HA PRO 24 15.025 -5.421 9.228 169 HB2 PRO 24 HB2 PRO 24 13.516 -3.765 10.761 170 HB3 PRO 24 HB3 PRO 24 13.099 -4.174 9.094 171 HG2 PRO 24 HG2 PRO 24 12.029 -5.312 11.647 172 HG3 PRO 24 HG3 PRO 24 11.155 -4.851 10.175 173 HD2 PRO 24 HD2 PRO 24 11.786 -7.420 10.748 174 HD3 PRO 24 HD3 PRO 24 11.703 -6.805 9.085 175 H ALA 25 H ALA 25 16.478 -4.289 10.535 176 HA ALA 25 HA ALA 25 16.940 -5.501 13.160 177 HB1 ALA 25 HB1 ALA 25 18.784 -3.710 11.587 178 HB2 ALA 25 HB2 ALA 25 19.189 -4.690 12.997 179 HB3 ALA 25 HB3 ALA 25 18.770 -5.471 11.472 180 H ILE 26 H ILE 26 16.861 -4.382 15.033 181 HA ILE 26 HA ILE 26 15.990 -1.578 14.864 182 HB ILE 26 HB ILE 26 15.368 -3.796 16.735 183 HG12 ILE 26 HG12 ILE 26 13.897 -2.636 14.895 184 HG13 ILE 26 HG13 ILE 26 13.179 -3.103 16.432 185 HG21 ILE 26 HG21 ILE 26 16.370 -2.381 18.330 186 HG22 ILE 26 HG22 ILE 26 15.683 -0.934 17.594 187 HG23 ILE 26 HG23 ILE 26 14.638 -2.071 18.446 188 HD11 ILE 26 HD11 ILE 26 12.476 -0.876 15.713 189 HD12 ILE 26 HD12 ILE 26 13.365 -0.828 17.235 190 HD13 ILE 26 HD13 ILE 26 14.158 -0.346 15.735 191 H ASN 27 H ASN 27 17.048 0.024 15.941 192 HA ASN 27 HA ASN 27 18.736 1.120 16.999 193 HB2 ASN 27 HB2 ASN 27 19.189 -1.479 18.478 194 HB3 ASN 27 HB3 ASN 27 19.705 0.127 18.984 195 HD21 ASN 27 HD21 ASN 27 17.351 1.515 18.294 196 HD22 ASN 27 HD22 ASN 27 16.109 1.032 19.394 197 H VAL 28 H VAL 28 19.479 0.497 14.592 198 HA VAL 28 HA VAL 28 22.114 -0.803 14.807 199 HB VAL 28 HB VAL 28 20.400 -0.408 12.350 200 HG11 VAL 28 HG11 VAL 28 22.698 -0.280 11.711 201 HG12 VAL 28 HG12 VAL 28 23.109 -1.676 12.710 202 HG13 VAL 28 HG13 VAL 28 22.107 -1.883 11.273 203 HG21 VAL 28 HG21 VAL 28 19.372 -2.253 13.064 204 HG22 VAL 28 HG22 VAL 28 20.871 -3.109 12.705 205 HG23 VAL 28 HG23 VAL 28 20.563 -2.518 14.337 206 H ALA 29 H ALA 29 23.666 0.667 15.038 207 HA ALA 29 HA ALA 29 23.501 3.379 14.440 208 HB1 ALA 29 HB1 ALA 29 25.427 1.631 15.517 209 HB2 ALA 29 HB2 ALA 29 26.218 2.518 14.213 210 HB3 ALA 29 HB3 ALA 29 25.434 3.395 15.527 211 H VAL 30 H VAL 30 23.690 4.540 12.630 212 HA VAL 30 HA VAL 30 24.986 3.345 10.285 213 HB VAL 30 HB VAL 30 22.311 4.742 10.143 214 HG11 VAL 30 HG11 VAL 30 24.269 3.789 8.151 215 HG12 VAL 30 HG12 VAL 30 22.575 3.436 7.809 216 HG13 VAL 30 HG13 VAL 30 23.097 5.103 8.054 217 HG21 VAL 30 HG21 VAL 30 21.885 2.205 9.249 218 HG22 VAL 30 HG22 VAL 30 23.023 1.929 10.568 219 HG23 VAL 30 HG23 VAL 30 21.507 2.776 10.874 220 H HIS 31 H HIS 31 26.284 4.719 9.237 221 HA HIS 31 HA HIS 31 25.966 7.602 9.745 222 HB2 HIS 31 HB2 HIS 31 28.643 6.257 9.402 223 HB3 HIS 31 HB3 HIS 31 28.314 7.889 9.975 224 HD1 HIS 31 HD1 HIS 31 26.236 7.270 12.153 225 HD2 HIS 31 HD2 HIS 31 29.755 5.128 11.613 226 HE1 HIS 31 HE1 HIS 31 26.719 6.197 14.376 227 H VAL 32 H VAL 32 25.518 8.636 7.925 228 HA VAL 32 HA VAL 32 26.317 7.465 5.365 229 HB VAL 32 HB VAL 32 24.528 9.855 5.798 230 HG11 VAL 32 HG11 VAL 32 23.820 8.422 3.501 231 HG12 VAL 32 HG12 VAL 32 24.630 9.988 3.581 232 HG13 VAL 32 HG13 VAL 32 25.581 8.506 3.486 233 HG21 VAL 32 HG21 VAL 32 22.630 8.368 5.628 234 HG22 VAL 32 HG22 VAL 32 23.699 6.974 5.459 235 HG23 VAL 32 HG23 VAL 32 23.650 7.869 6.977 236 H PHE 33 H PHE 33 27.791 8.355 4.043 237 HA PHE 33 HA PHE 33 28.833 11.023 4.723 238 HB2 PHE 33 HB2 PHE 33 30.353 8.490 4.156 239 HB3 PHE 33 HB3 PHE 33 31.086 10.068 3.889 240 HD1 PHE 33 HD1 PHE 33 29.341 8.081 6.506 241 HD2 PHE 33 HD2 PHE 33 32.178 11.128 5.624 242 HE1 PHE 33 HE1 PHE 33 29.956 8.193 8.886 243 HE2 PHE 33 HE2 PHE 33 32.799 11.245 8.002 244 HZ PHE 33 HZ PHE 33 31.686 9.776 9.636 245 H ARG 34 H ARG 34 30.086 12.009 2.897 246 HA ARG 34 HA ARG 34 29.085 11.141 0.274 247 HB2 ARG 34 HB2 ARG 34 27.682 12.994 1.055 248 HB3 ARG 34 HB3 ARG 34 29.115 13.983 1.303 249 HG2 ARG 34 HG2 ARG 34 28.864 12.892 -1.400 250 HG3 ARG 34 HG3 ARG 34 27.571 13.997 -0.932 251 HD2 ARG 34 HD2 ARG 34 29.416 15.567 -0.151 252 HD3 ARG 34 HD3 ARG 34 30.529 14.516 -1.024 253 HE ARG 34 HE ARG 34 28.808 16.471 -2.149 254 HH11 ARG 34 HH11 ARG 34 30.166 13.319 -2.733 255 HH12 ARG 34 HH12 ARG 34 30.085 13.460 -4.458 256 HH21 ARG 34 HH21 ARG 34 28.695 16.668 -4.419 257 HH22 ARG 34 HH22 ARG 34 29.249 15.366 -5.416 258 H LYS 35 H LYS 35 30.393 11.700 -1.511 259 HA LYS 35 HA LYS 35 33.174 11.632 -1.005 260 HB2 LYS 35 HB2 LYS 35 32.607 10.641 -3.019 261 HB3 LYS 35 HB3 LYS 35 31.470 11.913 -3.445 262 HG2 LYS 35 HG2 LYS 35 33.409 11.977 -4.892 263 HG3 LYS 35 HG3 LYS 35 33.336 13.430 -3.892 264 HD2 LYS 35 HD2 LYS 35 35.588 12.769 -3.829 265 HD3 LYS 35 HD3 LYS 35 34.912 12.205 -2.299 266 HE2 LYS 35 HE2 LYS 35 36.183 10.401 -3.088 267 HE3 LYS 35 HE3 LYS 35 34.518 9.984 -3.493 268 HZ1 LYS 35 HZ1 LYS 35 36.608 9.984 -5.219 269 HZ2 LYS 35 HZ2 LYS 35 35.850 11.455 -5.566 270 HZ3 LYS 35 HZ3 LYS 35 34.976 10.010 -5.659 271 H ALA 36 H ALA 36 34.255 13.292 -0.164 272 HA ALA 36 HA ALA 36 33.437 16.012 -0.487 273 HB1 ALA 36 HB1 ALA 36 34.954 16.507 1.125 274 HB2 ALA 36 HB2 ALA 36 34.829 14.772 1.421 275 HB3 ALA 36 HB3 ALA 36 36.172 15.410 0.473 276 H ALA 37 H ALA 37 34.820 17.717 -1.359 277 HA ALA 37 HA ALA 37 35.557 17.249 -4.020 278 HB1 ALA 37 HB1 ALA 37 35.014 19.461 -2.641 279 HB2 ALA 37 HB2 ALA 37 36.775 19.558 -2.621 280 HB3 ALA 37 HB3 ALA 37 35.914 19.486 -4.159 281 H ASP 38 H ASP 38 37.303 16.811 -1.094 282 HA ASP 38 HA ASP 38 39.886 16.774 -2.454 283 HB2 ASP 38 HB2 ASP 38 39.115 17.500 0.116 284 HB3 ASP 38 HB3 ASP 38 39.901 15.940 0.337 285 H ASP 39 H ASP 39 37.613 14.750 -2.729 286 HA ASP 39 HA ASP 39 37.409 12.511 -3.076 287 HB2 ASP 39 HB2 ASP 39 39.570 12.880 -4.287 288 HB3 ASP 39 HB3 ASP 39 40.420 12.434 -2.809 289 H THR 40 H THR 40 37.093 13.449 -0.447 290 HA THR 40 HA THR 40 38.062 11.134 1.100 291 HB THR 40 HB THR 40 38.269 12.444 3.058 292 HG1 THR 40 HG1 THR 40 37.585 14.660 3.080 293 HG21 THR 40 HG21 THR 40 40.138 12.743 1.530 294 HG22 THR 40 HG22 THR 40 39.830 14.241 2.411 295 HG23 THR 40 HG23 THR 40 39.301 14.077 0.737 296 H TRP 41 H TRP 41 36.629 11.090 3.267 297 HA TRP 41 HA TRP 41 33.858 10.897 2.314 298 HB2 TRP 41 HB2 TRP 41 35.372 9.459 4.485 299 HB3 TRP 41 HB3 TRP 41 33.614 9.415 4.395 300 HD1 TRP 41 HD1 TRP 41 35.600 9.325 1.151 301 HE1 TRP 41 HE1 TRP 41 35.350 6.995 0.084 302 HE3 TRP 41 HE3 TRP 41 33.231 6.923 4.992 303 HZ2 TRP 41 HZ2 TRP 41 34.287 4.474 0.778 304 HZ3 TRP 41 HZ3 TRP 41 32.631 4.553 4.709 305 HH2 TRP 41 HH2 TRP 41 33.149 3.357 2.646 306 H GLU 42 H GLU 42 32.763 12.700 2.789 307 HA GLU 42 HA GLU 42 33.248 14.056 5.333 308 HB2 GLU 42 HB2 GLU 42 31.862 14.833 2.785 309 HB3 GLU 42 HB3 GLU 42 31.570 15.728 4.268 310 HG2 GLU 42 HG2 GLU 42 34.387 15.267 3.482 311 HG3 GLU 42 HG3 GLU 42 33.448 16.420 2.536 312 HA PRO 43 HA PRO 43 29.626 12.534 7.293 313 HB2 PRO 43 HB2 PRO 43 28.969 14.653 8.858 314 HB3 PRO 43 HB3 PRO 43 30.356 13.608 9.189 315 HG2 PRO 43 HG2 PRO 43 30.278 16.288 7.858 316 HG3 PRO 43 HG3 PRO 43 31.422 15.671 9.064 317 HD2 PRO 43 HD2 PRO 43 31.998 15.759 6.419 318 HD3 PRO 43 HD3 PRO 43 32.638 14.499 7.493 319 H PHE 44 H PHE 44 27.796 12.245 6.184 320 HA PHE 44 HA PHE 44 26.412 14.590 5.083 321 HB2 PHE 44 HB2 PHE 44 27.007 12.782 3.492 322 HB3 PHE 44 HB3 PHE 44 26.016 11.665 4.423 323 HD1 PHE 44 HD2 PHE 44 23.543 12.088 4.586 324 HD2 PHE 44 HD1 PHE 44 26.064 14.180 1.867 325 HE1 PHE 44 HE2 PHE 44 21.573 12.734 3.260 326 HE2 PHE 44 HE1 PHE 44 24.097 14.830 0.539 327 HZ PHE 44 HZ PHE 44 21.848 14.107 1.236 328 H ALA 45 H ALA 45 25.944 11.713 7.067 329 HA ALA 45 HA ALA 45 23.954 12.946 8.658 330 HB1 ALA 45 HB1 ALA 45 22.885 10.769 6.873 331 HB2 ALA 45 HB2 ALA 45 21.991 11.765 8.021 332 HB3 ALA 45 HB3 ALA 45 22.655 12.489 6.558 333 H SER 46 H SER 46 22.786 11.157 10.029 334 HA SER 46 HA SER 46 24.081 8.657 10.358 335 HB2 SER 46 HB2 SER 46 25.913 9.424 11.456 336 HB3 SER 46 HB3 SER 46 25.156 10.971 11.838 337 HG SER 46 HG SER 46 24.797 10.210 13.749 338 H GLY 47 H GLY 47 23.263 7.459 12.230 339 HA2 GLY 47 HA2 GLY 47 21.472 8.242 14.123 340 HA3 GLY 47 HA3 GLY 47 20.485 8.076 12.677 341 H LYS 48 H LYS 48 19.312 6.386 13.676 342 HA LYS 48 HA LYS 48 20.697 3.806 13.521 343 HB2 LYS 48 HB2 LYS 48 19.385 4.991 15.891 344 HB3 LYS 48 HB3 LYS 48 18.983 3.311 15.562 345 HG2 LYS 48 HG2 LYS 48 21.374 2.752 15.568 346 HG3 LYS 48 HG3 LYS 48 21.751 4.434 15.948 347 HD2 LYS 48 HD2 LYS 48 20.035 2.631 17.653 348 HD3 LYS 48 HD3 LYS 48 21.749 2.948 17.936 349 HE2 LYS 48 HE2 LYS 48 20.796 5.472 17.751 350 HE3 LYS 48 HE3 LYS 48 19.394 4.647 18.432 351 HZ1 LYS 48 HZ1 LYS 48 21.719 5.473 19.746 352 HZ2 LYS 48 HZ2 LYS 48 21.684 3.783 19.795 353 HZ3 LYS 48 HZ3 LYS 48 20.378 4.674 20.399 354 H THR 49 H THR 49 19.542 2.221 12.565 355 HA THR 49 HA THR 49 17.248 2.848 11.075 356 HB THR 49 HB THR 49 17.148 0.534 10.453 357 HG1 THR 49 HG1 THR 49 18.546 0.173 12.870 358 HG21 THR 49 HG21 THR 49 19.967 0.326 10.574 359 HG22 THR 49 HG22 THR 49 19.576 2.037 10.402 360 HG23 THR 49 HG23 THR 49 18.973 0.872 9.224 361 H SER 50 H SER 50 15.211 1.424 11.201 362 HA SER 50 HA SER 50 14.336 1.194 14.005 363 HB2 SER 50 HB2 SER 50 13.436 3.247 12.868 364 HB3 SER 50 HB3 SER 50 12.608 2.187 11.727 365 HG SER 50 HG SER 50 12.080 2.676 14.419 366 H GLU 51 H GLU 51 12.113 -0.020 14.038 367 HA GLU 51 HA GLU 51 12.611 -2.633 13.049 368 HB2 GLU 51 HB2 GLU 51 10.270 -3.084 13.917 369 HB3 GLU 51 HB3 GLU 51 11.430 -2.483 15.093 370 HG2 GLU 51 HG2 GLU 51 10.121 -0.771 15.575 371 HG3 GLU 51 HG3 GLU 51 10.088 -0.272 13.885 372 H SER 52 H SER 52 11.380 0.080 11.550 373 HA SER 52 HA SER 52 9.709 -1.468 9.697 374 HB2 SER 52 HB2 SER 52 8.670 0.539 10.668 375 HB3 SER 52 HB3 SER 52 9.975 1.532 10.021 376 HG SER 52 HG SER 52 7.787 0.433 8.750 377 H GLY 53 H GLY 53 12.829 -0.796 9.966 378 HA2 GLY 53 HA2 GLY 53 14.559 -0.862 8.449 379 HA3 GLY 53 HA3 GLY 53 13.366 -1.157 7.193 380 H GLU 54 H GLU 54 12.966 1.641 9.166 381 HA GLU 54 HA GLU 54 14.144 3.330 7.065 382 HB2 GLU 54 HB2 GLU 54 12.196 4.917 7.492 383 HB3 GLU 54 HB3 GLU 54 11.841 3.455 6.584 384 HG2 GLU 54 HG2 GLU 54 10.710 2.473 8.364 385 HG3 GLU 54 HG3 GLU 54 11.428 3.569 9.545 386 H LEU 55 H LEU 55 14.814 5.428 7.748 387 HA LEU 55 HA LEU 55 15.401 5.546 10.627 388 HB2 LEU 55 HB2 LEU 55 17.014 5.882 8.331 389 HB3 LEU 55 HB3 LEU 55 16.894 7.456 9.116 390 HG LEU 55 HG LEU 55 17.696 4.989 10.633 391 HD11 LEU 55 HD11 LEU 55 19.301 6.666 8.778 392 HD12 LEU 55 HD12 LEU 55 19.415 4.942 9.134 393 HD13 LEU 55 HD13 LEU 55 20.048 6.124 10.281 394 HD21 LEU 55 HD21 LEU 55 17.648 7.921 11.107 395 HD22 LEU 55 HD22 LEU 55 18.961 6.985 11.824 396 HD23 LEU 55 HD23 LEU 55 17.284 6.588 12.204 397 H HIS 56 H HIS 56 15.545 7.758 11.563 398 HA HIS 56 HA HIS 56 13.166 9.108 11.490 399 HB2 HIS 56 HB2 HIS 56 15.933 9.948 12.280 400 HB3 HIS 56 HB3 HIS 56 14.623 11.125 12.305 401 HD1 HIS 56 HD1 HIS 56 12.352 9.751 13.575 402 HD2 HIS 56 HD2 HIS 56 16.262 9.063 14.801 403 HE1 HIS 56 HE1 HIS 56 12.175 8.864 15.922 404 H GLY 57 H GLY 57 16.089 10.692 10.224 405 HA2 GLY 57 HA2 GLY 57 15.019 11.171 7.636 406 HA3 GLY 57 HA3 GLY 57 14.767 12.572 8.667 407 H LEU 58 H LEU 58 17.414 10.270 8.005 408 HA LEU 58 HA LEU 58 19.497 12.040 8.575 409 HB2 LEU 58 HB2 LEU 58 19.217 9.483 7.121 410 HB3 LEU 58 HB3 LEU 58 20.656 10.435 6.759 411 HG LEU 58 HG LEU 58 21.128 10.442 9.240 412 HD11 LEU 58 HD11 LEU 58 18.792 8.571 9.160 413 HD12 LEU 58 HD12 LEU 58 19.114 9.906 10.267 414 HD13 LEU 58 HD13 LEU 58 20.045 8.413 10.392 415 HD21 LEU 58 HD21 LEU 58 21.309 8.173 7.373 416 HD22 LEU 58 HD22 LEU 58 21.579 7.789 9.072 417 HD23 LEU 58 HD23 LEU 58 22.572 9.009 8.275 418 H THR 59 H THR 59 17.411 11.864 5.861 419 HA THR 59 HA THR 59 18.915 12.839 3.771 420 HB THR 59 HB THR 59 16.845 13.851 2.889 421 HG1 THR 59 HG1 THR 59 15.696 13.086 5.385 422 HG21 THR 59 HG21 THR 59 16.973 11.087 3.938 423 HG22 THR 59 HG22 THR 59 16.763 11.663 2.285 424 HG23 THR 59 HG23 THR 59 15.394 11.650 3.395 425 H THR 60 H THR 60 19.430 14.888 2.986 426 HA THR 60 HA THR 60 18.892 17.217 4.641 427 HB THR 60 HB THR 60 21.331 17.862 4.630 428 HG1 THR 60 HG1 THR 60 22.657 15.773 4.573 429 HG21 THR 60 HG21 THR 60 21.675 16.935 6.699 430 HG22 THR 60 HG22 THR 60 21.093 15.345 6.204 431 HG23 THR 60 HG23 THR 60 19.945 16.646 6.524 432 H GLU 61 H GLU 61 20.077 19.194 3.592 433 HA GLU 61 HA GLU 61 19.080 19.442 0.960 434 HB2 GLU 61 HB2 GLU 61 20.296 21.637 0.977 435 HB3 GLU 61 HB3 GLU 61 19.197 21.399 2.326 436 HG2 GLU 61 HG2 GLU 61 21.023 20.896 3.800 437 HG3 GLU 61 HG3 GLU 61 22.166 20.942 2.459 438 H GLU 62 H GLU 62 21.964 18.129 2.153 439 HA GLU 62 HA GLU 62 23.638 18.744 -0.094 440 HB2 GLU 62 HB2 GLU 62 23.865 17.122 2.378 441 HB3 GLU 62 HB3 GLU 62 24.875 16.631 1.026 442 HG2 GLU 62 HG2 GLU 62 24.829 19.327 2.358 443 HG3 GLU 62 HG3 GLU 62 26.105 18.116 2.454 444 H GLU 63 H GLU 63 21.017 16.759 0.248 445 HA GLU 63 HA GLU 63 21.834 14.421 -1.118 446 HB2 GLU 63 HB2 GLU 63 19.476 13.939 -1.362 447 HB3 GLU 63 HB3 GLU 63 19.774 14.577 0.249 448 HG2 GLU 63 HG2 GLU 63 17.884 15.720 -0.330 449 HG3 GLU 63 HG3 GLU 63 19.130 16.855 -0.848 450 H PHE 64 H PHE 64 21.310 17.599 -2.181 451 HA PHE 64 HA PHE 64 20.625 16.862 -4.905 452 HB2 PHE 64 HB2 PHE 64 19.701 18.911 -3.764 453 HB3 PHE 64 HB3 PHE 64 21.318 19.603 -3.837 454 HD1 PHE 64 HD2 PHE 64 18.765 18.049 -6.065 455 HD2 PHE 64 HD1 PHE 64 21.866 20.932 -5.629 456 HE1 PHE 64 HE2 PHE 64 18.299 18.888 -8.330 457 HE2 PHE 64 HE1 PHE 64 21.403 21.777 -7.893 458 HZ PHE 64 HZ PHE 64 19.619 20.754 -9.247 459 H VAL 65 H VAL 65 22.918 15.624 -4.389 460 HA VAL 65 HA VAL 65 24.995 17.286 -5.661 461 HB VAL 65 HB VAL 65 26.648 15.713 -4.662 462 HG11 VAL 65 HG11 VAL 65 24.843 17.363 -2.927 463 HG12 VAL 65 HG12 VAL 65 26.248 16.530 -2.256 464 HG13 VAL 65 HG13 VAL 65 26.459 17.738 -3.523 465 HG21 VAL 65 HG21 VAL 65 26.070 14.074 -3.114 466 HG22 VAL 65 HG22 VAL 65 24.465 14.755 -2.844 467 HG23 VAL 65 HG23 VAL 65 24.824 13.913 -4.351 468 H GLU 66 H GLU 66 26.755 15.565 -6.583 469 HA GLU 66 HA GLU 66 25.788 14.632 -8.970 470 HB2 GLU 66 HB2 GLU 66 28.097 13.485 -7.391 471 HB3 GLU 66 HB3 GLU 66 27.814 13.232 -9.107 472 HG2 GLU 66 HG2 GLU 66 28.038 16.014 -8.074 473 HG3 GLU 66 HG3 GLU 66 29.498 15.047 -8.273 474 H GLY 67 H GLY 67 26.023 12.881 -5.906 475 HA2 GLY 67 HA2 GLY 67 24.003 11.341 -5.660 476 HA3 GLY 67 HA3 GLY 67 24.587 10.626 -7.156 477 H ILE 68 H ILE 68 27.266 11.552 -5.501 478 HA ILE 68 HA ILE 68 27.947 8.859 -4.818 479 HB ILE 68 HB ILE 68 29.469 11.349 -4.061 480 HG12 ILE 68 HG12 ILE 68 29.746 9.712 -6.589 481 HG13 ILE 68 HG13 ILE 68 28.930 11.269 -6.501 482 HG21 ILE 68 HG21 ILE 68 29.968 8.467 -3.915 483 HG22 ILE 68 HG22 ILE 68 31.286 9.403 -4.619 484 HG23 ILE 68 HG23 ILE 68 30.692 9.794 -3.006 485 HD11 ILE 68 HD11 ILE 68 31.459 11.027 -7.238 486 HD12 ILE 68 HD12 ILE 68 30.868 12.430 -6.346 487 HD13 ILE 68 HD13 ILE 68 31.708 11.133 -5.496 488 H TYR 69 H TYR 69 27.290 7.866 -3.038 489 HA TYR 69 HA TYR 69 27.355 9.310 -0.495 490 HB2 TYR 69 HB2 TYR 69 24.999 7.591 -1.280 491 HB3 TYR 69 HB3 TYR 69 25.170 8.575 0.169 492 HD1 TYR 69 HD2 TYR 69 25.633 11.159 -0.357 493 HD2 TYR 69 HD1 TYR 69 23.697 8.431 -2.986 494 HE1 TYR 69 HE2 TYR 69 24.548 13.044 -1.504 495 HE2 TYR 69 HE1 TYR 69 22.606 10.309 -4.140 496 HH TYR 69 HH TYR 69 22.541 12.541 -4.372 497 H LYS 70 H LYS 70 28.234 8.146 1.097 498 HA LYS 70 HA LYS 70 28.455 5.230 0.731 499 HB2 LYS 70 HB2 LYS 70 30.656 5.452 1.981 500 HB3 LYS 70 HB3 LYS 70 30.634 6.053 0.328 501 HG2 LYS 70 HG2 LYS 70 29.914 8.217 1.972 502 HG3 LYS 70 HG3 LYS 70 31.292 7.428 2.744 503 HD2 LYS 70 HD2 LYS 70 32.133 9.092 1.241 504 HD3 LYS 70 HD3 LYS 70 32.471 7.505 0.544 505 HE2 LYS 70 HE2 LYS 70 29.899 8.695 -0.239 506 HE3 LYS 70 HE3 LYS 70 31.325 9.565 -0.800 507 HZ1 LYS 70 HZ1 LYS 70 31.699 8.018 -2.323 508 HZ2 LYS 70 HZ2 LYS 70 30.206 7.324 -1.934 509 HZ3 LYS 70 HZ3 LYS 70 31.619 6.767 -1.188 510 H VAL 71 H VAL 71 27.022 4.433 2.150 511 HA VAL 71 HA VAL 71 26.823 5.615 4.820 512 HB VAL 71 HB VAL 71 25.119 3.494 3.506 513 HG11 VAL 71 HG11 VAL 71 25.126 4.700 6.230 514 HG12 VAL 71 HG12 VAL 71 23.583 4.276 5.488 515 HG13 VAL 71 HG13 VAL 71 24.813 3.037 5.734 516 HG21 VAL 71 HG21 VAL 71 25.056 6.417 3.495 517 HG22 VAL 71 HG22 VAL 71 24.275 5.261 2.416 518 HG23 VAL 71 HG23 VAL 71 23.527 5.672 3.959 519 H GLU 72 H GLU 72 27.259 4.504 6.691 520 HA GLU 72 HA GLU 72 28.473 1.837 6.387 521 HB2 GLU 72 HB2 GLU 72 30.394 2.938 6.890 522 HB3 GLU 72 HB3 GLU 72 29.548 4.289 7.632 523 HG2 GLU 72 HG2 GLU 72 29.404 3.235 9.693 524 HG3 GLU 72 HG3 GLU 72 29.679 1.636 9.003 525 H ILE 73 H ILE 73 27.966 0.320 7.903 526 HA ILE 73 HA ILE 73 26.070 1.145 10.005 527 HB ILE 73 HB ILE 73 26.115 -1.436 8.439 528 HG12 ILE 73 HG12 ILE 73 23.619 0.041 8.519 529 HG13 ILE 73 HG13 ILE 73 24.924 1.027 7.868 530 HG21 ILE 73 HG21 ILE 73 25.282 -2.322 10.320 531 HG22 ILE 73 HG22 ILE 73 24.945 -0.743 11.029 532 HG23 ILE 73 HG23 ILE 73 23.806 -1.458 9.888 533 HD11 ILE 73 HD11 ILE 73 23.454 -0.486 6.317 534 HD12 ILE 73 HD12 ILE 73 25.185 -0.295 6.027 535 HD13 ILE 73 HD13 ILE 73 24.580 -1.739 6.839 536 H ASP 74 H ASP 74 26.552 0.608 12.042 537 HA ASP 74 HA ASP 74 28.975 -0.963 12.508 538 HB2 ASP 74 HB2 ASP 74 27.796 1.337 13.747 539 HB3 ASP 74 HB3 ASP 74 27.947 0.056 14.946 540 H THR 75 H THR 75 28.248 -3.065 12.279 541 HA THR 75 HA THR 75 25.948 -3.984 13.783 542 HB THR 75 HB THR 75 26.216 -6.080 12.707 543 HG1 THR 75 HG1 THR 75 28.871 -5.233 12.426 544 HG21 THR 75 HG21 THR 75 25.422 -4.292 11.228 545 HG22 THR 75 HG22 THR 75 26.352 -5.495 10.335 546 HG23 THR 75 HG23 THR 75 27.084 -3.946 10.753 547 H LYS 76 H LYS 76 29.403 -3.932 14.089 548 HA LYS 76 HA LYS 76 29.906 -6.030 15.807 549 HB2 LYS 76 HB2 LYS 76 31.797 -4.691 16.654 550 HB3 LYS 76 HB3 LYS 76 31.684 -4.645 14.900 551 HG2 LYS 76 HG2 LYS 76 31.975 -2.442 15.207 552 HG3 LYS 76 HG3 LYS 76 30.238 -2.461 15.522 553 HD2 LYS 76 HD2 LYS 76 31.083 -1.282 17.338 554 HD3 LYS 76 HD3 LYS 76 30.930 -2.921 17.973 555 HE2 LYS 76 HE2 LYS 76 33.219 -3.292 17.914 556 HE3 LYS 76 HE3 LYS 76 33.495 -2.023 16.722 557 HZ1 LYS 76 HZ1 LYS 76 33.230 -1.827 19.619 558 HZ2 LYS 76 HZ2 LYS 76 32.566 -0.564 18.709 559 HZ3 LYS 76 HZ3 LYS 76 34.209 -0.942 18.559 560 H SER 77 H SER 77 28.585 -2.841 16.543 561 HA SER 77 HA SER 77 28.438 -3.454 19.380 562 HB2 SER 77 HB2 SER 77 27.302 -1.138 19.419 563 HB3 SER 77 HB3 SER 77 29.012 -1.203 18.993 564 HG SER 77 HG SER 77 27.782 0.115 17.561 565 H TYR 78 H TYR 78 26.529 -3.861 16.620 566 HA TYR 78 HA TYR 78 23.966 -3.642 17.910 567 HB2 TYR 78 HB2 TYR 78 24.082 -3.166 15.551 568 HB3 TYR 78 HB3 TYR 78 24.797 -4.740 15.220 569 HD1 TYR 78 HD1 TYR 78 21.820 -3.711 17.232 570 HD2 TYR 78 HD2 TYR 78 23.314 -5.983 13.960 571 HE1 TYR 78 HE1 TYR 78 19.575 -4.647 16.865 572 HE2 TYR 78 HE2 TYR 78 21.073 -6.925 13.583 573 HH TYR 78 HH TYR 78 18.928 -7.292 15.255 574 H TRP 79 H TRP 79 26.261 -6.179 17.183 575 HA TRP 79 HA TRP 79 24.459 -8.321 17.848 576 HB2 TRP 79 HB2 TRP 79 27.470 -8.431 17.622 577 HB3 TRP 79 HB3 TRP 79 26.346 -9.782 17.519 578 HD1 TRP 79 HD1 TRP 79 28.470 -8.159 15.280 579 HE1 TRP 79 HE1 TRP 79 27.536 -7.999 12.888 580 HE3 TRP 79 HE3 TRP 79 23.538 -9.066 16.273 581 HZ2 TRP 79 HZ2 TRP 79 25.038 -8.226 11.592 582 HZ3 TRP 79 HZ3 TRP 79 21.941 -9.077 14.401 583 HH2 TRP 79 HH2 TRP 79 22.677 -8.666 12.111 584 H LYS 80 H LYS 80 26.799 -6.358 19.520 585 HA LYS 80 HA LYS 80 27.048 -8.049 21.810 586 HB2 LYS 80 HB2 LYS 80 28.385 -6.366 22.734 587 HB3 LYS 80 HB3 LYS 80 28.662 -6.211 21.004 588 HG2 LYS 80 HG2 LYS 80 28.215 -4.052 21.269 589 HG3 LYS 80 HG3 LYS 80 26.526 -4.532 21.451 590 HD2 LYS 80 HD2 LYS 80 26.957 -3.204 23.331 591 HD3 LYS 80 HD3 LYS 80 27.081 -4.860 23.930 592 HE2 LYS 80 HE2 LYS 80 29.592 -4.630 23.432 593 HE3 LYS 80 HE3 LYS 80 29.275 -2.899 23.342 594 HZ1 LYS 80 HZ1 LYS 80 29.724 -3.037 25.533 595 HZ2 LYS 80 HZ2 LYS 80 29.287 -4.666 25.653 596 HZ3 LYS 80 HZ3 LYS 80 28.092 -3.469 25.639 597 H ALA 81 H ALA 81 24.672 -5.868 20.714 598 HA ALA 81 HA ALA 81 23.628 -5.225 23.334 599 HB1 ALA 81 HB1 ALA 81 21.676 -4.544 21.510 600 HB2 ALA 81 HB2 ALA 81 22.942 -3.481 22.127 601 HB3 ALA 81 HB3 ALA 81 23.175 -4.339 20.604 602 H LEU 82 H LEU 82 22.685 -7.259 20.583 603 HA LEU 82 HA LEU 82 20.536 -8.428 22.194 604 HB2 LEU 82 HB2 LEU 82 21.190 -8.748 19.269 605 HB3 LEU 82 HB3 LEU 82 19.808 -9.470 20.091 606 HG LEU 82 HG LEU 82 18.888 -7.645 18.996 607 HD11 LEU 82 HD11 LEU 82 18.148 -6.170 20.688 608 HD12 LEU 82 HD12 LEU 82 19.610 -6.415 21.643 609 HD13 LEU 82 HD13 LEU 82 18.438 -7.721 21.477 610 HD21 LEU 82 HD21 LEU 82 19.881 -5.526 18.699 611 HD22 LEU 82 HD22 LEU 82 21.164 -6.702 18.405 612 HD23 LEU 82 HD23 LEU 82 21.096 -5.835 19.940 613 H GLY 83 H GLY 83 23.678 -8.931 21.980 614 HA2 GLY 83 HA2 GLY 83 25.070 -10.722 22.323 615 HA3 GLY 83 HA3 GLY 83 23.664 -11.514 23.018 616 H ILE 84 H ILE 84 24.317 -10.467 19.686 617 HA ILE 84 HA ILE 84 23.524 -13.107 18.746 618 HB ILE 84 HB ILE 84 24.298 -10.743 17.044 619 HG12 ILE 84 HG12 ILE 84 22.502 -10.080 18.591 620 HG13 ILE 84 HG13 ILE 84 21.918 -10.178 16.935 621 HG21 ILE 84 HG21 ILE 84 24.189 -12.487 15.583 622 HG22 ILE 84 HG22 ILE 84 23.048 -13.392 16.577 623 HG23 ILE 84 HG23 ILE 84 22.485 -12.033 15.606 624 HD11 ILE 84 HD11 ILE 84 20.897 -11.446 19.235 625 HD12 ILE 84 HD12 ILE 84 20.329 -11.571 17.569 626 HD13 ILE 84 HD13 ILE 84 21.536 -12.704 18.176 627 H SER 85 H SER 85 24.791 -14.284 17.192 628 HA SER 85 HA SER 85 27.385 -14.800 17.935 629 HB2 SER 85 HB2 SER 85 26.409 -16.446 16.597 630 HB3 SER 85 HB3 SER 85 25.881 -15.283 15.380 631 HG SER 85 HG SER 85 28.435 -16.380 15.806 632 HA PRO 86 HA PRO 86 29.781 -11.423 16.425 633 HB2 PRO 86 HB2 PRO 86 32.215 -12.624 16.434 634 HB3 PRO 86 HB3 PRO 86 31.393 -12.108 17.911 635 HG2 PRO 86 HG2 PRO 86 31.551 -14.835 16.686 636 HG3 PRO 86 HG3 PRO 86 31.705 -14.362 18.388 637 HD2 PRO 86 HD2 PRO 86 29.421 -15.396 17.364 638 HD3 PRO 86 HD3 PRO 86 29.424 -14.206 18.682 639 H MET 87 H MET 87 30.345 -10.654 14.466 640 HA MET 87 HA MET 87 31.229 -12.486 12.378 641 HB2 MET 87 HB2 MET 87 29.588 -11.385 10.773 642 HB3 MET 87 HB3 MET 87 28.914 -12.536 11.920 643 HG2 MET 87 HG2 MET 87 27.819 -10.923 13.114 644 HG3 MET 87 HG3 MET 87 28.951 -9.655 12.648 645 HE1 MET 87 HE1 MET 87 29.268 -9.701 9.751 646 HE2 MET 87 HE2 MET 87 27.894 -8.923 8.966 647 HE3 MET 87 HE3 MET 87 28.658 -8.161 10.361 648 H HIS 88 H HIS 88 31.415 -10.952 10.241 649 HA HIS 88 HA HIS 88 32.560 -8.373 10.994 650 HB2 HIS 88 HB2 HIS 88 34.247 -10.469 10.829 651 HB3 HIS 88 HB3 HIS 88 34.226 -9.975 9.138 652 HD1 HIS 88 HD1 HIS 88 36.421 -8.828 8.879 653 HD2 HIS 88 HD2 HIS 88 34.366 -7.549 12.257 654 HE1 HIS 88 HE1 HIS 88 37.768 -6.914 9.801 655 H GLU 89 H GLU 89 33.434 -7.295 8.854 656 HA GLU 89 HA GLU 89 32.935 -6.388 6.827 657 HB2 GLU 89 HB2 GLU 89 33.139 -8.913 6.230 658 HB3 GLU 89 HB3 GLU 89 31.388 -8.850 6.092 659 HG2 GLU 89 HG2 GLU 89 31.484 -7.290 4.326 660 HG3 GLU 89 HG3 GLU 89 33.195 -6.974 4.603 661 H HIS 90 H HIS 90 31.484 -5.155 8.423 662 HA HIS 90 HA HIS 90 28.722 -5.592 8.545 663 HB2 HIS 90 HB2 HIS 90 28.561 -3.224 9.213 664 HB3 HIS 90 HB3 HIS 90 29.863 -4.056 10.060 665 HD1 HIS 90 HD1 HIS 90 32.253 -3.262 9.627 666 HD2 HIS 90 HD2 HIS 90 29.405 -1.278 7.343 667 HE1 HIS 90 HE1 HIS 90 33.457 -1.308 8.601 668 H ALA 91 H ALA 91 27.091 -5.232 7.172 669 HA ALA 91 HA ALA 91 27.441 -4.841 4.463 670 HB1 ALA 91 HB1 ALA 91 24.922 -3.968 4.726 671 HB2 ALA 91 HB2 ALA 91 25.371 -5.670 4.835 672 HB3 ALA 91 HB3 ALA 91 25.135 -4.724 6.306 673 H GLU 92 H GLU 92 27.655 -3.133 3.137 674 HA GLU 92 HA GLU 92 27.062 -0.449 4.123 675 HB2 GLU 92 HB2 GLU 92 29.295 0.326 3.170 676 HB3 GLU 92 HB3 GLU 92 29.345 -0.538 4.700 677 HG2 GLU 92 HG2 GLU 92 30.498 -2.259 3.842 678 HG3 GLU 92 HG3 GLU 92 29.614 -2.228 2.317 679 H VAL 93 H VAL 93 27.362 1.194 2.311 680 HA VAL 93 HA VAL 93 26.925 0.038 -0.344 681 HB VAL 93 HB VAL 93 25.056 2.040 0.935 682 HG11 VAL 93 HG11 VAL 93 25.536 1.244 -1.865 683 HG12 VAL 93 HG12 VAL 93 23.847 1.339 -1.363 684 HG13 VAL 93 HG13 VAL 93 24.895 2.748 -1.204 685 HG21 VAL 93 HG21 VAL 93 23.371 0.209 0.449 686 HG22 VAL 93 HG22 VAL 93 24.750 -0.858 0.188 687 HG23 VAL 93 HG23 VAL 93 24.505 -0.103 1.762 688 H VAL 94 H VAL 94 28.403 0.951 -1.600 689 HA VAL 94 HA VAL 94 28.866 3.848 -1.351 690 HB VAL 94 HB VAL 94 30.997 1.784 -1.923 691 HG11 VAL 94 HG11 VAL 94 32.476 3.846 -1.544 692 HG12 VAL 94 HG12 VAL 94 31.625 3.712 -3.083 693 HG13 VAL 94 HG13 VAL 94 31.009 4.782 -1.824 694 HG21 VAL 94 HG21 VAL 94 30.168 3.211 0.558 695 HG22 VAL 94 HG22 VAL 94 30.710 1.547 0.344 696 HG23 VAL 94 HG23 VAL 94 31.879 2.867 0.302 697 H PHE 95 H PHE 95 28.003 4.703 -3.131 698 HA PHE 95 HA PHE 95 28.724 3.510 -5.722 699 HB2 PHE 95 HB2 PHE 95 26.024 4.447 -4.781 700 HB3 PHE 95 HB3 PHE 95 26.425 4.399 -6.495 701 HD1 PHE 95 HD1 PHE 95 26.045 2.341 -3.456 702 HD2 PHE 95 HD2 PHE 95 26.435 2.369 -7.694 703 HE1 PHE 95 HE1 PHE 95 25.449 -0.045 -3.523 704 HE2 PHE 95 HE2 PHE 95 25.840 -0.018 -7.768 705 HZ PHE 95 HZ PHE 95 25.345 -1.228 -5.681 706 H THR 96 H THR 96 29.061 4.951 -7.423 707 HA THR 96 HA THR 96 29.226 7.790 -6.643 708 HB THR 96 HB THR 96 31.471 6.992 -6.815 709 HG1 THR 96 HG1 THR 96 32.121 8.161 -8.823 710 HG21 THR 96 HG21 THR 96 30.374 5.374 -8.960 711 HG22 THR 96 HG22 THR 96 31.843 5.140 -8.011 712 HG23 THR 96 HG23 THR 96 31.870 6.175 -9.438 713 H ALA 97 H ALA 97 28.664 9.335 -8.167 714 HA ALA 97 HA ALA 97 26.811 8.449 -10.187 715 HB1 ALA 97 HB1 ALA 97 27.047 10.718 -8.634 716 HB2 ALA 97 HB2 ALA 97 27.468 11.277 -10.253 717 HB3 ALA 97 HB3 ALA 97 25.920 10.480 -9.971 718 H ASN 98 H ASN 98 26.905 9.180 -12.424 719 HA ASN 98 HA ASN 98 27.917 9.269 -14.459 720 HB2 ASN 98 HB2 ASN 98 29.762 10.920 -12.762 721 HB3 ASN 98 HB3 ASN 98 30.177 10.581 -14.440 722 HD21 ASN 98 HD21 ASN 98 28.489 12.585 -12.357 723 HD22 ASN 98 HD22 ASN 98 27.549 13.441 -13.525 724 H ASP 99 H ASP 99 28.234 6.881 -13.151 725 HA ASP 99 HA ASP 99 30.818 6.006 -14.207 726 HB2 ASP 99 HB2 ASP 99 31.285 6.259 -11.864 727 HB3 ASP 99 HB3 ASP 99 29.801 5.419 -11.424 728 H SER 100 H SER 100 27.665 5.079 -12.894 729 HA SER 100 HA SER 100 27.550 2.926 -14.885 730 HB2 SER 100 HB2 SER 100 28.120 1.749 -12.885 731 HB3 SER 100 HB3 SER 100 26.953 2.668 -11.935 732 HG SER 100 HG SER 100 25.715 1.014 -12.358 733 H GLY 101 H GLY 101 25.402 3.981 -12.250 734 HA2 GLY 101 HA2 GLY 101 23.603 5.613 -13.088 735 HA3 GLY 101 HA3 GLY 101 23.285 4.348 -14.266 736 HA PRO 102 HA PRO 102 22.024 2.605 -9.917 737 HB2 PRO 102 HB2 PRO 102 21.810 4.441 -7.929 738 HB3 PRO 102 HB3 PRO 102 23.301 3.547 -8.255 739 HG2 PRO 102 HG2 PRO 102 22.540 6.327 -9.067 740 HG3 PRO 102 HG3 PRO 102 24.086 5.729 -8.437 741 HD2 PRO 102 HD2 PRO 102 23.665 6.179 -11.074 742 HD3 PRO 102 HD3 PRO 102 24.743 4.897 -10.484 743 H ARG 103 H ARG 103 19.898 2.273 -9.539 744 HA ARG 103 HA ARG 103 18.034 4.326 -10.483 745 HB2 ARG 103 HB2 ARG 103 17.969 1.362 -10.281 746 HB3 ARG 103 HB3 ARG 103 16.442 2.210 -10.081 747 HG2 ARG 103 HG2 ARG 103 16.550 3.127 -12.247 748 HG3 ARG 103 HG3 ARG 103 18.249 2.688 -12.429 749 HD2 ARG 103 HD2 ARG 103 17.104 1.093 -13.695 750 HD3 ARG 103 HD3 ARG 103 17.458 0.269 -12.178 751 HE ARG 103 HE ARG 103 14.900 1.522 -12.133 752 HH11 ARG 103 HH11 ARG 103 16.624 -1.276 -13.282 753 HH12 ARG 103 HH12 ARG 103 15.217 -2.288 -13.321 754 HH21 ARG 103 HH21 ARG 103 13.041 0.200 -12.181 755 HH22 ARG 103 HH22 ARG 103 13.180 -1.448 -12.696 756 H ARG 104 H ARG 104 17.692 1.790 -8.013 757 HA ARG 104 HA ARG 104 15.885 3.173 -6.421 758 HB2 ARG 104 HB2 ARG 104 17.756 0.892 -5.943 759 HB3 ARG 104 HB3 ARG 104 16.932 1.614 -4.567 760 HG2 ARG 104 HG2 ARG 104 15.443 0.676 -6.997 761 HG3 ARG 104 HG3 ARG 104 15.844 -0.405 -5.661 762 HD2 ARG 104 HD2 ARG 104 14.572 0.896 -4.125 763 HD3 ARG 104 HD3 ARG 104 14.363 2.191 -5.304 764 HE ARG 104 HE ARG 104 13.273 -0.195 -6.325 765 HH11 ARG 104 HH11 ARG 104 12.679 2.224 -3.893 766 HH12 ARG 104 HH12 ARG 104 10.961 2.005 -3.908 767 HH21 ARG 104 HH21 ARG 104 11.013 -0.493 -6.354 768 HH22 ARG 104 HH22 ARG 104 10.014 0.458 -5.308 769 H TYR 105 H TYR 105 16.087 4.330 -4.480 770 HA TYR 105 HA TYR 105 18.738 5.550 -4.066 771 HB2 TYR 105 HB2 TYR 105 16.052 6.816 -3.500 772 HB3 TYR 105 HB3 TYR 105 17.629 7.591 -3.392 773 HD1 TYR 105 HD2 TYR 105 18.977 7.849 -5.544 774 HD2 TYR 105 HD1 TYR 105 14.845 6.835 -5.508 775 HE1 TYR 105 HE2 TYR 105 18.785 8.570 -7.887 776 HE2 TYR 105 HE1 TYR 105 14.642 7.552 -7.853 777 HH TYR 105 HH TYR 105 15.952 7.951 -9.775 778 H THR 106 H THR 106 17.535 3.136 -2.815 779 HA THR 106 HA THR 106 17.499 4.052 -0.013 780 HB THR 106 HB THR 106 16.244 1.574 -1.206 781 HG1 THR 106 HG1 THR 106 14.328 2.615 -0.804 782 HG21 THR 106 HG21 THR 106 16.600 2.487 1.632 783 HG22 THR 106 HG22 THR 106 16.915 0.900 0.930 784 HG23 THR 106 HG23 THR 106 15.255 1.445 1.171 785 H ILE 107 H ILE 107 18.817 3.064 1.472 786 HA ILE 107 HA ILE 107 21.063 1.587 0.380 787 HB ILE 107 HB ILE 107 20.544 2.608 3.175 788 HG12 ILE 107 HG12 ILE 107 22.602 4.060 2.383 789 HG13 ILE 107 HG13 ILE 107 21.985 3.675 0.780 790 HG21 ILE 107 HG21 ILE 107 23.286 2.125 2.753 791 HG22 ILE 107 HG22 ILE 107 22.195 1.294 3.860 792 HG23 ILE 107 HG23 ILE 107 22.426 0.678 2.224 793 HD11 ILE 107 HD11 ILE 107 21.224 5.850 1.880 794 HD12 ILE 107 HD12 ILE 107 19.994 4.821 1.146 795 HD13 ILE 107 HD13 ILE 107 20.210 4.826 2.896 796 H ALA 108 H ALA 108 20.694 -0.524 0.064 797 HA ALA 108 HA ALA 108 19.118 -2.044 1.990 798 HB1 ALA 108 HB1 ALA 108 19.914 -2.385 -0.816 799 HB2 ALA 108 HB2 ALA 108 19.898 -3.867 0.140 800 HB3 ALA 108 HB3 ALA 108 18.442 -2.880 0.018 801 H ALA 109 H ALA 109 20.146 -2.798 3.719 802 HA ALA 109 HA ALA 109 22.818 -3.981 3.348 803 HB1 ALA 109 HB1 ALA 109 21.847 -2.217 5.579 804 HB2 ALA 109 HB2 ALA 109 23.263 -3.257 5.738 805 HB3 ALA 109 HB3 ALA 109 23.238 -1.982 4.520 806 H MET 110 H MET 110 22.740 -6.096 3.684 807 HA MET 110 HA MET 110 20.745 -7.158 5.566 808 HB2 MET 110 HB2 MET 110 22.105 -8.385 3.172 809 HB3 MET 110 HB3 MET 110 21.229 -9.352 4.351 810 HG2 MET 110 HG2 MET 110 19.248 -7.823 3.889 811 HG3 MET 110 HG3 MET 110 20.160 -7.260 2.491 812 HE1 MET 110 HE1 MET 110 17.585 -10.498 3.367 813 HE2 MET 110 HE2 MET 110 19.034 -11.498 3.458 814 HE3 MET 110 HE3 MET 110 18.891 -10.059 4.469 815 H LEU 111 H LEU 111 21.415 -8.042 7.409 816 HA LEU 111 HA LEU 111 24.253 -8.266 7.930 817 HB2 LEU 111 HB2 LEU 111 21.892 -8.825 9.719 818 HB3 LEU 111 HB3 LEU 111 23.577 -8.745 10.228 819 HG LEU 111 HG LEU 111 22.710 -6.700 10.899 820 HD11 LEU 111 HD11 LEU 111 23.793 -6.163 8.137 821 HD12 LEU 111 HD12 LEU 111 24.769 -6.453 9.577 822 HD13 LEU 111 HD13 LEU 111 23.736 -5.027 9.485 823 HD21 LEU 111 HD21 LEU 111 20.615 -7.146 9.372 824 HD22 LEU 111 HD22 LEU 111 21.453 -6.042 8.281 825 HD23 LEU 111 HD23 LEU 111 21.020 -5.515 9.908 826 H SER 112 H SER 112 24.524 -10.022 6.338 827 HA SER 112 HA SER 112 23.371 -12.587 6.840 828 HB2 SER 112 HB2 SER 112 24.023 -12.729 4.691 829 HB3 SER 112 HB3 SER 112 25.159 -11.392 4.872 830 HG SER 112 HG SER 112 26.693 -12.810 4.940 831 HA PRO 113 HA PRO 113 26.103 -14.314 9.804 832 HB2 PRO 113 HB2 PRO 113 26.394 -16.862 8.913 833 HB3 PRO 113 HB3 PRO 113 24.897 -16.262 9.638 834 HG2 PRO 113 HG2 PRO 113 25.597 -16.603 6.748 835 HG3 PRO 113 HG3 PRO 113 24.086 -17.001 7.587 836 HD2 PRO 113 HD2 PRO 113 24.384 -14.751 6.109 837 HD3 PRO 113 HD3 PRO 113 23.343 -14.819 7.546 838 H TYR 114 H TYR 114 28.237 -15.148 10.185 839 HA TYR 114 HA TYR 114 30.043 -15.340 7.913 840 HB2 TYR 114 HB2 TYR 114 30.284 -13.217 10.046 841 HB3 TYR 114 HB3 TYR 114 31.627 -13.698 9.015 842 HD1 TYR 114 HD2 TYR 114 31.572 -13.217 6.600 843 HD2 TYR 114 HD1 TYR 114 28.497 -11.853 9.205 844 HE1 TYR 114 HE2 TYR 114 30.822 -11.632 4.875 845 HE2 TYR 114 HE1 TYR 114 27.737 -10.266 7.486 846 HH TYR 114 HH TYR 114 29.488 -9.299 4.975 847 H SER 115 H SER 115 30.574 -17.416 8.429 848 HA SER 115 HA SER 115 31.102 -18.336 11.052 849 HB2 SER 115 HB2 SER 115 30.477 -19.750 9.034 850 HB3 SER 115 HB3 SER 115 32.152 -19.580 8.507 851 HG SER 115 HG SER 115 31.570 -21.491 9.838 852 H TYR 116 H TYR 116 33.350 -19.551 11.356 853 HA TYR 116 HA TYR 116 35.556 -19.337 11.866 854 HB2 TYR 116 HB2 TYR 116 35.611 -19.132 9.297 855 HB3 TYR 116 HB3 TYR 116 35.832 -17.407 9.572 856 HD1 TYR 116 HD2 TYR 116 37.285 -20.702 10.554 857 HD2 TYR 116 HD1 TYR 116 37.980 -16.569 9.823 858 HE1 TYR 116 HE2 TYR 116 39.702 -21.065 10.839 859 HE2 TYR 116 HE1 TYR 116 40.398 -16.919 10.105 860 HH TYR 116 HH TYR 116 42.015 -18.856 9.889 861 H SER 117 H SER 117 33.792 -17.703 13.257 862 HA SER 117 HA SER 117 34.694 -14.995 13.335 863 HB2 SER 117 HB2 SER 117 33.200 -16.468 15.512 864 HB3 SER 117 HB3 SER 117 33.227 -14.730 15.212 865 HG SER 117 HG SER 117 31.349 -16.032 14.421 866 H THR 118 H THR 118 36.116 -14.007 14.702 867 HA THR 118 HA THR 118 37.796 -15.796 16.330 868 HB THR 118 HB THR 118 38.726 -13.078 15.499 869 HG1 THR 118 HG1 THR 118 38.552 -13.665 13.473 870 HG21 THR 118 HG21 THR 118 40.894 -14.435 15.345 871 HG22 THR 118 HG22 THR 118 39.996 -15.724 16.150 872 HG23 THR 118 HG23 THR 118 40.215 -14.169 16.951 873 H THR 119 H THR 119 38.713 -14.891 18.300 874 HA THR 119 HA THR 119 36.833 -13.867 20.047 875 HB THR 119 HB THR 119 38.756 -14.935 20.961 876 HG1 THR 119 HG1 THR 119 37.950 -13.262 22.278 877 HG21 THR 119 HG21 THR 119 40.655 -14.714 19.777 878 HG22 THR 119 HG22 THR 119 40.925 -13.274 20.760 879 HG23 THR 119 HG23 THR 119 40.194 -13.127 19.162 880 H ALA 120 H ALA 120 36.402 -11.843 20.910 881 HA ALA 120 HA ALA 120 36.988 -9.614 19.143 882 HB1 ALA 120 HB1 ALA 120 35.171 -8.550 20.048 883 HB2 ALA 120 HB2 ALA 120 34.712 -10.235 20.296 884 HB3 ALA 120 HB3 ALA 120 35.382 -9.299 21.631 885 H VAL 121 H VAL 121 39.169 -9.192 19.540 886 HA VAL 121 HA VAL 121 39.662 -7.676 21.978 887 HB VAL 121 HB VAL 121 40.407 -9.997 22.477 888 HG11 VAL 121 HG11 VAL 121 41.066 -10.621 20.195 889 HG12 VAL 121 HG12 VAL 121 42.424 -9.499 20.289 890 HG13 VAL 121 HG13 VAL 121 42.364 -10.903 21.355 891 HG21 VAL 121 HG21 VAL 121 41.738 -7.584 22.911 892 HG22 VAL 121 HG22 VAL 121 41.928 -9.083 23.820 893 HG23 VAL 121 HG23 VAL 121 42.999 -8.733 22.464 894 H VAL 122 H VAL 122 41.120 -6.033 21.721 895 HA VAL 122 HA VAL 122 42.266 -4.418 20.590 896 HB VAL 122 HB VAL 122 43.503 -6.752 19.126 897 HG11 VAL 122 HG11 VAL 122 43.838 -4.050 18.719 898 HG12 VAL 122 HG12 VAL 122 45.182 -4.467 19.784 899 HG13 VAL 122 HG13 VAL 122 44.973 -5.317 18.253 900 HG21 VAL 122 HG21 VAL 122 45.291 -6.229 21.024 901 HG22 VAL 122 HG22 VAL 122 43.837 -5.742 21.896 902 HG23 VAL 122 HG23 VAL 122 43.978 -7.381 21.262 903 H THR 123 H THR 123 40.149 -3.880 19.585 904 HA THR 123 HA THR 123 40.328 -4.168 16.661 905 HB THR 123 HB THR 123 37.671 -3.993 18.059 906 HG1 THR 123 HG1 THR 123 39.327 -6.240 17.680 907 HG21 THR 123 HG21 THR 123 37.296 -5.453 15.822 908 HG22 THR 123 HG22 THR 123 38.665 -4.462 15.317 909 HG23 THR 123 HG23 THR 123 37.177 -3.694 15.868 910 H ASN 124 H ASN 124 41.403 -2.099 16.736 911 HA ASN 124 HA ASN 124 39.668 0.066 16.249 912 HB2 ASN 124 HB2 ASN 124 40.742 1.461 18.225 913 HB3 ASN 124 HB3 ASN 124 39.284 0.506 18.477 914 HD21 ASN 124 HD21 ASN 124 39.288 -0.797 20.154 915 HD22 ASN 124 HD22 ASN 124 40.685 -1.409 20.964 916 HA PRO 125 HA PRO 125 43.233 1.623 14.221 917 HB2 PRO 125 HB2 PRO 125 42.874 4.309 14.391 918 HB3 PRO 125 HB3 PRO 125 41.896 3.274 13.344 919 HG2 PRO 125 HG2 PRO 125 41.254 4.375 16.052 920 HG3 PRO 125 HG3 PRO 125 40.220 4.262 14.617 921 HD2 PRO 125 HD2 PRO 125 40.064 2.500 16.668 922 HD3 PRO 125 HD3 PRO 125 39.738 2.039 14.984 923 H LYS 126 H LYS 126 45.035 3.338 14.466 924 HA LYS 126 HA LYS 126 46.573 2.769 16.689 925 HB2 LYS 126 HB2 LYS 126 48.073 4.451 15.958 926 HB3 LYS 126 HB3 LYS 126 47.319 3.814 14.503 927 HG2 LYS 126 HG2 LYS 126 46.368 6.306 15.888 928 HG3 LYS 126 HG3 LYS 126 47.575 6.309 14.600 929 HD2 LYS 126 HD2 LYS 126 45.753 4.907 13.328 930 HD3 LYS 126 HD3 LYS 126 44.661 5.683 14.477 931 HE2 LYS 126 HE2 LYS 126 44.634 7.160 12.699 932 HE3 LYS 126 HE3 LYS 126 45.860 7.866 13.752 933 HZ1 LYS 126 HZ1 LYS 126 46.475 6.065 11.476 934 HZ2 LYS 126 HZ2 LYS 126 47.578 6.950 12.404 935 HZ3 LYS 126 HZ3 LYS 126 46.502 7.754 11.376 936 H GLU 127 H GLU 127 44.105 5.192 16.282 937 HA GLU 127 HA GLU 127 44.799 6.496 18.795 938 HB2 GLU 127 HB2 GLU 127 42.875 7.090 16.575 939 HB3 GLU 127 HB3 GLU 127 42.653 7.843 18.148 940 HG2 GLU 127 HG2 GLU 127 45.040 8.642 17.961 941 HG3 GLU 127 HG3 GLU 127 44.985 8.116 16.279 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -2.061 -5.997 3.715 2 HA2 GLY 1 HA2 GLY 1 -0.728 -4.137 4.087 3 HA3 GLY 1 HA3 GLY 1 0.311 -4.657 2.768 4 HA PRO 2 HA PRO 2 -2.260 -0.925 1.520 5 HB2 PRO 2 HB2 PRO 2 -0.164 0.723 1.015 6 HB3 PRO 2 HB3 PRO 2 -0.923 0.594 2.606 7 HG2 PRO 2 HG2 PRO 2 1.583 -0.691 1.593 8 HG3 PRO 2 HG3 PRO 2 1.274 0.076 3.161 9 HD2 PRO 2 HD2 PRO 2 1.242 -2.610 2.822 10 HD3 PRO 2 HD3 PRO 2 0.204 -1.783 4.003 11 H THR 3 H THR 3 -1.532 0.525 -0.549 12 HA THR 3 HA THR 3 -1.757 -1.120 -2.768 13 HB THR 3 HB THR 3 -1.303 0.800 -4.139 14 HG1 THR 3 HG1 THR 3 0.080 2.283 -3.533 15 HG21 THR 3 HG21 THR 3 -3.417 0.794 -2.835 16 HG22 THR 3 HG22 THR 3 -2.845 2.417 -3.217 17 HG23 THR 3 HG23 THR 3 -2.617 1.761 -1.596 18 H GLY 4 H GLY 4 -0.315 -1.795 -4.381 19 HA2 GLY 4 HA2 GLY 4 2.210 -2.679 -3.464 20 HA3 GLY 4 HA3 GLY 4 1.636 -2.751 -5.124 21 H THR 5 H THR 5 4.046 -1.605 -3.272 22 HA THR 5 HA THR 5 4.537 0.670 -5.084 23 HB THR 5 HB THR 5 5.680 1.856 -3.337 24 HG1 THR 5 HG1 THR 5 6.628 0.508 -1.970 25 HG21 THR 5 HG21 THR 5 3.159 1.941 -3.433 26 HG22 THR 5 HG22 THR 5 3.871 2.387 -1.883 27 HG23 THR 5 HG23 THR 5 3.148 0.794 -2.094 28 H GLY 6 H GLY 6 6.115 0.165 -6.454 29 HA2 GLY 6 HA2 GLY 6 8.206 -1.709 -5.591 30 HA3 GLY 6 HA3 GLY 6 7.818 -1.299 -7.256 31 H GLU 7 H GLU 7 8.097 1.202 -4.862 32 HA GLU 7 HA GLU 7 10.865 1.767 -5.467 33 HB2 GLU 7 HB2 GLU 7 9.222 2.747 -7.305 34 HB3 GLU 7 HB3 GLU 7 9.002 4.008 -6.100 35 HG2 GLU 7 HG2 GLU 7 11.320 4.553 -6.136 36 HG3 GLU 7 HG3 GLU 7 11.689 3.151 -7.139 37 H SER 8 H SER 8 11.584 3.808 -4.340 38 HA SER 8 HA SER 8 10.387 3.841 -1.685 39 HB2 SER 8 HB2 SER 8 12.970 4.973 -2.774 40 HB3 SER 8 HB3 SER 8 12.432 5.211 -1.112 41 HG SER 8 HG SER 8 12.875 2.700 -2.363 42 H LYS 9 H LYS 9 10.824 6.234 -0.661 43 HA LYS 9 HA LYS 9 9.261 8.060 -2.365 44 HB2 LYS 9 HB2 LYS 9 9.389 8.143 0.646 45 HB3 LYS 9 HB3 LYS 9 8.242 8.958 -0.409 46 HG2 LYS 9 HG2 LYS 9 6.932 7.245 0.283 47 HG3 LYS 9 HG3 LYS 9 7.688 6.461 -1.106 48 HD2 LYS 9 HD2 LYS 9 9.504 5.827 0.726 49 HD3 LYS 9 HD3 LYS 9 8.116 6.018 1.801 50 HE2 LYS 9 HE2 LYS 9 8.159 4.266 -0.654 51 HE3 LYS 9 HE3 LYS 9 8.446 3.692 0.989 52 HZ1 LYS 9 HZ1 LYS 9 6.272 3.522 1.274 53 HZ2 LYS 9 HZ2 LYS 9 5.998 4.055 -0.308 54 HZ3 LYS 9 HZ3 LYS 9 6.066 5.172 0.961 55 H CYS 10 H CYS 10 11.320 8.388 0.529 56 HA CYS 10 HA CYS 10 12.222 10.967 -0.111 57 HB2 CYS 10 HB2 CYS 10 13.045 8.847 1.811 58 HB3 CYS 10 HB3 CYS 10 14.187 10.147 1.499 59 HG CYS 10 HG CYS 10 11.534 11.783 1.974 60 HA PRO 11 HA PRO 11 15.461 10.441 -3.018 61 HB2 PRO 11 HB2 PRO 11 17.335 12.196 -2.137 62 HB3 PRO 11 HB3 PRO 11 15.820 12.707 -2.889 63 HG2 PRO 11 HG2 PRO 11 16.539 12.560 0.013 64 HG3 PRO 11 HG3 PRO 11 15.664 13.832 -0.860 65 HD2 PRO 11 HD2 PRO 11 14.403 11.961 0.638 66 HD3 PRO 11 HD3 PRO 11 13.676 12.667 -0.821 67 H LEU 12 H LEU 12 16.416 10.262 0.376 68 HA LEU 12 HA LEU 12 18.251 8.090 -0.297 69 HB2 LEU 12 HB2 LEU 12 19.568 10.188 -0.208 70 HB3 LEU 12 HB3 LEU 12 19.039 10.409 1.459 71 HG LEU 12 HG LEU 12 21.381 9.472 1.066 72 HD11 LEU 12 HD11 LEU 12 21.277 8.742 3.171 73 HD12 LEU 12 HD12 LEU 12 20.091 7.499 2.775 74 HD13 LEU 12 HD13 LEU 12 19.562 9.150 3.098 75 HD21 LEU 12 HD21 LEU 12 20.135 6.793 0.855 76 HD22 LEU 12 HD22 LEU 12 21.701 7.366 0.279 77 HD23 LEU 12 HD23 LEU 12 20.233 7.759 -0.619 78 H MET 13 H MET 13 17.671 6.413 0.900 79 HA MET 13 HA MET 13 16.979 6.851 3.716 80 HB2 MET 13 HB2 MET 13 15.121 5.265 3.559 81 HB3 MET 13 HB3 MET 13 14.865 6.644 2.498 82 HG2 MET 13 HG2 MET 13 15.047 5.408 0.608 83 HG3 MET 13 HG3 MET 13 16.177 4.265 1.331 84 HE1 MET 13 HE1 MET 13 15.013 1.784 2.730 85 HE2 MET 13 HE2 MET 13 15.310 3.265 3.641 86 HE3 MET 13 HE3 MET 13 13.760 2.434 3.789 87 H VAL 14 H VAL 14 17.441 5.116 5.103 88 HA VAL 14 HA VAL 14 19.373 3.206 3.993 89 HB VAL 14 HB VAL 14 18.883 4.033 6.857 90 HG11 VAL 14 HG11 VAL 14 20.951 2.756 7.334 91 HG12 VAL 14 HG12 VAL 14 19.617 1.737 6.790 92 HG13 VAL 14 HG13 VAL 14 20.924 2.151 5.679 93 HG21 VAL 14 HG21 VAL 14 21.222 4.609 5.042 94 HG22 VAL 14 HG22 VAL 14 19.939 5.754 5.431 95 HG23 VAL 14 HG23 VAL 14 21.012 5.168 6.702 96 H LYS 15 H LYS 15 19.033 1.062 4.012 97 HA LYS 15 HA LYS 15 16.669 0.051 5.450 98 HB2 LYS 15 HB2 LYS 15 16.080 0.104 3.128 99 HB3 LYS 15 HB3 LYS 15 17.612 -0.625 2.662 100 HG2 LYS 15 HG2 LYS 15 15.884 -2.272 2.497 101 HG3 LYS 15 HG3 LYS 15 16.939 -2.691 3.848 102 HD2 LYS 15 HD2 LYS 15 14.655 -0.987 4.557 103 HD3 LYS 15 HD3 LYS 15 14.220 -2.594 3.968 104 HE2 LYS 15 HE2 LYS 15 16.227 -3.219 5.662 105 HE3 LYS 15 HE3 LYS 15 15.582 -1.782 6.455 106 HZ1 LYS 15 HZ1 LYS 15 14.319 -3.448 7.370 107 HZ2 LYS 15 HZ2 LYS 15 14.272 -4.365 5.950 108 HZ3 LYS 15 HZ3 LYS 15 13.327 -2.969 6.087 109 H VAL 16 H VAL 16 17.417 -1.153 7.069 110 HA VAL 16 HA VAL 16 19.569 -3.081 6.483 111 HB VAL 16 HB VAL 16 19.110 -1.650 9.104 112 HG11 VAL 16 HG11 VAL 16 21.611 -2.839 9.130 113 HG12 VAL 16 HG12 VAL 16 20.175 -3.397 9.990 114 HG13 VAL 16 HG13 VAL 16 20.564 -4.057 8.401 115 HG21 VAL 16 HG21 VAL 16 21.373 -0.678 8.609 116 HG22 VAL 16 HG22 VAL 16 21.211 -1.314 6.972 117 HG23 VAL 16 HG23 VAL 16 20.070 -0.108 7.565 118 H LEU 17 H LEU 17 18.913 -5.114 6.645 119 HA LEU 17 HA LEU 17 16.966 -5.833 8.712 120 HB2 LEU 17 HB2 LEU 17 15.527 -6.943 7.280 121 HB3 LEU 17 HB3 LEU 17 15.926 -5.473 6.391 122 HG LEU 17 HG LEU 17 17.802 -7.260 5.474 123 HD11 LEU 17 HD11 LEU 17 15.413 -8.726 6.389 124 HD12 LEU 17 HD12 LEU 17 17.066 -9.284 6.139 125 HD13 LEU 17 HD13 LEU 17 15.980 -9.101 4.762 126 HD21 LEU 17 HD21 LEU 17 16.055 -5.594 4.383 127 HD22 LEU 17 HD22 LEU 17 15.191 -7.099 4.066 128 HD23 LEU 17 HD23 LEU 17 16.829 -6.876 3.449 129 H ASP 18 H ASP 18 17.138 -7.938 9.490 130 HA ASP 18 HA ASP 18 19.732 -9.146 9.128 131 HB2 ASP 18 HB2 ASP 18 17.500 -9.385 11.041 132 HB3 ASP 18 HB3 ASP 18 18.384 -10.878 10.742 133 H ALA 19 H ALA 19 20.120 -10.455 7.475 134 HA ALA 19 HA ALA 19 18.160 -11.673 5.877 135 HB1 ALA 19 HB1 ALA 19 20.938 -12.766 6.067 136 HB2 ALA 19 HB2 ALA 19 19.901 -12.582 4.651 137 HB3 ALA 19 HB3 ALA 19 20.654 -11.165 5.384 138 H VAL 20 H VAL 20 19.417 -12.565 8.914 139 HA VAL 20 HA VAL 20 19.371 -15.328 8.895 140 HB VAL 20 HB VAL 20 18.379 -13.600 11.164 141 HG11 VAL 20 HG11 VAL 20 19.025 -16.451 10.862 142 HG12 VAL 20 HG12 VAL 20 19.712 -15.671 12.288 143 HG13 VAL 20 HG13 VAL 20 17.968 -15.640 12.018 144 HG21 VAL 20 HG21 VAL 20 20.948 -14.162 11.787 145 HG22 VAL 20 HG22 VAL 20 21.069 -14.007 10.035 146 HG23 VAL 20 HG23 VAL 20 20.429 -12.673 10.996 147 H ARG 21 H ARG 21 16.667 -13.121 9.603 148 HA ARG 21 HA ARG 21 14.826 -15.362 9.072 149 HB2 ARG 21 HB2 ARG 21 14.071 -12.951 10.696 150 HB3 ARG 21 HB3 ARG 21 13.329 -14.545 10.676 151 HG2 ARG 21 HG2 ARG 21 14.438 -14.780 12.615 152 HG3 ARG 21 HG3 ARG 21 15.784 -15.193 11.552 153 HD2 ARG 21 HD2 ARG 21 16.870 -13.581 12.679 154 HD3 ARG 21 HD3 ARG 21 15.983 -12.490 11.614 155 HE ARG 21 HE ARG 21 14.818 -11.755 13.430 156 HH11 ARG 21 HH11 ARG 21 16.211 -14.855 14.183 157 HH12 ARG 21 HH12 ARG 21 15.713 -14.821 15.842 158 HH21 ARG 21 HH21 ARG 21 14.157 -11.699 15.612 159 HH22 ARG 21 HH22 ARG 21 14.545 -13.027 16.654 160 H GLY 22 H GLY 22 15.868 -12.266 8.116 161 HA2 GLY 22 HA2 GLY 22 15.273 -11.281 6.053 162 HA3 GLY 22 HA3 GLY 22 13.770 -12.191 6.080 163 H SER 23 H SER 23 14.207 -10.903 9.094 164 HA SER 23 HA SER 23 12.247 -8.819 8.555 165 HB2 SER 23 HB2 SER 23 12.815 -8.799 11.289 166 HB3 SER 23 HB3 SER 23 11.453 -9.599 10.505 167 HG SER 23 HG SER 23 12.587 -11.491 10.470 168 HA PRO 24 HA PRO 24 14.915 -5.357 8.916 169 HB2 PRO 24 HB2 PRO 24 13.462 -3.630 10.424 170 HB3 PRO 24 HB3 PRO 24 13.057 -4.016 8.749 171 HG2 PRO 24 HG2 PRO 24 11.884 -5.101 11.280 172 HG3 PRO 24 HG3 PRO 24 11.061 -4.595 9.793 173 HD2 PRO 24 HD2 PRO 24 11.553 -7.193 10.374 174 HD3 PRO 24 HD3 PRO 24 11.532 -6.576 8.710 175 H ALA 25 H ALA 25 16.398 -4.299 10.251 176 HA ALA 25 HA ALA 25 16.744 -5.530 12.885 177 HB1 ALA 25 HB1 ALA 25 19.046 -4.655 12.759 178 HB2 ALA 25 HB2 ALA 25 18.643 -5.706 11.399 179 HB3 ALA 25 HB3 ALA 25 18.672 -3.955 11.183 180 H ILE 26 H ILE 26 16.732 -4.392 14.756 181 HA ILE 26 HA ILE 26 15.987 -1.555 14.563 182 HB ILE 26 HB ILE 26 15.276 -3.726 16.455 183 HG12 ILE 26 HG12 ILE 26 13.845 -2.534 14.614 184 HG13 ILE 26 HG13 ILE 26 13.116 -2.927 16.168 185 HG21 ILE 26 HG21 ILE 26 15.721 -0.874 17.290 186 HG22 ILE 26 HG22 ILE 26 14.628 -1.955 18.153 187 HG23 ILE 26 HG23 ILE 26 16.344 -2.345 18.037 188 HD11 ILE 26 HD11 ILE 26 14.229 -0.239 15.400 189 HD12 ILE 26 HD12 ILE 26 12.522 -0.685 15.399 190 HD13 ILE 26 HD13 ILE 26 13.423 -0.646 16.915 191 H ASN 27 H ASN 27 17.122 0.011 15.611 192 HA ASN 27 HA ASN 27 18.858 1.045 16.653 193 HB2 ASN 27 HB2 ASN 27 19.203 -1.552 18.166 194 HB3 ASN 27 HB3 ASN 27 19.785 0.039 18.650 195 HD21 ASN 27 HD21 ASN 27 17.483 1.509 17.936 196 HD22 ASN 27 HD22 ASN 27 16.226 1.093 19.046 197 H VAL 28 H VAL 28 19.643 0.510 14.303 198 HA VAL 28 HA VAL 28 22.187 -0.967 14.510 199 HB VAL 28 HB VAL 28 20.531 -0.472 12.031 200 HG11 VAL 28 HG11 VAL 28 22.129 -1.914 10.899 201 HG12 VAL 28 HG12 VAL 28 22.946 -0.514 11.595 202 HG13 VAL 28 HG13 VAL 28 23.055 -2.084 12.390 203 HG21 VAL 28 HG21 VAL 28 20.798 -3.196 12.400 204 HG22 VAL 28 HG22 VAL 28 20.506 -2.583 14.027 205 HG23 VAL 28 HG23 VAL 28 19.357 -2.236 12.735 206 H ALA 29 H ALA 29 23.809 0.426 14.749 207 HA ALA 29 HA ALA 29 23.778 3.143 14.170 208 HB1 ALA 29 HB1 ALA 29 26.366 2.794 14.127 209 HB2 ALA 29 HB2 ALA 29 25.461 2.547 15.621 210 HB3 ALA 29 HB3 ALA 29 25.955 1.161 14.649 211 H VAL 30 H VAL 30 23.954 4.291 12.356 212 HA VAL 30 HA VAL 30 25.229 3.083 10.007 213 HB VAL 30 HB VAL 30 22.561 4.493 9.897 214 HG11 VAL 30 HG11 VAL 30 24.063 4.801 7.933 215 HG12 VAL 30 HG12 VAL 30 24.055 3.050 7.713 216 HG13 VAL 30 HG13 VAL 30 22.556 3.967 7.559 217 HG21 VAL 30 HG21 VAL 30 21.770 2.501 10.565 218 HG22 VAL 30 HG22 VAL 30 22.142 1.986 8.920 219 HG23 VAL 30 HG23 VAL 30 23.290 1.672 10.222 220 H HIS 31 H HIS 31 26.485 4.456 8.884 221 HA HIS 31 HA HIS 31 26.249 7.334 9.462 222 HB2 HIS 31 HB2 HIS 31 28.886 5.959 8.974 223 HB3 HIS 31 HB3 HIS 31 28.601 7.573 9.617 224 HD1 HIS 31 HD1 HIS 31 28.254 3.940 10.613 225 HD2 HIS 31 HD2 HIS 31 28.421 7.713 12.344 226 HE1 HIS 31 HE1 HIS 31 28.397 3.537 13.092 227 H VAL 32 H VAL 32 25.906 8.508 7.704 228 HA VAL 32 HA VAL 32 26.556 7.350 5.084 229 HB VAL 32 HB VAL 32 24.769 9.722 5.600 230 HG11 VAL 32 HG11 VAL 32 25.689 8.288 3.248 231 HG12 VAL 32 HG12 VAL 32 23.929 8.386 3.335 232 HG13 VAL 32 HG13 VAL 32 24.900 9.859 3.377 233 HG21 VAL 32 HG21 VAL 32 23.699 8.007 6.790 234 HG22 VAL 32 HG22 VAL 32 22.911 8.012 5.212 235 HG23 VAL 32 HG23 VAL 32 24.125 6.788 5.588 236 H PHE 33 H PHE 33 27.859 8.378 3.643 237 HA PHE 33 HA PHE 33 28.916 11.019 4.371 238 HB2 PHE 33 HB2 PHE 33 30.506 8.540 3.726 239 HB3 PHE 33 HB3 PHE 33 31.184 10.156 3.548 240 HD1 PHE 33 HD1 PHE 33 29.551 7.924 6.030 241 HD2 PHE 33 HD2 PHE 33 32.171 11.211 5.358 242 HE1 PHE 33 HE1 PHE 33 30.148 7.932 8.417 243 HE2 PHE 33 HE2 PHE 33 32.773 11.223 7.744 244 HZ PHE 33 HZ PHE 33 31.760 9.583 9.277 245 H ARG 34 H ARG 34 30.112 12.042 2.532 246 HA ARG 34 HA ARG 34 29.081 11.160 -0.077 247 HB2 ARG 34 HB2 ARG 34 27.693 13.016 0.770 248 HB3 ARG 34 HB3 ARG 34 29.134 14.012 0.925 249 HG2 ARG 34 HG2 ARG 34 28.649 12.842 -1.737 250 HG3 ARG 34 HG3 ARG 34 27.506 14.074 -1.201 251 HD2 ARG 34 HD2 ARG 34 29.481 15.530 -0.665 252 HD3 ARG 34 HD3 ARG 34 30.495 14.328 -1.463 253 HE ARG 34 HE ARG 34 28.891 16.304 -2.724 254 HH11 ARG 34 HH11 ARG 34 30.032 13.032 -3.061 255 HH12 ARG 34 HH12 ARG 34 29.932 13.036 -4.791 256 HH21 ARG 34 HH21 ARG 34 28.757 16.323 -5.000 257 HH22 ARG 34 HH22 ARG 34 29.208 14.909 -5.893 258 H LYS 35 H LYS 35 30.421 11.478 -1.823 259 HA LYS 35 HA LYS 35 33.192 11.568 -1.344 260 HB2 LYS 35 HB2 LYS 35 32.600 10.415 -3.276 261 HB3 LYS 35 HB3 LYS 35 31.484 11.669 -3.803 262 HG2 LYS 35 HG2 LYS 35 33.431 11.614 -5.233 263 HG3 LYS 35 HG3 LYS 35 33.383 13.128 -4.326 264 HD2 LYS 35 HD2 LYS 35 35.632 12.362 -4.268 265 HD3 LYS 35 HD3 LYS 35 34.950 12.056 -2.669 266 HE2 LYS 35 HE2 LYS 35 35.834 10.006 -2.971 267 HE3 LYS 35 HE3 LYS 35 34.364 9.728 -3.904 268 HZ1 LYS 35 HZ1 LYS 35 37.048 9.723 -4.784 269 HZ2 LYS 35 HZ2 LYS 35 36.185 10.909 -5.625 270 HZ3 LYS 35 HZ3 LYS 35 35.649 9.304 -5.639 271 H ALA 36 H ALA 36 34.211 13.317 -0.606 272 HA ALA 36 HA ALA 36 33.326 15.981 -1.076 273 HB1 ALA 36 HB1 ALA 36 36.118 15.466 -0.207 274 HB2 ALA 36 HB2 ALA 36 34.935 16.624 0.403 275 HB3 ALA 36 HB3 ALA 36 34.810 14.922 0.844 276 H ALA 37 H ALA 37 34.476 17.658 -2.190 277 HA ALA 37 HA ALA 37 35.192 17.008 -4.816 278 HB1 ALA 37 HB1 ALA 37 34.363 19.234 -3.933 279 HB2 ALA 37 HB2 ALA 37 36.023 19.538 -3.417 280 HB3 ALA 37 HB3 ALA 37 35.660 19.298 -5.127 281 H ASP 38 H ASP 38 37.032 16.960 -1.926 282 HA ASP 38 HA ASP 38 39.581 17.064 -3.344 283 HB2 ASP 38 HB2 ASP 38 38.730 17.270 -0.505 284 HB3 ASP 38 HB3 ASP 38 40.325 16.589 -0.814 285 H ASP 39 H ASP 39 37.463 14.820 -3.350 286 HA ASP 39 HA ASP 39 37.486 12.557 -3.593 287 HB2 ASP 39 HB2 ASP 39 40.462 12.504 -3.225 288 HB3 ASP 39 HB3 ASP 39 39.454 11.508 -4.272 289 H THR 40 H THR 40 37.077 13.652 -1.034 290 HA THR 40 HA THR 40 38.232 11.541 0.670 291 HB THR 40 HB THR 40 38.331 12.994 2.527 292 HG1 THR 40 HG1 THR 40 36.744 14.386 2.675 293 HG21 THR 40 HG21 THR 40 39.719 14.875 1.756 294 HG22 THR 40 HG22 THR 40 39.188 14.577 0.101 295 HG23 THR 40 HG23 THR 40 40.151 13.368 0.950 296 H TRP 41 H TRP 41 36.792 11.550 2.844 297 HA TRP 41 HA TRP 41 34.037 11.106 1.912 298 HB2 TRP 41 HB2 TRP 41 35.659 9.810 4.098 299 HB3 TRP 41 HB3 TRP 41 33.908 9.640 4.007 300 HD1 TRP 41 HD1 TRP 41 36.273 9.525 0.962 301 HE1 TRP 41 HE1 TRP 41 36.047 7.212 -0.143 302 HE3 TRP 41 HE3 TRP 41 33.188 7.295 4.374 303 HZ2 TRP 41 HZ2 TRP 41 34.733 4.765 0.364 304 HZ3 TRP 41 HZ3 TRP 41 32.493 4.965 3.990 305 HH2 TRP 41 HH2 TRP 41 33.250 3.729 2.025 306 H GLU 42 H GLU 42 32.824 12.831 2.378 307 HA GLU 42 HA GLU 42 33.264 14.281 4.876 308 HB2 GLU 42 HB2 GLU 42 31.661 14.881 2.397 309 HB3 GLU 42 HB3 GLU 42 31.505 15.838 3.864 310 HG2 GLU 42 HG2 GLU 42 34.235 15.409 2.807 311 HG3 GLU 42 HG3 GLU 42 33.169 16.482 1.902 312 HA PRO 43 HA PRO 43 29.842 12.504 6.978 313 HB2 PRO 43 HB2 PRO 43 29.107 14.581 8.564 314 HB3 PRO 43 HB3 PRO 43 30.571 13.632 8.842 315 HG2 PRO 43 HG2 PRO 43 30.266 16.295 7.511 316 HG3 PRO 43 HG3 PRO 43 31.495 15.760 8.672 317 HD2 PRO 43 HD2 PRO 43 31.960 15.876 6.007 318 HD3 PRO 43 HD3 PRO 43 32.722 14.665 7.057 319 H PHE 44 H PHE 44 28.007 12.091 5.911 320 HA PHE 44 HA PHE 44 26.448 14.318 4.816 321 HB2 PHE 44 HB2 PHE 44 27.025 12.459 3.289 322 HB3 PHE 44 HB3 PHE 44 26.156 11.344 4.339 323 HD1 PHE 44 HD2 PHE 44 23.684 11.615 4.621 324 HD2 PHE 44 HD1 PHE 44 25.902 13.742 1.675 325 HE1 PHE 44 HE2 PHE 44 21.602 12.081 3.394 326 HE2 PHE 44 HE1 PHE 44 23.824 14.212 0.445 327 HZ PHE 44 HZ PHE 44 21.670 13.382 1.303 328 H ALA 45 H ALA 45 26.172 11.517 6.950 329 HA ALA 45 HA ALA 45 24.295 12.742 8.646 330 HB1 ALA 45 HB1 ALA 45 22.249 11.963 8.019 331 HB2 ALA 45 HB2 ALA 45 22.995 12.108 6.426 332 HB3 ALA 45 HB3 ALA 45 22.912 10.536 7.221 333 H SER 46 H SER 46 23.175 10.966 10.070 334 HA SER 46 HA SER 46 24.399 8.421 10.272 335 HB2 SER 46 HB2 SER 46 26.356 9.174 11.177 336 HB3 SER 46 HB3 SER 46 25.634 10.675 11.758 337 HG SER 46 HG SER 46 25.115 9.732 13.590 338 H GLY 47 H GLY 47 23.406 7.117 11.806 339 HA2 GLY 47 HA2 GLY 47 21.896 7.961 13.993 340 HA3 GLY 47 HA3 GLY 47 20.808 7.893 12.614 341 H LYS 48 H LYS 48 19.645 6.238 13.739 342 HA LYS 48 HA LYS 48 20.916 3.601 13.451 343 HB2 LYS 48 HB2 LYS 48 19.574 4.785 15.815 344 HB3 LYS 48 HB3 LYS 48 19.195 3.105 15.461 345 HG2 LYS 48 HG2 LYS 48 21.562 2.540 15.544 346 HG3 LYS 48 HG3 LYS 48 21.960 4.229 15.866 347 HD2 LYS 48 HD2 LYS 48 20.221 2.503 17.626 348 HD3 LYS 48 HD3 LYS 48 21.933 2.824 17.908 349 HE2 LYS 48 HE2 LYS 48 21.094 5.337 17.686 350 HE3 LYS 48 HE3 LYS 48 19.580 4.609 18.219 351 HZ1 LYS 48 HZ1 LYS 48 21.830 3.734 19.759 352 HZ2 LYS 48 HZ2 LYS 48 20.354 4.375 20.277 353 HZ3 LYS 48 HZ3 LYS 48 21.615 5.411 19.833 354 H THR 49 H THR 49 19.760 2.145 12.342 355 HA THR 49 HA THR 49 17.517 2.842 10.857 356 HB THR 49 HB THR 49 17.299 0.513 10.266 357 HG1 THR 49 HG1 THR 49 18.572 0.150 12.720 358 HG21 THR 49 HG21 THR 49 20.010 0.081 10.197 359 HG22 THR 49 HG22 THR 49 19.904 1.833 10.354 360 HG23 THR 49 HG23 THR 49 19.094 1.017 9.017 361 H SER 50 H SER 50 15.416 1.485 10.934 362 HA SER 50 HA SER 50 14.452 1.328 13.712 363 HB2 SER 50 HB2 SER 50 13.706 3.401 12.389 364 HB3 SER 50 HB3 SER 50 12.726 2.289 11.433 365 HG SER 50 HG SER 50 11.722 3.319 13.353 366 H GLU 51 H GLU 51 12.202 0.194 13.719 367 HA GLU 51 HA GLU 51 12.608 -2.439 12.739 368 HB2 GLU 51 HB2 GLU 51 10.242 -2.794 13.582 369 HB3 GLU 51 HB3 GLU 51 11.412 -2.239 14.770 370 HG2 GLU 51 HG2 GLU 51 10.137 -0.503 15.250 371 HG3 GLU 51 HG3 GLU 51 10.200 0.036 13.574 372 H SER 52 H SER 52 11.494 0.319 11.226 373 HA SER 52 HA SER 52 9.758 -1.148 9.373 374 HB2 SER 52 HB2 SER 52 8.786 0.898 10.227 375 HB3 SER 52 HB3 SER 52 10.213 1.820 9.756 376 HG SER 52 HG SER 52 8.444 1.981 8.258 377 H GLY 53 H GLY 53 12.931 -0.572 9.668 378 HA2 GLY 53 HA2 GLY 53 14.668 -0.788 8.171 379 HA3 GLY 53 HA3 GLY 53 13.474 -1.094 6.918 380 H GLU 54 H GLU 54 13.159 1.803 8.757 381 HA GLU 54 HA GLU 54 14.425 3.352 6.601 382 HB2 GLU 54 HB2 GLU 54 12.529 5.026 6.936 383 HB3 GLU 54 HB3 GLU 54 12.138 3.544 6.075 384 HG2 GLU 54 HG2 GLU 54 10.843 2.730 7.772 385 HG3 GLU 54 HG3 GLU 54 11.709 3.632 9.014 386 H LEU 55 H LEU 55 15.584 5.102 7.229 387 HA LEU 55 HA LEU 55 15.708 5.627 10.123 388 HB2 LEU 55 HB2 LEU 55 17.722 4.912 8.379 389 HB3 LEU 55 HB3 LEU 55 17.915 6.658 8.529 390 HG LEU 55 HG LEU 55 17.788 4.822 10.912 391 HD11 LEU 55 HD11 LEU 55 19.742 4.621 9.064 392 HD12 LEU 55 HD12 LEU 55 19.983 4.349 10.790 393 HD13 LEU 55 HD13 LEU 55 20.390 5.911 10.077 394 HD21 LEU 55 HD21 LEU 55 19.338 7.067 11.433 395 HD22 LEU 55 HD22 LEU 55 17.689 6.768 11.985 396 HD23 LEU 55 HD23 LEU 55 17.971 7.678 10.499 397 H HIS 56 H HIS 56 14.607 7.400 10.638 398 HA HIS 56 HA HIS 56 14.453 9.616 8.737 399 HB2 HIS 56 HB2 HIS 56 12.329 8.948 9.633 400 HB3 HIS 56 HB3 HIS 56 12.942 9.016 11.283 401 HD1 HIS 56 HD1 HIS 56 13.344 11.704 8.646 402 HD2 HIS 56 HD2 HIS 56 11.407 11.052 12.264 403 HE1 HIS 56 HE1 HIS 56 12.348 13.923 9.285 404 H GLY 57 H GLY 57 15.748 11.318 8.918 405 HA2 GLY 57 HA2 GLY 57 16.377 13.119 10.579 406 HA3 GLY 57 HA3 GLY 57 17.046 11.800 11.527 407 H LEU 58 H LEU 58 17.554 11.000 8.383 408 HA LEU 58 HA LEU 58 20.315 11.965 8.510 409 HB2 LEU 58 HB2 LEU 58 19.067 9.897 6.705 410 HB3 LEU 58 HB3 LEU 58 20.782 10.289 6.802 411 HG LEU 58 HG LEU 58 19.093 8.937 8.901 412 HD11 LEU 58 HD11 LEU 58 19.929 7.020 8.147 413 HD12 LEU 58 HD12 LEU 58 21.566 7.673 8.081 414 HD13 LEU 58 HD13 LEU 58 20.465 7.914 6.725 415 HD21 LEU 58 HD21 LEU 58 21.750 8.841 9.689 416 HD22 LEU 58 HD22 LEU 58 20.469 9.812 10.415 417 HD23 LEU 58 HD23 LEU 58 21.508 10.510 9.173 418 H THR 59 H THR 59 17.379 12.322 6.713 419 HA THR 59 HA THR 59 18.356 13.303 4.285 420 HB THR 59 HB THR 59 16.139 14.574 4.199 421 HG1 THR 59 HG1 THR 59 14.707 14.216 5.846 422 HG21 THR 59 HG21 THR 59 15.194 12.719 3.335 423 HG22 THR 59 HG22 THR 59 15.412 11.796 4.821 424 HG23 THR 59 HG23 THR 59 16.752 11.974 3.689 425 H THR 60 H THR 60 19.326 15.139 3.718 426 HA THR 60 HA THR 60 18.933 17.569 5.262 427 HB THR 60 HB THR 60 21.417 17.969 5.394 428 HG1 THR 60 HG1 THR 60 21.538 15.154 4.944 429 HG21 THR 60 HG21 THR 60 20.137 17.346 7.372 430 HG22 THR 60 HG22 THR 60 21.729 16.589 7.408 431 HG23 THR 60 HG23 THR 60 20.311 15.639 6.967 432 H GLU 61 H GLU 61 20.374 19.377 4.231 433 HA GLU 61 HA GLU 61 19.566 19.633 1.539 434 HB2 GLU 61 HB2 GLU 61 20.898 21.706 1.545 435 HB3 GLU 61 HB3 GLU 61 19.865 21.582 2.961 436 HG2 GLU 61 HG2 GLU 61 21.761 20.879 4.308 437 HG3 GLU 61 HG3 GLU 61 22.807 20.950 2.890 438 H GLU 62 H GLU 62 22.230 18.075 2.944 439 HA GLU 62 HA GLU 62 24.173 18.442 0.923 440 HB2 GLU 62 HB2 GLU 62 23.808 16.698 3.261 441 HB3 GLU 62 HB3 GLU 62 24.753 15.978 1.965 442 HG2 GLU 62 HG2 GLU 62 25.317 18.562 3.397 443 HG3 GLU 62 HG3 GLU 62 26.227 17.056 3.515 444 H GLU 63 H GLU 63 21.251 16.745 0.939 445 HA GLU 63 HA GLU 63 21.891 14.560 -0.735 446 HB2 GLU 63 HB2 GLU 63 19.534 14.281 -1.026 447 HB3 GLU 63 HB3 GLU 63 19.806 14.788 0.636 448 HG2 GLU 63 HG2 GLU 63 19.295 17.139 -0.141 449 HG3 GLU 63 HG3 GLU 63 18.731 16.414 -1.645 450 H PHE 64 H PHE 64 21.716 17.882 -1.349 451 HA PHE 64 HA PHE 64 20.996 17.630 -4.145 452 HB2 PHE 64 HB2 PHE 64 21.695 19.937 -2.350 453 HB3 PHE 64 HB3 PHE 64 21.639 20.143 -4.098 454 HD1 PHE 64 HD1 PHE 64 19.384 18.738 -5.025 455 HD2 PHE 64 HD2 PHE 64 19.844 20.831 -1.348 456 HE1 PHE 64 HE1 PHE 64 16.947 19.063 -4.910 457 HE2 PHE 64 HE2 PHE 64 17.409 21.158 -1.225 458 HZ PHE 64 HZ PHE 64 15.958 20.273 -3.008 459 H VAL 65 H VAL 65 23.082 16.035 -3.867 460 HA VAL 65 HA VAL 65 25.367 17.570 -4.928 461 HB VAL 65 HB VAL 65 26.816 15.711 -4.120 462 HG11 VAL 65 HG11 VAL 65 26.562 16.313 -1.656 463 HG12 VAL 65 HG12 VAL 65 26.823 17.644 -2.785 464 HG13 VAL 65 HG13 VAL 65 25.205 17.320 -2.159 465 HG21 VAL 65 HG21 VAL 65 24.771 14.786 -2.213 466 HG22 VAL 65 HG22 VAL 65 24.544 14.271 -3.885 467 HG23 VAL 65 HG23 VAL 65 26.044 13.887 -3.040 468 H GLU 66 H GLU 66 26.909 15.773 -6.057 469 HA GLU 66 HA GLU 66 25.801 15.207 -8.509 470 HB2 GLU 66 HB2 GLU 66 28.067 13.783 -7.104 471 HB3 GLU 66 HB3 GLU 66 27.689 13.601 -8.812 472 HG2 GLU 66 HG2 GLU 66 28.117 16.345 -7.774 473 HG3 GLU 66 HG3 GLU 66 29.522 15.294 -7.947 474 H GLY 67 H GLY 67 26.169 12.986 -5.752 475 HA2 GLY 67 HA2 GLY 67 23.913 11.654 -5.634 476 HA3 GLY 67 HA3 GLY 67 24.523 11.005 -7.149 477 H ILE 68 H ILE 68 27.287 11.474 -5.700 478 HA ILE 68 HA ILE 68 27.664 8.755 -4.996 479 HB ILE 68 HB ILE 68 29.452 11.087 -4.300 480 HG12 ILE 68 HG12 ILE 68 29.593 9.302 -6.735 481 HG13 ILE 68 HG13 ILE 68 28.857 10.901 -6.743 482 HG21 ILE 68 HG21 ILE 68 31.217 9.282 -4.449 483 HG22 ILE 68 HG22 ILE 68 30.128 9.192 -3.064 484 HG23 ILE 68 HG23 ILE 68 29.892 8.117 -4.441 485 HD11 ILE 68 HD11 ILE 68 31.733 10.161 -6.392 486 HD12 ILE 68 HD12 ILE 68 30.997 11.252 -7.567 487 HD13 ILE 68 HD13 ILE 68 31.117 11.728 -5.874 488 H TYR 69 H TYR 69 27.163 7.755 -3.171 489 HA TYR 69 HA TYR 69 27.286 9.218 -0.640 490 HB2 TYR 69 HB2 TYR 69 24.906 7.556 -1.493 491 HB3 TYR 69 HB3 TYR 69 25.122 8.310 0.082 492 HD1 TYR 69 HD2 TYR 69 25.802 10.969 -0.241 493 HD2 TYR 69 HD1 TYR 69 23.384 8.625 -2.841 494 HE1 TYR 69 HE2 TYR 69 24.718 13.016 -1.068 495 HE2 TYR 69 HE1 TYR 69 22.294 10.665 -3.676 496 HH TYR 69 HH TYR 69 22.188 12.876 -3.562 497 H LYS 70 H LYS 70 28.394 8.103 0.816 498 HA LYS 70 HA LYS 70 28.615 5.184 0.474 499 HB2 LYS 70 HB2 LYS 70 30.767 5.641 1.931 500 HB3 LYS 70 HB3 LYS 70 30.791 5.861 0.187 501 HG2 LYS 70 HG2 LYS 70 30.043 8.205 1.831 502 HG3 LYS 70 HG3 LYS 70 31.727 7.681 1.882 503 HD2 LYS 70 HD2 LYS 70 31.056 7.610 -0.815 504 HD3 LYS 70 HD3 LYS 70 30.282 9.075 -0.207 505 HE2 LYS 70 HE2 LYS 70 32.247 10.116 0.136 506 HE3 LYS 70 HE3 LYS 70 33.029 8.654 0.737 507 HZ1 LYS 70 HZ1 LYS 70 33.670 8.027 -1.349 508 HZ2 LYS 70 HZ2 LYS 70 33.743 9.708 -1.520 509 HZ3 LYS 70 HZ3 LYS 70 32.414 8.854 -2.126 510 H VAL 71 H VAL 71 27.196 4.306 1.861 511 HA VAL 71 HA VAL 71 26.994 5.402 4.575 512 HB VAL 71 HB VAL 71 25.216 3.420 3.147 513 HG11 VAL 71 HG11 VAL 71 23.694 3.842 5.105 514 HG12 VAL 71 HG12 VAL 71 25.147 2.907 5.467 515 HG13 VAL 71 HG13 VAL 71 25.062 4.613 5.906 516 HG21 VAL 71 HG21 VAL 71 24.287 5.226 2.239 517 HG22 VAL 71 HG22 VAL 71 23.778 5.704 3.858 518 HG23 VAL 71 HG23 VAL 71 25.300 6.303 3.200 519 H GLU 72 H GLU 72 27.404 4.184 6.385 520 HA GLU 72 HA GLU 72 28.498 1.485 5.947 521 HB2 GLU 72 HB2 GLU 72 30.350 1.888 7.278 522 HB3 GLU 72 HB3 GLU 72 30.173 3.420 6.433 523 HG2 GLU 72 HG2 GLU 72 28.734 4.056 8.525 524 HG3 GLU 72 HG3 GLU 72 29.647 2.753 9.285 525 H ILE 73 H ILE 73 27.909 -0.066 7.384 526 HA ILE 73 HA ILE 73 26.109 0.766 9.565 527 HB ILE 73 HB ILE 73 26.031 -1.798 7.969 528 HG12 ILE 73 HG12 ILE 73 23.581 -0.494 7.777 529 HG13 ILE 73 HG13 ILE 73 24.761 0.804 7.643 530 HG21 ILE 73 HG21 ILE 73 23.742 -1.859 9.296 531 HG22 ILE 73 HG22 ILE 73 25.229 -2.516 9.978 532 HG23 ILE 73 HG23 ILE 73 24.673 -0.912 10.457 533 HD11 ILE 73 HD11 ILE 73 25.352 0.187 5.589 534 HD12 ILE 73 HD12 ILE 73 25.423 -1.521 6.023 535 HD13 ILE 73 HD13 ILE 73 23.879 -0.782 5.600 536 H ASP 74 H ASP 74 26.488 0.022 11.579 537 HA ASP 74 HA ASP 74 28.864 -1.670 11.942 538 HB2 ASP 74 HB2 ASP 74 28.080 0.747 13.151 539 HB3 ASP 74 HB3 ASP 74 27.883 -0.492 14.388 540 H THR 75 H THR 75 28.263 -3.745 12.053 541 HA THR 75 HA THR 75 25.803 -4.494 13.422 542 HB THR 75 HB THR 75 26.436 -6.826 12.665 543 HG1 THR 75 HG1 THR 75 28.563 -6.781 12.221 544 HG21 THR 75 HG21 THR 75 25.929 -4.558 10.771 545 HG22 THR 75 HG22 THR 75 24.818 -5.804 11.339 546 HG23 THR 75 HG23 THR 75 26.077 -6.210 10.173 547 H LYS 76 H LYS 76 28.454 -3.553 14.694 548 HA LYS 76 HA LYS 76 29.228 -5.852 16.277 549 HB2 LYS 76 HB2 LYS 76 30.933 -4.486 17.177 550 HB3 LYS 76 HB3 LYS 76 30.811 -4.024 15.485 551 HG2 LYS 76 HG2 LYS 76 30.873 -1.955 16.390 552 HG3 LYS 76 HG3 LYS 76 29.134 -2.230 16.510 553 HD2 LYS 76 HD2 LYS 76 29.813 -3.288 18.832 554 HD3 LYS 76 HD3 LYS 76 31.216 -2.235 18.639 555 HE2 LYS 76 HE2 LYS 76 28.706 -0.895 18.028 556 HE3 LYS 76 HE3 LYS 76 28.763 -1.514 19.678 557 HZ1 LYS 76 HZ1 LYS 76 29.745 0.495 19.979 558 HZ2 LYS 76 HZ2 LYS 76 30.384 0.565 18.415 559 HZ3 LYS 76 HZ3 LYS 76 31.128 -0.400 19.590 560 H SER 77 H SER 77 27.287 -2.956 16.627 561 HA SER 77 HA SER 77 26.864 -3.447 19.464 562 HB2 SER 77 HB2 SER 77 25.158 -1.404 18.801 563 HB3 SER 77 HB3 SER 77 26.823 -1.190 19.346 564 HG SER 77 HG SER 77 25.751 -1.022 16.766 565 H TYR 78 H TYR 78 25.490 -4.351 16.518 566 HA TYR 78 HA TYR 78 22.754 -4.495 17.319 567 HB2 TYR 78 HB2 TYR 78 23.319 -4.375 14.963 568 HB3 TYR 78 HB3 TYR 78 24.248 -5.865 15.074 569 HD1 TYR 78 HD1 TYR 78 20.830 -4.455 15.221 570 HD2 TYR 78 HD2 TYR 78 23.191 -7.982 14.899 571 HE1 TYR 78 HE1 TYR 78 18.816 -5.744 14.643 572 HE2 TYR 78 HE2 TYR 78 21.184 -9.279 14.320 573 HH TYR 78 HH TYR 78 18.105 -7.733 13.720 574 H TRP 79 H TRP 79 25.459 -6.758 17.276 575 HA TRP 79 HA TRP 79 23.870 -8.985 18.154 576 HB2 TRP 79 HB2 TRP 79 25.671 -10.199 17.587 577 HB3 TRP 79 HB3 TRP 79 26.369 -8.696 16.986 578 HD1 TRP 79 HD1 TRP 79 26.217 -10.591 20.381 579 HE1 TRP 79 HE1 TRP 79 28.493 -10.295 21.547 580 HE3 TRP 79 HE3 TRP 79 28.499 -7.566 16.949 581 HZ2 TRP 79 HZ2 TRP 79 30.931 -8.955 21.074 582 HZ3 TRP 79 HZ3 TRP 79 30.804 -6.820 17.381 583 HH2 TRP 79 HH2 TRP 79 31.993 -7.501 19.402 584 H LYS 80 H LYS 80 25.792 -6.497 19.660 585 HA LYS 80 HA LYS 80 25.843 -7.786 22.241 586 HB2 LYS 80 HB2 LYS 80 27.178 -6.031 22.947 587 HB3 LYS 80 HB3 LYS 80 27.546 -6.085 21.228 588 HG2 LYS 80 HG2 LYS 80 27.173 -3.876 21.348 589 HG3 LYS 80 HG3 LYS 80 25.479 -4.357 21.216 590 HD2 LYS 80 HD2 LYS 80 25.405 -2.971 23.052 591 HD3 LYS 80 HD3 LYS 80 25.645 -4.539 23.824 592 HE2 LYS 80 HE2 LYS 80 28.054 -4.099 23.945 593 HE3 LYS 80 HE3 LYS 80 27.801 -2.527 23.186 594 HZ1 LYS 80 HZ1 LYS 80 27.789 -1.919 25.358 595 HZ2 LYS 80 HZ2 LYS 80 27.182 -3.400 25.907 596 HZ3 LYS 80 HZ3 LYS 80 26.142 -2.271 25.193 597 H ALA 81 H ALA 81 23.633 -5.893 20.495 598 HA ALA 81 HA ALA 81 22.330 -4.766 22.830 599 HB1 ALA 81 HB1 ALA 81 20.611 -4.140 20.941 600 HB2 ALA 81 HB2 ALA 81 22.137 -3.272 21.107 601 HB3 ALA 81 HB3 ALA 81 21.968 -4.533 19.884 602 H LEU 82 H LEU 82 21.630 -7.197 20.338 603 HA LEU 82 HA LEU 82 19.355 -8.123 21.953 604 HB2 LEU 82 HB2 LEU 82 20.005 -8.817 19.095 605 HB3 LEU 82 HB3 LEU 82 18.520 -9.190 19.969 606 HG LEU 82 HG LEU 82 17.860 -7.424 18.651 607 HD11 LEU 82 HD11 LEU 82 17.814 -7.005 21.262 608 HD12 LEU 82 HD12 LEU 82 17.259 -5.788 20.114 609 HD13 LEU 82 HD13 LEU 82 18.871 -5.665 20.819 610 HD21 LEU 82 HD21 LEU 82 20.253 -7.024 17.875 611 HD22 LEU 82 HD22 LEU 82 20.374 -5.873 19.206 612 HD23 LEU 82 HD23 LEU 82 19.183 -5.623 17.928 613 H GLY 83 H GLY 83 22.445 -8.713 21.953 614 HA2 GLY 83 HA2 GLY 83 23.782 -10.511 22.452 615 HA3 GLY 83 HA3 GLY 83 22.320 -11.247 23.091 616 H ILE 84 H ILE 84 23.213 -10.366 19.765 617 HA ILE 84 HA ILE 84 22.402 -13.017 18.881 618 HB ILE 84 HB ILE 84 23.423 -10.784 17.136 619 HG12 ILE 84 HG12 ILE 84 21.581 -9.907 18.488 620 HG13 ILE 84 HG13 ILE 84 21.071 -10.120 16.817 621 HG21 ILE 84 HG21 ILE 84 21.864 -13.304 16.689 622 HG22 ILE 84 HG22 ILE 84 21.785 -11.968 15.541 623 HG23 ILE 84 HG23 ILE 84 23.330 -12.744 15.883 624 HD11 ILE 84 HD11 ILE 84 20.498 -12.074 19.029 625 HD12 ILE 84 HD12 ILE 84 19.384 -10.823 18.478 626 HD13 ILE 84 HD13 ILE 84 19.873 -12.114 17.381 627 H SER 85 H SER 85 23.746 -14.243 17.377 628 HA SER 85 HA SER 85 26.198 -14.950 18.364 629 HB2 SER 85 HB2 SER 85 24.810 -15.332 15.781 630 HB3 SER 85 HB3 SER 85 26.556 -15.569 15.745 631 HG SER 85 HG SER 85 25.316 -17.479 16.270 632 HA PRO 86 HA PRO 86 29.199 -11.970 17.201 633 HB2 PRO 86 HB2 PRO 86 31.330 -13.517 16.543 634 HB3 PRO 86 HB3 PRO 86 30.774 -13.306 18.207 635 HG2 PRO 86 HG2 PRO 86 30.261 -15.565 16.310 636 HG3 PRO 86 HG3 PRO 86 30.668 -15.622 18.035 637 HD2 PRO 86 HD2 PRO 86 28.136 -15.928 17.127 638 HD3 PRO 86 HD3 PRO 86 28.504 -15.174 18.691 639 H MET 87 H MET 87 30.149 -10.924 15.451 640 HA MET 87 HA MET 87 30.558 -12.069 12.911 641 HB2 MET 87 HB2 MET 87 28.074 -12.125 12.929 642 HB3 MET 87 HB3 MET 87 28.060 -10.378 13.126 643 HG2 MET 87 HG2 MET 87 27.787 -10.493 10.882 644 HG3 MET 87 HG3 MET 87 29.549 -10.477 10.951 645 HE1 MET 87 HE1 MET 87 30.639 -13.642 9.385 646 HE2 MET 87 HE2 MET 87 30.786 -11.885 9.422 647 HE3 MET 87 HE3 MET 87 31.009 -12.820 10.901 648 H HIS 88 H HIS 88 32.048 -10.846 11.963 649 HA HIS 88 HA HIS 88 33.076 -8.513 13.010 650 HB2 HIS 88 HB2 HIS 88 33.223 -9.797 10.315 651 HB3 HIS 88 HB3 HIS 88 33.885 -8.178 10.517 652 HD1 HIS 88 HD1 HIS 88 34.239 -10.336 13.470 653 HD2 HIS 88 HD2 HIS 88 36.436 -9.434 10.062 654 HE1 HIS 88 HE1 HIS 88 36.567 -11.172 13.930 655 H GLU 89 H GLU 89 33.153 -6.335 11.974 656 HA GLU 89 HA GLU 89 30.694 -5.092 11.988 657 HB2 GLU 89 HB2 GLU 89 33.321 -4.297 10.758 658 HB3 GLU 89 HB3 GLU 89 31.913 -3.250 10.661 659 HG2 GLU 89 HG2 GLU 89 33.037 -2.452 12.512 660 HG3 GLU 89 HG3 GLU 89 31.810 -3.503 13.216 661 H HIS 90 H HIS 90 29.558 -3.965 10.231 662 HA HIS 90 HA HIS 90 29.093 -5.777 8.027 663 HB2 HIS 90 HB2 HIS 90 27.400 -4.271 9.449 664 HB3 HIS 90 HB3 HIS 90 27.732 -3.135 8.144 665 HD1 HIS 90 HD1 HIS 90 27.387 -6.878 7.737 666 HD2 HIS 90 HD2 HIS 90 25.373 -3.374 6.773 667 HE1 HIS 90 HE1 HIS 90 25.514 -7.577 6.211 668 H ALA 91 H ALA 91 28.643 -4.647 5.820 669 HA ALA 91 HA ALA 91 31.124 -3.304 5.087 670 HB1 ALA 91 HB1 ALA 91 29.572 -5.252 3.859 671 HB2 ALA 91 HB2 ALA 91 29.307 -3.801 2.892 672 HB3 ALA 91 HB3 ALA 91 30.945 -4.397 3.158 673 H GLU 92 H GLU 92 30.425 -1.889 2.870 674 HA GLU 92 HA GLU 92 28.452 0.085 3.790 675 HB2 GLU 92 HB2 GLU 92 30.037 1.864 2.890 676 HB3 GLU 92 HB3 GLU 92 30.482 1.110 4.413 677 HG2 GLU 92 HG2 GLU 92 31.990 -0.409 3.136 678 HG3 GLU 92 HG3 GLU 92 31.637 0.544 1.696 679 H VAL 93 H VAL 93 27.545 1.404 2.117 680 HA VAL 93 HA VAL 93 27.639 0.090 -0.514 681 HB VAL 93 HB VAL 93 25.471 1.892 0.569 682 HG11 VAL 93 HG11 VAL 93 24.190 1.264 -1.313 683 HG12 VAL 93 HG12 VAL 93 25.786 1.687 -1.937 684 HG13 VAL 93 HG13 VAL 93 25.327 -0.007 -1.759 685 HG21 VAL 93 HG21 VAL 93 25.126 0.088 1.910 686 HG22 VAL 93 HG22 VAL 93 24.279 -0.489 0.474 687 HG23 VAL 93 HG23 VAL 93 25.925 -1.029 0.804 688 H VAL 94 H VAL 94 28.948 1.124 -1.874 689 HA VAL 94 HA VAL 94 28.872 4.073 -1.913 690 HB VAL 94 HB VAL 94 31.184 2.339 -2.789 691 HG11 VAL 94 HG11 VAL 94 32.409 4.523 -2.673 692 HG12 VAL 94 HG12 VAL 94 31.195 4.420 -3.950 693 HG13 VAL 94 HG13 VAL 94 30.845 5.314 -2.471 694 HG21 VAL 94 HG21 VAL 94 31.444 2.039 -0.567 695 HG22 VAL 94 HG22 VAL 94 32.119 3.666 -0.639 696 HG23 VAL 94 HG23 VAL 94 30.440 3.428 -0.152 697 H PHE 95 H PHE 95 27.704 4.734 -3.591 698 HA PHE 95 HA PHE 95 28.147 3.433 -6.193 699 HB2 PHE 95 HB2 PHE 95 25.547 4.214 -4.897 700 HB3 PHE 95 HB3 PHE 95 25.686 4.088 -6.647 701 HD1 PHE 95 HD2 PHE 95 26.868 1.821 -7.439 702 HD2 PHE 95 HD1 PHE 95 24.780 2.376 -3.772 703 HE1 PHE 95 HE2 PHE 95 26.483 -0.605 -7.295 704 HE2 PHE 95 HE1 PHE 95 24.394 -0.049 -3.621 705 HZ PHE 95 HZ PHE 95 25.245 -1.543 -5.385 706 H THR 96 H THR 96 28.541 4.766 -7.864 707 HA THR 96 HA THR 96 28.649 7.631 -7.297 708 HB THR 96 HB THR 96 30.667 6.543 -8.221 709 HG1 THR 96 HG1 THR 96 29.404 8.433 -9.945 710 HG21 THR 96 HG21 THR 96 28.808 5.331 -9.969 711 HG22 THR 96 HG22 THR 96 30.557 5.108 -9.921 712 HG23 THR 96 HG23 THR 96 29.854 6.349 -10.957 713 H ALA 97 H ALA 97 27.650 9.186 -8.562 714 HA ALA 97 HA ALA 97 25.218 8.340 -9.856 715 HB1 ALA 97 HB1 ALA 97 25.898 11.157 -10.136 716 HB2 ALA 97 HB2 ALA 97 24.486 10.399 -9.398 717 HB3 ALA 97 HB3 ALA 97 25.971 10.590 -8.466 718 H ASN 98 H ASN 98 24.588 9.067 -12.005 719 HA ASN 98 HA ASN 98 24.877 9.218 -14.255 720 HB2 ASN 98 HB2 ASN 98 27.654 10.283 -13.843 721 HB3 ASN 98 HB3 ASN 98 26.476 10.708 -15.083 722 HD21 ASN 98 HD21 ASN 98 27.922 11.705 -12.295 723 HD22 ASN 98 HD22 ASN 98 26.774 12.894 -11.789 724 H ASP 99 H ASP 99 25.145 6.754 -13.536 725 HA ASP 99 HA ASP 99 27.082 5.671 -15.347 726 HB2 ASP 99 HB2 ASP 99 28.502 4.534 -13.879 727 HB3 ASP 99 HB3 ASP 99 28.314 6.108 -13.110 728 H SER 100 H SER 100 27.134 3.059 -14.617 729 HA SER 100 HA SER 100 24.530 2.183 -15.329 730 HB2 SER 100 HB2 SER 100 26.522 0.947 -16.025 731 HB3 SER 100 HB3 SER 100 26.916 0.601 -14.342 732 HG SER 100 HG SER 100 25.251 -0.710 -15.995 733 H GLY 101 H GLY 101 23.105 2.899 -13.727 734 HA2 GLY 101 HA2 GLY 101 22.202 1.235 -11.831 735 HA3 GLY 101 HA3 GLY 101 23.508 2.047 -10.980 736 HA PRO 102 HA PRO 102 20.249 5.466 -12.045 737 HB2 PRO 102 HB2 PRO 102 17.861 4.598 -13.005 738 HB3 PRO 102 HB3 PRO 102 19.219 5.024 -14.052 739 HG2 PRO 102 HG2 PRO 102 18.305 2.323 -13.138 740 HG3 PRO 102 HG3 PRO 102 18.839 2.837 -14.748 741 HD2 PRO 102 HD2 PRO 102 20.453 1.494 -13.038 742 HD3 PRO 102 HD3 PRO 102 21.072 2.693 -14.192 743 H ARG 103 H ARG 103 18.645 2.391 -11.200 744 HA ARG 103 HA ARG 103 17.090 3.677 -9.130 745 HB2 ARG 103 HB2 ARG 103 17.296 0.852 -10.145 746 HB3 ARG 103 HB3 ARG 103 16.390 1.240 -8.689 747 HG2 ARG 103 HG2 ARG 103 15.816 2.774 -11.171 748 HG3 ARG 103 HG3 ARG 103 15.219 1.119 -11.033 749 HD2 ARG 103 HD2 ARG 103 14.769 3.149 -8.868 750 HD3 ARG 103 HD3 ARG 103 13.685 3.017 -10.253 751 HE ARG 103 HE ARG 103 13.784 1.288 -7.999 752 HH11 ARG 103 HH11 ARG 103 13.206 1.344 -11.432 753 HH12 ARG 103 HH12 ARG 103 12.173 -0.046 -11.412 754 HH21 ARG 103 HH21 ARG 103 12.426 -0.543 -7.960 755 HH22 ARG 103 HH22 ARG 103 11.729 -1.119 -9.437 756 H ARG 104 H ARG 104 19.159 4.400 -8.062 757 HA ARG 104 HA ARG 104 19.873 2.438 -6.010 758 HB2 ARG 104 HB2 ARG 104 21.883 4.112 -7.526 759 HB3 ARG 104 HB3 ARG 104 22.245 3.087 -6.144 760 HG2 ARG 104 HG2 ARG 104 21.207 1.207 -7.619 761 HG3 ARG 104 HG3 ARG 104 21.562 2.321 -8.940 762 HD2 ARG 104 HD2 ARG 104 23.904 2.400 -8.248 763 HD3 ARG 104 HD3 ARG 104 23.550 1.304 -6.913 764 HE ARG 104 HE ARG 104 23.952 0.603 -9.659 765 HH11 ARG 104 HH11 ARG 104 22.363 -0.322 -6.704 766 HH12 ARG 104 HH12 ARG 104 22.275 -2.001 -7.123 767 HH21 ARG 104 HH21 ARG 104 23.842 -1.605 -10.223 768 HH22 ARG 104 HH22 ARG 104 23.117 -2.729 -9.125 769 H TYR 105 H TYR 105 18.360 3.750 -4.787 770 HA TYR 105 HA TYR 105 19.580 6.262 -3.844 771 HB2 TYR 105 HB2 TYR 105 16.668 5.570 -4.228 772 HB3 TYR 105 HB3 TYR 105 17.201 6.940 -3.260 773 HD1 TYR 105 HD2 TYR 105 19.294 8.184 -4.736 774 HD2 TYR 105 HD1 TYR 105 15.775 6.308 -6.221 775 HE1 TYR 105 HE2 TYR 105 19.416 9.573 -6.761 776 HE2 TYR 105 HE1 TYR 105 15.888 7.691 -8.251 777 HH TYR 105 HH TYR 105 18.461 10.101 -8.692 778 H THR 106 H THR 106 17.706 3.401 -2.985 779 HA THR 106 HA THR 106 17.988 3.973 -0.142 780 HB THR 106 HB THR 106 16.633 1.653 -1.530 781 HG1 THR 106 HG1 THR 106 14.768 2.792 -1.203 782 HG21 THR 106 HG21 THR 106 16.938 2.417 1.351 783 HG22 THR 106 HG22 THR 106 17.117 0.836 0.592 784 HG23 THR 106 HG23 THR 106 15.513 1.534 0.807 785 H ILE 107 H ILE 107 19.353 2.950 1.216 786 HA ILE 107 HA ILE 107 21.412 1.279 0.037 787 HB ILE 107 HB ILE 107 21.113 2.369 2.838 788 HG12 ILE 107 HG12 ILE 107 23.335 3.523 1.807 789 HG13 ILE 107 HG13 ILE 107 22.377 3.337 0.342 790 HG21 ILE 107 HG21 ILE 107 22.619 0.853 3.449 791 HG22 ILE 107 HG22 ILE 107 22.819 0.299 1.787 792 HG23 ILE 107 HG23 ILE 107 23.771 1.659 2.383 793 HD11 ILE 107 HD11 ILE 107 21.123 4.544 2.756 794 HD12 ILE 107 HD12 ILE 107 22.214 5.509 1.761 795 HD13 ILE 107 HD13 ILE 107 20.764 4.802 1.048 796 H ALA 108 H ALA 108 20.964 -0.816 -0.187 797 HA ALA 108 HA ALA 108 19.276 -2.179 1.759 798 HB1 ALA 108 HB1 ALA 108 20.458 -3.147 -0.841 799 HB2 ALA 108 HB2 ALA 108 19.351 -4.062 0.182 800 HB3 ALA 108 HB3 ALA 108 18.811 -2.571 -0.589 801 H ALA 109 H ALA 109 20.230 -2.950 3.522 802 HA ALA 109 HA ALA 109 22.834 -4.294 3.224 803 HB1 ALA 109 HB1 ALA 109 22.891 -2.040 4.406 804 HB2 ALA 109 HB2 ALA 109 22.025 -2.835 5.721 805 HB3 ALA 109 HB3 ALA 109 23.625 -3.405 5.248 806 H MET 110 H MET 110 22.578 -6.400 3.545 807 HA MET 110 HA MET 110 20.522 -7.305 5.444 808 HB2 MET 110 HB2 MET 110 21.781 -8.609 3.041 809 HB3 MET 110 HB3 MET 110 20.907 -9.547 4.246 810 HG2 MET 110 HG2 MET 110 18.963 -7.963 3.842 811 HG3 MET 110 HG3 MET 110 19.853 -7.415 2.423 812 HE1 MET 110 HE1 MET 110 18.601 -11.621 3.387 813 HE2 MET 110 HE2 MET 110 18.544 -10.187 4.412 814 HE3 MET 110 HE3 MET 110 17.193 -10.559 3.339 815 H LEU 111 H LEU 111 21.154 -8.129 7.321 816 HA LEU 111 HA LEU 111 23.967 -8.602 7.813 817 HB2 LEU 111 HB2 LEU 111 21.629 -8.912 9.688 818 HB3 LEU 111 HB3 LEU 111 23.333 -8.850 10.131 819 HG LEU 111 HG LEU 111 22.607 -6.735 10.690 820 HD11 LEU 111 HD11 LEU 111 23.340 -6.271 7.812 821 HD12 LEU 111 HD12 LEU 111 24.517 -6.736 9.038 822 HD13 LEU 111 HD13 LEU 111 23.631 -5.220 9.197 823 HD21 LEU 111 HD21 LEU 111 20.381 -7.262 9.337 824 HD22 LEU 111 HD22 LEU 111 21.136 -6.167 8.178 825 HD23 LEU 111 HD23 LEU 111 20.821 -5.626 9.827 826 H SER 112 H SER 112 24.368 -10.460 6.569 827 HA SER 112 HA SER 112 22.862 -12.875 7.021 828 HB2 SER 112 HB2 SER 112 25.127 -12.055 5.273 829 HB3 SER 112 HB3 SER 112 24.983 -13.770 5.656 830 HG SER 112 HG SER 112 23.532 -12.285 3.943 831 HA PRO 113 HA PRO 113 25.187 -14.692 10.267 832 HB2 PRO 113 HB2 PRO 113 25.305 -17.297 9.513 833 HB3 PRO 113 HB3 PRO 113 23.819 -16.530 10.087 834 HG2 PRO 113 HG2 PRO 113 24.705 -17.077 7.281 835 HG3 PRO 113 HG3 PRO 113 23.105 -17.294 8.011 836 HD2 PRO 113 HD2 PRO 113 23.723 -15.158 6.467 837 HD3 PRO 113 HD3 PRO 113 22.573 -15.059 7.816 838 H TYR 114 H TYR 114 27.014 -16.565 10.484 839 HA TYR 114 HA TYR 114 29.312 -15.439 9.140 840 HB2 TYR 114 HB2 TYR 114 29.076 -16.256 11.631 841 HB3 TYR 114 HB3 TYR 114 29.487 -17.822 10.941 842 HD1 TYR 114 HD2 TYR 114 31.525 -17.420 9.051 843 HD2 TYR 114 HD1 TYR 114 30.878 -15.274 12.667 844 HE1 TYR 114 HE2 TYR 114 33.912 -16.828 9.120 845 HE2 TYR 114 HE1 TYR 114 33.263 -14.675 12.745 846 HH TYR 114 HH TYR 114 35.246 -14.882 11.776 847 H SER 115 H SER 115 28.898 -16.107 6.983 848 HA SER 115 HA SER 115 28.760 -18.926 6.366 849 HB2 SER 115 HB2 SER 115 29.073 -16.558 4.505 850 HB3 SER 115 HB3 SER 115 28.654 -18.204 4.032 851 HG SER 115 HG SER 115 26.754 -17.969 5.337 852 H TYR 116 H TYR 116 30.322 -20.137 5.286 853 HA TYR 116 HA TYR 116 33.032 -19.451 5.926 854 HB2 TYR 116 HB2 TYR 116 32.127 -21.779 6.028 855 HB3 TYR 116 HB3 TYR 116 32.022 -21.772 4.271 856 HD1 TYR 116 HD2 TYR 116 34.619 -20.821 6.797 857 HD2 TYR 116 HD1 TYR 116 33.686 -22.990 3.256 858 HE1 TYR 116 HE2 TYR 116 36.951 -21.591 6.660 859 HE2 TYR 116 HE1 TYR 116 36.015 -23.766 3.111 860 HH TYR 116 HH TYR 116 37.997 -23.845 4.131 861 H SER 117 H SER 117 31.155 -19.803 2.941 862 HA SER 117 HA SER 117 33.224 -19.392 1.111 863 HB2 SER 117 HB2 SER 117 30.381 -18.447 0.722 864 HB3 SER 117 HB3 SER 117 31.527 -18.962 -0.515 865 HG SER 117 HG SER 117 31.225 -21.028 0.035 866 H THR 118 H THR 118 33.651 -17.493 -0.217 867 HA THR 118 HA THR 118 33.948 -15.138 1.430 868 HB THR 118 HB THR 118 35.034 -14.229 -0.733 869 HG1 THR 118 HG1 THR 118 35.811 -16.270 -1.924 870 HG21 THR 118 HG21 THR 118 37.014 -15.950 -0.328 871 HG22 THR 118 HG22 THR 118 36.028 -16.375 1.071 872 HG23 THR 118 HG23 THR 118 36.598 -14.719 0.864 873 H THR 119 H THR 119 31.899 -16.223 -1.150 874 HA THR 119 HA THR 119 30.204 -15.240 -2.323 875 HB THR 119 HB THR 119 28.612 -14.033 -1.059 876 HG1 THR 119 HG1 THR 119 29.395 -12.401 0.038 877 HG21 THR 119 HG21 THR 119 30.108 -15.670 0.988 878 HG22 THR 119 HG22 THR 119 29.090 -16.363 -0.275 879 HG23 THR 119 HG23 THR 119 28.381 -15.315 0.953 880 H ALA 120 H ALA 120 32.756 -14.135 -2.853 881 HA ALA 120 HA ALA 120 31.929 -11.538 -3.869 882 HB1 ALA 120 HB1 ALA 120 34.503 -10.997 -2.992 883 HB2 ALA 120 HB2 ALA 120 33.001 -10.388 -2.294 884 HB3 ALA 120 HB3 ALA 120 33.751 -11.845 -1.641 885 H VAL 121 H VAL 121 32.654 -11.222 -5.882 886 HA VAL 121 HA VAL 121 34.760 -13.026 -6.878 887 HB VAL 121 HB VAL 121 32.653 -11.624 -8.523 888 HG11 VAL 121 HG11 VAL 121 34.129 -12.156 -10.133 889 HG12 VAL 121 HG12 VAL 121 34.963 -13.337 -9.120 890 HG13 VAL 121 HG13 VAL 121 33.469 -13.781 -9.947 891 HG21 VAL 121 HG21 VAL 121 31.358 -13.101 -7.314 892 HG22 VAL 121 HG22 VAL 121 31.812 -14.085 -8.705 893 HG23 VAL 121 HG23 VAL 121 32.655 -14.287 -7.170 894 H VAL 122 H VAL 122 36.526 -11.722 -6.398 895 HA VAL 122 HA VAL 122 36.636 -9.131 -7.798 896 HB VAL 122 HB VAL 122 38.435 -8.502 -6.261 897 HG11 VAL 122 HG11 VAL 122 36.224 -7.855 -5.624 898 HG12 VAL 122 HG12 VAL 122 35.894 -9.453 -4.952 899 HG13 VAL 122 HG13 VAL 122 37.069 -8.393 -4.174 900 HG21 VAL 122 HG21 VAL 122 38.047 -10.559 -4.280 901 HG22 VAL 122 HG22 VAL 122 38.618 -11.250 -5.799 902 HG23 VAL 122 HG23 VAL 122 39.542 -9.973 -5.009 903 H THR 123 H THR 123 38.783 -8.523 -8.651 904 HA THR 123 HA THR 123 40.207 -10.882 -9.701 905 HB THR 123 HB THR 123 40.322 -8.268 -11.138 906 HG1 THR 123 HG1 THR 123 38.378 -8.722 -12.182 907 HG21 THR 123 HG21 THR 123 39.979 -10.322 -12.941 908 HG22 THR 123 HG22 THR 123 40.899 -11.085 -11.644 909 HG23 THR 123 HG23 THR 123 41.526 -9.641 -12.440 910 H ASN 124 H ASN 124 40.524 -7.588 -8.487 911 HA ASN 124 HA ASN 124 42.273 -6.445 -7.590 912 HB2 ASN 124 HB2 ASN 124 42.324 -8.673 -6.264 913 HB3 ASN 124 HB3 ASN 124 43.739 -9.047 -7.241 914 HD21 ASN 124 HD21 ASN 124 42.387 -6.590 -5.097 915 HD22 ASN 124 HD22 ASN 124 43.901 -6.080 -4.437 916 HA PRO 125 HA PRO 125 44.568 -6.812 -11.618 917 HB2 PRO 125 HB2 PRO 125 44.161 -4.231 -12.358 918 HB3 PRO 125 HB3 PRO 125 43.013 -5.526 -12.719 919 HG2 PRO 125 HG2 PRO 125 42.948 -3.494 -10.522 920 HG3 PRO 125 HG3 PRO 125 41.626 -4.066 -11.556 921 HD2 PRO 125 HD2 PRO 125 41.989 -4.962 -9.026 922 HD3 PRO 125 HD3 PRO 125 41.315 -5.983 -10.313 923 H LYS 126 H LYS 126 46.202 -4.975 -12.431 924 HA LYS 126 HA LYS 126 48.313 -4.893 -10.654 925 HB2 LYS 126 HB2 LYS 126 49.403 -3.436 -12.172 926 HB3 LYS 126 HB3 LYS 126 48.357 -4.454 -13.152 927 HG2 LYS 126 HG2 LYS 126 47.575 -1.703 -12.229 928 HG3 LYS 126 HG3 LYS 126 48.393 -2.021 -13.760 929 HD2 LYS 126 HD2 LYS 126 46.426 -3.763 -14.043 930 HD3 LYS 126 HD3 LYS 126 45.617 -2.679 -12.909 931 HE2 LYS 126 HE2 LYS 126 46.995 -1.581 -15.327 932 HE3 LYS 126 HE3 LYS 126 45.383 -2.280 -15.468 933 HZ1 LYS 126 HZ1 LYS 126 44.747 -0.202 -14.963 934 HZ2 LYS 126 HZ2 LYS 126 46.218 0.207 -14.236 935 HZ3 LYS 126 HZ3 LYS 126 45.061 -0.669 -13.368 936 H GLU 127 H GLU 127 45.607 -2.719 -10.959 937 HA GLU 127 HA GLU 127 46.809 -0.812 -9.101 938 HB2 GLU 127 HB2 GLU 127 44.448 -0.769 -10.930 939 HB3 GLU 127 HB3 GLU 127 44.458 0.306 -9.539 940 HG2 GLU 127 HG2 GLU 127 46.639 1.199 -10.319 941 HG3 GLU 127 HG3 GLU 127 46.470 0.215 -11.771 Start of MODEL 13 1 H1 GLY 1 H GLY 1 4.201 -8.334 -14.041 2 HA2 GLY 1 HA2 GLY 1 5.864 -6.324 -13.556 3 HA3 GLY 1 HA3 GLY 1 4.279 -6.358 -12.798 4 HA PRO 2 HA PRO 2 7.502 -8.033 -9.572 5 HB2 PRO 2 HB2 PRO 2 10.098 -7.458 -10.124 6 HB3 PRO 2 HB3 PRO 2 9.317 -8.958 -10.637 7 HG2 PRO 2 HG2 PRO 2 9.835 -6.462 -12.205 8 HG3 PRO 2 HG3 PRO 2 10.039 -8.154 -12.696 9 HD2 PRO 2 HD2 PRO 2 7.890 -6.675 -13.420 10 HD3 PRO 2 HD3 PRO 2 7.794 -8.425 -13.142 11 H THR 3 H THR 3 9.426 -6.785 -8.276 12 HA THR 3 HA THR 3 8.319 -4.455 -7.289 13 HB THR 3 HB THR 3 10.385 -4.051 -6.126 14 HG1 THR 3 HG1 THR 3 11.469 -5.617 -8.208 15 HG21 THR 3 HG21 THR 3 10.683 -6.130 -5.006 16 HG22 THR 3 HG22 THR 3 10.166 -7.043 -6.423 17 HG23 THR 3 HG23 THR 3 8.999 -6.074 -5.524 18 H GLY 4 H GLY 4 9.053 -2.235 -7.392 19 HA2 GLY 4 HA2 GLY 4 10.478 -1.527 -9.866 20 HA3 GLY 4 HA3 GLY 4 8.899 -0.822 -9.552 21 H THR 5 H THR 5 10.360 1.137 -9.836 22 HA THR 5 HA THR 5 11.841 1.802 -7.402 23 HB THR 5 HB THR 5 12.648 3.768 -8.631 24 HG1 THR 5 HG1 THR 5 11.036 4.278 -10.037 25 HG21 THR 5 HG21 THR 5 12.902 1.240 -10.263 26 HG22 THR 5 HG22 THR 5 13.850 1.621 -8.826 27 HG23 THR 5 HG23 THR 5 14.010 2.612 -10.277 28 H GLY 6 H GLY 6 10.250 2.253 -5.904 29 HA2 GLY 6 HA2 GLY 6 9.319 4.764 -5.533 30 HA3 GLY 6 HA3 GLY 6 8.075 4.046 -6.547 31 H GLU 7 H GLU 7 9.995 2.623 -3.919 32 HA GLU 7 HA GLU 7 7.470 1.872 -2.616 33 HB2 GLU 7 HB2 GLU 7 9.208 0.116 -3.311 34 HB3 GLU 7 HB3 GLU 7 10.185 0.730 -1.985 35 HG2 GLU 7 HG2 GLU 7 9.143 -0.883 -0.828 36 HG3 GLU 7 HG3 GLU 7 7.867 0.324 -0.694 37 H SER 8 H SER 8 9.615 4.278 -2.451 38 HA SER 8 HA SER 8 9.363 4.518 0.476 39 HB2 SER 8 HB2 SER 8 11.595 5.869 -1.000 40 HB3 SER 8 HB3 SER 8 11.519 5.358 0.686 41 HG SER 8 HG SER 8 11.538 3.159 -0.170 42 H LYS 9 H LYS 9 10.070 7.049 0.916 43 HA LYS 9 HA LYS 9 8.294 8.657 -0.800 44 HB2 LYS 9 HB2 LYS 9 7.838 9.979 1.349 45 HB3 LYS 9 HB3 LYS 9 7.063 8.408 1.182 46 HG2 LYS 9 HG2 LYS 9 9.675 8.315 2.494 47 HG3 LYS 9 HG3 LYS 9 8.457 9.252 3.362 48 HD2 LYS 9 HD2 LYS 9 7.486 7.381 4.068 49 HD3 LYS 9 HD3 LYS 9 7.264 6.842 2.401 50 HE2 LYS 9 HE2 LYS 9 9.518 5.900 2.405 51 HE3 LYS 9 HE3 LYS 9 9.755 6.456 4.061 52 HZ1 LYS 9 HZ1 LYS 9 7.548 5.052 4.380 53 HZ2 LYS 9 HZ2 LYS 9 9.085 4.356 4.490 54 HZ3 LYS 9 HZ3 LYS 9 8.192 4.208 3.062 55 H CYS 10 H CYS 10 11.150 8.573 1.251 56 HA CYS 10 HA CYS 10 11.881 11.289 0.501 57 HB2 CYS 10 HB2 CYS 10 12.675 9.380 2.586 58 HB3 CYS 10 HB3 CYS 10 14.019 10.287 1.904 59 HG CYS 10 HG CYS 10 12.291 11.227 4.331 60 HA PRO 11 HA PRO 11 14.660 10.286 -2.739 61 HB2 PRO 11 HB2 PRO 11 16.721 11.996 -2.295 62 HB3 PRO 11 HB3 PRO 11 15.144 12.527 -2.890 63 HG2 PRO 11 HG2 PRO 11 16.244 12.611 -0.108 64 HG3 PRO 11 HG3 PRO 11 15.322 13.847 -0.985 65 HD2 PRO 11 HD2 PRO 11 14.185 12.210 0.849 66 HD3 PRO 11 HD3 PRO 11 13.302 12.818 -0.567 67 H LEU 12 H LEU 12 15.891 10.191 0.534 68 HA LEU 12 HA LEU 12 17.681 8.008 -0.243 69 HB2 LEU 12 HB2 LEU 12 18.924 10.206 -0.092 70 HB3 LEU 12 HB3 LEU 12 18.556 10.193 1.632 71 HG LEU 12 HG LEU 12 20.860 9.412 1.000 72 HD11 LEU 12 HD11 LEU 12 20.880 8.272 2.914 73 HD12 LEU 12 HD12 LEU 12 19.768 7.051 2.296 74 HD13 LEU 12 HD13 LEU 12 19.140 8.553 2.973 75 HD21 LEU 12 HD21 LEU 12 21.224 7.653 -0.341 76 HD22 LEU 12 HD22 LEU 12 19.583 7.954 -0.914 77 HD23 LEU 12 HD23 LEU 12 19.874 6.736 0.329 78 H MET 13 H MET 13 17.253 6.297 0.970 79 HA MET 13 HA MET 13 16.588 6.673 3.798 80 HB2 MET 13 HB2 MET 13 14.751 5.074 3.666 81 HB3 MET 13 HB3 MET 13 14.453 6.443 2.603 82 HG2 MET 13 HG2 MET 13 14.591 5.196 0.724 83 HG3 MET 13 HG3 MET 13 15.796 4.105 1.403 84 HE1 MET 13 HE1 MET 13 15.420 2.401 3.043 85 HE2 MET 13 HE2 MET 13 14.134 2.854 4.160 86 HE3 MET 13 HE3 MET 13 13.964 1.411 3.161 87 H VAL 14 H VAL 14 17.121 4.926 5.142 88 HA VAL 14 HA VAL 14 19.061 3.075 3.952 89 HB VAL 14 HB VAL 14 18.626 3.836 6.843 90 HG11 VAL 14 HG11 VAL 14 19.417 1.572 6.736 91 HG12 VAL 14 HG12 VAL 14 20.661 2.015 5.564 92 HG13 VAL 14 HG13 VAL 14 20.756 2.610 7.222 93 HG21 VAL 14 HG21 VAL 14 19.600 5.609 5.418 94 HG22 VAL 14 HG22 VAL 14 20.714 5.035 6.660 95 HG23 VAL 14 HG23 VAL 14 20.908 4.508 4.988 96 H LYS 15 H LYS 15 18.834 0.899 4.051 97 HA LYS 15 HA LYS 15 16.495 -0.171 5.481 98 HB2 LYS 15 HB2 LYS 15 15.877 -0.118 3.164 99 HB3 LYS 15 HB3 LYS 15 17.415 -0.818 2.680 100 HG2 LYS 15 HG2 LYS 15 15.711 -2.493 2.533 101 HG3 LYS 15 HG3 LYS 15 16.797 -2.898 3.864 102 HD2 LYS 15 HD2 LYS 15 14.495 -1.240 4.619 103 HD3 LYS 15 HD3 LYS 15 14.081 -2.853 4.034 104 HE2 LYS 15 HE2 LYS 15 16.135 -3.436 5.691 105 HE3 LYS 15 HE3 LYS 15 15.462 -2.021 6.500 106 HZ1 LYS 15 HZ1 LYS 15 14.276 -4.661 6.079 107 HZ2 LYS 15 HZ2 LYS 15 13.236 -3.327 6.073 108 HZ3 LYS 15 HZ3 LYS 15 14.197 -3.645 7.429 109 H VAL 16 H VAL 16 17.298 -1.362 7.084 110 HA VAL 16 HA VAL 16 19.507 -3.214 6.464 111 HB VAL 16 HB VAL 16 18.987 -1.821 9.095 112 HG11 VAL 16 HG11 VAL 16 20.335 -4.258 8.513 113 HG12 VAL 16 HG12 VAL 16 21.535 -3.055 8.994 114 HG13 VAL 16 HG13 VAL 16 20.179 -3.426 10.059 115 HG21 VAL 16 HG21 VAL 16 21.112 -0.692 8.682 116 HG22 VAL 16 HG22 VAL 16 21.249 -1.502 7.121 117 HG23 VAL 16 HG23 VAL 16 19.951 -0.342 7.402 118 H LEU 17 H LEU 17 18.905 -5.267 6.563 119 HA LEU 17 HA LEU 17 17.003 -6.106 8.626 120 HB2 LEU 17 HB2 LEU 17 15.582 -7.216 7.175 121 HB3 LEU 17 HB3 LEU 17 15.922 -5.707 6.331 122 HG LEU 17 HG LEU 17 17.843 -7.462 5.372 123 HD11 LEU 17 HD11 LEU 17 17.061 -9.546 5.244 124 HD12 LEU 17 HD12 LEU 17 15.437 -9.003 4.823 125 HD13 LEU 17 HD13 LEU 17 15.931 -9.076 6.514 126 HD21 LEU 17 HD21 LEU 17 16.941 -6.938 3.350 127 HD22 LEU 17 HD22 LEU 17 16.158 -5.699 4.331 128 HD23 LEU 17 HD23 LEU 17 15.282 -7.169 3.903 129 H ASP 18 H ASP 18 17.198 -8.273 9.276 130 HA ASP 18 HA ASP 18 19.841 -9.353 8.985 131 HB2 ASP 18 HB2 ASP 18 17.446 -9.938 10.631 132 HB3 ASP 18 HB3 ASP 18 18.528 -11.293 10.322 133 H ALA 19 H ALA 19 20.517 -10.790 7.542 134 HA ALA 19 HA ALA 19 18.665 -11.905 5.634 135 HB1 ALA 19 HB1 ALA 19 21.066 -13.059 5.054 136 HB2 ALA 19 HB2 ALA 19 20.511 -11.506 4.429 137 HB3 ALA 19 HB3 ALA 19 21.564 -11.561 5.842 138 H VAL 20 H VAL 20 19.464 -12.802 8.671 139 HA VAL 20 HA VAL 20 19.742 -15.652 8.219 140 HB VAL 20 HB VAL 20 19.372 -14.176 10.828 141 HG11 VAL 20 HG11 VAL 20 20.399 -16.955 10.265 142 HG12 VAL 20 HG12 VAL 20 20.267 -16.193 11.852 143 HG13 VAL 20 HG13 VAL 20 18.812 -16.560 10.925 144 HG21 VAL 20 HG21 VAL 20 21.869 -14.597 11.022 145 HG22 VAL 20 HG22 VAL 20 21.845 -14.926 9.291 146 HG23 VAL 20 HG23 VAL 20 21.369 -13.339 9.892 147 H ARG 21 H ARG 21 17.295 -13.392 9.392 148 HA ARG 21 HA ARG 21 15.343 -15.599 9.387 149 HB2 ARG 21 HB2 ARG 21 14.965 -12.987 10.833 150 HB3 ARG 21 HB3 ARG 21 14.114 -14.507 11.080 151 HG2 ARG 21 HG2 ARG 21 15.487 -14.619 12.866 152 HG3 ARG 21 HG3 ARG 21 16.587 -15.315 11.674 153 HD2 ARG 21 HD2 ARG 21 17.687 -13.210 11.368 154 HD3 ARG 21 HD3 ARG 21 16.487 -12.383 12.360 155 HE ARG 21 HE ARG 21 18.779 -13.816 13.277 156 HH11 ARG 21 HH11 ARG 21 15.517 -12.912 14.091 157 HH12 ARG 21 HH12 ARG 21 15.776 -13.017 15.801 158 HH21 ARG 21 HH21 ARG 21 19.132 -13.960 15.527 159 HH22 ARG 21 HH22 ARG 21 17.833 -13.613 16.617 160 H GLY 22 H GLY 22 16.176 -12.492 8.116 161 HA2 GLY 22 HA2 GLY 22 15.329 -11.649 6.081 162 HA3 GLY 22 HA3 GLY 22 13.911 -12.670 6.276 163 H SER 23 H SER 23 14.513 -11.200 9.184 164 HA SER 23 HA SER 23 12.395 -9.246 8.691 165 HB2 SER 23 HB2 SER 23 13.120 -9.252 11.428 166 HB3 SER 23 HB3 SER 23 11.669 -9.936 10.694 167 HG SER 23 HG SER 23 13.912 -11.189 11.649 168 HA PRO 24 HA PRO 24 14.933 -5.681 8.976 169 HB2 PRO 24 HB2 PRO 24 13.438 -3.998 10.493 170 HB3 PRO 24 HB3 PRO 24 13.021 -4.416 8.827 171 HG2 PRO 24 HG2 PRO 24 11.932 -5.524 11.386 172 HG3 PRO 24 HG3 PRO 24 11.067 -5.064 9.908 173 HD2 PRO 24 HD2 PRO 24 11.671 -7.636 10.502 174 HD3 PRO 24 HD3 PRO 24 11.598 -7.032 8.834 175 H ALA 25 H ALA 25 16.375 -4.525 10.289 176 HA ALA 25 HA ALA 25 16.818 -5.729 12.924 177 HB1 ALA 25 HB1 ALA 25 19.080 -4.829 12.762 178 HB2 ALA 25 HB2 ALA 25 18.684 -5.812 11.352 179 HB3 ALA 25 HB3 ALA 25 18.668 -4.053 11.232 180 H ILE 26 H ILE 26 16.773 -4.579 14.784 181 HA ILE 26 HA ILE 26 15.916 -1.774 14.579 182 HB ILE 26 HB ILE 26 15.314 -3.957 16.494 183 HG12 ILE 26 HG12 ILE 26 13.815 -2.830 14.667 184 HG13 ILE 26 HG13 ILE 26 13.122 -3.241 16.233 185 HG21 ILE 26 HG21 ILE 26 14.627 -2.207 18.195 186 HG22 ILE 26 HG22 ILE 26 16.354 -2.528 18.051 187 HG23 ILE 26 HG23 ILE 26 15.662 -1.086 17.310 188 HD11 ILE 26 HD11 ILE 26 13.347 -0.948 16.964 189 HD12 ILE 26 HD12 ILE 26 14.124 -0.518 15.440 190 HD13 ILE 26 HD13 ILE 26 12.436 -1.026 15.456 191 H ASN 27 H ASN 27 16.999 -0.155 15.601 192 HA ASN 27 HA ASN 27 18.707 0.956 16.609 193 HB2 ASN 27 HB2 ASN 27 19.173 -1.608 18.144 194 HB3 ASN 27 HB3 ASN 27 19.694 0.011 18.606 195 HD21 ASN 27 HD21 ASN 27 17.328 1.379 17.906 196 HD22 ASN 27 HD22 ASN 27 16.100 0.922 19.032 197 H VAL 28 H VAL 28 19.440 0.327 14.223 198 HA VAL 28 HA VAL 28 22.042 -1.041 14.413 199 HB VAL 28 HB VAL 28 20.353 -0.547 11.956 200 HG11 VAL 28 HG11 VAL 28 22.921 -2.098 12.271 201 HG12 VAL 28 HG12 VAL 28 21.972 -1.945 10.791 202 HG13 VAL 28 HG13 VAL 28 22.759 -0.528 11.487 203 HG21 VAL 28 HG21 VAL 28 19.251 -2.386 12.543 204 HG22 VAL 28 HG22 VAL 28 20.757 -3.290 12.372 205 HG23 VAL 28 HG23 VAL 28 20.300 -2.625 13.940 206 H ALA 29 H ALA 29 23.640 0.376 14.657 207 HA ALA 29 HA ALA 29 23.555 3.102 14.108 208 HB1 ALA 29 HB1 ALA 29 26.239 2.344 13.858 209 HB2 ALA 29 HB2 ALA 29 25.418 2.933 15.303 210 HB3 ALA 29 HB3 ALA 29 25.518 1.200 14.990 211 H VAL 30 H VAL 30 23.750 4.286 12.316 212 HA VAL 30 HA VAL 30 24.999 3.104 9.940 213 HB VAL 30 HB VAL 30 22.369 4.582 9.817 214 HG11 VAL 30 HG11 VAL 30 23.757 4.799 7.824 215 HG12 VAL 30 HG12 VAL 30 23.907 3.043 7.727 216 HG13 VAL 30 HG13 VAL 30 22.335 3.809 7.498 217 HG21 VAL 30 HG21 VAL 30 22.974 1.744 10.259 218 HG22 VAL 30 HG22 VAL 30 21.501 2.657 10.591 219 HG23 VAL 30 HG23 VAL 30 21.822 2.062 8.962 220 H HIS 31 H HIS 31 26.295 4.474 8.873 221 HA HIS 31 HA HIS 31 26.069 7.349 9.472 222 HB2 HIS 31 HB2 HIS 31 28.689 5.929 9.002 223 HB3 HIS 31 HB3 HIS 31 28.437 7.564 9.607 224 HD1 HIS 31 HD1 HIS 31 26.403 6.965 11.842 225 HD2 HIS 31 HD2 HIS 31 29.855 4.754 11.164 226 HE1 HIS 31 HE1 HIS 31 26.930 5.851 14.035 227 H VAL 32 H VAL 32 25.691 8.516 7.717 228 HA VAL 32 HA VAL 32 26.374 7.393 5.090 229 HB VAL 32 HB VAL 32 24.577 9.754 5.620 230 HG11 VAL 32 HG11 VAL 32 24.302 9.847 3.413 231 HG12 VAL 32 HG12 VAL 32 25.665 8.735 3.279 232 HG13 VAL 32 HG13 VAL 32 24.015 8.110 3.306 233 HG21 VAL 32 HG21 VAL 32 24.098 6.938 6.104 234 HG22 VAL 32 HG22 VAL 32 23.116 8.338 6.534 235 HG23 VAL 32 HG23 VAL 32 22.962 7.610 4.935 236 H PHE 33 H PHE 33 27.733 8.400 3.706 237 HA PHE 33 HA PHE 33 28.785 11.036 4.477 238 HB2 PHE 33 HB2 PHE 33 30.334 8.561 3.735 239 HB3 PHE 33 HB3 PHE 33 31.029 10.171 3.573 240 HD1 PHE 33 HD1 PHE 33 29.365 7.963 6.063 241 HD2 PHE 33 HD2 PHE 33 32.129 11.123 5.363 242 HE1 PHE 33 HE1 PHE 33 30.016 7.914 8.436 243 HE2 PHE 33 HE2 PHE 33 32.785 11.080 7.735 244 HZ PHE 33 HZ PHE 33 31.727 9.474 9.274 245 H ARG 34 H ARG 34 29.978 12.100 2.651 246 HA ARG 34 HA ARG 34 28.850 11.345 0.040 247 HB2 ARG 34 HB2 ARG 34 27.587 13.240 0.994 248 HB3 ARG 34 HB3 ARG 34 29.082 14.156 1.129 249 HG2 ARG 34 HG2 ARG 34 28.398 13.090 -1.544 250 HG3 ARG 34 HG3 ARG 34 27.412 14.415 -0.922 251 HD2 ARG 34 HD2 ARG 34 29.521 15.673 -0.476 252 HD3 ARG 34 HD3 ARG 34 30.402 14.383 -1.295 253 HE ARG 34 HE ARG 34 28.954 16.497 -2.520 254 HH11 ARG 34 HH11 ARG 34 29.784 13.135 -2.878 255 HH12 ARG 34 HH12 ARG 34 29.643 13.149 -4.605 256 HH21 ARG 34 HH21 ARG 34 28.766 16.529 -4.794 257 HH22 ARG 34 HH22 ARG 34 29.065 15.080 -5.693 258 H LYS 35 H LYS 35 30.182 11.553 -1.703 259 HA LYS 35 HA LYS 35 32.959 11.539 -1.297 260 HB2 LYS 35 HB2 LYS 35 32.263 10.429 -3.223 261 HB3 LYS 35 HB3 LYS 35 31.201 11.741 -3.717 262 HG2 LYS 35 HG2 LYS 35 33.111 11.603 -5.190 263 HG3 LYS 35 HG3 LYS 35 33.162 13.107 -4.268 264 HD2 LYS 35 HD2 LYS 35 35.368 12.216 -4.279 265 HD3 LYS 35 HD3 LYS 35 34.712 11.954 -2.661 266 HE2 LYS 35 HE2 LYS 35 35.411 9.843 -2.943 267 HE3 LYS 35 HE3 LYS 35 33.965 9.665 -3.937 268 HZ1 LYS 35 HZ1 LYS 35 35.221 9.315 -5.709 269 HZ2 LYS 35 HZ2 LYS 35 36.598 9.339 -4.727 270 HZ3 LYS 35 HZ3 LYS 35 36.067 10.761 -5.473 271 H ALA 36 H ALA 36 34.059 13.239 -0.559 272 HA ALA 36 HA ALA 36 33.283 15.942 -1.011 273 HB1 ALA 36 HB1 ALA 36 36.032 15.174 -0.120 274 HB2 ALA 36 HB2 ALA 36 35.033 16.541 0.377 275 HB3 ALA 36 HB3 ALA 36 34.647 14.915 0.942 276 H ALA 37 H ALA 37 34.530 17.574 -2.108 277 HA ALA 37 HA ALA 37 35.182 16.913 -4.749 278 HB1 ALA 37 HB1 ALA 37 35.769 19.173 -5.044 279 HB2 ALA 37 HB2 ALA 37 34.498 19.175 -3.821 280 HB3 ALA 37 HB3 ALA 37 36.183 19.373 -3.341 281 H ASP 38 H ASP 38 37.045 16.730 -1.878 282 HA ASP 38 HA ASP 38 39.580 16.689 -3.328 283 HB2 ASP 38 HB2 ASP 38 38.776 16.950 -0.479 284 HB3 ASP 38 HB3 ASP 38 40.318 16.164 -0.802 285 H ASP 39 H ASP 39 37.337 14.577 -3.320 286 HA ASP 39 HA ASP 39 37.217 12.317 -3.556 287 HB2 ASP 39 HB2 ASP 39 40.189 12.079 -3.240 288 HB3 ASP 39 HB3 ASP 39 39.105 11.157 -4.278 289 H THR 40 H THR 40 36.931 13.436 -0.986 290 HA THR 40 HA THR 40 38.001 11.265 0.699 291 HB THR 40 HB THR 40 38.179 12.713 2.556 292 HG1 THR 40 HG1 THR 40 37.448 14.984 2.274 293 HG21 THR 40 HG21 THR 40 39.635 14.538 1.763 294 HG22 THR 40 HG22 THR 40 39.085 14.241 0.113 295 HG23 THR 40 HG23 THR 40 40.003 13.006 0.974 296 H TRP 41 H TRP 41 36.602 11.241 2.859 297 HA TRP 41 HA TRP 41 33.813 10.959 1.973 298 HB2 TRP 41 HB2 TRP 41 35.417 9.551 4.101 299 HB3 TRP 41 HB3 TRP 41 33.657 9.469 4.055 300 HD1 TRP 41 HD1 TRP 41 35.790 9.354 0.864 301 HE1 TRP 41 HE1 TRP 41 35.478 7.050 -0.242 302 HE3 TRP 41 HE3 TRP 41 33.034 7.070 4.514 303 HZ2 TRP 41 HZ2 TRP 41 34.228 4.590 0.355 304 HZ3 TRP 41 HZ3 TRP 41 32.320 4.740 4.168 305 HH2 TRP 41 HH2 TRP 41 32.905 3.529 2.131 306 H GLU 42 H GLU 42 32.684 12.727 2.489 307 HA GLU 42 HA GLU 42 33.220 14.100 5.015 308 HB2 GLU 42 HB2 GLU 42 31.661 14.843 2.548 309 HB3 GLU 42 HB3 GLU 42 31.524 15.763 4.040 310 HG2 GLU 42 HG2 GLU 42 34.248 15.249 3.000 311 HG3 GLU 42 HG3 GLU 42 33.239 16.399 2.124 312 HA PRO 43 HA PRO 43 29.716 12.449 7.087 313 HB2 PRO 43 HB2 PRO 43 29.110 14.516 8.741 314 HB3 PRO 43 HB3 PRO 43 30.519 13.476 8.978 315 HG2 PRO 43 HG2 PRO 43 30.357 16.193 7.731 316 HG3 PRO 43 HG3 PRO 43 31.560 15.552 8.866 317 HD2 PRO 43 HD2 PRO 43 32.017 15.724 6.203 318 HD3 PRO 43 HD3 PRO 43 32.715 14.440 7.210 319 H PHE 44 H PHE 44 27.841 12.174 6.051 320 HA PHE 44 HA PHE 44 26.400 14.524 5.048 321 HB2 PHE 44 HB2 PHE 44 26.907 12.693 3.442 322 HB3 PHE 44 HB3 PHE 44 25.931 11.603 4.421 323 HD1 PHE 44 HD2 PHE 44 23.509 11.832 4.502 324 HD2 PHE 44 HD1 PHE 44 25.895 14.353 2.037 325 HE1 PHE 44 HE2 PHE 44 21.499 12.514 3.258 326 HE2 PHE 44 HE1 PHE 44 23.888 15.038 0.789 327 HZ PHE 44 HZ PHE 44 21.686 14.119 1.400 328 H ALA 45 H ALA 45 25.863 11.517 6.862 329 HA ALA 45 HA ALA 45 24.051 12.788 8.660 330 HB1 ALA 45 HB1 ALA 45 22.609 10.633 7.266 331 HB2 ALA 45 HB2 ALA 45 22.018 12.161 7.921 332 HB3 ALA 45 HB3 ALA 45 22.822 12.127 6.352 333 H SER 46 H SER 46 22.879 10.980 10.009 334 HA SER 46 HA SER 46 24.085 8.421 10.165 335 HB2 SER 46 HB2 SER 46 26.021 9.142 11.142 336 HB3 SER 46 HB3 SER 46 25.286 10.624 11.751 337 HG SER 46 HG SER 46 25.276 9.599 13.585 338 H GLY 47 H GLY 47 23.073 7.080 11.669 339 HA2 GLY 47 HA2 GLY 47 21.472 7.911 13.807 340 HA3 GLY 47 HA3 GLY 47 20.442 7.793 12.390 341 H LYS 48 H LYS 48 19.334 6.139 13.666 342 HA LYS 48 HA LYS 48 20.656 3.525 13.362 343 HB2 LYS 48 HB2 LYS 48 19.319 4.709 15.728 344 HB3 LYS 48 HB3 LYS 48 18.963 3.018 15.398 345 HG2 LYS 48 HG2 LYS 48 21.338 2.491 15.461 346 HG3 LYS 48 HG3 LYS 48 21.715 4.191 15.751 347 HD2 LYS 48 HD2 LYS 48 20.013 2.479 17.561 348 HD3 LYS 48 HD3 LYS 48 21.731 2.801 17.811 349 HE2 LYS 48 HE2 LYS 48 20.861 5.314 17.550 350 HE3 LYS 48 HE3 LYS 48 19.386 4.574 18.172 351 HZ1 LYS 48 HZ1 LYS 48 21.418 5.469 19.691 352 HZ2 LYS 48 HZ2 LYS 48 21.777 3.819 19.596 353 HZ3 LYS 48 HZ3 LYS 48 20.276 4.326 20.192 354 H THR 49 H THR 49 19.527 2.036 12.273 355 HA THR 49 HA THR 49 17.241 2.664 10.819 356 HB THR 49 HB THR 49 17.096 0.339 10.215 357 HG1 THR 49 HG1 THR 49 18.311 -0.005 12.684 358 HG21 THR 49 HG21 THR 49 19.799 -0.048 10.115 359 HG22 THR 49 HG22 THR 49 19.691 1.698 10.337 360 HG23 THR 49 HG23 THR 49 18.876 0.930 8.975 361 H SER 50 H SER 50 15.192 1.217 10.932 362 HA SER 50 HA SER 50 14.275 1.048 13.724 363 HB2 SER 50 HB2 SER 50 13.407 3.086 12.520 364 HB3 SER 50 HB3 SER 50 12.570 1.997 11.414 365 HG SER 50 HG SER 50 12.132 2.403 14.171 366 H GLU 51 H GLU 51 12.071 -0.171 13.774 367 HA GLU 51 HA GLU 51 12.562 -2.795 12.820 368 HB2 GLU 51 HB2 GLU 51 10.207 -3.220 13.676 369 HB3 GLU 51 HB3 GLU 51 11.371 -2.625 14.851 370 HG2 GLU 51 HG2 GLU 51 10.096 -0.880 15.310 371 HG3 GLU 51 HG3 GLU 51 10.041 -0.416 13.610 372 H SER 52 H SER 52 11.311 -0.095 11.293 373 HA SER 52 HA SER 52 9.655 -1.666 9.450 374 HB2 SER 52 HB2 SER 52 9.009 0.649 10.590 375 HB3 SER 52 HB3 SER 52 9.890 1.298 9.207 376 HG SER 52 HG SER 52 7.476 0.769 9.077 377 H GLY 53 H GLY 53 12.779 -0.994 9.720 378 HA2 GLY 53 HA2 GLY 53 14.508 -1.120 8.204 379 HA3 GLY 53 HA3 GLY 53 13.313 -1.393 6.945 380 H GLU 54 H GLU 54 13.016 1.416 8.939 381 HA GLU 54 HA GLU 54 14.192 3.077 6.815 382 HB2 GLU 54 HB2 GLU 54 12.346 4.659 7.010 383 HB3 GLU 54 HB3 GLU 54 11.752 3.069 6.554 384 HG2 GLU 54 HG2 GLU 54 11.349 2.755 9.086 385 HG3 GLU 54 HG3 GLU 54 11.474 4.512 9.154 386 H LEU 55 H LEU 55 15.569 4.573 7.529 387 HA LEU 55 HA LEU 55 15.933 4.885 10.392 388 HB2 LEU 55 HB2 LEU 55 17.712 4.662 8.413 389 HB3 LEU 55 HB3 LEU 55 17.573 6.419 8.459 390 HG LEU 55 HG LEU 55 18.058 5.047 11.040 391 HD11 LEU 55 HD11 LEU 55 20.260 5.407 9.016 392 HD12 LEU 55 HD12 LEU 55 19.530 3.857 9.430 393 HD13 LEU 55 HD13 LEU 55 20.406 4.773 10.656 394 HD21 LEU 55 HD21 LEU 55 18.093 7.659 10.044 395 HD22 LEU 55 HD22 LEU 55 19.782 7.243 10.342 396 HD23 LEU 55 HD23 LEU 55 18.598 7.114 11.644 397 H HIS 56 H HIS 56 16.316 7.070 11.297 398 HA HIS 56 HA HIS 56 14.101 8.730 10.958 399 HB2 HIS 56 HB2 HIS 56 16.799 9.220 12.216 400 HB3 HIS 56 HB3 HIS 56 15.516 10.427 12.239 401 HD1 HIS 56 HD1 HIS 56 14.347 6.959 12.592 402 HD2 HIS 56 HD2 HIS 56 15.547 10.053 15.093 403 HE1 HIS 56 HE1 HIS 56 13.558 6.311 14.891 404 H GLY 57 H GLY 57 14.705 11.291 10.692 405 HA2 GLY 57 HA2 GLY 57 15.012 11.637 7.904 406 HA3 GLY 57 HA3 GLY 57 14.984 12.923 9.101 407 H LEU 58 H LEU 58 16.994 10.760 7.250 408 HA LEU 58 HA LEU 58 19.434 11.938 8.329 409 HB2 LEU 58 HB2 LEU 58 18.878 9.672 6.441 410 HB3 LEU 58 HB3 LEU 58 20.503 10.317 6.666 411 HG LEU 58 HG LEU 58 18.791 9.067 8.815 412 HD11 LEU 58 HD11 LEU 58 19.451 7.230 7.641 413 HD12 LEU 58 HD12 LEU 58 20.873 7.448 8.660 414 HD13 LEU 58 HD13 LEU 58 20.888 8.020 6.992 415 HD21 LEU 58 HD21 LEU 58 20.184 9.944 10.300 416 HD22 LEU 58 HD22 LEU 58 20.970 10.850 9.007 417 HD23 LEU 58 HD23 LEU 58 21.566 9.250 9.450 418 H THR 59 H THR 59 17.359 12.154 5.579 419 HA THR 59 HA THR 59 19.145 13.197 3.679 420 HB THR 59 HB THR 59 17.241 13.958 2.456 421 HG1 THR 59 HG1 THR 59 15.780 14.958 3.623 422 HG21 THR 59 HG21 THR 59 15.719 11.781 3.568 423 HG22 THR 59 HG22 THR 59 17.429 11.356 3.482 424 HG23 THR 59 HG23 THR 59 16.574 11.874 2.030 425 H THR 60 H THR 60 19.563 15.334 3.026 426 HA THR 60 HA THR 60 18.698 17.523 4.728 427 HB THR 60 HB THR 60 20.975 18.320 5.183 428 HG1 THR 60 HG1 THR 60 22.740 16.980 4.709 429 HG21 THR 60 HG21 THR 60 19.805 16.893 6.835 430 HG22 THR 60 HG22 THR 60 21.559 16.726 6.912 431 HG23 THR 60 HG23 THR 60 20.587 15.479 6.130 432 H GLU 61 H GLU 61 20.195 19.556 3.915 433 HA GLU 61 HA GLU 61 19.292 20.067 1.292 434 HB2 GLU 61 HB2 GLU 61 20.710 22.127 1.468 435 HB3 GLU 61 HB3 GLU 61 19.575 21.906 2.793 436 HG2 GLU 61 HG2 GLU 61 21.258 21.320 4.297 437 HG3 GLU 61 HG3 GLU 61 22.417 20.989 3.011 438 H GLU 62 H GLU 62 22.005 18.393 2.428 439 HA GLU 62 HA GLU 62 23.751 18.978 0.217 440 HB2 GLU 62 HB2 GLU 62 23.833 17.044 2.513 441 HB3 GLU 62 HB3 GLU 62 24.982 16.910 1.190 442 HG2 GLU 62 HG2 GLU 62 24.587 19.368 2.880 443 HG3 GLU 62 HG3 GLU 62 25.855 18.167 3.118 444 H GLU 63 H GLU 63 20.955 17.298 0.391 445 HA GLU 63 HA GLU 63 21.607 14.920 -1.036 446 HB2 GLU 63 HB2 GLU 63 19.249 14.567 -1.217 447 HB3 GLU 63 HB3 GLU 63 19.563 15.233 0.380 448 HG2 GLU 63 HG2 GLU 63 18.973 17.490 -0.599 449 HG3 GLU 63 HG3 GLU 63 18.373 16.611 -2.004 450 H PHE 64 H PHE 64 21.546 18.119 -1.965 451 HA PHE 64 HA PHE 64 20.624 17.653 -4.679 452 HB2 PHE 64 HB2 PHE 64 20.551 19.942 -4.929 453 HB3 PHE 64 HB3 PHE 64 20.338 19.812 -3.186 454 HD1 PHE 64 HD1 PHE 64 22.813 19.567 -1.980 455 HD2 PHE 64 HD2 PHE 64 21.894 21.675 -5.561 456 HE1 PHE 64 HE1 PHE 64 24.778 21.007 -1.633 457 HE2 PHE 64 HE2 PHE 64 23.857 23.118 -5.221 458 HZ PHE 64 HZ PHE 64 25.302 22.786 -3.254 459 H VAL 65 H VAL 65 23.273 16.708 -3.253 460 HA VAL 65 HA VAL 65 25.364 17.821 -4.841 461 HB VAL 65 HB VAL 65 26.724 15.917 -3.976 462 HG11 VAL 65 HG11 VAL 65 26.888 17.796 -2.641 463 HG12 VAL 65 HG12 VAL 65 25.191 17.734 -2.163 464 HG13 VAL 65 HG13 VAL 65 26.341 16.577 -1.491 465 HG21 VAL 65 HG21 VAL 65 25.027 14.964 -1.939 466 HG22 VAL 65 HG22 VAL 65 24.127 14.837 -3.449 467 HG23 VAL 65 HG23 VAL 65 25.704 14.064 -3.296 468 H GLU 66 H GLU 66 26.859 15.949 -5.911 469 HA GLU 66 HA GLU 66 25.765 15.376 -8.371 470 HB2 GLU 66 HB2 GLU 66 27.974 13.929 -6.902 471 HB3 GLU 66 HB3 GLU 66 27.606 13.692 -8.605 472 HG2 GLU 66 HG2 GLU 66 28.092 16.464 -7.678 473 HG3 GLU 66 HG3 GLU 66 29.473 15.373 -7.777 474 H GLY 67 H GLY 67 26.055 13.179 -5.583 475 HA2 GLY 67 HA2 GLY 67 23.766 11.917 -5.433 476 HA3 GLY 67 HA3 GLY 67 24.329 11.248 -6.958 477 H ILE 68 H ILE 68 27.127 11.633 -5.532 478 HA ILE 68 HA ILE 68 27.430 8.900 -4.848 479 HB ILE 68 HB ILE 68 29.269 11.219 -4.241 480 HG12 ILE 68 HG12 ILE 68 29.702 9.236 -6.440 481 HG13 ILE 68 HG13 ILE 68 28.574 10.562 -6.697 482 HG21 ILE 68 HG21 ILE 68 29.977 9.496 -2.843 483 HG22 ILE 68 HG22 ILE 68 29.595 8.248 -4.028 484 HG23 ILE 68 HG23 ILE 68 30.985 9.305 -4.277 485 HD11 ILE 68 HD11 ILE 68 31.518 10.592 -6.445 486 HD12 ILE 68 HD12 ILE 68 30.454 11.539 -7.485 487 HD13 ILE 68 HD13 ILE 68 30.632 11.967 -5.784 488 H TYR 69 H TYR 69 26.975 7.893 -3.012 489 HA TYR 69 HA TYR 69 27.121 9.356 -0.482 490 HB2 TYR 69 HB2 TYR 69 24.729 7.704 -1.319 491 HB3 TYR 69 HB3 TYR 69 24.960 8.449 0.257 492 HD1 TYR 69 HD2 TYR 69 25.645 11.107 -0.059 493 HD2 TYR 69 HD1 TYR 69 23.201 8.784 -2.652 494 HE1 TYR 69 HE2 TYR 69 24.561 13.161 -0.866 495 HE2 TYR 69 HE1 TYR 69 22.110 10.832 -3.469 496 HH TYR 69 HH TYR 69 21.794 13.353 -2.267 497 H LYS 70 H LYS 70 28.225 8.236 0.972 498 HA LYS 70 HA LYS 70 28.515 5.332 0.578 499 HB2 LYS 70 HB2 LYS 70 30.357 7.281 1.976 500 HB3 LYS 70 HB3 LYS 70 30.625 5.547 1.855 501 HG2 LYS 70 HG2 LYS 70 31.936 6.299 0.146 502 HG3 LYS 70 HG3 LYS 70 30.424 6.007 -0.716 503 HD2 LYS 70 HD2 LYS 70 30.626 8.114 -1.444 504 HD3 LYS 70 HD3 LYS 70 30.122 8.586 0.180 505 HE2 LYS 70 HE2 LYS 70 32.054 9.791 0.009 506 HE3 LYS 70 HE3 LYS 70 32.697 8.295 0.683 507 HZ1 LYS 70 HZ1 LYS 70 32.634 8.042 -2.102 508 HZ2 LYS 70 HZ2 LYS 70 33.988 8.101 -1.088 509 HZ3 LYS 70 HZ3 LYS 70 33.358 9.530 -1.742 510 H VAL 71 H VAL 71 27.029 4.367 1.834 511 HA VAL 71 HA VAL 71 26.602 5.355 4.560 512 HB VAL 71 HB VAL 71 25.045 3.318 2.960 513 HG11 VAL 71 HG11 VAL 71 23.375 3.571 4.815 514 HG12 VAL 71 HG12 VAL 71 24.863 2.735 5.263 515 HG13 VAL 71 HG13 VAL 71 24.619 4.419 5.731 516 HG21 VAL 71 HG21 VAL 71 23.273 5.100 3.063 517 HG22 VAL 71 HG22 VAL 71 24.516 6.200 3.659 518 HG23 VAL 71 HG23 VAL 71 24.667 5.485 2.054 519 H GLU 72 H GLU 72 27.236 4.258 6.324 520 HA GLU 72 HA GLU 72 28.348 1.558 5.934 521 HB2 GLU 72 HB2 GLU 72 30.307 2.589 6.422 522 HB3 GLU 72 HB3 GLU 72 29.514 3.958 7.188 523 HG2 GLU 72 HG2 GLU 72 29.371 2.887 9.245 524 HG3 GLU 72 HG3 GLU 72 29.607 1.291 8.536 525 H ILE 73 H ILE 73 27.862 0.019 7.440 526 HA ILE 73 HA ILE 73 25.992 0.828 9.571 527 HB ILE 73 HB ILE 73 26.080 -1.799 8.082 528 HG12 ILE 73 HG12 ILE 73 23.564 -0.521 7.874 529 HG13 ILE 73 HG13 ILE 73 24.781 0.701 7.517 530 HG21 ILE 73 HG21 ILE 73 25.219 -2.537 10.032 531 HG22 ILE 73 HG22 ILE 73 24.734 -0.923 10.552 532 HG23 ILE 73 HG23 ILE 73 23.736 -1.818 9.405 533 HD11 ILE 73 HD11 ILE 73 25.566 -0.445 5.667 534 HD12 ILE 73 HD12 ILE 73 24.884 -1.981 6.205 535 HD13 ILE 73 HD13 ILE 73 23.824 -0.710 5.595 536 H ASP 74 H ASP 74 26.374 0.158 11.616 537 HA ASP 74 HA ASP 74 28.851 -1.356 12.069 538 HB2 ASP 74 HB2 ASP 74 27.701 0.978 13.301 539 HB3 ASP 74 HB3 ASP 74 27.920 -0.286 14.509 540 H THR 75 H THR 75 28.416 -3.463 12.254 541 HA THR 75 HA THR 75 25.979 -4.349 13.587 542 HB THR 75 HB THR 75 26.558 -6.587 12.821 543 HG1 THR 75 HG1 THR 75 28.820 -5.564 11.475 544 HG21 THR 75 HG21 THR 75 27.074 -4.704 10.530 545 HG22 THR 75 HG22 THR 75 25.484 -4.883 11.271 546 HG23 THR 75 HG23 THR 75 26.259 -6.265 10.496 547 H LYS 76 H LYS 76 28.518 -3.181 14.887 548 HA LYS 76 HA LYS 76 29.440 -5.369 16.542 549 HB2 LYS 76 HB2 LYS 76 30.859 -3.679 17.611 550 HB3 LYS 76 HB3 LYS 76 31.015 -3.627 15.860 551 HG2 LYS 76 HG2 LYS 76 30.816 -1.411 16.220 552 HG3 LYS 76 HG3 LYS 76 29.094 -1.796 16.166 553 HD2 LYS 76 HD2 LYS 76 29.215 -0.565 18.108 554 HD3 LYS 76 HD3 LYS 76 29.414 -2.204 18.733 555 HE2 LYS 76 HE2 LYS 76 31.125 -1.091 19.800 556 HE3 LYS 76 HE3 LYS 76 31.952 -1.729 18.379 557 HZ1 LYS 76 HZ1 LYS 76 32.166 0.778 19.089 558 HZ2 LYS 76 HZ2 LYS 76 30.750 0.928 18.176 559 HZ3 LYS 76 HZ3 LYS 76 32.158 0.323 17.461 560 H SER 77 H SER 77 27.419 -2.493 16.890 561 HA SER 77 HA SER 77 26.861 -3.133 19.674 562 HB2 SER 77 HB2 SER 77 25.297 -1.037 19.311 563 HB3 SER 77 HB3 SER 77 27.039 -0.836 19.489 564 HG SER 77 HG SER 77 25.443 -0.302 17.356 565 H TYR 78 H TYR 78 25.604 -3.833 16.618 566 HA TYR 78 HA TYR 78 22.835 -3.991 17.308 567 HB2 TYR 78 HB2 TYR 78 23.387 -3.706 14.998 568 HB3 TYR 78 HB3 TYR 78 24.436 -5.120 15.010 569 HD1 TYR 78 HD1 TYR 78 20.881 -4.362 15.910 570 HD2 TYR 78 HD2 TYR 78 23.595 -6.944 13.892 571 HE1 TYR 78 HE1 TYR 78 18.995 -5.760 15.174 572 HE2 TYR 78 HE2 TYR 78 21.717 -8.347 13.147 573 HH TYR 78 HH TYR 78 18.857 -7.591 12.863 574 H TRP 79 H TRP 79 25.486 -6.327 17.079 575 HA TRP 79 HA TRP 79 23.857 -8.576 17.759 576 HB2 TRP 79 HB2 TRP 79 25.660 -9.741 17.119 577 HB3 TRP 79 HB3 TRP 79 26.431 -8.201 16.749 578 HD1 TRP 79 HD1 TRP 79 26.037 -10.529 19.838 579 HE1 TRP 79 HE1 TRP 79 28.229 -10.428 21.182 580 HE3 TRP 79 HE3 TRP 79 28.554 -7.077 17.029 581 HZ2 TRP 79 HZ2 TRP 79 30.698 -9.066 21.068 582 HZ3 TRP 79 HZ3 TRP 79 30.826 -6.429 17.715 583 HH2 TRP 79 HH2 TRP 79 31.874 -7.403 19.694 584 H LYS 80 H LYS 80 25.779 -6.264 19.535 585 HA LYS 80 HA LYS 80 25.663 -7.758 22.005 586 HB2 LYS 80 HB2 LYS 80 27.042 -6.129 22.908 587 HB3 LYS 80 HB3 LYS 80 27.496 -6.085 21.209 588 HG2 LYS 80 HG2 LYS 80 27.237 -3.872 21.477 589 HG3 LYS 80 HG3 LYS 80 25.532 -4.247 21.213 590 HD2 LYS 80 HD2 LYS 80 25.422 -2.986 23.137 591 HD3 LYS 80 HD3 LYS 80 25.520 -4.618 23.803 592 HE2 LYS 80 HE2 LYS 80 27.962 -4.325 24.055 593 HE3 LYS 80 HE3 LYS 80 27.798 -2.668 23.476 594 HZ1 LYS 80 HZ1 LYS 80 25.973 -2.872 25.500 595 HZ2 LYS 80 HZ2 LYS 80 27.484 -2.121 25.592 596 HZ3 LYS 80 HZ3 LYS 80 27.310 -3.731 26.079 597 H ALA 81 H ALA 81 23.661 -5.565 20.334 598 HA ALA 81 HA ALA 81 22.327 -4.492 22.650 599 HB1 ALA 81 HB1 ALA 81 22.291 -3.039 20.833 600 HB2 ALA 81 HB2 ALA 81 21.858 -4.317 19.696 601 HB3 ALA 81 HB3 ALA 81 20.663 -3.719 20.847 602 H LEU 82 H LEU 82 21.580 -6.913 20.163 603 HA LEU 82 HA LEU 82 19.237 -7.743 21.725 604 HB2 LEU 82 HB2 LEU 82 20.023 -8.522 18.922 605 HB3 LEU 82 HB3 LEU 82 18.510 -8.917 19.734 606 HG LEU 82 HG LEU 82 17.884 -7.190 18.341 607 HD11 LEU 82 HD11 LEU 82 17.643 -6.756 20.934 608 HD12 LEU 82 HD12 LEU 82 17.147 -5.552 19.746 609 HD13 LEU 82 HD13 LEU 82 18.701 -5.395 20.563 610 HD21 LEU 82 HD21 LEU 82 20.302 -5.552 19.040 611 HD22 LEU 82 HD22 LEU 82 19.189 -5.352 17.686 612 HD23 LEU 82 HD23 LEU 82 20.307 -6.717 17.716 613 H GLY 83 H GLY 83 22.425 -8.494 21.432 614 HA2 GLY 83 HA2 GLY 83 23.675 -10.285 22.143 615 HA3 GLY 83 HA3 GLY 83 22.207 -10.905 22.883 616 H ILE 84 H ILE 84 23.047 -10.312 19.479 617 HA ILE 84 HA ILE 84 22.065 -12.967 18.807 618 HB ILE 84 HB ILE 84 23.159 -10.909 16.896 619 HG12 ILE 84 HG12 ILE 84 21.374 -9.865 18.190 620 HG13 ILE 84 HG13 ILE 84 20.816 -10.196 16.554 621 HG21 ILE 84 HG21 ILE 84 22.923 -12.708 15.561 622 HG22 ILE 84 HG22 ILE 84 21.804 -13.509 16.663 623 HG23 ILE 84 HG23 ILE 84 21.220 -12.248 15.579 624 HD11 ILE 84 HD11 ILE 84 19.059 -11.196 17.446 625 HD12 ILE 84 HD12 ILE 84 20.141 -12.459 18.036 626 HD13 ILE 84 HD13 ILE 84 19.749 -11.081 19.064 627 H SER 85 H SER 85 23.284 -14.455 17.521 628 HA SER 85 HA SER 85 25.782 -15.093 18.473 629 HB2 SER 85 HB2 SER 85 24.303 -15.809 15.972 630 HB3 SER 85 HB3 SER 85 25.985 -16.309 16.140 631 HG SER 85 HG SER 85 25.195 -17.114 18.304 632 HA PRO 86 HA PRO 86 28.766 -12.501 16.573 633 HB2 PRO 86 HB2 PRO 86 30.803 -14.229 16.088 634 HB3 PRO 86 HB3 PRO 86 30.373 -13.683 17.713 635 HG2 PRO 86 HG2 PRO 86 29.665 -16.239 16.324 636 HG3 PRO 86 HG3 PRO 86 30.193 -15.985 17.998 637 HD2 PRO 86 HD2 PRO 86 27.595 -16.355 17.330 638 HD3 PRO 86 HD3 PRO 86 28.094 -15.333 18.694 639 H MET 87 H MET 87 28.937 -11.657 14.595 640 HA MET 87 HA MET 87 29.687 -13.033 12.284 641 HB2 MET 87 HB2 MET 87 27.435 -12.785 11.063 642 HB3 MET 87 HB3 MET 87 27.635 -14.151 12.150 643 HG2 MET 87 HG2 MET 87 26.429 -12.924 13.895 644 HG3 MET 87 HG3 MET 87 26.206 -11.579 12.779 645 HE1 MET 87 HE1 MET 87 25.521 -15.398 13.353 646 HE2 MET 87 HE2 MET 87 24.411 -15.764 12.032 647 HE3 MET 87 HE3 MET 87 26.093 -15.358 11.685 648 H HIS 88 H HIS 88 30.977 -11.192 12.109 649 HA HIS 88 HA HIS 88 29.933 -8.551 12.060 650 HB2 HIS 88 HB2 HIS 88 32.529 -9.460 10.816 651 HB3 HIS 88 HB3 HIS 88 32.131 -7.857 11.427 652 HD1 HIS 88 HD1 HIS 88 30.936 -8.868 14.178 653 HD2 HIS 88 HD2 HIS 88 34.605 -9.955 12.562 654 HE1 HIS 88 HE1 HIS 88 32.341 -9.598 16.131 655 H GLU 89 H GLU 89 28.539 -7.899 10.555 656 HA GLU 89 HA GLU 89 29.224 -8.362 7.740 657 HB2 GLU 89 HB2 GLU 89 26.781 -9.213 9.158 658 HB3 GLU 89 HB3 GLU 89 26.508 -8.396 7.626 659 HG2 GLU 89 HG2 GLU 89 26.600 -10.777 7.288 660 HG3 GLU 89 HG3 GLU 89 27.984 -10.007 6.515 661 H HIS 90 H HIS 90 30.031 -6.157 8.003 662 HA HIS 90 HA HIS 90 27.908 -4.127 8.117 663 HB2 HIS 90 HB2 HIS 90 29.864 -2.525 8.369 664 HB3 HIS 90 HB3 HIS 90 29.595 -3.630 9.713 665 HD1 HIS 90 HD1 HIS 90 31.313 -5.608 9.968 666 HD2 HIS 90 HD2 HIS 90 32.303 -2.773 7.098 667 HE1 HIS 90 HE1 HIS 90 33.736 -6.010 9.435 668 H ALA 91 H ALA 91 27.334 -4.832 5.898 669 HA ALA 91 HA ALA 91 29.167 -4.239 3.762 670 HB1 ALA 91 HB1 ALA 91 27.464 -6.033 3.614 671 HB2 ALA 91 HB2 ALA 91 26.209 -4.794 3.594 672 HB3 ALA 91 HB3 ALA 91 27.383 -4.879 2.282 673 H GLU 92 H GLU 92 29.431 -2.363 2.732 674 HA GLU 92 HA GLU 92 27.583 -0.168 3.374 675 HB2 GLU 92 HB2 GLU 92 29.494 1.284 2.535 676 HB3 GLU 92 HB3 GLU 92 29.767 0.427 4.045 677 HG2 GLU 92 HG2 GLU 92 31.153 -1.179 2.984 678 HG3 GLU 92 HG3 GLU 92 30.704 -0.597 1.381 679 H VAL 93 H VAL 93 26.968 1.310 1.705 680 HA VAL 93 HA VAL 93 26.995 0.089 -0.979 681 HB VAL 93 HB VAL 93 24.886 1.877 0.240 682 HG11 VAL 93 HG11 VAL 93 23.726 0.882 -1.958 683 HG12 VAL 93 HG12 VAL 93 24.607 2.411 -1.944 684 HG13 VAL 93 HG13 VAL 93 25.397 0.941 -2.517 685 HG21 VAL 93 HG21 VAL 93 24.931 -1.074 -0.366 686 HG22 VAL 93 HG22 VAL 93 24.733 -0.301 1.207 687 HG23 VAL 93 HG23 VAL 93 23.459 -0.170 -0.005 688 H VAL 94 H VAL 94 28.398 1.127 -2.237 689 HA VAL 94 HA VAL 94 28.484 4.071 -2.098 690 HB VAL 94 HB VAL 94 30.738 2.201 -2.841 691 HG11 VAL 94 HG11 VAL 94 31.532 3.948 -3.976 692 HG12 VAL 94 HG12 VAL 94 30.295 5.028 -3.327 693 HG13 VAL 94 HG13 VAL 94 31.774 4.727 -2.413 694 HG21 VAL 94 HG21 VAL 94 31.207 4.006 -0.629 695 HG22 VAL 94 HG22 VAL 94 29.836 2.941 -0.321 696 HG23 VAL 94 HG23 VAL 94 31.412 2.256 -0.718 697 H PHE 95 H PHE 95 27.370 4.827 -3.781 698 HA PHE 95 HA PHE 95 27.956 3.708 -6.437 699 HB2 PHE 95 HB2 PHE 95 25.302 4.260 -5.172 700 HB3 PHE 95 HB3 PHE 95 25.478 4.470 -6.911 701 HD1 PHE 95 HD2 PHE 95 26.438 2.478 -8.229 702 HD2 PHE 95 HD1 PHE 95 24.856 2.169 -4.290 703 HE1 PHE 95 HE2 PHE 95 26.112 0.061 -8.554 704 HE2 PHE 95 HE1 PHE 95 24.528 -0.249 -4.608 705 HZ PHE 95 HZ PHE 95 25.155 -1.306 -6.742 706 H THR 96 H THR 96 28.408 5.159 -7.994 707 HA THR 96 HA THR 96 28.385 7.987 -7.228 708 HB THR 96 HB THR 96 30.548 7.225 -7.937 709 HG1 THR 96 HG1 THR 96 29.613 8.559 -10.241 710 HG21 THR 96 HG21 THR 96 29.069 6.136 -10.318 711 HG22 THR 96 HG22 THR 96 30.130 5.282 -9.197 712 HG23 THR 96 HG23 THR 96 30.808 6.428 -10.353 713 H ALA 97 H ALA 97 27.299 9.530 -8.355 714 HA ALA 97 HA ALA 97 25.210 8.623 -10.138 715 HB1 ALA 97 HB1 ALA 97 25.667 10.906 -8.439 716 HB2 ALA 97 HB2 ALA 97 25.131 11.406 -10.043 717 HB3 ALA 97 HB3 ALA 97 24.157 10.280 -9.098 718 H ASN 98 H ASN 98 24.820 9.525 -12.236 719 HA ASN 98 HA ASN 98 25.407 10.098 -14.357 720 HB2 ASN 98 HB2 ASN 98 27.756 11.633 -13.281 721 HB3 ASN 98 HB3 ASN 98 26.741 11.999 -14.672 722 HD21 ASN 98 HD21 ASN 98 24.308 12.173 -13.947 723 HD22 ASN 98 HD22 ASN 98 24.049 13.246 -12.618 724 H ASP 99 H ASP 99 26.359 7.663 -13.380 725 HA ASP 99 HA ASP 99 28.990 7.453 -14.693 726 HB2 ASP 99 HB2 ASP 99 29.349 6.801 -12.466 727 HB3 ASP 99 HB3 ASP 99 27.807 5.955 -12.369 728 H SER 100 H SER 100 26.112 5.468 -13.974 729 HA SER 100 HA SER 100 26.211 4.478 -16.740 730 HB2 SER 100 HB2 SER 100 27.200 2.750 -15.309 731 HB3 SER 100 HB3 SER 100 25.774 2.775 -14.274 732 HG SER 100 HG SER 100 25.872 1.087 -15.950 733 H GLY 101 H GLY 101 24.247 4.508 -13.763 734 HA2 GLY 101 HA2 GLY 101 22.092 5.869 -14.303 735 HA3 GLY 101 HA3 GLY 101 21.824 4.539 -15.419 736 HA PRO 102 HA PRO 102 21.620 2.618 -10.983 737 HB2 PRO 102 HB2 PRO 102 21.632 4.361 -8.902 738 HB3 PRO 102 HB3 PRO 102 23.107 3.654 -9.570 739 HG2 PRO 102 HG2 PRO 102 21.906 6.349 -10.069 740 HG3 PRO 102 HG3 PRO 102 23.603 5.914 -9.798 741 HD2 PRO 102 HD2 PRO 102 22.597 6.385 -12.267 742 HD3 PRO 102 HD3 PRO 102 23.904 5.220 -11.975 743 H ARG 103 H ARG 103 19.592 1.977 -10.662 744 HA ARG 103 HA ARG 103 17.460 4.001 -10.616 745 HB2 ARG 103 HB2 ARG 103 17.544 1.125 -11.462 746 HB3 ARG 103 HB3 ARG 103 16.017 1.856 -10.985 747 HG2 ARG 103 HG2 ARG 103 16.678 3.701 -12.698 748 HG3 ARG 103 HG3 ARG 103 17.747 2.450 -13.339 749 HD2 ARG 103 HD2 ARG 103 15.728 0.937 -13.414 750 HD3 ARG 103 HD3 ARG 103 14.751 2.361 -13.061 751 HE ARG 103 HE ARG 103 16.323 3.008 -15.242 752 HH11 ARG 103 HH11 ARG 103 13.861 0.675 -14.459 753 HH12 ARG 103 HH12 ARG 103 13.268 0.562 -16.083 754 HH21 ARG 103 HH21 ARG 103 15.551 2.869 -17.384 755 HH22 ARG 103 HH22 ARG 103 14.231 1.810 -17.746 756 H ARG 104 H ARG 104 19.176 3.190 -8.335 757 HA ARG 104 HA ARG 104 17.002 2.490 -6.496 758 HB2 ARG 104 HB2 ARG 104 18.744 1.141 -5.189 759 HB3 ARG 104 HB3 ARG 104 18.089 0.413 -6.651 760 HG2 ARG 104 HG2 ARG 104 20.577 2.002 -6.910 761 HG3 ARG 104 HG3 ARG 104 20.681 0.431 -6.113 762 HD2 ARG 104 HD2 ARG 104 19.227 0.660 -8.707 763 HD3 ARG 104 HD3 ARG 104 20.989 0.642 -8.708 764 HE ARG 104 HE ARG 104 20.024 -1.489 -7.140 765 HH11 ARG 104 HH11 ARG 104 20.262 -0.464 -10.459 766 HH12 ARG 104 HH12 ARG 104 20.299 -2.076 -11.090 767 HH21 ARG 104 HH21 ARG 104 20.071 -3.617 -7.960 768 HH22 ARG 104 HH22 ARG 104 20.188 -3.870 -9.669 769 H TYR 105 H TYR 105 16.877 3.837 -4.821 770 HA TYR 105 HA TYR 105 19.193 5.570 -4.265 771 HB2 TYR 105 HB2 TYR 105 17.518 7.183 -3.355 772 HB3 TYR 105 HB3 TYR 105 17.328 6.864 -5.075 773 HD1 TYR 105 HD1 TYR 105 16.012 5.816 -1.749 774 HD2 TYR 105 HD2 TYR 105 15.246 6.244 -5.913 775 HE1 TYR 105 HE1 TYR 105 13.657 5.218 -1.372 776 HE2 TYR 105 HE2 TYR 105 12.889 5.648 -5.547 777 HH TYR 105 HH TYR 105 11.261 5.528 -3.864 778 H THR 106 H THR 106 17.143 3.165 -3.007 779 HA THR 106 HA THR 106 17.596 3.855 -0.224 780 HB THR 106 HB THR 106 16.234 1.450 -1.453 781 HG1 THR 106 HG1 THR 106 14.344 2.573 -0.676 782 HG21 THR 106 HG21 THR 106 16.734 2.272 1.383 783 HG22 THR 106 HG22 THR 106 16.857 0.676 0.642 784 HG23 THR 106 HG23 THR 106 15.272 1.377 0.968 785 H ILE 107 H ILE 107 18.992 2.864 1.152 786 HA ILE 107 HA ILE 107 21.099 1.271 -0.048 787 HB ILE 107 HB ILE 107 20.801 2.340 2.760 788 HG12 ILE 107 HG12 ILE 107 22.931 3.620 1.688 789 HG13 ILE 107 HG13 ILE 107 21.948 3.396 0.245 790 HG21 ILE 107 HG21 ILE 107 22.449 0.978 3.351 791 HG22 ILE 107 HG22 ILE 107 22.536 0.331 1.713 792 HG23 ILE 107 HG23 ILE 107 23.488 1.750 2.153 793 HD11 ILE 107 HD11 ILE 107 20.229 4.715 1.063 794 HD12 ILE 107 HD12 ILE 107 20.771 4.557 2.735 795 HD13 ILE 107 HD13 ILE 107 21.682 5.556 1.602 796 H ALA 108 H ALA 108 20.777 -0.845 -0.240 797 HA ALA 108 HA ALA 108 19.144 -2.270 1.709 798 HB1 ALA 108 HB1 ALA 108 19.118 -2.518 -0.906 799 HB2 ALA 108 HB2 ALA 108 20.442 -3.642 -0.592 800 HB3 ALA 108 HB3 ALA 108 18.861 -3.915 0.141 801 H ALA 109 H ALA 109 20.126 -2.973 3.487 802 HA ALA 109 HA ALA 109 22.810 -4.161 3.222 803 HB1 ALA 109 HB1 ALA 109 23.629 -2.921 4.885 804 HB2 ALA 109 HB2 ALA 109 22.215 -1.892 4.657 805 HB3 ALA 109 HB3 ALA 109 22.195 -3.158 5.884 806 H MET 110 H MET 110 22.627 -6.291 3.450 807 HA MET 110 HA MET 110 20.639 -7.349 5.339 808 HB2 MET 110 HB2 MET 110 21.975 -8.564 2.926 809 HB3 MET 110 HB3 MET 110 21.076 -9.529 4.090 810 HG2 MET 110 HG2 MET 110 19.134 -7.936 3.643 811 HG3 MET 110 HG3 MET 110 20.061 -7.401 2.242 812 HE1 MET 110 HE1 MET 110 18.543 -11.601 3.088 813 HE2 MET 110 HE2 MET 110 18.795 -10.268 4.214 814 HE3 MET 110 HE3 MET 110 17.342 -10.314 3.213 815 H LEU 111 H LEU 111 21.287 -8.323 7.148 816 HA LEU 111 HA LEU 111 24.128 -8.583 7.663 817 HB2 LEU 111 HB2 LEU 111 21.768 -9.150 9.453 818 HB3 LEU 111 HB3 LEU 111 23.457 -9.082 9.953 819 HG LEU 111 HG LEU 111 22.600 -7.045 10.660 820 HD11 LEU 111 HD11 LEU 111 24.652 -6.801 9.310 821 HD12 LEU 111 HD12 LEU 111 23.638 -5.359 9.287 822 HD13 LEU 111 HD13 LEU 111 23.653 -6.449 7.899 823 HD21 LEU 111 HD21 LEU 111 21.314 -6.407 8.040 824 HD22 LEU 111 HD22 LEU 111 20.941 -5.798 9.652 825 HD23 LEU 111 HD23 LEU 111 20.479 -7.440 9.200 826 H SER 112 H SER 112 24.312 -10.312 6.003 827 HA SER 112 HA SER 112 23.128 -12.798 6.110 828 HB2 SER 112 HB2 SER 112 24.629 -13.351 4.513 829 HB3 SER 112 HB3 SER 112 25.142 -11.667 4.627 830 HG SER 112 HG SER 112 26.965 -12.330 5.412 831 HA PRO 113 HA PRO 113 24.563 -14.919 9.671 832 HB2 PRO 113 HB2 PRO 113 24.991 -17.428 8.728 833 HB3 PRO 113 HB3 PRO 113 23.375 -16.747 8.946 834 HG2 PRO 113 HG2 PRO 113 25.010 -16.983 6.449 835 HG3 PRO 113 HG3 PRO 113 23.281 -17.298 6.689 836 HD2 PRO 113 HD2 PRO 113 24.206 -15.003 5.589 837 HD3 PRO 113 HD3 PRO 113 22.730 -15.063 6.575 838 H TYR 114 H TYR 114 26.336 -16.931 10.030 839 HA TYR 114 HA TYR 114 28.784 -15.725 10.255 840 HB2 TYR 114 HB2 TYR 114 28.422 -18.685 9.769 841 HB3 TYR 114 HB3 TYR 114 29.722 -17.902 10.660 842 HD1 TYR 114 HD2 TYR 114 28.963 -16.501 12.747 843 HD2 TYR 114 HD1 TYR 114 26.626 -19.562 10.939 844 HE1 TYR 114 HE2 TYR 114 27.688 -16.752 14.835 845 HE2 TYR 114 HE1 TYR 114 25.343 -19.820 13.021 846 HH TYR 114 HH TYR 114 26.120 -19.133 15.757 847 H SER 115 H SER 115 29.933 -14.800 8.694 848 HA SER 115 HA SER 115 29.804 -15.424 5.968 849 HB2 SER 115 HB2 SER 115 30.670 -13.321 6.265 850 HB3 SER 115 HB3 SER 115 31.605 -13.789 7.685 851 HG SER 115 HG SER 115 32.419 -13.586 5.153 852 H TYR 116 H TYR 116 30.216 -17.460 5.316 853 HA TYR 116 HA TYR 116 32.354 -19.029 6.413 854 HB2 TYR 116 HB2 TYR 116 31.691 -20.675 4.656 855 HB3 TYR 116 HB3 TYR 116 30.358 -20.167 5.685 856 HD1 TYR 116 HD2 TYR 116 31.904 -19.644 2.355 857 HD2 TYR 116 HD1 TYR 116 28.425 -19.188 4.761 858 HE1 TYR 116 HE2 TYR 116 30.613 -19.013 0.358 859 HE2 TYR 116 HE1 TYR 116 27.124 -18.557 2.772 860 HH TYR 116 HH TYR 116 27.437 -19.090 0.123 861 H SER 117 H SER 117 31.945 -16.894 3.717 862 HA SER 117 HA SER 117 34.767 -17.065 3.113 863 HB2 SER 117 HB2 SER 117 33.703 -18.873 1.725 864 HB3 SER 117 HB3 SER 117 32.776 -17.617 0.903 865 HG SER 117 HG SER 117 35.608 -17.655 1.049 866 H THR 118 H THR 118 35.242 -14.973 3.285 867 HA THR 118 HA THR 118 33.399 -12.895 2.580 868 HB THR 118 HB THR 118 35.211 -11.343 3.156 869 HG1 THR 118 HG1 THR 118 36.770 -13.716 3.447 870 HG21 THR 118 HG21 THR 118 33.939 -12.072 5.016 871 HG22 THR 118 HG22 THR 118 35.628 -12.192 5.512 872 HG23 THR 118 HG23 THR 118 34.741 -13.643 5.042 873 H THR 119 H THR 119 33.193 -11.837 0.710 874 HA THR 119 HA THR 119 35.156 -12.402 -1.412 875 HB THR 119 HB THR 119 33.367 -11.849 -3.019 876 HG1 THR 119 HG1 THR 119 31.293 -11.444 -2.284 877 HG21 THR 119 HG21 THR 119 33.333 -14.110 -2.834 878 HG22 THR 119 HG22 THR 119 31.760 -13.799 -2.098 879 HG23 THR 119 HG23 THR 119 33.173 -14.071 -1.078 880 H ALA 120 H ALA 120 33.436 -9.890 0.302 881 HA ALA 120 HA ALA 120 35.287 -7.915 -0.774 882 HB1 ALA 120 HB1 ALA 120 32.360 -7.921 -1.294 883 HB2 ALA 120 HB2 ALA 120 33.156 -6.374 -1.000 884 HB3 ALA 120 HB3 ALA 120 33.693 -7.405 -2.327 885 H VAL 121 H VAL 121 36.180 -7.224 1.067 886 HA VAL 121 HA VAL 121 34.387 -6.501 3.294 887 HB VAL 121 HB VAL 121 36.294 -6.878 4.814 888 HG11 VAL 121 HG11 VAL 121 35.706 -9.302 3.121 889 HG12 VAL 121 HG12 VAL 121 36.195 -9.281 4.817 890 HG13 VAL 121 HG13 VAL 121 34.617 -8.648 4.345 891 HG21 VAL 121 HG21 VAL 121 37.923 -8.516 3.144 892 HG22 VAL 121 HG22 VAL 121 37.767 -6.925 2.400 893 HG23 VAL 121 HG23 VAL 121 38.371 -7.070 4.051 894 H VAL 122 H VAL 122 35.785 -4.954 4.850 895 HA VAL 122 HA VAL 122 36.720 -2.750 3.130 896 HB VAL 122 HB VAL 122 34.627 -2.227 4.300 897 HG11 VAL 122 HG11 VAL 122 34.521 -2.076 6.707 898 HG12 VAL 122 HG12 VAL 122 35.000 -3.710 6.244 899 HG13 VAL 122 HG13 VAL 122 36.207 -2.573 6.845 900 HG21 VAL 122 HG21 VAL 122 36.802 -0.635 5.618 901 HG22 VAL 122 HG22 VAL 122 36.517 -0.540 3.881 902 HG23 VAL 122 HG23 VAL 122 35.240 -0.086 5.010 903 H THR 123 H THR 123 37.314 -4.618 6.032 904 HA THR 123 HA THR 123 39.681 -3.067 6.703 905 HB THR 123 HB THR 123 39.863 -5.020 8.466 906 HG1 THR 123 HG1 THR 123 37.070 -5.051 7.928 907 HG21 THR 123 HG21 THR 123 39.411 -2.669 8.996 908 HG22 THR 123 HG22 THR 123 38.424 -3.747 9.981 909 HG23 THR 123 HG23 THR 123 37.708 -2.908 8.607 910 H ASN 124 H ASN 124 41.787 -3.866 6.687 911 HA ASN 124 HA ASN 124 43.572 -4.986 5.830 912 HB2 ASN 124 HB2 ASN 124 41.632 -7.262 6.224 913 HB3 ASN 124 HB3 ASN 124 43.278 -7.519 5.651 914 HD21 ASN 124 HD21 ASN 124 44.013 -8.624 7.398 915 HD22 ASN 124 HD22 ASN 124 44.185 -7.928 8.970 916 HA PRO 125 HA PRO 125 41.671 -4.781 1.578 917 HB2 PRO 125 HB2 PRO 125 43.275 -2.779 0.689 918 HB3 PRO 125 HB3 PRO 125 41.754 -2.485 1.540 919 HG2 PRO 125 HG2 PRO 125 44.555 -2.437 2.595 920 HG3 PRO 125 HG3 PRO 125 43.219 -1.315 2.913 921 HD2 PRO 125 HD2 PRO 125 43.924 -3.270 4.650 922 HD3 PRO 125 HD3 PRO 125 42.248 -2.711 4.469 923 H LYS 126 H LYS 126 43.092 -4.605 -0.554 924 HA LYS 126 HA LYS 126 44.825 -6.848 -0.528 925 HB2 LYS 126 HB2 LYS 126 44.887 -6.650 -2.828 926 HB3 LYS 126 HB3 LYS 126 43.375 -5.834 -2.456 927 HG2 LYS 126 HG2 LYS 126 46.013 -4.460 -2.925 928 HG3 LYS 126 HG3 LYS 126 44.720 -4.627 -4.115 929 HD2 LYS 126 HD2 LYS 126 44.368 -3.283 -1.440 930 HD3 LYS 126 HD3 LYS 126 44.786 -2.419 -2.922 931 HE2 LYS 126 HE2 LYS 126 42.692 -2.538 -3.718 932 HE3 LYS 126 HE3 LYS 126 42.489 -4.209 -3.197 933 HZ1 LYS 126 HZ1 LYS 126 41.546 -3.586 -1.271 934 HZ2 LYS 126 HZ2 LYS 126 41.201 -2.154 -2.104 935 HZ3 LYS 126 HZ3 LYS 126 42.542 -2.232 -1.075 936 H GLU 127 H GLU 127 45.336 -3.620 0.276 937 HA GLU 127 HA GLU 127 48.220 -3.815 -0.275 938 HB2 GLU 127 HB2 GLU 127 46.317 -1.535 -0.110 939 HB3 GLU 127 HB3 GLU 127 47.964 -1.255 0.434 940 HG2 GLU 127 HG2 GLU 127 47.187 -2.300 -2.278 941 HG3 GLU 127 HG3 GLU 127 47.621 -0.631 -1.912 Start of MODEL 14 1 H1 GLY 1 H GLY 1 3.326 5.889 -8.182 2 HA2 GLY 1 HA2 GLY 1 4.318 3.948 -8.907 3 HA3 GLY 1 HA3 GLY 1 5.183 3.997 -7.377 4 HA PRO 2 HA PRO 2 1.209 1.273 -6.752 5 HB2 PRO 2 HB2 PRO 2 0.041 0.390 -9.039 6 HB3 PRO 2 HB3 PRO 2 -0.442 1.885 -8.230 7 HG2 PRO 2 HG2 PRO 2 1.353 1.505 -10.595 8 HG3 PRO 2 HG3 PRO 2 0.083 2.716 -10.337 9 HD2 PRO 2 HD2 PRO 2 2.713 3.268 -10.002 10 HD3 PRO 2 HD3 PRO 2 1.442 4.048 -9.036 11 H THR 3 H THR 3 0.601 -1.105 -7.720 12 HA THR 3 HA THR 3 2.813 -2.702 -7.322 13 HB THR 3 HB THR 3 1.534 -4.562 -8.197 14 HG1 THR 3 HG1 THR 3 -0.550 -2.881 -9.048 15 HG21 THR 3 HG21 THR 3 -0.496 -4.350 -6.871 16 HG22 THR 3 HG22 THR 3 -0.304 -2.598 -6.823 17 HG23 THR 3 HG23 THR 3 0.868 -3.635 -6.012 18 H GLY 4 H GLY 4 4.441 -3.476 -8.545 19 HA2 GLY 4 HA2 GLY 4 5.428 -4.197 -10.585 20 HA3 GLY 4 HA3 GLY 4 4.287 -3.188 -11.461 21 H THR 5 H THR 5 5.748 -1.721 -8.743 22 HA THR 5 HA THR 5 7.883 -0.530 -10.351 23 HB THR 5 HB THR 5 7.296 1.735 -9.735 24 HG1 THR 5 HG1 THR 5 5.325 0.425 -8.203 25 HG21 THR 5 HG21 THR 5 4.694 0.635 -10.712 26 HG22 THR 5 HG22 THR 5 6.143 0.446 -11.700 27 HG23 THR 5 HG23 THR 5 5.584 2.057 -11.252 28 H GLY 6 H GLY 6 9.619 -1.103 -9.187 29 HA2 GLY 6 HA2 GLY 6 9.491 -1.093 -6.272 30 HA3 GLY 6 HA3 GLY 6 10.805 -1.722 -7.253 31 H GLU 7 H GLU 7 9.227 1.468 -7.120 32 HA GLU 7 HA GLU 7 11.892 2.677 -6.906 33 HB2 GLU 7 HB2 GLU 7 10.668 4.798 -7.510 34 HB3 GLU 7 HB3 GLU 7 10.673 3.554 -8.752 35 HG2 GLU 7 HG2 GLU 7 8.412 2.914 -8.157 36 HG3 GLU 7 HG3 GLU 7 8.401 4.101 -6.854 37 H SER 8 H SER 8 12.562 3.471 -5.034 38 HA SER 8 HA SER 8 11.019 3.379 -2.685 39 HB2 SER 8 HB2 SER 8 13.520 5.020 -3.138 40 HB3 SER 8 HB3 SER 8 12.897 4.439 -1.593 41 HG SER 8 HG SER 8 14.110 2.992 -3.680 42 H LYS 9 H LYS 9 10.343 5.126 -1.313 43 HA LYS 9 HA LYS 9 9.074 7.244 -2.810 44 HB2 LYS 9 HB2 LYS 9 8.974 6.312 0.041 45 HB3 LYS 9 HB3 LYS 9 8.300 7.875 -0.402 46 HG2 LYS 9 HG2 LYS 9 6.540 6.267 -0.402 47 HG3 LYS 9 HG3 LYS 9 6.872 6.718 -2.075 48 HD2 LYS 9 HD2 LYS 9 6.552 4.305 -1.852 49 HD3 LYS 9 HD3 LYS 9 8.197 4.687 -2.366 50 HE2 LYS 9 HE2 LYS 9 8.084 2.926 -0.621 51 HE3 LYS 9 HE3 LYS 9 9.031 4.332 -0.142 52 HZ1 LYS 9 HZ1 LYS 9 6.254 4.516 0.580 53 HZ2 LYS 9 HZ2 LYS 9 7.634 4.792 1.517 54 HZ3 LYS 9 HZ3 LYS 9 7.050 3.217 1.318 55 H CYS 10 H CYS 10 10.749 7.493 0.313 56 HA CYS 10 HA CYS 10 11.467 10.165 0.030 57 HB2 CYS 10 HB2 CYS 10 12.342 7.921 1.774 58 HB3 CYS 10 HB3 CYS 10 13.385 9.337 1.706 59 HG CYS 10 HG CYS 10 10.170 9.158 2.826 60 HA PRO 11 HA PRO 11 14.966 10.328 -2.607 61 HB2 PRO 11 HB2 PRO 11 16.558 12.141 -1.363 62 HB3 PRO 11 HB3 PRO 11 15.059 12.585 -2.190 63 HG2 PRO 11 HG2 PRO 11 15.556 12.158 0.731 64 HG3 PRO 11 HG3 PRO 11 14.619 13.433 -0.070 65 HD2 PRO 11 HD2 PRO 11 13.457 11.275 1.084 66 HD3 PRO 11 HD3 PRO 11 12.776 12.077 -0.346 67 H LEU 12 H LEU 12 15.822 10.052 0.833 68 HA LEU 12 HA LEU 12 17.757 7.981 0.153 69 HB2 LEU 12 HB2 LEU 12 19.035 10.069 0.164 70 HB3 LEU 12 HB3 LEU 12 18.460 10.410 1.795 71 HG LEU 12 HG LEU 12 20.843 9.487 1.483 72 HD11 LEU 12 HD11 LEU 12 19.016 9.382 3.543 73 HD12 LEU 12 HD12 LEU 12 20.744 9.057 3.665 74 HD13 LEU 12 HD13 LEU 12 19.610 7.725 3.434 75 HD21 LEU 12 HD21 LEU 12 21.178 7.299 0.970 76 HD22 LEU 12 HD22 LEU 12 19.711 7.567 0.029 77 HD23 LEU 12 HD23 LEU 12 19.615 6.792 1.611 78 H MET 13 H MET 13 17.104 6.310 1.331 79 HA MET 13 HA MET 13 16.542 6.748 4.181 80 HB2 MET 13 HB2 MET 13 14.686 5.170 4.097 81 HB3 MET 13 HB3 MET 13 14.396 6.515 3.002 82 HG2 MET 13 HG2 MET 13 14.520 5.221 1.151 83 HG3 MET 13 HG3 MET 13 15.702 4.124 1.862 84 HE1 MET 13 HE1 MET 13 15.257 2.632 3.709 85 HE2 MET 13 HE2 MET 13 13.844 3.019 4.690 86 HE3 MET 13 HE3 MET 13 13.867 1.547 3.717 87 H VAL 14 H VAL 14 17.067 5.023 5.557 88 HA VAL 14 HA VAL 14 18.947 3.098 4.375 89 HB VAL 14 HB VAL 14 18.652 4.024 7.236 90 HG11 VAL 14 HG11 VAL 14 19.375 1.796 7.384 91 HG12 VAL 14 HG12 VAL 14 20.428 1.954 5.976 92 HG13 VAL 14 HG13 VAL 14 20.850 2.757 7.490 93 HG21 VAL 14 HG21 VAL 14 19.642 5.718 5.827 94 HG22 VAL 14 HG22 VAL 14 20.889 5.010 6.855 95 HG23 VAL 14 HG23 VAL 14 20.776 4.545 5.157 96 H LYS 15 H LYS 15 18.551 0.973 4.408 97 HA LYS 15 HA LYS 15 16.317 0.000 6.065 98 HB2 LYS 15 HB2 LYS 15 15.522 0.009 3.815 99 HB3 LYS 15 HB3 LYS 15 17.018 -0.697 3.215 100 HG2 LYS 15 HG2 LYS 15 15.302 -2.368 3.210 101 HG3 LYS 15 HG3 LYS 15 16.490 -2.770 4.453 102 HD2 LYS 15 HD2 LYS 15 14.286 -1.100 5.411 103 HD3 LYS 15 HD3 LYS 15 13.779 -2.684 4.821 104 HE2 LYS 15 HE2 LYS 15 15.963 -3.339 6.298 105 HE3 LYS 15 HE3 LYS 15 15.341 -1.959 7.201 106 HZ1 LYS 15 HZ1 LYS 15 14.216 -3.718 8.135 107 HZ2 LYS 15 HZ2 LYS 15 14.060 -4.555 6.674 108 HZ3 LYS 15 HZ3 LYS 15 13.101 -3.194 6.976 109 H VAL 16 H VAL 16 17.183 -1.188 7.636 110 HA VAL 16 HA VAL 16 19.273 -3.136 6.908 111 HB VAL 16 HB VAL 16 19.017 -1.645 9.525 112 HG11 VAL 16 HG11 VAL 16 19.791 -3.879 9.944 113 HG12 VAL 16 HG12 VAL 16 20.964 -3.766 8.630 114 HG13 VAL 16 HG13 VAL 16 21.161 -2.777 10.077 115 HG21 VAL 16 HG21 VAL 16 21.268 -1.518 7.531 116 HG22 VAL 16 HG22 VAL 16 19.923 -0.377 7.538 117 HG23 VAL 16 HG23 VAL 16 20.997 -0.483 8.933 118 H LEU 17 H LEU 17 18.707 -5.181 7.224 119 HA LEU 17 HA LEU 17 16.851 -5.848 9.388 120 HB2 LEU 17 HB2 LEU 17 15.378 -7.041 8.057 121 HB3 LEU 17 HB3 LEU 17 15.706 -5.594 7.106 122 HG LEU 17 HG LEU 17 17.580 -7.385 6.177 123 HD11 LEU 17 HD11 LEU 17 15.242 -8.840 7.221 124 HD12 LEU 17 HD12 LEU 17 16.886 -9.398 6.908 125 HD13 LEU 17 HD13 LEU 17 15.738 -9.252 5.578 126 HD21 LEU 17 HD21 LEU 17 14.914 -7.259 4.867 127 HD22 LEU 17 HD22 LEU 17 16.526 -7.088 4.172 128 HD23 LEU 17 HD23 LEU 17 15.814 -5.759 5.087 129 H ASP 18 H ASP 18 17.094 -7.913 10.243 130 HA ASP 18 HA ASP 18 19.688 -9.101 9.806 131 HB2 ASP 18 HB2 ASP 18 17.518 -9.364 11.815 132 HB3 ASP 18 HB3 ASP 18 18.552 -10.770 11.578 133 H ALA 19 H ALA 19 19.955 -10.395 8.106 134 HA ALA 19 HA ALA 19 17.938 -11.740 6.717 135 HB1 ALA 19 HB1 ALA 19 20.461 -13.108 6.481 136 HB2 ALA 19 HB2 ALA 19 19.591 -12.143 5.288 137 HB3 ALA 19 HB3 ALA 19 20.686 -11.360 6.426 138 H VAL 20 H VAL 20 19.488 -12.517 9.667 139 HA VAL 20 HA VAL 20 19.479 -15.273 9.746 140 HB VAL 20 HB VAL 20 18.741 -13.377 11.980 141 HG11 VAL 20 HG11 VAL 20 18.989 -16.299 11.860 142 HG12 VAL 20 HG12 VAL 20 19.880 -15.532 13.175 143 HG13 VAL 20 HG13 VAL 20 18.142 -15.278 13.020 144 HG21 VAL 20 HG21 VAL 20 21.286 -14.215 10.754 145 HG22 VAL 20 HG22 VAL 20 20.876 -12.735 11.620 146 HG23 VAL 20 HG23 VAL 20 21.250 -14.207 12.517 147 H ARG 21 H ARG 21 16.808 -13.120 10.723 148 HA ARG 21 HA ARG 21 14.974 -15.403 10.402 149 HB2 ARG 21 HB2 ARG 21 14.293 -12.919 11.944 150 HB3 ARG 21 HB3 ARG 21 13.601 -14.530 12.083 151 HG2 ARG 21 HG2 ARG 21 14.879 -14.642 13.921 152 HG3 ARG 21 HG3 ARG 21 16.157 -15.040 12.772 153 HD2 ARG 21 HD2 ARG 21 17.231 -13.336 13.784 154 HD3 ARG 21 HD3 ARG 21 16.265 -12.351 12.685 155 HE ARG 21 HE ARG 21 15.198 -11.501 14.505 156 HH11 ARG 21 HH11 ARG 21 16.544 -14.593 15.368 157 HH12 ARG 21 HH12 ARG 21 16.067 -14.483 17.031 158 HH21 ARG 21 HH21 ARG 21 14.566 -11.344 16.691 159 HH22 ARG 21 HH22 ARG 21 14.942 -12.635 17.782 160 H GLY 22 H GLY 22 15.860 -12.341 9.199 161 HA2 GLY 22 HA2 GLY 22 15.078 -11.484 7.143 162 HA3 GLY 22 HA3 GLY 22 13.607 -12.425 7.337 163 H SER 23 H SER 23 14.266 -10.952 10.233 164 HA SER 23 HA SER 23 12.201 -8.956 9.751 165 HB2 SER 23 HB2 SER 23 13.034 -8.774 12.422 166 HB3 SER 23 HB3 SER 23 11.603 -9.606 11.814 167 HG SER 23 HG SER 23 12.830 -11.064 12.978 168 HA PRO 24 HA PRO 24 14.780 -5.409 9.677 169 HB2 PRO 24 HB2 PRO 24 13.415 -3.635 11.213 170 HB3 PRO 24 HB3 PRO 24 12.874 -4.129 9.605 171 HG2 PRO 24 HG2 PRO 24 11.965 -5.095 12.289 172 HG3 PRO 24 HG3 PRO 24 10.998 -4.698 10.856 173 HD2 PRO 24 HD2 PRO 24 11.621 -7.245 11.534 174 HD3 PRO 24 HD3 PRO 24 11.432 -6.725 9.848 175 H ALA 25 H ALA 25 16.309 -4.187 10.830 176 HA ALA 25 HA ALA 25 16.982 -5.300 13.451 177 HB1 ALA 25 HB1 ALA 25 19.192 -4.569 13.089 178 HB2 ALA 25 HB2 ALA 25 18.647 -5.212 11.540 179 HB3 ALA 25 HB3 ALA 25 18.702 -3.469 11.801 180 H ILE 26 H ILE 26 16.909 -4.154 15.292 181 HA ILE 26 HA ILE 26 16.059 -1.345 15.101 182 HB ILE 26 HB ILE 26 15.432 -3.533 16.994 183 HG12 ILE 26 HG12 ILE 26 13.964 -2.261 15.197 184 HG13 ILE 26 HG13 ILE 26 13.265 -2.803 16.720 185 HG21 ILE 26 HG21 ILE 26 16.540 -2.149 18.556 186 HG22 ILE 26 HG22 ILE 26 15.842 -0.685 17.865 187 HG23 ILE 26 HG23 ILE 26 14.818 -1.819 18.747 188 HD11 ILE 26 HD11 ILE 26 12.575 -0.536 16.152 189 HD12 ILE 26 HD12 ILE 26 13.520 -0.571 17.642 190 HD13 ILE 26 HD13 ILE 26 14.262 -0.023 16.139 191 H ASN 27 H ASN 27 17.157 0.259 16.137 192 HA ASN 27 HA ASN 27 18.872 1.351 17.158 193 HB2 ASN 27 HB2 ASN 27 19.358 -1.252 18.622 194 HB3 ASN 27 HB3 ASN 27 19.897 0.352 19.113 195 HD21 ASN 27 HD21 ASN 27 17.525 1.747 18.488 196 HD22 ASN 27 HD22 ASN 27 16.316 1.271 19.626 197 H VAL 28 H VAL 28 19.549 0.745 14.735 198 HA VAL 28 HA VAL 28 22.175 -0.586 14.864 199 HB VAL 28 HB VAL 28 20.400 -0.130 12.462 200 HG11 VAL 28 HG11 VAL 28 22.569 -0.042 11.614 201 HG12 VAL 28 HG12 VAL 28 23.166 -1.250 12.754 202 HG13 VAL 28 HG13 VAL 28 22.119 -1.735 11.420 203 HG21 VAL 28 HG21 VAL 28 19.381 -1.988 13.151 204 HG22 VAL 28 HG22 VAL 28 20.874 -2.844 12.766 205 HG23 VAL 28 HG23 VAL 28 20.587 -2.269 14.409 206 H ALA 29 H ALA 29 23.768 0.843 15.055 207 HA ALA 29 HA ALA 29 23.599 3.576 14.468 208 HB1 ALA 29 HB1 ALA 29 25.832 3.723 15.074 209 HB2 ALA 29 HB2 ALA 29 25.286 2.287 15.941 210 HB3 ALA 29 HB3 ALA 29 26.212 2.117 14.450 211 H VAL 30 H VAL 30 23.602 4.624 12.598 212 HA VAL 30 HA VAL 30 25.026 3.454 10.307 213 HB VAL 30 HB VAL 30 22.256 4.658 10.212 214 HG11 VAL 30 HG11 VAL 30 22.998 3.426 7.768 215 HG12 VAL 30 HG12 VAL 30 22.620 5.123 8.072 216 HG13 VAL 30 HG13 VAL 30 24.282 4.548 8.220 217 HG21 VAL 30 HG21 VAL 30 22.495 2.290 11.052 218 HG22 VAL 30 HG22 VAL 30 21.467 2.498 9.633 219 HG23 VAL 30 HG23 VAL 30 23.106 1.872 9.451 220 H HIS 31 H HIS 31 26.342 4.843 9.319 221 HA HIS 31 HA HIS 31 25.889 7.727 9.713 222 HB2 HIS 31 HB2 HIS 31 28.633 6.501 9.492 223 HB3 HIS 31 HB3 HIS 31 28.199 8.115 10.049 224 HD1 HIS 31 HD1 HIS 31 29.670 5.445 11.485 225 HD2 HIS 31 HD2 HIS 31 26.117 7.388 12.416 226 HE1 HIS 31 HE1 HIS 31 29.214 4.896 13.896 227 H VAL 32 H VAL 32 25.465 8.682 7.845 228 HA VAL 32 HA VAL 32 26.394 7.467 5.353 229 HB VAL 32 HB VAL 32 24.555 9.840 5.612 230 HG11 VAL 32 HG11 VAL 32 25.532 8.139 3.427 231 HG12 VAL 32 HG12 VAL 32 23.797 8.459 3.406 232 HG13 VAL 32 HG13 VAL 32 24.942 9.800 3.398 233 HG21 VAL 32 HG21 VAL 32 24.014 6.948 6.012 234 HG22 VAL 32 HG22 VAL 32 23.260 8.355 6.763 235 HG23 VAL 32 HG23 VAL 32 22.823 7.893 5.118 236 H PHE 33 H PHE 33 27.822 8.403 3.989 237 HA PHE 33 HA PHE 33 28.801 11.096 4.651 238 HB2 PHE 33 HB2 PHE 33 30.397 8.588 4.193 239 HB3 PHE 33 HB3 PHE 33 31.097 10.176 3.891 240 HD1 PHE 33 HD1 PHE 33 29.431 8.149 6.519 241 HD2 PHE 33 HD2 PHE 33 32.035 11.397 5.629 242 HE1 PHE 33 HE1 PHE 33 29.990 8.351 8.906 243 HE2 PHE 33 HE2 PHE 33 32.599 11.603 8.015 244 HZ PHE 33 HZ PHE 33 31.575 10.079 9.657 245 H ARG 34 H ARG 34 30.049 12.087 2.839 246 HA ARG 34 HA ARG 34 29.128 11.133 0.213 247 HB2 ARG 34 HB2 ARG 34 27.699 12.996 0.930 248 HB3 ARG 34 HB3 ARG 34 29.122 14.000 1.172 249 HG2 ARG 34 HG2 ARG 34 28.823 12.811 -1.508 250 HG3 ARG 34 HG3 ARG 34 27.632 14.032 -1.057 251 HD2 ARG 34 HD2 ARG 34 29.568 15.502 -0.386 252 HD3 ARG 34 HD3 ARG 34 30.627 14.315 -1.148 253 HE ARG 34 HE ARG 34 29.082 16.300 -2.461 254 HH11 ARG 34 HH11 ARG 34 30.224 13.027 -2.781 255 HH12 ARG 34 HH12 ARG 34 30.199 13.049 -4.513 256 HH21 ARG 34 HH21 ARG 34 29.045 16.341 -4.742 257 HH22 ARG 34 HH22 ARG 34 29.529 14.935 -5.627 258 H LYS 35 H LYS 35 30.526 11.436 -1.497 259 HA LYS 35 HA LYS 35 33.275 11.505 -0.931 260 HB2 LYS 35 HB2 LYS 35 32.730 10.373 -2.891 261 HB3 LYS 35 HB3 LYS 35 31.653 11.647 -3.446 262 HG2 LYS 35 HG2 LYS 35 33.644 11.574 -4.810 263 HG3 LYS 35 HG3 LYS 35 33.592 13.080 -3.890 264 HD2 LYS 35 HD2 LYS 35 35.825 12.264 -3.775 265 HD3 LYS 35 HD3 LYS 35 35.088 11.980 -2.198 266 HE2 LYS 35 HE2 LYS 35 35.888 9.897 -2.441 267 HE3 LYS 35 HE3 LYS 35 34.493 9.666 -3.494 268 HZ1 LYS 35 HZ1 LYS 35 35.767 9.781 -5.366 269 HZ2 LYS 35 HZ2 LYS 35 36.892 9.093 -4.307 270 HZ3 LYS 35 HZ3 LYS 35 36.959 10.748 -4.653 271 H ALA 36 H ALA 36 34.277 13.240 -0.134 272 HA ALA 36 HA ALA 36 33.444 15.916 -0.637 273 HB1 ALA 36 HB1 ALA 36 34.943 14.728 1.291 274 HB2 ALA 36 HB2 ALA 36 36.184 15.543 0.337 275 HB3 ALA 36 HB3 ALA 36 34.848 16.469 1.023 276 H ALA 37 H ALA 37 34.674 17.581 -1.683 277 HA ALA 37 HA ALA 37 35.503 16.943 -4.275 278 HB1 ALA 37 HB1 ALA 37 36.359 19.431 -2.825 279 HB2 ALA 37 HB2 ALA 37 36.024 19.219 -4.544 280 HB3 ALA 37 HB3 ALA 37 34.702 19.185 -3.377 281 H ASP 38 H ASP 38 37.215 16.846 -1.301 282 HA ASP 38 HA ASP 38 39.824 16.870 -2.611 283 HB2 ASP 38 HB2 ASP 38 38.853 17.149 0.176 284 HB3 ASP 38 HB3 ASP 38 40.416 16.366 -0.031 285 H ASP 39 H ASP 39 37.658 14.688 -2.727 286 HA ASP 39 HA ASP 39 37.627 12.426 -2.962 287 HB2 ASP 39 HB2 ASP 39 40.584 12.318 -2.445 288 HB3 ASP 39 HB3 ASP 39 39.609 11.309 -3.509 289 H THR 40 H THR 40 37.235 13.626 -0.386 290 HA THR 40 HA THR 40 38.213 11.468 1.369 291 HB THR 40 HB THR 40 38.248 12.931 3.216 292 HG1 THR 40 HG1 THR 40 37.362 15.054 3.084 293 HG21 THR 40 HG21 THR 40 40.139 13.282 1.718 294 HG22 THR 40 HG22 THR 40 39.684 14.796 2.500 295 HG23 THR 40 HG23 THR 40 39.225 14.495 0.824 296 H TRP 41 H TRP 41 36.649 11.591 3.487 297 HA TRP 41 HA TRP 41 33.951 11.123 2.410 298 HB2 TRP 41 HB2 TRP 41 35.465 9.879 4.694 299 HB3 TRP 41 HB3 TRP 41 33.711 9.765 4.593 300 HD1 TRP 41 HD1 TRP 41 35.973 9.494 1.500 301 HE1 TRP 41 HE1 TRP 41 35.722 7.129 0.516 302 HE3 TRP 41 HE3 TRP 41 33.074 7.398 5.153 303 HZ2 TRP 41 HZ2 TRP 41 34.461 4.697 1.198 304 HZ3 TRP 41 HZ3 TRP 41 32.390 5.047 4.911 305 HH2 TRP 41 HH2 TRP 41 33.069 3.726 2.974 306 H GLU 42 H GLU 42 32.735 12.881 2.736 307 HA GLU 42 HA GLU 42 33.039 14.417 5.203 308 HB2 GLU 42 HB2 GLU 42 31.582 14.940 2.617 309 HB3 GLU 42 HB3 GLU 42 31.370 15.957 4.035 310 HG2 GLU 42 HG2 GLU 42 34.151 15.459 3.199 311 HG3 GLU 42 HG3 GLU 42 33.170 16.439 2.112 312 HA PRO 43 HA PRO 43 29.480 12.741 7.156 313 HB2 PRO 43 HB2 PRO 43 28.682 14.876 8.631 314 HB3 PRO 43 HB3 PRO 43 30.116 13.919 9.024 315 HG2 PRO 43 HG2 PRO 43 29.922 16.542 7.595 316 HG3 PRO 43 HG3 PRO 43 31.074 16.030 8.841 317 HD2 PRO 43 HD2 PRO 43 31.695 16.056 6.206 318 HD3 PRO 43 HD3 PRO 43 32.379 14.871 7.336 319 H PHE 44 H PHE 44 27.709 12.315 5.990 320 HA PHE 44 HA PHE 44 26.227 14.537 4.775 321 HB2 PHE 44 HB2 PHE 44 26.929 12.667 3.298 322 HB3 PHE 44 HB3 PHE 44 25.957 11.566 4.269 323 HD1 PHE 44 HD2 PHE 44 23.481 11.837 4.319 324 HD2 PHE 44 HD1 PHE 44 25.959 14.007 1.622 325 HE1 PHE 44 HE2 PHE 44 21.518 12.336 2.922 326 HE2 PHE 44 HE1 PHE 44 23.999 14.510 0.222 327 HZ PHE 44 HZ PHE 44 21.775 13.675 0.872 328 H ALA 45 H ALA 45 25.845 11.747 6.900 329 HA ALA 45 HA ALA 45 23.795 12.972 8.411 330 HB1 ALA 45 HB1 ALA 45 22.723 12.137 6.128 331 HB2 ALA 45 HB2 ALA 45 22.644 10.618 7.023 332 HB3 ALA 45 HB3 ALA 45 21.853 12.060 7.660 333 H SER 46 H SER 46 22.655 11.192 9.827 334 HA SER 46 HA SER 46 23.997 8.741 10.264 335 HB2 SER 46 HB2 SER 46 25.849 9.796 11.187 336 HB3 SER 46 HB3 SER 46 24.892 11.120 11.852 337 HG SER 46 HG SER 46 25.730 9.418 13.347 338 H GLY 47 H GLY 47 23.074 7.514 11.972 339 HA2 GLY 47 HA2 GLY 47 21.328 8.359 13.927 340 HA3 GLY 47 HA3 GLY 47 20.341 8.169 12.486 341 H LYS 48 H LYS 48 19.345 6.585 14.088 342 HA LYS 48 HA LYS 48 20.667 3.968 13.777 343 HB2 LYS 48 HB2 LYS 48 19.435 5.252 16.128 344 HB3 LYS 48 HB3 LYS 48 18.969 3.575 15.873 345 HG2 LYS 48 HG2 LYS 48 21.305 2.905 15.883 346 HG3 LYS 48 HG3 LYS 48 21.798 4.588 16.088 347 HD2 LYS 48 HD2 LYS 48 20.114 2.998 18.025 348 HD3 LYS 48 HD3 LYS 48 21.832 3.364 18.214 349 HE2 LYS 48 HE2 LYS 48 20.757 5.840 17.779 350 HE3 LYS 48 HE3 LYS 48 19.480 5.041 18.692 351 HZ1 LYS 48 HZ1 LYS 48 20.742 5.835 20.387 352 HZ2 LYS 48 HZ2 LYS 48 22.192 5.750 19.522 353 HZ3 LYS 48 HZ3 LYS 48 21.514 4.345 20.176 354 H THR 49 H THR 49 19.547 2.433 12.750 355 HA THR 49 HA THR 49 17.229 2.951 11.320 356 HB THR 49 HB THR 49 17.085 0.584 10.864 357 HG1 THR 49 HG1 THR 49 17.780 -0.874 12.249 358 HG21 THR 49 HG21 THR 49 18.804 1.233 9.537 359 HG22 THR 49 HG22 THR 49 19.739 0.194 10.614 360 HG23 THR 49 HG23 THR 49 19.710 1.937 10.876 361 H SER 50 H SER 50 15.178 1.554 11.532 362 HA SER 50 HA SER 50 14.310 1.491 14.345 363 HB2 SER 50 HB2 SER 50 13.414 3.486 13.148 364 HB3 SER 50 HB3 SER 50 12.621 2.404 12.003 365 HG SER 50 HG SER 50 12.179 2.430 14.808 366 H GLU 51 H GLU 51 12.096 0.290 14.474 367 HA GLU 51 HA GLU 51 12.559 -2.373 13.605 368 HB2 GLU 51 HB2 GLU 51 10.215 -2.749 14.528 369 HB3 GLU 51 HB3 GLU 51 11.418 -2.137 15.656 370 HG2 GLU 51 HG2 GLU 51 10.191 -0.352 16.091 371 HG3 GLU 51 HG3 GLU 51 10.071 0.048 14.379 372 H SER 52 H SER 52 11.344 0.266 11.983 373 HA SER 52 HA SER 52 9.598 -1.343 10.258 374 HB2 SER 52 HB2 SER 52 8.608 0.729 11.085 375 HB3 SER 52 HB3 SER 52 9.958 1.658 10.438 376 HG SER 52 HG SER 52 9.270 1.255 8.398 377 H GLY 53 H GLY 53 12.752 -0.652 10.435 378 HA2 GLY 53 HA2 GLY 53 14.442 -0.920 8.887 379 HA3 GLY 53 HA3 GLY 53 13.213 -1.230 7.669 380 H GLU 54 H GLU 54 12.748 1.665 9.392 381 HA GLU 54 HA GLU 54 14.125 3.222 7.312 382 HB2 GLU 54 HB2 GLU 54 11.394 3.942 8.366 383 HB3 GLU 54 HB3 GLU 54 12.247 4.657 7.006 384 HG2 GLU 54 HG2 GLU 54 12.039 2.548 5.777 385 HG3 GLU 54 HG3 GLU 54 11.154 1.856 7.135 386 H LEU 55 H LEU 55 15.342 4.825 8.082 387 HA LEU 55 HA LEU 55 15.513 5.261 10.908 388 HB2 LEU 55 HB2 LEU 55 17.234 5.526 8.783 389 HB3 LEU 55 HB3 LEU 55 16.876 7.200 9.203 390 HG LEU 55 HG LEU 55 17.624 5.425 11.444 391 HD11 LEU 55 HD11 LEU 55 19.120 5.021 9.279 392 HD12 LEU 55 HD12 LEU 55 19.797 5.067 10.907 393 HD13 LEU 55 HD13 LEU 55 19.895 6.491 9.872 394 HD21 LEU 55 HD21 LEU 55 17.233 8.091 11.140 395 HD22 LEU 55 HD22 LEU 55 18.983 7.984 10.954 396 HD23 LEU 55 HD23 LEU 55 18.212 7.365 12.415 397 H HIS 56 H HIS 56 15.488 7.460 11.861 398 HA HIS 56 HA HIS 56 13.027 8.679 11.665 399 HB2 HIS 56 HB2 HIS 56 15.682 9.649 12.682 400 HB3 HIS 56 HB3 HIS 56 14.279 10.714 12.691 401 HD1 HIS 56 HD1 HIS 56 15.964 8.269 14.713 402 HD2 HIS 56 HD2 HIS 56 12.022 9.475 14.197 403 HE1 HIS 56 HE1 HIS 56 14.737 7.445 16.748 404 H GLY 57 H GLY 57 15.994 10.370 10.646 405 HA2 GLY 57 HA2 GLY 57 14.929 10.991 8.051 406 HA3 GLY 57 HA3 GLY 57 14.850 12.356 9.155 407 H LEU 58 H LEU 58 16.901 10.333 7.238 408 HA LEU 58 HA LEU 58 19.312 11.698 8.150 409 HB2 LEU 58 HB2 LEU 58 18.825 9.387 6.294 410 HB3 LEU 58 HB3 LEU 58 20.407 10.141 6.467 411 HG LEU 58 HG LEU 58 18.856 8.731 8.637 412 HD11 LEU 58 HD11 LEU 58 21.202 7.424 8.394 413 HD12 LEU 58 HD12 LEU 58 20.929 7.904 6.720 414 HD13 LEU 58 HD13 LEU 58 19.717 6.947 7.572 415 HD21 LEU 58 HD21 LEU 58 20.932 10.692 8.787 416 HD22 LEU 58 HD22 LEU 58 21.546 9.140 9.355 417 HD23 LEU 58 HD23 LEU 58 20.106 9.842 10.093 418 H THR 59 H THR 59 16.970 11.919 5.695 419 HA THR 59 HA THR 59 18.396 12.861 3.507 420 HB THR 59 HB THR 59 16.373 13.884 2.730 421 HG1 THR 59 HG1 THR 59 14.577 14.102 4.229 422 HG21 THR 59 HG21 THR 59 14.842 12.064 2.853 423 HG22 THR 59 HG22 THR 59 15.501 11.529 4.400 424 HG23 THR 59 HG23 THR 59 16.461 11.369 2.929 425 H THR 60 H THR 60 19.253 14.792 2.911 426 HA THR 60 HA THR 60 18.855 17.138 4.594 427 HB THR 60 HB THR 60 21.346 17.549 4.658 428 HG1 THR 60 HG1 THR 60 22.602 15.553 4.490 429 HG21 THR 60 HG21 THR 60 21.713 16.163 6.615 430 HG22 THR 60 HG22 THR 60 20.387 15.101 6.144 431 HG23 THR 60 HG23 THR 60 20.057 16.768 6.618 432 H GLU 61 H GLU 61 20.031 19.072 3.633 433 HA GLU 61 HA GLU 61 19.250 19.371 0.937 434 HB2 GLU 61 HB2 GLU 61 20.331 21.574 1.071 435 HB3 GLU 61 HB3 GLU 61 19.313 21.264 2.470 436 HG2 GLU 61 HG2 GLU 61 21.221 20.793 3.834 437 HG3 GLU 61 HG3 GLU 61 22.295 20.881 2.439 438 H GLU 62 H GLU 62 22.022 18.013 2.321 439 HA GLU 62 HA GLU 62 23.915 18.683 0.297 440 HB2 GLU 62 HB2 GLU 62 23.831 16.988 2.686 441 HB3 GLU 62 HB3 GLU 62 24.826 16.331 1.394 442 HG2 GLU 62 HG2 GLU 62 25.109 19.016 2.717 443 HG3 GLU 62 HG3 GLU 62 26.200 17.638 2.848 444 H GLU 63 H GLU 63 21.216 16.728 0.258 445 HA GLU 63 HA GLU 63 22.106 14.527 -1.277 446 HB2 GLU 63 HB2 GLU 63 19.805 14.039 -1.652 447 HB3 GLU 63 HB3 GLU 63 19.930 14.684 -0.021 448 HG2 GLU 63 HG2 GLU 63 19.148 16.851 -0.798 449 HG3 GLU 63 HG3 GLU 63 19.055 16.234 -2.447 450 H PHE 64 H PHE 64 21.698 17.800 -2.052 451 HA PHE 64 HA PHE 64 21.107 17.413 -4.849 452 HB2 PHE 64 HB2 PHE 64 20.443 19.439 -3.432 453 HB3 PHE 64 HB3 PHE 64 22.119 19.954 -3.584 454 HD1 PHE 64 HD2 PHE 64 19.443 18.655 -5.844 455 HD2 PHE 64 HD1 PHE 64 22.507 21.536 -5.185 456 HE1 PHE 64 HE2 PHE 64 18.921 19.699 -8.009 457 HE2 PHE 64 HE1 PHE 64 21.988 22.586 -7.349 458 HZ PHE 64 HZ PHE 64 20.194 21.667 -8.765 459 H VAL 65 H VAL 65 23.147 15.853 -4.635 460 HA VAL 65 HA VAL 65 25.404 17.365 -5.767 461 HB VAL 65 HB VAL 65 26.956 15.725 -4.709 462 HG11 VAL 65 HG11 VAL 65 26.976 16.782 -2.540 463 HG12 VAL 65 HG12 VAL 65 26.542 17.976 -3.766 464 HG13 VAL 65 HG13 VAL 65 25.295 17.280 -2.730 465 HG21 VAL 65 HG21 VAL 65 24.627 14.980 -2.954 466 HG22 VAL 65 HG22 VAL 65 25.149 14.004 -4.328 467 HG23 VAL 65 HG23 VAL 65 26.244 14.275 -2.972 468 H GLU 66 H GLU 66 27.050 15.488 -6.611 469 HA GLU 66 HA GLU 66 26.024 14.533 -8.964 470 HB2 GLU 66 HB2 GLU 66 28.293 13.466 -7.287 471 HB3 GLU 66 HB3 GLU 66 27.934 12.863 -8.899 472 HG2 GLU 66 HG2 GLU 66 28.295 15.789 -8.525 473 HG3 GLU 66 HG3 GLU 66 29.716 14.748 -8.502 474 H GLY 67 H GLY 67 26.239 12.811 -5.868 475 HA2 GLY 67 HA2 GLY 67 24.094 11.447 -5.535 476 HA3 GLY 67 HA3 GLY 67 24.592 10.658 -7.024 477 H ILE 68 H ILE 68 27.363 11.428 -5.440 478 HA ILE 68 HA ILE 68 27.876 8.712 -4.715 479 HB ILE 68 HB ILE 68 29.568 11.100 -3.993 480 HG12 ILE 68 HG12 ILE 68 29.680 9.466 -6.537 481 HG13 ILE 68 HG13 ILE 68 28.987 11.080 -6.421 482 HG21 ILE 68 HG21 ILE 68 29.830 8.253 -3.679 483 HG22 ILE 68 HG22 ILE 68 31.132 8.888 -4.686 484 HG23 ILE 68 HG23 ILE 68 30.863 9.547 -3.072 485 HD11 ILE 68 HD11 ILE 68 31.359 10.875 -7.306 486 HD12 ILE 68 HD12 ILE 68 31.071 12.064 -6.035 487 HD13 ILE 68 HD13 ILE 68 31.825 10.519 -5.643 488 H TYR 69 H TYR 69 27.130 7.801 -2.924 489 HA TYR 69 HA TYR 69 27.341 9.264 -0.398 490 HB2 TYR 69 HB2 TYR 69 24.857 7.710 -1.126 491 HB3 TYR 69 HB3 TYR 69 25.116 8.714 0.295 492 HD1 TYR 69 HD2 TYR 69 25.798 11.243 -0.334 493 HD2 TYR 69 HD1 TYR 69 23.559 8.600 -2.805 494 HE1 TYR 69 HE2 TYR 69 24.839 13.173 -1.519 495 HE2 TYR 69 HE1 TYR 69 22.594 10.523 -3.998 496 HH TYR 69 HH TYR 69 22.644 12.734 -4.270 497 H LYS 70 H LYS 70 28.320 8.071 1.089 498 HA LYS 70 HA LYS 70 28.306 5.141 0.766 499 HB2 LYS 70 HB2 LYS 70 30.490 5.212 2.017 500 HB3 LYS 70 HB3 LYS 70 30.529 5.926 0.411 501 HG2 LYS 70 HG2 LYS 70 29.874 8.013 2.160 502 HG3 LYS 70 HG3 LYS 70 31.169 7.104 2.943 503 HD2 LYS 70 HD2 LYS 70 32.173 8.797 1.584 504 HD3 LYS 70 HD3 LYS 70 32.454 7.239 0.804 505 HE2 LYS 70 HE2 LYS 70 29.981 8.551 -0.037 506 HE3 LYS 70 HE3 LYS 70 31.434 9.475 -0.412 507 HZ1 LYS 70 HZ1 LYS 70 32.041 8.020 -1.973 508 HZ2 LYS 70 HZ2 LYS 70 30.441 7.475 -1.920 509 HZ3 LYS 70 HZ3 LYS 70 31.638 6.671 -1.037 510 H VAL 71 H VAL 71 26.826 4.380 2.153 511 HA VAL 71 HA VAL 71 26.564 5.574 4.805 512 HB VAL 71 HB VAL 71 24.909 3.483 3.390 513 HG11 VAL 71 HG11 VAL 71 24.874 2.976 5.735 514 HG12 VAL 71 HG12 VAL 71 24.590 4.669 6.143 515 HG13 VAL 71 HG13 VAL 71 23.344 3.742 5.307 516 HG21 VAL 71 HG21 VAL 71 24.921 6.251 3.165 517 HG22 VAL 71 HG22 VAL 71 23.638 5.156 2.646 518 HG23 VAL 71 HG23 VAL 71 23.569 5.902 4.243 519 H GLU 72 H GLU 72 27.349 4.677 6.603 520 HA GLU 72 HA GLU 72 28.490 1.969 6.401 521 HB2 GLU 72 HB2 GLU 72 30.335 3.178 6.965 522 HB3 GLU 72 HB3 GLU 72 29.397 4.460 7.718 523 HG2 GLU 72 HG2 GLU 72 29.280 3.368 9.748 524 HG3 GLU 72 HG3 GLU 72 29.597 1.788 9.032 525 H ILE 73 H ILE 73 27.987 0.433 7.900 526 HA ILE 73 HA ILE 73 26.049 1.189 9.986 527 HB ILE 73 HB ILE 73 26.020 -1.305 8.284 528 HG12 ILE 73 HG12 ILE 73 23.544 0.138 8.380 529 HG13 ILE 73 HG13 ILE 73 24.837 1.249 7.942 530 HG21 ILE 73 HG21 ILE 73 23.718 -1.386 9.701 531 HG22 ILE 73 HG22 ILE 73 25.191 -2.243 10.152 532 HG23 ILE 73 HG23 ILE 73 24.815 -0.687 10.892 533 HD11 ILE 73 HD11 ILE 73 25.446 -0.108 6.069 534 HD12 ILE 73 HD12 ILE 73 24.308 -1.366 6.556 535 HD13 ILE 73 HD13 ILE 73 23.710 0.200 6.008 536 H ASP 74 H ASP 74 26.406 0.413 11.990 537 HA ASP 74 HA ASP 74 28.803 -1.238 12.369 538 HB2 ASP 74 HB2 ASP 74 28.287 1.109 13.518 539 HB3 ASP 74 HB3 ASP 74 27.436 0.079 14.666 540 H THR 75 H THR 75 28.192 -3.328 12.280 541 HA THR 75 HA THR 75 25.753 -4.203 13.606 542 HB THR 75 HB THR 75 26.190 -6.387 12.624 543 HG1 THR 75 HG1 THR 75 28.096 -6.484 11.170 544 HG21 THR 75 HG21 THR 75 26.217 -5.731 10.208 545 HG22 THR 75 HG22 THR 75 26.570 -4.079 10.716 546 HG23 THR 75 HG23 THR 75 25.051 -4.842 11.186 547 H LYS 76 H LYS 76 29.225 -4.371 14.001 548 HA LYS 76 HA LYS 76 29.443 -6.427 15.858 549 HB2 LYS 76 HB2 LYS 76 31.569 -5.555 16.405 550 HB3 LYS 76 HB3 LYS 76 31.310 -5.125 14.720 551 HG2 LYS 76 HG2 LYS 76 32.056 -3.125 15.454 552 HG3 LYS 76 HG3 LYS 76 30.350 -2.914 15.856 553 HD2 LYS 76 HD2 LYS 76 31.117 -4.066 18.114 554 HD3 LYS 76 HD3 LYS 76 32.682 -3.403 17.636 555 HE2 LYS 76 HE2 LYS 76 30.571 -1.461 17.299 556 HE3 LYS 76 HE3 LYS 76 30.615 -2.073 18.952 557 HZ1 LYS 76 HZ1 LYS 76 33.126 -1.628 18.759 558 HZ2 LYS 76 HZ2 LYS 76 32.088 -0.314 19.002 559 HZ3 LYS 76 HZ3 LYS 76 32.706 -0.629 17.459 560 H SER 77 H SER 77 28.394 -3.114 16.268 561 HA SER 77 HA SER 77 28.336 -3.357 19.166 562 HB2 SER 77 HB2 SER 77 27.101 -0.986 18.641 563 HB3 SER 77 HB3 SER 77 28.844 -1.174 18.823 564 HG SER 77 HG SER 77 28.173 -0.063 16.879 565 H TYR 78 H TYR 78 26.299 -3.985 16.537 566 HA TYR 78 HA TYR 78 23.816 -3.527 17.950 567 HB2 TYR 78 HB2 TYR 78 23.643 -3.141 15.636 568 HB3 TYR 78 HB3 TYR 78 24.518 -4.614 15.233 569 HD1 TYR 78 HD1 TYR 78 21.324 -3.399 16.706 570 HD2 TYR 78 HD2 TYR 78 23.352 -6.577 14.733 571 HE1 TYR 78 HE1 TYR 78 19.186 -4.584 16.430 572 HE2 TYR 78 HE2 TYR 78 21.220 -7.771 14.452 573 HH TYR 78 HH TYR 78 18.183 -6.432 15.719 574 H TRP 79 H TRP 79 25.893 -6.230 17.104 575 HA TRP 79 HA TRP 79 24.049 -8.236 18.000 576 HB2 TRP 79 HB2 TRP 79 26.983 -8.315 17.292 577 HB3 TRP 79 HB3 TRP 79 26.087 -9.736 17.818 578 HD1 TRP 79 HD1 TRP 79 23.461 -9.510 16.178 579 HE1 TRP 79 HE1 TRP 79 23.476 -9.725 13.613 580 HE3 TRP 79 HE3 TRP 79 28.364 -8.363 15.296 581 HZ2 TRP 79 HZ2 TRP 79 25.323 -9.447 11.496 582 HZ3 TRP 79 HZ3 TRP 79 29.176 -8.361 12.974 583 HH2 TRP 79 HH2 TRP 79 27.685 -8.892 11.115 584 H LYS 80 H LYS 80 26.254 -6.136 19.525 585 HA LYS 80 HA LYS 80 26.683 -7.831 21.839 586 HB2 LYS 80 HB2 LYS 80 28.165 -6.195 22.610 587 HB3 LYS 80 HB3 LYS 80 28.352 -6.129 20.862 588 HG2 LYS 80 HG2 LYS 80 28.053 -3.936 21.066 589 HG3 LYS 80 HG3 LYS 80 26.349 -4.307 21.336 590 HD2 LYS 80 HD2 LYS 80 26.951 -2.929 23.137 591 HD3 LYS 80 HD3 LYS 80 26.975 -4.565 23.800 592 HE2 LYS 80 HE2 LYS 80 28.971 -3.810 24.601 593 HE3 LYS 80 HE3 LYS 80 29.509 -4.438 23.043 594 HZ1 LYS 80 HZ1 LYS 80 29.012 -2.045 22.246 595 HZ2 LYS 80 HZ2 LYS 80 30.447 -2.355 23.087 596 HZ3 LYS 80 HZ3 LYS 80 29.136 -1.644 23.885 597 H ALA 81 H ALA 81 24.380 -5.564 20.762 598 HA ALA 81 HA ALA 81 23.510 -4.779 23.414 599 HB1 ALA 81 HB1 ALA 81 23.032 -3.887 20.695 600 HB2 ALA 81 HB2 ALA 81 21.547 -3.978 21.643 601 HB3 ALA 81 HB3 ALA 81 22.901 -3.003 22.215 602 H LEU 82 H LEU 82 22.289 -6.753 20.728 603 HA LEU 82 HA LEU 82 20.059 -7.672 22.362 604 HB2 LEU 82 HB2 LEU 82 20.822 -8.300 19.514 605 HB3 LEU 82 HB3 LEU 82 19.362 -8.868 20.322 606 HG LEU 82 HG LEU 82 18.604 -7.093 19.037 607 HD11 LEU 82 HD11 LEU 82 19.299 -5.728 21.628 608 HD12 LEU 82 HD12 LEU 82 18.003 -6.910 21.456 609 HD13 LEU 82 HD13 LEU 82 17.935 -5.391 20.563 610 HD21 LEU 82 HD21 LEU 82 19.741 -5.053 18.634 611 HD22 LEU 82 HD22 LEU 82 20.932 -6.339 18.444 612 HD23 LEU 82 HD23 LEU 82 20.909 -5.370 19.918 613 H GLY 83 H GLY 83 23.166 -8.429 22.336 614 HA2 GLY 83 HA2 GLY 83 24.396 -10.279 22.910 615 HA3 GLY 83 HA3 GLY 83 22.908 -10.885 23.622 616 H ILE 84 H ILE 84 23.785 -10.244 20.237 617 HA ILE 84 HA ILE 84 22.769 -12.871 19.510 618 HB ILE 84 HB ILE 84 23.908 -10.802 17.639 619 HG12 ILE 84 HG12 ILE 84 22.137 -9.753 18.962 620 HG13 ILE 84 HG13 ILE 84 21.596 -10.016 17.307 621 HG21 ILE 84 HG21 ILE 84 22.005 -12.038 16.242 622 HG22 ILE 84 HG22 ILE 84 23.660 -12.639 16.331 623 HG23 ILE 84 HG23 ILE 84 22.411 -13.340 17.359 624 HD11 ILE 84 HD11 ILE 84 19.834 -10.557 18.854 625 HD12 ILE 84 HD12 ILE 84 20.391 -12.024 18.050 626 HD13 ILE 84 HD13 ILE 84 20.887 -11.684 19.707 627 H SER 85 H SER 85 23.980 -14.323 18.148 628 HA SER 85 HA SER 85 26.437 -15.065 19.117 629 HB2 SER 85 HB2 SER 85 24.950 -15.637 16.603 630 HB3 SER 85 HB3 SER 85 26.653 -16.087 16.653 631 HG SER 85 HG SER 85 26.222 -17.339 18.481 632 HA PRO 86 HA PRO 86 29.516 -12.415 17.462 633 HB2 PRO 86 HB2 PRO 86 31.551 -14.147 16.985 634 HB3 PRO 86 HB3 PRO 86 31.061 -13.665 18.614 635 HG2 PRO 86 HG2 PRO 86 30.383 -16.150 17.088 636 HG3 PRO 86 HG3 PRO 86 30.846 -15.974 18.791 637 HD2 PRO 86 HD2 PRO 86 28.273 -16.283 18.005 638 HD3 PRO 86 HD3 PRO 86 28.728 -15.326 19.430 639 H MET 87 H MET 87 29.012 -11.555 15.514 640 HA MET 87 HA MET 87 29.641 -13.169 13.132 641 HB2 MET 87 HB2 MET 87 27.243 -11.540 13.763 642 HB3 MET 87 HB3 MET 87 27.854 -11.439 12.117 643 HG2 MET 87 HG2 MET 87 26.250 -13.130 12.061 644 HG3 MET 87 HG3 MET 87 27.794 -13.977 12.105 645 HE1 MET 87 HE1 MET 87 26.932 -16.469 13.332 646 HE2 MET 87 HE2 MET 87 28.446 -15.575 13.473 647 HE3 MET 87 HE3 MET 87 27.665 -16.222 14.916 648 H HIS 88 H HIS 88 30.222 -11.867 11.218 649 HA HIS 88 HA HIS 88 31.123 -9.155 11.710 650 HB2 HIS 88 HB2 HIS 88 33.000 -11.461 11.283 651 HB3 HIS 88 HB3 HIS 88 33.442 -9.836 10.768 652 HD1 HIS 88 HD1 HIS 88 34.390 -11.840 13.306 653 HD2 HIS 88 HD2 HIS 88 32.530 -8.125 13.357 654 HE1 HIS 88 HE1 HIS 88 34.905 -10.862 15.564 655 H GLU 89 H GLU 89 29.676 -8.571 10.080 656 HA GLU 89 HA GLU 89 30.507 -9.369 7.369 657 HB2 GLU 89 HB2 GLU 89 28.344 -10.382 7.923 658 HB3 GLU 89 HB3 GLU 89 27.696 -8.797 8.325 659 HG2 GLU 89 HG2 GLU 89 28.543 -8.335 5.816 660 HG3 GLU 89 HG3 GLU 89 28.151 -10.050 5.704 661 H HIS 90 H HIS 90 28.241 -6.957 8.678 662 HA HIS 90 HA HIS 90 28.038 -4.717 8.331 663 HB2 HIS 90 HB2 HIS 90 29.992 -4.365 9.583 664 HB3 HIS 90 HB3 HIS 90 31.024 -5.070 8.342 665 HD1 HIS 90 HD1 HIS 90 28.481 -2.363 7.679 666 HD2 HIS 90 HD2 HIS 90 32.601 -2.856 7.908 667 HE1 HIS 90 HE1 HIS 90 29.464 -0.208 6.836 668 H ALA 91 H ALA 91 26.908 -4.723 6.414 669 HA ALA 91 HA ALA 91 28.453 -4.650 3.920 670 HB1 ALA 91 HB1 ALA 91 25.481 -4.961 4.335 671 HB2 ALA 91 HB2 ALA 91 26.322 -5.024 2.786 672 HB3 ALA 91 HB3 ALA 91 26.624 -6.264 4.003 673 H GLU 92 H GLU 92 28.995 -2.706 3.196 674 HA GLU 92 HA GLU 92 27.287 -0.411 3.857 675 HB2 GLU 92 HB2 GLU 92 29.312 0.924 3.107 676 HB3 GLU 92 HB3 GLU 92 29.501 -0.010 4.583 677 HG2 GLU 92 HG2 GLU 92 31.054 -1.367 3.689 678 HG3 GLU 92 HG3 GLU 92 30.283 -1.384 2.104 679 H VAL 93 H VAL 93 26.743 1.125 2.246 680 HA VAL 93 HA VAL 93 26.776 0.023 -0.488 681 HB VAL 93 HB VAL 93 24.742 1.939 0.658 682 HG11 VAL 93 HG11 VAL 93 25.189 0.691 -1.995 683 HG12 VAL 93 HG12 VAL 93 23.522 0.845 -1.437 684 HG13 VAL 93 HG13 VAL 93 24.540 2.278 -1.583 685 HG21 VAL 93 HG21 VAL 93 24.631 -1.053 0.319 686 HG22 VAL 93 HG22 VAL 93 24.487 -0.136 1.818 687 HG23 VAL 93 HG23 VAL 93 23.215 -0.042 0.602 688 H VAL 94 H VAL 94 28.271 1.042 -1.655 689 HA VAL 94 HA VAL 94 28.363 3.983 -1.527 690 HB VAL 94 HB VAL 94 30.754 2.166 -1.868 691 HG11 VAL 94 HG11 VAL 94 30.374 5.123 -2.055 692 HG12 VAL 94 HG12 VAL 94 31.911 4.468 -1.486 693 HG13 VAL 94 HG13 VAL 94 31.309 4.044 -3.089 694 HG21 VAL 94 HG21 VAL 94 29.602 3.596 0.472 695 HG22 VAL 94 HG22 VAL 94 30.399 2.026 0.388 696 HG23 VAL 94 HG23 VAL 94 31.357 3.505 0.325 697 H PHE 95 H PHE 95 27.514 4.652 -3.390 698 HA PHE 95 HA PHE 95 28.471 3.393 -5.874 699 HB2 PHE 95 HB2 PHE 95 25.696 4.098 -5.027 700 HB3 PHE 95 HB3 PHE 95 26.119 4.269 -6.728 701 HD1 PHE 95 HD2 PHE 95 27.037 2.246 -7.943 702 HD2 PHE 95 HD1 PHE 95 25.176 2.013 -4.121 703 HE1 PHE 95 HE2 PHE 95 26.658 -0.161 -8.278 704 HE2 PHE 95 HE1 PHE 95 24.796 -0.396 -4.450 705 HZ PHE 95 HZ PHE 95 25.536 -1.486 -6.531 706 H THR 96 H THR 96 29.014 4.740 -7.544 707 HA THR 96 HA THR 96 29.077 7.609 -6.897 708 HB THR 96 HB THR 96 31.295 6.786 -7.206 709 HG1 THR 96 HG1 THR 96 31.867 8.316 -8.594 710 HG21 THR 96 HG21 THR 96 30.045 5.102 -9.185 711 HG22 THR 96 HG22 THR 96 31.620 4.936 -8.409 712 HG23 THR 96 HG23 THR 96 31.452 5.919 -9.863 713 H ALA 97 H ALA 97 28.412 9.139 -8.387 714 HA ALA 97 HA ALA 97 26.439 8.237 -10.287 715 HB1 ALA 97 HB1 ALA 97 25.534 10.232 -9.926 716 HB2 ALA 97 HB2 ALA 97 26.832 10.554 -8.776 717 HB3 ALA 97 HB3 ALA 97 27.001 11.054 -10.460 718 H ASN 98 H ASN 98 26.403 8.876 -12.528 719 HA ASN 98 HA ASN 98 27.286 9.029 -14.618 720 HB2 ASN 98 HB2 ASN 98 29.701 10.345 -13.380 721 HB3 ASN 98 HB3 ASN 98 29.061 10.563 -15.006 722 HD21 ASN 98 HD21 ASN 98 29.636 12.617 -13.136 723 HD22 ASN 98 HD22 ASN 98 28.152 13.426 -12.778 724 H ASP 99 H ASP 99 27.711 6.655 -13.176 725 HA ASP 99 HA ASP 99 30.337 5.809 -14.215 726 HB2 ASP 99 HB2 ASP 99 30.433 5.630 -11.840 727 HB3 ASP 99 HB3 ASP 99 28.836 4.889 -11.763 728 H SER 100 H SER 100 27.374 4.162 -13.114 729 HA SER 100 HA SER 100 27.339 2.724 -15.688 730 HB2 SER 100 HB2 SER 100 26.743 1.713 -12.905 731 HB3 SER 100 HB3 SER 100 26.243 0.845 -14.356 732 HG SER 100 HG SER 100 28.364 0.295 -13.359 733 H GLY 101 H GLY 101 25.084 2.980 -12.940 734 HA2 GLY 101 HA2 GLY 101 23.211 4.706 -13.710 735 HA3 GLY 101 HA3 GLY 101 22.892 3.379 -14.816 736 HA PRO 102 HA PRO 102 21.993 1.788 -10.318 737 HB2 PRO 102 HB2 PRO 102 21.718 3.722 -8.432 738 HB3 PRO 102 HB3 PRO 102 23.260 2.930 -8.778 739 HG2 PRO 102 HG2 PRO 102 22.242 5.585 -9.715 740 HG3 PRO 102 HG3 PRO 102 23.857 5.150 -9.127 741 HD2 PRO 102 HD2 PRO 102 23.285 5.399 -11.761 742 HD3 PRO 102 HD3 PRO 102 24.489 4.247 -11.151 743 H ARG 103 H ARG 103 19.927 1.415 -9.579 744 HA ARG 103 HA ARG 103 17.877 3.409 -10.277 745 HB2 ARG 103 HB2 ARG 103 17.866 0.441 -10.804 746 HB3 ARG 103 HB3 ARG 103 16.388 1.394 -10.779 747 HG2 ARG 103 HG2 ARG 103 17.128 2.715 -12.629 748 HG3 ARG 103 HG3 ARG 103 18.729 1.972 -12.579 749 HD2 ARG 103 HD2 ARG 103 17.324 -0.243 -12.875 750 HD3 ARG 103 HD3 ARG 103 16.146 0.872 -13.567 751 HE ARG 103 HE ARG 103 18.442 1.518 -14.846 752 HH11 ARG 103 HH11 ARG 103 16.741 -1.476 -14.331 753 HH12 ARG 103 HH12 ARG 103 17.280 -2.188 -15.816 754 HH21 ARG 103 HH21 ARG 103 19.158 0.591 -16.803 755 HH22 ARG 103 HH22 ARG 103 18.655 -1.012 -17.221 756 H ARG 104 H ARG 104 19.157 2.944 -7.736 757 HA ARG 104 HA ARG 104 16.762 2.407 -6.162 758 HB2 ARG 104 HB2 ARG 104 18.131 0.276 -6.352 759 HB3 ARG 104 HB3 ARG 104 19.385 1.104 -5.438 760 HG2 ARG 104 HG2 ARG 104 18.212 -0.143 -3.852 761 HG3 ARG 104 HG3 ARG 104 17.600 1.502 -3.665 762 HD2 ARG 104 HD2 ARG 104 15.687 0.151 -3.631 763 HD3 ARG 104 HD3 ARG 104 15.740 0.807 -5.266 764 HE ARG 104 HE ARG 104 17.034 -1.542 -5.529 765 HH11 ARG 104 HH11 ARG 104 13.974 -0.676 -4.112 766 HH12 ARG 104 HH12 ARG 104 13.230 -2.198 -4.467 767 HH21 ARG 104 HH21 ARG 104 16.064 -3.551 -6.003 768 HH22 ARG 104 HH22 ARG 104 14.420 -3.834 -5.543 769 H TYR 105 H TYR 105 16.646 3.569 -4.279 770 HA TYR 105 HA TYR 105 18.894 5.404 -3.757 771 HB2 TYR 105 HB2 TYR 105 16.000 5.964 -3.115 772 HB3 TYR 105 HB3 TYR 105 17.343 7.100 -3.128 773 HD1 TYR 105 HD2 TYR 105 18.641 6.868 -5.607 774 HD2 TYR 105 HD1 TYR 105 14.492 6.387 -4.799 775 HE1 TYR 105 HE2 TYR 105 18.126 7.457 -7.937 776 HE2 TYR 105 HE1 TYR 105 13.965 6.973 -7.129 777 HH TYR 105 HH TYR 105 14.863 8.005 -9.016 778 H THR 106 H THR 106 16.861 2.978 -2.492 779 HA THR 106 HA THR 106 17.298 3.696 0.286 780 HB THR 106 HB THR 106 15.972 1.255 -0.911 781 HG1 THR 106 HG1 THR 106 14.071 2.339 -0.469 782 HG21 THR 106 HG21 THR 106 16.398 2.170 1.910 783 HG22 THR 106 HG22 THR 106 16.585 0.559 1.219 784 HG23 THR 106 HG23 THR 106 14.973 1.222 1.487 785 H ILE 107 H ILE 107 18.670 2.697 1.692 786 HA ILE 107 HA ILE 107 20.814 1.137 0.513 787 HB ILE 107 HB ILE 107 20.444 2.234 3.301 788 HG12 ILE 107 HG12 ILE 107 22.625 3.465 2.343 789 HG13 ILE 107 HG13 ILE 107 21.795 3.166 0.820 790 HG21 ILE 107 HG21 ILE 107 23.127 1.590 2.917 791 HG22 ILE 107 HG22 ILE 107 21.975 0.765 3.965 792 HG23 ILE 107 HG23 ILE 107 22.230 0.195 2.316 793 HD11 ILE 107 HD11 ILE 107 21.337 5.387 1.828 794 HD12 ILE 107 HD12 ILE 107 19.894 4.415 1.537 795 HD13 ILE 107 HD13 ILE 107 20.545 4.562 3.170 796 H ALA 108 H ALA 108 20.500 -0.979 0.291 797 HA ALA 108 HA ALA 108 18.877 -2.435 2.229 798 HB1 ALA 108 HB1 ALA 108 18.231 -3.508 0.398 799 HB2 ALA 108 HB2 ALA 108 19.492 -2.736 -0.563 800 HB3 ALA 108 HB3 ALA 108 19.839 -4.227 0.313 801 H ALA 109 H ALA 109 19.876 -3.166 3.986 802 HA ALA 109 HA ALA 109 22.516 -4.429 3.666 803 HB1 ALA 109 HB1 ALA 109 23.119 -3.569 5.918 804 HB2 ALA 109 HB2 ALA 109 22.917 -2.304 4.704 805 HB3 ALA 109 HB3 ALA 109 21.648 -2.594 5.894 806 H MET 110 H MET 110 22.242 -6.531 4.020 807 HA MET 110 HA MET 110 20.295 -7.389 6.046 808 HB2 MET 110 HB2 MET 110 21.454 -8.749 3.627 809 HB3 MET 110 HB3 MET 110 20.663 -9.669 4.900 810 HG2 MET 110 HG2 MET 110 18.677 -8.106 4.553 811 HG3 MET 110 HG3 MET 110 19.480 -7.622 3.061 812 HE1 MET 110 HE1 MET 110 17.835 -11.693 4.208 813 HE2 MET 110 HE2 MET 110 18.159 -10.290 5.227 814 HE3 MET 110 HE3 MET 110 16.714 -10.330 4.215 815 H LEU 111 H LEU 111 20.998 -8.194 7.910 816 HA LEU 111 HA LEU 111 23.842 -8.633 8.289 817 HB2 LEU 111 HB2 LEU 111 21.602 -8.848 10.291 818 HB3 LEU 111 HB3 LEU 111 23.327 -8.772 10.642 819 HG LEU 111 HG LEU 111 22.621 -6.634 11.147 820 HD11 LEU 111 HD11 LEU 111 24.472 -6.685 9.457 821 HD12 LEU 111 HD12 LEU 111 23.557 -5.179 9.518 822 HD13 LEU 111 HD13 LEU 111 23.263 -6.337 8.221 823 HD21 LEU 111 HD21 LEU 111 21.071 -6.101 8.692 824 HD22 LEU 111 HD22 LEU 111 20.777 -5.597 10.356 825 HD23 LEU 111 HD23 LEU 111 20.352 -7.230 9.841 826 H SER 112 H SER 112 23.452 -10.530 6.684 827 HA SER 112 HA SER 112 22.188 -12.886 7.474 828 HB2 SER 112 HB2 SER 112 24.238 -13.849 5.987 829 HB3 SER 112 HB3 SER 112 22.799 -13.103 5.293 830 HG SER 112 HG SER 112 25.393 -12.138 5.479 831 HA PRO 113 HA PRO 113 24.682 -14.726 10.577 832 HB2 PRO 113 HB2 PRO 113 24.654 -17.348 9.874 833 HB3 PRO 113 HB3 PRO 113 23.244 -16.517 10.539 834 HG2 PRO 113 HG2 PRO 113 23.899 -17.150 7.688 835 HG3 PRO 113 HG3 PRO 113 22.349 -17.295 8.538 836 HD2 PRO 113 HD2 PRO 113 22.927 -15.213 6.906 837 HD3 PRO 113 HD3 PRO 113 21.883 -15.047 8.333 838 H TYR 114 H TYR 114 26.417 -16.756 10.628 839 HA TYR 114 HA TYR 114 28.646 -15.729 9.065 840 HB2 TYR 114 HB2 TYR 114 28.489 -16.527 11.655 841 HB3 TYR 114 HB3 TYR 114 29.094 -17.999 10.903 842 HD1 TYR 114 HD2 TYR 114 30.821 -16.880 8.776 843 HD2 TYR 114 HD1 TYR 114 30.323 -15.693 12.831 844 HE1 TYR 114 HE2 TYR 114 33.096 -15.946 8.775 845 HE2 TYR 114 HE1 TYR 114 32.597 -14.755 12.841 846 HH TYR 114 HH TYR 114 34.510 -14.551 11.712 847 H SER 115 H SER 115 26.881 -16.959 7.413 848 HA SER 115 HA SER 115 28.293 -19.445 6.706 849 HB2 SER 115 HB2 SER 115 26.140 -20.308 5.799 850 HB3 SER 115 HB3 SER 115 26.092 -20.051 7.544 851 HG SER 115 HG SER 115 24.298 -19.055 6.926 852 H TYR 116 H TYR 116 25.949 -17.150 5.297 853 HA TYR 116 HA TYR 116 27.755 -16.805 3.013 854 HB2 TYR 116 HB2 TYR 116 25.839 -18.522 2.628 855 HB3 TYR 116 HB3 TYR 116 24.801 -17.102 2.551 856 HD1 TYR 116 HD1 TYR 116 25.198 -15.389 0.776 857 HD2 TYR 116 HD2 TYR 116 27.240 -19.120 0.806 858 HE1 TYR 116 HE1 TYR 116 25.790 -15.077 -1.591 859 HE2 TYR 116 HE2 TYR 116 27.840 -18.818 -1.559 860 HH TYR 116 HH TYR 116 27.791 -17.451 -3.312 861 H SER 117 H SER 117 28.198 -14.713 2.920 862 HA SER 117 HA SER 117 26.023 -12.790 3.431 863 HB2 SER 117 HB2 SER 117 28.101 -11.267 4.054 864 HB3 SER 117 HB3 SER 117 27.375 -12.345 5.246 865 HG SER 117 HG SER 117 29.068 -13.655 5.123 866 H THR 118 H THR 118 25.859 -11.031 2.080 867 HA THR 118 HA THR 118 26.846 -11.344 -0.559 868 HB THR 118 HB THR 118 25.785 -8.715 0.403 869 HG1 THR 118 HG1 THR 118 24.126 -9.757 1.215 870 HG21 THR 118 HG21 THR 118 25.965 -8.496 -1.839 871 HG22 THR 118 HG22 THR 118 24.438 -9.378 -1.852 872 HG23 THR 118 HG23 THR 118 25.955 -10.237 -2.113 873 H THR 119 H THR 119 27.514 -8.866 1.918 874 HA THR 119 HA THR 119 30.149 -8.462 0.670 875 HB THR 119 HB THR 119 28.735 -6.145 1.934 876 HG1 THR 119 HG1 THR 119 27.486 -7.291 0.125 877 HG21 THR 119 HG21 THR 119 30.103 -4.896 0.289 878 HG22 THR 119 HG22 THR 119 30.779 -6.426 -0.271 879 HG23 THR 119 HG23 THR 119 31.076 -5.881 1.380 880 H ALA 120 H ALA 120 31.179 -9.697 2.240 881 HA ALA 120 HA ALA 120 30.873 -8.921 5.039 882 HB1 ALA 120 HB1 ALA 120 30.853 -11.301 4.524 883 HB2 ALA 120 HB2 ALA 120 32.457 -11.170 3.802 884 HB3 ALA 120 HB3 ALA 120 32.242 -10.888 5.530 885 H VAL 121 H VAL 121 32.378 -7.839 6.186 886 HA VAL 121 HA VAL 121 35.121 -7.677 5.495 887 HB VAL 121 HB VAL 121 34.341 -6.226 3.707 888 HG11 VAL 121 HG11 VAL 121 33.195 -4.398 5.805 889 HG12 VAL 121 HG12 VAL 121 33.054 -4.265 4.052 890 HG13 VAL 121 HG13 VAL 121 32.225 -5.565 4.908 891 HG21 VAL 121 HG21 VAL 121 35.427 -4.243 5.626 892 HG22 VAL 121 HG22 VAL 121 36.379 -5.700 5.339 893 HG23 VAL 121 HG23 VAL 121 35.953 -4.644 3.991 894 H VAL 122 H VAL 122 36.323 -6.879 7.164 895 HA VAL 122 HA VAL 122 34.868 -6.237 9.602 896 HB VAL 122 HB VAL 122 37.110 -6.395 10.689 897 HG11 VAL 122 HG11 VAL 122 35.432 -8.355 10.071 898 HG12 VAL 122 HG12 VAL 122 36.820 -8.902 9.129 899 HG13 VAL 122 HG13 VAL 122 36.974 -8.661 10.870 900 HG21 VAL 122 HG21 VAL 122 39.046 -6.796 9.556 901 HG22 VAL 122 HG22 VAL 122 38.231 -7.624 8.230 902 HG23 VAL 122 HG23 VAL 122 38.191 -5.864 8.326 903 H THR 123 H THR 123 35.176 -4.376 10.822 904 HA THR 123 HA THR 123 35.390 -1.962 9.482 905 HB THR 123 HB THR 123 36.055 -1.138 11.941 906 HG1 THR 123 HG1 THR 123 36.347 -3.371 12.625 907 HG21 THR 123 HG21 THR 123 33.798 -0.723 12.296 908 HG22 THR 123 HG22 THR 123 33.300 -2.252 11.571 909 HG23 THR 123 HG23 THR 123 33.871 -0.935 10.547 910 H ASN 124 H ASN 124 37.133 -1.441 8.296 911 HA ASN 124 HA ASN 124 39.561 -0.731 9.608 912 HB2 ASN 124 HB2 ASN 124 39.630 -3.320 9.173 913 HB3 ASN 124 HB3 ASN 124 39.981 -2.835 7.516 914 HD21 ASN 124 HD21 ASN 124 42.011 -3.919 7.855 915 HD22 ASN 124 HD22 ASN 124 43.301 -3.090 8.649 916 HA PRO 125 HA PRO 125 38.472 1.522 5.692 917 HB2 PRO 125 HB2 PRO 125 38.633 3.998 6.795 918 HB3 PRO 125 HB3 PRO 125 37.157 3.025 6.830 919 HG2 PRO 125 HG2 PRO 125 39.220 3.414 8.964 920 HG3 PRO 125 HG3 PRO 125 37.453 3.394 9.106 921 HD2 PRO 125 HD2 PRO 125 38.989 1.260 9.749 922 HD3 PRO 125 HD3 PRO 125 37.351 1.092 9.088 923 H LYS 126 H LYS 126 39.728 3.744 5.044 924 HA LYS 126 HA LYS 126 42.317 3.025 4.411 925 HB2 LYS 126 HB2 LYS 126 42.637 5.243 3.638 926 HB3 LYS 126 HB3 LYS 126 40.929 4.894 3.407 927 HG2 LYS 126 HG2 LYS 126 41.994 6.366 5.802 928 HG3 LYS 126 HG3 LYS 126 41.471 7.169 4.320 929 HD2 LYS 126 HD2 LYS 126 39.289 5.785 4.668 930 HD3 LYS 126 HD3 LYS 126 39.854 5.663 6.336 931 HE2 LYS 126 HE2 LYS 126 39.631 7.923 6.716 932 HE3 LYS 126 HE3 LYS 126 39.804 8.335 5.011 933 HZ1 LYS 126 HZ1 LYS 126 37.619 7.997 4.612 934 HZ2 LYS 126 HZ2 LYS 126 37.483 8.382 6.253 935 HZ3 LYS 126 HZ3 LYS 126 37.465 6.764 5.760 936 H GLU 127 H GLU 127 41.093 4.516 7.310 937 HA GLU 127 HA GLU 127 43.763 5.138 8.287 938 HB2 GLU 127 HB2 GLU 127 40.997 5.565 9.404 939 HB3 GLU 127 HB3 GLU 127 42.445 5.868 10.352 940 HG2 GLU 127 HG2 GLU 127 42.000 7.150 7.679 941 HG3 GLU 127 HG3 GLU 127 41.376 7.848 9.173 Start of MODEL 15 1 H1 GLY 1 H GLY 1 4.484 3.645 11.221 2 HA2 GLY 1 HA2 GLY 1 3.784 2.584 13.867 3 HA3 GLY 1 HA3 GLY 1 2.496 2.826 12.696 4 HA PRO 2 HA PRO 2 4.215 -1.486 12.251 5 HB2 PRO 2 HB2 PRO 2 1.813 -2.738 12.425 6 HB3 PRO 2 HB3 PRO 2 2.796 -2.345 13.841 7 HG2 PRO 2 HG2 PRO 2 0.436 -0.890 12.709 8 HG3 PRO 2 HG3 PRO 2 0.821 -1.252 14.402 9 HD2 PRO 2 HD2 PRO 2 1.277 1.175 13.292 10 HD3 PRO 2 HD3 PRO 2 2.307 0.502 14.571 11 H THR 3 H THR 3 2.012 0.564 10.658 12 HA THR 3 HA THR 3 2.401 -0.909 8.170 13 HB THR 3 HB THR 3 0.017 -0.652 7.536 14 HG1 THR 3 HG1 THR 3 -0.087 0.438 10.119 15 HG21 THR 3 HG21 THR 3 0.484 -2.263 10.049 16 HG22 THR 3 HG22 THR 3 0.819 -2.793 8.402 17 HG23 THR 3 HG23 THR 3 -0.843 -2.495 8.912 18 H GLY 4 H GLY 4 2.302 0.368 6.309 19 HA2 GLY 4 HA2 GLY 4 1.368 3.012 6.190 20 HA3 GLY 4 HA3 GLY 4 3.078 3.054 6.600 21 H THR 5 H THR 5 2.919 4.283 4.457 22 HA THR 5 HA THR 5 2.617 2.732 2.068 23 HB THR 5 HB THR 5 3.512 4.739 0.910 24 HG1 THR 5 HG1 THR 5 4.634 6.117 2.044 25 HG21 THR 5 HG21 THR 5 1.650 6.209 1.429 26 HG22 THR 5 HG22 THR 5 1.394 5.384 2.965 27 HG23 THR 5 HG23 THR 5 1.108 4.532 1.448 28 H GLY 6 H GLY 6 4.324 2.417 0.468 29 HA2 GLY 6 HA2 GLY 6 6.777 1.517 1.770 30 HA3 GLY 6 HA3 GLY 6 6.254 1.112 0.141 31 H GLU 7 H GLU 7 6.092 4.423 1.043 32 HA GLU 7 HA GLU 7 8.548 4.950 -0.499 33 HB2 GLU 7 HB2 GLU 7 7.472 7.078 -1.206 34 HB3 GLU 7 HB3 GLU 7 6.634 5.646 -1.786 35 HG2 GLU 7 HG2 GLU 7 5.002 5.888 0.034 36 HG3 GLU 7 HG3 GLU 7 5.823 7.359 0.551 37 H SER 8 H SER 8 9.010 7.524 -0.082 38 HA SER 8 HA SER 8 8.899 8.039 2.795 39 HB2 SER 8 HB2 SER 8 11.284 8.471 2.942 40 HB3 SER 8 HB3 SER 8 11.031 6.834 2.337 41 HG SER 8 HG SER 8 11.902 7.378 0.493 42 H LYS 9 H LYS 9 10.474 10.246 2.953 43 HA LYS 9 HA LYS 9 8.914 12.178 1.434 44 HB2 LYS 9 HB2 LYS 9 11.005 12.963 3.423 45 HB3 LYS 9 HB3 LYS 9 9.474 13.744 3.047 46 HG2 LYS 9 HG2 LYS 9 9.806 11.158 4.556 47 HG3 LYS 9 HG3 LYS 9 9.447 12.736 5.263 48 HD2 LYS 9 HD2 LYS 9 7.309 12.806 4.282 49 HD3 LYS 9 HD3 LYS 9 7.689 11.493 3.165 50 HE2 LYS 9 HE2 LYS 9 7.591 9.876 4.869 51 HE3 LYS 9 HE3 LYS 9 7.670 11.093 6.143 52 HZ1 LYS 9 HZ1 LYS 9 5.408 9.944 5.300 53 HZ2 LYS 9 HZ2 LYS 9 5.413 11.342 4.348 54 HZ3 LYS 9 HZ3 LYS 9 5.476 11.466 6.034 55 H CYS 10 H CYS 10 12.354 11.572 2.144 56 HA CYS 10 HA CYS 10 13.085 13.209 -0.170 57 HB2 CYS 10 HB2 CYS 10 14.372 12.493 2.365 58 HB3 CYS 10 HB3 CYS 10 15.449 12.391 0.978 59 HG CYS 10 HG CYS 10 13.638 15.204 1.083 60 HA PRO 11 HA PRO 11 14.227 9.856 -2.755 61 HB2 PRO 11 HB2 PRO 11 16.535 10.730 -3.886 62 HB3 PRO 11 HB3 PRO 11 14.952 11.403 -4.292 63 HG2 PRO 11 HG2 PRO 11 17.043 12.466 -2.431 64 HG3 PRO 11 HG3 PRO 11 16.055 13.337 -3.619 65 HD2 PRO 11 HD2 PRO 11 15.481 13.328 -0.973 66 HD3 PRO 11 HD3 PRO 11 14.223 13.419 -2.223 67 H LEU 12 H LEU 12 16.421 10.880 -0.286 68 HA LEU 12 HA LEU 12 17.983 8.405 -0.561 69 HB2 LEU 12 HB2 LEU 12 19.098 10.696 -0.459 70 HB3 LEU 12 HB3 LEU 12 18.626 10.725 1.239 71 HG LEU 12 HG LEU 12 20.995 10.043 0.802 72 HD11 LEU 12 HD11 LEU 12 19.743 7.680 2.050 73 HD12 LEU 12 HD12 LEU 12 19.310 9.249 2.728 74 HD13 LEU 12 HD13 LEU 12 21.002 8.757 2.657 75 HD21 LEU 12 HD21 LEU 12 21.563 8.196 -0.380 76 HD22 LEU 12 HD22 LEU 12 20.057 8.568 -1.218 77 HD23 LEU 12 HD23 LEU 12 20.083 7.334 0.041 78 H MET 13 H MET 13 17.369 6.770 0.677 79 HA MET 13 HA MET 13 16.570 7.302 3.443 80 HB2 MET 13 HB2 MET 13 14.679 5.780 3.297 81 HB3 MET 13 HB3 MET 13 14.495 7.083 2.129 82 HG2 MET 13 HG2 MET 13 14.615 5.701 0.365 83 HG3 MET 13 HG3 MET 13 15.832 4.672 1.118 84 HE1 MET 13 HE1 MET 13 14.114 2.121 3.078 85 HE2 MET 13 HE2 MET 13 15.393 3.334 3.110 86 HE3 MET 13 HE3 MET 13 13.888 3.615 3.987 87 H VAL 14 H VAL 14 16.956 5.592 4.889 88 HA VAL 14 HA VAL 14 18.907 3.641 3.896 89 HB VAL 14 HB VAL 14 18.298 4.483 6.733 90 HG11 VAL 14 HG11 VAL 14 20.702 3.308 6.879 91 HG12 VAL 14 HG12 VAL 14 19.187 2.441 7.139 92 HG13 VAL 14 HG13 VAL 14 19.993 2.360 5.572 93 HG21 VAL 14 HG21 VAL 14 19.349 6.293 5.595 94 HG22 VAL 14 HG22 VAL 14 20.585 5.509 6.579 95 HG23 VAL 14 HG23 VAL 14 20.524 5.216 4.840 96 H LYS 15 H LYS 15 18.685 1.455 4.211 97 HA LYS 15 HA LYS 15 16.249 0.489 5.525 98 HB2 LYS 15 HB2 LYS 15 15.606 0.558 3.224 99 HB3 LYS 15 HB3 LYS 15 17.126 -0.165 2.713 100 HG2 LYS 15 HG2 LYS 15 15.390 -1.808 2.569 101 HG3 LYS 15 HG3 LYS 15 16.482 -2.246 3.885 102 HD2 LYS 15 HD2 LYS 15 14.261 -0.549 4.731 103 HD3 LYS 15 HD3 LYS 15 13.745 -2.096 4.057 104 HE2 LYS 15 HE2 LYS 15 15.798 -2.873 5.655 105 HE3 LYS 15 HE3 LYS 15 15.166 -1.497 6.559 106 HZ1 LYS 15 HZ1 LYS 15 13.854 -4.040 5.894 107 HZ2 LYS 15 HZ2 LYS 15 12.903 -2.659 6.111 108 HZ3 LYS 15 HZ3 LYS 15 13.896 -3.207 7.366 109 H VAL 16 H VAL 16 16.982 -0.771 7.104 110 HA VAL 16 HA VAL 16 19.135 -2.684 6.475 111 HB VAL 16 HB VAL 16 18.665 -1.306 9.123 112 HG11 VAL 16 HG11 VAL 16 20.742 -2.433 9.815 113 HG12 VAL 16 HG12 VAL 16 19.451 -3.577 9.438 114 HG13 VAL 16 HG13 VAL 16 20.759 -3.309 8.285 115 HG21 VAL 16 HG21 VAL 16 20.888 -0.294 8.690 116 HG22 VAL 16 HG22 VAL 16 20.852 -0.987 7.069 117 HG23 VAL 16 HG23 VAL 16 19.653 0.219 7.540 118 H LEU 17 H LEU 17 18.490 -4.723 6.593 119 HA LEU 17 HA LEU 17 16.529 -5.495 8.628 120 HB2 LEU 17 HB2 LEU 17 15.093 -6.553 7.167 121 HB3 LEU 17 HB3 LEU 17 15.524 -5.088 6.288 122 HG LEU 17 HG LEU 17 17.386 -6.938 5.416 123 HD11 LEU 17 HD11 LEU 17 16.530 -9.001 5.297 124 HD12 LEU 17 HD12 LEU 17 14.908 -8.414 4.938 125 HD13 LEU 17 HD13 LEU 17 15.472 -8.476 6.607 126 HD21 LEU 17 HD21 LEU 17 14.816 -6.568 3.950 127 HD22 LEU 17 HD22 LEU 17 16.474 -6.534 3.348 128 HD23 LEU 17 HD23 LEU 17 15.838 -5.165 4.263 129 H ASP 18 H ASP 18 16.608 -7.703 9.239 130 HA ASP 18 HA ASP 18 19.244 -8.849 8.997 131 HB2 ASP 18 HB2 ASP 18 16.799 -9.435 10.614 132 HB3 ASP 18 HB3 ASP 18 18.010 -10.701 10.425 133 H ALA 19 H ALA 19 19.860 -10.366 7.607 134 HA ALA 19 HA ALA 19 17.960 -11.447 5.725 135 HB1 ALA 19 HB1 ALA 19 19.724 -11.598 4.383 136 HB2 ALA 19 HB2 ALA 19 20.682 -10.856 5.665 137 HB3 ALA 19 HB3 ALA 19 20.590 -12.611 5.537 138 H VAL 20 H VAL 20 18.701 -12.296 8.778 139 HA VAL 20 HA VAL 20 18.865 -15.169 8.389 140 HB VAL 20 HB VAL 20 18.662 -13.556 10.936 141 HG11 VAL 20 HG11 VAL 20 19.446 -15.670 12.006 142 HG12 VAL 20 HG12 VAL 20 17.816 -15.758 11.337 143 HG13 VAL 20 HG13 VAL 20 19.167 -16.489 10.470 144 HG21 VAL 20 HG21 VAL 20 20.740 -13.021 10.045 145 HG22 VAL 20 HG22 VAL 20 21.103 -14.385 11.101 146 HG23 VAL 20 HG23 VAL 20 20.972 -14.630 9.359 147 H ARG 21 H ARG 21 16.524 -12.756 9.423 148 HA ARG 21 HA ARG 21 14.477 -14.875 9.539 149 HB2 ARG 21 HB2 ARG 21 14.231 -12.208 10.910 150 HB3 ARG 21 HB3 ARG 21 13.315 -13.679 11.207 151 HG2 ARG 21 HG2 ARG 21 14.694 -13.811 12.985 152 HG3 ARG 21 HG3 ARG 21 15.758 -14.576 11.804 153 HD2 ARG 21 HD2 ARG 21 17.002 -12.594 11.495 154 HD3 ARG 21 HD3 ARG 21 15.787 -11.615 12.317 155 HE ARG 21 HE ARG 21 17.901 -13.129 13.530 156 HH11 ARG 21 HH11 ARG 21 14.729 -11.775 14.001 157 HH12 ARG 21 HH12 ARG 21 14.881 -11.683 15.725 158 HH21 ARG 21 HH21 ARG 21 18.114 -13.012 15.799 159 HH22 ARG 21 HH22 ARG 21 16.808 -12.386 16.746 160 H GLY 22 H GLY 22 15.439 -11.838 8.184 161 HA2 GLY 22 HA2 GLY 22 14.620 -11.010 6.132 162 HA3 GLY 22 HA3 GLY 22 13.164 -11.969 6.353 163 H SER 23 H SER 23 13.829 -10.456 9.225 164 HA SER 23 HA SER 23 11.809 -8.411 8.670 165 HB2 SER 23 HB2 SER 23 12.296 -8.328 11.388 166 HB3 SER 23 HB3 SER 23 11.005 -9.240 10.605 167 HG SER 23 HG SER 23 11.965 -10.904 11.450 168 HA PRO 24 HA PRO 24 14.521 -4.981 9.009 169 HB2 PRO 24 HB2 PRO 24 13.096 -3.223 10.508 170 HB3 PRO 24 HB3 PRO 24 12.681 -3.616 8.835 171 HG2 PRO 24 HG2 PRO 24 11.498 -4.667 11.376 172 HG3 PRO 24 HG3 PRO 24 10.680 -4.161 9.887 173 HD2 PRO 24 HD2 PRO 24 11.137 -6.761 10.484 174 HD3 PRO 24 HD3 PRO 24 11.122 -6.153 8.816 175 H ALA 25 H ALA 25 16.071 -4.018 10.305 176 HA ALA 25 HA ALA 25 16.419 -5.233 12.935 177 HB1 ALA 25 HB1 ALA 25 18.690 -4.638 12.793 178 HB2 ALA 25 HB2 ALA 25 18.244 -5.164 11.170 179 HB3 ALA 25 HB3 ALA 25 18.383 -3.444 11.532 180 H ILE 26 H ILE 26 16.337 -4.145 14.824 181 HA ILE 26 HA ILE 26 15.601 -1.301 14.690 182 HB ILE 26 HB ILE 26 14.817 -3.524 16.486 183 HG12 ILE 26 HG12 ILE 26 13.461 -2.211 14.656 184 HG13 ILE 26 HG13 ILE 26 12.681 -2.700 16.156 185 HG21 ILE 26 HG21 ILE 26 15.280 -0.714 17.446 186 HG22 ILE 26 HG22 ILE 26 14.155 -1.815 18.238 187 HG23 ILE 26 HG23 ILE 26 15.867 -2.222 18.146 188 HD11 ILE 26 HD11 ILE 26 12.118 -0.410 15.520 189 HD12 ILE 26 HD12 ILE 26 12.976 -0.473 17.060 190 HD13 ILE 26 HD13 ILE 26 13.825 0.026 15.597 191 H ASN 27 H ASN 27 16.720 0.228 15.804 192 HA ASN 27 HA ASN 27 18.435 1.223 16.918 193 HB2 ASN 27 HB2 ASN 27 18.713 -1.406 18.388 194 HB3 ASN 27 HB3 ASN 27 19.283 0.172 18.924 195 HD21 ASN 27 HD21 ASN 27 17.013 1.664 18.164 196 HD22 ASN 27 HD22 ASN 27 15.716 1.232 19.221 197 H VAL 28 H VAL 28 19.265 0.682 14.565 198 HA VAL 28 HA VAL 28 21.813 -0.778 14.842 199 HB VAL 28 HB VAL 28 20.153 -0.356 12.352 200 HG11 VAL 28 HG11 VAL 28 22.387 -0.272 11.634 201 HG12 VAL 28 HG12 VAL 28 22.888 -1.530 12.765 202 HG13 VAL 28 HG13 VAL 28 21.889 -1.943 11.370 203 HG21 VAL 28 HG21 VAL 28 20.603 -2.674 14.183 204 HG22 VAL 28 HG22 VAL 28 19.103 -2.087 13.466 205 HG23 VAL 28 HG23 VAL 28 20.273 -2.957 12.474 206 H ALA 29 H ALA 29 23.414 0.634 15.101 207 HA ALA 29 HA ALA 29 23.365 3.345 14.469 208 HB1 ALA 29 HB1 ALA 29 25.960 3.020 14.517 209 HB2 ALA 29 HB2 ALA 29 25.007 2.813 15.986 210 HB3 ALA 29 HB3 ALA 29 25.542 1.400 15.075 211 H VAL 30 H VAL 30 23.553 4.440 12.628 212 HA VAL 30 HA VAL 30 24.954 3.218 10.361 213 HB VAL 30 HB VAL 30 22.209 4.466 10.176 214 HG11 VAL 30 HG11 VAL 30 22.549 3.480 7.754 215 HG12 VAL 30 HG12 VAL 30 23.121 5.095 8.175 216 HG13 VAL 30 HG13 VAL 30 24.250 3.740 8.138 217 HG21 VAL 30 HG21 VAL 30 23.165 1.708 10.400 218 HG22 VAL 30 HG22 VAL 30 21.569 2.385 10.720 219 HG23 VAL 30 HG23 VAL 30 22.040 1.981 9.069 220 H HIS 31 H HIS 31 26.247 4.599 9.308 221 HA HIS 31 HA HIS 31 25.874 7.483 9.783 222 HB2 HIS 31 HB2 HIS 31 28.572 6.197 9.404 223 HB3 HIS 31 HB3 HIS 31 28.206 7.805 10.021 224 HD1 HIS 31 HD1 HIS 31 27.970 8.043 12.502 225 HD2 HIS 31 HD2 HIS 31 27.926 4.074 11.274 226 HE1 HIS 31 HE1 HIS 31 28.043 6.684 14.617 227 H VAL 32 H VAL 32 25.593 8.632 7.995 228 HA VAL 32 HA VAL 32 26.320 7.424 5.418 229 HB VAL 32 HB VAL 32 24.531 9.816 5.824 230 HG11 VAL 32 HG11 VAL 32 25.412 8.189 3.544 231 HG12 VAL 32 HG12 VAL 32 23.681 8.527 3.593 232 HG13 VAL 32 HG13 VAL 32 24.840 9.856 3.598 233 HG21 VAL 32 HG21 VAL 32 23.487 8.083 7.069 234 HG22 VAL 32 HG22 VAL 32 22.649 8.169 5.519 235 HG23 VAL 32 HG23 VAL 32 23.824 6.888 5.817 236 H PHE 33 H PHE 33 27.660 8.423 3.991 237 HA PHE 33 HA PHE 33 28.699 11.078 4.688 238 HB2 PHE 33 HB2 PHE 33 30.302 8.581 4.170 239 HB3 PHE 33 HB3 PHE 33 30.990 10.185 3.943 240 HD1 PHE 33 HD1 PHE 33 29.267 8.078 6.476 241 HD2 PHE 33 HD2 PHE 33 31.957 11.291 5.731 242 HE1 PHE 33 HE1 PHE 33 29.804 8.180 8.875 243 HE2 PHE 33 HE2 PHE 33 32.500 11.397 8.128 244 HZ PHE 33 HZ PHE 33 31.423 9.841 9.703 245 H ARG 34 H ARG 34 29.970 12.043 2.859 246 HA ARG 34 HA ARG 34 28.996 11.108 0.245 247 HB2 ARG 34 HB2 ARG 34 27.632 13.022 1.042 248 HB3 ARG 34 HB3 ARG 34 29.094 13.992 1.146 249 HG2 ARG 34 HG2 ARG 34 28.622 12.723 -1.461 250 HG3 ARG 34 HG3 ARG 34 27.443 13.948 -0.986 251 HD2 ARG 34 HD2 ARG 34 29.383 15.468 -0.486 252 HD3 ARG 34 HD3 ARG 34 30.427 14.262 -1.237 253 HE ARG 34 HE ARG 34 28.778 16.154 -2.571 254 HH11 ARG 34 HH11 ARG 34 30.019 12.909 -2.792 255 HH12 ARG 34 HH12 ARG 34 29.934 12.854 -4.521 256 HH21 ARG 34 HH21 ARG 34 28.661 16.095 -4.848 257 HH22 ARG 34 HH22 ARG 34 29.162 14.668 -5.690 258 H LYS 35 H LYS 35 30.344 11.518 -1.521 259 HA LYS 35 HA LYS 35 33.125 11.540 -0.947 260 HB2 LYS 35 HB2 LYS 35 32.583 10.311 -2.846 261 HB3 LYS 35 HB3 LYS 35 31.481 11.541 -3.452 262 HG2 LYS 35 HG2 LYS 35 33.456 11.437 -4.832 263 HG3 LYS 35 HG3 LYS 35 33.397 12.981 -3.979 264 HD2 LYS 35 HD2 LYS 35 35.642 12.198 -3.856 265 HD3 LYS 35 HD3 LYS 35 34.926 11.973 -2.257 266 HE2 LYS 35 HE2 LYS 35 35.744 9.891 -2.420 267 HE3 LYS 35 HE3 LYS 35 34.345 9.599 -3.451 268 HZ1 LYS 35 HZ1 LYS 35 35.771 9.070 -5.045 269 HZ2 LYS 35 HZ2 LYS 35 37.100 9.574 -4.128 270 HZ3 LYS 35 HZ3 LYS 35 36.269 10.687 -5.094 271 H ALA 36 H ALA 36 34.130 13.316 -0.257 272 HA ALA 36 HA ALA 36 33.262 15.960 -0.873 273 HB1 ALA 36 HB1 ALA 36 35.019 14.760 0.972 274 HB2 ALA 36 HB2 ALA 36 35.964 15.933 0.055 275 HB3 ALA 36 HB3 ALA 36 34.503 16.445 0.900 276 H ALA 37 H ALA 37 34.491 17.589 -1.994 277 HA ALA 37 HA ALA 37 35.292 16.833 -4.566 278 HB1 ALA 37 HB1 ALA 37 36.153 19.174 -4.742 279 HB2 ALA 37 HB2 ALA 37 34.481 19.043 -4.194 280 HB3 ALA 37 HB3 ALA 37 35.765 19.381 -3.034 281 H ASP 38 H ASP 38 37.027 16.878 -1.608 282 HA ASP 38 HA ASP 38 39.626 16.883 -2.935 283 HB2 ASP 38 HB2 ASP 38 38.744 17.782 -0.443 284 HB3 ASP 38 HB3 ASP 38 39.694 16.343 -0.084 285 H ASP 39 H ASP 39 37.472 14.673 -2.937 286 HA ASP 39 HA ASP 39 37.458 12.402 -3.085 287 HB2 ASP 39 HB2 ASP 39 40.427 12.325 -2.648 288 HB3 ASP 39 HB3 ASP 39 39.428 11.297 -3.672 289 H THR 40 H THR 40 36.992 13.583 -0.583 290 HA THR 40 HA THR 40 38.089 11.532 1.229 291 HB THR 40 HB THR 40 38.140 13.054 3.035 292 HG1 THR 40 HG1 THR 40 37.242 15.154 2.866 293 HG21 THR 40 HG21 THR 40 40.011 13.346 1.494 294 HG22 THR 40 HG22 THR 40 39.576 14.883 2.240 295 HG23 THR 40 HG23 THR 40 39.088 14.539 0.581 296 H TRP 41 H TRP 41 36.613 11.513 3.326 297 HA TRP 41 HA TRP 41 33.875 11.089 2.348 298 HB2 TRP 41 HB2 TRP 41 35.440 9.856 4.610 299 HB3 TRP 41 HB3 TRP 41 33.690 9.694 4.491 300 HD1 TRP 41 HD1 TRP 41 35.938 9.530 1.387 301 HE1 TRP 41 HE1 TRP 41 35.786 7.161 0.392 302 HE3 TRP 41 HE3 TRP 41 33.190 7.280 5.065 303 HZ2 TRP 41 HZ2 TRP 41 34.650 4.669 1.077 304 HZ3 TRP 41 HZ3 TRP 41 32.614 4.901 4.819 305 HH2 TRP 41 HH2 TRP 41 33.329 3.624 2.865 306 H GLU 42 H GLU 42 32.652 12.829 2.729 307 HA GLU 42 HA GLU 42 33.032 14.361 5.186 308 HB2 GLU 42 HB2 GLU 42 31.466 14.870 2.663 309 HB3 GLU 42 HB3 GLU 42 31.299 15.882 4.090 310 HG2 GLU 42 HG2 GLU 42 34.011 15.383 2.967 311 HG3 GLU 42 HG3 GLU 42 32.941 16.539 2.175 312 HA PRO 43 HA PRO 43 29.577 12.635 7.278 313 HB2 PRO 43 HB2 PRO 43 28.816 14.755 8.793 314 HB3 PRO 43 HB3 PRO 43 30.276 13.813 9.122 315 HG2 PRO 43 HG2 PRO 43 29.994 16.440 7.713 316 HG3 PRO 43 HG3 PRO 43 31.202 15.936 8.909 317 HD2 PRO 43 HD2 PRO 43 31.713 15.979 6.250 318 HD3 PRO 43 HD3 PRO 43 32.457 14.797 7.347 319 H PHE 44 H PHE 44 27.764 12.192 6.185 320 HA PHE 44 HA PHE 44 26.216 14.394 5.022 321 HB2 PHE 44 HB2 PHE 44 26.865 12.491 3.552 322 HB3 PHE 44 HB3 PHE 44 25.911 11.419 4.573 323 HD1 PHE 44 HD2 PHE 44 23.448 11.686 4.671 324 HD2 PHE 44 HD1 PHE 44 25.853 13.860 1.914 325 HE1 PHE 44 HE2 PHE 44 21.448 12.191 3.330 326 HE2 PHE 44 HE1 PHE 44 23.856 14.370 0.569 327 HZ PHE 44 HZ PHE 44 21.651 13.534 1.276 328 H ALA 45 H ALA 45 25.956 11.659 7.227 329 HA ALA 45 HA ALA 45 24.016 12.872 8.845 330 HB1 ALA 45 HB1 ALA 45 22.609 10.621 7.604 331 HB2 ALA 45 HB2 ALA 45 22.011 12.208 8.092 332 HB3 ALA 45 HB3 ALA 45 22.840 12.015 6.547 333 H SER 46 H SER 46 22.893 11.108 10.282 334 HA SER 46 HA SER 46 24.132 8.583 10.559 335 HB2 SER 46 HB2 SER 46 26.082 9.369 11.455 336 HB3 SER 46 HB3 SER 46 25.345 10.874 12.008 337 HG SER 46 HG SER 46 25.620 9.821 13.859 338 H GLY 47 H GLY 47 23.171 7.320 12.168 339 HA2 GLY 47 HA2 GLY 47 21.644 8.188 14.314 340 HA3 GLY 47 HA3 GLY 47 20.555 8.122 12.936 341 H LYS 48 H LYS 48 19.329 6.463 13.859 342 HA LYS 48 HA LYS 48 20.592 3.821 13.664 343 HB2 LYS 48 HB2 LYS 48 19.266 5.024 16.019 344 HB3 LYS 48 HB3 LYS 48 18.822 3.362 15.656 345 HG2 LYS 48 HG2 LYS 48 21.188 2.726 15.720 346 HG3 LYS 48 HG3 LYS 48 21.615 4.392 16.118 347 HD2 LYS 48 HD2 LYS 48 19.814 2.624 17.774 348 HD3 LYS 48 HD3 LYS 48 21.524 2.914 18.101 349 HE2 LYS 48 HE2 LYS 48 20.573 5.454 17.877 350 HE3 LYS 48 HE3 LYS 48 19.187 4.624 18.582 351 HZ1 LYS 48 HZ1 LYS 48 20.248 4.317 20.520 352 HZ2 LYS 48 HZ2 LYS 48 21.213 5.609 20.007 353 HZ3 LYS 48 HZ3 LYS 48 21.748 4.018 19.796 354 H THR 49 H THR 49 19.413 2.348 12.587 355 HA THR 49 HA THR 49 17.195 3.082 11.066 356 HB THR 49 HB THR 49 16.965 0.760 10.462 357 HG1 THR 49 HG1 THR 49 17.115 -0.219 12.494 358 HG21 THR 49 HG21 THR 49 18.801 1.067 9.235 359 HG22 THR 49 HG22 THR 49 19.750 0.395 10.560 360 HG23 THR 49 HG23 THR 49 19.487 2.136 10.458 361 H SER 50 H SER 50 15.072 1.788 11.121 362 HA SER 50 HA SER 50 14.093 1.598 13.892 363 HB2 SER 50 HB2 SER 50 12.798 2.957 11.528 364 HB3 SER 50 HB3 SER 50 11.890 2.491 12.965 365 HG SER 50 HG SER 50 12.514 4.459 13.517 366 H GLU 51 H GLU 51 11.818 0.512 13.866 367 HA GLU 51 HA GLU 51 12.177 -2.112 12.840 368 HB2 GLU 51 HB2 GLU 51 9.794 -2.428 13.664 369 HB3 GLU 51 HB3 GLU 51 10.976 -1.933 14.867 370 HG2 GLU 51 HG2 GLU 51 9.787 -0.142 15.370 371 HG3 GLU 51 HG3 GLU 51 9.791 0.385 13.688 372 H SER 52 H SER 52 11.146 0.690 11.362 373 HA SER 52 HA SER 52 9.375 -0.701 9.485 374 HB2 SER 52 HB2 SER 52 8.799 1.568 10.605 375 HB3 SER 52 HB3 SER 52 9.930 2.255 9.440 376 HG SER 52 HG SER 52 7.463 0.990 8.999 377 H GLY 53 H GLY 53 12.553 -0.284 9.792 378 HA2 GLY 53 HA2 GLY 53 14.307 -0.457 8.317 379 HA3 GLY 53 HA3 GLY 53 13.121 -0.814 7.070 380 H GLU 54 H GLU 54 12.692 2.132 8.771 381 HA GLU 54 HA GLU 54 14.017 3.631 6.615 382 HB2 GLU 54 HB2 GLU 54 11.360 4.450 7.776 383 HB3 GLU 54 HB3 GLU 54 12.160 5.085 6.346 384 HG2 GLU 54 HG2 GLU 54 11.917 2.587 5.532 385 HG3 GLU 54 HG3 GLU 54 10.592 2.593 6.695 386 H LEU 55 H LEU 55 15.271 5.253 7.293 387 HA LEU 55 HA LEU 55 15.168 5.962 10.142 388 HB2 LEU 55 HB2 LEU 55 17.283 5.244 8.474 389 HB3 LEU 55 HB3 LEU 55 17.457 6.983 8.703 390 HG LEU 55 HG LEU 55 17.171 5.078 11.014 391 HD11 LEU 55 HD11 LEU 55 19.844 6.118 10.364 392 HD12 LEU 55 HD12 LEU 55 19.227 4.877 9.274 393 HD13 LEU 55 HD13 LEU 55 19.356 4.548 11.002 394 HD21 LEU 55 HD21 LEU 55 17.176 6.948 12.204 395 HD22 LEU 55 HD22 LEU 55 17.304 7.908 10.731 396 HD23 LEU 55 HD23 LEU 55 18.763 7.354 11.552 397 H HIS 56 H HIS 56 14.028 7.742 10.524 398 HA HIS 56 HA HIS 56 13.948 9.876 8.530 399 HB2 HIS 56 HB2 HIS 56 11.862 8.944 9.679 400 HB3 HIS 56 HB3 HIS 56 12.411 9.791 11.122 401 HD1 HIS 56 HD1 HIS 56 11.606 10.620 7.497 402 HD2 HIS 56 HD2 HIS 56 11.496 12.332 11.281 403 HE1 HIS 56 HE1 HIS 56 10.527 12.871 7.186 404 H GLY 57 H GLY 57 15.512 11.347 8.655 405 HA2 GLY 57 HA2 GLY 57 15.964 13.310 10.304 406 HA3 GLY 57 HA3 GLY 57 16.634 12.015 11.285 407 H LEU 58 H LEU 58 17.481 10.724 8.629 408 HA LEU 58 HA LEU 58 20.122 11.850 8.627 409 HB2 LEU 58 HB2 LEU 58 18.907 9.737 6.852 410 HB3 LEU 58 HB3 LEU 58 20.623 10.125 6.966 411 HG LEU 58 HG LEU 58 18.886 8.835 9.065 412 HD11 LEU 58 HD11 LEU 58 19.701 6.918 8.308 413 HD12 LEU 58 HD12 LEU 58 21.354 7.516 8.447 414 HD13 LEU 58 HD13 LEU 58 20.435 7.798 6.968 415 HD21 LEU 58 HD21 LEU 58 20.198 9.839 10.566 416 HD22 LEU 58 HD22 LEU 58 21.334 10.395 9.337 417 HD23 LEU 58 HD23 LEU 58 21.470 8.762 9.991 418 H THR 59 H THR 59 17.261 12.167 6.700 419 HA THR 59 HA THR 59 18.258 13.026 4.268 420 HB THR 59 HB THR 59 16.170 14.231 3.941 421 HG1 THR 59 HG1 THR 59 14.698 14.347 5.764 422 HG21 THR 59 HG21 THR 59 15.923 11.609 5.406 423 HG22 THR 59 HG22 THR 59 15.960 11.880 3.663 424 HG23 THR 59 HG23 THR 59 14.562 12.396 4.607 425 H THR 60 H THR 60 19.003 14.932 3.444 426 HA THR 60 HA THR 60 19.045 17.330 5.076 427 HB THR 60 HB THR 60 21.530 17.610 4.757 428 HG1 THR 60 HG1 THR 60 22.618 15.476 4.538 429 HG21 THR 60 HG21 THR 60 20.540 16.976 6.921 430 HG22 THR 60 HG22 THR 60 22.128 16.244 6.684 431 HG23 THR 60 HG23 THR 60 20.670 15.276 6.472 432 H GLU 61 H GLU 61 19.955 19.197 3.882 433 HA GLU 61 HA GLU 61 18.890 19.338 1.275 434 HB2 GLU 61 HB2 GLU 61 20.073 21.562 1.195 435 HB3 GLU 61 HB3 GLU 61 18.981 21.341 2.554 436 HG2 GLU 61 HG2 GLU 61 20.763 21.034 4.066 437 HG3 GLU 61 HG3 GLU 61 21.934 20.850 2.761 438 H GLU 62 H GLU 62 21.817 18.095 2.403 439 HA GLU 62 HA GLU 62 23.399 18.692 0.073 440 HB2 GLU 62 HB2 GLU 62 23.791 17.278 2.633 441 HB3 GLU 62 HB3 GLU 62 24.725 16.653 1.281 442 HG2 GLU 62 HG2 GLU 62 24.754 19.458 2.363 443 HG3 GLU 62 HG3 GLU 62 26.042 18.260 2.462 444 H GLU 63 H GLU 63 20.823 16.748 0.482 445 HA GLU 63 HA GLU 63 21.671 14.316 -0.716 446 HB2 GLU 63 HB2 GLU 63 19.441 13.670 -0.665 447 HB3 GLU 63 HB3 GLU 63 19.528 14.826 0.656 448 HG2 GLU 63 HG2 GLU 63 18.587 15.498 -2.121 449 HG3 GLU 63 HG3 GLU 63 17.523 15.067 -0.783 450 H PHE 64 H PHE 64 21.360 17.386 -1.974 451 HA PHE 64 HA PHE 64 20.591 16.496 -4.648 452 HB2 PHE 64 HB2 PHE 64 19.736 18.652 -3.514 453 HB3 PHE 64 HB3 PHE 64 21.324 19.315 -3.891 454 HD1 PHE 64 HD2 PHE 64 18.992 17.126 -5.809 455 HD2 PHE 64 HD1 PHE 64 21.120 20.807 -5.623 456 HE1 PHE 64 HE2 PHE 64 18.214 17.687 -8.076 457 HE2 PHE 64 HE1 PHE 64 20.345 21.374 -7.889 458 HZ PHE 64 HZ PHE 64 18.889 19.813 -9.118 459 H VAL 65 H VAL 65 22.982 15.415 -3.805 460 HA VAL 65 HA VAL 65 25.076 17.003 -5.107 461 HB VAL 65 HB VAL 65 26.635 15.286 -4.179 462 HG11 VAL 65 HG11 VAL 65 25.718 15.978 -1.664 463 HG12 VAL 65 HG12 VAL 65 26.807 16.928 -2.678 464 HG13 VAL 65 HG13 VAL 65 25.071 17.241 -2.710 465 HG21 VAL 65 HG21 VAL 65 24.477 13.695 -3.937 466 HG22 VAL 65 HG22 VAL 65 25.959 13.475 -3.007 467 HG23 VAL 65 HG23 VAL 65 24.586 14.317 -2.290 468 H GLU 66 H GLU 66 26.799 15.295 -6.107 469 HA GLU 66 HA GLU 66 25.847 14.552 -8.572 470 HB2 GLU 66 HB2 GLU 66 28.136 13.342 -7.013 471 HB3 GLU 66 HB3 GLU 66 27.849 13.068 -8.726 472 HG2 GLU 66 HG2 GLU 66 28.046 15.873 -7.787 473 HG3 GLU 66 HG3 GLU 66 29.523 14.915 -7.858 474 H GLY 67 H GLY 67 26.195 12.490 -5.696 475 HA2 GLY 67 HA2 GLY 67 24.039 11.006 -5.636 476 HA3 GLY 67 HA3 GLY 67 24.773 10.337 -7.087 477 H ILE 68 H ILE 68 27.414 11.062 -5.511 478 HA ILE 68 HA ILE 68 27.923 8.404 -4.657 479 HB ILE 68 HB ILE 68 29.511 10.911 -4.091 480 HG12 ILE 68 HG12 ILE 68 30.156 8.850 -6.180 481 HG13 ILE 68 HG13 ILE 68 29.037 10.161 -6.536 482 HG21 ILE 68 HG21 ILE 68 31.385 9.134 -3.962 483 HG22 ILE 68 HG22 ILE 68 30.320 9.355 -2.575 484 HG23 ILE 68 HG23 ILE 68 30.066 8.000 -3.675 485 HD11 ILE 68 HD11 ILE 68 31.010 11.628 -5.586 486 HD12 ILE 68 HD12 ILE 68 31.963 10.231 -6.085 487 HD13 ILE 68 HD13 ILE 68 30.973 11.090 -7.265 488 H TYR 69 H TYR 69 27.468 7.463 -2.786 489 HA TYR 69 HA TYR 69 27.351 9.064 -0.344 490 HB2 TYR 69 HB2 TYR 69 25.130 7.202 -1.212 491 HB3 TYR 69 HB3 TYR 69 25.224 8.034 0.336 492 HD1 TYR 69 HD2 TYR 69 25.685 10.710 -0.029 493 HD2 TYR 69 HD1 TYR 69 23.655 8.114 -2.720 494 HE1 TYR 69 HE2 TYR 69 24.504 12.641 -0.991 495 HE2 TYR 69 HE1 TYR 69 22.469 10.038 -3.690 496 HH TYR 69 HH TYR 69 22.709 12.437 -3.894 497 H LYS 70 H LYS 70 28.348 8.086 1.294 498 HA LYS 70 HA LYS 70 28.870 5.193 1.070 499 HB2 LYS 70 HB2 LYS 70 30.556 7.367 2.322 500 HB3 LYS 70 HB3 LYS 70 30.904 5.648 2.454 501 HG2 LYS 70 HG2 LYS 70 32.258 6.201 0.709 502 HG3 LYS 70 HG3 LYS 70 30.793 5.757 -0.171 503 HD2 LYS 70 HD2 LYS 70 31.047 7.757 -1.163 504 HD3 LYS 70 HD3 LYS 70 30.346 8.395 0.325 505 HE2 LYS 70 HE2 LYS 70 32.228 9.678 0.219 506 HE3 LYS 70 HE3 LYS 70 32.868 8.305 1.121 507 HZ1 LYS 70 HZ1 LYS 70 33.874 9.310 -1.205 508 HZ2 LYS 70 HZ2 LYS 70 33.043 7.926 -1.708 509 HZ3 LYS 70 HZ3 LYS 70 34.250 7.805 -0.529 510 H VAL 71 H VAL 71 27.391 4.238 2.343 511 HA VAL 71 HA VAL 71 26.860 5.371 4.997 512 HB VAL 71 HB VAL 71 25.368 3.221 3.485 513 HG11 VAL 71 HG11 VAL 71 25.140 4.294 6.243 514 HG12 VAL 71 HG12 VAL 71 23.647 3.941 5.371 515 HG13 VAL 71 HG13 VAL 71 24.839 2.668 5.631 516 HG21 VAL 71 HG21 VAL 71 23.587 5.167 3.688 517 HG22 VAL 71 HG22 VAL 71 25.040 6.165 3.736 518 HG23 VAL 71 HG23 VAL 71 24.742 5.107 2.358 519 H GLU 72 H GLU 72 27.306 4.287 6.855 520 HA GLU 72 HA GLU 72 28.525 1.618 6.607 521 HB2 GLU 72 HB2 GLU 72 30.328 2.173 7.935 522 HB3 GLU 72 HB3 GLU 72 30.090 3.672 7.048 523 HG2 GLU 72 HG2 GLU 72 28.567 4.266 9.102 524 HG3 GLU 72 HG3 GLU 72 29.560 3.051 9.905 525 H ILE 73 H ILE 73 27.974 0.132 8.133 526 HA ILE 73 HA ILE 73 26.061 1.011 10.197 527 HB ILE 73 HB ILE 73 26.140 -1.662 8.792 528 HG12 ILE 73 HG12 ILE 73 23.720 -0.044 8.551 529 HG13 ILE 73 HG13 ILE 73 25.131 0.737 7.845 530 HG21 ILE 73 HG21 ILE 73 24.184 -0.568 10.810 531 HG22 ILE 73 HG22 ILE 73 24.062 -2.122 9.986 532 HG23 ILE 73 HG23 ILE 73 25.388 -1.823 11.111 533 HD11 ILE 73 HD11 ILE 73 24.626 -2.111 7.181 534 HD12 ILE 73 HD12 ILE 73 23.601 -0.876 6.447 535 HD13 ILE 73 HD13 ILE 73 25.348 -0.829 6.209 536 H ASP 74 H ASP 74 26.340 0.317 12.262 537 HA ASP 74 HA ASP 74 28.843 -1.102 12.824 538 HB2 ASP 74 HB2 ASP 74 27.445 1.091 14.071 539 HB3 ASP 74 HB3 ASP 74 27.701 -0.205 15.237 540 H THR 75 H THR 75 28.103 -3.210 12.401 541 HA THR 75 HA THR 75 26.016 -4.229 14.204 542 HB THR 75 HB THR 75 25.664 -6.034 12.724 543 HG1 THR 75 HG1 THR 75 28.224 -5.362 11.785 544 HG21 THR 75 HG21 THR 75 24.885 -4.968 10.825 545 HG22 THR 75 HG22 THR 75 26.293 -3.912 10.713 546 HG23 THR 75 HG23 THR 75 25.061 -3.613 11.940 547 H LYS 76 H LYS 76 28.999 -3.714 14.693 548 HA LYS 76 HA LYS 76 30.013 -6.378 15.223 549 HB2 LYS 76 HB2 LYS 76 31.997 -5.159 16.110 550 HB3 LYS 76 HB3 LYS 76 31.604 -4.747 14.446 551 HG2 LYS 76 HG2 LYS 76 31.836 -2.638 15.145 552 HG3 LYS 76 HG3 LYS 76 30.210 -2.852 15.797 553 HD2 LYS 76 HD2 LYS 76 31.334 -2.053 17.643 554 HD3 LYS 76 HD3 LYS 76 31.490 -3.797 17.875 555 HE2 LYS 76 HE2 LYS 76 33.708 -3.681 17.749 556 HE3 LYS 76 HE3 LYS 76 33.630 -2.790 16.230 557 HZ1 LYS 76 HZ1 LYS 76 33.184 -1.463 18.834 558 HZ2 LYS 76 HZ2 LYS 76 33.573 -0.756 17.348 559 HZ3 LYS 76 HZ3 LYS 76 34.736 -1.651 18.189 560 H SER 77 H SER 77 29.048 -3.521 17.098 561 HA SER 77 HA SER 77 29.237 -5.050 19.574 562 HB2 SER 77 HB2 SER 77 28.809 -2.914 20.696 563 HB3 SER 77 HB3 SER 77 30.119 -2.745 19.529 564 HG SER 77 HG SER 77 28.306 -1.111 19.588 565 H TYR 78 H TYR 78 26.803 -3.140 17.814 566 HA TYR 78 HA TYR 78 24.615 -3.555 19.421 567 HB2 TYR 78 HB2 TYR 78 24.815 -3.337 16.419 568 HB3 TYR 78 HB3 TYR 78 23.270 -3.412 17.258 569 HD1 TYR 78 HD1 TYR 78 26.373 -1.423 16.897 570 HD2 TYR 78 HD2 TYR 78 22.358 -1.496 18.304 571 HE1 TYR 78 HE1 TYR 78 26.463 1.008 17.264 572 HE2 TYR 78 HE2 TYR 78 22.436 0.934 18.673 573 HH TYR 78 HH TYR 78 24.354 2.665 19.127 574 H TRP 79 H TRP 79 26.147 -5.786 17.217 575 HA TRP 79 HA TRP 79 24.062 -7.691 17.079 576 HB2 TRP 79 HB2 TRP 79 26.935 -7.598 16.380 577 HB3 TRP 79 HB3 TRP 79 26.277 -9.202 16.692 578 HD1 TRP 79 HD1 TRP 79 23.680 -7.006 15.216 579 HE1 TRP 79 HE1 TRP 79 23.371 -7.540 12.717 580 HE3 TRP 79 HE3 TRP 79 27.818 -9.920 14.491 581 HZ2 TRP 79 HZ2 TRP 79 24.704 -9.004 10.706 582 HZ3 TRP 79 HZ3 TRP 79 28.228 -10.849 12.250 583 HH2 TRP 79 HH2 TRP 79 26.703 -10.399 10.398 584 H LYS 80 H LYS 80 26.817 -7.294 19.255 585 HA LYS 80 HA LYS 80 26.405 -9.721 20.678 586 HB2 LYS 80 HB2 LYS 80 28.173 -9.072 22.011 587 HB3 LYS 80 HB3 LYS 80 28.496 -8.141 20.555 588 HG2 LYS 80 HG2 LYS 80 28.685 -6.411 21.952 589 HG3 LYS 80 HG3 LYS 80 26.920 -6.424 21.957 590 HD2 LYS 80 HD2 LYS 80 27.448 -6.414 24.220 591 HD3 LYS 80 HD3 LYS 80 27.172 -8.126 23.889 592 HE2 LYS 80 HE2 LYS 80 29.386 -8.662 24.092 593 HE3 LYS 80 HE3 LYS 80 29.932 -7.065 23.581 594 HZ1 LYS 80 HZ1 LYS 80 29.136 -7.997 26.238 595 HZ2 LYS 80 HZ2 LYS 80 28.807 -6.386 25.839 596 HZ3 LYS 80 HZ3 LYS 80 30.398 -6.961 25.790 597 H ALA 81 H ALA 81 24.834 -6.695 20.717 598 HA ALA 81 HA ALA 81 23.950 -6.704 23.427 599 HB1 ALA 81 HB1 ALA 81 22.127 -5.280 21.764 600 HB2 ALA 81 HB2 ALA 81 23.330 -4.644 22.887 601 HB3 ALA 81 HB3 ALA 81 23.770 -4.961 21.209 602 H LEU 82 H LEU 82 22.496 -7.736 20.360 603 HA LEU 82 HA LEU 82 20.176 -8.792 21.775 604 HB2 LEU 82 HB2 LEU 82 20.810 -8.719 18.829 605 HB3 LEU 82 HB3 LEU 82 19.289 -9.256 19.539 606 HG LEU 82 HG LEU 82 18.802 -7.115 18.798 607 HD11 LEU 82 HD11 LEU 82 18.334 -5.858 20.721 608 HD12 LEU 82 HD12 LEU 82 19.743 -6.484 21.578 609 HD13 LEU 82 HD13 LEU 82 18.361 -7.534 21.269 610 HD21 LEU 82 HD21 LEU 82 21.258 -6.618 18.343 611 HD22 LEU 82 HD22 LEU 82 21.320 -5.989 19.989 612 HD23 LEU 82 HD23 LEU 82 20.236 -5.257 18.805 613 H GLY 83 H GLY 83 23.059 -9.907 21.720 614 HA2 GLY 83 HA2 GLY 83 24.031 -11.984 21.802 615 HA3 GLY 83 HA3 GLY 83 22.403 -12.607 22.026 616 H ILE 84 H ILE 84 23.877 -10.949 19.250 617 HA ILE 84 HA ILE 84 22.984 -13.168 17.556 618 HB ILE 84 HB ILE 84 24.054 -10.513 16.615 619 HG12 ILE 84 HG12 ILE 84 22.122 -10.124 18.086 620 HG13 ILE 84 HG13 ILE 84 21.727 -9.769 16.407 621 HG21 ILE 84 HG21 ILE 84 22.882 -12.897 15.355 622 HG22 ILE 84 HG22 ILE 84 22.270 -11.352 14.765 623 HG23 ILE 84 HG23 ILE 84 23.999 -11.698 14.701 624 HD11 ILE 84 HD11 ILE 84 19.887 -10.916 17.375 625 HD12 ILE 84 HD12 ILE 84 20.685 -12.029 16.263 626 HD13 ILE 84 HD13 ILE 84 20.934 -12.190 18.001 627 H SER 85 H SER 85 24.379 -14.023 15.917 628 HA SER 85 HA SER 85 26.852 -14.864 16.777 629 HB2 SER 85 HB2 SER 85 25.560 -14.688 14.088 630 HB3 SER 85 HB3 SER 85 27.273 -15.104 14.172 631 HG SER 85 HG SER 85 25.781 -16.920 14.241 632 HA PRO 86 HA PRO 86 29.072 -10.971 16.421 633 HB2 PRO 86 HB2 PRO 86 31.287 -11.856 17.718 634 HB3 PRO 86 HB3 PRO 86 29.820 -11.347 18.561 635 HG2 PRO 86 HG2 PRO 86 30.757 -14.109 17.890 636 HG3 PRO 86 HG3 PRO 86 30.036 -13.507 19.394 637 HD2 PRO 86 HD2 PRO 86 28.613 -14.885 17.548 638 HD3 PRO 86 HD3 PRO 86 27.891 -13.618 18.560 639 H MET 87 H MET 87 29.357 -11.078 14.152 640 HA MET 87 HA MET 87 31.969 -12.151 13.361 641 HB2 MET 87 HB2 MET 87 29.482 -12.420 11.667 642 HB3 MET 87 HB3 MET 87 31.088 -13.021 11.283 643 HG2 MET 87 HG2 MET 87 29.447 -13.952 13.624 644 HG3 MET 87 HG3 MET 87 29.502 -14.761 12.060 645 HE1 MET 87 HE1 MET 87 31.283 -16.564 15.101 646 HE2 MET 87 HE2 MET 87 29.738 -16.226 14.320 647 HE3 MET 87 HE3 MET 87 30.887 -17.330 13.562 648 H HIS 88 H HIS 88 33.073 -10.336 12.966 649 HA HIS 88 HA HIS 88 32.038 -7.870 12.210 650 HB2 HIS 88 HB2 HIS 88 34.408 -8.516 13.056 651 HB3 HIS 88 HB3 HIS 88 34.781 -8.745 11.351 652 HD1 HIS 88 HD1 HIS 88 33.343 -6.335 10.138 653 HD2 HIS 88 HD2 HIS 88 35.639 -6.156 13.596 654 HE1 HIS 88 HE1 HIS 88 34.052 -3.932 10.350 655 H GLU 89 H GLU 89 30.801 -7.561 10.469 656 HA GLU 89 HA GLU 89 31.833 -7.605 7.874 657 HB2 GLU 89 HB2 GLU 89 30.380 -9.441 6.927 658 HB3 GLU 89 HB3 GLU 89 31.753 -9.979 7.883 659 HG2 GLU 89 HG2 GLU 89 30.456 -10.828 9.532 660 HG3 GLU 89 HG3 GLU 89 29.189 -9.622 9.309 661 H HIS 90 H HIS 90 30.733 -5.541 8.655 662 HA HIS 90 HA HIS 90 27.849 -5.511 8.493 663 HB2 HIS 90 HB2 HIS 90 28.108 -3.060 8.805 664 HB3 HIS 90 HB3 HIS 90 28.923 -3.998 10.052 665 HD1 HIS 90 HD1 HIS 90 29.555 -1.626 7.262 666 HD2 HIS 90 HD2 HIS 90 31.746 -3.881 9.977 667 HE1 HIS 90 HE1 HIS 90 31.901 -0.730 7.141 668 H ALA 91 H ALA 91 26.778 -5.466 6.641 669 HA ALA 91 HA ALA 91 28.040 -5.041 4.132 670 HB1 ALA 91 HB1 ALA 91 25.072 -4.930 4.516 671 HB2 ALA 91 HB2 ALA 91 25.999 -5.576 3.161 672 HB3 ALA 91 HB3 ALA 91 25.952 -6.448 4.692 673 H GLU 92 H GLU 92 28.694 -3.123 3.423 674 HA GLU 92 HA GLU 92 27.146 -0.733 4.146 675 HB2 GLU 92 HB2 GLU 92 29.154 0.544 3.549 676 HB3 GLU 92 HB3 GLU 92 29.500 -0.663 4.780 677 HG2 GLU 92 HG2 GLU 92 29.949 -1.352 1.921 678 HG3 GLU 92 HG3 GLU 92 31.105 -0.309 2.746 679 H VAL 93 H VAL 93 27.261 1.037 2.405 680 HA VAL 93 HA VAL 93 26.900 -0.142 -0.269 681 HB VAL 93 HB VAL 93 25.117 1.951 0.984 682 HG11 VAL 93 HG11 VAL 93 24.048 0.836 -1.400 683 HG12 VAL 93 HG12 VAL 93 24.502 2.510 -1.074 684 HG13 VAL 93 HG13 VAL 93 25.690 1.385 -1.736 685 HG21 VAL 93 HG21 VAL 93 23.379 0.114 0.575 686 HG22 VAL 93 HG22 VAL 93 24.756 -0.980 0.442 687 HG23 VAL 93 HG23 VAL 93 24.478 -0.088 1.939 688 H VAL 94 H VAL 94 28.471 0.682 -1.486 689 HA VAL 94 HA VAL 94 28.943 3.585 -1.369 690 HB VAL 94 HB VAL 94 31.067 1.470 -1.741 691 HG11 VAL 94 HG11 VAL 94 32.289 3.903 -1.259 692 HG12 VAL 94 HG12 VAL 94 32.172 3.081 -2.817 693 HG13 VAL 94 HG13 VAL 94 30.979 4.300 -2.370 694 HG21 VAL 94 HG21 VAL 94 31.936 2.631 0.400 695 HG22 VAL 94 HG22 VAL 94 30.271 3.183 0.582 696 HG23 VAL 94 HG23 VAL 94 30.628 1.457 0.539 697 H PHE 95 H PHE 95 28.129 4.349 -3.213 698 HA PHE 95 HA PHE 95 29.040 3.148 -5.725 699 HB2 PHE 95 HB2 PHE 95 26.174 3.751 -4.995 700 HB3 PHE 95 HB3 PHE 95 26.711 3.562 -6.661 701 HD1 PHE 95 HD2 PHE 95 28.041 1.351 -7.149 702 HD2 PHE 95 HD1 PHE 95 25.392 1.912 -3.866 703 HE1 PHE 95 HE2 PHE 95 27.764 -1.087 -6.961 704 HE2 PHE 95 HE1 PHE 95 25.111 -0.525 -3.672 705 HZ PHE 95 HZ PHE 95 26.296 -2.028 -5.222 706 H THR 96 H THR 96 29.000 4.591 -7.533 707 HA THR 96 HA THR 96 28.881 7.434 -6.759 708 HB THR 96 HB THR 96 31.189 6.866 -7.100 709 HG1 THR 96 HG1 THR 96 31.642 8.390 -8.648 710 HG21 THR 96 HG21 THR 96 32.013 5.901 -9.190 711 HG22 THR 96 HG22 THR 96 30.361 5.781 -9.795 712 HG23 THR 96 HG23 THR 96 30.865 4.817 -8.407 713 H ALA 97 H ALA 97 28.016 8.890 -8.222 714 HA ALA 97 HA ALA 97 26.151 7.776 -10.116 715 HB1 ALA 97 HB1 ALA 97 25.025 9.584 -9.497 716 HB2 ALA 97 HB2 ALA 97 26.444 10.240 -8.679 717 HB3 ALA 97 HB3 ALA 97 26.185 10.566 -10.392 718 H ASN 98 H ASN 98 25.994 8.508 -12.346 719 HA ASN 98 HA ASN 98 26.827 8.808 -14.441 720 HB2 ASN 98 HB2 ASN 98 29.165 10.269 -13.228 721 HB3 ASN 98 HB3 ASN 98 28.419 10.517 -14.804 722 HD21 ASN 98 HD21 ASN 98 28.947 12.398 -12.622 723 HD22 ASN 98 HD22 ASN 98 27.419 13.104 -12.232 724 H ASP 99 H ASP 99 27.432 6.413 -13.185 725 HA ASP 99 HA ASP 99 29.719 5.584 -14.718 726 HB2 ASP 99 HB2 ASP 99 29.856 5.828 -11.745 727 HB3 ASP 99 HB3 ASP 99 30.640 4.446 -12.505 728 H SER 100 H SER 100 30.186 3.130 -14.044 729 HA SER 100 HA SER 100 27.778 1.738 -14.633 730 HB2 SER 100 HB2 SER 100 29.231 -0.312 -14.323 731 HB3 SER 100 HB3 SER 100 29.817 0.851 -15.513 732 HG SER 100 HG SER 100 31.454 1.362 -14.238 733 H GLY 101 H GLY 101 26.218 1.491 -13.167 734 HA2 GLY 101 HA2 GLY 101 26.602 -0.061 -10.839 735 HA3 GLY 101 HA3 GLY 101 26.511 1.636 -10.394 736 HA PRO 102 HA PRO 102 22.229 -0.326 -10.810 737 HB2 PRO 102 HB2 PRO 102 21.541 -0.194 -8.187 738 HB3 PRO 102 HB3 PRO 102 22.353 -1.593 -8.899 739 HG2 PRO 102 HG2 PRO 102 23.513 0.668 -7.316 740 HG3 PRO 102 HG3 PRO 102 23.859 -1.068 -7.206 741 HD2 PRO 102 HD2 PRO 102 25.480 0.661 -8.516 742 HD3 PRO 102 HD3 PRO 102 25.276 -1.029 -9.024 743 H ARG 103 H ARG 103 23.618 2.448 -9.225 744 HA ARG 103 HA ARG 103 22.909 4.591 -8.939 745 HB2 ARG 103 HB2 ARG 103 21.331 3.679 -11.310 746 HB3 ARG 103 HB3 ARG 103 20.968 5.242 -10.593 747 HG2 ARG 103 HG2 ARG 103 22.491 5.875 -12.157 748 HG3 ARG 103 HG3 ARG 103 23.575 5.560 -10.800 749 HD2 ARG 103 HD2 ARG 103 24.243 3.485 -11.676 750 HD3 ARG 103 HD3 ARG 103 22.893 3.435 -12.809 751 HE ARG 103 HE ARG 103 25.428 4.677 -13.218 752 HH11 ARG 103 HH11 ARG 103 22.042 4.891 -14.002 753 HH12 ARG 103 HH12 ARG 103 22.307 5.727 -15.495 754 HH21 ARG 103 HH21 ARG 103 25.790 5.777 -15.183 755 HH22 ARG 103 HH22 ARG 103 24.439 6.229 -16.168 756 H ARG 104 H ARG 104 21.628 2.364 -7.445 757 HA ARG 104 HA ARG 104 18.883 2.837 -7.085 758 HB2 ARG 104 HB2 ARG 104 21.026 1.514 -5.481 759 HB3 ARG 104 HB3 ARG 104 19.487 1.856 -4.703 760 HG2 ARG 104 HG2 ARG 104 18.345 0.343 -5.975 761 HG3 ARG 104 HG3 ARG 104 19.459 0.483 -7.336 762 HD2 ARG 104 HD2 ARG 104 21.173 -0.697 -5.973 763 HD3 ARG 104 HD3 ARG 104 19.952 -0.940 -4.725 764 HE ARG 104 HE ARG 104 19.055 -1.912 -7.237 765 HH11 ARG 104 HH11 ARG 104 21.169 -2.660 -4.574 766 HH12 ARG 104 HH12 ARG 104 21.083 -4.374 -4.817 767 HH21 ARG 104 HH21 ARG 104 18.933 -4.166 -7.566 768 HH22 ARG 104 HH22 ARG 104 19.811 -5.229 -6.519 769 H TYR 105 H TYR 105 17.921 3.648 -4.997 770 HA TYR 105 HA TYR 105 19.274 6.144 -4.205 771 HB2 TYR 105 HB2 TYR 105 16.302 5.641 -4.077 772 HB3 TYR 105 HB3 TYR 105 17.145 7.180 -3.950 773 HD1 TYR 105 HD2 TYR 105 18.902 7.305 -6.188 774 HD2 TYR 105 HD1 TYR 105 15.008 5.602 -5.985 775 HE1 TYR 105 HE2 TYR 105 18.627 7.659 -8.606 776 HE2 TYR 105 HE1 TYR 105 14.723 5.951 -8.402 777 HH TYR 105 HH TYR 105 16.081 6.252 -10.391 778 H THR 106 H THR 106 17.310 3.437 -3.075 779 HA THR 106 HA THR 106 17.593 4.247 -0.301 780 HB THR 106 HB THR 106 16.295 1.795 -1.508 781 HG1 THR 106 HG1 THR 106 15.365 4.037 -1.775 782 HG21 THR 106 HG21 THR 106 15.212 1.695 0.799 783 HG22 THR 106 HG22 THR 106 16.495 2.782 1.328 784 HG23 THR 106 HG23 THR 106 16.897 1.188 0.690 785 H ILE 107 H ILE 107 18.831 3.238 1.233 786 HA ILE 107 HA ILE 107 21.048 1.656 0.236 787 HB ILE 107 HB ILE 107 20.480 2.749 2.994 788 HG12 ILE 107 HG12 ILE 107 22.689 4.031 2.181 789 HG13 ILE 107 HG13 ILE 107 21.959 3.731 0.607 790 HG21 ILE 107 HG21 ILE 107 23.208 2.133 2.688 791 HG22 ILE 107 HG22 ILE 107 22.038 1.370 3.763 792 HG23 ILE 107 HG23 ILE 107 22.307 0.717 2.148 793 HD11 ILE 107 HD11 ILE 107 20.433 5.006 2.850 794 HD12 ILE 107 HD12 ILE 107 21.431 5.938 1.732 795 HD13 ILE 107 HD13 ILE 107 20.064 5.003 1.125 796 H ALA 108 H ALA 108 20.607 -0.444 -0.062 797 HA ALA 108 HA ALA 108 18.911 -1.871 1.831 798 HB1 ALA 108 HB1 ALA 108 19.174 -2.050 -0.882 799 HB2 ALA 108 HB2 ALA 108 20.125 -3.428 -0.324 800 HB3 ALA 108 HB3 ALA 108 18.433 -3.273 0.153 801 H ALA 109 H ALA 109 19.854 -2.629 3.608 802 HA ALA 109 HA ALA 109 22.496 -3.909 3.346 803 HB1 ALA 109 HB1 ALA 109 21.486 -2.139 5.560 804 HB2 ALA 109 HB2 ALA 109 22.901 -3.182 5.724 805 HB3 ALA 109 HB3 ALA 109 22.891 -1.890 4.522 806 H MET 110 H MET 110 22.172 -6.031 3.520 807 HA MET 110 HA MET 110 20.144 -7.012 5.403 808 HB2 MET 110 HB2 MET 110 21.472 -8.252 3.001 809 HB3 MET 110 HB3 MET 110 20.570 -9.218 4.164 810 HG2 MET 110 HG2 MET 110 18.635 -7.620 3.734 811 HG3 MET 110 HG3 MET 110 19.560 -7.063 2.342 812 HE1 MET 110 HE1 MET 110 18.104 -9.826 4.258 813 HE2 MET 110 HE2 MET 110 16.756 -9.981 3.132 814 HE3 MET 110 HE3 MET 110 18.006 -11.224 3.187 815 H LEU 111 H LEU 111 20.756 -7.881 7.267 816 HA LEU 111 HA LEU 111 23.564 -8.286 7.819 817 HB2 LEU 111 HB2 LEU 111 21.145 -8.698 9.569 818 HB3 LEU 111 HB3 LEU 111 22.822 -8.744 10.108 819 HG LEU 111 HG LEU 111 22.092 -6.645 10.779 820 HD11 LEU 111 HD11 LEU 111 23.274 -5.047 9.411 821 HD12 LEU 111 HD12 LEU 111 23.254 -6.157 8.041 822 HD13 LEU 111 HD13 LEU 111 24.189 -6.554 9.483 823 HD21 LEU 111 HD21 LEU 111 19.987 -6.909 9.260 824 HD22 LEU 111 HD22 LEU 111 20.920 -5.932 8.126 825 HD23 LEU 111 HD23 LEU 111 20.542 -5.302 9.730 826 H SER 112 H SER 112 23.523 -10.047 6.089 827 HA SER 112 HA SER 112 22.288 -12.531 6.591 828 HB2 SER 112 HB2 SER 112 24.375 -13.287 5.091 829 HB3 SER 112 HB3 SER 112 22.983 -12.445 4.410 830 HG SER 112 HG SER 112 25.517 -11.666 4.431 831 HA PRO 113 HA PRO 113 24.786 -14.486 9.620 832 HB2 PRO 113 HB2 PRO 113 24.947 -17.033 8.694 833 HB3 PRO 113 HB3 PRO 113 23.465 -16.350 9.371 834 HG2 PRO 113 HG2 PRO 113 24.257 -16.689 6.504 835 HG3 PRO 113 HG3 PRO 113 22.691 -17.001 7.277 836 HD2 PRO 113 HD2 PRO 113 23.192 -14.753 5.853 837 HD3 PRO 113 HD3 PRO 113 22.091 -14.775 7.246 838 H TYR 114 H TYR 114 26.679 -16.287 9.670 839 HA TYR 114 HA TYR 114 28.952 -14.995 8.601 840 HB2 TYR 114 HB2 TYR 114 28.722 -16.553 10.677 841 HB3 TYR 114 HB3 TYR 114 29.002 -17.852 9.522 842 HD1 TYR 114 HD1 TYR 114 30.502 -14.447 9.884 843 HD2 TYR 114 HD2 TYR 114 31.150 -18.651 9.805 844 HE1 TYR 114 HE1 TYR 114 32.926 -14.071 10.057 845 HE2 TYR 114 HE2 TYR 114 33.576 -18.288 9.980 846 HH TYR 114 HH TYR 114 35.170 -16.727 10.506 847 H SER 115 H SER 115 30.304 -15.522 6.918 848 HA SER 115 HA SER 115 29.218 -16.513 4.576 849 HB2 SER 115 HB2 SER 115 31.390 -15.159 4.950 850 HB3 SER 115 HB3 SER 115 32.166 -16.729 5.151 851 HG SER 115 HG SER 115 32.270 -16.050 2.989 852 H TYR 116 H TYR 116 28.693 -18.480 3.913 853 HA TYR 116 HA TYR 116 29.889 -20.791 5.289 854 HB2 TYR 116 HB2 TYR 116 27.175 -20.285 4.139 855 HB3 TYR 116 HB3 TYR 116 27.783 -21.936 4.188 856 HD1 TYR 116 HD1 TYR 116 29.042 -22.340 6.648 857 HD2 TYR 116 HD2 TYR 116 25.704 -19.828 5.845 858 HE1 TYR 116 HE1 TYR 116 28.340 -22.533 8.998 859 HE2 TYR 116 HE2 TYR 116 24.993 -20.012 8.192 860 HH TYR 116 HH TYR 116 26.251 -22.311 10.318 861 H SER 117 H SER 117 30.235 -22.734 4.000 862 HA SER 117 HA SER 117 31.223 -23.825 2.264 863 HB2 SER 117 HB2 SER 117 28.935 -23.307 1.277 864 HB3 SER 117 HB3 SER 117 29.699 -21.952 0.447 865 HG SER 117 HG SER 117 30.241 -23.364 -1.000 866 H THR 118 H THR 118 32.596 -21.579 3.394 867 HA THR 118 HA THR 118 34.269 -20.847 1.086 868 HB THR 118 HB THR 118 34.730 -18.670 2.423 869 HG1 THR 118 HG1 THR 118 32.179 -19.429 3.453 870 HG21 THR 118 HG21 THR 118 32.749 -17.569 1.353 871 HG22 THR 118 HG22 THR 118 32.156 -19.176 0.931 872 HG23 THR 118 HG23 THR 118 33.684 -18.596 0.269 873 H THR 119 H THR 119 36.473 -20.102 1.775 874 HA THR 119 HA THR 119 37.731 -22.065 3.327 875 HB THR 119 HB THR 119 39.716 -20.465 3.290 876 HG1 THR 119 HG1 THR 119 39.062 -18.469 2.918 877 HG21 THR 119 HG21 THR 119 38.346 -21.745 1.026 878 HG22 THR 119 HG22 THR 119 40.015 -21.898 1.574 879 HG23 THR 119 HG23 THR 119 39.535 -20.525 0.575 880 H ALA 120 H ALA 120 39.192 -21.548 5.224 881 HA ALA 120 HA ALA 120 37.884 -19.679 7.086 882 HB1 ALA 120 HB1 ALA 120 37.284 -22.123 7.451 883 HB2 ALA 120 HB2 ALA 120 38.959 -22.345 7.963 884 HB3 ALA 120 HB3 ALA 120 37.906 -21.237 8.845 885 H VAL 121 H VAL 121 39.246 -18.947 8.846 886 HA VAL 121 HA VAL 121 42.127 -19.172 8.275 887 HB VAL 121 HB VAL 121 42.384 -16.804 8.976 888 HG11 VAL 121 HG11 VAL 121 40.590 -16.340 6.777 889 HG12 VAL 121 HG12 VAL 121 42.353 -16.299 6.812 890 HG13 VAL 121 HG13 VAL 121 41.511 -17.822 6.521 891 HG21 VAL 121 HG21 VAL 121 39.370 -16.811 8.874 892 HG22 VAL 121 HG22 VAL 121 40.379 -16.533 10.294 893 HG23 VAL 121 HG23 VAL 121 40.373 -15.363 8.975 894 H VAL 122 H VAL 122 43.531 -18.861 10.088 895 HA VAL 122 HA VAL 122 42.231 -19.086 12.717 896 HB VAL 122 HB VAL 122 42.867 -21.341 12.072 897 HG11 VAL 122 HG11 VAL 122 45.138 -21.964 11.568 898 HG12 VAL 122 HG12 VAL 122 44.635 -20.684 10.462 899 HG13 VAL 122 HG13 VAL 122 45.690 -20.310 11.825 900 HG21 VAL 122 HG21 VAL 122 43.152 -20.515 14.435 901 HG22 VAL 122 HG22 VAL 122 44.107 -21.936 14.008 902 HG23 VAL 122 HG23 VAL 122 44.873 -20.349 14.086 903 H THR 123 H THR 123 43.292 -18.122 14.413 904 HA THR 123 HA THR 123 45.249 -16.127 13.709 905 HB THR 123 HB THR 123 43.483 -15.555 15.294 906 HG1 THR 123 HG1 THR 123 45.584 -14.564 15.506 907 HG21 THR 123 HG21 THR 123 44.697 -17.770 16.936 908 HG22 THR 123 HG22 THR 123 43.024 -17.597 16.403 909 HG23 THR 123 HG23 THR 123 43.673 -16.517 17.636 910 H ASN 124 H ASN 124 47.361 -15.976 14.426 911 HA ASN 124 HA ASN 124 48.457 -18.263 15.901 912 HB2 ASN 124 HB2 ASN 124 50.494 -17.935 14.244 913 HB3 ASN 124 HB3 ASN 124 49.137 -18.974 13.818 914 HD21 ASN 124 HD21 ASN 124 48.029 -18.550 12.025 915 HD22 ASN 124 HD22 ASN 124 48.226 -17.145 11.041 916 HA PRO 125 HA PRO 125 50.801 -15.322 18.161 917 HB2 PRO 125 HB2 PRO 125 53.148 -16.627 18.556 918 HB3 PRO 125 HB3 PRO 125 51.650 -17.077 19.378 919 HG2 PRO 125 HG2 PRO 125 52.928 -18.303 16.966 920 HG3 PRO 125 HG3 PRO 125 52.176 -19.099 18.360 921 HD2 PRO 125 HD2 PRO 125 50.899 -18.798 15.991 922 HD3 PRO 125 HD3 PRO 125 50.042 -18.789 17.546 923 H LYS 126 H LYS 126 53.150 -14.364 18.260 924 HA LYS 126 HA LYS 126 53.619 -13.114 15.739 925 HB2 LYS 126 HB2 LYS 126 55.084 -11.707 16.866 926 HB3 LYS 126 HB3 LYS 126 53.966 -12.177 18.139 927 HG2 LYS 126 HG2 LYS 126 56.651 -13.449 17.653 928 HG3 LYS 126 HG3 LYS 126 56.320 -12.201 18.857 929 HD2 LYS 126 HD2 LYS 126 54.996 -14.912 18.748 930 HD3 LYS 126 HD3 LYS 126 56.327 -14.473 19.821 931 HE2 LYS 126 HE2 LYS 126 53.575 -13.237 19.774 932 HE3 LYS 126 HE3 LYS 126 54.206 -14.341 20.996 933 HZ1 LYS 126 HZ1 LYS 126 54.524 -11.524 20.787 934 HZ2 LYS 126 HZ2 LYS 126 56.030 -12.290 20.852 935 HZ3 LYS 126 HZ3 LYS 126 54.895 -12.550 22.080 936 H GLU 127 H GLU 127 54.714 -15.994 17.151 937 HA GLU 127 HA GLU 127 57.136 -16.058 15.498 938 HB2 GLU 127 HB2 GLU 127 56.199 -17.652 17.863 939 HB3 GLU 127 HB3 GLU 127 57.449 -18.287 16.803 940 HG2 GLU 127 HG2 GLU 127 58.531 -15.924 17.228 941 HG3 GLU 127 HG3 GLU 127 57.537 -15.992 18.683 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -4.198 2.639 4.642 2 HA2 GLY 1 HA2 GLY 1 -3.897 -0.010 5.810 3 HA3 GLY 1 HA3 GLY 1 -3.888 0.382 4.097 4 HA PRO 2 HA PRO 2 0.462 -0.506 5.596 5 HB2 PRO 2 HB2 PRO 2 0.956 -2.521 3.845 6 HB3 PRO 2 HB3 PRO 2 0.227 -2.786 5.433 7 HG2 PRO 2 HG2 PRO 2 -1.091 -2.589 2.753 8 HG3 PRO 2 HG3 PRO 2 -1.408 -3.729 4.073 9 HD2 PRO 2 HD2 PRO 2 -2.965 -1.562 3.613 10 HD3 PRO 2 HD3 PRO 2 -2.691 -2.212 5.242 11 H THR 3 H THR 3 2.370 -0.994 3.847 12 HA THR 3 HA THR 3 2.777 1.349 2.452 13 HB THR 3 HB THR 3 4.631 0.291 1.349 14 HG1 THR 3 HG1 THR 3 4.825 -1.948 1.245 15 HG21 THR 3 HG21 THR 3 5.823 -0.641 3.218 16 HG22 THR 3 HG22 THR 3 4.314 -1.039 4.041 17 HG23 THR 3 HG23 THR 3 4.779 0.647 3.816 18 H GLY 4 H GLY 4 2.445 2.058 0.382 19 HA2 GLY 4 HA2 GLY 4 1.339 0.271 -1.621 20 HA3 GLY 4 HA3 GLY 4 0.240 1.514 -1.043 21 H THR 5 H THR 5 0.141 3.212 -2.334 22 HA THR 5 HA THR 5 2.616 4.207 -3.563 23 HB THR 5 HB THR 5 1.267 4.747 -5.637 24 HG1 THR 5 HG1 THR 5 -0.479 2.695 -4.758 25 HG21 THR 5 HG21 THR 5 1.485 2.482 -6.573 26 HG22 THR 5 HG22 THR 5 1.678 1.835 -4.943 27 HG23 THR 5 HG23 THR 5 2.891 2.928 -5.606 28 H GLY 6 H GLY 6 1.913 6.396 -4.799 29 HA2 GLY 6 HA2 GLY 6 0.061 8.160 -4.316 30 HA3 GLY 6 HA3 GLY 6 0.696 8.029 -2.683 31 H GLU 7 H GLU 7 3.371 7.941 -3.015 32 HA GLU 7 HA GLU 7 4.176 10.114 -4.773 33 HB2 GLU 7 HB2 GLU 7 3.377 10.910 -2.371 34 HB3 GLU 7 HB3 GLU 7 4.996 10.396 -1.919 35 HG2 GLU 7 HG2 GLU 7 6.010 11.967 -3.341 36 HG3 GLU 7 HG3 GLU 7 4.499 12.286 -4.193 37 H SER 8 H SER 8 6.484 10.329 -4.966 38 HA SER 8 HA SER 8 7.823 7.840 -4.993 39 HB2 SER 8 HB2 SER 8 9.020 10.609 -5.251 40 HB3 SER 8 HB3 SER 8 9.765 9.096 -5.768 41 HG SER 8 HG SER 8 8.185 10.648 -7.169 42 H LYS 9 H LYS 9 9.397 6.989 -3.693 43 HA LYS 9 HA LYS 9 9.339 7.556 -0.959 44 HB2 LYS 9 HB2 LYS 9 11.252 6.041 -0.771 45 HB3 LYS 9 HB3 LYS 9 10.036 5.387 -1.861 46 HG2 LYS 9 HG2 LYS 9 12.156 6.988 -3.128 47 HG3 LYS 9 HG3 LYS 9 12.665 5.458 -2.410 48 HD2 LYS 9 HD2 LYS 9 11.887 4.386 -4.194 49 HD3 LYS 9 HD3 LYS 9 10.262 4.964 -3.816 50 HE2 LYS 9 HE2 LYS 9 10.459 5.868 -5.887 51 HE3 LYS 9 HE3 LYS 9 11.223 7.166 -4.972 52 HZ1 LYS 9 HZ1 LYS 9 12.361 5.383 -6.906 53 HZ2 LYS 9 HZ2 LYS 9 13.265 5.447 -5.478 54 HZ3 LYS 9 HZ3 LYS 9 12.939 6.868 -6.335 55 H CYS 10 H CYS 10 11.177 8.227 0.408 56 HA CYS 10 HA CYS 10 12.016 10.804 -0.111 57 HB2 CYS 10 HB2 CYS 10 12.822 8.685 1.803 58 HB3 CYS 10 HB3 CYS 10 13.950 10.018 1.591 59 HG CYS 10 HG CYS 10 11.309 9.900 3.467 60 HA PRO 11 HA PRO 11 15.475 10.654 -2.802 61 HB2 PRO 11 HB2 PRO 11 17.141 12.509 -1.727 62 HB3 PRO 11 HB3 PRO 11 15.643 12.933 -2.563 63 HG2 PRO 11 HG2 PRO 11 16.177 12.716 0.375 64 HG3 PRO 11 HG3 PRO 11 15.263 13.954 -0.508 65 HD2 PRO 11 HD2 PRO 11 14.058 11.930 0.827 66 HD3 PRO 11 HD3 PRO 11 13.376 12.639 -0.651 67 H LEU 12 H LEU 12 16.244 10.444 0.643 68 HA LEU 12 HA LEU 12 18.219 8.385 0.047 69 HB2 LEU 12 HB2 LEU 12 19.453 10.521 0.124 70 HB3 LEU 12 HB3 LEU 12 18.852 10.784 1.760 71 HG LEU 12 HG LEU 12 21.247 9.922 1.473 72 HD11 LEU 12 HD11 LEU 12 19.348 9.605 3.458 73 HD12 LEU 12 HD12 LEU 12 21.087 9.362 3.618 74 HD13 LEU 12 HD13 LEU 12 20.034 7.992 3.260 75 HD21 LEU 12 HD21 LEU 12 21.575 7.608 1.106 76 HD22 LEU 12 HD22 LEU 12 20.539 8.173 -0.205 77 HD23 LEU 12 HD23 LEU 12 19.842 7.281 1.148 78 H MET 13 H MET 13 17.538 6.710 1.201 79 HA MET 13 HA MET 13 16.906 7.123 4.033 80 HB2 MET 13 HB2 MET 13 14.989 5.603 3.884 81 HB3 MET 13 HB3 MET 13 14.761 7.018 2.865 82 HG2 MET 13 HG2 MET 13 14.856 5.826 0.938 83 HG3 MET 13 HG3 MET 13 15.957 4.623 1.607 84 HE1 MET 13 HE1 MET 13 13.972 2.058 3.272 85 HE2 MET 13 HE2 MET 13 15.399 3.089 3.377 86 HE3 MET 13 HE3 MET 13 13.969 3.460 4.342 87 H VAL 14 H VAL 14 17.337 5.349 5.378 88 HA VAL 14 HA VAL 14 19.166 3.386 4.191 89 HB VAL 14 HB VAL 14 18.785 4.199 7.076 90 HG11 VAL 14 HG11 VAL 14 19.403 1.856 6.928 91 HG12 VAL 14 HG12 VAL 14 20.741 2.257 5.850 92 HG13 VAL 14 HG13 VAL 14 20.761 2.810 7.525 93 HG21 VAL 14 HG21 VAL 14 21.233 4.935 6.676 94 HG22 VAL 14 HG22 VAL 14 20.794 4.896 4.968 95 HG23 VAL 14 HG23 VAL 14 19.926 5.956 6.078 96 H LYS 15 H LYS 15 18.689 1.279 4.114 97 HA LYS 15 HA LYS 15 16.353 0.326 5.636 98 HB2 LYS 15 HB2 LYS 15 15.671 0.462 3.348 99 HB3 LYS 15 HB3 LYS 15 17.157 -0.300 2.795 100 HG2 LYS 15 HG2 LYS 15 15.360 -1.879 2.653 101 HG3 LYS 15 HG3 LYS 15 16.467 -2.383 3.933 102 HD2 LYS 15 HD2 LYS 15 14.303 -0.633 4.845 103 HD3 LYS 15 HD3 LYS 15 13.751 -2.176 4.185 104 HE2 LYS 15 HE2 LYS 15 15.826 -2.981 5.736 105 HE3 LYS 15 HE3 LYS 15 15.245 -1.590 6.650 106 HZ1 LYS 15 HZ1 LYS 15 12.992 -2.599 6.524 107 HZ2 LYS 15 HZ2 LYS 15 14.102 -3.506 7.421 108 HZ3 LYS 15 HZ3 LYS 15 13.689 -3.986 5.852 109 H VAL 16 H VAL 16 17.115 -0.948 7.196 110 HA VAL 16 HA VAL 16 19.203 -2.909 6.493 111 HB VAL 16 HB VAL 16 18.738 -1.625 9.189 112 HG11 VAL 16 HG11 VAL 16 20.348 -3.930 8.284 113 HG12 VAL 16 HG12 VAL 16 21.137 -2.809 9.396 114 HG13 VAL 16 HG13 VAL 16 19.627 -3.595 9.858 115 HG21 VAL 16 HG21 VAL 16 21.034 -0.684 8.773 116 HG22 VAL 16 HG22 VAL 16 20.869 -1.214 7.099 117 HG23 VAL 16 HG23 VAL 16 19.754 -0.018 7.759 118 H LEU 17 H LEU 17 18.525 -4.939 6.535 119 HA LEU 17 HA LEU 17 16.538 -5.751 8.529 120 HB2 LEU 17 HB2 LEU 17 15.071 -6.680 7.035 121 HB3 LEU 17 HB3 LEU 17 15.597 -5.247 6.154 122 HG LEU 17 HG LEU 17 17.369 -7.096 5.248 123 HD11 LEU 17 HD11 LEU 17 15.682 -8.693 6.618 124 HD12 LEU 17 HD12 LEU 17 16.577 -9.200 5.186 125 HD13 LEU 17 HD13 LEU 17 14.898 -8.679 5.037 126 HD21 LEU 17 HD21 LEU 17 14.740 -6.971 3.877 127 HD22 LEU 17 HD22 LEU 17 16.367 -6.751 3.233 128 HD23 LEU 17 HD23 LEU 17 15.598 -5.454 4.149 129 H ASP 18 H ASP 18 16.565 -7.990 9.044 130 HA ASP 18 HA ASP 18 19.188 -9.165 8.797 131 HB2 ASP 18 HB2 ASP 18 18.083 -11.014 10.193 132 HB3 ASP 18 HB3 ASP 18 18.236 -9.424 10.935 133 H ALA 19 H ALA 19 19.803 -10.751 7.462 134 HA ALA 19 HA ALA 19 17.957 -11.654 5.433 135 HB1 ALA 19 HB1 ALA 19 20.827 -12.491 5.788 136 HB2 ALA 19 HB2 ALA 19 19.850 -12.561 4.320 137 HB3 ALA 19 HB3 ALA 19 20.340 -11.001 4.979 138 H VAL 20 H VAL 20 18.659 -12.669 8.501 139 HA VAL 20 HA VAL 20 18.586 -15.521 8.005 140 HB VAL 20 HB VAL 20 18.370 -14.073 10.647 141 HG11 VAL 20 HG11 VAL 20 19.046 -16.926 9.943 142 HG12 VAL 20 HG12 VAL 20 19.189 -16.228 11.557 143 HG13 VAL 20 HG13 VAL 20 17.607 -16.354 10.786 144 HG21 VAL 20 HG21 VAL 20 20.431 -13.394 9.691 145 HG22 VAL 20 HG22 VAL 20 20.814 -14.676 10.838 146 HG23 VAL 20 HG23 VAL 20 20.778 -15.022 9.108 147 H ARG 21 H ARG 21 16.432 -13.030 9.304 148 HA ARG 21 HA ARG 21 14.238 -14.991 9.277 149 HB2 ARG 21 HB2 ARG 21 14.091 -12.330 10.659 150 HB3 ARG 21 HB3 ARG 21 13.172 -13.794 10.982 151 HG2 ARG 21 HG2 ARG 21 14.572 -14.014 12.712 152 HG3 ARG 21 HG3 ARG 21 15.691 -14.645 11.499 153 HD2 ARG 21 HD2 ARG 21 16.679 -12.447 11.230 154 HD3 ARG 21 HD3 ARG 21 15.513 -11.759 12.359 155 HE ARG 21 HE ARG 21 16.973 -13.873 13.565 156 HH11 ARG 21 HH11 ARG 21 17.232 -10.541 12.587 157 HH12 ARG 21 HH12 ARG 21 18.432 -10.150 13.773 158 HH21 ARG 21 HH21 ARG 21 18.553 -13.370 15.132 159 HH22 ARG 21 HH22 ARG 21 19.183 -11.760 15.220 160 H GLY 22 H GLY 22 15.324 -11.886 8.101 161 HA2 GLY 22 HA2 GLY 22 14.609 -10.952 6.052 162 HA3 GLY 22 HA3 GLY 22 13.144 -11.917 6.149 163 H SER 23 H SER 23 13.997 -10.316 9.037 164 HA SER 23 HA SER 23 11.858 -8.356 8.562 165 HB2 SER 23 HB2 SER 23 12.515 -8.408 11.309 166 HB3 SER 23 HB3 SER 23 11.065 -9.051 10.539 167 HG SER 23 HG SER 23 12.874 -10.424 11.785 168 HA PRO 24 HA PRO 24 14.542 -4.908 8.937 169 HB2 PRO 24 HB2 PRO 24 13.102 -3.183 10.461 170 HB3 PRO 24 HB3 PRO 24 12.690 -3.558 8.783 171 HG2 PRO 24 HG2 PRO 24 11.520 -4.653 11.311 172 HG3 PRO 24 HG3 PRO 24 10.694 -4.135 9.829 173 HD2 PRO 24 HD2 PRO 24 11.177 -6.739 10.393 174 HD3 PRO 24 HD3 PRO 24 11.153 -6.109 8.733 175 H ALA 25 H ALA 25 16.126 -4.023 10.218 176 HA ALA 25 HA ALA 25 16.441 -5.220 12.860 177 HB1 ALA 25 HB1 ALA 25 18.257 -5.191 11.057 178 HB2 ALA 25 HB2 ALA 25 18.471 -3.492 11.483 179 HB3 ALA 25 HB3 ALA 25 18.724 -4.745 12.698 180 H ILE 26 H ILE 26 16.433 -4.105 14.741 181 HA ILE 26 HA ILE 26 15.740 -1.252 14.581 182 HB ILE 26 HB ILE 26 14.981 -3.434 16.438 183 HG12 ILE 26 HG12 ILE 26 13.582 -2.166 14.618 184 HG13 ILE 26 HG13 ILE 26 12.841 -2.585 16.158 185 HG21 ILE 26 HG21 ILE 26 16.083 -2.106 18.043 186 HG22 ILE 26 HG22 ILE 26 15.491 -0.608 17.326 187 HG23 ILE 26 HG23 ILE 26 14.377 -1.682 18.171 188 HD11 ILE 26 HD11 ILE 26 13.191 -0.331 16.966 189 HD12 ILE 26 HD12 ILE 26 14.009 0.099 15.464 190 HD13 ILE 26 HD13 ILE 26 12.295 -0.313 15.447 191 H ASN 27 H ASN 27 16.907 0.280 15.638 192 HA ASN 27 HA ASN 27 18.660 1.270 16.696 193 HB2 ASN 27 HB2 ASN 27 18.952 -1.345 18.186 194 HB3 ASN 27 HB3 ASN 27 19.559 0.231 18.687 195 HD21 ASN 27 HD21 ASN 27 17.283 1.743 17.977 196 HD22 ASN 27 HD22 ASN 27 16.014 1.338 19.078 197 H VAL 28 H VAL 28 19.420 0.703 14.329 198 HA VAL 28 HA VAL 28 21.937 -0.818 14.531 199 HB VAL 28 HB VAL 28 20.288 -0.257 12.063 200 HG11 VAL 28 HG11 VAL 28 22.807 -1.883 12.388 201 HG12 VAL 28 HG12 VAL 28 21.866 -1.711 10.905 202 HG13 VAL 28 HG13 VAL 28 22.688 -0.312 11.596 203 HG21 VAL 28 HG21 VAL 28 20.511 -2.983 12.363 204 HG22 VAL 28 HG22 VAL 28 20.275 -2.416 14.016 205 HG23 VAL 28 HG23 VAL 28 19.096 -2.012 12.769 206 H ALA 29 H ALA 29 23.590 0.532 14.797 207 HA ALA 29 HA ALA 29 23.628 3.257 14.250 208 HB1 ALA 29 HB1 ALA 29 25.395 2.883 15.567 209 HB2 ALA 29 HB2 ALA 29 25.584 1.224 14.998 210 HB3 ALA 29 HB3 ALA 29 26.269 2.558 14.069 211 H VAL 30 H VAL 30 23.817 4.413 12.446 212 HA VAL 30 HA VAL 30 25.089 3.210 10.092 213 HB VAL 30 HB VAL 30 22.443 4.666 9.983 214 HG11 VAL 30 HG11 VAL 30 22.539 3.707 7.597 215 HG12 VAL 30 HG12 VAL 30 23.523 5.124 7.968 216 HG13 VAL 30 HG13 VAL 30 24.268 3.525 7.895 217 HG21 VAL 30 HG21 VAL 30 22.004 2.170 8.973 218 HG22 VAL 30 HG22 VAL 30 23.123 1.833 10.294 219 HG23 VAL 30 HG23 VAL 30 21.609 2.680 10.615 220 H HIS 31 H HIS 31 26.380 4.572 8.997 221 HA HIS 31 HA HIS 31 26.183 7.449 9.600 222 HB2 HIS 31 HB2 HIS 31 28.794 6.013 9.133 223 HB3 HIS 31 HB3 HIS 31 28.550 7.645 9.748 224 HD1 HIS 31 HD1 HIS 31 28.313 4.040 10.793 225 HD2 HIS 31 HD2 HIS 31 28.139 7.834 12.478 226 HE1 HIS 31 HE1 HIS 31 28.371 3.673 13.280 227 H VAL 32 H VAL 32 25.853 8.635 7.848 228 HA VAL 32 HA VAL 32 26.500 7.492 5.222 229 HB VAL 32 HB VAL 32 24.777 9.911 5.739 230 HG11 VAL 32 HG11 VAL 32 23.806 9.106 3.515 231 HG12 VAL 32 HG12 VAL 32 25.406 9.850 3.482 232 HG13 VAL 32 HG13 VAL 32 25.245 8.096 3.393 233 HG21 VAL 32 HG21 VAL 32 24.053 6.997 5.751 234 HG22 VAL 32 HG22 VAL 32 23.652 8.239 6.937 235 HG23 VAL 32 HG23 VAL 32 22.872 8.246 5.355 236 H PHE 33 H PHE 33 27.821 8.511 3.786 237 HA PHE 33 HA PHE 33 28.950 11.110 4.551 238 HB2 PHE 33 HB2 PHE 33 30.460 8.589 3.900 239 HB3 PHE 33 HB3 PHE 33 31.189 10.176 3.678 240 HD1 PHE 33 HD1 PHE 33 29.480 8.090 6.241 241 HD2 PHE 33 HD2 PHE 33 32.284 11.190 5.441 242 HE1 PHE 33 HE1 PHE 33 30.115 8.123 8.618 243 HE2 PHE 33 HE2 PHE 33 32.926 11.228 7.817 244 HZ PHE 33 HZ PHE 33 31.841 9.692 9.409 245 H ARG 34 H ARG 34 30.181 12.121 2.723 246 HA ARG 34 HA ARG 34 29.108 11.315 0.105 247 HB2 ARG 34 HB2 ARG 34 27.810 13.222 1.025 248 HB3 ARG 34 HB3 ARG 34 29.295 14.158 1.114 249 HG2 ARG 34 HG2 ARG 34 28.711 13.001 -1.521 250 HG3 ARG 34 HG3 ARG 34 27.568 14.223 -0.959 251 HD2 ARG 34 HD2 ARG 34 29.543 15.697 -0.471 252 HD3 ARG 34 HD3 ARG 34 30.547 14.505 -1.294 253 HE ARG 34 HE ARG 34 28.890 16.464 -2.513 254 HH11 ARG 34 HH11 ARG 34 30.071 13.210 -2.881 255 HH12 ARG 34 HH12 ARG 34 29.933 13.216 -4.608 256 HH21 ARG 34 HH21 ARG 34 28.704 16.484 -4.786 257 HH22 ARG 34 HH22 ARG 34 29.156 15.080 -5.691 258 H LYS 35 H LYS 35 30.410 11.763 -1.683 259 HA LYS 35 HA LYS 35 33.207 11.710 -1.196 260 HB2 LYS 35 HB2 LYS 35 32.595 10.571 -3.126 261 HB3 LYS 35 HB3 LYS 35 31.483 11.834 -3.642 262 HG2 LYS 35 HG2 LYS 35 33.463 11.707 -5.070 263 HG3 LYS 35 HG3 LYS 35 33.343 13.264 -4.247 264 HD2 LYS 35 HD2 LYS 35 35.642 12.345 -4.257 265 HD3 LYS 35 HD3 LYS 35 35.001 12.588 -2.630 266 HE2 LYS 35 HE2 LYS 35 34.408 9.943 -3.675 267 HE3 LYS 35 HE3 LYS 35 36.139 10.270 -3.624 268 HZ1 LYS 35 HZ1 LYS 35 34.235 10.001 -1.434 269 HZ2 LYS 35 HZ2 LYS 35 35.457 11.152 -1.238 270 HZ3 LYS 35 HZ3 LYS 35 35.858 9.534 -1.520 271 H ALA 36 H ALA 36 34.321 13.420 -0.525 272 HA ALA 36 HA ALA 36 33.474 16.111 -0.986 273 HB1 ALA 36 HB1 ALA 36 35.099 16.730 0.490 274 HB2 ALA 36 HB2 ALA 36 34.914 15.037 0.954 275 HB3 ALA 36 HB3 ALA 36 36.247 15.524 -0.094 276 H ALA 37 H ALA 37 34.779 17.763 -2.038 277 HA ALA 37 HA ALA 37 35.437 17.104 -4.685 278 HB1 ALA 37 HB1 ALA 37 36.458 19.562 -3.298 279 HB2 ALA 37 HB2 ALA 37 35.977 19.360 -4.984 280 HB3 ALA 37 HB3 ALA 37 34.755 19.370 -3.713 281 H ASP 38 H ASP 38 37.281 16.945 -1.795 282 HA ASP 38 HA ASP 38 39.829 16.908 -3.219 283 HB2 ASP 38 HB2 ASP 38 38.988 17.161 -0.385 284 HB3 ASP 38 HB3 ASP 38 40.524 16.351 -0.680 285 H ASP 39 H ASP 39 37.588 14.788 -3.248 286 HA ASP 39 HA ASP 39 37.473 12.529 -3.495 287 HB2 ASP 39 HB2 ASP 39 40.460 12.357 -3.205 288 HB3 ASP 39 HB3 ASP 39 39.387 11.359 -4.182 289 H THR 40 H THR 40 37.108 13.561 -0.939 290 HA THR 40 HA THR 40 38.212 11.396 0.730 291 HB THR 40 HB THR 40 38.380 12.825 2.610 292 HG1 THR 40 HG1 THR 40 37.133 14.520 2.819 293 HG21 THR 40 HG21 THR 40 40.231 13.092 1.056 294 HG22 THR 40 HG22 THR 40 39.875 14.632 1.839 295 HG23 THR 40 HG23 THR 40 39.345 14.341 0.182 296 H TRP 41 H TRP 41 36.821 11.320 2.879 297 HA TRP 41 HA TRP 41 34.032 11.054 1.996 298 HB2 TRP 41 HB2 TRP 41 35.639 9.657 4.127 299 HB3 TRP 41 HB3 TRP 41 33.880 9.574 4.091 300 HD1 TRP 41 HD1 TRP 41 35.880 9.486 0.834 301 HE1 TRP 41 HE1 TRP 41 35.606 7.163 -0.239 302 HE3 TRP 41 HE3 TRP 41 33.419 7.121 4.639 303 HZ2 TRP 41 HZ2 TRP 41 34.493 4.658 0.439 304 HZ3 TRP 41 HZ3 TRP 41 32.785 4.762 4.347 305 HH2 TRP 41 HH2 TRP 41 33.311 3.557 2.289 306 H GLU 42 H GLU 42 32.889 12.816 2.506 307 HA GLU 42 HA GLU 42 33.419 14.209 5.020 308 HB2 GLU 42 HB2 GLU 42 31.876 14.913 2.538 309 HB3 GLU 42 HB3 GLU 42 31.670 15.827 4.025 310 HG2 GLU 42 HG2 GLU 42 34.428 15.394 3.018 311 HG3 GLU 42 HG3 GLU 42 33.398 16.550 2.174 312 HA PRO 43 HA PRO 43 29.938 12.563 7.129 313 HB2 PRO 43 HB2 PRO 43 29.283 14.660 8.724 314 HB3 PRO 43 HB3 PRO 43 30.714 13.657 8.993 315 HG2 PRO 43 HG2 PRO 43 30.498 16.335 7.673 316 HG3 PRO 43 HG3 PRO 43 31.711 15.752 8.827 317 HD2 PRO 43 HD2 PRO 43 32.171 15.860 6.161 318 HD3 PRO 43 HD3 PRO 43 32.893 14.619 7.205 319 H PHE 44 H PHE 44 28.072 12.219 6.095 320 HA PHE 44 HA PHE 44 26.589 14.507 5.013 321 HB2 PHE 44 HB2 PHE 44 27.099 12.657 3.458 322 HB3 PHE 44 HB3 PHE 44 26.213 11.549 4.500 323 HD1 PHE 44 HD2 PHE 44 23.752 11.844 4.785 324 HD2 PHE 44 HD1 PHE 44 25.991 14.022 1.895 325 HE1 PHE 44 HE2 PHE 44 21.674 12.376 3.583 326 HE2 PHE 44 HE1 PHE 44 23.915 14.560 0.688 327 HZ PHE 44 HZ PHE 44 21.753 13.735 1.531 328 H ALA 45 H ALA 45 26.215 11.671 7.091 329 HA ALA 45 HA ALA 45 24.385 12.940 8.815 330 HB1 ALA 45 HB1 ALA 45 22.318 12.244 8.176 331 HB2 ALA 45 HB2 ALA 45 23.069 12.358 6.584 332 HB3 ALA 45 HB3 ALA 45 22.928 10.791 7.382 333 H SER 46 H SER 46 23.214 11.182 10.220 334 HA SER 46 HA SER 46 24.374 8.602 10.391 335 HB2 SER 46 HB2 SER 46 26.331 9.247 11.350 336 HB3 SER 46 HB3 SER 46 25.681 10.804 11.865 337 HG SER 46 HG SER 46 26.163 9.366 13.619 338 H GLY 47 H GLY 47 23.385 7.308 11.962 339 HA2 GLY 47 HA2 GLY 47 21.863 8.161 14.125 340 HA3 GLY 47 HA3 GLY 47 20.783 8.123 12.740 341 H LYS 48 H LYS 48 19.559 6.472 13.748 342 HA LYS 48 HA LYS 48 20.790 3.818 13.473 343 HB2 LYS 48 HB2 LYS 48 19.469 4.997 15.852 344 HB3 LYS 48 HB3 LYS 48 19.061 3.328 15.476 345 HG2 LYS 48 HG2 LYS 48 21.424 2.727 15.543 346 HG3 LYS 48 HG3 LYS 48 21.841 4.403 15.908 347 HD2 LYS 48 HD2 LYS 48 20.074 2.655 17.618 348 HD3 LYS 48 HD3 LYS 48 21.789 2.950 17.914 349 HE2 LYS 48 HE2 LYS 48 20.922 5.482 17.716 350 HE3 LYS 48 HE3 LYS 48 19.452 4.716 18.319 351 HZ1 LYS 48 HZ1 LYS 48 21.699 5.471 19.773 352 HZ2 LYS 48 HZ2 LYS 48 21.661 3.779 19.789 353 HZ3 LYS 48 HZ3 LYS 48 20.326 4.661 20.337 354 H THR 49 H THR 49 19.571 2.343 12.434 355 HA THR 49 HA THR 49 17.355 3.115 10.921 356 HB THR 49 HB THR 49 17.078 0.790 10.330 357 HG1 THR 49 HG1 THR 49 17.238 -0.247 12.297 358 HG21 THR 49 HG21 THR 49 18.879 1.287 9.078 359 HG22 THR 49 HG22 THR 49 19.764 0.283 10.226 360 HG23 THR 49 HG23 THR 49 19.729 2.034 10.430 361 H SER 50 H SER 50 15.219 1.825 10.996 362 HA SER 50 HA SER 50 14.254 1.674 13.775 363 HB2 SER 50 HB2 SER 50 13.520 3.783 12.672 364 HB3 SER 50 HB3 SER 50 12.711 2.821 11.435 365 HG SER 50 HG SER 50 11.099 2.964 12.794 366 H GLU 51 H GLU 51 11.983 0.598 13.788 367 HA GLU 51 HA GLU 51 12.307 -2.033 12.780 368 HB2 GLU 51 HB2 GLU 51 9.927 -2.321 13.625 369 HB3 GLU 51 HB3 GLU 51 11.124 -1.828 14.815 370 HG2 GLU 51 HG2 GLU 51 9.943 -0.034 15.320 371 HG3 GLU 51 HG3 GLU 51 9.966 0.498 13.638 372 H SER 52 H SER 52 11.258 0.771 11.299 373 HA SER 52 HA SER 52 9.468 -0.627 9.445 374 HB2 SER 52 HB2 SER 52 8.635 1.486 10.369 375 HB3 SER 52 HB3 SER 52 10.054 2.330 9.751 376 HG SER 52 HG SER 52 7.766 1.666 8.474 377 H GLY 53 H GLY 53 12.662 -0.173 9.725 378 HA2 GLY 53 HA2 GLY 53 14.382 -0.448 8.219 379 HA3 GLY 53 HA3 GLY 53 13.171 -0.708 6.971 380 H GLU 54 H GLU 54 12.978 2.196 8.820 381 HA GLU 54 HA GLU 54 14.286 3.700 6.657 382 HB2 GLU 54 HB2 GLU 54 12.455 5.444 7.009 383 HB3 GLU 54 HB3 GLU 54 12.006 3.981 6.145 384 HG2 GLU 54 HG2 GLU 54 10.758 3.160 7.911 385 HG3 GLU 54 HG3 GLU 54 11.581 4.176 9.095 386 H LEU 55 H LEU 55 15.413 5.510 7.264 387 HA LEU 55 HA LEU 55 15.622 5.977 10.165 388 HB2 LEU 55 HB2 LEU 55 17.595 5.244 8.379 389 HB3 LEU 55 HB3 LEU 55 17.823 6.983 8.549 390 HG LEU 55 HG LEU 55 17.728 5.076 10.882 391 HD11 LEU 55 HD11 LEU 55 20.311 6.233 10.224 392 HD12 LEU 55 HD12 LEU 55 19.708 5.151 8.969 393 HD13 LEU 55 HD13 LEU 55 19.882 4.570 10.625 394 HD21 LEU 55 HD21 LEU 55 17.870 7.960 10.576 395 HD22 LEU 55 HD22 LEU 55 19.211 7.317 11.524 396 HD23 LEU 55 HD23 LEU 55 17.547 6.988 12.012 397 H HIS 56 H HIS 56 14.563 7.764 10.711 398 HA HIS 56 HA HIS 56 14.373 9.986 8.827 399 HB2 HIS 56 HB2 HIS 56 12.750 10.918 10.460 400 HB3 HIS 56 HB3 HIS 56 12.304 9.311 9.895 401 HD1 HIS 56 HD1 HIS 56 12.538 7.349 11.610 402 HD2 HIS 56 HD2 HIS 56 13.251 11.129 13.178 403 HE1 HIS 56 HE1 HIS 56 12.478 7.062 14.107 404 H GLY 57 H GLY 57 15.635 11.723 8.946 405 HA2 GLY 57 HA2 GLY 57 16.407 13.482 10.594 406 HA3 GLY 57 HA3 GLY 57 17.171 12.140 11.434 407 H LEU 58 H LEU 58 17.735 10.972 8.656 408 HA LEU 58 HA LEU 58 20.330 12.223 8.387 409 HB2 LEU 58 HB2 LEU 58 19.157 9.986 6.748 410 HB3 LEU 58 HB3 LEU 58 20.858 10.426 6.892 411 HG LEU 58 HG LEU 58 19.127 9.195 9.034 412 HD11 LEU 58 HD11 LEU 58 21.246 7.556 8.689 413 HD12 LEU 58 HD12 LEU 58 21.025 8.153 7.044 414 HD13 LEU 58 HD13 LEU 58 19.694 7.352 7.877 415 HD21 LEU 58 HD21 LEU 58 21.456 10.817 9.272 416 HD22 LEU 58 HD22 LEU 58 21.875 9.159 9.704 417 HD23 LEU 58 HD23 LEU 58 20.554 9.982 10.537 418 H THR 59 H THR 59 17.312 12.052 6.623 419 HA THR 59 HA THR 59 18.144 13.012 4.138 420 HB THR 59 HB THR 59 15.797 13.843 3.876 421 HG1 THR 59 HG1 THR 59 15.205 12.672 6.371 422 HG21 THR 59 HG21 THR 59 15.268 11.758 3.280 423 HG22 THR 59 HG22 THR 59 15.207 11.235 4.963 424 HG23 THR 59 HG23 THR 59 16.739 11.220 4.089 425 H THR 60 H THR 60 18.923 14.905 3.496 426 HA THR 60 HA THR 60 18.098 17.372 4.783 427 HB THR 60 HB THR 60 20.489 18.126 5.053 428 HG1 THR 60 HG1 THR 60 20.893 15.381 4.493 429 HG21 THR 60 HG21 THR 60 20.796 17.027 7.215 430 HG22 THR 60 HG22 THR 60 19.612 15.798 6.768 431 HG23 THR 60 HG23 THR 60 19.109 17.476 6.973 432 H GLU 61 H GLU 61 19.277 19.285 3.682 433 HA GLU 61 HA GLU 61 18.710 19.179 0.928 434 HB2 GLU 61 HB2 GLU 61 19.680 21.428 0.828 435 HB3 GLU 61 HB3 GLU 61 18.598 21.259 2.203 436 HG2 GLU 61 HG2 GLU 61 20.446 21.065 3.712 437 HG3 GLU 61 HG3 GLU 61 21.591 21.024 2.373 438 H GLU 62 H GLU 62 21.453 18.212 2.684 439 HA GLU 62 HA GLU 62 23.501 18.703 0.818 440 HB2 GLU 62 HB2 GLU 62 23.141 16.966 3.187 441 HB3 GLU 62 HB3 GLU 62 24.385 16.469 2.049 442 HG2 GLU 62 HG2 GLU 62 25.562 18.510 2.308 443 HG3 GLU 62 HG3 GLU 62 24.231 19.236 3.208 444 H GLU 63 H GLU 63 20.879 16.546 0.739 445 HA GLU 63 HA GLU 63 22.001 14.429 -0.762 446 HB2 GLU 63 HB2 GLU 63 19.744 13.741 -1.194 447 HB3 GLU 63 HB3 GLU 63 19.822 14.334 0.459 448 HG2 GLU 63 HG2 GLU 63 17.913 15.353 -0.212 449 HG3 GLU 63 HG3 GLU 63 19.077 16.590 -0.686 450 H PHE 64 H PHE 64 21.309 17.638 -1.575 451 HA PHE 64 HA PHE 64 20.733 17.203 -4.359 452 HB2 PHE 64 HB2 PHE 64 20.107 19.235 -2.822 453 HB3 PHE 64 HB3 PHE 64 21.701 19.826 -3.282 454 HD1 PHE 64 HD2 PHE 64 18.514 18.580 -4.732 455 HD2 PHE 64 HD1 PHE 64 21.977 20.996 -5.259 456 HE1 PHE 64 HE2 PHE 64 17.575 19.462 -6.829 457 HE2 PHE 64 HE1 PHE 64 21.044 21.883 -7.356 458 HZ PHE 64 HZ PHE 64 18.840 21.117 -8.143 459 H VAL 65 H VAL 65 22.833 15.735 -4.190 460 HA VAL 65 HA VAL 65 25.043 17.355 -5.274 461 HB VAL 65 HB VAL 65 26.621 15.663 -4.352 462 HG11 VAL 65 HG11 VAL 65 26.464 16.454 -1.995 463 HG12 VAL 65 HG12 VAL 65 26.371 17.747 -3.192 464 HG13 VAL 65 HG13 VAL 65 24.906 17.179 -2.391 465 HG21 VAL 65 HG21 VAL 65 24.572 14.739 -2.421 466 HG22 VAL 65 HG22 VAL 65 24.533 14.041 -4.039 467 HG23 VAL 65 HG23 VAL 65 25.990 13.905 -3.055 468 H GLU 66 H GLU 66 26.702 15.593 -6.289 469 HA GLU 66 HA GLU 66 25.627 14.785 -8.688 470 HB2 GLU 66 HB2 GLU 66 27.985 13.616 -7.202 471 HB3 GLU 66 HB3 GLU 66 27.616 13.286 -8.889 472 HG2 GLU 66 HG2 GLU 66 27.663 15.909 -9.067 473 HG3 GLU 66 HG3 GLU 66 28.664 15.760 -7.622 474 H GLY 67 H GLY 67 26.032 12.862 -5.733 475 HA2 GLY 67 HA2 GLY 67 23.928 11.376 -5.495 476 HA3 GLY 67 HA3 GLY 67 24.519 10.678 -6.995 477 H ILE 68 H ILE 68 27.264 11.460 -5.524 478 HA ILE 68 HA ILE 68 27.861 8.784 -4.770 479 HB ILE 68 HB ILE 68 29.471 11.255 -4.130 480 HG12 ILE 68 HG12 ILE 68 29.703 9.473 -6.561 481 HG13 ILE 68 HG13 ILE 68 28.874 11.025 -6.563 482 HG21 ILE 68 HG21 ILE 68 30.675 9.730 -3.011 483 HG22 ILE 68 HG22 ILE 68 29.892 8.376 -3.823 484 HG23 ILE 68 HG23 ILE 68 31.224 9.224 -4.609 485 HD11 ILE 68 HD11 ILE 68 31.038 12.054 -5.808 486 HD12 ILE 68 HD12 ILE 68 31.796 10.496 -6.135 487 HD13 ILE 68 HD13 ILE 68 31.029 11.395 -7.444 488 H TYR 69 H TYR 69 27.336 7.817 -2.936 489 HA TYR 69 HA TYR 69 27.425 9.336 -0.435 490 HB2 TYR 69 HB2 TYR 69 25.105 7.549 -1.193 491 HB3 TYR 69 HB3 TYR 69 25.292 8.438 0.315 492 HD1 TYR 69 HD2 TYR 69 25.809 11.082 -0.172 493 HD2 TYR 69 HD1 TYR 69 23.597 8.447 -2.676 494 HE1 TYR 69 HE2 TYR 69 24.643 13.009 -1.160 495 HE2 TYR 69 HE1 TYR 69 22.426 10.367 -3.672 496 HH TYR 69 HH TYR 69 22.094 13.153 -2.452 497 H LYS 70 H LYS 70 28.049 8.165 1.341 498 HA LYS 70 HA LYS 70 28.623 5.308 0.905 499 HB2 LYS 70 HB2 LYS 70 30.358 7.298 2.383 500 HB3 LYS 70 HB3 LYS 70 30.681 5.576 2.224 501 HG2 LYS 70 HG2 LYS 70 31.781 5.964 0.348 502 HG3 LYS 70 HG3 LYS 70 30.309 6.610 -0.382 503 HD2 LYS 70 HD2 LYS 70 30.936 8.776 0.917 504 HD3 LYS 70 HD3 LYS 70 32.549 8.059 0.973 505 HE2 LYS 70 HE2 LYS 70 30.992 8.375 -1.582 506 HE3 LYS 70 HE3 LYS 70 32.067 9.627 -0.962 507 HZ1 LYS 70 HZ1 LYS 70 33.183 8.215 -2.572 508 HZ2 LYS 70 HZ2 LYS 70 32.862 6.845 -1.633 509 HZ3 LYS 70 HZ3 LYS 70 33.895 8.050 -1.046 510 H VAL 71 H VAL 71 27.110 4.329 2.116 511 HA VAL 71 HA VAL 71 26.591 5.339 4.824 512 HB VAL 71 HB VAL 71 25.034 3.345 3.172 513 HG11 VAL 71 HG11 VAL 71 23.316 3.910 5.068 514 HG12 VAL 71 HG12 VAL 71 24.548 2.670 5.315 515 HG13 VAL 71 HG13 VAL 71 24.772 4.286 5.989 516 HG21 VAL 71 HG21 VAL 71 24.606 6.249 3.820 517 HG22 VAL 71 HG22 VAL 71 24.694 5.483 2.234 518 HG23 VAL 71 HG23 VAL 71 23.299 5.197 3.276 519 H GLU 72 H GLU 72 27.510 4.356 6.491 520 HA GLU 72 HA GLU 72 28.445 1.584 6.149 521 HB2 GLU 72 HB2 GLU 72 30.415 2.560 6.678 522 HB3 GLU 72 HB3 GLU 72 29.641 3.966 7.393 523 HG2 GLU 72 HG2 GLU 72 29.404 2.931 9.470 524 HG3 GLU 72 HG3 GLU 72 29.671 1.323 8.799 525 H ILE 73 H ILE 73 27.790 0.037 7.539 526 HA ILE 73 HA ILE 73 25.982 0.870 9.712 527 HB ILE 73 HB ILE 73 25.958 -1.721 8.160 528 HG12 ILE 73 HG12 ILE 73 23.530 -0.172 8.042 529 HG13 ILE 73 HG13 ILE 73 24.892 0.808 7.511 530 HG21 ILE 73 HG21 ILE 73 23.579 -1.532 9.509 531 HG22 ILE 73 HG22 ILE 73 24.960 -2.512 9.997 532 HG23 ILE 73 HG23 ILE 73 24.737 -0.901 10.678 533 HD11 ILE 73 HD11 ILE 73 23.618 -0.538 5.758 534 HD12 ILE 73 HD12 ILE 73 25.379 -0.623 5.741 535 HD13 ILE 73 HD13 ILE 73 24.439 -1.946 6.431 536 H ASP 74 H ASP 74 26.441 0.263 11.736 537 HA ASP 74 HA ASP 74 28.813 -1.406 12.153 538 HB2 ASP 74 HB2 ASP 74 27.968 0.988 13.318 539 HB3 ASP 74 HB3 ASP 74 27.691 -0.231 14.559 540 H THR 75 H THR 75 28.131 -3.491 12.073 541 HA THR 75 HA THR 75 25.725 -4.327 13.451 542 HB THR 75 HB THR 75 26.123 -6.514 12.551 543 HG1 THR 75 HG1 THR 75 28.212 -6.998 12.639 544 HG21 THR 75 HG21 THR 75 26.303 -6.036 10.146 545 HG22 THR 75 HG22 THR 75 26.893 -4.416 10.519 546 HG23 THR 75 HG23 THR 75 25.251 -4.881 10.964 547 H LYS 76 H LYS 76 29.104 -4.143 14.083 548 HA LYS 76 HA LYS 76 29.537 -6.182 15.893 549 HB2 LYS 76 HB2 LYS 76 31.292 -4.775 16.856 550 HB3 LYS 76 HB3 LYS 76 31.307 -4.684 15.100 551 HG2 LYS 76 HG2 LYS 76 31.498 -2.479 15.532 552 HG3 LYS 76 HG3 LYS 76 29.738 -2.586 15.612 553 HD2 LYS 76 HD2 LYS 76 30.152 -1.492 17.577 554 HD3 LYS 76 HD3 LYS 76 30.239 -3.162 18.141 555 HE2 LYS 76 HE2 LYS 76 32.526 -3.112 18.357 556 HE3 LYS 76 HE3 LYS 76 32.720 -1.853 17.138 557 HZ1 LYS 76 HZ1 LYS 76 33.156 -0.768 19.118 558 HZ2 LYS 76 HZ2 LYS 76 31.937 -1.576 19.967 559 HZ3 LYS 76 HZ3 LYS 76 31.534 -0.377 18.843 560 H SER 77 H SER 77 27.989 -3.054 16.408 561 HA SER 77 HA SER 77 27.582 -3.629 19.233 562 HB2 SER 77 HB2 SER 77 26.311 -1.343 19.024 563 HB3 SER 77 HB3 SER 77 28.073 -1.373 18.981 564 HG SER 77 HG SER 77 26.454 -0.401 17.160 565 H TYR 78 H TYR 78 25.994 -4.145 16.298 566 HA TYR 78 HA TYR 78 23.297 -3.964 17.270 567 HB2 TYR 78 HB2 TYR 78 23.677 -3.607 14.920 568 HB3 TYR 78 HB3 TYR 78 24.476 -5.168 14.760 569 HD1 TYR 78 HD1 TYR 78 21.218 -4.003 16.193 570 HD2 TYR 78 HD2 TYR 78 23.223 -6.675 13.558 571 HE1 TYR 78 HE1 TYR 78 19.064 -5.039 15.613 572 HE2 TYR 78 HE2 TYR 78 21.075 -7.716 12.969 573 HH TYR 78 HH TYR 78 18.049 -6.350 13.913 574 H TRP 79 H TRP 79 25.645 -6.545 16.735 575 HA TRP 79 HA TRP 79 23.806 -8.630 17.473 576 HB2 TRP 79 HB2 TRP 79 25.574 -10.135 17.076 577 HB3 TRP 79 HB3 TRP 79 25.828 -8.840 15.908 578 HD1 TRP 79 HD1 TRP 79 28.082 -7.538 16.029 579 HE1 TRP 79 HE1 TRP 79 30.186 -7.730 17.500 580 HE3 TRP 79 HE3 TRP 79 26.298 -10.753 19.582 581 HZ2 TRP 79 HZ2 TRP 79 30.984 -9.067 19.854 582 HZ3 TRP 79 HZ3 TRP 79 27.796 -11.440 21.409 583 HH2 TRP 79 HH2 TRP 79 30.090 -10.613 21.540 584 H LYS 80 H LYS 80 25.997 -6.532 19.116 585 HA LYS 80 HA LYS 80 26.280 -8.163 21.465 586 HB2 LYS 80 HB2 LYS 80 27.679 -6.521 22.269 587 HB3 LYS 80 HB3 LYS 80 27.823 -6.246 20.538 588 HG2 LYS 80 HG2 LYS 80 27.442 -4.112 21.133 589 HG3 LYS 80 HG3 LYS 80 25.754 -4.626 21.081 590 HD2 LYS 80 HD2 LYS 80 25.818 -3.641 23.150 591 HD3 LYS 80 HD3 LYS 80 26.230 -5.302 23.583 592 HE2 LYS 80 HE2 LYS 80 27.860 -4.128 24.703 593 HE3 LYS 80 HE3 LYS 80 28.681 -4.490 23.185 594 HZ1 LYS 80 HZ1 LYS 80 28.663 -2.338 22.559 595 HZ2 LYS 80 HZ2 LYS 80 28.569 -2.059 24.224 596 HZ3 LYS 80 HZ3 LYS 80 27.168 -2.006 23.277 597 H ALA 81 H ALA 81 23.915 -6.024 20.250 598 HA ALA 81 HA ALA 81 22.811 -5.368 22.856 599 HB1 ALA 81 HB1 ALA 81 22.198 -3.577 21.686 600 HB2 ALA 81 HB2 ALA 81 22.517 -4.379 20.148 601 HB3 ALA 81 HB3 ALA 81 20.960 -4.594 20.948 602 H LEU 82 H LEU 82 21.906 -7.286 20.009 603 HA LEU 82 HA LEU 82 19.674 -8.442 21.512 604 HB2 LEU 82 HB2 LEU 82 20.409 -8.687 18.598 605 HB3 LEU 82 HB3 LEU 82 18.979 -9.387 19.354 606 HG LEU 82 HG LEU 82 18.155 -7.497 18.292 607 HD11 LEU 82 HD11 LEU 82 17.428 -6.037 20.013 608 HD12 LEU 82 HD12 LEU 82 18.836 -6.399 21.010 609 HD13 LEU 82 HD13 LEU 82 17.605 -7.633 20.741 610 HD21 LEU 82 HD21 LEU 82 19.228 -5.413 18.082 611 HD22 LEU 82 HD22 LEU 82 20.489 -6.618 17.815 612 HD23 LEU 82 HD23 LEU 82 20.380 -5.785 19.366 613 H GLY 83 H GLY 83 22.809 -9.034 21.358 614 HA2 GLY 83 HA2 GLY 83 24.137 -10.878 21.677 615 HA3 GLY 83 HA3 GLY 83 22.691 -11.646 22.314 616 H ILE 84 H ILE 84 23.465 -10.521 19.034 617 HA ILE 84 HA ILE 84 22.601 -13.098 17.990 618 HB ILE 84 HB ILE 84 23.525 -10.724 16.381 619 HG12 ILE 84 HG12 ILE 84 21.726 -10.004 17.888 620 HG13 ILE 84 HG13 ILE 84 21.165 -10.060 16.220 621 HG21 ILE 84 HG21 ILE 84 21.786 -11.827 14.794 622 HG22 ILE 84 HG22 ILE 84 23.398 -12.524 14.941 623 HG23 ILE 84 HG23 ILE 84 22.043 -13.252 15.801 624 HD11 ILE 84 HD11 ILE 84 19.438 -10.966 17.526 625 HD12 ILE 84 HD12 ILE 84 20.229 -12.342 16.757 626 HD13 ILE 84 HD13 ILE 84 20.555 -11.970 18.449 627 H SER 85 H SER 85 23.867 -14.256 16.405 628 HA SER 85 HA SER 85 26.407 -14.926 17.213 629 HB2 SER 85 HB2 SER 85 24.907 -15.266 14.652 630 HB3 SER 85 HB3 SER 85 26.627 -15.658 14.674 631 HG SER 85 HG SER 85 24.714 -17.216 15.420 632 HA PRO 86 HA PRO 86 29.233 -11.885 15.799 633 HB2 PRO 86 HB2 PRO 86 31.338 -13.388 14.972 634 HB3 PRO 86 HB3 PRO 86 30.916 -13.181 16.677 635 HG2 PRO 86 HG2 PRO 86 30.299 -15.460 14.837 636 HG3 PRO 86 HG3 PRO 86 30.848 -15.500 16.522 637 HD2 PRO 86 HD2 PRO 86 28.257 -15.866 15.826 638 HD3 PRO 86 HD3 PRO 86 28.736 -15.096 17.352 639 H MET 87 H MET 87 30.270 -10.957 13.948 640 HA MET 87 HA MET 87 30.244 -12.150 11.387 641 HB2 MET 87 HB2 MET 87 27.839 -11.881 11.526 642 HB3 MET 87 HB3 MET 87 28.020 -10.189 11.970 643 HG2 MET 87 HG2 MET 87 27.362 -10.421 9.647 644 HG3 MET 87 HG3 MET 87 28.964 -9.698 9.786 645 HE1 MET 87 HE1 MET 87 28.552 -13.736 10.240 646 HE2 MET 87 HE2 MET 87 27.093 -12.992 9.585 647 HE3 MET 87 HE3 MET 87 28.087 -14.034 8.565 648 H HIS 88 H HIS 88 32.355 -11.297 11.473 649 HA HIS 88 HA HIS 88 32.689 -8.414 11.610 650 HB2 HIS 88 HB2 HIS 88 34.751 -10.583 11.170 651 HB3 HIS 88 HB3 HIS 88 35.088 -8.887 11.504 652 HD1 HIS 88 HD1 HIS 88 32.607 -9.032 13.736 653 HD2 HIS 88 HD2 HIS 88 36.177 -11.152 13.589 654 HE1 HIS 88 HE1 HIS 88 33.050 -9.770 16.100 655 H GLU 89 H GLU 89 31.196 -8.527 9.560 656 HA GLU 89 HA GLU 89 32.980 -8.198 7.263 657 HB2 GLU 89 HB2 GLU 89 30.632 -10.039 7.441 658 HB3 GLU 89 HB3 GLU 89 30.963 -9.234 5.913 659 HG2 GLU 89 HG2 GLU 89 32.012 -11.344 5.814 660 HG3 GLU 89 HG3 GLU 89 33.291 -10.153 6.042 661 H HIS 90 H HIS 90 31.504 -6.415 9.128 662 HA HIS 90 HA HIS 90 29.226 -5.285 8.063 663 HB2 HIS 90 HB2 HIS 90 30.106 -3.118 9.111 664 HB3 HIS 90 HB3 HIS 90 29.911 -4.504 10.179 665 HD1 HIS 90 HD1 HIS 90 32.049 -5.562 11.153 666 HD2 HIS 90 HD2 HIS 90 32.756 -2.308 8.668 667 HE1 HIS 90 HE1 HIS 90 34.459 -4.945 11.522 668 H ALA 91 H ALA 91 28.969 -4.836 5.964 669 HA ALA 91 HA ALA 91 31.133 -3.542 4.483 670 HB1 ALA 91 HB1 ALA 91 29.581 -3.955 2.514 671 HB2 ALA 91 HB2 ALA 91 30.260 -5.379 3.302 672 HB3 ALA 91 HB3 ALA 91 28.594 -4.901 3.628 673 H GLU 92 H GLU 92 30.252 -1.917 2.760 674 HA GLU 92 HA GLU 92 28.217 -0.163 3.931 675 HB2 GLU 92 HB2 GLU 92 30.661 1.122 2.806 676 HB3 GLU 92 HB3 GLU 92 29.555 1.706 4.041 677 HG2 GLU 92 HG2 GLU 92 30.498 0.120 5.640 678 HG3 GLU 92 HG3 GLU 92 31.609 -0.464 4.402 679 H VAL 93 H VAL 93 27.167 1.205 2.452 680 HA VAL 93 HA VAL 93 27.267 0.237 -0.295 681 HB VAL 93 HB VAL 93 25.323 2.127 1.039 682 HG11 VAL 93 HG11 VAL 93 24.001 1.268 -1.112 683 HG12 VAL 93 HG12 VAL 93 25.007 2.718 -1.130 684 HG13 VAL 93 HG13 VAL 93 25.642 1.195 -1.754 685 HG21 VAL 93 HG21 VAL 93 25.407 -0.817 0.669 686 HG22 VAL 93 HG22 VAL 93 24.763 0.137 2.004 687 HG23 VAL 93 HG23 VAL 93 23.847 -0.012 0.504 688 H VAL 94 H VAL 94 28.691 1.198 -1.592 689 HA VAL 94 HA VAL 94 28.822 4.140 -1.565 690 HB VAL 94 HB VAL 94 31.172 2.298 -2.027 691 HG11 VAL 94 HG11 VAL 94 30.779 5.247 -2.231 692 HG12 VAL 94 HG12 VAL 94 32.344 4.618 -1.710 693 HG13 VAL 94 HG13 VAL 94 31.685 4.157 -3.280 694 HG21 VAL 94 HG21 VAL 94 31.908 3.671 0.119 695 HG22 VAL 94 HG22 VAL 94 30.164 3.716 0.380 696 HG23 VAL 94 HG23 VAL 94 30.995 2.167 0.243 697 H PHE 95 H PHE 95 27.857 4.756 -3.390 698 HA PHE 95 HA PHE 95 28.705 3.479 -5.899 699 HB2 PHE 95 HB2 PHE 95 26.390 3.776 -6.765 700 HB3 PHE 95 HB3 PHE 95 26.488 2.634 -5.430 701 HD1 PHE 95 HD1 PHE 95 25.471 6.041 -6.389 702 HD2 PHE 95 HD2 PHE 95 25.354 3.025 -3.388 703 HE1 PHE 95 HE1 PHE 95 23.746 7.313 -5.182 704 HE2 PHE 95 HE2 PHE 95 23.628 4.293 -2.177 705 HZ PHE 95 HZ PHE 95 22.823 6.440 -3.072 706 H THR 96 H THR 96 28.988 4.828 -7.641 707 HA THR 96 HA THR 96 28.906 7.703 -7.029 708 HB THR 96 HB THR 96 31.135 6.993 -7.553 709 HG1 THR 96 HG1 THR 96 31.483 8.271 -9.463 710 HG21 THR 96 HG21 THR 96 29.767 5.445 -9.665 711 HG22 THR 96 HG22 THR 96 31.207 5.055 -8.725 712 HG23 THR 96 HG23 THR 96 31.324 6.145 -10.106 713 H ALA 97 H ALA 97 27.933 9.150 -8.403 714 HA ALA 97 HA ALA 97 25.885 8.084 -10.127 715 HB1 ALA 97 HB1 ALA 97 24.842 9.995 -9.680 716 HB2 ALA 97 HB2 ALA 97 26.191 10.407 -8.621 717 HB3 ALA 97 HB3 ALA 97 26.192 10.947 -10.300 718 H ASN 98 H ASN 98 25.565 8.811 -12.342 719 HA ASN 98 HA ASN 98 26.234 9.024 -14.505 720 HB2 ASN 98 HB2 ASN 98 28.516 10.620 -13.321 721 HB3 ASN 98 HB3 ASN 98 27.997 10.643 -15.003 722 HD21 ASN 98 HD21 ASN 98 27.389 11.756 -11.806 723 HD22 ASN 98 HD22 ASN 98 26.107 12.846 -12.197 724 H ASP 99 H ASP 99 27.114 6.742 -12.982 725 HA ASP 99 HA ASP 99 29.647 6.129 -14.360 726 HB2 ASP 99 HB2 ASP 99 30.035 6.016 -12.010 727 HB3 ASP 99 HB3 ASP 99 28.546 5.115 -11.739 728 H SER 100 H SER 100 26.636 4.632 -13.188 729 HA SER 100 HA SER 100 26.738 2.838 -15.523 730 HB2 SER 100 HB2 SER 100 27.213 1.524 -13.541 731 HB3 SER 100 HB3 SER 100 25.805 2.192 -12.716 732 HG SER 100 HG SER 100 25.940 0.076 -14.342 733 H GLY 101 H GLY 101 24.316 3.488 -12.995 734 HA2 GLY 101 HA2 GLY 101 22.558 5.164 -14.060 735 HA3 GLY 101 HA3 GLY 101 22.282 3.754 -15.071 736 HA PRO 102 HA PRO 102 21.010 2.491 -10.570 737 HB2 PRO 102 HB2 PRO 102 20.836 4.509 -8.763 738 HB3 PRO 102 HB3 PRO 102 22.312 3.570 -9.015 739 HG2 PRO 102 HG2 PRO 102 21.581 6.269 -10.081 740 HG3 PRO 102 HG3 PRO 102 23.124 5.713 -9.409 741 HD2 PRO 102 HD2 PRO 102 22.684 5.916 -12.073 742 HD3 PRO 102 HD3 PRO 102 23.752 4.683 -11.374 743 H ARG 103 H ARG 103 18.923 2.554 -9.578 744 HA ARG 103 HA ARG 103 17.057 4.428 -10.882 745 HB2 ARG 103 HB2 ARG 103 16.886 1.498 -10.346 746 HB3 ARG 103 HB3 ARG 103 15.405 2.442 -10.286 747 HG2 ARG 103 HG2 ARG 103 16.171 3.327 -12.599 748 HG3 ARG 103 HG3 ARG 103 17.204 1.896 -12.604 749 HD2 ARG 103 HD2 ARG 103 14.259 1.733 -12.034 750 HD3 ARG 103 HD3 ARG 103 14.894 1.693 -13.679 751 HE ARG 103 HE ARG 103 16.158 -0.215 -11.965 752 HH11 ARG 103 HH11 ARG 103 13.352 0.391 -13.933 753 HH12 ARG 103 HH12 ARG 103 13.030 -1.287 -14.222 754 HH21 ARG 103 HH21 ARG 103 15.746 -2.428 -12.338 755 HH22 ARG 103 HH22 ARG 103 14.392 -2.889 -13.313 756 H ARG 104 H ARG 104 17.199 2.263 -8.044 757 HA ARG 104 HA ARG 104 15.406 3.947 -6.556 758 HB2 ARG 104 HB2 ARG 104 17.030 1.531 -5.742 759 HB3 ARG 104 HB3 ARG 104 15.868 2.343 -4.700 760 HG2 ARG 104 HG2 ARG 104 14.975 1.383 -7.372 761 HG3 ARG 104 HG3 ARG 104 15.202 0.214 -6.069 762 HD2 ARG 104 HD2 ARG 104 13.574 1.239 -4.721 763 HD3 ARG 104 HD3 ARG 104 13.578 2.710 -5.691 764 HE ARG 104 HE ARG 104 12.080 0.314 -6.189 765 HH11 ARG 104 HH11 ARG 104 13.514 3.135 -7.640 766 HH12 ARG 104 HH12 ARG 104 12.445 3.137 -9.003 767 HH21 ARG 104 HH21 ARG 104 10.668 0.306 -7.979 768 HH22 ARG 104 HH22 ARG 104 10.827 1.527 -9.195 769 H TYR 105 H TYR 105 15.965 4.792 -4.397 770 HA TYR 105 HA TYR 105 18.765 5.701 -4.265 771 HB2 TYR 105 HB2 TYR 105 16.395 7.347 -3.381 772 HB3 TYR 105 HB3 TYR 105 18.064 7.873 -3.565 773 HD1 TYR 105 HD2 TYR 105 19.051 7.863 -5.934 774 HD2 TYR 105 HD1 TYR 105 14.879 7.592 -5.143 775 HE1 TYR 105 HE2 TYR 105 18.574 8.591 -8.234 776 HE2 TYR 105 HE1 TYR 105 14.390 8.320 -7.441 777 HH TYR 105 HH TYR 105 15.297 8.630 -9.506 778 H THR 106 H THR 106 17.342 3.455 -2.946 779 HA THR 106 HA THR 106 17.583 4.310 -0.138 780 HB THR 106 HB THR 106 16.092 1.944 -1.289 781 HG1 THR 106 HG1 THR 106 14.431 3.250 -1.258 782 HG21 THR 106 HG21 THR 106 16.767 1.169 0.792 783 HG22 THR 106 HG22 THR 106 15.213 1.918 1.159 784 HG23 THR 106 HG23 THR 106 16.712 2.773 1.520 785 H ILE 107 H ILE 107 18.907 3.208 1.257 786 HA ILE 107 HA ILE 107 20.976 1.590 0.024 787 HB ILE 107 HB ILE 107 20.680 2.625 2.845 788 HG12 ILE 107 HG12 ILE 107 22.915 3.775 1.808 789 HG13 ILE 107 HG13 ILE 107 21.919 3.639 0.363 790 HG21 ILE 107 HG21 ILE 107 22.394 0.573 1.762 791 HG22 ILE 107 HG22 ILE 107 23.336 1.922 2.394 792 HG23 ILE 107 HG23 ILE 107 22.180 1.092 3.434 793 HD11 ILE 107 HD11 ILE 107 20.707 4.782 2.821 794 HD12 ILE 107 HD12 ILE 107 21.827 5.767 1.881 795 HD13 ILE 107 HD13 ILE 107 20.368 5.127 1.126 796 H ALA 108 H ALA 108 20.639 -0.517 -0.206 797 HA ALA 108 HA ALA 108 18.923 -1.948 1.666 798 HB1 ALA 108 HB1 ALA 108 20.205 -3.457 -0.505 799 HB2 ALA 108 HB2 ALA 108 18.516 -3.409 0.006 800 HB3 ALA 108 HB3 ALA 108 19.163 -2.132 -1.024 801 H ALA 109 H ALA 109 19.840 -2.700 3.458 802 HA ALA 109 HA ALA 109 22.494 -3.964 3.241 803 HB1 ALA 109 HB1 ALA 109 21.542 -2.571 5.725 804 HB2 ALA 109 HB2 ALA 109 23.179 -3.076 5.302 805 HB3 ALA 109 HB3 ALA 109 22.427 -1.725 4.455 806 H MET 110 H MET 110 22.177 -6.088 3.410 807 HA MET 110 HA MET 110 20.147 -7.074 5.293 808 HB2 MET 110 HB2 MET 110 21.397 -8.255 2.827 809 HB3 MET 110 HB3 MET 110 20.588 -9.276 4.008 810 HG2 MET 110 HG2 MET 110 18.579 -7.750 3.725 811 HG3 MET 110 HG3 MET 110 19.413 -7.100 2.315 812 HE1 MET 110 HE1 MET 110 17.865 -11.348 2.926 813 HE2 MET 110 HE2 MET 110 18.307 -10.159 4.151 814 HE3 MET 110 HE3 MET 110 16.795 -9.985 3.260 815 H LEU 111 H LEU 111 20.774 -7.996 7.129 816 HA LEU 111 HA LEU 111 23.595 -8.449 7.612 817 HB2 LEU 111 HB2 LEU 111 21.250 -8.848 9.463 818 HB3 LEU 111 HB3 LEU 111 22.952 -8.805 9.917 819 HG LEU 111 HG LEU 111 22.221 -6.717 10.562 820 HD11 LEU 111 HD11 LEU 111 23.167 -5.107 9.044 821 HD12 LEU 111 HD12 LEU 111 23.045 -6.245 7.703 822 HD13 LEU 111 HD13 LEU 111 24.158 -6.567 9.032 823 HD21 LEU 111 HD21 LEU 111 20.790 -5.951 8.104 824 HD22 LEU 111 HD22 LEU 111 20.397 -5.637 9.795 825 HD23 LEU 111 HD23 LEU 111 20.024 -7.207 9.079 826 H SER 112 H SER 112 24.364 -10.291 6.767 827 HA SER 112 HA SER 112 22.842 -12.671 6.477 828 HB2 SER 112 HB2 SER 112 25.655 -11.852 6.011 829 HB3 SER 112 HB3 SER 112 25.371 -13.576 6.251 830 HG SER 112 HG SER 112 23.558 -13.075 4.618 831 HA PRO 113 HA PRO 113 23.326 -14.713 10.328 832 HB2 PRO 113 HB2 PRO 113 23.733 -17.289 9.574 833 HB3 PRO 113 HB3 PRO 113 22.168 -16.481 9.428 834 HG2 PRO 113 HG2 PRO 113 24.259 -16.956 7.338 835 HG3 PRO 113 HG3 PRO 113 22.498 -17.130 7.219 836 HD2 PRO 113 HD2 PRO 113 23.814 -14.964 6.266 837 HD3 PRO 113 HD3 PRO 113 22.167 -14.869 6.922 838 H TYR 114 H TYR 114 25.431 -16.929 8.632 839 HA TYR 114 HA TYR 114 27.786 -15.804 9.966 840 HB2 TYR 114 HB2 TYR 114 26.653 -17.737 11.273 841 HB3 TYR 114 HB3 TYR 114 27.306 -18.772 10.008 842 HD1 TYR 114 HD1 TYR 114 28.748 -15.822 11.792 843 HD2 TYR 114 HD2 TYR 114 29.072 -19.969 10.899 844 HE1 TYR 114 HE1 TYR 114 30.901 -15.901 12.976 845 HE2 TYR 114 HE2 TYR 114 31.227 -20.061 12.082 846 HH TYR 114 HH TYR 114 32.929 -18.753 12.910 847 H SER 115 H SER 115 26.509 -18.131 7.629 848 HA SER 115 HA SER 115 29.068 -18.071 6.192 849 HB2 SER 115 HB2 SER 115 27.864 -20.267 6.830 850 HB3 SER 115 HB3 SER 115 26.752 -19.874 5.520 851 HG SER 115 HG SER 115 29.515 -20.428 5.392 852 H TYR 116 H TYR 116 28.446 -18.552 3.660 853 HA TYR 116 HA TYR 116 26.728 -16.288 2.879 854 HB2 TYR 116 HB2 TYR 116 28.184 -15.828 1.052 855 HB3 TYR 116 HB3 TYR 116 29.210 -16.025 2.468 856 HD1 TYR 116 HD1 TYR 116 30.545 -18.099 2.746 857 HD2 TYR 116 HD2 TYR 116 28.347 -17.310 -0.810 858 HE1 TYR 116 HE1 TYR 116 31.857 -19.811 1.562 859 HE2 TYR 116 HE2 TYR 116 29.652 -19.020 -2.003 860 HH TYR 116 HH TYR 116 30.971 -21.126 -1.338 861 H SER 117 H SER 117 25.145 -16.638 1.434 862 HA SER 117 HA SER 117 25.109 -19.192 -0.021 863 HB2 SER 117 HB2 SER 117 22.937 -19.731 0.641 864 HB3 SER 117 HB3 SER 117 23.631 -19.085 2.127 865 HG SER 117 HG SER 117 21.734 -17.959 0.404 866 H THR 118 H THR 118 25.714 -16.380 -0.755 867 HA THR 118 HA THR 118 23.678 -15.107 -2.127 868 HB THR 118 HB THR 118 26.550 -15.257 -3.059 869 HG1 THR 118 HG1 THR 118 26.928 -14.338 -1.188 870 HG21 THR 118 HG21 THR 118 25.862 -13.860 -4.654 871 HG22 THR 118 HG22 THR 118 25.457 -12.692 -3.395 872 HG23 THR 118 HG23 THR 118 24.234 -13.821 -3.976 873 H THR 119 H THR 119 22.553 -15.513 -3.922 874 HA THR 119 HA THR 119 23.612 -17.427 -5.876 875 HB THR 119 HB THR 119 21.241 -18.346 -6.096 876 HG1 THR 119 HG1 THR 119 20.968 -17.418 -3.427 877 HG21 THR 119 HG21 THR 119 23.389 -19.093 -4.461 878 HG22 THR 119 HG22 THR 119 22.062 -20.115 -5.014 879 HG23 THR 119 HG23 THR 119 21.947 -19.283 -3.463 880 H ALA 120 H ALA 120 22.938 -17.106 -7.995 881 HA ALA 120 HA ALA 120 22.223 -15.947 -9.819 882 HB1 ALA 120 HB1 ALA 120 20.066 -14.990 -9.798 883 HB2 ALA 120 HB2 ALA 120 20.004 -16.343 -8.667 884 HB3 ALA 120 HB3 ALA 120 20.131 -14.691 -8.060 885 H VAL 121 H VAL 121 24.314 -14.852 -8.245 886 HA VAL 121 HA VAL 121 24.077 -12.052 -9.049 887 HB VAL 121 HB VAL 121 24.993 -12.883 -6.291 888 HG11 VAL 121 HG11 VAL 121 25.333 -10.427 -7.872 889 HG12 VAL 121 HG12 VAL 121 24.768 -10.187 -6.218 890 HG13 VAL 121 HG13 VAL 121 26.278 -11.048 -6.520 891 HG21 VAL 121 HG21 VAL 121 22.519 -11.479 -7.272 892 HG22 VAL 121 HG22 VAL 121 22.629 -12.960 -6.320 893 HG23 VAL 121 HG23 VAL 121 23.057 -11.412 -5.594 894 H VAL 122 H VAL 122 25.879 -11.308 -9.991 895 HA VAL 122 HA VAL 122 28.046 -13.055 -10.527 896 HB VAL 122 HB VAL 122 27.375 -11.311 -12.109 897 HG11 VAL 122 HG11 VAL 122 27.574 -9.024 -11.722 898 HG12 VAL 122 HG12 VAL 122 26.932 -9.640 -10.198 899 HG13 VAL 122 HG13 VAL 122 28.648 -9.253 -10.342 900 HG21 VAL 122 HG21 VAL 122 30.173 -10.715 -11.184 901 HG22 VAL 122 HG22 VAL 122 29.738 -12.231 -11.973 902 HG23 VAL 122 HG23 VAL 122 29.537 -10.703 -12.829 903 H THR 123 H THR 123 29.916 -13.362 -9.494 904 HA THR 123 HA THR 123 30.888 -11.351 -7.608 905 HB THR 123 HB THR 123 31.270 -12.983 -5.839 906 HG1 THR 123 HG1 THR 123 30.687 -15.093 -6.061 907 HG21 THR 123 HG21 THR 123 28.390 -13.336 -6.593 908 HG22 THR 123 HG22 THR 123 29.018 -11.742 -6.173 909 HG23 THR 123 HG23 THR 123 29.099 -13.060 -5.003 910 H ASN 124 H ASN 124 33.123 -11.750 -6.923 911 HA ASN 124 HA ASN 124 34.769 -13.735 -7.996 912 HB2 ASN 124 HB2 ASN 124 35.983 -12.038 -9.624 913 HB3 ASN 124 HB3 ASN 124 34.628 -13.016 -10.179 914 HD21 ASN 124 HD21 ASN 124 33.191 -11.947 -11.306 915 HD22 ASN 124 HD22 ASN 124 32.796 -10.273 -11.139 916 HA PRO 125 HA PRO 125 37.635 -11.934 -5.205 917 HB2 PRO 125 HB2 PRO 125 40.022 -12.553 -6.342 918 HB3 PRO 125 HB3 PRO 125 38.986 -13.757 -5.567 919 HG2 PRO 125 HG2 PRO 125 39.298 -13.115 -8.474 920 HG3 PRO 125 HG3 PRO 125 39.191 -14.699 -7.683 921 HD2 PRO 125 HD2 PRO 125 37.081 -13.547 -8.932 922 HD3 PRO 125 HD3 PRO 125 36.894 -14.598 -7.513 923 H LYS 126 H LYS 126 39.533 -10.427 -5.041 924 HA LYS 126 HA LYS 126 38.999 -7.991 -6.264 925 HB2 LYS 126 HB2 LYS 126 40.944 -7.167 -5.216 926 HB3 LYS 126 HB3 LYS 126 40.367 -8.449 -4.160 927 HG2 LYS 126 HG2 LYS 126 42.533 -8.822 -6.215 928 HG3 LYS 126 HG3 LYS 126 42.832 -8.418 -4.523 929 HD2 LYS 126 HD2 LYS 126 41.257 -10.521 -4.140 930 HD3 LYS 126 HD3 LYS 126 41.873 -10.955 -5.736 931 HE2 LYS 126 HE2 LYS 126 43.517 -10.340 -3.283 932 HE3 LYS 126 HE3 LYS 126 43.259 -11.931 -3.997 933 HZ1 LYS 126 HZ1 LYS 126 44.340 -11.063 -6.039 934 HZ2 LYS 126 HZ2 LYS 126 45.370 -11.134 -4.700 935 HZ3 LYS 126 HZ3 LYS 126 44.728 -9.649 -5.196 936 H GLU 127 H GLU 127 40.875 -10.676 -7.382 937 HA GLU 127 HA GLU 127 41.260 -9.354 -9.935 938 HB2 GLU 127 HB2 GLU 127 43.503 -10.089 -8.102 939 HB3 GLU 127 HB3 GLU 127 43.730 -10.271 -9.836 940 HG2 GLU 127 HG2 GLU 127 42.866 -7.820 -9.932 941 HG3 GLU 127 HG3 GLU 127 43.323 -7.792 -8.230 Start of MODEL 17 1 H1 GLY 1 H GLY 1 2.537 14.883 -1.975 2 HA2 GLY 1 HA2 GLY 1 4.073 13.171 -3.782 3 HA3 GLY 1 HA3 GLY 1 2.964 12.376 -2.675 4 HA PRO 2 HA PRO 2 0.328 15.054 -5.754 5 HB2 PRO 2 HB2 PRO 2 1.619 15.815 -8.019 6 HB3 PRO 2 HB3 PRO 2 1.559 16.817 -6.564 7 HG2 PRO 2 HG2 PRO 2 3.744 15.016 -7.536 8 HG3 PRO 2 HG3 PRO 2 3.861 16.644 -6.843 9 HD2 PRO 2 HD2 PRO 2 4.360 14.408 -5.401 10 HD3 PRO 2 HD3 PRO 2 3.666 15.874 -4.680 11 H THR 3 H THR 3 2.527 12.543 -6.416 12 HA THR 3 HA THR 3 0.649 11.391 -8.366 13 HB THR 3 HB THR 3 2.539 10.384 -9.592 14 HG1 THR 3 HG1 THR 3 4.629 10.949 -9.091 15 HG21 THR 3 HG21 THR 3 1.518 12.757 -10.033 16 HG22 THR 3 HG22 THR 3 2.952 12.232 -10.913 17 HG23 THR 3 HG23 THR 3 3.113 13.316 -9.532 18 H GLY 4 H GLY 4 0.339 9.174 -8.246 19 HA2 GLY 4 HA2 GLY 4 0.632 7.969 -5.728 20 HA3 GLY 4 HA3 GLY 4 0.199 7.132 -7.211 21 H THR 5 H THR 5 2.515 7.464 -4.816 22 HA THR 5 HA THR 5 4.420 5.874 -6.394 23 HB THR 5 HB THR 5 6.310 7.004 -5.328 24 HG1 THR 5 HG1 THR 5 6.020 8.407 -3.753 25 HG21 THR 5 HG21 THR 5 4.371 8.849 -6.725 26 HG22 THR 5 HG22 THR 5 5.635 7.870 -7.469 27 HG23 THR 5 HG23 THR 5 6.067 9.230 -6.432 28 H GLY 6 H GLY 6 3.975 3.928 -5.455 29 HA2 GLY 6 HA2 GLY 6 3.777 3.707 -2.564 30 HA3 GLY 6 HA3 GLY 6 3.571 2.407 -3.728 31 H GLU 7 H GLU 7 6.244 4.656 -3.022 32 HA GLU 7 HA GLU 7 7.969 2.302 -2.612 33 HB2 GLU 7 HB2 GLU 7 8.524 3.327 -4.738 34 HB3 GLU 7 HB3 GLU 7 8.650 4.910 -3.981 35 HG2 GLU 7 HG2 GLU 7 10.823 3.776 -4.497 36 HG3 GLU 7 HG3 GLU 7 10.621 4.310 -2.829 37 H SER 8 H SER 8 8.493 5.796 -2.244 38 HA SER 8 HA SER 8 8.386 5.767 0.595 39 HB2 SER 8 HB2 SER 8 11.050 5.446 -0.741 40 HB3 SER 8 HB3 SER 8 10.934 6.371 0.756 41 HG SER 8 HG SER 8 9.691 4.368 1.469 42 H LYS 9 H LYS 9 8.930 7.847 1.535 43 HA LYS 9 HA LYS 9 8.190 10.005 -0.195 44 HB2 LYS 9 HB2 LYS 9 8.869 9.774 2.720 45 HB3 LYS 9 HB3 LYS 9 8.703 11.355 1.968 46 HG2 LYS 9 HG2 LYS 9 6.622 10.823 2.965 47 HG3 LYS 9 HG3 LYS 9 6.418 10.663 1.218 48 HD2 LYS 9 HD2 LYS 9 5.353 8.812 2.412 49 HD3 LYS 9 HD3 LYS 9 6.684 8.242 1.402 50 HE2 LYS 9 HE2 LYS 9 6.595 7.220 3.681 51 HE3 LYS 9 HE3 LYS 9 8.119 8.017 3.295 52 HZ1 LYS 9 HZ1 LYS 9 5.953 9.362 4.802 53 HZ2 LYS 9 HZ2 LYS 9 7.567 9.842 4.651 54 HZ3 LYS 9 HZ3 LYS 9 7.175 8.473 5.563 55 H CYS 10 H CYS 10 10.905 9.991 2.096 56 HA CYS 10 HA CYS 10 12.418 11.922 0.843 57 HB2 CYS 10 HB2 CYS 10 14.388 10.843 2.016 58 HB3 CYS 10 HB3 CYS 10 13.023 11.263 3.044 59 HG CYS 10 HG CYS 10 12.353 8.843 3.784 60 HA PRO 11 HA PRO 11 14.173 10.174 -2.778 61 HB2 PRO 11 HB2 PRO 11 16.628 11.333 -2.806 62 HB3 PRO 11 HB3 PRO 11 15.142 12.223 -3.160 63 HG2 PRO 11 HG2 PRO 11 16.716 12.098 -0.617 64 HG3 PRO 11 HG3 PRO 11 15.973 13.503 -1.405 65 HD2 PRO 11 HD2 PRO 11 14.830 12.241 0.701 66 HD3 PRO 11 HD3 PRO 11 13.877 13.014 -0.582 67 H LEU 12 H LEU 12 16.160 10.017 0.144 68 HA LEU 12 HA LEU 12 17.242 7.451 -0.819 69 HB2 LEU 12 HB2 LEU 12 19.079 8.899 -0.831 70 HB3 LEU 12 HB3 LEU 12 18.579 9.686 0.666 71 HG LEU 12 HG LEU 12 19.078 7.415 1.775 72 HD11 LEU 12 HD11 LEU 12 21.183 6.621 0.168 73 HD12 LEU 12 HD12 LEU 12 19.863 6.904 -0.966 74 HD13 LEU 12 HD13 LEU 12 19.647 5.782 0.377 75 HD21 LEU 12 HD21 LEU 12 20.582 9.710 1.321 76 HD22 LEU 12 HD22 LEU 12 21.680 8.376 0.967 77 HD23 LEU 12 HD23 LEU 12 20.882 8.469 2.537 78 H MET 13 H MET 13 17.173 5.741 0.555 79 HA MET 13 HA MET 13 16.394 6.193 3.338 80 HB2 MET 13 HB2 MET 13 14.632 4.509 3.225 81 HB3 MET 13 HB3 MET 13 14.303 5.822 2.101 82 HG2 MET 13 HG2 MET 13 14.554 4.512 0.275 83 HG3 MET 13 HG3 MET 13 15.775 3.494 1.035 84 HE1 MET 13 HE1 MET 13 13.749 2.036 3.774 85 HE2 MET 13 HE2 MET 13 14.325 0.792 2.664 86 HE3 MET 13 HE3 MET 13 15.331 2.198 3.013 87 H VAL 14 H VAL 14 16.967 4.522 4.762 88 HA VAL 14 HA VAL 14 18.994 2.692 3.679 89 HB VAL 14 HB VAL 14 18.536 3.614 6.521 90 HG11 VAL 14 HG11 VAL 14 20.758 2.498 6.913 91 HG12 VAL 14 HG12 VAL 14 19.403 1.405 6.622 92 HG13 VAL 14 HG13 VAL 14 20.566 1.733 5.337 93 HG21 VAL 14 HG21 VAL 14 19.637 5.062 4.538 94 HG22 VAL 14 HG22 VAL 14 20.137 5.183 6.225 95 HG23 VAL 14 HG23 VAL 14 21.059 4.184 5.102 96 H LYS 15 H LYS 15 18.815 0.526 3.864 97 HA LYS 15 HA LYS 15 16.506 -0.535 5.356 98 HB2 LYS 15 HB2 LYS 15 15.951 -0.666 3.024 99 HB3 LYS 15 HB3 LYS 15 17.522 -1.351 2.632 100 HG2 LYS 15 HG2 LYS 15 15.883 -3.089 2.568 101 HG3 LYS 15 HG3 LYS 15 16.929 -3.353 3.964 102 HD2 LYS 15 HD2 LYS 15 14.536 -1.721 4.481 103 HD3 LYS 15 HD3 LYS 15 14.219 -3.404 4.048 104 HE2 LYS 15 HE2 LYS 15 16.232 -3.712 5.828 105 HE3 LYS 15 HE3 LYS 15 15.457 -2.262 6.465 106 HZ1 LYS 15 HZ1 LYS 15 14.383 -4.983 6.207 107 HZ2 LYS 15 HZ2 LYS 15 13.313 -3.674 6.146 108 HZ3 LYS 15 HZ3 LYS 15 14.285 -3.908 7.511 109 H VAL 16 H VAL 16 17.313 -1.579 7.057 110 HA VAL 16 HA VAL 16 19.597 -3.392 6.617 111 HB VAL 16 HB VAL 16 18.990 -1.781 9.101 112 HG11 VAL 16 HG11 VAL 16 19.820 -3.984 9.695 113 HG12 VAL 16 HG12 VAL 16 21.173 -3.797 8.577 114 HG13 VAL 16 HG13 VAL 16 21.055 -2.763 10.002 115 HG21 VAL 16 HG21 VAL 16 19.999 -0.400 7.427 116 HG22 VAL 16 HG22 VAL 16 21.231 -0.790 8.626 117 HG23 VAL 16 HG23 VAL 16 21.216 -1.627 7.074 118 H LEU 17 H LEU 17 19.039 -5.445 6.848 119 HA LEU 17 HA LEU 17 17.127 -6.183 8.944 120 HB2 LEU 17 HB2 LEU 17 15.781 -7.454 7.559 121 HB3 LEU 17 HB3 LEU 17 16.099 -6.014 6.594 122 HG LEU 17 HG LEU 17 18.098 -7.793 5.849 123 HD11 LEU 17 HD11 LEU 17 17.364 -9.897 5.870 124 HD12 LEU 17 HD12 LEU 17 15.741 -9.430 5.362 125 HD13 LEU 17 HD13 LEU 17 16.188 -9.351 7.066 126 HD21 LEU 17 HD21 LEU 17 15.587 -7.696 4.275 127 HD22 LEU 17 HD22 LEU 17 17.258 -7.451 3.765 128 HD23 LEU 17 HD23 LEU 17 16.397 -6.166 4.614 129 H ASP 18 H ASP 18 17.382 -8.277 9.781 130 HA ASP 18 HA ASP 18 20.067 -9.285 9.630 131 HB2 ASP 18 HB2 ASP 18 17.620 -9.999 11.213 132 HB3 ASP 18 HB3 ASP 18 19.000 -11.093 11.185 133 H ALA 19 H ALA 19 20.815 -10.855 8.368 134 HA ALA 19 HA ALA 19 19.047 -12.174 6.514 135 HB1 ALA 19 HB1 ALA 19 21.954 -11.830 6.820 136 HB2 ALA 19 HB2 ALA 19 21.441 -13.341 6.070 137 HB3 ALA 19 HB3 ALA 19 20.949 -11.799 5.370 138 H VAL 20 H VAL 20 19.731 -12.769 9.647 139 HA VAL 20 HA VAL 20 20.091 -15.636 9.495 140 HB VAL 20 HB VAL 20 19.527 -13.908 11.907 141 HG11 VAL 20 HG11 VAL 20 20.543 -15.860 13.121 142 HG12 VAL 20 HG12 VAL 20 18.957 -16.161 12.408 143 HG13 VAL 20 HG13 VAL 20 20.412 -16.771 11.618 144 HG21 VAL 20 HG21 VAL 20 21.581 -13.116 11.390 145 HG22 VAL 20 HG22 VAL 20 22.107 -14.610 12.166 146 HG23 VAL 20 HG23 VAL 20 21.997 -14.520 10.408 147 H ARG 21 H ARG 21 17.514 -13.358 10.295 148 HA ARG 21 HA ARG 21 15.622 -15.617 10.329 149 HB2 ARG 21 HB2 ARG 21 15.080 -12.949 11.608 150 HB3 ARG 21 HB3 ARG 21 14.282 -14.488 11.902 151 HG2 ARG 21 HG2 ARG 21 15.568 -14.554 13.728 152 HG3 ARG 21 HG3 ARG 21 16.834 -15.074 12.614 153 HD2 ARG 21 HD2 ARG 21 17.986 -13.332 13.427 154 HD3 ARG 21 HD3 ARG 21 16.959 -12.361 12.373 155 HE ARG 21 HE ARG 21 15.901 -11.531 14.227 156 HH11 ARG 21 HH11 ARG 21 17.738 -14.349 15.122 157 HH12 ARG 21 HH12 ARG 21 17.489 -14.131 16.823 158 HH21 ARG 21 HH21 ARG 21 15.567 -11.233 16.463 159 HH22 ARG 21 HH22 ARG 21 16.253 -12.360 17.585 160 H GLY 22 H GLY 22 16.470 -12.583 8.922 161 HA2 GLY 22 HA2 GLY 22 15.714 -11.878 6.800 162 HA3 GLY 22 HA3 GLY 22 14.298 -12.901 6.991 163 H SER 23 H SER 23 14.736 -11.254 9.828 164 HA SER 23 HA SER 23 12.616 -9.374 9.125 165 HB2 SER 23 HB2 SER 23 13.066 -9.069 11.828 166 HB3 SER 23 HB3 SER 23 11.867 -10.143 11.108 167 HG SER 23 HG SER 23 13.776 -10.880 12.647 168 HA PRO 24 HA PRO 24 15.069 -5.739 9.233 169 HB2 PRO 24 HB2 PRO 24 13.502 -3.992 10.598 170 HB3 PRO 24 HB3 PRO 24 13.135 -4.529 8.954 171 HG2 PRO 24 HG2 PRO 24 12.006 -5.487 11.556 172 HG3 PRO 24 HG3 PRO 24 11.169 -5.145 10.030 173 HD2 PRO 24 HD2 PRO 24 11.809 -7.658 10.811 174 HD3 PRO 24 HD3 PRO 24 11.766 -7.171 9.105 175 H ALA 25 H ALA 25 16.522 -4.565 10.469 176 HA ALA 25 HA ALA 25 16.952 -5.580 13.168 177 HB1 ALA 25 HB1 ALA 25 19.160 -4.877 12.983 178 HB2 ALA 25 HB2 ALA 25 18.757 -5.382 11.341 179 HB3 ALA 25 HB3 ALA 25 18.775 -3.668 11.757 180 H ILE 26 H ILE 26 16.699 -4.415 14.986 181 HA ILE 26 HA ILE 26 15.749 -1.648 14.687 182 HB ILE 26 HB ILE 26 15.077 -3.837 16.564 183 HG12 ILE 26 HG12 ILE 26 13.690 -2.682 14.640 184 HG13 ILE 26 HG13 ILE 26 12.902 -3.204 16.124 185 HG21 ILE 26 HG21 ILE 26 15.318 -0.965 17.410 186 HG22 ILE 26 HG22 ILE 26 14.237 -2.100 18.216 187 HG23 ILE 26 HG23 ILE 26 15.975 -2.400 18.197 188 HD11 ILE 26 HD11 ILE 26 12.987 -0.941 16.987 189 HD12 ILE 26 HD12 ILE 26 13.833 -0.405 15.535 190 HD13 ILE 26 HD13 ILE 26 12.172 -0.986 15.423 191 H ASN 27 H ASN 27 16.723 0.017 15.732 192 HA ASN 27 HA ASN 27 18.310 1.197 16.854 193 HB2 ASN 27 HB2 ASN 27 18.760 -1.333 18.448 194 HB3 ASN 27 HB3 ASN 27 19.186 0.307 18.925 195 HD21 ASN 27 HD21 ASN 27 16.824 1.575 18.046 196 HD22 ASN 27 HD22 ASN 27 15.539 1.084 19.091 197 H VAL 28 H VAL 28 19.231 0.587 14.537 198 HA VAL 28 HA VAL 28 21.888 -0.623 14.947 199 HB VAL 28 HB VAL 28 20.256 -0.479 12.410 200 HG11 VAL 28 HG11 VAL 28 22.411 -0.279 11.612 201 HG12 VAL 28 HG12 VAL 28 23.100 -1.229 12.930 202 HG13 VAL 28 HG13 VAL 28 22.203 -2.030 11.640 203 HG21 VAL 28 HG21 VAL 28 20.889 -2.656 14.357 204 HG22 VAL 28 HG22 VAL 28 19.349 -2.240 13.605 205 HG23 VAL 28 HG23 VAL 28 20.603 -3.045 12.661 206 H ALA 29 H ALA 29 23.371 0.920 15.147 207 HA ALA 29 HA ALA 29 23.117 3.586 14.402 208 HB1 ALA 29 HB1 ALA 29 24.878 3.528 15.774 209 HB2 ALA 29 HB2 ALA 29 25.255 1.855 15.362 210 HB3 ALA 29 HB3 ALA 29 25.830 3.167 14.333 211 H VAL 30 H VAL 30 23.354 4.680 12.552 212 HA VAL 30 HA VAL 30 24.750 3.415 10.305 213 HB VAL 30 HB VAL 30 22.018 4.682 10.071 214 HG11 VAL 30 HG11 VAL 30 22.887 3.174 7.785 215 HG12 VAL 30 HG12 VAL 30 22.375 4.860 7.885 216 HG13 VAL 30 HG13 VAL 30 24.062 4.431 8.171 217 HG21 VAL 30 HG21 VAL 30 22.916 1.908 10.435 218 HG22 VAL 30 HG22 VAL 30 21.355 2.651 10.780 219 HG23 VAL 30 HG23 VAL 30 21.750 2.152 9.135 220 H HIS 31 H HIS 31 26.065 4.773 9.262 221 HA HIS 31 HA HIS 31 25.654 7.668 9.629 222 HB2 HIS 31 HB2 HIS 31 28.371 6.386 9.382 223 HB3 HIS 31 HB3 HIS 31 27.982 8.022 9.904 224 HD1 HIS 31 HD1 HIS 31 27.657 4.444 11.106 225 HD2 HIS 31 HD2 HIS 31 27.692 8.320 12.601 226 HE1 HIS 31 HE1 HIS 31 27.677 4.198 13.608 227 H VAL 32 H VAL 32 25.341 8.705 7.782 228 HA VAL 32 HA VAL 32 26.213 7.440 5.280 229 HB VAL 32 HB VAL 32 24.302 9.755 5.524 230 HG11 VAL 32 HG11 VAL 32 23.525 8.504 3.333 231 HG12 VAL 32 HG12 VAL 32 24.862 9.655 3.309 232 HG13 VAL 32 HG13 VAL 32 25.189 7.922 3.357 233 HG21 VAL 32 HG21 VAL 32 22.786 7.511 4.973 234 HG22 VAL 32 HG22 VAL 32 23.893 6.970 6.235 235 HG23 VAL 32 HG23 VAL 32 22.858 8.370 6.512 236 H PHE 33 H PHE 33 27.708 8.348 4.003 237 HA PHE 33 HA PHE 33 28.561 11.102 4.604 238 HB2 PHE 33 HB2 PHE 33 30.247 8.646 4.173 239 HB3 PHE 33 HB3 PHE 33 30.894 10.259 3.897 240 HD1 PHE 33 HD1 PHE 33 29.139 8.246 6.492 241 HD2 PHE 33 HD2 PHE 33 31.869 11.401 5.648 242 HE1 PHE 33 HE1 PHE 33 29.645 8.445 8.891 243 HE2 PHE 33 HE2 PHE 33 32.379 11.604 8.046 244 HZ PHE 33 HZ PHE 33 31.268 10.126 9.671 245 H ARG 34 H ARG 34 29.843 12.076 2.783 246 HA ARG 34 HA ARG 34 28.966 11.068 0.165 247 HB2 ARG 34 HB2 ARG 34 27.480 12.911 0.879 248 HB3 ARG 34 HB3 ARG 34 28.883 13.960 1.040 249 HG2 ARG 34 HG2 ARG 34 28.519 12.645 -1.577 250 HG3 ARG 34 HG3 ARG 34 27.345 13.887 -1.141 251 HD2 ARG 34 HD2 ARG 34 29.248 15.416 -0.647 252 HD3 ARG 34 HD3 ARG 34 30.342 14.180 -1.268 253 HE ARG 34 HE ARG 34 28.791 16.001 -2.799 254 HH11 ARG 34 HH11 ARG 34 30.012 12.740 -2.778 255 HH12 ARG 34 HH12 ARG 34 30.031 12.598 -4.505 256 HH21 ARG 34 HH21 ARG 34 28.812 15.826 -5.073 257 HH22 ARG 34 HH22 ARG 34 29.350 14.354 -5.809 258 H LYS 35 H LYS 35 30.422 11.260 -1.477 259 HA LYS 35 HA LYS 35 33.144 11.505 -0.869 260 HB2 LYS 35 HB2 LYS 35 32.745 10.251 -2.773 261 HB3 LYS 35 HB3 LYS 35 31.559 11.389 -3.401 262 HG2 LYS 35 HG2 LYS 35 33.602 11.370 -4.736 263 HG3 LYS 35 HG3 LYS 35 33.325 12.944 -3.988 264 HD2 LYS 35 HD2 LYS 35 35.685 12.228 -3.856 265 HD3 LYS 35 HD3 LYS 35 34.952 12.454 -2.265 266 HE2 LYS 35 HE2 LYS 35 34.675 9.741 -3.313 267 HE3 LYS 35 HE3 LYS 35 36.350 10.240 -3.088 268 HZ1 LYS 35 HZ1 LYS 35 34.234 9.884 -1.091 269 HZ2 LYS 35 HZ2 LYS 35 35.427 11.046 -0.797 270 HZ3 LYS 35 HZ3 LYS 35 35.861 9.427 -1.028 271 H ALA 36 H ALA 36 34.134 13.301 -0.233 272 HA ALA 36 HA ALA 36 33.172 15.918 -0.862 273 HB1 ALA 36 HB1 ALA 36 35.901 15.371 0.245 274 HB2 ALA 36 HB2 ALA 36 34.816 16.724 0.567 275 HB3 ALA 36 HB3 ALA 36 34.459 15.129 1.231 276 H ALA 37 H ALA 37 34.437 17.590 -1.928 277 HA ALA 37 HA ALA 37 35.258 16.857 -4.505 278 HB1 ALA 37 HB1 ALA 37 36.072 19.417 -3.163 279 HB2 ALA 37 HB2 ALA 37 35.732 19.127 -4.871 280 HB3 ALA 37 HB3 ALA 37 34.416 19.119 -3.695 281 H ASP 38 H ASP 38 36.968 16.917 -1.529 282 HA ASP 38 HA ASP 38 39.577 16.925 -2.841 283 HB2 ASP 38 HB2 ASP 38 38.611 17.284 -0.052 284 HB3 ASP 38 HB3 ASP 38 40.212 16.581 -0.263 285 H ASP 39 H ASP 39 37.463 14.705 -2.874 286 HA ASP 39 HA ASP 39 37.452 12.432 -2.966 287 HB2 ASP 39 HB2 ASP 39 39.613 12.819 -4.166 288 HB3 ASP 39 HB3 ASP 39 40.450 12.636 -2.627 289 H THR 40 H THR 40 36.850 13.530 -0.524 290 HA THR 40 HA THR 40 37.996 11.551 1.334 291 HB THR 40 HB THR 40 37.972 13.096 3.137 292 HG1 THR 40 HG1 THR 40 37.247 15.348 2.612 293 HG21 THR 40 HG21 THR 40 39.859 13.300 1.499 294 HG22 THR 40 HG22 THR 40 39.557 14.755 2.449 295 HG23 THR 40 HG23 THR 40 39.007 14.663 0.777 296 H TRP 41 H TRP 41 36.481 11.620 3.441 297 HA TRP 41 HA TRP 41 33.766 11.117 2.428 298 HB2 TRP 41 HB2 TRP 41 35.312 9.963 4.744 299 HB3 TRP 41 HB3 TRP 41 33.566 9.777 4.606 300 HD1 TRP 41 HD1 TRP 41 35.907 9.543 1.568 301 HE1 TRP 41 HE1 TRP 41 35.777 7.152 0.625 302 HE3 TRP 41 HE3 TRP 41 33.018 7.394 5.198 303 HZ2 TRP 41 HZ2 TRP 41 34.604 4.682 1.325 304 HZ3 TRP 41 HZ3 TRP 41 32.438 5.012 4.986 305 HH2 TRP 41 HH2 TRP 41 33.214 3.687 3.089 306 H GLU 42 H GLU 42 32.511 12.846 2.749 307 HA GLU 42 HA GLU 42 32.827 14.426 5.190 308 HB2 GLU 42 HB2 GLU 42 31.470 14.907 2.556 309 HB3 GLU 42 HB3 GLU 42 31.062 15.883 3.960 310 HG2 GLU 42 HG2 GLU 42 33.926 15.576 3.244 311 HG3 GLU 42 HG3 GLU 42 32.917 16.625 2.250 312 HA PRO 43 HA PRO 43 29.282 12.743 7.164 313 HB2 PRO 43 HB2 PRO 43 28.478 14.883 8.626 314 HB3 PRO 43 HB3 PRO 43 29.917 13.935 9.022 315 HG2 PRO 43 HG2 PRO 43 29.707 16.549 7.576 316 HG3 PRO 43 HG3 PRO 43 30.866 16.050 8.823 317 HD2 PRO 43 HD2 PRO 43 31.479 16.062 6.185 318 HD3 PRO 43 HD3 PRO 43 32.172 14.886 7.322 319 H PHE 44 H PHE 44 27.490 12.301 6.043 320 HA PHE 44 HA PHE 44 26.013 14.497 4.779 321 HB2 PHE 44 HB2 PHE 44 26.670 12.596 3.340 322 HB3 PHE 44 HB3 PHE 44 25.740 11.512 4.369 323 HD1 PHE 44 HD2 PHE 44 23.256 11.798 4.506 324 HD2 PHE 44 HD1 PHE 44 25.643 13.831 1.628 325 HE1 PHE 44 HE2 PHE 44 21.247 12.232 3.152 326 HE2 PHE 44 HE1 PHE 44 23.639 14.268 0.269 327 HZ PHE 44 HZ PHE 44 21.438 13.469 1.031 328 H ALA 45 H ALA 45 25.569 11.709 6.915 329 HA ALA 45 HA ALA 45 23.632 12.989 8.505 330 HB1 ALA 45 HB1 ALA 45 22.306 10.797 6.993 331 HB2 ALA 45 HB2 ALA 45 21.607 12.211 7.786 332 HB3 ALA 45 HB3 ALA 45 22.431 12.386 6.237 333 H SER 46 H SER 46 22.389 11.230 9.863 334 HA SER 46 HA SER 46 23.609 8.681 10.157 335 HB2 SER 46 HB2 SER 46 25.480 9.582 11.179 336 HB3 SER 46 HB3 SER 46 24.585 10.938 11.861 337 HG SER 46 HG SER 46 25.160 9.419 13.464 338 H GLY 47 H GLY 47 22.436 7.351 11.497 339 HA2 GLY 47 HA2 GLY 47 20.630 8.331 13.479 340 HA3 GLY 47 HA3 GLY 47 19.783 7.907 11.998 341 H LYS 48 H LYS 48 18.652 6.236 13.030 342 HA LYS 48 HA LYS 48 20.217 3.782 13.307 343 HB2 LYS 48 HB2 LYS 48 18.780 5.158 15.473 344 HB3 LYS 48 HB3 LYS 48 18.390 3.451 15.317 345 HG2 LYS 48 HG2 LYS 48 20.797 2.923 15.448 346 HG3 LYS 48 HG3 LYS 48 21.130 4.638 15.705 347 HD2 LYS 48 HD2 LYS 48 19.355 2.958 17.474 348 HD3 LYS 48 HD3 LYS 48 21.054 3.304 17.804 349 HE2 LYS 48 HE2 LYS 48 19.954 5.792 17.303 350 HE3 LYS 48 HE3 LYS 48 18.699 4.955 18.215 351 HZ1 LYS 48 HZ1 LYS 48 21.407 4.699 19.238 352 HZ2 LYS 48 HZ2 LYS 48 19.950 4.912 20.070 353 HZ3 LYS 48 HZ3 LYS 48 20.717 6.240 19.357 354 H THR 49 H THR 49 19.283 2.130 12.287 355 HA THR 49 HA THR 49 16.963 2.414 10.759 356 HB THR 49 HB THR 49 17.135 0.096 10.230 357 HG1 THR 49 HG1 THR 49 17.298 -0.831 12.264 358 HG21 THR 49 HG21 THR 49 19.975 0.220 10.587 359 HG22 THR 49 HG22 THR 49 19.366 1.820 10.157 360 HG23 THR 49 HG23 THR 49 19.031 0.438 9.114 361 H SER 50 H SER 50 14.875 1.571 10.969 362 HA SER 50 HA SER 50 14.053 1.083 13.751 363 HB2 SER 50 HB2 SER 50 13.111 3.078 12.457 364 HB3 SER 50 HB3 SER 50 12.229 1.899 11.488 365 HG SER 50 HG SER 50 11.261 2.881 13.545 366 H GLU 51 H GLU 51 11.810 -0.169 13.722 367 HA GLU 51 HA GLU 51 12.421 -2.803 12.856 368 HB2 GLU 51 HB2 GLU 51 10.035 -3.269 13.612 369 HB3 GLU 51 HB3 GLU 51 11.134 -2.629 14.826 370 HG2 GLU 51 HG2 GLU 51 9.782 -0.928 15.211 371 HG3 GLU 51 HG3 GLU 51 9.835 -0.457 13.513 372 H SER 52 H SER 52 11.243 -0.182 11.182 373 HA SER 52 HA SER 52 9.666 -1.817 9.323 374 HB2 SER 52 HB2 SER 52 8.760 0.376 10.269 375 HB3 SER 52 HB3 SER 52 9.954 1.186 9.254 376 HG SER 52 HG SER 52 8.812 0.729 7.532 377 H GLY 53 H GLY 53 12.777 -1.092 9.721 378 HA2 GLY 53 HA2 GLY 53 14.592 -1.199 8.313 379 HA3 GLY 53 HA3 GLY 53 13.482 -1.666 7.033 380 H GLU 54 H GLU 54 13.135 1.319 8.819 381 HA GLU 54 HA GLU 54 14.134 2.806 6.484 382 HB2 GLU 54 HB2 GLU 54 12.291 4.434 6.813 383 HB3 GLU 54 HB3 GLU 54 11.724 2.836 6.347 384 HG2 GLU 54 HG2 GLU 54 10.246 3.331 8.008 385 HG3 GLU 54 HG3 GLU 54 11.496 2.502 8.935 386 H LEU 55 H LEU 55 15.144 4.760 6.902 387 HA LEU 55 HA LEU 55 15.943 5.148 9.695 388 HB2 LEU 55 HB2 LEU 55 17.439 5.005 7.425 389 HB3 LEU 55 HB3 LEU 55 17.260 6.747 7.616 390 HG LEU 55 HG LEU 55 19.344 5.825 8.603 391 HD11 LEU 55 HD11 LEU 55 17.944 6.777 10.987 392 HD12 LEU 55 HD12 LEU 55 17.697 7.778 9.556 393 HD13 LEU 55 HD13 LEU 55 19.332 7.455 10.133 394 HD21 LEU 55 HD21 LEU 55 19.296 4.466 10.552 395 HD22 LEU 55 HD22 LEU 55 18.275 3.678 9.349 396 HD23 LEU 55 HD23 LEU 55 17.539 4.586 10.671 397 H HIS 56 H HIS 56 15.903 7.194 10.674 398 HA HIS 56 HA HIS 56 13.638 8.758 10.162 399 HB2 HIS 56 HB2 HIS 56 15.533 8.585 12.184 400 HB3 HIS 56 HB3 HIS 56 15.744 10.216 11.552 401 HD1 HIS 56 HD1 HIS 56 12.627 8.146 12.290 402 HD2 HIS 56 HD2 HIS 56 14.288 11.866 13.105 403 HE1 HIS 56 HE1 HIS 56 10.912 9.360 13.672 404 H GLY 57 H GLY 57 14.323 11.394 10.249 405 HA2 GLY 57 HA2 GLY 57 14.780 11.998 7.535 406 HA3 GLY 57 HA3 GLY 57 14.768 13.160 8.853 407 H LEU 58 H LEU 58 16.729 11.149 6.811 408 HA LEU 58 HA LEU 58 19.180 12.110 8.091 409 HB2 LEU 58 HB2 LEU 58 18.637 9.990 6.029 410 HB3 LEU 58 HB3 LEU 58 20.267 10.528 6.432 411 HG LEU 58 HG LEU 58 18.310 9.148 8.266 412 HD11 LEU 58 HD11 LEU 58 20.567 8.281 6.601 413 HD12 LEU 58 HD12 LEU 58 19.192 7.368 7.218 414 HD13 LEU 58 HD13 LEU 58 20.581 7.680 8.258 415 HD21 LEU 58 HD21 LEU 58 20.349 9.141 9.804 416 HD22 LEU 58 HD22 LEU 58 19.443 10.647 9.662 417 HD23 LEU 58 HD23 LEU 58 20.964 10.447 8.792 418 H THR 59 H THR 59 17.279 12.445 5.199 419 HA THR 59 HA THR 59 19.105 13.495 3.409 420 HB THR 59 HB THR 59 17.255 14.613 2.309 421 HG1 THR 59 HG1 THR 59 15.498 13.909 4.397 422 HG21 THR 59 HG21 THR 59 15.580 12.434 2.984 423 HG22 THR 59 HG22 THR 59 17.247 11.863 3.079 424 HG23 THR 59 HG23 THR 59 16.648 12.596 1.591 425 H THR 60 H THR 60 19.791 15.585 2.893 426 HA THR 60 HA THR 60 19.139 17.785 4.668 427 HB THR 60 HB THR 60 21.574 18.276 5.095 428 HG1 THR 60 HG1 THR 60 21.829 15.586 4.184 429 HG21 THR 60 HG21 THR 60 20.802 15.648 6.327 430 HG22 THR 60 HG22 THR 60 19.922 17.130 6.703 431 HG23 THR 60 HG23 THR 60 21.645 17.011 7.062 432 H GLU 61 H GLU 61 20.816 19.687 4.005 433 HA GLU 61 HA GLU 61 20.100 20.437 1.410 434 HB2 GLU 61 HB2 GLU 61 21.855 22.223 1.696 435 HB3 GLU 61 HB3 GLU 61 20.651 22.144 2.975 436 HG2 GLU 61 HG2 GLU 61 22.198 21.015 4.429 437 HG3 GLU 61 HG3 GLU 61 23.395 20.921 3.139 438 H GLU 62 H GLU 62 22.660 18.449 2.532 439 HA GLU 62 HA GLU 62 24.328 18.798 0.200 440 HB2 GLU 62 HB2 GLU 62 24.436 16.927 2.561 441 HB3 GLU 62 HB3 GLU 62 25.562 16.810 1.216 442 HG2 GLU 62 HG2 GLU 62 26.342 19.069 1.646 443 HG3 GLU 62 HG3 GLU 62 25.181 19.233 2.962 444 H GLU 63 H GLU 63 21.451 17.322 0.653 445 HA GLU 63 HA GLU 63 21.812 14.792 -0.556 446 HB2 GLU 63 HB2 GLU 63 19.450 14.662 -0.666 447 HB3 GLU 63 HB3 GLU 63 19.813 15.570 0.795 448 HG2 GLU 63 HG2 GLU 63 19.404 17.664 -0.489 449 HG3 GLU 63 HG3 GLU 63 18.872 16.667 -1.843 450 H PHE 64 H PHE 64 21.782 17.963 -1.821 451 HA PHE 64 HA PHE 64 21.071 17.116 -4.513 452 HB2 PHE 64 HB2 PHE 64 20.524 19.405 -3.279 453 HB3 PHE 64 HB3 PHE 64 22.094 19.858 -3.937 454 HD1 PHE 64 HD1 PHE 64 22.153 18.597 -6.530 455 HD2 PHE 64 HD2 PHE 64 18.910 20.482 -4.517 456 HE1 PHE 64 HE1 PHE 64 21.101 19.096 -8.698 457 HE2 PHE 64 HE2 PHE 64 17.854 20.984 -6.681 458 HZ PHE 64 HZ PHE 64 18.949 20.291 -8.775 459 H VAL 65 H VAL 65 23.140 15.658 -4.061 460 HA VAL 65 HA VAL 65 25.455 17.077 -5.211 461 HB VAL 65 HB VAL 65 26.869 15.297 -4.192 462 HG11 VAL 65 HG11 VAL 65 26.458 16.121 -1.773 463 HG12 VAL 65 HG12 VAL 65 26.925 17.292 -3.009 464 HG13 VAL 65 HG13 VAL 65 25.237 17.159 -2.510 465 HG21 VAL 65 HG21 VAL 65 26.058 13.671 -2.784 466 HG22 VAL 65 HG22 VAL 65 24.606 14.589 -2.382 467 HG23 VAL 65 HG23 VAL 65 24.737 13.788 -3.948 468 H GLU 66 H GLU 66 27.021 15.185 -6.125 469 HA GLU 66 HA GLU 66 25.968 14.387 -8.542 470 HB2 GLU 66 HB2 GLU 66 28.222 13.152 -6.955 471 HB3 GLU 66 HB3 GLU 66 27.871 12.755 -8.631 472 HG2 GLU 66 HG2 GLU 66 28.221 15.616 -7.980 473 HG3 GLU 66 HG3 GLU 66 29.656 14.594 -7.918 474 H GLY 67 H GLY 67 26.386 12.370 -5.631 475 HA2 GLY 67 HA2 GLY 67 24.105 11.054 -5.411 476 HA3 GLY 67 HA3 GLY 67 24.750 10.279 -6.851 477 H ILE 68 H ILE 68 27.494 10.874 -5.455 478 HA ILE 68 HA ILE 68 27.902 8.252 -4.506 479 HB ILE 68 HB ILE 68 29.611 10.670 -3.915 480 HG12 ILE 68 HG12 ILE 68 29.881 8.737 -6.223 481 HG13 ILE 68 HG13 ILE 68 29.093 10.305 -6.359 482 HG21 ILE 68 HG21 ILE 68 31.107 8.296 -4.297 483 HG22 ILE 68 HG22 ILE 68 30.928 9.256 -2.830 484 HG23 ILE 68 HG23 ILE 68 29.806 7.936 -3.161 485 HD11 ILE 68 HD11 ILE 68 31.979 9.691 -5.870 486 HD12 ILE 68 HD12 ILE 68 31.248 10.671 -7.141 487 HD13 ILE 68 HD13 ILE 68 31.293 11.268 -5.483 488 H TYR 69 H TYR 69 27.232 7.392 -2.666 489 HA TYR 69 HA TYR 69 27.292 9.017 -0.226 490 HB2 TYR 69 HB2 TYR 69 24.958 7.277 -1.052 491 HB3 TYR 69 HB3 TYR 69 25.109 8.138 0.475 492 HD1 TYR 69 HD2 TYR 69 25.911 10.778 -0.137 493 HD2 TYR 69 HD1 TYR 69 23.350 8.235 -2.392 494 HE1 TYR 69 HE2 TYR 69 24.844 12.754 -1.142 495 HE2 TYR 69 HE1 TYR 69 22.278 10.204 -3.403 496 HH TYR 69 HH TYR 69 22.001 12.478 -3.160 497 H LYS 70 H LYS 70 28.281 8.006 1.390 498 HA LYS 70 HA LYS 70 28.652 5.091 1.189 499 HB2 LYS 70 HB2 LYS 70 30.371 7.021 2.749 500 HB3 LYS 70 HB3 LYS 70 30.720 5.338 2.375 501 HG2 LYS 70 HG2 LYS 70 31.789 5.970 0.548 502 HG3 LYS 70 HG3 LYS 70 30.301 6.686 -0.077 503 HD2 LYS 70 HD2 LYS 70 30.937 8.669 1.505 504 HD3 LYS 70 HD3 LYS 70 32.556 7.975 1.402 505 HE2 LYS 70 HE2 LYS 70 30.833 8.970 -0.860 506 HE3 LYS 70 HE3 LYS 70 32.357 9.650 -0.293 507 HZ1 LYS 70 HZ1 LYS 70 32.002 6.996 -1.579 508 HZ2 LYS 70 HZ2 LYS 70 33.467 7.605 -0.993 509 HZ3 LYS 70 HZ3 LYS 70 32.695 8.365 -2.293 510 H VAL 71 H VAL 71 27.114 4.171 2.414 511 HA VAL 71 HA VAL 71 26.506 5.317 5.044 512 HB VAL 71 HB VAL 71 25.069 3.163 3.485 513 HG11 VAL 71 HG11 VAL 71 23.456 4.268 5.527 514 HG12 VAL 71 HG12 VAL 71 24.049 2.613 5.379 515 HG13 VAL 71 HG13 VAL 71 24.995 3.814 6.259 516 HG21 VAL 71 HG21 VAL 71 24.430 6.066 3.983 517 HG22 VAL 71 HG22 VAL 71 24.768 5.296 2.432 518 HG23 VAL 71 HG23 VAL 71 23.288 4.902 3.309 519 H GLU 72 H GLU 72 27.339 4.458 6.824 520 HA GLU 72 HA GLU 72 28.441 1.730 6.677 521 HB2 GLU 72 HB2 GLU 72 30.165 2.344 8.084 522 HB3 GLU 72 HB3 GLU 72 29.918 3.832 7.181 523 HG2 GLU 72 HG2 GLU 72 28.318 4.436 9.138 524 HG3 GLU 72 HG3 GLU 72 29.217 3.195 10.008 525 H ILE 73 H ILE 73 27.835 0.217 8.141 526 HA ILE 73 HA ILE 73 25.774 1.019 10.087 527 HB ILE 73 HB ILE 73 26.160 -1.642 8.712 528 HG12 ILE 73 HG12 ILE 73 23.583 -0.262 8.499 529 HG13 ILE 73 HG13 ILE 73 24.917 0.634 7.779 530 HG21 ILE 73 HG21 ILE 73 23.789 -1.902 9.899 531 HG22 ILE 73 HG22 ILE 73 25.298 -2.380 10.676 532 HG23 ILE 73 HG23 ILE 73 24.560 -0.825 11.065 533 HD11 ILE 73 HD11 ILE 73 23.518 -1.106 6.397 534 HD12 ILE 73 HD12 ILE 73 25.254 -0.915 6.146 535 HD13 ILE 73 HD13 ILE 73 24.645 -2.249 7.127 536 H ASP 74 H ASP 74 26.052 0.561 12.193 537 HA ASP 74 HA ASP 74 28.525 -0.839 12.947 538 HB2 ASP 74 HB2 ASP 74 27.866 1.618 13.682 539 HB3 ASP 74 HB3 ASP 74 26.942 0.759 14.911 540 H THR 75 H THR 75 27.259 -2.847 12.476 541 HA THR 75 HA THR 75 25.390 -3.556 14.624 542 HB THR 75 HB THR 75 24.476 -4.046 12.476 543 HG1 THR 75 HG1 THR 75 23.833 -5.915 13.212 544 HG21 THR 75 HG21 THR 75 26.321 -4.055 11.016 545 HG22 THR 75 HG22 THR 75 25.714 -5.711 10.975 546 HG23 THR 75 HG23 THR 75 27.144 -5.318 11.929 547 H LYS 76 H LYS 76 28.613 -3.736 14.002 548 HA LYS 76 HA LYS 76 29.173 -6.421 14.809 549 HB2 LYS 76 HB2 LYS 76 31.516 -5.596 15.021 550 HB3 LYS 76 HB3 LYS 76 30.787 -5.259 13.456 551 HG2 LYS 76 HG2 LYS 76 31.611 -3.204 13.780 552 HG3 LYS 76 HG3 LYS 76 30.182 -2.986 14.795 553 HD2 LYS 76 HD2 LYS 76 31.818 -2.308 16.249 554 HD3 LYS 76 HD3 LYS 76 31.753 -4.029 16.639 555 HE2 LYS 76 HE2 LYS 76 34.054 -3.336 16.408 556 HE3 LYS 76 HE3 LYS 76 33.629 -4.419 15.084 557 HZ1 LYS 76 HZ1 LYS 76 34.856 -2.082 14.746 558 HZ2 LYS 76 HZ2 LYS 76 33.247 -1.590 14.566 559 HZ3 LYS 76 HZ3 LYS 76 33.879 -2.800 13.566 560 H SER 77 H SER 77 29.245 -3.270 16.439 561 HA SER 77 HA SER 77 29.855 -4.543 18.984 562 HB2 SER 77 HB2 SER 77 29.750 -1.722 17.993 563 HB3 SER 77 HB3 SER 77 29.586 -2.020 19.724 564 HG SER 77 HG SER 77 31.759 -1.735 19.206 565 H TYR 78 H TYR 78 27.146 -3.335 17.231 566 HA TYR 78 HA TYR 78 25.434 -2.933 19.491 567 HB2 TYR 78 HB2 TYR 78 25.184 -2.800 16.552 568 HB3 TYR 78 HB3 TYR 78 23.711 -3.227 17.414 569 HD1 TYR 78 HD1 TYR 78 26.378 -0.654 17.196 570 HD2 TYR 78 HD2 TYR 78 22.438 -1.581 18.508 571 HE1 TYR 78 HE1 TYR 78 25.996 1.721 17.708 572 HE2 TYR 78 HE2 TYR 78 22.044 0.792 19.022 573 HH TYR 78 HH TYR 78 22.885 2.843 19.010 574 H TRP 79 H TRP 79 26.314 -5.617 17.486 575 HA TRP 79 HA TRP 79 24.072 -7.267 18.115 576 HB2 TRP 79 HB2 TRP 79 26.622 -7.562 16.663 577 HB3 TRP 79 HB3 TRP 79 26.018 -9.038 17.411 578 HD1 TRP 79 HD1 TRP 79 23.486 -6.537 16.071 579 HE1 TRP 79 HE1 TRP 79 22.335 -7.541 13.999 580 HE3 TRP 79 HE3 TRP 79 26.426 -10.671 15.433 581 HZ2 TRP 79 HZ2 TRP 79 22.634 -9.788 12.318 582 HZ3 TRP 79 HZ3 TRP 79 25.925 -12.197 13.569 583 HH2 TRP 79 HH2 TRP 79 24.068 -11.764 12.045 584 H LYS 80 H LYS 80 27.193 -6.668 19.566 585 HA LYS 80 HA LYS 80 27.168 -8.922 21.312 586 HB2 LYS 80 HB2 LYS 80 29.130 -8.052 22.239 587 HB3 LYS 80 HB3 LYS 80 29.178 -7.490 20.573 588 HG2 LYS 80 HG2 LYS 80 29.528 -5.459 21.392 589 HG3 LYS 80 HG3 LYS 80 27.842 -5.473 21.915 590 HD2 LYS 80 HD2 LYS 80 29.027 -4.937 23.856 591 HD3 LYS 80 HD3 LYS 80 28.717 -6.667 24.016 592 HE2 LYS 80 HE2 LYS 80 30.917 -6.794 24.444 593 HE3 LYS 80 HE3 LYS 80 31.088 -6.675 22.693 594 HZ1 LYS 80 HZ1 LYS 80 31.984 -4.653 22.851 595 HZ2 LYS 80 HZ2 LYS 80 32.229 -5.009 24.486 596 HZ3 LYS 80 HZ3 LYS 80 30.868 -4.126 24.008 597 H ALA 81 H ALA 81 25.571 -5.910 21.319 598 HA ALA 81 HA ALA 81 25.270 -5.628 24.150 599 HB1 ALA 81 HB1 ALA 81 24.868 -3.979 22.002 600 HB2 ALA 81 HB2 ALA 81 23.220 -4.358 22.506 601 HB3 ALA 81 HB3 ALA 81 24.353 -3.649 23.656 602 H LEU 82 H LEU 82 23.289 -6.960 21.540 603 HA LEU 82 HA LEU 82 21.212 -7.737 23.430 604 HB2 LEU 82 HB2 LEU 82 21.404 -8.123 20.446 605 HB3 LEU 82 HB3 LEU 82 20.003 -8.517 21.440 606 HG LEU 82 HG LEU 82 19.421 -6.497 20.454 607 HD11 LEU 82 HD11 LEU 82 19.366 -4.872 22.226 608 HD12 LEU 82 HD12 LEU 82 20.712 -5.663 23.046 609 HD13 LEU 82 HD13 LEU 82 19.158 -6.484 22.913 610 HD21 LEU 82 HD21 LEU 82 22.066 -5.249 21.136 611 HD22 LEU 82 HD22 LEU 82 20.840 -4.687 19.999 612 HD23 LEU 82 HD23 LEU 82 21.804 -6.117 19.623 613 H GLY 83 H GLY 83 24.064 -8.937 23.044 614 HA2 GLY 83 HA2 GLY 83 25.011 -11.006 23.345 615 HA3 GLY 83 HA3 GLY 83 23.426 -11.543 23.879 616 H ILE 84 H ILE 84 24.474 -10.337 20.709 617 HA ILE 84 HA ILE 84 23.281 -12.697 19.476 618 HB ILE 84 HB ILE 84 24.482 -10.318 18.064 619 HG12 ILE 84 HG12 ILE 84 22.717 -9.583 19.629 620 HG13 ILE 84 HG13 ILE 84 22.233 -9.380 17.948 621 HG21 ILE 84 HG21 ILE 84 22.673 -12.569 17.247 622 HG22 ILE 84 HG22 ILE 84 22.773 -11.072 16.322 623 HG23 ILE 84 HG23 ILE 84 24.209 -12.072 16.537 624 HD11 ILE 84 HD11 ILE 84 20.479 -10.281 19.502 625 HD12 ILE 84 HD12 ILE 84 20.779 -11.237 18.049 626 HD13 ILE 84 HD13 ILE 84 21.438 -11.757 19.600 627 H SER 85 H SER 85 24.395 -13.963 17.914 628 HA SER 85 HA SER 85 26.879 -14.894 18.648 629 HB2 SER 85 HB2 SER 85 25.209 -15.115 16.204 630 HB3 SER 85 HB3 SER 85 26.908 -15.556 16.038 631 HG SER 85 HG SER 85 26.480 -17.334 17.053 632 HA PRO 86 HA PRO 86 29.952 -12.148 17.146 633 HB2 PRO 86 HB2 PRO 86 31.863 -13.851 16.243 634 HB3 PRO 86 HB3 PRO 86 31.522 -13.614 17.961 635 HG2 PRO 86 HG2 PRO 86 30.615 -15.806 16.135 636 HG3 PRO 86 HG3 PRO 86 31.215 -15.913 17.801 637 HD2 PRO 86 HD2 PRO 86 28.578 -16.009 17.192 638 HD3 PRO 86 HD3 PRO 86 29.184 -15.303 18.704 639 H MET 87 H MET 87 30.631 -11.092 15.315 640 HA MET 87 HA MET 87 30.294 -12.364 12.716 641 HB2 MET 87 HB2 MET 87 28.114 -11.298 13.233 642 HB3 MET 87 HB3 MET 87 28.934 -9.752 13.402 643 HG2 MET 87 HG2 MET 87 28.105 -9.640 11.261 644 HG3 MET 87 HG3 MET 87 29.757 -10.194 10.994 645 HE1 MET 87 HE1 MET 87 29.461 -13.212 9.018 646 HE2 MET 87 HE2 MET 87 30.342 -11.786 9.571 647 HE3 MET 87 HE3 MET 87 30.168 -13.183 10.635 648 H HIS 88 H HIS 88 31.631 -11.553 11.142 649 HA HIS 88 HA HIS 88 33.971 -10.247 11.913 650 HB2 HIS 88 HB2 HIS 88 33.164 -11.587 9.681 651 HB3 HIS 88 HB3 HIS 88 33.215 -9.931 9.081 652 HD1 HIS 88 HD1 HIS 88 35.507 -12.301 10.987 653 HD2 HIS 88 HD2 HIS 88 35.673 -9.194 8.234 654 HE1 HIS 88 HE1 HIS 88 37.934 -12.082 10.367 655 H GLU 89 H GLU 89 34.669 -8.229 10.395 656 HA GLU 89 HA GLU 89 33.585 -5.970 11.549 657 HB2 GLU 89 HB2 GLU 89 35.182 -6.430 9.059 658 HB3 GLU 89 HB3 GLU 89 34.549 -4.824 9.391 659 HG2 GLU 89 HG2 GLU 89 36.074 -6.258 11.510 660 HG3 GLU 89 HG3 GLU 89 36.941 -5.502 10.175 661 H HIS 90 H HIS 90 31.905 -4.645 11.147 662 HA HIS 90 HA HIS 90 29.667 -5.487 9.770 663 HB2 HIS 90 HB2 HIS 90 29.001 -3.019 9.823 664 HB3 HIS 90 HB3 HIS 90 29.365 -3.777 11.371 665 HD1 HIS 90 HD1 HIS 90 31.878 -2.371 8.906 666 HD2 HIS 90 HD2 HIS 90 30.409 -1.654 12.726 667 HE1 HIS 90 HE1 HIS 90 33.329 -0.549 9.853 668 H ALA 91 H ALA 91 28.611 -4.457 7.879 669 HA ALA 91 HA ALA 91 30.569 -4.130 5.718 670 HB1 ALA 91 HB1 ALA 91 27.748 -5.100 5.821 671 HB2 ALA 91 HB2 ALA 91 28.397 -4.458 4.312 672 HB3 ALA 91 HB3 ALA 91 29.167 -5.844 5.084 673 H GLU 92 H GLU 92 29.924 -2.624 3.933 674 HA GLU 92 HA GLU 92 28.401 -0.304 4.880 675 HB2 GLU 92 HB2 GLU 92 30.207 1.165 3.854 676 HB3 GLU 92 HB3 GLU 92 30.605 0.384 5.378 677 HG2 GLU 92 HG2 GLU 92 32.134 -1.020 4.425 678 HG3 GLU 92 HG3 GLU 92 31.349 -0.982 2.847 679 H VAL 93 H VAL 93 27.878 1.222 3.110 680 HA VAL 93 HA VAL 93 27.704 -0.147 0.505 681 HB VAL 93 HB VAL 93 25.581 1.616 1.735 682 HG11 VAL 93 HG11 VAL 93 25.837 0.249 -0.921 683 HG12 VAL 93 HG12 VAL 93 24.257 0.636 -0.238 684 HG13 VAL 93 HG13 VAL 93 25.415 1.925 -0.570 685 HG21 VAL 93 HG21 VAL 93 24.899 -0.216 2.796 686 HG22 VAL 93 HG22 VAL 93 24.545 -0.925 1.221 687 HG23 VAL 93 HG23 VAL 93 26.110 -1.208 1.983 688 H VAL 94 H VAL 94 29.012 0.911 -0.837 689 HA VAL 94 HA VAL 94 28.836 3.849 -0.917 690 HB VAL 94 HB VAL 94 31.359 2.228 -1.284 691 HG11 VAL 94 HG11 VAL 94 30.785 5.170 -1.535 692 HG12 VAL 94 HG12 VAL 94 32.413 4.527 -1.307 693 HG13 VAL 94 HG13 VAL 94 31.482 4.087 -2.740 694 HG21 VAL 94 HG21 VAL 94 31.990 3.782 0.736 695 HG22 VAL 94 HG22 VAL 94 30.246 3.795 0.995 696 HG23 VAL 94 HG23 VAL 94 31.127 2.267 1.000 697 H PHE 95 H PHE 95 27.801 4.287 -2.756 698 HA PHE 95 HA PHE 95 28.653 2.872 -5.196 699 HB2 PHE 95 HB2 PHE 95 26.307 3.463 -6.040 700 HB3 PHE 95 HB3 PHE 95 26.427 2.182 -4.839 701 HD1 PHE 95 HD1 PHE 95 25.777 5.825 -5.177 702 HD2 PHE 95 HD2 PHE 95 25.164 2.281 -2.901 703 HE1 PHE 95 HE1 PHE 95 24.182 7.027 -3.740 704 HE2 PHE 95 HE2 PHE 95 23.566 3.477 -1.461 705 HZ PHE 95 HZ PHE 95 23.074 5.854 -1.880 706 H THR 96 H THR 96 28.636 4.097 -7.160 707 HA THR 96 HA THR 96 29.097 6.964 -6.689 708 HB THR 96 HB THR 96 31.008 5.646 -7.603 709 HG1 THR 96 HG1 THR 96 31.576 7.316 -8.860 710 HG21 THR 96 HG21 THR 96 30.891 4.409 -9.486 711 HG22 THR 96 HG22 THR 96 29.842 5.568 -10.302 712 HG23 THR 96 HG23 THR 96 29.159 4.408 -9.163 713 H ALA 97 H ALA 97 28.190 8.515 -8.037 714 HA ALA 97 HA ALA 97 25.668 7.779 -9.217 715 HB1 ALA 97 HB1 ALA 97 25.118 9.898 -8.824 716 HB2 ALA 97 HB2 ALA 97 26.691 10.076 -8.045 717 HB3 ALA 97 HB3 ALA 97 26.496 10.499 -9.746 718 H ASN 98 H ASN 98 25.035 8.414 -11.397 719 HA ASN 98 HA ASN 98 25.271 8.409 -13.659 720 HB2 ASN 98 HB2 ASN 98 26.837 10.360 -13.028 721 HB3 ASN 98 HB3 ASN 98 28.149 9.223 -13.323 722 HD21 ASN 98 HD21 ASN 98 29.019 9.999 -15.140 723 HD22 ASN 98 HD22 ASN 98 28.170 10.209 -16.630 724 H ASP 99 H ASP 99 25.502 5.984 -12.463 725 HA ASP 99 HA ASP 99 27.768 4.670 -13.801 726 HB2 ASP 99 HB2 ASP 99 27.515 2.853 -12.268 727 HB3 ASP 99 HB3 ASP 99 27.457 4.337 -11.321 728 H SER 100 H SER 100 25.205 5.576 -15.034 729 HA SER 100 HA SER 100 23.758 4.846 -16.631 730 HB2 SER 100 HB2 SER 100 25.910 3.591 -17.317 731 HB3 SER 100 HB3 SER 100 25.139 2.170 -16.613 732 HG SER 100 HG SER 100 24.429 2.087 -18.637 733 H GLY 101 H GLY 101 22.129 4.918 -14.942 734 HA2 GLY 101 HA2 GLY 101 20.213 3.990 -14.054 735 HA3 GLY 101 HA3 GLY 101 20.672 2.460 -14.789 736 HA PRO 102 HA PRO 102 22.846 2.715 -10.454 737 HB2 PRO 102 HB2 PRO 102 21.847 4.586 -8.759 738 HB3 PRO 102 HB3 PRO 102 23.204 4.902 -9.847 739 HG2 PRO 102 HG2 PRO 102 20.312 5.605 -10.175 740 HG3 PRO 102 HG3 PRO 102 21.749 6.587 -10.516 741 HD2 PRO 102 HD2 PRO 102 20.370 5.296 -12.457 742 HD3 PRO 102 HD3 PRO 102 22.124 5.558 -12.545 743 H ARG 103 H ARG 103 19.466 3.858 -10.306 744 HA ARG 103 HA ARG 103 17.708 3.123 -9.016 745 HB2 ARG 103 HB2 ARG 103 17.045 0.841 -9.579 746 HB3 ARG 103 HB3 ARG 103 17.635 1.686 -11.004 747 HG2 ARG 103 HG2 ARG 103 19.625 0.463 -11.051 748 HG3 ARG 103 HG3 ARG 103 19.424 -0.093 -9.388 749 HD2 ARG 103 HD2 ARG 103 17.658 -1.556 -10.002 750 HD3 ARG 103 HD3 ARG 103 17.529 -0.835 -11.606 751 HE ARG 103 HE ARG 103 19.268 -2.156 -12.304 752 HH11 ARG 103 HH11 ARG 103 19.111 -2.198 -8.827 753 HH12 ARG 103 HH12 ARG 103 20.283 -3.464 -8.660 754 HH21 ARG 103 HH21 ARG 103 20.812 -3.822 -12.098 755 HH22 ARG 103 HH22 ARG 103 21.250 -4.387 -10.520 756 H ARG 104 H ARG 104 19.923 3.459 -7.389 757 HA ARG 104 HA ARG 104 19.572 1.249 -5.477 758 HB2 ARG 104 HB2 ARG 104 21.982 1.872 -4.749 759 HB3 ARG 104 HB3 ARG 104 21.756 0.869 -6.177 760 HG2 ARG 104 HG2 ARG 104 23.432 2.507 -6.644 761 HG3 ARG 104 HG3 ARG 104 21.987 2.901 -7.578 762 HD2 ARG 104 HD2 ARG 104 21.381 4.622 -6.013 763 HD3 ARG 104 HD3 ARG 104 22.690 4.154 -4.928 764 HE ARG 104 HE ARG 104 23.965 4.772 -7.242 765 HH11 ARG 104 HH11 ARG 104 21.679 6.446 -5.219 766 HH12 ARG 104 HH12 ARG 104 22.283 8.021 -5.615 767 HH21 ARG 104 HH21 ARG 104 24.769 6.841 -7.772 768 HH22 ARG 104 HH22 ARG 104 24.040 8.244 -7.068 769 H TYR 105 H TYR 105 18.042 3.608 -5.539 770 HA TYR 105 HA TYR 105 18.991 5.661 -3.881 771 HB2 TYR 105 HB2 TYR 105 16.111 4.780 -4.093 772 HB3 TYR 105 HB3 TYR 105 16.717 6.388 -3.712 773 HD1 TYR 105 HD2 TYR 105 18.319 7.391 -5.608 774 HD2 TYR 105 HD1 TYR 105 15.341 4.417 -6.234 775 HE1 TYR 105 HE2 TYR 105 18.223 7.997 -7.990 776 HE2 TYR 105 HE1 TYR 105 15.237 5.014 -8.618 777 HH TYR 105 HH TYR 105 15.926 7.468 -9.932 778 H THR 106 H THR 106 17.756 2.504 -3.162 779 HA THR 106 HA THR 106 17.634 3.147 -0.296 780 HB THR 106 HB THR 106 16.594 0.710 -1.756 781 HG1 THR 106 HG1 THR 106 14.667 1.693 -1.697 782 HG21 THR 106 HG21 THR 106 15.376 0.408 0.481 783 HG22 THR 106 HG22 THR 106 16.582 1.515 1.140 784 HG23 THR 106 HG23 THR 106 17.087 -0.014 0.421 785 H ILE 107 H ILE 107 19.034 2.280 1.127 786 HA ILE 107 HA ILE 107 21.294 0.802 0.067 787 HB ILE 107 HB ILE 107 20.742 1.950 2.801 788 HG12 ILE 107 HG12 ILE 107 23.039 3.089 1.815 789 HG13 ILE 107 HG13 ILE 107 22.075 2.886 0.357 790 HG21 ILE 107 HG21 ILE 107 22.769 0.025 1.898 791 HG22 ILE 107 HG22 ILE 107 23.392 1.396 2.812 792 HG23 ILE 107 HG23 ILE 107 22.157 0.354 3.518 793 HD11 ILE 107 HD11 ILE 107 20.242 4.119 1.420 794 HD12 ILE 107 HD12 ILE 107 21.249 4.355 2.849 795 HD13 ILE 107 HD13 ILE 107 21.721 5.073 1.309 796 H ALA 108 H ALA 108 21.110 -1.331 -0.123 797 HA ALA 108 HA ALA 108 19.432 -2.836 1.724 798 HB1 ALA 108 HB1 ALA 108 19.215 -3.290 -0.662 799 HB2 ALA 108 HB2 ALA 108 20.919 -3.743 -0.738 800 HB3 ALA 108 HB3 ALA 108 19.789 -4.715 0.204 801 H ALA 109 H ALA 109 20.327 -3.465 3.573 802 HA ALA 109 HA ALA 109 23.046 -4.589 3.495 803 HB1 ALA 109 HB1 ALA 109 23.335 -3.667 5.829 804 HB2 ALA 109 HB2 ALA 109 23.337 -2.481 4.524 805 HB3 ALA 109 HB3 ALA 109 21.899 -2.689 5.524 806 H MET 110 H MET 110 23.018 -6.658 4.050 807 HA MET 110 HA MET 110 20.907 -7.599 5.876 808 HB2 MET 110 HB2 MET 110 22.376 -8.993 3.644 809 HB3 MET 110 HB3 MET 110 21.445 -9.872 4.850 810 HG2 MET 110 HG2 MET 110 19.490 -8.385 4.183 811 HG3 MET 110 HG3 MET 110 20.465 -7.933 2.787 812 HE1 MET 110 HE1 MET 110 17.816 -10.961 3.845 813 HE2 MET 110 HE2 MET 110 19.156 -12.103 3.955 814 HE3 MET 110 HE3 MET 110 19.169 -10.631 4.927 815 H LEU 111 H LEU 111 21.500 -8.327 7.810 816 HA LEU 111 HA LEU 111 24.324 -8.543 8.440 817 HB2 LEU 111 HB2 LEU 111 21.936 -8.893 10.243 818 HB3 LEU 111 HB3 LEU 111 23.613 -8.693 10.745 819 HG LEU 111 HG LEU 111 22.714 -6.603 11.143 820 HD11 LEU 111 HD11 LEU 111 23.803 -5.140 9.696 821 HD12 LEU 111 HD12 LEU 111 23.530 -6.172 8.292 822 HD13 LEU 111 HD13 LEU 111 24.703 -6.647 9.520 823 HD21 LEU 111 HD21 LEU 111 20.910 -5.675 10.128 824 HD22 LEU 111 HD22 LEU 111 20.613 -7.356 9.686 825 HD23 LEU 111 HD23 LEU 111 21.367 -6.258 8.528 826 H SER 112 H SER 112 24.819 -10.449 7.251 827 HA SER 112 HA SER 112 23.547 -12.894 7.387 828 HB2 SER 112 HB2 SER 112 26.344 -12.027 6.850 829 HB3 SER 112 HB3 SER 112 26.075 -13.742 7.163 830 HG SER 112 HG SER 112 25.891 -12.903 4.896 831 HA PRO 113 HA PRO 113 24.168 -14.592 11.383 832 HB2 PRO 113 HB2 PRO 113 24.674 -17.203 10.836 833 HB3 PRO 113 HB3 PRO 113 23.073 -16.474 10.648 834 HG2 PRO 113 HG2 PRO 113 25.156 -17.033 8.572 835 HG3 PRO 113 HG3 PRO 113 23.402 -17.289 8.495 836 HD2 PRO 113 HD2 PRO 113 24.614 -15.156 7.348 837 HD3 PRO 113 HD3 PRO 113 22.972 -15.075 8.021 838 H TYR 114 H TYR 114 26.607 -15.843 9.097 839 HA TYR 114 HA TYR 114 28.782 -14.886 10.669 840 HB2 TYR 114 HB2 TYR 114 28.214 -16.791 12.073 841 HB3 TYR 114 HB3 TYR 114 28.253 -17.864 10.679 842 HD1 TYR 114 HD1 TYR 114 30.537 -15.307 12.184 843 HD2 TYR 114 HD2 TYR 114 30.100 -19.230 10.597 844 HE1 TYR 114 HE1 TYR 114 32.927 -15.728 12.581 845 HE2 TYR 114 HE2 TYR 114 32.488 -19.662 10.990 846 HH TYR 114 HH TYR 114 34.457 -18.745 11.550 847 H SER 115 H SER 115 30.762 -15.044 9.601 848 HA SER 115 HA SER 115 30.717 -16.321 6.953 849 HB2 SER 115 HB2 SER 115 30.317 -13.786 6.902 850 HB3 SER 115 HB3 SER 115 31.998 -13.629 7.412 851 HG SER 115 HG SER 115 32.556 -14.869 5.533 852 H TYR 116 H TYR 116 32.500 -17.450 6.455 853 HA TYR 116 HA TYR 116 34.848 -17.143 8.211 854 HB2 TYR 116 HB2 TYR 116 33.546 -19.260 8.562 855 HB3 TYR 116 HB3 TYR 116 33.926 -19.710 6.904 856 HD1 TYR 116 HD2 TYR 116 35.703 -18.570 9.994 857 HD2 TYR 116 HD1 TYR 116 35.732 -21.103 6.575 858 HE1 TYR 116 HE2 TYR 116 37.819 -19.565 10.755 859 HE2 TYR 116 HE1 TYR 116 37.849 -22.105 7.327 860 HH TYR 116 HH TYR 116 39.513 -21.994 8.807 861 H SER 117 H SER 117 33.760 -18.176 4.991 862 HA SER 117 HA SER 117 36.434 -17.502 3.955 863 HB2 SER 117 HB2 SER 117 35.959 -19.821 3.546 864 HB3 SER 117 HB3 SER 117 34.356 -19.441 2.920 865 HG SER 117 HG SER 117 36.866 -18.848 1.746 866 H THR 118 H THR 118 36.004 -15.298 3.684 867 HA THR 118 HA THR 118 34.482 -14.682 1.280 868 HB THR 118 HB THR 118 32.852 -14.348 3.093 869 HG1 THR 118 HG1 THR 118 33.025 -12.893 1.197 870 HG21 THR 118 HG21 THR 118 33.169 -12.742 4.827 871 HG22 THR 118 HG22 THR 118 34.685 -12.185 4.118 872 HG23 THR 118 HG23 THR 118 34.584 -13.793 4.835 873 H THR 119 H THR 119 34.820 -12.357 0.624 874 HA THR 119 HA THR 119 37.360 -11.260 1.600 875 HB THR 119 HB THR 119 36.812 -11.403 -1.355 876 HG1 THR 119 HG1 THR 119 38.177 -13.295 0.281 877 HG21 THR 119 HG21 THR 119 38.592 -9.910 -0.035 878 HG22 THR 119 HG22 THR 119 38.927 -10.600 -1.622 879 HG23 THR 119 HG23 THR 119 39.530 -11.397 -0.170 880 H ALA 120 H ALA 120 36.483 -9.450 2.489 881 HA ALA 120 HA ALA 120 35.028 -7.655 0.657 882 HB1 ALA 120 HB1 ALA 120 34.397 -6.866 3.260 883 HB2 ALA 120 HB2 ALA 120 33.343 -7.680 2.102 884 HB3 ALA 120 HB3 ALA 120 34.277 -8.626 3.260 885 H VAL 121 H VAL 121 36.890 -6.565 0.003 886 HA VAL 121 HA VAL 121 37.968 -4.722 2.013 887 HB VAL 121 HB VAL 121 40.245 -4.977 1.105 888 HG11 VAL 121 HG11 VAL 121 39.158 -6.397 3.036 889 HG12 VAL 121 HG12 VAL 121 39.449 -7.730 1.917 890 HG13 VAL 121 HG13 VAL 121 40.794 -6.732 2.471 891 HG21 VAL 121 HG21 VAL 121 40.139 -5.795 -1.031 892 HG22 VAL 121 HG22 VAL 121 40.530 -7.275 -0.155 893 HG23 VAL 121 HG23 VAL 121 38.866 -6.953 -0.644 894 H VAL 122 H VAL 122 39.441 -3.052 0.803 895 HA VAL 122 HA VAL 122 37.961 -2.191 -1.597 896 HB VAL 122 HB VAL 122 38.819 0.119 -0.984 897 HG11 VAL 122 HG11 VAL 122 37.115 0.320 0.934 898 HG12 VAL 122 HG12 VAL 122 36.541 -0.233 -0.640 899 HG13 VAL 122 HG13 VAL 122 36.819 -1.397 0.656 900 HG21 VAL 122 HG21 VAL 122 40.061 0.470 0.836 901 HG22 VAL 122 HG22 VAL 122 39.025 -0.547 1.839 902 HG23 VAL 122 HG23 VAL 122 40.309 -1.276 0.873 903 H THR 123 H THR 123 39.536 -3.668 -2.705 904 HA THR 123 HA THR 123 41.413 -4.052 -3.945 905 HB THR 123 HB THR 123 42.162 -2.266 -5.302 906 HG1 THR 123 HG1 THR 123 42.558 -0.386 -4.435 907 HG21 THR 123 HG21 THR 123 40.196 -1.685 -6.272 908 HG22 THR 123 HG22 THR 123 39.501 -1.100 -4.761 909 HG23 THR 123 HG23 THR 123 39.537 -2.829 -5.104 910 H ASN 124 H ASN 124 41.930 -4.154 -1.221 911 HA ASN 124 HA ASN 124 44.747 -3.404 -1.199 912 HB2 ASN 124 HB2 ASN 124 42.686 -2.381 0.717 913 HB3 ASN 124 HB3 ASN 124 44.318 -2.694 1.299 914 HD21 ASN 124 HD21 ASN 124 42.294 -0.476 -0.155 915 HD22 ASN 124 HD22 ASN 124 43.485 0.648 -0.705 916 HA PRO 125 HA PRO 125 43.829 -7.662 0.430 917 HB2 PRO 125 HB2 PRO 125 45.707 -8.904 -1.088 918 HB3 PRO 125 HB3 PRO 125 44.061 -8.599 -1.656 919 HG2 PRO 125 HG2 PRO 125 46.570 -7.064 -2.211 920 HG3 PRO 125 HG3 PRO 125 45.271 -7.524 -3.326 921 HD2 PRO 125 HD2 PRO 125 45.467 -5.041 -2.263 922 HD3 PRO 125 HD3 PRO 125 43.907 -5.795 -2.649 923 H LYS 126 H LYS 126 45.581 -9.286 1.215 924 HA LYS 126 HA LYS 126 47.052 -8.138 3.249 925 HB2 LYS 126 HB2 LYS 126 48.039 -10.264 3.600 926 HB3 LYS 126 HB3 LYS 126 46.432 -10.580 2.957 927 HG2 LYS 126 HG2 LYS 126 48.907 -10.539 1.251 928 HG3 LYS 126 HG3 LYS 126 48.280 -11.998 2.023 929 HD2 LYS 126 HD2 LYS 126 46.038 -11.152 0.841 930 HD3 LYS 126 HD3 LYS 126 47.216 -10.446 -0.267 931 HE2 LYS 126 HE2 LYS 126 46.900 -12.511 -1.221 932 HE3 LYS 126 HE3 LYS 126 48.281 -12.835 -0.174 933 HZ1 LYS 126 HZ1 LYS 126 47.016 -14.521 0.541 934 HZ2 LYS 126 HZ2 LYS 126 45.574 -13.835 -0.020 935 HZ3 LYS 126 HZ3 LYS 126 46.223 -13.345 1.464 936 H GLU 127 H GLU 127 47.915 -8.613 -0.093 937 HA GLU 127 HA GLU 127 50.585 -7.498 0.465 938 HB2 GLU 127 HB2 GLU 127 51.193 -8.511 -1.785 939 HB3 GLU 127 HB3 GLU 127 50.911 -9.644 -0.470 940 HG2 GLU 127 HG2 GLU 127 49.273 -10.643 -1.575 941 HG3 GLU 127 HG3 GLU 127 48.476 -9.108 -1.916 Start of MODEL 18 1 H1 GLY 1 H GLY 1 0.588 -7.037 0.984 2 HA2 GLY 1 HA2 GLY 1 -0.204 -7.946 -1.694 3 HA3 GLY 1 HA3 GLY 1 0.479 -6.337 -1.518 4 HA PRO 2 HA PRO 2 3.910 -9.371 -2.349 5 HB2 PRO 2 HB2 PRO 2 5.022 -7.942 -4.372 6 HB3 PRO 2 HB3 PRO 2 3.728 -9.118 -4.625 7 HG2 PRO 2 HG2 PRO 2 3.563 -6.136 -4.413 8 HG3 PRO 2 HG3 PRO 2 2.741 -7.225 -5.547 9 HD2 PRO 2 HD2 PRO 2 1.515 -6.203 -3.359 10 HD3 PRO 2 HD3 PRO 2 1.124 -7.807 -4.011 11 H THR 3 H THR 3 6.343 -8.504 -2.866 12 HA THR 3 HA THR 3 7.295 -7.388 -0.531 13 HB THR 3 HB THR 3 9.417 -7.090 -1.617 14 HG1 THR 3 HG1 THR 3 8.000 -7.356 -4.079 15 HG21 THR 3 HG21 THR 3 8.515 -9.430 -1.282 16 HG22 THR 3 HG22 THR 3 9.794 -9.270 -2.486 17 HG23 THR 3 HG23 THR 3 8.115 -9.431 -2.999 18 H GLY 4 H GLY 4 7.773 -5.360 0.194 19 HA2 GLY 4 HA2 GLY 4 6.528 -3.160 -1.271 20 HA3 GLY 4 HA3 GLY 4 7.051 -3.127 0.406 21 H THR 5 H THR 5 7.854 -2.378 -2.819 22 HA THR 5 HA THR 5 10.321 -1.118 -1.924 23 HB THR 5 HB THR 5 11.688 -2.035 -3.703 24 HG1 THR 5 HG1 THR 5 10.602 -2.741 -5.380 25 HG21 THR 5 HG21 THR 5 10.310 -4.309 -2.273 26 HG22 THR 5 HG22 THR 5 11.522 -3.261 -1.535 27 HG23 THR 5 HG23 THR 5 11.957 -4.286 -2.902 28 H GLY 6 H GLY 6 10.245 0.911 -2.617 29 HA2 GLY 6 HA2 GLY 6 10.353 2.394 -4.553 30 HA3 GLY 6 HA3 GLY 6 9.069 1.435 -5.275 31 H GLU 7 H GLU 7 9.319 2.715 -1.977 32 HA GLU 7 HA GLU 7 7.337 4.750 -2.498 33 HB2 GLU 7 HB2 GLU 7 6.129 2.498 -2.113 34 HB3 GLU 7 HB3 GLU 7 6.623 2.682 -0.436 35 HG2 GLU 7 HG2 GLU 7 4.572 3.641 -0.329 36 HG3 GLU 7 HG3 GLU 7 5.530 5.063 -0.738 37 H SER 8 H SER 8 8.021 6.455 -1.405 38 HA SER 8 HA SER 8 8.483 6.474 1.371 39 HB2 SER 8 HB2 SER 8 10.794 6.534 1.607 40 HB3 SER 8 HB3 SER 8 10.601 5.313 0.349 41 HG SER 8 HG SER 8 10.923 7.080 -1.173 42 H LYS 9 H LYS 9 9.833 8.618 1.919 43 HA LYS 9 HA LYS 9 8.714 10.719 0.184 44 HB2 LYS 9 HB2 LYS 9 9.411 11.034 3.101 45 HB3 LYS 9 HB3 LYS 9 8.439 12.105 2.100 46 HG2 LYS 9 HG2 LYS 9 6.776 11.057 3.228 47 HG3 LYS 9 HG3 LYS 9 6.942 9.931 1.879 48 HD2 LYS 9 HD2 LYS 9 8.749 8.863 3.521 49 HD3 LYS 9 HD3 LYS 9 7.704 9.616 4.728 50 HE2 LYS 9 HE2 LYS 9 6.692 7.807 2.542 51 HE3 LYS 9 HE3 LYS 9 7.145 7.234 4.147 52 HZ1 LYS 9 HZ1 LYS 9 4.903 7.578 4.377 53 HZ2 LYS 9 HZ2 LYS 9 4.877 8.927 3.356 54 HZ3 LYS 9 HZ3 LYS 9 5.504 9.065 4.920 55 H CYS 10 H CYS 10 11.251 10.547 2.685 56 HA CYS 10 HA CYS 10 12.849 12.575 1.715 57 HB2 CYS 10 HB2 CYS 10 14.736 11.373 2.901 58 HB3 CYS 10 HB3 CYS 10 13.309 11.697 3.879 59 HG CYS 10 HG CYS 10 13.507 9.287 4.800 60 HA PRO 11 HA PRO 11 14.807 11.152 -1.945 61 HB2 PRO 11 HB2 PRO 11 17.263 12.287 -1.721 62 HB3 PRO 11 HB3 PRO 11 15.803 13.219 -2.078 63 HG2 PRO 11 HG2 PRO 11 17.223 12.848 0.531 64 HG3 PRO 11 HG3 PRO 11 16.532 14.324 -0.167 65 HD2 PRO 11 HD2 PRO 11 15.263 12.884 1.742 66 HD3 PRO 11 HD3 PRO 11 14.389 13.780 0.483 67 H LEU 12 H LEU 12 16.616 10.710 1.062 68 HA LEU 12 HA LEU 12 17.709 8.212 -0.052 69 HB2 LEU 12 HB2 LEU 12 19.571 9.620 0.076 70 HB3 LEU 12 HB3 LEU 12 19.045 10.323 1.604 71 HG LEU 12 HG LEU 12 19.469 7.961 2.570 72 HD11 LEU 12 HD11 LEU 12 20.023 6.455 1.015 73 HD12 LEU 12 HD12 LEU 12 21.616 7.210 1.054 74 HD13 LEU 12 HD13 LEU 12 20.443 7.692 -0.170 75 HD21 LEU 12 HD21 LEU 12 22.114 8.908 1.985 76 HD22 LEU 12 HD22 LEU 12 21.205 8.988 3.496 77 HD23 LEU 12 HD23 LEU 12 21.036 10.270 2.295 78 H MET 13 H MET 13 17.530 6.417 1.186 79 HA MET 13 HA MET 13 16.728 6.694 3.985 80 HB2 MET 13 HB2 MET 13 14.902 5.100 3.729 81 HB3 MET 13 HB3 MET 13 14.642 6.501 2.700 82 HG2 MET 13 HG2 MET 13 14.910 5.322 0.778 83 HG3 MET 13 HG3 MET 13 16.019 4.166 1.511 84 HE1 MET 13 HE1 MET 13 15.404 2.783 3.372 85 HE2 MET 13 HE2 MET 13 13.775 2.571 4.015 86 HE3 MET 13 HE3 MET 13 14.394 1.457 2.795 87 H VAL 14 H VAL 14 17.213 4.902 5.289 88 HA VAL 14 HA VAL 14 19.159 3.056 4.084 89 HB VAL 14 HB VAL 14 18.767 3.830 6.979 90 HG11 VAL 14 HG11 VAL 14 20.896 2.579 7.326 91 HG12 VAL 14 HG12 VAL 14 19.526 1.559 6.883 92 HG13 VAL 14 HG13 VAL 14 20.748 1.967 5.679 93 HG21 VAL 14 HG21 VAL 14 21.113 4.425 5.189 94 HG22 VAL 14 HG22 VAL 14 19.769 5.544 5.422 95 HG23 VAL 14 HG23 VAL 14 20.777 5.077 6.792 96 H LYS 15 H LYS 15 18.787 0.928 4.017 97 HA LYS 15 HA LYS 15 16.480 -0.122 5.521 98 HB2 LYS 15 HB2 LYS 15 15.867 -0.062 3.206 99 HB3 LYS 15 HB3 LYS 15 17.399 -0.780 2.723 100 HG2 LYS 15 HG2 LYS 15 15.681 -2.438 2.569 101 HG3 LYS 15 HG3 LYS 15 16.750 -2.854 3.910 102 HD2 LYS 15 HD2 LYS 15 14.461 -1.168 4.642 103 HD3 LYS 15 HD3 LYS 15 14.033 -2.776 4.056 104 HE2 LYS 15 HE2 LYS 15 16.057 -3.392 5.730 105 HE3 LYS 15 HE3 LYS 15 15.416 -1.958 6.529 106 HZ1 LYS 15 HZ1 LYS 15 14.104 -3.537 7.461 107 HZ2 LYS 15 HZ2 LYS 15 14.174 -4.572 6.125 108 HZ3 LYS 15 HZ3 LYS 15 13.162 -3.217 6.093 109 H VAL 16 H VAL 16 17.254 -1.328 7.127 110 HA VAL 16 HA VAL 16 19.418 -3.233 6.511 111 HB VAL 16 HB VAL 16 18.969 -1.809 9.137 112 HG11 VAL 16 HG11 VAL 16 20.338 -4.247 8.487 113 HG12 VAL 16 HG12 VAL 16 21.487 -3.041 9.068 114 HG13 VAL 16 HG13 VAL 16 20.098 -3.486 10.059 115 HG21 VAL 16 HG21 VAL 16 21.292 -0.907 8.595 116 HG22 VAL 16 HG22 VAL 16 20.989 -1.445 6.943 117 HG23 VAL 16 HG23 VAL 16 19.938 -0.238 7.682 118 H LEU 17 H LEU 17 18.769 -5.269 6.652 119 HA LEU 17 HA LEU 17 16.845 -6.018 8.734 120 HB2 LEU 17 HB2 LEU 17 15.413 -7.135 7.303 121 HB3 LEU 17 HB3 LEU 17 15.799 -5.665 6.411 122 HG LEU 17 HG LEU 17 17.688 -7.489 5.530 123 HD11 LEU 17 HD11 LEU 17 15.235 -8.999 5.058 124 HD12 LEU 17 HD12 LEU 17 15.786 -9.043 6.732 125 HD13 LEU 17 HD13 LEU 17 16.862 -9.563 5.436 126 HD21 LEU 17 HD21 LEU 17 16.057 -5.739 4.406 127 HD22 LEU 17 HD22 LEU 17 15.128 -7.194 4.050 128 HD23 LEU 17 HD23 LEU 17 16.791 -7.048 3.480 129 H ASP 18 H ASP 18 16.955 -8.205 9.396 130 HA ASP 18 HA ASP 18 19.595 -9.339 9.147 131 HB2 ASP 18 HB2 ASP 18 17.209 -9.804 10.850 132 HB3 ASP 18 HB3 ASP 18 18.277 -11.181 10.595 133 H ALA 19 H ALA 19 20.209 -10.902 7.804 134 HA ALA 19 HA ALA 19 18.324 -12.005 5.929 135 HB1 ALA 19 HB1 ALA 19 21.189 -12.852 6.179 136 HB2 ALA 19 HB2 ALA 19 20.168 -12.807 4.742 137 HB3 ALA 19 HB3 ALA 19 20.744 -11.304 5.461 138 H VAL 20 H VAL 20 19.050 -12.800 9.023 139 HA VAL 20 HA VAL 20 19.208 -15.665 8.766 140 HB VAL 20 HB VAL 20 18.609 -14.052 11.249 141 HG11 VAL 20 HG11 VAL 20 18.098 -16.479 11.339 142 HG12 VAL 20 HG12 VAL 20 19.788 -16.813 10.957 143 HG13 VAL 20 HG13 VAL 20 19.370 -15.989 12.459 144 HG21 VAL 20 HG21 VAL 20 20.659 -13.191 10.625 145 HG22 VAL 20 HG22 VAL 20 21.138 -14.561 11.628 146 HG23 VAL 20 HG23 VAL 20 21.182 -14.697 9.870 147 H ARG 21 H ARG 21 16.729 -13.308 9.689 148 HA ARG 21 HA ARG 21 14.724 -15.461 9.498 149 HB2 ARG 21 HB2 ARG 21 14.311 -12.887 11.003 150 HB3 ARG 21 HB3 ARG 21 13.409 -14.390 11.137 151 HG2 ARG 21 HG2 ARG 21 14.646 -14.600 13.010 152 HG3 ARG 21 HG3 ARG 21 15.814 -15.280 11.875 153 HD2 ARG 21 HD2 ARG 21 16.797 -12.997 11.640 154 HD3 ARG 21 HD3 ARG 21 15.720 -12.458 12.927 155 HE ARG 21 HE ARG 21 18.109 -14.043 13.209 156 HH11 ARG 21 HH11 ARG 21 15.085 -13.101 14.654 157 HH12 ARG 21 HH12 ARG 21 15.595 -13.460 16.270 158 HH21 ARG 21 HH21 ARG 21 18.793 -14.519 15.332 159 HH22 ARG 21 HH22 ARG 21 17.706 -14.265 16.655 160 H GLY 22 H GLY 22 15.773 -12.396 8.334 161 HA2 GLY 22 HA2 GLY 22 15.081 -11.487 6.270 162 HA3 GLY 22 HA3 GLY 22 13.593 -12.415 6.386 163 H SER 23 H SER 23 14.111 -11.033 9.340 164 HA SER 23 HA SER 23 12.124 -8.971 8.793 165 HB2 SER 23 HB2 SER 23 12.648 -8.847 11.496 166 HB3 SER 23 HB3 SER 23 11.378 -9.816 10.749 167 HG SER 23 HG SER 23 12.490 -11.578 11.126 168 HA PRO 24 HA PRO 24 14.789 -5.496 9.040 169 HB2 PRO 24 HB2 PRO 24 13.359 -3.744 10.541 170 HB3 PRO 24 HB3 PRO 24 12.924 -4.163 8.881 171 HG2 PRO 24 HG2 PRO 24 11.801 -5.202 11.453 172 HG3 PRO 24 HG3 PRO 24 10.950 -4.727 9.972 173 HD2 PRO 24 HD2 PRO 24 11.459 -7.313 10.594 174 HD3 PRO 24 HD3 PRO 24 11.406 -6.726 8.919 175 H ALA 25 H ALA 25 16.311 -4.436 10.317 176 HA ALA 25 HA ALA 25 16.713 -5.615 12.965 177 HB1 ALA 25 HB1 ALA 25 18.637 -3.922 11.381 178 HB2 ALA 25 HB2 ALA 25 18.993 -4.923 12.789 179 HB3 ALA 25 HB3 ALA 25 18.536 -5.679 11.262 180 H ILE 26 H ILE 26 16.690 -4.464 14.822 181 HA ILE 26 HA ILE 26 15.930 -1.632 14.614 182 HB ILE 26 HB ILE 26 15.233 -3.795 16.517 183 HG12 ILE 26 HG12 ILE 26 13.793 -2.593 14.687 184 HG13 ILE 26 HG13 ILE 26 13.074 -2.996 16.244 185 HG21 ILE 26 HG21 ILE 26 16.320 -2.418 18.090 186 HG22 ILE 26 HG22 ILE 26 15.693 -0.945 17.351 187 HG23 ILE 26 HG23 ILE 26 14.606 -2.025 18.223 188 HD11 ILE 26 HD11 ILE 26 13.388 -0.718 17.002 189 HD12 ILE 26 HD12 ILE 26 14.180 -0.304 15.482 190 HD13 ILE 26 HD13 ILE 26 12.473 -0.751 15.495 191 H ASN 27 H ASN 27 17.067 -0.054 15.639 192 HA ASN 27 HA ASN 27 18.805 0.996 16.664 193 HB2 ASN 27 HB2 ASN 27 19.172 -1.587 18.195 194 HB3 ASN 27 HB3 ASN 27 19.745 0.011 18.664 195 HD21 ASN 27 HD21 ASN 27 17.431 1.459 17.953 196 HD22 ASN 27 HD22 ASN 27 16.181 1.044 19.071 197 H VAL 28 H VAL 28 19.556 0.404 14.299 198 HA VAL 28 HA VAL 28 22.108 -1.059 14.501 199 HB VAL 28 HB VAL 28 20.450 -0.545 12.027 200 HG11 VAL 28 HG11 VAL 28 22.867 -0.614 11.596 201 HG12 VAL 28 HG12 VAL 28 22.953 -2.193 12.380 202 HG13 VAL 28 HG13 VAL 28 22.030 -1.995 10.888 203 HG21 VAL 28 HG21 VAL 28 19.277 -2.332 12.638 204 HG22 VAL 28 HG22 VAL 28 20.748 -3.292 12.468 205 HG23 VAL 28 HG23 VAL 28 20.320 -2.603 14.034 206 H ALA 29 H ALA 29 23.744 0.317 14.728 207 HA ALA 29 HA ALA 29 23.734 3.037 14.181 208 HB1 ALA 29 HB1 ALA 29 26.347 2.552 14.003 209 HB2 ALA 29 HB2 ALA 29 25.479 2.521 15.538 210 HB3 ALA 29 HB3 ALA 29 25.834 1.013 14.695 211 H VAL 30 H VAL 30 23.909 4.219 12.389 212 HA VAL 30 HA VAL 30 25.087 3.018 9.985 213 HB VAL 30 HB VAL 30 22.501 4.573 9.915 214 HG11 VAL 30 HG11 VAL 30 24.047 4.617 7.917 215 HG12 VAL 30 HG12 VAL 30 23.747 2.884 7.758 216 HG13 VAL 30 HG13 VAL 30 22.412 4.028 7.614 217 HG21 VAL 30 HG21 VAL 30 23.020 1.727 10.371 218 HG22 VAL 30 HG22 VAL 30 21.572 2.682 10.689 219 HG23 VAL 30 HG23 VAL 30 21.879 2.057 9.068 220 H HIS 31 H HIS 31 26.399 4.359 8.897 221 HA HIS 31 HA HIS 31 26.256 7.237 9.500 222 HB2 HIS 31 HB2 HIS 31 28.815 5.689 9.069 223 HB3 HIS 31 HB3 HIS 31 28.659 7.378 9.547 224 HD1 HIS 31 HD1 HIS 31 29.753 4.507 11.026 225 HD2 HIS 31 HD2 HIS 31 26.782 7.196 12.122 226 HE1 HIS 31 HE1 HIS 31 29.440 4.191 13.501 227 H VAL 32 H VAL 32 25.850 8.382 7.739 228 HA VAL 32 HA VAL 32 26.523 7.248 5.116 229 HB VAL 32 HB VAL 32 24.719 9.601 5.682 230 HG11 VAL 32 HG11 VAL 32 24.097 8.146 3.310 231 HG12 VAL 32 HG12 VAL 32 24.613 9.825 3.477 232 HG13 VAL 32 HG13 VAL 32 25.814 8.544 3.302 233 HG21 VAL 32 HG21 VAL 32 23.628 7.838 6.758 234 HG22 VAL 32 HG22 VAL 32 22.900 7.868 5.151 235 HG23 VAL 32 HG23 VAL 32 24.127 6.663 5.542 236 H PHE 33 H PHE 33 27.876 8.248 3.717 237 HA PHE 33 HA PHE 33 28.962 10.870 4.493 238 HB2 PHE 33 HB2 PHE 33 30.469 8.389 3.685 239 HB3 PHE 33 HB3 PHE 33 31.179 9.994 3.538 240 HD1 PHE 33 HD1 PHE 33 29.672 7.641 5.976 241 HD2 PHE 33 HD2 PHE 33 32.183 11.024 5.371 242 HE1 PHE 33 HE1 PHE 33 30.363 7.546 8.335 243 HE2 PHE 33 HE2 PHE 33 32.879 10.933 7.728 244 HZ PHE 33 HZ PHE 33 31.968 9.193 9.215 245 H ARG 34 H ARG 34 30.116 11.957 2.665 246 HA ARG 34 HA ARG 34 29.001 11.213 0.048 247 HB2 ARG 34 HB2 ARG 34 27.616 13.007 0.993 248 HB3 ARG 34 HB3 ARG 34 29.050 14.001 1.216 249 HG2 ARG 34 HG2 ARG 34 28.536 13.004 -1.517 250 HG3 ARG 34 HG3 ARG 34 27.435 14.231 -0.888 251 HD2 ARG 34 HD2 ARG 34 29.456 15.595 -0.290 252 HD3 ARG 34 HD3 ARG 34 30.427 14.417 -1.172 253 HE ARG 34 HE ARG 34 28.875 16.513 -2.290 254 HH11 ARG 34 HH11 ARG 34 29.898 13.231 -2.840 255 HH12 ARG 34 HH12 ARG 34 29.779 13.345 -4.565 256 HH21 ARG 34 HH21 ARG 34 28.712 16.675 -4.559 257 HH22 ARG 34 HH22 ARG 34 29.105 15.304 -5.541 258 H LYS 35 H LYS 35 30.327 11.524 -1.685 259 HA LYS 35 HA LYS 35 33.090 11.622 -1.293 260 HB2 LYS 35 HB2 LYS 35 32.435 10.602 -3.279 261 HB3 LYS 35 HB3 LYS 35 31.319 11.897 -3.694 262 HG2 LYS 35 HG2 LYS 35 33.227 11.919 -5.176 263 HG3 LYS 35 HG3 LYS 35 33.217 13.370 -4.172 264 HD2 LYS 35 HD2 LYS 35 35.459 12.585 -4.227 265 HD3 LYS 35 HD3 LYS 35 34.817 12.183 -2.632 266 HE2 LYS 35 HE2 LYS 35 35.678 10.152 -3.089 267 HE3 LYS 35 HE3 LYS 35 34.177 9.943 -3.990 268 HZ1 LYS 35 HZ1 LYS 35 36.645 9.635 -5.018 269 HZ2 LYS 35 HZ2 LYS 35 36.283 11.219 -5.486 270 HZ3 LYS 35 HZ3 LYS 35 35.255 9.952 -5.931 271 H ALA 36 H ALA 36 34.139 13.314 -0.466 272 HA ALA 36 HA ALA 36 33.267 16.007 -0.727 273 HB1 ALA 36 HB1 ALA 36 34.820 14.804 1.054 274 HB2 ALA 36 HB2 ALA 36 36.087 15.425 -0.006 275 HB3 ALA 36 HB3 ALA 36 34.933 16.535 0.733 276 H ALA 37 H ALA 37 34.373 17.748 -1.775 277 HA ALA 37 HA ALA 37 34.993 17.271 -4.462 278 HB1 ALA 37 HB1 ALA 37 34.215 19.438 -3.338 279 HB2 ALA 37 HB2 ALA 37 35.923 19.713 -2.990 280 HB3 ALA 37 HB3 ALA 37 35.375 19.566 -4.660 281 H ASP 38 H ASP 38 36.932 17.031 -1.652 282 HA ASP 38 HA ASP 38 39.430 17.233 -3.155 283 HB2 ASP 38 HB2 ASP 38 38.686 17.269 -0.275 284 HB3 ASP 38 HB3 ASP 38 40.271 16.618 -0.687 285 H ASP 39 H ASP 39 37.311 14.988 -3.206 286 HA ASP 39 HA ASP 39 37.323 12.743 -3.576 287 HB2 ASP 39 HB2 ASP 39 40.312 12.670 -3.336 288 HB3 ASP 39 HB3 ASP 39 39.259 11.743 -4.401 289 H THR 40 H THR 40 37.018 13.684 -0.946 290 HA THR 40 HA THR 40 38.260 11.495 0.591 291 HB THR 40 HB THR 40 38.405 12.841 2.522 292 HG1 THR 40 HG1 THR 40 37.330 14.756 2.763 293 HG21 THR 40 HG21 THR 40 40.151 13.340 0.886 294 HG22 THR 40 HG22 THR 40 39.737 14.779 1.818 295 HG23 THR 40 HG23 THR 40 39.135 14.592 0.171 296 H TRP 41 H TRP 41 36.854 11.560 2.878 297 HA TRP 41 HA TRP 41 34.100 11.010 1.991 298 HB2 TRP 41 HB2 TRP 41 35.839 9.705 4.070 299 HB3 TRP 41 HB3 TRP 41 34.086 9.542 4.119 300 HD1 TRP 41 HD1 TRP 41 36.365 9.371 0.989 301 HE1 TRP 41 HE1 TRP 41 35.977 7.097 -0.151 302 HE3 TRP 41 HE3 TRP 41 33.159 7.297 4.389 303 HZ2 TRP 41 HZ2 TRP 41 34.505 4.736 0.327 304 HZ3 TRP 41 HZ3 TRP 41 32.306 5.027 3.973 305 HH2 TRP 41 HH2 TRP 41 32.966 3.774 1.983 306 H GLU 42 H GLU 42 32.862 12.705 2.509 307 HA GLU 42 HA GLU 42 33.300 14.071 5.064 308 HB2 GLU 42 HB2 GLU 42 31.804 14.824 2.562 309 HB3 GLU 42 HB3 GLU 42 31.596 15.707 4.067 310 HG2 GLU 42 HG2 GLU 42 34.358 15.284 3.071 311 HG3 GLU 42 HG3 GLU 42 33.339 16.454 2.234 312 HA PRO 43 HA PRO 43 29.783 12.254 6.968 313 HB2 PRO 43 HB2 PRO 43 29.081 14.245 8.675 314 HB3 PRO 43 HB3 PRO 43 30.506 13.229 8.918 315 HG2 PRO 43 HG2 PRO 43 30.320 15.985 7.764 316 HG3 PRO 43 HG3 PRO 43 31.503 15.330 8.911 317 HD2 PRO 43 HD2 PRO 43 32.033 15.608 6.272 318 HD3 PRO 43 HD3 PRO 43 32.731 14.303 7.253 319 H PHE 44 H PHE 44 27.918 11.974 5.924 320 HA PHE 44 HA PHE 44 26.477 14.319 4.906 321 HB2 PHE 44 HB2 PHE 44 27.004 12.524 3.289 322 HB3 PHE 44 HB3 PHE 44 26.075 11.390 4.264 323 HD1 PHE 44 HD2 PHE 44 23.609 11.753 4.531 324 HD2 PHE 44 HD1 PHE 44 25.960 13.931 1.730 325 HE1 PHE 44 HE2 PHE 44 21.568 12.369 3.303 326 HE2 PHE 44 HE1 PHE 44 23.922 14.552 0.498 327 HZ PHE 44 HZ PHE 44 21.722 13.770 1.283 328 H ALA 45 H ALA 45 26.027 11.390 6.839 329 HA ALA 45 HA ALA 45 24.118 12.640 8.532 330 HB1 ALA 45 HB1 ALA 45 22.960 10.460 6.816 331 HB2 ALA 45 HB2 ALA 45 22.123 11.525 7.945 332 HB3 ALA 45 HB3 ALA 45 22.772 12.172 6.439 333 H SER 46 H SER 46 22.994 10.854 9.936 334 HA SER 46 HA SER 46 24.260 8.337 10.203 335 HB2 SER 46 HB2 SER 46 26.171 9.086 11.182 336 HB3 SER 46 HB3 SER 46 25.449 10.626 11.646 337 HG SER 46 HG SER 46 25.835 9.456 13.503 338 H GLY 47 H GLY 47 23.382 7.075 11.912 339 HA2 GLY 47 HA2 GLY 47 21.768 7.895 13.984 340 HA3 GLY 47 HA3 GLY 47 20.702 7.805 12.589 341 H LYS 48 H LYS 48 19.551 6.148 13.740 342 HA LYS 48 HA LYS 48 20.845 3.521 13.456 343 HB2 LYS 48 HB2 LYS 48 19.512 4.702 15.826 344 HB3 LYS 48 HB3 LYS 48 19.142 3.018 15.481 345 HG2 LYS 48 HG2 LYS 48 21.511 2.468 15.548 346 HG3 LYS 48 HG3 LYS 48 21.904 4.161 15.857 347 HD2 LYS 48 HD2 LYS 48 20.173 2.454 17.643 348 HD3 LYS 48 HD3 LYS 48 21.894 2.744 17.901 349 HE2 LYS 48 HE2 LYS 48 21.057 5.275 17.659 350 HE3 LYS 48 HE3 LYS 48 19.578 4.547 18.282 351 HZ1 LYS 48 HZ1 LYS 48 21.038 5.393 20.043 352 HZ2 LYS 48 HZ2 LYS 48 22.246 4.312 19.563 353 HZ3 LYS 48 HZ3 LYS 48 20.782 3.726 20.177 354 H THR 49 H THR 49 19.686 2.040 12.378 355 HA THR 49 HA THR 49 17.439 2.707 10.890 356 HB THR 49 HB THR 49 17.218 0.367 10.343 357 HG1 THR 49 HG1 THR 49 17.887 -1.194 11.652 358 HG21 THR 49 HG21 THR 49 19.011 0.989 9.101 359 HG22 THR 49 HG22 THR 49 19.861 -0.129 10.168 360 HG23 THR 49 HG23 THR 49 19.897 1.604 10.496 361 H SER 50 H SER 50 15.336 1.359 10.995 362 HA SER 50 HA SER 50 14.377 1.249 13.777 363 HB2 SER 50 HB2 SER 50 12.940 2.416 11.384 364 HB3 SER 50 HB3 SER 50 12.194 2.140 12.958 365 HG SER 50 HG SER 50 13.382 3.726 13.821 366 H GLU 51 H GLU 51 12.130 0.118 13.813 367 HA GLU 51 HA GLU 51 12.522 -2.528 12.866 368 HB2 GLU 51 HB2 GLU 51 10.153 -2.860 13.723 369 HB3 GLU 51 HB3 GLU 51 11.338 -2.306 14.898 370 HG2 GLU 51 HG2 GLU 51 10.100 -0.542 15.368 371 HG3 GLU 51 HG3 GLU 51 10.124 -0.036 13.680 372 H SER 52 H SER 52 11.408 0.212 11.321 373 HA SER 52 HA SER 52 9.658 -1.275 9.498 374 HB2 SER 52 HB2 SER 52 8.770 0.834 10.405 375 HB3 SER 52 HB3 SER 52 10.142 1.706 9.723 376 HG SER 52 HG SER 52 7.874 0.736 8.494 377 H GLY 53 H GLY 53 12.838 -0.652 9.773 378 HA2 GLY 53 HA2 GLY 53 14.565 -0.911 8.267 379 HA3 GLY 53 HA3 GLY 53 13.364 -1.230 7.024 380 H GLU 54 H GLU 54 13.156 1.691 8.874 381 HA GLU 54 HA GLU 54 14.343 3.206 6.650 382 HB2 GLU 54 HB2 GLU 54 12.546 4.778 6.648 383 HB3 GLU 54 HB3 GLU 54 11.836 3.174 6.533 384 HG2 GLU 54 HG2 GLU 54 10.465 4.094 8.091 385 HG3 GLU 54 HG3 GLU 54 11.699 3.409 9.148 386 H LEU 55 H LEU 55 15.174 5.277 7.200 387 HA LEU 55 HA LEU 55 15.469 5.800 10.075 388 HB2 LEU 55 HB2 LEU 55 17.481 4.761 8.501 389 HB3 LEU 55 HB3 LEU 55 17.830 6.487 8.516 390 HG LEU 55 HG LEU 55 17.587 4.694 10.931 391 HD11 LEU 55 HD11 LEU 55 19.850 5.674 9.297 392 HD12 LEU 55 HD12 LEU 55 19.669 4.175 10.208 393 HD13 LEU 55 HD13 LEU 55 20.061 5.675 11.048 394 HD21 LEU 55 HD21 LEU 55 17.632 7.623 10.600 395 HD22 LEU 55 HD22 LEU 55 18.709 6.969 11.834 396 HD23 LEU 55 HD23 LEU 55 16.978 6.636 11.906 397 H HIS 56 H HIS 56 14.516 7.700 10.387 398 HA HIS 56 HA HIS 56 14.631 9.748 8.306 399 HB2 HIS 56 HB2 HIS 56 12.951 10.927 9.701 400 HB3 HIS 56 HB3 HIS 56 12.437 9.307 9.241 401 HD1 HIS 56 HD1 HIS 56 11.499 7.977 11.096 402 HD2 HIS 56 HD2 HIS 56 14.135 10.882 12.464 403 HE1 HIS 56 HE1 HIS 56 11.441 7.810 13.604 404 H GLY 57 H GLY 57 15.125 11.981 8.887 405 HA2 GLY 57 HA2 GLY 57 16.125 13.592 10.334 406 HA3 GLY 57 HA3 GLY 57 16.825 12.276 11.265 407 H LEU 58 H LEU 58 17.764 10.865 8.871 408 HA LEU 58 HA LEU 58 20.337 12.002 8.696 409 HB2 LEU 58 HB2 LEU 58 18.891 9.805 7.300 410 HB3 LEU 58 HB3 LEU 58 20.409 10.384 6.617 411 HG LEU 58 HG LEU 58 21.427 9.919 8.910 412 HD11 LEU 58 HD11 LEU 58 18.974 8.200 9.213 413 HD12 LEU 58 HD12 LEU 58 19.211 9.733 10.051 414 HD13 LEU 58 HD13 LEU 58 20.309 8.385 10.350 415 HD21 LEU 58 HD21 LEU 58 22.012 7.764 8.275 416 HD22 LEU 58 HD22 LEU 58 21.544 8.514 6.748 417 HD23 LEU 58 HD23 LEU 58 20.426 7.431 7.577 418 H THR 59 H THR 59 17.442 12.476 6.855 419 HA THR 59 HA THR 59 18.402 13.396 4.432 420 HB THR 59 HB THR 59 16.342 14.594 4.153 421 HG1 THR 59 HG1 THR 59 15.435 15.571 5.791 422 HG21 THR 59 HG21 THR 59 14.721 12.889 4.654 423 HG22 THR 59 HG22 THR 59 15.753 12.215 5.915 424 HG23 THR 59 HG23 THR 59 16.239 12.102 4.225 425 H THR 60 H THR 60 19.322 15.235 3.700 426 HA THR 60 HA THR 60 19.400 17.620 5.349 427 HB THR 60 HB THR 60 21.906 17.791 5.136 428 HG1 THR 60 HG1 THR 60 23.038 16.077 4.454 429 HG21 THR 60 HG21 THR 60 20.538 16.952 7.182 430 HG22 THR 60 HG22 THR 60 22.287 16.723 7.162 431 HG23 THR 60 HG23 THR 60 21.217 15.378 6.770 432 H GLU 61 H GLU 61 20.560 19.424 4.199 433 HA GLU 61 HA GLU 61 19.560 19.662 1.565 434 HB2 GLU 61 HB2 GLU 61 20.763 21.815 1.524 435 HB3 GLU 61 HB3 GLU 61 19.810 21.611 2.987 436 HG2 GLU 61 HG2 GLU 61 21.804 21.031 4.236 437 HG3 GLU 61 HG3 GLU 61 22.777 21.153 2.771 438 H GLU 62 H GLU 62 22.370 18.227 2.778 439 HA GLU 62 HA GLU 62 24.147 18.747 0.619 440 HB2 GLU 62 HB2 GLU 62 24.124 17.098 3.033 441 HB3 GLU 62 HB3 GLU 62 24.960 16.335 1.687 442 HG2 GLU 62 HG2 GLU 62 25.556 19.025 2.892 443 HG3 GLU 62 HG3 GLU 62 26.535 17.564 3.012 444 H GLU 63 H GLU 63 21.351 16.916 0.813 445 HA GLU 63 HA GLU 63 22.014 14.684 -0.790 446 HB2 GLU 63 HB2 GLU 63 19.681 14.283 -0.952 447 HB3 GLU 63 HB3 GLU 63 19.953 14.957 0.649 448 HG2 GLU 63 HG2 GLU 63 18.139 16.171 0.039 449 HG3 GLU 63 HG3 GLU 63 19.408 17.219 -0.593 450 H PHE 64 H PHE 64 21.469 17.992 -1.528 451 HA PHE 64 HA PHE 64 20.743 17.588 -4.281 452 HB2 PHE 64 HB2 PHE 64 20.118 19.603 -2.857 453 HB3 PHE 64 HB3 PHE 64 21.784 20.139 -3.051 454 HD1 PHE 64 HD2 PHE 64 19.268 18.669 -5.382 455 HD2 PHE 64 HD1 PHE 64 21.901 21.898 -4.512 456 HE1 PHE 64 HE2 PHE 64 18.672 19.727 -7.522 457 HE2 PHE 64 HE1 PHE 64 21.308 22.962 -6.650 458 HZ PHE 64 HZ PHE 64 19.691 21.876 -8.158 459 H VAL 65 H VAL 65 22.749 16.060 -4.344 460 HA VAL 65 HA VAL 65 24.925 17.604 -5.574 461 HB VAL 65 HB VAL 65 26.577 15.996 -4.632 462 HG11 VAL 65 HG11 VAL 65 26.713 17.033 -2.451 463 HG12 VAL 65 HG12 VAL 65 26.199 18.227 -3.645 464 HG13 VAL 65 HG13 VAL 65 25.019 17.515 -2.543 465 HG21 VAL 65 HG21 VAL 65 24.427 15.197 -2.689 466 HG22 VAL 65 HG22 VAL 65 24.789 14.254 -4.133 467 HG23 VAL 65 HG23 VAL 65 26.029 14.492 -2.903 468 H GLU 66 H GLU 66 26.531 15.755 -6.542 469 HA GLU 66 HA GLU 66 25.357 14.787 -8.816 470 HB2 GLU 66 HB2 GLU 66 27.675 13.501 -7.362 471 HB3 GLU 66 HB3 GLU 66 27.288 13.314 -9.066 472 HG2 GLU 66 HG2 GLU 66 27.506 15.931 -9.068 473 HG3 GLU 66 HG3 GLU 66 28.485 15.625 -7.634 474 H GLY 67 H GLY 67 25.806 13.059 -5.746 475 HA2 GLY 67 HA2 GLY 67 23.713 11.674 -5.250 476 HA3 GLY 67 HA3 GLY 67 24.083 10.904 -6.786 477 H ILE 68 H ILE 68 26.984 11.657 -5.461 478 HA ILE 68 HA ILE 68 27.599 8.949 -4.849 479 HB ILE 68 HB ILE 68 29.256 11.366 -4.133 480 HG12 ILE 68 HG12 ILE 68 29.293 9.789 -6.715 481 HG13 ILE 68 HG13 ILE 68 28.557 11.378 -6.530 482 HG21 ILE 68 HG21 ILE 68 29.870 8.450 -4.528 483 HG22 ILE 68 HG22 ILE 68 31.117 9.696 -4.533 484 HG23 ILE 68 HG23 ILE 68 30.133 9.439 -3.093 485 HD11 ILE 68 HD11 ILE 68 30.769 12.277 -5.901 486 HD12 ILE 68 HD12 ILE 68 31.469 10.692 -6.229 487 HD13 ILE 68 HD13 ILE 68 30.718 11.611 -7.533 488 H TYR 69 H TYR 69 26.788 7.993 -3.096 489 HA TYR 69 HA TYR 69 27.200 9.299 -0.502 490 HB2 TYR 69 HB2 TYR 69 24.661 7.809 -1.177 491 HB3 TYR 69 HB3 TYR 69 25.007 8.739 0.277 492 HD1 TYR 69 HD2 TYR 69 25.838 11.282 -0.422 493 HD2 TYR 69 HD1 TYR 69 23.137 8.801 -2.581 494 HE1 TYR 69 HE2 TYR 69 24.841 13.278 -1.457 495 HE2 TYR 69 HE1 TYR 69 22.135 10.790 -3.623 496 HH TYR 69 HH TYR 69 22.926 13.195 -4.140 497 H LYS 70 H LYS 70 28.260 8.019 0.848 498 HA LYS 70 HA LYS 70 28.191 5.111 0.373 499 HB2 LYS 70 HB2 LYS 70 30.429 5.309 1.766 500 HB3 LYS 70 HB3 LYS 70 30.409 5.587 0.029 501 HG2 LYS 70 HG2 LYS 70 29.978 7.906 1.836 502 HG3 LYS 70 HG3 LYS 70 31.609 7.248 1.674 503 HD2 LYS 70 HD2 LYS 70 30.942 7.369 -0.912 504 HD3 LYS 70 HD3 LYS 70 29.923 8.675 -0.303 505 HE2 LYS 70 HE2 LYS 70 32.914 8.412 -0.164 506 HE3 LYS 70 HE3 LYS 70 31.961 9.686 -0.923 507 HZ1 LYS 70 HZ1 LYS 70 32.492 10.738 0.990 508 HZ2 LYS 70 HZ2 LYS 70 32.662 9.311 1.881 509 HZ3 LYS 70 HZ3 LYS 70 31.120 9.929 1.563 510 H VAL 71 H VAL 71 26.753 4.297 1.778 511 HA VAL 71 HA VAL 71 26.662 5.322 4.515 512 HB VAL 71 HB VAL 71 24.860 3.350 3.102 513 HG11 VAL 71 HG11 VAL 71 23.375 3.782 5.106 514 HG12 VAL 71 HG12 VAL 71 24.806 2.790 5.398 515 HG13 VAL 71 HG13 VAL 71 24.791 4.485 5.887 516 HG21 VAL 71 HG21 VAL 71 23.393 5.577 3.831 517 HG22 VAL 71 HG22 VAL 71 24.919 6.249 3.258 518 HG23 VAL 71 HG23 VAL 71 23.972 5.192 2.209 519 H GLU 72 H GLU 72 27.200 4.143 6.293 520 HA GLU 72 HA GLU 72 28.255 1.431 5.831 521 HB2 GLU 72 HB2 GLU 72 30.248 2.415 6.284 522 HB3 GLU 72 HB3 GLU 72 29.506 3.782 7.103 523 HG2 GLU 72 HG2 GLU 72 29.392 2.664 9.137 524 HG3 GLU 72 HG3 GLU 72 29.578 1.081 8.385 525 H ILE 73 H ILE 73 27.764 -0.118 7.323 526 HA ILE 73 HA ILE 73 25.978 0.702 9.520 527 HB ILE 73 HB ILE 73 25.930 -1.886 7.963 528 HG12 ILE 73 HG12 ILE 73 23.450 -0.653 7.780 529 HG13 ILE 73 HG13 ILE 73 24.587 0.682 7.629 530 HG21 ILE 73 HG21 ILE 73 23.629 -1.861 9.365 531 HG22 ILE 73 HG22 ILE 73 25.104 -2.653 9.916 532 HG23 ILE 73 HG23 ILE 73 24.698 -1.041 10.502 533 HD11 ILE 73 HD11 ILE 73 23.997 -0.198 5.456 534 HD12 ILE 73 HD12 ILE 73 25.703 -0.494 5.797 535 HD13 ILE 73 HD13 ILE 73 24.534 -1.808 5.941 536 H ASP 74 H ASP 74 26.436 0.025 11.537 537 HA ASP 74 HA ASP 74 28.836 -1.636 11.875 538 HB2 ASP 74 HB2 ASP 74 27.948 0.780 13.115 539 HB3 ASP 74 HB3 ASP 74 28.030 -0.479 14.344 540 H THR 75 H THR 75 28.271 -3.713 12.073 541 HA THR 75 HA THR 75 25.849 -4.450 13.517 542 HB THR 75 HB THR 75 26.482 -6.792 12.816 543 HG1 THR 75 HG1 THR 75 28.303 -5.567 11.033 544 HG21 THR 75 HG21 THR 75 26.128 -6.228 10.295 545 HG22 THR 75 HG22 THR 75 25.927 -4.578 10.881 546 HG23 THR 75 HG23 THR 75 24.856 -5.855 11.457 547 H LYS 76 H LYS 76 28.462 -3.412 14.739 548 HA LYS 76 HA LYS 76 29.361 -5.643 16.343 549 HB2 LYS 76 HB2 LYS 76 30.929 -4.096 17.314 550 HB3 LYS 76 HB3 LYS 76 30.905 -3.846 15.573 551 HG2 LYS 76 HG2 LYS 76 30.839 -1.685 16.256 552 HG3 LYS 76 HG3 LYS 76 29.106 -2.019 16.226 553 HD2 LYS 76 HD2 LYS 76 29.153 -1.219 18.329 554 HD3 LYS 76 HD3 LYS 76 29.752 -2.830 18.735 555 HE2 LYS 76 HE2 LYS 76 31.819 -2.077 19.199 556 HE3 LYS 76 HE3 LYS 76 31.817 -0.947 17.846 557 HZ1 LYS 76 HZ1 LYS 76 30.273 -0.457 20.324 558 HZ2 LYS 76 HZ2 LYS 76 30.666 0.648 19.106 559 HZ3 LYS 76 HZ3 LYS 76 31.873 0.060 20.135 560 H SER 77 H SER 77 27.340 -2.790 16.725 561 HA SER 77 HA SER 77 26.918 -3.345 19.550 562 HB2 SER 77 HB2 SER 77 25.307 -1.317 19.252 563 HB3 SER 77 HB3 SER 77 27.048 -1.041 19.190 564 HG SER 77 HG SER 77 26.285 -0.026 17.424 565 H TYR 78 H TYR 78 25.574 -4.244 16.594 566 HA TYR 78 HA TYR 78 22.836 -4.454 17.396 567 HB2 TYR 78 HB2 TYR 78 23.462 -4.264 15.033 568 HB3 TYR 78 HB3 TYR 78 24.318 -5.799 15.126 569 HD1 TYR 78 HD1 TYR 78 20.914 -4.439 15.875 570 HD2 TYR 78 HD2 TYR 78 23.222 -7.652 14.309 571 HE1 TYR 78 HE1 TYR 78 18.844 -5.622 15.269 572 HE2 TYR 78 HE2 TYR 78 21.160 -8.843 13.698 573 HH TYR 78 HH TYR 78 18.199 -8.128 14.895 574 H TRP 79 H TRP 79 25.523 -6.755 17.095 575 HA TRP 79 HA TRP 79 24.021 -9.007 17.962 576 HB2 TRP 79 HB2 TRP 79 25.864 -10.141 17.375 577 HB3 TRP 79 HB3 TRP 79 26.536 -8.596 16.858 578 HD1 TRP 79 HD1 TRP 79 26.367 -10.665 20.147 579 HE1 TRP 79 HE1 TRP 79 28.603 -10.357 21.384 580 HE3 TRP 79 HE3 TRP 79 28.622 -7.384 16.940 581 HZ2 TRP 79 HZ2 TRP 79 31.005 -8.914 21.045 582 HZ3 TRP 79 HZ3 TRP 79 30.890 -6.589 17.469 583 HH2 TRP 79 HH2 TRP 79 32.054 -7.338 19.480 584 H LYS 80 H LYS 80 25.876 -6.538 19.592 585 HA LYS 80 HA LYS 80 25.886 -7.917 22.126 586 HB2 LYS 80 HB2 LYS 80 27.194 -6.181 22.920 587 HB3 LYS 80 HB3 LYS 80 27.596 -6.171 21.208 588 HG2 LYS 80 HG2 LYS 80 27.205 -3.971 21.398 589 HG3 LYS 80 HG3 LYS 80 25.517 -4.457 21.220 590 HD2 LYS 80 HD2 LYS 80 25.407 -3.132 23.100 591 HD3 LYS 80 HD3 LYS 80 25.630 -4.728 23.819 592 HE2 LYS 80 HE2 LYS 80 28.042 -4.292 23.993 593 HE3 LYS 80 HE3 LYS 80 27.792 -2.686 23.308 594 HZ1 LYS 80 HZ1 LYS 80 27.331 -1.932 25.321 595 HZ2 LYS 80 HZ2 LYS 80 27.598 -3.466 25.981 596 HZ3 LYS 80 HZ3 LYS 80 26.046 -3.021 25.476 597 H ALA 81 H ALA 81 23.707 -5.962 20.403 598 HA ALA 81 HA ALA 81 22.343 -4.943 22.756 599 HB1 ALA 81 HB1 ALA 81 22.238 -3.382 21.064 600 HB2 ALA 81 HB2 ALA 81 22.004 -4.600 19.809 601 HB3 ALA 81 HB3 ALA 81 20.678 -4.189 20.897 602 H LEU 82 H LEU 82 21.716 -7.258 20.139 603 HA LEU 82 HA LEU 82 19.384 -8.245 21.628 604 HB2 LEU 82 HB2 LEU 82 20.180 -8.845 18.785 605 HB3 LEU 82 HB3 LEU 82 18.664 -9.276 19.573 606 HG LEU 82 HG LEU 82 18.035 -7.479 18.282 607 HD11 LEU 82 HD11 LEU 82 18.937 -6.029 20.758 608 HD12 LEU 82 HD12 LEU 82 17.569 -7.142 20.736 609 HD13 LEU 82 HD13 LEU 82 17.536 -5.686 19.741 610 HD21 LEU 82 HD21 LEU 82 19.350 -5.665 17.648 611 HD22 LEU 82 HD22 LEU 82 20.494 -7.006 17.699 612 HD23 LEU 82 HD23 LEU 82 20.436 -5.845 19.026 613 H GLY 83 H GLY 83 22.492 -8.833 21.706 614 HA2 GLY 83 HA2 GLY 83 23.809 -10.640 22.222 615 HA3 GLY 83 HA3 GLY 83 22.327 -11.383 22.806 616 H ILE 84 H ILE 84 23.322 -10.453 19.524 617 HA ILE 84 HA ILE 84 22.532 -13.087 18.575 618 HB ILE 84 HB ILE 84 23.602 -10.827 16.896 619 HG12 ILE 84 HG12 ILE 84 21.721 -9.974 18.205 620 HG13 ILE 84 HG13 ILE 84 21.260 -10.161 16.517 621 HG21 ILE 84 HG21 ILE 84 23.522 -12.596 15.473 622 HG22 ILE 84 HG22 ILE 84 22.267 -13.422 16.393 623 HG23 ILE 84 HG23 ILE 84 21.843 -12.075 15.338 624 HD11 ILE 84 HD11 ILE 84 20.106 -12.231 17.049 625 HD12 ILE 84 HD12 ILE 84 20.595 -12.079 18.737 626 HD13 ILE 84 HD13 ILE 84 19.497 -10.895 18.027 627 H SER 85 H SER 85 23.917 -14.299 17.101 628 HA SER 85 HA SER 85 26.343 -15.012 18.146 629 HB2 SER 85 HB2 SER 85 25.908 -16.586 16.596 630 HB3 SER 85 HB3 SER 85 24.931 -15.477 15.635 631 HG SER 85 HG SER 85 26.644 -14.947 14.466 632 HA PRO 86 HA PRO 86 29.368 -12.020 17.079 633 HB2 PRO 86 HB2 PRO 86 31.518 -13.561 16.471 634 HB3 PRO 86 HB3 PRO 86 30.918 -13.359 18.121 635 HG2 PRO 86 HG2 PRO 86 30.459 -15.609 16.201 636 HG3 PRO 86 HG3 PRO 86 30.821 -15.675 17.936 637 HD2 PRO 86 HD2 PRO 86 28.314 -15.980 16.958 638 HD3 PRO 86 HD3 PRO 86 28.640 -15.233 18.535 639 H MET 87 H MET 87 30.369 -10.967 15.361 640 HA MET 87 HA MET 87 30.898 -12.066 12.841 641 HB2 MET 87 HB2 MET 87 29.041 -10.971 11.551 642 HB3 MET 87 HB3 MET 87 28.547 -12.348 12.527 643 HG2 MET 87 HG2 MET 87 27.751 -10.790 14.264 644 HG3 MET 87 HG3 MET 87 28.172 -9.442 13.209 645 HE1 MET 87 HE1 MET 87 26.504 -12.897 11.886 646 HE2 MET 87 HE2 MET 87 26.172 -12.669 13.602 647 HE3 MET 87 HE3 MET 87 24.863 -12.539 12.426 648 H HIS 88 H HIS 88 32.296 -10.738 11.878 649 HA HIS 88 HA HIS 88 33.189 -8.370 12.970 650 HB2 HIS 88 HB2 HIS 88 33.300 -9.072 10.031 651 HB3 HIS 88 HB3 HIS 88 34.390 -7.997 10.903 652 HD1 HIS 88 HD1 HIS 88 34.481 -11.164 9.496 653 HD2 HIS 88 HD2 HIS 88 35.534 -9.725 13.248 654 HE1 HIS 88 HE1 HIS 88 36.087 -12.854 10.437 655 H GLU 89 H GLU 89 33.162 -6.178 11.928 656 HA GLU 89 HA GLU 89 30.643 -5.063 11.980 657 HB2 GLU 89 HB2 GLU 89 31.706 -3.120 10.747 658 HB3 GLU 89 HB3 GLU 89 32.504 -3.620 12.231 659 HG2 GLU 89 HG2 GLU 89 34.328 -4.468 11.132 660 HG3 GLU 89 HG3 GLU 89 33.430 -4.759 9.643 661 H HIS 90 H HIS 90 29.446 -3.970 10.231 662 HA HIS 90 HA HIS 90 29.010 -5.801 8.043 663 HB2 HIS 90 HB2 HIS 90 27.306 -4.296 9.463 664 HB3 HIS 90 HB3 HIS 90 27.601 -3.185 8.130 665 HD1 HIS 90 HD1 HIS 90 27.265 -6.952 7.886 666 HD2 HIS 90 HD2 HIS 90 25.289 -3.490 6.715 667 HE1 HIS 90 HE1 HIS 90 25.404 -7.717 6.378 668 H ALA 91 H ALA 91 28.445 -4.593 5.850 669 HA ALA 91 HA ALA 91 30.925 -3.260 5.068 670 HB1 ALA 91 HB1 ALA 91 29.509 -5.266 3.882 671 HB2 ALA 91 HB2 ALA 91 28.985 -3.857 2.961 672 HB3 ALA 91 HB3 ALA 91 30.701 -4.250 3.071 673 H GLU 92 H GLU 92 30.172 -1.860 2.857 674 HA GLU 92 HA GLU 92 28.170 0.078 3.784 675 HB2 GLU 92 HB2 GLU 92 29.758 1.879 2.867 676 HB3 GLU 92 HB3 GLU 92 30.131 1.179 4.435 677 HG2 GLU 92 HG2 GLU 92 31.745 -0.331 3.339 678 HG3 GLU 92 HG3 GLU 92 31.418 0.479 1.808 679 H VAL 93 H VAL 93 27.139 1.270 2.146 680 HA VAL 93 HA VAL 93 27.359 0.041 -0.514 681 HB VAL 93 HB VAL 93 25.079 1.694 0.576 682 HG11 VAL 93 HG11 VAL 93 25.689 1.106 -2.025 683 HG12 VAL 93 HG12 VAL 93 24.584 -0.201 -1.595 684 HG13 VAL 93 HG13 VAL 93 24.077 1.479 -1.415 685 HG21 VAL 93 HG21 VAL 93 24.882 -0.159 1.900 686 HG22 VAL 93 HG22 VAL 93 24.005 -0.717 0.475 687 HG23 VAL 93 HG23 VAL 93 25.676 -1.216 0.733 688 H VAL 94 H VAL 94 28.629 1.177 -1.832 689 HA VAL 94 HA VAL 94 28.402 4.116 -1.803 690 HB VAL 94 HB VAL 94 30.771 2.528 -2.790 691 HG11 VAL 94 HG11 VAL 94 30.984 4.555 -3.824 692 HG12 VAL 94 HG12 VAL 94 30.113 5.419 -2.556 693 HG13 VAL 94 HG13 VAL 94 31.783 4.912 -2.294 694 HG21 VAL 94 HG21 VAL 94 30.013 3.385 -0.082 695 HG22 VAL 94 HG22 VAL 94 31.121 2.116 -0.604 696 HG23 VAL 94 HG23 VAL 94 31.658 3.795 -0.565 697 H PHE 95 H PHE 95 27.636 5.059 -3.576 698 HA PHE 95 HA PHE 95 27.889 3.702 -6.158 699 HB2 PHE 95 HB2 PHE 95 25.334 4.518 -4.817 700 HB3 PHE 95 HB3 PHE 95 25.446 4.533 -6.574 701 HD1 PHE 95 HD2 PHE 95 26.414 2.321 -7.626 702 HD2 PHE 95 HD1 PHE 95 24.616 2.602 -3.778 703 HE1 PHE 95 HE2 PHE 95 25.934 -0.092 -7.678 704 HE2 PHE 95 HE1 PHE 95 24.134 0.189 -3.824 705 HZ PHE 95 HZ PHE 95 24.793 -1.162 -5.775 706 H THR 96 H THR 96 28.779 5.060 -7.550 707 HA THR 96 HA THR 96 28.674 7.929 -7.044 708 HB THR 96 HB THR 96 30.866 7.052 -7.528 709 HG1 THR 96 HG1 THR 96 30.768 9.034 -8.411 710 HG21 THR 96 HG21 THR 96 31.027 6.289 -10.118 711 HG22 THR 96 HG22 THR 96 29.431 5.668 -9.701 712 HG23 THR 96 HG23 THR 96 30.844 5.165 -8.773 713 H ALA 97 H ALA 97 27.837 9.435 -8.455 714 HA ALA 97 HA ALA 97 25.750 8.493 -10.206 715 HB1 ALA 97 HB1 ALA 97 24.831 10.476 -9.802 716 HB2 ALA 97 HB2 ALA 97 26.176 10.797 -8.708 717 HB3 ALA 97 HB3 ALA 97 26.259 11.329 -10.387 718 H ASN 98 H ASN 98 25.527 9.138 -12.435 719 HA ASN 98 HA ASN 98 26.243 9.320 -14.586 720 HB2 ASN 98 HB2 ASN 98 28.758 10.650 -13.608 721 HB3 ASN 98 HB3 ASN 98 27.870 10.935 -15.103 722 HD21 ASN 98 HD21 ASN 98 28.743 12.802 -13.031 723 HD22 ASN 98 HD22 ASN 98 27.314 13.609 -12.490 724 H ASP 99 H ASP 99 26.927 6.994 -13.026 725 HA ASP 99 HA ASP 99 29.398 6.168 -14.406 726 HB2 ASP 99 HB2 ASP 99 29.403 6.280 -11.830 727 HB3 ASP 99 HB3 ASP 99 28.367 4.859 -11.901 728 H SER 100 H SER 100 29.494 3.932 -15.084 729 HA SER 100 HA SER 100 27.223 3.112 -16.500 730 HB2 SER 100 HB2 SER 100 29.584 1.398 -15.693 731 HB3 SER 100 HB3 SER 100 28.472 1.092 -17.026 732 HG SER 100 HG SER 100 30.644 2.254 -17.355 733 H GLY 101 H GLY 101 25.408 2.216 -15.794 734 HA2 GLY 101 HA2 GLY 101 24.611 0.091 -14.682 735 HA3 GLY 101 HA3 GLY 101 25.502 0.668 -13.281 736 HA PRO 102 HA PRO 102 21.015 2.154 -13.265 737 HB2 PRO 102 HB2 PRO 102 20.202 0.738 -11.096 738 HB3 PRO 102 HB3 PRO 102 20.089 0.116 -12.746 739 HG2 PRO 102 HG2 PRO 102 22.154 -0.437 -10.652 740 HG3 PRO 102 HG3 PRO 102 21.362 -1.565 -11.767 741 HD2 PRO 102 HD2 PRO 102 23.854 -0.602 -12.197 742 HD3 PRO 102 HD3 PRO 102 22.741 -0.997 -13.523 743 H ARG 103 H ARG 103 19.877 3.037 -11.194 744 HA ARG 103 HA ARG 103 21.868 4.100 -9.313 745 HB2 ARG 103 HB2 ARG 103 20.866 6.321 -9.454 746 HB3 ARG 103 HB3 ARG 103 21.459 5.807 -11.029 747 HG2 ARG 103 HG2 ARG 103 19.155 5.170 -11.648 748 HG3 ARG 103 HG3 ARG 103 18.597 5.804 -10.098 749 HD2 ARG 103 HD2 ARG 103 18.248 7.477 -11.784 750 HD3 ARG 103 HD3 ARG 103 19.549 8.010 -10.720 751 HE ARG 103 HE ARG 103 20.979 7.941 -12.503 752 HH11 ARG 103 HH11 ARG 103 18.118 6.114 -13.275 753 HH12 ARG 103 HH12 ARG 103 18.563 5.870 -14.931 754 HH21 ARG 103 HH21 ARG 103 21.576 7.626 -14.681 755 HH22 ARG 103 HH22 ARG 103 20.530 6.729 -15.730 756 H ARG 104 H ARG 104 21.263 3.953 -7.249 757 HA ARG 104 HA ARG 104 18.400 3.624 -6.646 758 HB2 ARG 104 HB2 ARG 104 20.742 2.001 -5.702 759 HB3 ARG 104 HB3 ARG 104 19.294 2.132 -4.713 760 HG2 ARG 104 HG2 ARG 104 19.267 1.199 -7.570 761 HG3 ARG 104 HG3 ARG 104 19.411 0.113 -6.187 762 HD2 ARG 104 HD2 ARG 104 17.253 0.458 -5.515 763 HD3 ARG 104 HD3 ARG 104 17.189 2.085 -6.192 764 HE ARG 104 HE ARG 104 17.348 0.503 -8.383 765 HH11 ARG 104 HH11 ARG 104 15.261 0.542 -5.597 766 HH12 ARG 104 HH12 ARG 104 13.900 -0.112 -6.446 767 HH21 ARG 104 HH21 ARG 104 15.563 -0.358 -9.511 768 HH22 ARG 104 HH22 ARG 104 14.073 -0.624 -8.672 769 H TYR 105 H TYR 105 17.771 4.246 -4.482 770 HA TYR 105 HA TYR 105 19.567 6.288 -3.344 771 HB2 TYR 105 HB2 TYR 105 17.394 7.319 -2.484 772 HB3 TYR 105 HB3 TYR 105 17.695 7.439 -4.214 773 HD1 TYR 105 HD2 TYR 105 16.354 6.175 -5.803 774 HD2 TYR 105 HD1 TYR 105 15.622 5.900 -1.620 775 HE1 TYR 105 HE2 TYR 105 14.177 5.126 -6.258 776 HE2 TYR 105 HE1 TYR 105 13.444 4.849 -2.065 777 HH TYR 105 HH TYR 105 11.943 4.905 -5.014 778 H THR 106 H THR 106 17.473 3.578 -2.705 779 HA THR 106 HA THR 106 17.722 3.847 0.175 780 HB THR 106 HB THR 106 16.454 1.631 -1.447 781 HG1 THR 106 HG1 THR 106 14.518 2.706 -0.964 782 HG21 THR 106 HG21 THR 106 16.642 2.194 1.486 783 HG22 THR 106 HG22 THR 106 16.832 0.667 0.626 784 HG23 THR 106 HG23 THR 106 15.228 1.367 0.837 785 H ILE 107 H ILE 107 19.166 2.825 1.419 786 HA ILE 107 HA ILE 107 21.199 1.201 0.135 787 HB ILE 107 HB ILE 107 20.958 2.211 2.970 788 HG12 ILE 107 HG12 ILE 107 23.195 3.336 1.908 789 HG13 ILE 107 HG13 ILE 107 22.173 3.230 0.479 790 HG21 ILE 107 HG21 ILE 107 22.440 0.648 3.523 791 HG22 ILE 107 HG22 ILE 107 22.629 0.147 1.844 792 HG23 ILE 107 HG23 ILE 107 23.597 1.476 2.482 793 HD11 ILE 107 HD11 ILE 107 20.497 4.573 1.482 794 HD12 ILE 107 HD12 ILE 107 21.287 4.492 3.057 795 HD13 ILE 107 HD13 ILE 107 22.042 5.383 1.736 796 H ALA 108 H ALA 108 20.837 -0.900 -0.114 797 HA ALA 108 HA ALA 108 19.138 -2.333 1.773 798 HB1 ALA 108 HB1 ALA 108 19.999 -4.162 -0.110 799 HB2 ALA 108 HB2 ALA 108 18.478 -3.269 -0.137 800 HB3 ALA 108 HB3 ALA 108 19.878 -2.652 -1.014 801 H ALA 109 H ALA 109 20.085 -3.116 3.536 802 HA ALA 109 HA ALA 109 22.703 -4.436 3.243 803 HB1 ALA 109 HB1 ALA 109 23.168 -3.699 5.606 804 HB2 ALA 109 HB2 ALA 109 23.162 -2.415 4.396 805 HB3 ALA 109 HB3 ALA 109 21.774 -2.627 5.462 806 H MET 110 H MET 110 22.531 -6.537 3.630 807 HA MET 110 HA MET 110 20.447 -7.466 5.489 808 HB2 MET 110 HB2 MET 110 21.701 -8.729 3.067 809 HB3 MET 110 HB3 MET 110 20.883 -9.707 4.279 810 HG2 MET 110 HG2 MET 110 18.878 -8.197 3.936 811 HG3 MET 110 HG3 MET 110 19.721 -7.577 2.518 812 HE1 MET 110 HE1 MET 110 18.425 -11.812 3.371 813 HE2 MET 110 HE2 MET 110 18.436 -10.407 4.437 814 HE3 MET 110 HE3 MET 110 17.080 -10.670 3.339 815 H LEU 111 H LEU 111 21.082 -8.291 7.365 816 HA LEU 111 HA LEU 111 23.892 -8.713 7.884 817 HB2 LEU 111 HB2 LEU 111 21.504 -9.101 9.682 818 HB3 LEU 111 HB3 LEU 111 23.191 -9.106 10.188 819 HG LEU 111 HG LEU 111 22.470 -7.002 10.821 820 HD11 LEU 111 HD11 LEU 111 24.491 -6.948 9.355 821 HD12 LEU 111 HD12 LEU 111 23.593 -5.433 9.420 822 HD13 LEU 111 HD13 LEU 111 23.438 -6.489 8.016 823 HD21 LEU 111 HD21 LEU 111 20.798 -5.769 9.874 824 HD22 LEU 111 HD22 LEU 111 20.314 -7.380 9.343 825 HD23 LEU 111 HD23 LEU 111 21.175 -6.308 8.237 826 H SER 112 H SER 112 24.622 -10.535 6.903 827 HA SER 112 HA SER 112 23.116 -12.998 6.992 828 HB2 SER 112 HB2 SER 112 25.440 -13.823 5.998 829 HB3 SER 112 HB3 SER 112 24.288 -12.923 5.011 830 HG SER 112 HG SER 112 26.721 -12.102 6.117 831 HA PRO 113 HA PRO 113 24.859 -14.852 10.564 832 HB2 PRO 113 HB2 PRO 113 25.195 -17.430 9.780 833 HB3 PRO 113 HB3 PRO 113 23.606 -16.719 10.089 834 HG2 PRO 113 HG2 PRO 113 25.011 -17.158 7.482 835 HG3 PRO 113 HG3 PRO 113 23.309 -17.439 7.897 836 HD2 PRO 113 HD2 PRO 113 24.137 -15.241 6.548 837 HD3 PRO 113 HD3 PRO 113 22.755 -15.214 7.663 838 H TYR 114 H TYR 114 26.741 -16.005 11.441 839 HA TYR 114 HA TYR 114 29.085 -16.058 9.688 840 HB2 TYR 114 HB2 TYR 114 28.696 -14.310 12.077 841 HB3 TYR 114 HB3 TYR 114 30.297 -14.978 11.780 842 HD1 TYR 114 HD1 TYR 114 27.572 -13.108 10.042 843 HD2 TYR 114 HD2 TYR 114 31.751 -13.840 10.375 844 HE1 TYR 114 HE1 TYR 114 28.011 -11.312 8.419 845 HE2 TYR 114 HE2 TYR 114 32.200 -12.046 8.754 846 HH TYR 114 HH TYR 114 30.994 -10.885 6.913 847 H SER 115 H SER 115 27.354 -18.041 11.092 848 HA SER 115 HA SER 115 28.907 -19.132 13.235 849 HB2 SER 115 HB2 SER 115 26.829 -20.634 11.649 850 HB3 SER 115 HB3 SER 115 27.289 -20.856 13.336 851 HG SER 115 HG SER 115 25.315 -19.426 12.467 852 H TYR 116 H TYR 116 29.241 -21.717 12.921 853 HA TYR 116 HA TYR 116 30.774 -22.093 10.438 854 HB2 TYR 116 HB2 TYR 116 32.471 -23.343 11.834 855 HB3 TYR 116 HB3 TYR 116 32.435 -21.600 12.076 856 HD1 TYR 116 HD2 TYR 116 31.509 -24.852 13.553 857 HD2 TYR 116 HD1 TYR 116 31.852 -20.660 14.192 858 HE1 TYR 116 HE2 TYR 116 31.208 -25.202 15.969 859 HE2 TYR 116 HE1 TYR 116 31.553 -20.997 16.609 860 HH TYR 116 HH TYR 116 32.036 -23.553 18.183 861 H SER 117 H SER 117 28.105 -23.000 11.301 862 HA SER 117 HA SER 117 28.329 -25.802 11.898 863 HB2 SER 117 HB2 SER 117 26.367 -24.134 12.415 864 HB3 SER 117 HB3 SER 117 25.829 -24.568 10.792 865 HG SER 117 HG SER 117 24.896 -25.980 12.249 866 H THR 118 H THR 118 27.140 -27.404 10.455 867 HA THR 118 HA THR 118 28.257 -27.164 7.773 868 HB THR 118 HB THR 118 28.622 -29.240 9.111 869 HG1 THR 118 HG1 THR 118 28.152 -30.619 7.330 870 HG21 THR 118 HG21 THR 118 26.814 -30.827 9.388 871 HG22 THR 118 HG22 THR 118 25.686 -29.727 8.598 872 HG23 THR 118 HG23 THR 118 26.380 -29.304 10.163 873 H THR 119 H THR 119 27.073 -27.262 5.892 874 HA THR 119 HA THR 119 24.218 -27.660 5.933 875 HB THR 119 HB THR 119 24.216 -25.347 6.602 876 HG1 THR 119 HG1 THR 119 22.980 -24.546 4.915 877 HG21 THR 119 HG21 THR 119 26.008 -24.111 6.089 878 HG22 THR 119 HG22 THR 119 25.281 -23.893 4.497 879 HG23 THR 119 HG23 THR 119 26.458 -25.180 4.760 880 H ALA 120 H ALA 120 23.285 -27.714 3.796 881 HA ALA 120 HA ALA 120 25.211 -28.616 1.816 882 HB1 ALA 120 HB1 ALA 120 23.484 -29.734 0.793 883 HB2 ALA 120 HB2 ALA 120 22.929 -29.715 2.467 884 HB3 ALA 120 HB3 ALA 120 22.273 -28.559 1.308 885 H VAL 121 H VAL 121 26.074 -26.405 1.532 886 HA VAL 121 HA VAL 121 24.435 -24.406 0.292 887 HB VAL 121 HB VAL 121 26.439 -23.854 1.659 888 HG11 VAL 121 HG11 VAL 121 27.697 -25.753 0.100 889 HG12 VAL 121 HG12 VAL 121 28.348 -24.227 -0.501 890 HG13 VAL 121 HG13 VAL 121 28.482 -24.631 1.211 891 HG21 VAL 121 HG21 VAL 121 26.843 -22.800 -1.119 892 HG22 VAL 121 HG22 VAL 121 25.406 -22.386 -0.185 893 HG23 VAL 121 HG23 VAL 121 27.005 -21.959 0.422 894 H VAL 122 H VAL 122 24.526 -23.673 -1.851 895 HA VAL 122 HA VAL 122 24.491 -25.570 -3.854 896 HB VAL 122 HB VAL 122 25.120 -22.632 -4.173 897 HG11 VAL 122 HG11 VAL 122 23.805 -23.298 -6.414 898 HG12 VAL 122 HG12 VAL 122 25.565 -23.338 -6.277 899 HG13 VAL 122 HG13 VAL 122 24.630 -24.823 -6.092 900 HG21 VAL 122 HG21 VAL 122 23.044 -22.322 -3.426 901 HG22 VAL 122 HG22 VAL 122 22.487 -23.101 -4.906 902 HG23 VAL 122 HG23 VAL 122 22.705 -24.053 -3.438 903 H THR 123 H THR 123 26.024 -26.736 -4.787 904 HA THR 123 HA THR 123 28.816 -25.888 -4.542 905 HB THR 123 HB THR 123 27.755 -28.559 -5.481 906 HG1 THR 123 HG1 THR 123 28.331 -29.215 -3.317 907 HG21 THR 123 HG21 THR 123 30.487 -27.527 -4.765 908 HG22 THR 123 HG22 THR 123 29.971 -28.346 -6.240 909 HG23 THR 123 HG23 THR 123 30.103 -29.249 -4.731 910 H ASN 124 H ASN 124 28.489 -24.232 -6.211 911 HA ASN 124 HA ASN 124 28.413 -25.346 -8.933 912 HB2 ASN 124 HB2 ASN 124 27.252 -22.977 -7.733 913 HB3 ASN 124 HB3 ASN 124 28.255 -22.558 -9.118 914 HD21 ASN 124 HD21 ASN 124 26.257 -25.408 -8.487 915 HD22 ASN 124 HD22 ASN 124 25.240 -25.216 -9.870 916 HA PRO 125 HA PRO 125 32.585 -24.252 -9.732 917 HB2 PRO 125 HB2 PRO 125 32.471 -23.316 -12.278 918 HB3 PRO 125 HB3 PRO 125 32.281 -25.025 -11.874 919 HG2 PRO 125 HG2 PRO 125 30.182 -22.972 -12.458 920 HG3 PRO 125 HG3 PRO 125 30.287 -24.653 -13.012 921 HD2 PRO 125 HD2 PRO 125 28.691 -23.893 -10.961 922 HD3 PRO 125 HD3 PRO 125 29.462 -25.490 -11.030 923 H LYS 126 H LYS 126 34.001 -22.425 -10.629 924 HA LYS 126 HA LYS 126 33.687 -20.132 -9.129 925 HB2 LYS 126 HB2 LYS 126 35.498 -19.205 -10.344 926 HB3 LYS 126 HB3 LYS 126 35.773 -20.943 -10.322 927 HG2 LYS 126 HG2 LYS 126 34.470 -19.511 -12.622 928 HG3 LYS 126 HG3 LYS 126 36.208 -19.798 -12.511 929 HD2 LYS 126 HD2 LYS 126 35.354 -22.284 -12.054 930 HD3 LYS 126 HD3 LYS 126 33.989 -21.703 -13.009 931 HE2 LYS 126 HE2 LYS 126 35.472 -22.634 -14.572 932 HE3 LYS 126 HE3 LYS 126 35.721 -20.894 -14.691 933 HZ1 LYS 126 HZ1 LYS 126 37.839 -21.924 -14.658 934 HZ2 LYS 126 HZ2 LYS 126 37.450 -22.866 -13.309 935 HZ3 LYS 126 HZ3 LYS 126 37.635 -21.192 -13.146 936 H GLU 127 H GLU 127 32.368 -20.902 -12.261 937 HA GLU 127 HA GLU 127 31.157 -18.218 -12.379 938 HB2 GLU 127 HB2 GLU 127 30.891 -18.685 -14.841 939 HB3 GLU 127 HB3 GLU 127 32.549 -18.489 -14.290 940 HG2 GLU 127 HG2 GLU 127 33.056 -20.714 -14.577 941 HG3 GLU 127 HG3 GLU 127 31.372 -21.222 -14.454 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -4.656 -4.065 6.108 2 HA2 GLY 1 HA2 GLY 1 -2.480 -3.947 7.569 3 HA3 GLY 1 HA3 GLY 1 -2.358 -4.535 5.918 4 HA PRO 2 HA PRO 2 0.481 -0.866 6.555 5 HB2 PRO 2 HB2 PRO 2 2.757 -2.142 5.804 6 HB3 PRO 2 HB3 PRO 2 2.167 -2.130 7.471 7 HG2 PRO 2 HG2 PRO 2 1.888 -4.253 5.379 8 HG3 PRO 2 HG3 PRO 2 2.284 -4.423 7.098 9 HD2 PRO 2 HD2 PRO 2 -0.199 -4.884 6.123 10 HD3 PRO 2 HD3 PRO 2 0.082 -4.239 7.753 11 H THR 3 H THR 3 2.378 -0.361 4.798 12 HA THR 3 HA THR 3 1.111 0.379 2.463 13 HB THR 3 HB THR 3 3.272 0.866 1.526 14 HG1 THR 3 HG1 THR 3 4.646 -0.743 1.845 15 HG21 THR 3 HG21 THR 3 2.412 2.108 3.622 16 HG22 THR 3 HG22 THR 3 4.093 2.338 3.142 17 HG23 THR 3 HG23 THR 3 3.696 1.249 4.471 18 H GLY 4 H GLY 4 0.816 -0.493 0.460 19 HA2 GLY 4 HA2 GLY 4 1.458 -3.358 0.205 20 HA3 GLY 4 HA3 GLY 4 0.127 -2.547 -0.607 21 H THR 5 H THR 5 3.198 -0.968 -0.481 22 HA THR 5 HA THR 5 3.765 -1.798 -3.248 23 HB THR 5 HB THR 5 4.381 0.465 -3.859 24 HG1 THR 5 HG1 THR 5 4.025 2.174 -2.348 25 HG21 THR 5 HG21 THR 5 2.134 1.595 -3.573 26 HG22 THR 5 HG22 THR 5 1.655 0.203 -2.601 27 HG23 THR 5 HG23 THR 5 2.097 -0.013 -4.294 28 H GLY 6 H GLY 6 5.957 -1.777 -3.869 29 HA2 GLY 6 HA2 GLY 6 7.788 -2.040 -1.601 30 HA3 GLY 6 HA3 GLY 6 8.071 -2.623 -3.235 31 H GLU 7 H GLU 7 6.897 0.603 -2.725 32 HA GLU 7 HA GLU 7 9.482 1.631 -3.664 33 HB2 GLU 7 HB2 GLU 7 8.320 3.511 -4.547 34 HB3 GLU 7 HB3 GLU 7 7.397 2.086 -5.004 35 HG2 GLU 7 HG2 GLU 7 6.009 2.574 -2.893 36 HG3 GLU 7 HG3 GLU 7 6.747 4.173 -2.964 37 H SER 8 H SER 8 9.962 3.923 -2.889 38 HA SER 8 HA SER 8 9.506 4.028 0.020 39 HB2 SER 8 HB2 SER 8 11.803 5.245 -1.530 40 HB3 SER 8 HB3 SER 8 11.641 5.156 0.223 41 HG SER 8 HG SER 8 11.622 2.824 -1.362 42 H LYS 9 H LYS 9 10.316 6.556 0.586 43 HA LYS 9 HA LYS 9 8.493 8.271 -0.969 44 HB2 LYS 9 HB2 LYS 9 8.389 9.435 1.460 45 HB3 LYS 9 HB3 LYS 9 7.235 8.226 0.915 46 HG2 LYS 9 HG2 LYS 9 9.707 7.299 2.278 47 HG3 LYS 9 HG3 LYS 9 8.431 8.037 3.249 48 HD2 LYS 9 HD2 LYS 9 7.120 6.233 3.073 49 HD3 LYS 9 HD3 LYS 9 7.411 6.092 1.338 50 HE2 LYS 9 HE2 LYS 9 8.291 4.119 2.230 51 HE3 LYS 9 HE3 LYS 9 9.700 5.151 1.990 52 HZ1 LYS 9 HZ1 LYS 9 8.859 5.739 4.517 53 HZ2 LYS 9 HZ2 LYS 9 10.161 4.740 4.110 54 HZ3 LYS 9 HZ3 LYS 9 8.640 4.065 4.411 55 H CYS 10 H CYS 10 10.720 8.848 1.744 56 HA CYS 10 HA CYS 10 11.643 11.310 0.876 57 HB2 CYS 10 HB2 CYS 10 12.694 9.227 2.733 58 HB3 CYS 10 HB3 CYS 10 13.779 10.526 2.256 59 HG CYS 10 HG CYS 10 12.299 12.568 3.317 60 HA PRO 11 HA PRO 11 14.484 10.647 -2.397 61 HB2 PRO 11 HB2 PRO 11 16.474 12.398 -1.813 62 HB3 PRO 11 HB3 PRO 11 14.882 12.909 -2.385 63 HG2 PRO 11 HG2 PRO 11 15.959 12.838 0.407 64 HG3 PRO 11 HG3 PRO 11 14.997 14.096 -0.388 65 HD2 PRO 11 HD2 PRO 11 13.911 12.292 1.313 66 HD3 PRO 11 HD3 PRO 11 13.015 12.964 -0.064 67 H LEU 12 H LEU 12 15.680 10.347 0.873 68 HA LEU 12 HA LEU 12 17.505 8.250 -0.006 69 HB2 LEU 12 HB2 LEU 12 18.747 10.441 0.116 70 HB3 LEU 12 HB3 LEU 12 18.431 10.431 1.850 71 HG LEU 12 HG LEU 12 20.720 9.655 1.133 72 HD11 LEU 12 HD11 LEU 12 19.054 8.795 3.172 73 HD12 LEU 12 HD12 LEU 12 20.801 8.586 3.080 74 HD13 LEU 12 HD13 LEU 12 19.731 7.308 2.507 75 HD21 LEU 12 HD21 LEU 12 19.687 6.973 0.539 76 HD22 LEU 12 HD22 LEU 12 21.040 7.855 -0.171 77 HD23 LEU 12 HD23 LEU 12 19.393 8.178 -0.715 78 H MET 13 H MET 13 16.955 6.529 1.144 79 HA MET 13 HA MET 13 16.460 6.857 4.021 80 HB2 MET 13 HB2 MET 13 14.621 5.255 3.924 81 HB3 MET 13 HB3 MET 13 14.286 6.644 2.899 82 HG2 MET 13 HG2 MET 13 14.355 5.434 0.994 83 HG3 MET 13 HG3 MET 13 15.589 4.335 1.606 84 HE1 MET 13 HE1 MET 13 15.303 2.575 3.160 85 HE2 MET 13 HE2 MET 13 14.069 2.944 4.366 86 HE3 MET 13 HE3 MET 13 13.869 1.559 3.293 87 H VAL 14 H VAL 14 17.035 5.087 5.319 88 HA VAL 14 HA VAL 14 18.938 3.259 4.038 89 HB VAL 14 HB VAL 14 18.594 3.985 6.950 90 HG11 VAL 14 HG11 VAL 14 20.603 2.178 5.610 91 HG12 VAL 14 HG12 VAL 14 20.691 2.723 7.285 92 HG13 VAL 14 HG13 VAL 14 19.354 1.700 6.759 93 HG21 VAL 14 HG21 VAL 14 20.732 4.702 4.946 94 HG22 VAL 14 HG22 VAL 14 19.543 5.797 5.649 95 HG23 VAL 14 HG23 VAL 14 20.787 5.075 6.668 96 H LYS 15 H LYS 15 18.634 1.111 3.990 97 HA LYS 15 HA LYS 15 16.349 0.012 5.490 98 HB2 LYS 15 HB2 LYS 15 15.720 0.080 3.179 99 HB3 LYS 15 HB3 LYS 15 17.260 -0.609 2.680 100 HG2 LYS 15 HG2 LYS 15 15.564 -2.292 2.525 101 HG3 LYS 15 HG3 LYS 15 16.654 -2.703 3.852 102 HD2 LYS 15 HD2 LYS 15 14.345 -1.060 4.623 103 HD3 LYS 15 HD3 LYS 15 13.937 -2.671 4.026 104 HE2 LYS 15 HE2 LYS 15 15.990 -3.265 5.674 105 HE3 LYS 15 HE3 LYS 15 15.329 -1.851 6.493 106 HZ1 LYS 15 HZ1 LYS 15 14.029 -3.431 7.421 107 HZ2 LYS 15 HZ2 LYS 15 14.157 -4.491 6.110 108 HZ3 LYS 15 HZ3 LYS 15 13.097 -3.175 6.032 109 H VAL 16 H VAL 16 17.159 -1.191 7.082 110 HA VAL 16 HA VAL 16 19.380 -3.023 6.445 111 HB VAL 16 HB VAL 16 18.822 -1.723 9.115 112 HG11 VAL 16 HG11 VAL 16 21.172 -2.694 9.555 113 HG12 VAL 16 HG12 VAL 16 19.782 -3.779 9.624 114 HG13 VAL 16 HG13 VAL 16 20.817 -3.760 8.196 115 HG21 VAL 16 HG21 VAL 16 21.029 -1.223 7.119 116 HG22 VAL 16 HG22 VAL 16 19.707 -0.121 7.509 117 HG23 VAL 16 HG23 VAL 16 20.921 -0.510 8.729 118 H LEU 17 H LEU 17 18.787 -5.079 6.491 119 HA LEU 17 HA LEU 17 16.875 -5.974 8.522 120 HB2 LEU 17 HB2 LEU 17 15.443 -7.003 7.055 121 HB3 LEU 17 HB3 LEU 17 15.868 -5.542 6.166 122 HG LEU 17 HG LEU 17 17.733 -7.285 5.232 123 HD11 LEU 17 HD11 LEU 17 16.182 -8.981 6.627 124 HD12 LEU 17 HD12 LEU 17 17.053 -9.432 5.162 125 HD13 LEU 17 HD13 LEU 17 15.344 -9.003 5.076 126 HD21 LEU 17 HD21 LEU 17 15.081 -7.312 3.901 127 HD22 LEU 17 HD22 LEU 17 16.684 -6.999 3.233 128 HD23 LEU 17 HD23 LEU 17 15.855 -5.748 4.160 129 H ASP 18 H ASP 18 17.021 -8.207 9.050 130 HA ASP 18 HA ASP 18 19.699 -9.244 8.795 131 HB2 ASP 18 HB2 ASP 18 18.724 -11.139 10.203 132 HB3 ASP 18 HB3 ASP 18 18.735 -9.536 10.934 133 H ALA 19 H ALA 19 20.400 -10.782 7.450 134 HA ALA 19 HA ALA 19 18.598 -11.795 5.430 135 HB1 ALA 19 HB1 ALA 19 21.432 -12.690 5.623 136 HB2 ALA 19 HB2 ALA 19 20.460 -12.317 4.199 137 HB3 ALA 19 HB3 ALA 19 21.094 -11.012 5.200 138 H VAL 20 H VAL 20 19.467 -12.782 8.486 139 HA VAL 20 HA VAL 20 19.561 -15.623 7.995 140 HB VAL 20 HB VAL 20 19.259 -14.156 10.618 141 HG11 VAL 20 HG11 VAL 20 20.438 -16.433 11.299 142 HG12 VAL 20 HG12 VAL 20 18.683 -16.281 11.205 143 HG13 VAL 20 HG13 VAL 20 19.579 -17.010 9.871 144 HG21 VAL 20 HG21 VAL 20 21.309 -13.532 9.410 145 HG22 VAL 20 HG22 VAL 20 21.654 -14.442 10.880 146 HG23 VAL 20 HG23 VAL 20 21.752 -15.236 9.308 147 H ARG 21 H ARG 21 17.219 -13.297 9.272 148 HA ARG 21 HA ARG 21 15.177 -15.417 9.238 149 HB2 ARG 21 HB2 ARG 21 14.868 -12.768 10.628 150 HB3 ARG 21 HB3 ARG 21 13.995 -14.268 10.916 151 HG2 ARG 21 HG2 ARG 21 15.369 -14.549 12.641 152 HG3 ARG 21 HG3 ARG 21 16.593 -14.972 11.443 153 HD2 ARG 21 HD2 ARG 21 17.696 -13.012 11.682 154 HD3 ARG 21 HD3 ARG 21 16.216 -12.091 11.941 155 HE ARG 21 HE ARG 21 16.867 -13.809 14.140 156 HH11 ARG 21 HH11 ARG 21 17.482 -10.709 12.678 157 HH12 ARG 21 HH12 ARG 21 17.960 -9.957 14.164 158 HH21 ARG 21 HH21 ARG 21 17.494 -12.831 16.102 159 HH22 ARG 21 HH22 ARG 21 17.968 -11.165 16.111 160 H GLY 22 H GLY 22 16.033 -12.235 8.072 161 HA2 GLY 22 HA2 GLY 22 15.264 -11.359 6.015 162 HA3 GLY 22 HA3 GLY 22 13.872 -12.428 6.108 163 H SER 23 H SER 23 14.600 -10.764 8.995 164 HA SER 23 HA SER 23 12.337 -8.950 8.500 165 HB2 SER 23 HB2 SER 23 12.875 -8.948 11.246 166 HB3 SER 23 HB3 SER 23 11.557 -9.787 10.429 167 HG SER 23 HG SER 23 12.588 -11.392 11.440 168 HA PRO 24 HA PRO 24 14.785 -5.341 8.966 169 HB2 PRO 24 HB2 PRO 24 13.221 -3.735 10.496 170 HB3 PRO 24 HB3 PRO 24 12.853 -4.110 8.808 171 HG2 PRO 24 HG2 PRO 24 11.725 -5.316 11.305 172 HG3 PRO 24 HG3 PRO 24 10.886 -4.828 9.821 173 HD2 PRO 24 HD2 PRO 24 11.527 -7.405 10.352 174 HD3 PRO 24 HD3 PRO 24 11.483 -6.753 8.702 175 H ALA 25 H ALA 25 16.293 -4.374 10.281 176 HA ALA 25 HA ALA 25 16.641 -5.581 12.918 177 HB1 ALA 25 HB1 ALA 25 18.499 -5.532 11.229 178 HB2 ALA 25 HB2 ALA 25 18.569 -3.784 11.463 179 HB3 ALA 25 HB3 ALA 25 18.905 -4.869 12.813 180 H ILE 26 H ILE 26 16.533 -4.483 14.802 181 HA ILE 26 HA ILE 26 15.714 -1.663 14.646 182 HB ILE 26 HB ILE 26 15.020 -3.889 16.480 183 HG12 ILE 26 HG12 ILE 26 13.606 -2.689 14.621 184 HG13 ILE 26 HG13 ILE 26 12.848 -3.162 16.138 185 HG21 ILE 26 HG21 ILE 26 14.279 -2.170 18.192 186 HG22 ILE 26 HG22 ILE 26 16.008 -2.506 18.110 187 HG23 ILE 26 HG23 ILE 26 15.361 -1.041 17.375 188 HD11 ILE 26 HD11 ILE 26 13.053 -0.899 16.971 189 HD12 ILE 26 HD12 ILE 26 13.877 -0.411 15.488 190 HD13 ILE 26 HD13 ILE 26 12.189 -0.921 15.435 191 H ASN 27 H ASN 27 16.780 -0.089 15.752 192 HA ASN 27 HA ASN 27 18.461 0.971 16.858 193 HB2 ASN 27 HB2 ASN 27 18.844 -1.648 18.322 194 HB3 ASN 27 HB3 ASN 27 19.372 -0.055 18.853 195 HD21 ASN 27 HD21 ASN 27 17.050 1.370 18.121 196 HD22 ASN 27 HD22 ASN 27 15.779 0.897 19.192 197 H VAL 28 H VAL 28 19.282 0.442 14.489 198 HA VAL 28 HA VAL 28 21.886 -0.915 14.743 199 HB VAL 28 HB VAL 28 20.199 -0.536 12.267 200 HG11 VAL 28 HG11 VAL 28 22.316 -0.448 11.389 201 HG12 VAL 28 HG12 VAL 28 23.010 -1.437 12.674 202 HG13 VAL 28 HG13 VAL 28 22.046 -2.190 11.403 203 HG21 VAL 28 HG21 VAL 28 20.679 -2.815 14.121 204 HG22 VAL 28 HG22 VAL 28 19.196 -2.313 13.308 205 HG23 VAL 28 HG23 VAL 28 20.456 -3.152 12.405 206 H ALA 29 H ALA 29 23.442 0.548 14.996 207 HA ALA 29 HA ALA 29 23.286 3.260 14.361 208 HB1 ALA 29 HB1 ALA 29 25.526 1.402 15.004 209 HB2 ALA 29 HB2 ALA 29 25.893 3.031 14.434 210 HB3 ALA 29 HB3 ALA 29 24.932 2.804 15.896 211 H VAL 30 H VAL 30 23.533 4.384 12.537 212 HA VAL 30 HA VAL 30 24.942 3.165 10.274 213 HB VAL 30 HB VAL 30 22.237 4.484 10.013 214 HG11 VAL 30 HG11 VAL 30 22.352 3.902 7.691 215 HG12 VAL 30 HG12 VAL 30 23.817 4.792 8.109 216 HG13 VAL 30 HG13 VAL 30 23.871 3.038 7.933 217 HG21 VAL 30 HG21 VAL 30 21.504 2.479 10.722 218 HG22 VAL 30 HG22 VAL 30 21.911 1.958 9.087 219 HG23 VAL 30 HG23 VAL 30 23.048 1.686 10.408 220 H HIS 31 H HIS 31 26.217 4.549 9.193 221 HA HIS 31 HA HIS 31 25.865 7.431 9.693 222 HB2 HIS 31 HB2 HIS 31 28.558 6.134 9.319 223 HB3 HIS 31 HB3 HIS 31 28.199 7.745 9.935 224 HD1 HIS 31 HD1 HIS 31 27.905 7.983 12.416 225 HD2 HIS 31 HD2 HIS 31 27.946 4.015 11.187 226 HE1 HIS 31 HE1 HIS 31 27.979 6.624 14.532 227 H VAL 32 H VAL 32 25.611 8.596 7.910 228 HA VAL 32 HA VAL 32 26.372 7.402 5.334 229 HB VAL 32 HB VAL 32 24.496 9.728 5.733 230 HG11 VAL 32 HG11 VAL 32 24.999 9.764 3.509 231 HG12 VAL 32 HG12 VAL 32 25.349 8.035 3.444 232 HG13 VAL 32 HG13 VAL 32 23.677 8.598 3.482 233 HG21 VAL 32 HG21 VAL 32 24.051 6.844 6.122 234 HG22 VAL 32 HG22 VAL 32 23.167 8.227 6.767 235 HG23 VAL 32 HG23 VAL 32 22.855 7.671 5.123 236 H PHE 33 H PHE 33 27.793 8.380 4.007 237 HA PHE 33 HA PHE 33 28.733 11.073 4.730 238 HB2 PHE 33 HB2 PHE 33 30.364 8.618 4.111 239 HB3 PHE 33 HB3 PHE 33 31.027 10.239 3.918 240 HD1 PHE 33 HD1 PHE 33 29.424 7.998 6.407 241 HD2 PHE 33 HD2 PHE 33 31.958 11.350 5.731 242 HE1 PHE 33 HE1 PHE 33 29.998 8.041 8.799 243 HE2 PHE 33 HE2 PHE 33 32.538 11.397 8.121 244 HZ PHE 33 HZ PHE 33 31.559 9.741 9.658 245 H ARG 34 H ARG 34 29.977 12.113 2.917 246 HA ARG 34 HA ARG 34 28.976 11.260 0.286 247 HB2 ARG 34 HB2 ARG 34 27.595 13.122 1.161 248 HB3 ARG 34 HB3 ARG 34 29.044 14.110 1.290 249 HG2 ARG 34 HG2 ARG 34 28.535 12.925 -1.357 250 HG3 ARG 34 HG3 ARG 34 27.385 14.151 -0.819 251 HD2 ARG 34 HD2 ARG 34 29.346 15.630 -0.312 252 HD3 ARG 34 HD3 ARG 34 30.371 14.431 -1.099 253 HE ARG 34 HE ARG 34 28.736 16.375 -2.375 254 HH11 ARG 34 HH11 ARG 34 29.934 13.120 -2.684 255 HH12 ARG 34 HH12 ARG 34 29.836 13.110 -4.413 256 HH21 ARG 34 HH21 ARG 34 28.603 16.372 -4.652 257 HH22 ARG 34 HH22 ARG 34 29.080 14.960 -5.532 258 H LYS 35 H LYS 35 30.315 11.678 -1.465 259 HA LYS 35 HA LYS 35 33.095 11.750 -0.925 260 HB2 LYS 35 HB2 LYS 35 32.544 10.560 -2.849 261 HB3 LYS 35 HB3 LYS 35 31.427 11.795 -3.414 262 HG2 LYS 35 HG2 LYS 35 33.396 11.740 -4.811 263 HG3 LYS 35 HG3 LYS 35 33.323 13.264 -3.923 264 HD2 LYS 35 HD2 LYS 35 35.577 12.505 -3.830 265 HD3 LYS 35 HD3 LYS 35 34.875 12.239 -2.234 266 HE2 LYS 35 HE2 LYS 35 35.726 10.172 -2.449 267 HE3 LYS 35 HE3 LYS 35 34.313 9.882 -3.462 268 HZ1 LYS 35 HZ1 LYS 35 36.674 11.020 -4.747 269 HZ2 LYS 35 HZ2 LYS 35 35.543 9.917 -5.349 270 HZ3 LYS 35 HZ3 LYS 35 36.755 9.393 -4.292 271 H ALA 36 H ALA 36 34.073 13.525 -0.191 272 HA ALA 36 HA ALA 36 33.163 16.168 -0.726 273 HB1 ALA 36 HB1 ALA 36 34.689 15.098 1.211 274 HB2 ALA 36 HB2 ALA 36 35.942 15.807 0.193 275 HB3 ALA 36 HB3 ALA 36 34.652 16.822 0.839 276 H ALA 37 H ALA 37 34.323 17.842 -1.839 277 HA ALA 37 HA ALA 37 35.102 17.164 -4.437 278 HB1 ALA 37 HB1 ALA 37 34.245 19.396 -3.599 279 HB2 ALA 37 HB2 ALA 37 35.892 19.715 -3.057 280 HB3 ALA 37 HB3 ALA 37 35.562 19.452 -4.770 281 H ASP 38 H ASP 38 36.885 17.181 -1.509 282 HA ASP 38 HA ASP 38 39.460 17.261 -2.883 283 HB2 ASP 38 HB2 ASP 38 38.555 17.553 -0.069 284 HB3 ASP 38 HB3 ASP 38 40.152 16.855 -0.322 285 H ASP 39 H ASP 39 37.355 15.010 -2.874 286 HA ASP 39 HA ASP 39 37.382 12.741 -3.038 287 HB2 ASP 39 HB2 ASP 39 40.358 12.717 -2.658 288 HB3 ASP 39 HB3 ASP 39 39.360 11.679 -3.675 289 H THR 40 H THR 40 36.889 13.842 -0.535 290 HA THR 40 HA THR 40 38.084 11.818 1.245 291 HB THR 40 HB THR 40 38.113 13.323 3.068 292 HG1 THR 40 HG1 THR 40 36.618 14.805 3.181 293 HG21 THR 40 HG21 THR 40 39.495 15.197 2.275 294 HG22 THR 40 HG22 THR 40 39.002 14.849 0.617 295 HG23 THR 40 HG23 THR 40 39.961 13.675 1.516 296 H TRP 41 H TRP 41 36.642 11.718 3.355 297 HA TRP 41 HA TRP 41 33.902 11.232 2.413 298 HB2 TRP 41 HB2 TRP 41 35.508 10.041 4.673 299 HB3 TRP 41 HB3 TRP 41 33.771 9.797 4.514 300 HD1 TRP 41 HD1 TRP 41 36.392 9.673 1.665 301 HE1 TRP 41 HE1 TRP 41 36.258 7.350 0.563 302 HE3 TRP 41 HE3 TRP 41 32.959 7.499 4.767 303 HZ2 TRP 41 HZ2 TRP 41 34.880 4.919 0.957 304 HZ3 TRP 41 HZ3 TRP 41 32.286 5.172 4.336 305 HH2 TRP 41 HH2 TRP 41 33.227 3.910 2.469 306 H GLU 42 H GLU 42 32.629 12.927 2.826 307 HA GLU 42 HA GLU 42 32.979 14.416 5.322 308 HB2 GLU 42 HB2 GLU 42 31.443 15.000 2.793 309 HB3 GLU 42 HB3 GLU 42 31.291 15.981 4.244 310 HG2 GLU 42 HG2 GLU 42 33.999 15.470 3.117 311 HG3 GLU 42 HG3 GLU 42 32.945 16.651 2.339 312 HA PRO 43 HA PRO 43 29.486 12.607 7.276 313 HB2 PRO 43 HB2 PRO 43 28.703 14.667 8.862 314 HB3 PRO 43 HB3 PRO 43 30.153 13.708 9.179 315 HG2 PRO 43 HG2 PRO 43 29.905 16.389 7.874 316 HG3 PRO 43 HG3 PRO 43 31.089 15.833 9.070 317 HD2 PRO 43 HD2 PRO 43 31.650 15.982 6.425 318 HD3 PRO 43 HD3 PRO 43 32.370 14.754 7.486 319 H PHE 44 H PHE 44 27.666 12.215 6.184 320 HA PHE 44 HA PHE 44 26.158 14.465 5.057 321 HB2 PHE 44 HB2 PHE 44 26.814 12.604 3.536 322 HB3 PHE 44 HB3 PHE 44 25.837 11.508 4.507 323 HD1 PHE 44 HD2 PHE 44 23.369 11.827 4.604 324 HD2 PHE 44 HD1 PHE 44 25.842 13.997 1.904 325 HE1 PHE 44 HE2 PHE 44 21.392 12.390 3.252 326 HE2 PHE 44 HE1 PHE 44 23.869 14.565 0.548 327 HZ PHE 44 HZ PHE 44 21.641 13.761 1.221 328 H ALA 45 H ALA 45 25.839 11.652 7.159 329 HA ALA 45 HA ALA 45 23.885 12.832 8.791 330 HB1 ALA 45 HB1 ALA 45 22.514 10.626 7.406 331 HB2 ALA 45 HB2 ALA 45 21.881 12.155 8.019 332 HB3 ALA 45 HB3 ALA 45 22.719 12.105 6.468 333 H SER 46 H SER 46 22.731 11.032 10.154 334 HA SER 46 HA SER 46 23.955 8.491 10.372 335 HB2 SER 46 HB2 SER 46 25.905 9.341 11.274 336 HB3 SER 46 HB3 SER 46 25.089 10.722 12.006 337 HG SER 46 HG SER 46 25.293 9.540 13.746 338 H GLY 47 H GLY 47 22.890 7.170 11.824 339 HA2 GLY 47 HA2 GLY 47 21.318 8.034 13.984 340 HA3 GLY 47 HA3 GLY 47 20.283 7.908 12.570 341 H LYS 48 H LYS 48 19.140 6.262 13.771 342 HA LYS 48 HA LYS 48 20.468 3.645 13.546 343 HB2 LYS 48 HB2 LYS 48 19.099 4.865 15.868 344 HB3 LYS 48 HB3 LYS 48 18.698 3.183 15.542 345 HG2 LYS 48 HG2 LYS 48 21.072 2.602 15.638 346 HG3 LYS 48 HG3 LYS 48 21.466 4.289 15.978 347 HD2 LYS 48 HD2 LYS 48 19.663 2.588 17.696 348 HD3 LYS 48 HD3 LYS 48 21.385 2.828 18.000 349 HE2 LYS 48 HE2 LYS 48 20.410 5.393 17.671 350 HE3 LYS 48 HE3 LYS 48 19.128 4.572 18.559 351 HZ1 LYS 48 HZ1 LYS 48 21.709 5.410 19.457 352 HZ2 LYS 48 HZ2 LYS 48 21.425 3.778 19.801 353 HZ3 LYS 48 HZ3 LYS 48 20.351 4.960 20.359 354 H THR 49 H THR 49 19.358 2.134 12.463 355 HA THR 49 HA THR 49 17.105 2.760 10.944 356 HB THR 49 HB THR 49 16.984 0.433 10.341 357 HG1 THR 49 HG1 THR 49 18.311 0.093 12.791 358 HG21 THR 49 HG21 THR 49 18.816 0.797 9.127 359 HG22 THR 49 HG22 THR 49 19.788 0.194 10.469 360 HG23 THR 49 HG23 THR 49 19.437 1.918 10.337 361 H SER 50 H SER 50 15.045 1.366 11.010 362 HA SER 50 HA SER 50 14.083 1.144 13.785 363 HB2 SER 50 HB2 SER 50 13.266 3.216 12.574 364 HB3 SER 50 HB3 SER 50 12.398 2.138 11.481 365 HG SER 50 HG SER 50 11.019 1.640 13.035 366 H GLU 51 H GLU 51 11.856 -0.045 13.765 367 HA GLU 51 HA GLU 51 12.336 -2.655 12.759 368 HB2 GLU 51 HB2 GLU 51 9.977 -3.084 13.586 369 HB3 GLU 51 HB3 GLU 51 11.123 -2.505 14.786 370 HG2 GLU 51 HG2 GLU 51 9.798 -0.810 15.272 371 HG3 GLU 51 HG3 GLU 51 9.854 -0.256 13.599 372 H SER 52 H SER 52 11.167 0.089 11.266 373 HA SER 52 HA SER 52 9.482 -1.405 9.386 374 HB2 SER 52 HB2 SER 52 8.446 0.603 10.264 375 HB3 SER 52 HB3 SER 52 9.846 1.571 9.802 376 HG SER 52 HG SER 52 7.765 1.255 8.370 377 H GLY 53 H GLY 53 12.630 -0.775 9.706 378 HA2 GLY 53 HA2 GLY 53 14.376 -0.941 8.210 379 HA3 GLY 53 HA3 GLY 53 13.191 -1.203 6.939 380 H GLU 54 H GLU 54 12.882 1.620 8.901 381 HA GLU 54 HA GLU 54 14.132 3.254 6.800 382 HB2 GLU 54 HB2 GLU 54 12.255 4.910 7.162 383 HB3 GLU 54 HB3 GLU 54 11.814 3.428 6.328 384 HG2 GLU 54 HG2 GLU 54 10.580 2.635 8.092 385 HG3 GLU 54 HG3 GLU 54 11.474 3.581 9.281 386 H LEU 55 H LEU 55 15.497 4.749 7.539 387 HA LEU 55 HA LEU 55 15.775 5.083 10.413 388 HB2 LEU 55 HB2 LEU 55 17.610 4.825 8.472 389 HB3 LEU 55 HB3 LEU 55 17.507 6.583 8.544 390 HG LEU 55 HG LEU 55 17.881 5.157 11.114 391 HD11 LEU 55 HD11 LEU 55 20.116 5.473 9.116 392 HD12 LEU 55 HD12 LEU 55 19.386 3.943 9.599 393 HD13 LEU 55 HD13 LEU 55 20.267 4.910 10.781 394 HD21 LEU 55 HD21 LEU 55 19.669 7.329 10.520 395 HD22 LEU 55 HD22 LEU 55 18.435 7.203 11.775 396 HD23 LEU 55 HD23 LEU 55 18.002 7.786 10.167 397 H HIS 56 H HIS 56 16.162 7.274 11.303 398 HA HIS 56 HA HIS 56 13.983 8.963 10.857 399 HB2 HIS 56 HB2 HIS 56 16.070 8.803 12.706 400 HB3 HIS 56 HB3 HIS 56 16.258 10.388 11.962 401 HD1 HIS 56 HD1 HIS 56 13.159 8.474 13.090 402 HD2 HIS 56 HD2 HIS 56 15.027 12.152 13.586 403 HE1 HIS 56 HE1 HIS 56 11.628 9.812 14.569 404 H GLY 57 H GLY 57 14.705 11.524 10.633 405 HA2 GLY 57 HA2 GLY 57 15.092 11.860 7.855 406 HA3 GLY 57 HA3 GLY 57 15.096 13.145 9.054 407 H LEU 58 H LEU 58 17.042 10.909 7.228 408 HA LEU 58 HA LEU 58 19.507 11.997 8.358 409 HB2 LEU 58 HB2 LEU 58 18.927 9.715 6.489 410 HB3 LEU 58 HB3 LEU 58 20.564 10.287 6.804 411 HG LEU 58 HG LEU 58 18.671 9.150 8.861 412 HD11 LEU 58 HD11 LEU 58 19.313 7.228 7.884 413 HD12 LEU 58 HD12 LEU 58 20.796 7.493 8.798 414 HD13 LEU 58 HD13 LEU 58 20.711 7.965 7.101 415 HD21 LEU 58 HD21 LEU 58 21.410 9.216 9.659 416 HD22 LEU 58 HD22 LEU 58 20.013 9.981 10.418 417 HD23 LEU 58 HD23 LEU 58 20.914 10.835 9.163 418 H THR 59 H THR 59 17.525 12.171 5.524 419 HA THR 59 HA THR 59 19.367 13.083 3.634 420 HB THR 59 HB THR 59 17.527 13.918 2.373 421 HG1 THR 59 HG1 THR 59 15.474 14.250 3.369 422 HG21 THR 59 HG21 THR 59 17.538 11.349 3.470 423 HG22 THR 59 HG22 THR 59 16.682 11.881 2.022 424 HG23 THR 59 HG23 THR 59 15.864 11.889 3.584 425 H THR 60 H THR 60 19.815 15.209 2.866 426 HA THR 60 HA THR 60 19.139 17.468 4.558 427 HB THR 60 HB THR 60 21.555 18.149 4.768 428 HG1 THR 60 HG1 THR 60 23.119 16.705 4.290 429 HG21 THR 60 HG21 THR 60 21.994 16.739 6.711 430 HG22 THR 60 HG22 THR 60 20.777 15.586 6.164 431 HG23 THR 60 HG23 THR 60 20.296 17.209 6.658 432 H GLU 61 H GLU 61 20.609 19.436 3.657 433 HA GLU 61 HA GLU 61 19.660 19.943 1.069 434 HB2 GLU 61 HB2 GLU 61 21.179 21.921 1.133 435 HB3 GLU 61 HB3 GLU 61 20.143 21.774 2.545 436 HG2 GLU 61 HG2 GLU 61 22.003 20.819 3.810 437 HG3 GLU 61 HG3 GLU 61 23.041 20.978 2.395 438 H GLU 62 H GLU 62 22.417 18.234 2.140 439 HA GLU 62 HA GLU 62 23.979 18.620 -0.250 440 HB2 GLU 62 HB2 GLU 62 24.253 16.910 2.201 441 HB3 GLU 62 HB3 GLU 62 25.274 16.621 0.799 442 HG2 GLU 62 HG2 GLU 62 25.100 19.141 2.430 443 HG3 GLU 62 HG3 GLU 62 26.452 18.013 2.345 444 H GLU 63 H GLU 63 21.208 16.980 0.317 445 HA GLU 63 HA GLU 63 21.683 14.460 -0.876 446 HB2 GLU 63 HB2 GLU 63 19.317 14.202 -0.938 447 HB3 GLU 63 HB3 GLU 63 19.690 15.095 0.530 448 HG2 GLU 63 HG2 GLU 63 17.945 16.329 -0.220 449 HG3 GLU 63 HG3 GLU 63 19.260 17.170 -1.040 450 H PHE 64 H PHE 64 21.195 17.628 -2.170 451 HA PHE 64 HA PHE 64 20.527 16.690 -4.824 452 HB2 PHE 64 HB2 PHE 64 19.718 18.875 -3.742 453 HB3 PHE 64 HB3 PHE 64 21.325 19.502 -4.097 454 HD1 PHE 64 HD2 PHE 64 18.866 17.424 -5.988 455 HD2 PHE 64 HD1 PHE 64 21.296 20.917 -5.893 456 HE1 PHE 64 HE2 PHE 64 18.136 17.990 -8.269 457 HE2 PHE 64 HE1 PHE 64 20.571 21.488 -8.175 458 HZ PHE 64 HZ PHE 64 18.990 20.023 -9.366 459 H VAL 65 H VAL 65 22.716 15.389 -4.428 460 HA VAL 65 HA VAL 65 24.844 16.931 -5.764 461 HB VAL 65 HB VAL 65 26.476 15.391 -4.683 462 HG11 VAL 65 HG11 VAL 65 24.819 17.377 -3.266 463 HG12 VAL 65 HG12 VAL 65 25.838 16.353 -2.252 464 HG13 VAL 65 HG13 VAL 65 26.561 17.331 -3.529 465 HG21 VAL 65 HG21 VAL 65 24.754 13.602 -4.241 466 HG22 VAL 65 HG22 VAL 65 25.850 13.952 -2.904 467 HG23 VAL 65 HG23 VAL 65 24.203 14.582 -2.883 468 H GLU 66 H GLU 66 26.545 15.115 -6.601 469 HA GLU 66 HA GLU 66 25.477 14.028 -8.890 470 HB2 GLU 66 HB2 GLU 66 27.833 12.889 -7.380 471 HB3 GLU 66 HB3 GLU 66 27.509 12.733 -9.100 472 HG2 GLU 66 HG2 GLU 66 27.706 15.226 -9.266 473 HG3 GLU 66 HG3 GLU 66 28.269 15.221 -7.595 474 H GLY 67 H GLY 67 25.895 12.484 -5.731 475 HA2 GLY 67 HA2 GLY 67 23.892 10.963 -5.276 476 HA3 GLY 67 HA3 GLY 67 24.409 10.147 -6.743 477 H ILE 68 H ILE 68 27.157 11.200 -5.291 478 HA ILE 68 HA ILE 68 27.918 8.575 -4.479 479 HB ILE 68 HB ILE 68 29.392 11.139 -3.887 480 HG12 ILE 68 HG12 ILE 68 29.653 9.379 -6.334 481 HG13 ILE 68 HG13 ILE 68 28.790 10.912 -6.306 482 HG21 ILE 68 HG21 ILE 68 30.380 9.400 -2.672 483 HG22 ILE 68 HG22 ILE 68 30.162 8.241 -3.981 484 HG23 ILE 68 HG23 ILE 68 31.362 9.526 -4.132 485 HD11 ILE 68 HD11 ILE 68 30.906 12.021 -5.642 486 HD12 ILE 68 HD12 ILE 68 31.729 10.477 -5.860 487 HD13 ILE 68 HD13 ILE 68 30.957 11.266 -7.234 488 H TYR 69 H TYR 69 27.225 7.670 -2.659 489 HA TYR 69 HA TYR 69 27.372 9.219 -0.178 490 HB2 TYR 69 HB2 TYR 69 25.018 7.440 -0.816 491 HB3 TYR 69 HB3 TYR 69 25.213 8.504 0.572 492 HD1 TYR 69 HD2 TYR 69 25.732 11.061 -0.198 493 HD2 TYR 69 HD1 TYR 69 23.562 8.169 -2.439 494 HE1 TYR 69 HE2 TYR 69 24.595 12.869 -1.418 495 HE2 TYR 69 HE1 TYR 69 22.419 9.967 -3.666 496 HH TYR 69 HH TYR 69 21.851 12.399 -3.262 497 H LYS 70 H LYS 70 28.377 8.148 1.394 498 HA LYS 70 HA LYS 70 28.764 5.248 1.063 499 HB2 LYS 70 HB2 LYS 70 30.483 7.160 2.651 500 HB3 LYS 70 HB3 LYS 70 30.833 5.475 2.288 501 HG2 LYS 70 HG2 LYS 70 32.054 6.288 0.611 502 HG3 LYS 70 HG3 LYS 70 30.507 6.530 -0.207 503 HD2 LYS 70 HD2 LYS 70 30.406 8.814 0.685 504 HD3 LYS 70 HD3 LYS 70 31.961 8.567 1.482 505 HE2 LYS 70 HE2 LYS 70 31.553 8.302 -1.490 506 HE3 LYS 70 HE3 LYS 70 32.048 9.803 -0.709 507 HZ1 LYS 70 HZ1 LYS 70 34.006 8.743 -1.426 508 HZ2 LYS 70 HZ2 LYS 70 33.527 7.239 -0.817 509 HZ3 LYS 70 HZ3 LYS 70 33.946 8.487 0.244 510 H VAL 71 H VAL 71 27.253 4.256 2.264 511 HA VAL 71 HA VAL 71 26.664 5.280 4.949 512 HB VAL 71 HB VAL 71 25.228 3.176 3.324 513 HG11 VAL 71 HG11 VAL 71 24.494 4.429 5.967 514 HG12 VAL 71 HG12 VAL 71 23.495 3.305 5.045 515 HG13 VAL 71 HG13 VAL 71 25.033 2.769 5.722 516 HG21 VAL 71 HG21 VAL 71 24.747 6.095 3.792 517 HG22 VAL 71 HG22 VAL 71 24.753 5.199 2.273 518 HG23 VAL 71 HG23 VAL 71 23.414 5.007 3.405 519 H GLU 72 H GLU 72 27.342 4.272 6.733 520 HA GLU 72 HA GLU 72 28.493 1.574 6.444 521 HB2 GLU 72 HB2 GLU 72 30.269 2.115 7.815 522 HB3 GLU 72 HB3 GLU 72 30.024 3.633 6.964 523 HG2 GLU 72 HG2 GLU 72 28.485 4.199 8.987 524 HG3 GLU 72 HG3 GLU 72 29.405 2.928 9.792 525 H ILE 73 H ILE 73 27.926 0.032 7.901 526 HA ILE 73 HA ILE 73 25.951 0.817 9.943 527 HB ILE 73 HB ILE 73 26.176 -1.886 8.621 528 HG12 ILE 73 HG12 ILE 73 23.760 -0.543 7.939 529 HG13 ILE 73 HG13 ILE 73 25.096 0.550 7.591 530 HG21 ILE 73 HG21 ILE 73 23.818 -0.802 10.117 531 HG22 ILE 73 HG22 ILE 73 24.225 -2.476 9.747 532 HG23 ILE 73 HG23 ILE 73 25.150 -1.592 10.960 533 HD11 ILE 73 HD11 ILE 73 26.082 -0.989 6.098 534 HD12 ILE 73 HD12 ILE 73 25.016 -2.291 6.626 535 HD13 ILE 73 HD13 ILE 73 24.363 -0.935 5.706 536 H ASP 74 H ASP 74 26.274 0.222 12.013 537 HA ASP 74 HA ASP 74 28.740 -1.262 12.603 538 HB2 ASP 74 HB2 ASP 74 27.942 1.167 13.545 539 HB3 ASP 74 HB3 ASP 74 27.356 0.102 14.819 540 H THR 75 H THR 75 27.778 -3.325 12.274 541 HA THR 75 HA THR 75 25.757 -4.098 14.266 542 HB THR 75 HB THR 75 25.090 -5.866 12.882 543 HG1 THR 75 HG1 THR 75 26.981 -6.823 12.276 544 HG21 THR 75 HG21 THR 75 24.261 -4.751 11.083 545 HG22 THR 75 HG22 THR 75 25.832 -4.090 10.630 546 HG23 THR 75 HG23 THR 75 24.914 -3.361 11.947 547 H LYS 76 H LYS 76 28.799 -3.831 14.505 548 HA LYS 76 HA LYS 76 29.628 -6.556 15.048 549 HB2 LYS 76 HB2 LYS 76 31.773 -5.510 15.716 550 HB3 LYS 76 HB3 LYS 76 31.266 -5.050 14.095 551 HG2 LYS 76 HG2 LYS 76 31.775 -2.983 14.790 552 HG3 LYS 76 HG3 LYS 76 30.178 -3.044 15.538 553 HD2 LYS 76 HD2 LYS 76 31.415 -2.414 17.350 554 HD3 LYS 76 HD3 LYS 76 31.550 -4.166 17.508 555 HE2 LYS 76 HE2 LYS 76 33.739 -3.345 17.776 556 HE3 LYS 76 HE3 LYS 76 33.676 -3.974 16.131 557 HZ1 LYS 76 HZ1 LYS 76 34.745 -1.711 16.487 558 HZ2 LYS 76 HZ2 LYS 76 33.176 -1.120 16.710 559 HZ3 LYS 76 HZ3 LYS 76 33.608 -1.837 15.240 560 H SER 77 H SER 77 28.953 -3.597 16.879 561 HA SER 77 HA SER 77 29.308 -5.007 19.400 562 HB2 SER 77 HB2 SER 77 28.444 -2.573 20.163 563 HB3 SER 77 HB3 SER 77 30.130 -2.910 19.766 564 HG SER 77 HG SER 77 28.787 -1.072 18.689 565 H TYR 78 H TYR 78 26.733 -3.199 17.734 566 HA TYR 78 HA TYR 78 24.680 -3.564 19.537 567 HB2 TYR 78 HB2 TYR 78 24.756 -3.259 16.559 568 HB3 TYR 78 HB3 TYR 78 23.224 -3.606 17.351 569 HD1 TYR 78 HD2 TYR 78 22.283 -1.991 18.982 570 HD2 TYR 78 HD1 TYR 78 25.763 -1.100 16.702 571 HE1 TYR 78 HE2 TYR 78 22.008 0.397 19.507 572 HE2 TYR 78 HE1 TYR 78 25.498 1.290 17.222 573 HH TYR 78 HH TYR 78 24.401 2.663 19.063 574 H TRP 79 H TRP 79 26.135 -5.872 17.401 575 HA TRP 79 HA TRP 79 24.031 -7.780 17.403 576 HB2 TRP 79 HB2 TRP 79 26.771 -7.613 16.423 577 HB3 TRP 79 HB3 TRP 79 26.375 -9.217 17.032 578 HD1 TRP 79 HD1 TRP 79 26.238 -10.414 14.702 579 HE1 TRP 79 HE1 TRP 79 24.605 -10.251 12.718 580 HE3 TRP 79 HE3 TRP 79 23.749 -6.155 16.044 581 HZ2 TRP 79 HZ2 TRP 79 22.537 -8.545 11.839 582 HZ3 TRP 79 HZ3 TRP 79 21.957 -5.324 14.577 583 HH2 TRP 79 HH2 TRP 79 21.366 -6.495 12.517 584 H LYS 80 H LYS 80 26.836 -7.231 19.460 585 HA LYS 80 HA LYS 80 26.629 -9.627 20.956 586 HB2 LYS 80 HB2 LYS 80 28.301 -8.758 22.320 587 HB3 LYS 80 HB3 LYS 80 28.590 -7.939 20.791 588 HG2 LYS 80 HG2 LYS 80 28.594 -6.053 21.964 589 HG3 LYS 80 HG3 LYS 80 26.844 -6.250 22.086 590 HD2 LYS 80 HD2 LYS 80 27.645 -5.908 24.294 591 HD3 LYS 80 HD3 LYS 80 27.258 -7.625 24.159 592 HE2 LYS 80 HE2 LYS 80 29.450 -8.265 24.243 593 HE3 LYS 80 HE3 LYS 80 30.030 -6.765 23.520 594 HZ1 LYS 80 HZ1 LYS 80 29.543 -5.635 25.618 595 HZ2 LYS 80 HZ2 LYS 80 30.663 -6.884 25.829 596 HZ3 LYS 80 HZ3 LYS 80 29.055 -7.103 26.306 597 H ALA 81 H ALA 81 24.776 -6.770 20.934 598 HA ALA 81 HA ALA 81 23.896 -6.874 23.664 599 HB1 ALA 81 HB1 ALA 81 23.687 -5.053 21.521 600 HB2 ALA 81 HB2 ALA 81 22.043 -5.475 22.004 601 HB3 ALA 81 HB3 ALA 81 23.174 -4.831 23.193 602 H LEU 82 H LEU 82 22.591 -7.916 20.541 603 HA LEU 82 HA LEU 82 20.257 -9.075 21.849 604 HB2 LEU 82 HB2 LEU 82 21.036 -8.947 18.940 605 HB3 LEU 82 HB3 LEU 82 19.518 -9.595 19.559 606 HG LEU 82 HG LEU 82 18.939 -7.478 18.804 607 HD11 LEU 82 HD11 LEU 82 19.640 -6.888 21.667 608 HD12 LEU 82 HD12 LEU 82 18.320 -7.962 21.206 609 HD13 LEU 82 HD13 LEU 82 18.287 -6.266 20.722 610 HD21 LEU 82 HD21 LEU 82 21.287 -6.212 20.186 611 HD22 LEU 82 HD22 LEU 82 20.236 -5.523 18.950 612 HD23 LEU 82 HD23 LEU 82 21.376 -6.801 18.526 613 H GLY 83 H GLY 83 23.205 -10.060 21.886 614 HA2 GLY 83 HA2 GLY 83 24.250 -12.097 22.036 615 HA3 GLY 83 HA3 GLY 83 22.642 -12.790 22.182 616 H ILE 84 H ILE 84 24.177 -11.066 19.481 617 HA ILE 84 HA ILE 84 23.483 -13.332 17.753 618 HB ILE 84 HB ILE 84 24.423 -10.623 16.834 619 HG12 ILE 84 HG12 ILE 84 22.445 -10.295 18.234 620 HG13 ILE 84 HG13 ILE 84 22.048 -10.029 16.540 621 HG21 ILE 84 HG21 ILE 84 22.946 -11.383 14.848 622 HG22 ILE 84 HG22 ILE 84 24.553 -12.082 15.040 623 HG23 ILE 84 HG23 ILE 84 23.130 -12.992 15.546 624 HD11 ILE 84 HD11 ILE 84 21.351 -12.388 18.257 625 HD12 ILE 84 HD12 ILE 84 20.264 -11.252 17.459 626 HD13 ILE 84 HD13 ILE 84 21.197 -12.402 16.500 627 H SER 85 H SER 85 25.006 -14.002 16.098 628 HA SER 85 HA SER 85 27.462 -14.775 17.045 629 HB2 SER 85 HB2 SER 85 26.077 -14.927 14.571 630 HB3 SER 85 HB3 SER 85 27.714 -14.370 14.221 631 HG SER 85 HG SER 85 26.838 -16.819 15.092 632 HA PRO 86 HA PRO 86 29.890 -11.084 17.111 633 HB2 PRO 86 HB2 PRO 86 32.320 -12.261 17.397 634 HB3 PRO 86 HB3 PRO 86 31.151 -12.138 18.718 635 HG2 PRO 86 HG2 PRO 86 31.740 -14.458 16.919 636 HG3 PRO 86 HG3 PRO 86 31.470 -14.441 18.672 637 HD2 PRO 86 HD2 PRO 86 29.547 -15.164 16.907 638 HD3 PRO 86 HD3 PRO 86 29.178 -14.354 18.443 639 H MET 87 H MET 87 31.196 -13.795 15.187 640 HA MET 87 HA MET 87 32.652 -12.092 13.427 641 HB2 MET 87 HB2 MET 87 32.901 -14.182 12.057 642 HB3 MET 87 HB3 MET 87 33.443 -14.325 13.723 643 HG2 MET 87 HG2 MET 87 30.769 -15.087 13.776 644 HG3 MET 87 HG3 MET 87 31.422 -15.810 12.308 645 HE1 MET 87 HE1 MET 87 33.649 -17.505 12.372 646 HE2 MET 87 HE2 MET 87 33.178 -18.819 13.450 647 HE3 MET 87 HE3 MET 87 31.984 -18.086 12.378 648 H HIS 88 H HIS 88 30.970 -10.595 12.815 649 HA HIS 88 HA HIS 88 29.199 -11.673 10.719 650 HB2 HIS 88 HB2 HIS 88 28.043 -10.789 12.786 651 HB3 HIS 88 HB3 HIS 88 28.663 -9.196 12.363 652 HD1 HIS 88 HD1 HIS 88 27.532 -7.963 10.426 653 HD2 HIS 88 HD2 HIS 88 25.992 -11.761 11.108 654 HE1 HIS 88 HE1 HIS 88 25.422 -8.087 9.064 655 H GLU 89 H GLU 89 31.590 -9.346 11.595 656 HA GLU 89 HA GLU 89 32.482 -7.531 10.488 657 HB2 GLU 89 HB2 GLU 89 33.239 -8.217 8.155 658 HB3 GLU 89 HB3 GLU 89 33.770 -9.233 9.487 659 HG2 GLU 89 HG2 GLU 89 32.034 -10.851 8.971 660 HG3 GLU 89 HG3 GLU 89 31.450 -9.824 7.664 661 H HIS 90 H HIS 90 30.559 -6.212 10.599 662 HA HIS 90 HA HIS 90 28.483 -6.130 8.788 663 HB2 HIS 90 HB2 HIS 90 28.345 -3.680 9.340 664 HB3 HIS 90 HB3 HIS 90 28.407 -4.745 10.742 665 HD1 HIS 90 HD1 HIS 90 30.159 -4.237 12.435 666 HD2 HIS 90 HD2 HIS 90 30.935 -2.418 8.781 667 HE1 HIS 90 HE1 HIS 90 32.157 -2.761 12.830 668 H ALA 91 H ALA 91 28.078 -4.975 6.881 669 HA ALA 91 HA ALA 91 30.485 -4.450 5.289 670 HB1 ALA 91 HB1 ALA 91 29.191 -4.855 3.351 671 HB2 ALA 91 HB2 ALA 91 28.752 -6.112 4.509 672 HB3 ALA 91 HB3 ALA 91 27.677 -4.738 4.249 673 H GLU 92 H GLU 92 29.718 -2.807 3.363 674 HA GLU 92 HA GLU 92 28.401 -0.485 4.545 675 HB2 GLU 92 HB2 GLU 92 30.319 0.951 3.636 676 HB3 GLU 92 HB3 GLU 92 30.604 0.069 5.129 677 HG2 GLU 92 HG2 GLU 92 31.368 -1.204 2.554 678 HG3 GLU 92 HG3 GLU 92 32.376 0.094 3.196 679 H VAL 93 H VAL 93 27.685 1.065 3.009 680 HA VAL 93 HA VAL 93 27.459 -0.037 0.290 681 HB VAL 93 HB VAL 93 25.687 2.058 1.546 682 HG11 VAL 93 HG11 VAL 93 25.755 0.624 -1.051 683 HG12 VAL 93 HG12 VAL 93 24.176 0.955 -0.336 684 HG13 VAL 93 HG13 VAL 93 25.283 2.283 -0.684 685 HG21 VAL 93 HG21 VAL 93 25.775 -0.792 1.991 686 HG22 VAL 93 HG22 VAL 93 24.781 0.437 2.774 687 HG23 VAL 93 HG23 VAL 93 24.239 -0.309 1.270 688 H VAL 94 H VAL 94 28.869 0.855 -1.066 689 HA VAL 94 HA VAL 94 29.217 3.780 -0.984 690 HB VAL 94 HB VAL 94 31.392 1.823 -1.729 691 HG11 VAL 94 HG11 VAL 94 32.787 3.625 -2.023 692 HG12 VAL 94 HG12 VAL 94 31.256 4.292 -2.597 693 HG13 VAL 94 HG13 VAL 94 31.832 4.674 -0.974 694 HG21 VAL 94 HG21 VAL 94 30.559 2.900 0.882 695 HG22 VAL 94 HG22 VAL 94 31.465 1.437 0.493 696 HG23 VAL 94 HG23 VAL 94 32.285 2.998 0.533 697 H PHE 95 H PHE 95 28.183 4.526 -2.720 698 HA PHE 95 HA PHE 95 28.715 3.227 -5.308 699 HB2 PHE 95 HB2 PHE 95 26.113 4.090 -4.113 700 HB3 PHE 95 HB3 PHE 95 26.327 4.210 -5.857 701 HD1 PHE 95 HD2 PHE 95 26.883 2.144 -7.159 702 HD2 PHE 95 HD1 PHE 95 25.679 2.030 -3.077 703 HE1 PHE 95 HE2 PHE 95 26.329 -0.242 -7.392 704 HE2 PHE 95 HE1 PHE 95 25.125 -0.355 -3.304 705 HZ PHE 95 HZ PHE 95 25.449 -1.495 -5.462 706 H THR 96 H THR 96 28.939 4.578 -7.089 707 HA THR 96 HA THR 96 29.138 7.455 -6.472 708 HB THR 96 HB THR 96 31.364 6.425 -6.774 709 HG1 THR 96 HG1 THR 96 32.077 7.999 -8.215 710 HG21 THR 96 HG21 THR 96 31.755 4.918 -8.367 711 HG22 THR 96 HG22 THR 96 31.325 6.089 -9.614 712 HG23 THR 96 HG23 THR 96 30.079 5.069 -8.894 713 H ALA 97 H ALA 97 28.466 8.914 -8.035 714 HA ALA 97 HA ALA 97 26.491 7.915 -9.879 715 HB1 ALA 97 HB1 ALA 97 25.804 10.131 -10.149 716 HB2 ALA 97 HB2 ALA 97 26.348 10.053 -8.472 717 HB3 ALA 97 HB3 ALA 97 27.386 10.773 -9.703 718 H ASN 98 H ASN 98 26.433 8.526 -12.153 719 HA ASN 98 HA ASN 98 27.304 8.594 -14.254 720 HB2 ASN 98 HB2 ASN 98 28.382 10.709 -13.147 721 HB3 ASN 98 HB3 ASN 98 29.862 9.756 -13.208 722 HD21 ASN 98 HD21 ASN 98 30.872 11.044 -14.696 723 HD22 ASN 98 HD22 ASN 98 30.372 11.150 -16.346 724 H ASP 99 H ASP 99 27.762 6.305 -12.511 725 HA ASP 99 HA ASP 99 30.245 5.262 -13.710 726 HB2 ASP 99 HB2 ASP 99 30.648 3.961 -11.814 727 HB3 ASP 99 HB3 ASP 99 30.025 5.461 -11.131 728 H SER 100 H SER 100 26.841 4.810 -13.241 729 HA SER 100 HA SER 100 26.903 2.585 -15.140 730 HB2 SER 100 HB2 SER 100 25.271 2.476 -12.595 731 HB3 SER 100 HB3 SER 100 25.417 1.217 -13.820 732 HG SER 100 HG SER 100 26.763 0.864 -11.975 733 H GLY 101 H GLY 101 24.259 1.959 -15.244 734 HA2 GLY 101 HA2 GLY 101 23.177 4.311 -16.541 735 HA3 GLY 101 HA3 GLY 101 22.479 2.698 -16.548 736 HA PRO 102 HA PRO 102 19.496 3.851 -13.559 737 HB2 PRO 102 HB2 PRO 102 19.367 1.678 -11.937 738 HB3 PRO 102 HB3 PRO 102 18.738 1.683 -13.589 739 HG2 PRO 102 HG2 PRO 102 21.339 0.621 -12.555 740 HG3 PRO 102 HG3 PRO 102 20.220 -0.105 -13.724 741 HD2 PRO 102 HD2 PRO 102 22.475 1.191 -14.477 742 HD3 PRO 102 HD3 PRO 102 21.000 1.191 -15.464 743 H ARG 103 H ARG 103 19.109 4.427 -11.343 744 HA ARG 103 HA ARG 103 21.576 4.662 -9.747 745 HB2 ARG 103 HB2 ARG 103 20.766 6.793 -8.909 746 HB3 ARG 103 HB3 ARG 103 20.825 6.825 -10.667 747 HG2 ARG 103 HG2 ARG 103 18.506 6.745 -10.868 748 HG3 ARG 103 HG3 ARG 103 18.292 6.164 -9.215 749 HD2 ARG 103 HD2 ARG 103 17.635 8.491 -9.371 750 HD3 ARG 103 HD3 ARG 103 19.078 8.336 -8.372 751 HE ARG 103 HE ARG 103 20.261 9.530 -9.937 752 HH11 ARG 103 HH11 ARG 103 17.188 8.580 -11.269 753 HH12 ARG 103 HH12 ARG 103 17.347 9.570 -12.682 754 HH21 ARG 103 HH21 ARG 103 20.482 10.837 -11.793 755 HH22 ARG 103 HH22 ARG 103 19.222 10.853 -12.980 756 H ARG 104 H ARG 104 20.943 5.238 -7.361 757 HA ARG 104 HA ARG 104 18.663 3.584 -6.522 758 HB2 ARG 104 HB2 ARG 104 21.533 3.284 -5.803 759 HB3 ARG 104 HB3 ARG 104 20.352 3.038 -4.524 760 HG2 ARG 104 HG2 ARG 104 20.617 0.908 -5.340 761 HG3 ARG 104 HG3 ARG 104 19.207 1.464 -6.244 762 HD2 ARG 104 HD2 ARG 104 21.138 2.277 -7.909 763 HD3 ARG 104 HD3 ARG 104 21.964 0.908 -7.165 764 HE ARG 104 HE ARG 104 19.406 0.081 -7.931 765 HH11 ARG 104 HH11 ARG 104 22.399 1.114 -9.375 766 HH12 ARG 104 HH12 ARG 104 22.169 0.192 -10.825 767 HH21 ARG 104 HH21 ARG 104 19.092 -1.138 -9.833 768 HH22 ARG 104 HH22 ARG 104 20.288 -1.088 -11.084 769 H TYR 105 H TYR 105 17.644 4.215 -4.623 770 HA TYR 105 HA TYR 105 18.501 6.821 -3.546 771 HB2 TYR 105 HB2 TYR 105 16.014 7.096 -2.998 772 HB3 TYR 105 HB3 TYR 105 16.481 7.236 -4.690 773 HD1 TYR 105 HD1 TYR 105 14.773 5.145 -2.202 774 HD2 TYR 105 HD2 TYR 105 15.790 5.583 -6.310 775 HE1 TYR 105 HE1 TYR 105 13.140 3.400 -2.787 776 HE2 TYR 105 HE2 TYR 105 14.160 3.841 -6.906 777 HH TYR 105 HH TYR 105 12.680 2.370 -6.157 778 H THR 106 H THR 106 17.235 3.635 -2.839 779 HA THR 106 HA THR 106 17.411 4.183 0.042 780 HB THR 106 HB THR 106 16.100 1.879 -1.415 781 HG1 THR 106 HG1 THR 106 14.193 2.891 -0.784 782 HG21 THR 106 HG21 THR 106 16.688 2.378 1.455 783 HG22 THR 106 HG22 THR 106 16.591 0.856 0.566 784 HG23 THR 106 HG23 THR 106 15.116 1.691 1.052 785 H ILE 107 H ILE 107 18.841 3.146 1.331 786 HA ILE 107 HA ILE 107 20.958 1.650 0.028 787 HB ILE 107 HB ILE 107 20.636 2.664 2.849 788 HG12 ILE 107 HG12 ILE 107 22.937 3.722 1.807 789 HG13 ILE 107 HG13 ILE 107 21.912 3.629 0.378 790 HG21 ILE 107 HG21 ILE 107 22.549 0.721 1.708 791 HG22 ILE 107 HG22 ILE 107 23.214 1.964 2.767 792 HG23 ILE 107 HG23 ILE 107 21.947 0.888 3.358 793 HD11 ILE 107 HD11 ILE 107 21.581 5.769 1.284 794 HD12 ILE 107 HD12 ILE 107 20.154 4.835 1.733 795 HD13 ILE 107 HD13 ILE 107 21.419 5.137 2.923 796 H ALA 108 H ALA 108 20.747 -0.466 -0.242 797 HA ALA 108 HA ALA 108 19.080 -2.020 1.577 798 HB1 ALA 108 HB1 ALA 108 18.798 -2.318 -0.841 799 HB2 ALA 108 HB2 ALA 108 20.470 -2.868 -0.962 800 HB3 ALA 108 HB3 ALA 108 19.295 -3.814 -0.048 801 H ALA 109 H ALA 109 20.016 -2.772 3.360 802 HA ALA 109 HA ALA 109 22.708 -3.943 3.133 803 HB1 ALA 109 HB1 ALA 109 21.854 -2.707 5.705 804 HB2 ALA 109 HB2 ALA 109 23.472 -2.920 5.036 805 HB3 ALA 109 HB3 ALA 109 22.414 -1.660 4.401 806 H MET 110 H MET 110 22.499 -6.068 3.369 807 HA MET 110 HA MET 110 20.480 -7.096 5.242 808 HB2 MET 110 HB2 MET 110 21.763 -8.240 2.783 809 HB3 MET 110 HB3 MET 110 21.044 -9.304 3.983 810 HG2 MET 110 HG2 MET 110 18.929 -7.958 3.737 811 HG3 MET 110 HG3 MET 110 19.687 -7.188 2.345 812 HE1 MET 110 HE1 MET 110 18.546 -10.210 4.083 813 HE2 MET 110 HE2 MET 110 17.165 -10.253 2.986 814 HE3 MET 110 HE3 MET 110 18.408 -11.502 2.889 815 H LEU 111 H LEU 111 21.149 -7.886 7.119 816 HA LEU 111 HA LEU 111 23.962 -8.231 7.646 817 HB2 LEU 111 HB2 LEU 111 21.592 -8.775 9.426 818 HB3 LEU 111 HB3 LEU 111 23.277 -8.676 9.934 819 HG LEU 111 HG LEU 111 22.474 -6.624 10.588 820 HD11 LEU 111 HD11 LEU 111 23.297 -6.083 7.739 821 HD12 LEU 111 HD12 LEU 111 24.410 -6.363 9.078 822 HD13 LEU 111 HD13 LEU 111 23.353 -4.952 9.092 823 HD21 LEU 111 HD21 LEU 111 21.018 -5.911 8.120 824 HD22 LEU 111 HD22 LEU 111 20.622 -5.589 9.808 825 HD23 LEU 111 HD23 LEU 111 20.300 -7.179 9.114 826 H SER 112 H SER 112 24.327 -9.985 6.136 827 HA SER 112 HA SER 112 23.104 -12.547 6.704 828 HB2 SER 112 HB2 SER 112 24.969 -13.213 4.927 829 HB3 SER 112 HB3 SER 112 23.472 -12.421 4.437 830 HG SER 112 HG SER 112 25.123 -11.288 3.506 831 HA PRO 113 HA PRO 113 26.148 -14.228 9.378 832 HB2 PRO 113 HB2 PRO 113 26.359 -16.784 8.489 833 HB3 PRO 113 HB3 PRO 113 24.943 -16.185 9.362 834 HG2 PRO 113 HG2 PRO 113 25.336 -16.555 6.418 835 HG3 PRO 113 HG3 PRO 113 23.925 -16.950 7.417 836 HD2 PRO 113 HD2 PRO 113 24.050 -14.718 5.891 837 HD3 PRO 113 HD3 PRO 113 23.168 -14.773 7.430 838 H TYR 114 H TYR 114 28.151 -15.900 9.181 839 HA TYR 114 HA TYR 114 30.146 -14.483 7.766 840 HB2 TYR 114 HB2 TYR 114 30.410 -15.905 9.882 841 HB3 TYR 114 HB3 TYR 114 30.451 -17.297 8.804 842 HD1 TYR 114 HD2 TYR 114 32.293 -17.484 7.118 843 HD2 TYR 114 HD1 TYR 114 32.309 -14.515 10.166 844 HE1 TYR 114 HE2 TYR 114 34.702 -17.141 6.763 845 HE2 TYR 114 HE1 TYR 114 34.719 -14.163 9.818 846 HH TYR 114 HH TYR 114 36.522 -14.765 8.680 847 H SER 115 H SER 115 29.892 -14.425 5.587 848 HA SER 115 HA SER 115 29.101 -16.628 3.998 849 HB2 SER 115 HB2 SER 115 30.691 -14.254 3.023 850 HB3 SER 115 HB3 SER 115 29.549 -15.242 2.113 851 HG SER 115 HG SER 115 28.940 -13.042 3.162 852 H TYR 116 H TYR 116 30.259 -18.111 2.851 853 HA TYR 116 HA TYR 116 33.084 -18.366 3.579 854 HB2 TYR 116 HB2 TYR 116 31.330 -20.245 3.877 855 HB3 TYR 116 HB3 TYR 116 31.475 -20.458 2.136 856 HD1 TYR 116 HD2 TYR 116 33.758 -20.064 5.077 857 HD2 TYR 116 HD1 TYR 116 32.917 -22.111 1.444 858 HE1 TYR 116 HE2 TYR 116 35.740 -21.479 5.422 859 HE2 TYR 116 HE1 TYR 116 34.895 -23.533 1.779 860 HH TYR 116 HH TYR 116 36.354 -24.279 3.515 861 H SER 117 H SER 117 32.079 -16.498 1.526 862 HA SER 117 HA SER 117 32.939 -17.624 -0.999 863 HB2 SER 117 HB2 SER 117 31.879 -14.935 -0.155 864 HB3 SER 117 HB3 SER 117 32.555 -15.188 -1.764 865 HG SER 117 HG SER 117 30.584 -15.813 -2.185 866 H THR 118 H THR 118 34.162 -15.432 1.454 867 HA THR 118 HA THR 118 36.797 -15.554 0.169 868 HB THR 118 HB THR 118 35.800 -13.378 -0.430 869 HG1 THR 118 HG1 THR 118 37.803 -12.741 -0.275 870 HG21 THR 118 HG21 THR 118 35.763 -12.887 2.551 871 HG22 THR 118 HG22 THR 118 34.344 -13.101 1.525 872 HG23 THR 118 HG23 THR 118 35.392 -11.700 1.302 873 H THR 119 H THR 119 38.466 -15.839 1.548 874 HA THR 119 HA THR 119 37.946 -15.552 4.430 875 HB THR 119 HB THR 119 39.525 -17.836 3.241 876 HG1 THR 119 HG1 THR 119 37.519 -18.981 4.116 877 HG21 THR 119 HG21 THR 119 38.607 -17.117 6.013 878 HG22 THR 119 HG22 THR 119 40.239 -17.485 5.453 879 HG23 THR 119 HG23 THR 119 39.037 -18.770 5.576 880 H ALA 120 H ALA 120 39.624 -14.802 5.662 881 HA ALA 120 HA ALA 120 41.846 -13.626 4.200 882 HB1 ALA 120 HB1 ALA 120 41.822 -12.040 5.765 883 HB2 ALA 120 HB2 ALA 120 40.325 -12.776 6.339 884 HB3 ALA 120 HB3 ALA 120 41.864 -13.220 7.076 885 H VAL 121 H VAL 121 43.263 -15.263 3.722 886 HA VAL 121 HA VAL 121 44.307 -16.848 5.969 887 HB VAL 121 HB VAL 121 43.428 -18.120 4.027 888 HG11 VAL 121 HG11 VAL 121 44.463 -18.065 1.903 889 HG12 VAL 121 HG12 VAL 121 44.178 -16.381 2.347 890 HG13 VAL 121 HG13 VAL 121 45.795 -17.072 2.494 891 HG21 VAL 121 HG21 VAL 121 44.850 -19.674 4.723 892 HG22 VAL 121 HG22 VAL 121 46.105 -18.989 3.690 893 HG23 VAL 121 HG23 VAL 121 45.927 -18.426 5.352 894 H VAL 122 H VAL 122 46.389 -16.689 6.589 895 HA VAL 122 HA VAL 122 48.454 -15.759 6.858 896 HB VAL 122 HB VAL 122 48.512 -15.854 3.839 897 HG11 VAL 122 HG11 VAL 122 50.998 -16.387 5.207 898 HG12 VAL 122 HG12 VAL 122 50.638 -15.206 3.946 899 HG13 VAL 122 HG13 VAL 122 50.358 -14.803 5.641 900 HG21 VAL 122 HG21 VAL 122 48.957 -17.953 5.930 901 HG22 VAL 122 HG22 VAL 122 47.999 -18.040 4.451 902 HG23 VAL 122 HG23 VAL 122 49.761 -18.052 4.363 903 H THR 123 H THR 123 47.312 -13.787 7.593 904 HA THR 123 HA THR 123 47.668 -11.539 5.722 905 HB THR 123 HB THR 123 46.155 -10.334 7.459 906 HG1 THR 123 HG1 THR 123 45.015 -11.607 8.791 907 HG21 THR 123 HG21 THR 123 44.199 -11.933 6.304 908 HG22 THR 123 HG22 THR 123 45.559 -12.031 5.184 909 HG23 THR 123 HG23 THR 123 44.888 -10.460 5.622 910 H ASN 124 H ASN 124 48.363 -12.749 8.940 911 HA ASN 124 HA ASN 124 50.718 -11.228 9.196 912 HB2 ASN 124 HB2 ASN 124 50.171 -9.496 10.633 913 HB3 ASN 124 HB3 ASN 124 48.755 -9.528 9.587 914 HD21 ASN 124 HD21 ASN 124 49.758 -9.378 12.705 915 HD22 ASN 124 HD22 ASN 124 48.331 -9.943 13.498 916 HA PRO 125 HA PRO 125 51.503 -14.280 12.250 917 HB2 PRO 125 HB2 PRO 125 53.309 -13.010 13.829 918 HB3 PRO 125 HB3 PRO 125 53.695 -13.595 12.207 919 HG2 PRO 125 HG2 PRO 125 52.985 -10.829 13.104 920 HG3 PRO 125 HG3 PRO 125 54.245 -11.349 11.969 921 HD2 PRO 125 HD2 PRO 125 51.867 -10.349 11.147 922 HD3 PRO 125 HD3 PRO 125 52.756 -11.578 10.225 923 H LYS 126 H LYS 126 51.790 -14.457 14.761 924 HA LYS 126 HA LYS 126 49.366 -13.947 15.980 925 HB2 LYS 126 HB2 LYS 126 50.351 -14.661 18.012 926 HB3 LYS 126 HB3 LYS 126 51.191 -15.536 16.739 927 HG2 LYS 126 HG2 LYS 126 52.253 -13.010 17.976 928 HG3 LYS 126 HG3 LYS 126 52.638 -14.625 18.575 929 HD2 LYS 126 HD2 LYS 126 53.241 -15.019 16.022 930 HD3 LYS 126 HD3 LYS 126 53.482 -13.271 16.067 931 HE2 LYS 126 HE2 LYS 126 54.802 -15.305 17.862 932 HE3 LYS 126 HE3 LYS 126 55.565 -14.446 16.525 933 HZ1 LYS 126 HZ1 LYS 126 56.174 -13.332 18.497 934 HZ2 LYS 126 HZ2 LYS 126 54.586 -13.309 19.082 935 HZ3 LYS 126 HZ3 LYS 126 55.012 -12.351 17.754 936 H GLU 127 H GLU 127 52.159 -11.886 15.686 937 HA GLU 127 HA GLU 127 51.047 -9.937 17.554 938 HB2 GLU 127 HB2 GLU 127 53.687 -10.289 16.195 939 HB3 GLU 127 HB3 GLU 127 53.226 -8.687 16.755 940 HG2 GLU 127 HG2 GLU 127 53.427 -11.166 18.450 941 HG3 GLU 127 HG3 GLU 127 54.584 -9.838 18.404 Start of MODEL 20 1 H1 GLY 1 H GLY 1 6.372 22.168 1.279 2 HA2 GLY 1 HA2 GLY 1 5.094 20.199 0.594 3 HA3 GLY 1 HA3 GLY 1 6.627 19.406 0.264 4 HA PRO 2 HA PRO 2 6.095 19.666 5.086 5 HB2 PRO 2 HB2 PRO 2 3.567 20.156 5.945 6 HB3 PRO 2 HB3 PRO 2 4.751 21.437 5.664 7 HG2 PRO 2 HG2 PRO 2 2.525 20.495 3.899 8 HG3 PRO 2 HG3 PRO 2 3.039 22.153 4.263 9 HD2 PRO 2 HD2 PRO 2 3.726 20.884 1.971 10 HD3 PRO 2 HD3 PRO 2 4.782 22.077 2.754 11 H THR 3 H THR 3 4.427 18.411 6.688 12 HA THR 3 HA THR 3 4.435 15.749 5.842 13 HB THR 3 HB THR 3 3.276 15.200 7.849 14 HG1 THR 3 HG1 THR 3 2.368 17.102 9.082 15 HG21 THR 3 HG21 THR 3 5.576 16.163 8.085 16 HG22 THR 3 HG22 THR 3 4.570 16.324 9.525 17 HG23 THR 3 HG23 THR 3 4.828 17.712 8.468 18 H GLY 4 H GLY 4 2.405 14.330 5.891 19 HA2 GLY 4 HA2 GLY 4 0.115 14.028 5.330 20 HA3 GLY 4 HA3 GLY 4 0.098 15.649 4.651 21 H THR 5 H THR 5 2.559 13.235 3.977 22 HA THR 5 HA THR 5 1.479 12.963 1.249 23 HB THR 5 HB THR 5 3.651 13.090 0.285 24 HG1 THR 5 HG1 THR 5 4.816 13.463 2.844 25 HG21 THR 5 HG21 THR 5 3.792 15.324 0.392 26 HG22 THR 5 HG22 THR 5 4.170 15.299 2.115 27 HG23 THR 5 HG23 THR 5 2.491 15.233 1.579 28 H GLY 6 H GLY 6 0.983 10.920 0.821 29 HA2 GLY 6 HA2 GLY 6 2.428 8.794 2.265 30 HA3 GLY 6 HA3 GLY 6 0.799 8.646 1.621 31 H GLU 7 H GLU 7 1.938 10.143 -0.840 32 HA GLU 7 HA GLU 7 2.801 7.699 -2.194 33 HB2 GLU 7 HB2 GLU 7 2.384 9.040 -4.278 34 HB3 GLU 7 HB3 GLU 7 0.966 8.775 -3.273 35 HG2 GLU 7 HG2 GLU 7 0.990 10.995 -2.479 36 HG3 GLU 7 HG3 GLU 7 2.604 11.284 -3.124 37 H SER 8 H SER 8 4.209 10.271 -0.703 38 HA SER 8 HA SER 8 6.667 9.934 -2.261 39 HB2 SER 8 HB2 SER 8 7.058 12.453 -1.940 40 HB3 SER 8 HB3 SER 8 5.895 11.972 -3.176 41 HG SER 8 HG SER 8 5.508 13.373 -0.856 42 H LYS 9 H LYS 9 8.596 10.710 -1.090 43 HA LYS 9 HA LYS 9 8.384 11.184 1.741 44 HB2 LYS 9 HB2 LYS 9 9.327 9.198 2.557 45 HB3 LYS 9 HB3 LYS 9 8.132 8.654 1.388 46 HG2 LYS 9 HG2 LYS 9 11.077 8.928 0.822 47 HG3 LYS 9 HG3 LYS 9 10.267 7.422 1.262 48 HD2 LYS 9 HD2 LYS 9 9.704 9.112 -1.175 49 HD3 LYS 9 HD3 LYS 9 10.551 7.563 -1.149 50 HE2 LYS 9 HE2 LYS 9 7.659 8.086 -0.485 51 HE3 LYS 9 HE3 LYS 9 8.297 7.170 -1.850 52 HZ1 LYS 9 HZ1 LYS 9 9.362 5.760 0.053 53 HZ2 LYS 9 HZ2 LYS 9 7.759 5.496 -0.418 54 HZ3 LYS 9 HZ3 LYS 9 8.093 6.400 0.972 55 H CYS 10 H CYS 10 10.848 10.733 2.634 56 HA CYS 10 HA CYS 10 12.386 12.800 1.657 57 HB2 CYS 10 HB2 CYS 10 14.315 11.635 2.817 58 HB3 CYS 10 HB3 CYS 10 12.893 11.930 3.811 59 HG CYS 10 HG CYS 10 14.289 9.030 2.885 60 HA PRO 11 HA PRO 11 14.349 11.447 -2.025 61 HB2 PRO 11 HB2 PRO 11 16.779 12.641 -1.815 62 HB3 PRO 11 HB3 PRO 11 15.293 13.538 -2.155 63 HG2 PRO 11 HG2 PRO 11 16.743 13.187 0.440 64 HG3 PRO 11 HG3 PRO 11 16.012 14.650 -0.243 65 HD2 PRO 11 HD2 PRO 11 14.793 13.168 1.668 66 HD3 PRO 11 HD3 PRO 11 13.888 14.049 0.421 67 H LEU 12 H LEU 12 16.166 11.013 0.972 68 HA LEU 12 HA LEU 12 17.309 8.549 -0.162 69 HB2 LEU 12 HB2 LEU 12 19.141 10.003 -0.068 70 HB3 LEU 12 HB3 LEU 12 18.633 10.682 1.477 71 HG LEU 12 HG LEU 12 19.125 8.315 2.406 72 HD11 LEU 12 HD11 LEU 12 20.041 8.099 -0.352 73 HD12 LEU 12 HD12 LEU 12 19.704 6.840 0.836 74 HD13 LEU 12 HD13 LEU 12 21.269 7.654 0.835 75 HD21 LEU 12 HD21 LEU 12 20.625 10.667 2.144 76 HD22 LEU 12 HD22 LEU 12 21.736 9.342 1.789 77 HD23 LEU 12 HD23 LEU 12 20.854 9.370 3.316 78 H MET 13 H MET 13 17.171 6.752 1.074 79 HA MET 13 HA MET 13 16.423 7.016 3.890 80 HB2 MET 13 HB2 MET 13 14.613 5.399 3.670 81 HB3 MET 13 HB3 MET 13 14.315 6.795 2.643 82 HG2 MET 13 HG2 MET 13 14.529 5.611 0.727 83 HG3 MET 13 HG3 MET 13 15.711 4.500 1.414 84 HE1 MET 13 HE1 MET 13 15.162 3.185 3.405 85 HE2 MET 13 HE2 MET 13 13.550 2.751 3.974 86 HE3 MET 13 HE3 MET 13 14.348 1.765 2.747 87 H VAL 14 H VAL 14 16.962 5.232 5.181 88 HA VAL 14 HA VAL 14 18.926 3.430 3.946 89 HB VAL 14 HB VAL 14 18.523 4.160 6.850 90 HG11 VAL 14 HG11 VAL 14 20.606 2.912 7.241 91 HG12 VAL 14 HG12 VAL 14 19.310 1.873 6.646 92 HG13 VAL 14 HG13 VAL 14 20.596 2.392 5.557 93 HG21 VAL 14 HG21 VAL 14 20.712 5.268 6.606 94 HG22 VAL 14 HG22 VAL 14 20.686 4.899 4.881 95 HG23 VAL 14 HG23 VAL 14 19.476 5.981 5.570 96 H LYS 15 H LYS 15 18.678 1.265 3.961 97 HA LYS 15 HA LYS 15 16.374 0.155 5.425 98 HB2 LYS 15 HB2 LYS 15 15.726 0.234 3.121 99 HB3 LYS 15 HB3 LYS 15 17.268 -0.433 2.602 100 HG2 LYS 15 HG2 LYS 15 15.582 -2.129 2.446 101 HG3 LYS 15 HG3 LYS 15 16.697 -2.546 3.751 102 HD2 LYS 15 HD2 LYS 15 14.428 -0.934 4.632 103 HD3 LYS 15 HD3 LYS 15 13.957 -2.487 3.940 104 HE2 LYS 15 HE2 LYS 15 16.035 -3.231 5.512 105 HE3 LYS 15 HE3 LYS 15 15.390 -1.876 6.436 106 HZ1 LYS 15 HZ1 LYS 15 14.187 -3.649 7.238 107 HZ2 LYS 15 HZ2 LYS 15 14.093 -4.424 5.738 108 HZ3 LYS 15 HZ3 LYS 15 13.144 -3.057 6.043 109 H VAL 16 H VAL 16 17.155 -1.105 6.979 110 HA VAL 16 HA VAL 16 19.390 -2.909 6.320 111 HB VAL 16 HB VAL 16 18.861 -1.566 8.974 112 HG11 VAL 16 HG11 VAL 16 19.680 -3.829 9.292 113 HG12 VAL 16 HG12 VAL 16 21.012 -3.525 8.174 114 HG13 VAL 16 HG13 VAL 16 20.933 -2.661 9.710 115 HG21 VAL 16 HG21 VAL 16 20.891 -0.357 8.605 116 HG22 VAL 16 HG22 VAL 16 21.227 -1.264 7.132 117 HG23 VAL 16 HG23 VAL 16 19.868 -0.141 7.185 118 H LEU 17 H LEU 17 18.819 -4.972 6.383 119 HA LEU 17 HA LEU 17 16.911 -5.872 8.415 120 HB2 LEU 17 HB2 LEU 17 15.475 -6.896 6.953 121 HB3 LEU 17 HB3 LEU 17 15.904 -5.443 6.053 122 HG LEU 17 HG LEU 17 17.763 -7.198 5.132 123 HD11 LEU 17 HD11 LEU 17 15.354 -8.901 5.012 124 HD12 LEU 17 HD12 LEU 17 16.234 -8.887 6.539 125 HD13 LEU 17 HD13 LEU 17 17.060 -9.344 5.050 126 HD21 LEU 17 HD21 LEU 17 15.904 -5.659 4.044 127 HD22 LEU 17 HD22 LEU 17 15.105 -7.213 3.807 128 HD23 LEU 17 HD23 LEU 17 16.708 -6.934 3.129 129 H ASP 18 H ASP 18 17.084 -8.087 8.970 130 HA ASP 18 HA ASP 18 19.757 -9.118 8.705 131 HB2 ASP 18 HB2 ASP 18 18.783 -11.023 10.107 132 HB3 ASP 18 HB3 ASP 18 18.797 -9.421 10.841 133 H ALA 19 H ALA 19 20.468 -10.605 7.317 134 HA ALA 19 HA ALA 19 18.678 -11.636 5.305 135 HB1 ALA 19 HB1 ALA 19 21.551 -11.321 5.629 136 HB2 ALA 19 HB2 ALA 19 21.109 -12.859 4.886 137 HB3 ALA 19 HB3 ALA 19 20.571 -11.343 4.162 138 H VAL 20 H VAL 20 19.499 -12.626 8.364 139 HA VAL 20 HA VAL 20 19.612 -15.469 7.862 140 HB VAL 20 HB VAL 20 19.236 -14.080 10.516 141 HG11 VAL 20 HG11 VAL 20 20.591 -16.273 11.120 142 HG12 VAL 20 HG12 VAL 20 18.832 -16.274 10.992 143 HG13 VAL 20 HG13 VAL 20 19.814 -16.863 9.651 144 HG21 VAL 20 HG21 VAL 20 21.234 -13.241 9.337 145 HG22 VAL 20 HG22 VAL 20 21.642 -14.162 10.786 146 HG23 VAL 20 HG23 VAL 20 21.822 -14.898 9.193 147 H ARG 21 H ARG 21 17.281 -13.179 9.247 148 HA ARG 21 HA ARG 21 15.236 -15.291 9.163 149 HB2 ARG 21 HB2 ARG 21 14.920 -12.641 10.548 150 HB3 ARG 21 HB3 ARG 21 14.048 -14.141 10.837 151 HG2 ARG 21 HG2 ARG 21 15.420 -14.404 12.570 152 HG3 ARG 21 HG3 ARG 21 16.637 -14.851 11.373 153 HD2 ARG 21 HD2 ARG 21 17.739 -12.874 11.554 154 HD3 ARG 21 HD3 ARG 21 16.267 -11.961 11.885 155 HE ARG 21 HE ARG 21 17.069 -13.724 14.017 156 HH11 ARG 21 HH11 ARG 21 17.389 -10.547 12.630 157 HH12 ARG 21 HH12 ARG 21 17.869 -9.803 14.120 158 HH21 ARG 21 HH21 ARG 21 17.699 -12.756 15.984 159 HH22 ARG 21 HH22 ARG 21 18.046 -11.060 16.026 160 H GLY 22 H GLY 22 16.089 -12.116 7.983 161 HA2 GLY 22 HA2 GLY 22 15.317 -11.248 5.925 162 HA3 GLY 22 HA3 GLY 22 13.925 -12.316 6.023 163 H SER 23 H SER 23 14.659 -10.637 8.901 164 HA SER 23 HA SER 23 12.394 -8.825 8.400 165 HB2 SER 23 HB2 SER 23 13.004 -8.855 11.160 166 HB3 SER 23 HB3 SER 23 11.608 -9.576 10.359 167 HG SER 23 HG SER 23 12.427 -11.436 10.844 168 HA PRO 24 HA PRO 24 14.850 -5.219 8.847 169 HB2 PRO 24 HB2 PRO 24 13.281 -3.600 10.359 170 HB3 PRO 24 HB3 PRO 24 12.919 -3.985 8.673 171 HG2 PRO 24 HG2 PRO 24 11.780 -5.173 11.174 172 HG3 PRO 24 HG3 PRO 24 10.948 -4.695 9.682 173 HD2 PRO 24 HD2 PRO 24 11.583 -7.268 10.235 174 HD3 PRO 24 HD3 PRO 24 11.546 -6.628 8.580 175 H ALA 25 H ALA 25 16.365 -4.265 10.155 176 HA ALA 25 HA ALA 25 16.709 -5.455 12.796 177 HB1 ALA 25 HB1 ALA 25 18.953 -4.919 12.651 178 HB2 ALA 25 HB2 ALA 25 18.533 -5.236 10.966 179 HB3 ALA 25 HB3 ALA 25 18.668 -3.575 11.545 180 H ILE 26 H ILE 26 16.567 -4.367 14.681 181 HA ILE 26 HA ILE 26 15.731 -1.553 14.530 182 HB ILE 26 HB ILE 26 15.032 -3.793 16.343 183 HG12 ILE 26 HG12 ILE 26 13.628 -2.583 14.485 184 HG13 ILE 26 HG13 ILE 26 12.860 -3.069 15.993 185 HG21 ILE 26 HG21 ILE 26 15.357 -0.952 17.266 186 HG22 ILE 26 HG22 ILE 26 14.272 -2.090 18.064 187 HG23 ILE 26 HG23 ILE 26 16.003 -2.422 17.994 188 HD11 ILE 26 HD11 ILE 26 12.205 -0.821 15.295 189 HD12 ILE 26 HD12 ILE 26 13.052 -0.810 16.842 190 HD13 ILE 26 HD13 ILE 26 13.891 -0.311 15.374 191 H ASN 27 H ASN 27 16.781 0.024 15.645 192 HA ASN 27 HA ASN 27 18.452 1.090 16.760 193 HB2 ASN 27 HB2 ASN 27 18.819 -1.518 18.248 194 HB3 ASN 27 HB3 ASN 27 19.328 0.084 18.778 195 HD21 ASN 27 HD21 ASN 27 17.009 1.488 17.998 196 HD22 ASN 27 HD22 ASN 27 15.723 1.014 19.050 197 H VAL 28 H VAL 28 19.308 0.552 14.411 198 HA VAL 28 HA VAL 28 21.909 -0.806 14.711 199 HB VAL 28 HB VAL 28 20.223 -0.467 12.229 200 HG11 VAL 28 HG11 VAL 28 23.066 -0.834 12.532 201 HG12 VAL 28 HG12 VAL 28 22.338 -2.206 11.695 202 HG13 VAL 28 HG13 VAL 28 22.118 -0.572 11.068 203 HG21 VAL 28 HG21 VAL 28 20.749 -2.697 14.111 204 HG22 VAL 28 HG22 VAL 28 19.287 -2.297 13.208 205 HG23 VAL 28 HG23 VAL 28 20.637 -3.089 12.394 206 H ALA 29 H ALA 29 23.461 0.659 14.975 207 HA ALA 29 HA ALA 29 23.322 3.366 14.343 208 HB1 ALA 29 HB1 ALA 29 25.553 1.492 14.967 209 HB2 ALA 29 HB2 ALA 29 25.932 3.116 14.391 210 HB3 ALA 29 HB3 ALA 29 24.979 2.901 15.860 211 H VAL 30 H VAL 30 23.478 4.467 12.502 212 HA VAL 30 HA VAL 30 24.922 3.289 10.237 213 HB VAL 30 HB VAL 30 22.171 4.515 9.998 214 HG11 VAL 30 HG11 VAL 30 23.147 5.015 7.982 215 HG12 VAL 30 HG12 VAL 30 24.210 3.608 8.023 216 HG13 VAL 30 HG13 VAL 30 22.500 3.410 7.642 217 HG21 VAL 30 HG21 VAL 30 21.491 2.480 10.651 218 HG22 VAL 30 HG22 VAL 30 21.983 1.968 9.037 219 HG23 VAL 30 HG23 VAL 30 23.082 1.760 10.401 220 H HIS 31 H HIS 31 26.222 4.700 9.250 221 HA HIS 31 HA HIS 31 25.726 7.576 9.651 222 HB2 HIS 31 HB2 HIS 31 28.471 6.330 9.512 223 HB3 HIS 31 HB3 HIS 31 28.061 7.982 9.959 224 HD1 HIS 31 HD1 HIS 31 27.786 4.451 11.282 225 HD2 HIS 31 HD2 HIS 31 27.581 8.377 12.627 226 HE1 HIS 31 HE1 HIS 31 27.691 4.298 13.790 227 H VAL 32 H VAL 32 25.375 8.578 7.793 228 HA VAL 32 HA VAL 32 26.319 7.364 5.303 229 HB VAL 32 HB VAL 32 24.496 9.751 5.549 230 HG11 VAL 32 HG11 VAL 32 23.712 8.551 3.327 231 HG12 VAL 32 HG12 VAL 32 25.080 9.665 3.343 232 HG13 VAL 32 HG13 VAL 32 25.359 7.923 3.370 233 HG21 VAL 32 HG21 VAL 32 23.832 6.820 5.667 234 HG22 VAL 32 HG22 VAL 32 23.366 8.096 6.793 235 HG23 VAL 32 HG23 VAL 32 22.653 8.040 5.180 236 H PHE 33 H PHE 33 27.759 8.307 3.953 237 HA PHE 33 HA PHE 33 28.752 10.986 4.649 238 HB2 PHE 33 HB2 PHE 33 30.341 8.473 4.198 239 HB3 PHE 33 HB3 PHE 33 31.054 10.060 3.925 240 HD1 PHE 33 HD1 PHE 33 29.237 8.100 6.515 241 HD2 PHE 33 HD2 PHE 33 32.062 11.172 5.678 242 HE1 PHE 33 HE1 PHE 33 29.753 8.273 8.914 243 HE2 PHE 33 HE2 PHE 33 32.583 11.349 8.076 244 HZ PHE 33 HZ PHE 33 31.429 9.899 9.698 245 H ARG 34 H ARG 34 30.055 11.962 2.857 246 HA ARG 34 HA ARG 34 29.138 11.040 0.217 247 HB2 ARG 34 HB2 ARG 34 27.764 12.950 0.949 248 HB3 ARG 34 HB3 ARG 34 29.222 13.908 1.169 249 HG2 ARG 34 HG2 ARG 34 28.952 12.730 -1.495 250 HG3 ARG 34 HG3 ARG 34 27.688 13.887 -1.072 251 HD2 ARG 34 HD2 ARG 34 29.565 15.437 -0.343 252 HD3 ARG 34 HD3 ARG 34 30.661 14.322 -1.158 253 HE ARG 34 HE ARG 34 29.000 16.270 -2.384 254 HH11 ARG 34 HH11 ARG 34 30.297 13.069 -2.821 255 HH12 ARG 34 HH12 ARG 34 30.243 13.143 -4.551 256 HH21 ARG 34 HH21 ARG 34 28.923 16.379 -4.661 257 HH22 ARG 34 HH22 ARG 34 29.462 15.025 -5.597 258 H LYS 35 H LYS 35 30.498 11.571 -1.549 259 HA LYS 35 HA LYS 35 33.272 11.471 -0.940 260 HB2 LYS 35 HB2 LYS 35 32.720 10.369 -2.914 261 HB3 LYS 35 HB3 LYS 35 31.664 11.665 -3.460 262 HG2 LYS 35 HG2 LYS 35 33.655 11.582 -4.820 263 HG3 LYS 35 HG3 LYS 35 33.630 13.074 -3.877 264 HD2 LYS 35 HD2 LYS 35 35.849 12.205 -3.783 265 HD3 LYS 35 HD3 LYS 35 35.109 11.933 -2.204 266 HE2 LYS 35 HE2 LYS 35 35.809 9.820 -2.439 267 HE3 LYS 35 HE3 LYS 35 34.461 9.643 -3.559 268 HZ1 LYS 35 HZ1 LYS 35 36.536 10.747 -5.013 269 HZ2 LYS 35 HZ2 LYS 35 35.942 9.168 -5.117 270 HZ3 LYS 35 HZ3 LYS 35 37.237 9.518 -4.087 271 H ALA 36 H ALA 36 34.300 13.179 -0.118 272 HA ALA 36 HA ALA 36 33.521 15.874 -0.594 273 HB1 ALA 36 HB1 ALA 36 35.014 16.428 1.014 274 HB2 ALA 36 HB2 ALA 36 34.916 14.701 1.363 275 HB3 ALA 36 HB3 ALA 36 36.252 15.330 0.399 276 H ALA 37 H ALA 37 34.841 17.535 -1.580 277 HA ALA 37 HA ALA 37 35.644 16.912 -4.192 278 HB1 ALA 37 HB1 ALA 37 36.603 19.361 -2.756 279 HB2 ALA 37 HB2 ALA 37 36.145 19.170 -4.449 280 HB3 ALA 37 HB3 ALA 37 34.906 19.165 -3.195 281 H ASP 38 H ASP 38 37.330 16.684 -1.223 282 HA ASP 38 HA ASP 38 39.948 16.688 -2.519 283 HB2 ASP 38 HB2 ASP 38 38.975 16.922 0.277 284 HB3 ASP 38 HB3 ASP 38 40.534 16.134 0.044 285 H ASP 39 H ASP 39 37.727 14.561 -2.672 286 HA ASP 39 HA ASP 39 37.635 12.303 -2.936 287 HB2 ASP 39 HB2 ASP 39 40.586 12.079 -2.450 288 HB3 ASP 39 HB3 ASP 39 39.570 11.166 -3.561 289 H THR 40 H THR 40 37.166 13.370 -0.384 290 HA THR 40 HA THR 40 38.148 11.185 1.335 291 HB THR 40 HB THR 40 38.237 12.608 3.219 292 HG1 THR 40 HG1 THR 40 36.916 14.246 3.379 293 HG21 THR 40 HG21 THR 40 39.756 14.424 2.531 294 HG22 THR 40 HG22 THR 40 39.294 14.156 0.849 295 HG23 THR 40 HG23 THR 40 40.148 12.897 1.742 296 H TRP 41 H TRP 41 36.625 11.217 3.441 297 HA TRP 41 HA TRP 41 33.896 10.909 2.391 298 HB2 TRP 41 HB2 TRP 41 35.379 9.556 4.637 299 HB3 TRP 41 HB3 TRP 41 33.622 9.487 4.520 300 HD1 TRP 41 HD1 TRP 41 35.768 9.302 1.361 301 HE1 TRP 41 HE1 TRP 41 35.524 6.955 0.335 302 HE3 TRP 41 HE3 TRP 41 33.115 7.051 5.107 303 HZ2 TRP 41 HZ2 TRP 41 34.360 4.476 1.022 304 HZ3 TRP 41 HZ3 TRP 41 32.475 4.690 4.844 305 HH2 TRP 41 HH2 TRP 41 33.085 3.431 2.843 306 H GLU 42 H GLU 42 32.741 12.693 2.782 307 HA GLU 42 HA GLU 42 33.115 14.137 5.296 308 HB2 GLU 42 HB2 GLU 42 31.760 14.797 2.695 309 HB3 GLU 42 HB3 GLU 42 31.435 15.737 4.145 310 HG2 GLU 42 HG2 GLU 42 34.274 15.311 3.468 311 HG3 GLU 42 HG3 GLU 42 33.350 16.350 2.385 312 HA PRO 43 HA PRO 43 29.484 12.580 7.209 313 HB2 PRO 43 HB2 PRO 43 28.716 14.733 8.673 314 HB3 PRO 43 HB3 PRO 43 30.124 13.746 9.082 315 HG2 PRO 43 HG2 PRO 43 30.003 16.371 7.649 316 HG3 PRO 43 HG3 PRO 43 31.130 15.835 8.909 317 HD2 PRO 43 HD2 PRO 43 31.780 15.845 6.281 318 HD3 PRO 43 HD3 PRO 43 32.426 14.646 7.420 319 H PHE 44 H PHE 44 27.697 12.192 6.058 320 HA PHE 44 HA PHE 44 26.270 14.454 4.841 321 HB2 PHE 44 HB2 PHE 44 26.986 12.615 3.329 322 HB3 PHE 44 HB3 PHE 44 25.985 11.499 4.254 323 HD1 PHE 44 HD2 PHE 44 23.493 11.908 4.336 324 HD2 PHE 44 HD1 PHE 44 26.079 13.895 1.600 325 HE1 PHE 44 HE2 PHE 44 21.560 12.463 2.917 326 HE2 PHE 44 HE1 PHE 44 24.151 14.454 0.179 327 HZ PHE 44 HZ PHE 44 21.887 13.739 0.836 328 H ALA 45 H ALA 45 25.856 11.636 6.915 329 HA ALA 45 HA ALA 45 23.769 12.834 8.397 330 HB1 ALA 45 HB1 ALA 45 22.813 10.542 6.704 331 HB2 ALA 45 HB2 ALA 45 21.863 11.621 7.726 332 HB3 ALA 45 HB3 ALA 45 22.589 12.229 6.239 333 H SER 46 H SER 46 22.625 11.045 9.789 334 HA SER 46 HA SER 46 23.982 8.601 10.234 335 HB2 SER 46 HB2 SER 46 25.794 9.563 11.260 336 HB3 SER 46 HB3 SER 46 24.891 10.994 11.756 337 HG SER 46 HG SER 46 24.319 10.025 13.555 338 H GLY 47 H GLY 47 23.145 7.433 12.103 339 HA2 GLY 47 HA2 GLY 47 21.340 8.192 13.974 340 HA3 GLY 47 HA3 GLY 47 20.356 8.058 12.524 341 H LYS 48 H LYS 48 19.172 6.373 13.558 342 HA LYS 48 HA LYS 48 20.540 3.781 13.372 343 HB2 LYS 48 HB2 LYS 48 19.171 4.956 15.713 344 HB3 LYS 48 HB3 LYS 48 18.758 3.284 15.357 345 HG2 LYS 48 HG2 LYS 48 21.138 2.694 15.428 346 HG3 LYS 48 HG3 LYS 48 21.529 4.368 15.826 347 HD2 LYS 48 HD2 LYS 48 19.730 2.597 17.478 348 HD3 LYS 48 HD3 LYS 48 21.446 2.856 17.802 349 HE2 LYS 48 HE2 LYS 48 20.462 5.414 17.557 350 HE3 LYS 48 HE3 LYS 48 19.149 4.563 18.368 351 HZ1 LYS 48 HZ1 LYS 48 20.870 5.590 19.852 352 HZ2 LYS 48 HZ2 LYS 48 21.960 4.423 19.293 353 HZ3 LYS 48 HZ3 LYS 48 20.568 3.948 20.127 354 H THR 49 H THR 49 19.391 2.190 12.402 355 HA THR 49 HA THR 49 17.159 2.842 10.829 356 HB THR 49 HB THR 49 17.050 0.524 10.216 357 HG1 THR 49 HG1 THR 49 17.982 -1.078 11.432 358 HG21 THR 49 HG21 THR 49 18.922 0.811 9.043 359 HG22 THR 49 HG22 THR 49 19.872 0.310 10.441 360 HG23 THR 49 HG23 THR 49 19.477 2.013 10.206 361 H SER 50 H SER 50 15.095 1.467 10.891 362 HA SER 50 HA SER 50 14.129 1.236 13.663 363 HB2 SER 50 HB2 SER 50 12.702 2.466 11.297 364 HB3 SER 50 HB3 SER 50 11.912 2.074 12.824 365 HG SER 50 HG SER 50 12.646 3.885 13.560 366 H GLU 51 H GLU 51 11.889 0.062 13.625 367 HA GLU 51 HA GLU 51 12.363 -2.550 12.617 368 HB2 GLU 51 HB2 GLU 51 9.995 -2.966 13.430 369 HB3 GLU 51 HB3 GLU 51 11.143 -2.406 14.638 370 HG2 GLU 51 HG2 GLU 51 9.864 -0.671 15.117 371 HG3 GLU 51 HG3 GLU 51 9.867 -0.154 13.432 372 H SER 52 H SER 52 11.229 0.199 11.119 373 HA SER 52 HA SER 52 9.521 -1.269 9.240 374 HB2 SER 52 HB2 SER 52 8.601 0.815 10.166 375 HB3 SER 52 HB3 SER 52 9.981 1.711 9.533 376 HG SER 52 HG SER 52 8.042 1.744 8.200 377 H GLY 53 H GLY 53 12.692 -0.652 9.571 378 HA2 GLY 53 HA2 GLY 53 14.455 -0.813 8.103 379 HA3 GLY 53 HA3 GLY 53 13.289 -1.210 6.849 380 H GLU 54 H GLU 54 12.794 1.728 8.565 381 HA GLU 54 HA GLU 54 14.055 3.261 6.394 382 HB2 GLU 54 HB2 GLU 54 12.082 4.833 6.536 383 HB3 GLU 54 HB3 GLU 54 11.752 3.264 5.814 384 HG2 GLU 54 HG2 GLU 54 10.666 2.496 7.782 385 HG3 GLU 54 HG3 GLU 54 11.192 3.908 8.695 386 H LEU 55 H LEU 55 14.956 5.213 6.964 387 HA LEU 55 HA LEU 55 14.963 5.832 9.845 388 HB2 LEU 55 HB2 LEU 55 17.108 5.166 8.178 389 HB3 LEU 55 HB3 LEU 55 17.231 6.906 8.430 390 HG LEU 55 HG LEU 55 17.124 4.830 10.619 391 HD11 LEU 55 HD11 LEU 55 19.392 6.295 9.311 392 HD12 LEU 55 HD12 LEU 55 19.216 4.566 9.611 393 HD13 LEU 55 HD13 LEU 55 19.514 5.668 10.955 394 HD21 LEU 55 HD21 LEU 55 18.034 6.960 11.860 395 HD22 LEU 55 HD22 LEU 55 16.302 6.701 11.654 396 HD23 LEU 55 HD23 LEU 55 17.162 7.808 10.583 397 H HIS 56 H HIS 56 15.000 8.017 10.466 398 HA HIS 56 HA HIS 56 14.356 9.941 8.332 399 HB2 HIS 56 HB2 HIS 56 12.813 11.038 10.009 400 HB3 HIS 56 HB3 HIS 56 12.274 9.477 9.398 401 HD1 HIS 56 HD1 HIS 56 12.895 11.287 12.480 402 HD2 HIS 56 HD2 HIS 56 12.786 7.302 11.309 403 HE1 HIS 56 HE1 HIS 56 12.670 9.966 14.608 404 H GLY 57 H GLY 57 14.820 12.181 8.851 405 HA2 GLY 57 HA2 GLY 57 15.896 13.868 10.108 406 HA3 GLY 57 HA3 GLY 57 16.623 12.623 11.113 407 H LEU 58 H LEU 58 17.550 11.039 8.851 408 HA LEU 58 HA LEU 58 20.105 12.146 8.539 409 HB2 LEU 58 HB2 LEU 58 18.608 9.904 7.281 410 HB3 LEU 58 HB3 LEU 58 20.110 10.435 6.527 411 HG LEU 58 HG LEU 58 21.204 10.061 8.790 412 HD11 LEU 58 HD11 LEU 58 20.108 8.602 10.346 413 HD12 LEU 58 HD12 LEU 58 18.701 8.462 9.293 414 HD13 LEU 58 HD13 LEU 58 19.076 10.004 10.062 415 HD21 LEU 58 HD21 LEU 58 20.082 7.534 7.632 416 HD22 LEU 58 HD22 LEU 58 21.695 7.842 8.275 417 HD23 LEU 58 HD23 LEU 58 21.217 8.532 6.723 418 H THR 59 H THR 59 17.180 12.652 6.790 419 HA THR 59 HA THR 59 18.034 13.394 4.277 420 HB THR 59 HB THR 59 16.064 14.797 4.106 421 HG1 THR 59 HG1 THR 59 14.967 15.498 5.873 422 HG21 THR 59 HG21 THR 59 14.415 13.170 4.494 423 HG22 THR 59 HG22 THR 59 15.269 12.512 5.890 424 HG23 THR 59 HG23 THR 59 15.897 12.245 4.264 425 H THR 60 H THR 60 18.847 15.231 3.339 426 HA THR 60 HA THR 60 19.339 17.600 4.940 427 HB THR 60 HB THR 60 21.782 17.619 4.309 428 HG1 THR 60 HG1 THR 60 21.431 15.811 2.745 429 HG21 THR 60 HG21 THR 60 22.439 16.490 6.243 430 HG22 THR 60 HG22 THR 60 21.187 15.262 6.066 431 HG23 THR 60 HG23 THR 60 20.755 16.897 6.566 432 H GLU 61 H GLU 61 20.329 19.359 3.623 433 HA GLU 61 HA GLU 61 19.041 19.460 1.053 434 HB2 GLU 61 HB2 GLU 61 19.993 21.775 0.975 435 HB3 GLU 61 HB3 GLU 61 18.988 21.451 2.379 436 HG2 GLU 61 HG2 GLU 61 20.912 21.215 3.782 437 HG3 GLU 61 HG3 GLU 61 21.992 21.319 2.394 438 H GLU 62 H GLU 62 22.078 18.484 2.174 439 HA GLU 62 HA GLU 62 23.591 19.211 -0.162 440 HB2 GLU 62 HB2 GLU 62 25.343 17.738 0.853 441 HB3 GLU 62 HB3 GLU 62 24.789 19.035 1.902 442 HG2 GLU 62 HG2 GLU 62 23.560 17.569 3.256 443 HG3 GLU 62 HG3 GLU 62 23.649 16.268 2.070 444 H GLU 63 H GLU 63 21.207 17.021 0.290 445 HA GLU 63 HA GLU 63 22.234 14.676 -0.907 446 HB2 GLU 63 HB2 GLU 63 19.969 13.944 -1.077 447 HB3 GLU 63 HB3 GLU 63 20.112 14.842 0.427 448 HG2 GLU 63 HG2 GLU 63 18.153 15.680 -0.384 449 HG3 GLU 63 HG3 GLU 63 19.299 16.847 -1.040 450 H PHE 64 H PHE 64 21.527 17.722 -2.190 451 HA PHE 64 HA PHE 64 20.866 16.802 -4.852 452 HB2 PHE 64 HB2 PHE 64 21.223 19.487 -3.564 453 HB3 PHE 64 HB3 PHE 64 21.215 19.351 -5.319 454 HD1 PHE 64 HD1 PHE 64 19.199 18.020 -6.327 455 HD2 PHE 64 HD2 PHE 64 19.231 19.796 -2.458 456 HE1 PHE 64 HE1 PHE 64 16.739 18.041 -6.319 457 HE2 PHE 64 HE2 PHE 64 16.772 19.817 -2.444 458 HZ PHE 64 HZ PHE 64 15.522 18.938 -4.375 459 H VAL 65 H VAL 65 23.116 15.557 -4.387 460 HA VAL 65 HA VAL 65 25.226 17.153 -5.688 461 HB VAL 65 HB VAL 65 26.839 15.528 -4.704 462 HG11 VAL 65 HG11 VAL 65 25.124 17.298 -3.016 463 HG12 VAL 65 HG12 VAL 65 26.415 16.354 -2.271 464 HG13 VAL 65 HG13 VAL 65 26.793 17.520 -3.539 465 HG21 VAL 65 HG21 VAL 65 24.662 14.651 -2.847 466 HG22 VAL 65 HG22 VAL 65 24.943 13.798 -4.364 467 HG23 VAL 65 HG23 VAL 65 26.228 13.904 -3.161 468 H GLU 66 H GLU 66 26.924 15.382 -6.628 469 HA GLU 66 HA GLU 66 25.889 14.468 -9.000 470 HB2 GLU 66 HB2 GLU 66 28.221 13.326 -7.453 471 HB3 GLU 66 HB3 GLU 66 27.887 13.004 -9.150 472 HG2 GLU 66 HG2 GLU 66 28.163 15.826 -8.246 473 HG3 GLU 66 HG3 GLU 66 29.611 14.838 -8.433 474 H GLY 67 H GLY 67 26.187 12.706 -5.944 475 HA2 GLY 67 HA2 GLY 67 24.129 11.206 -5.662 476 HA3 GLY 67 HA3 GLY 67 24.698 10.467 -7.152 477 H ILE 68 H ILE 68 27.411 11.361 -5.568 478 HA ILE 68 HA ILE 68 28.064 8.679 -4.845 479 HB ILE 68 HB ILE 68 29.612 11.163 -4.117 480 HG12 ILE 68 HG12 ILE 68 29.867 9.501 -6.632 481 HG13 ILE 68 HG13 ILE 68 29.057 11.063 -6.555 482 HG21 ILE 68 HG21 ILE 68 30.772 9.567 -3.027 483 HG22 ILE 68 HG22 ILE 68 30.112 8.263 -4.014 484 HG23 ILE 68 HG23 ILE 68 31.439 9.250 -4.628 485 HD11 ILE 68 HD11 ILE 68 31.802 11.012 -5.513 486 HD12 ILE 68 HD12 ILE 68 31.632 10.727 -7.246 487 HD13 ILE 68 HD13 ILE 68 30.988 12.202 -6.527 488 H TYR 69 H TYR 69 27.395 7.710 -3.056 489 HA TYR 69 HA TYR 69 27.486 9.177 -0.526 490 HB2 TYR 69 HB2 TYR 69 25.119 7.469 -1.306 491 HB3 TYR 69 HB3 TYR 69 25.301 8.431 0.156 492 HD1 TYR 69 HD2 TYR 69 25.833 11.024 -0.380 493 HD2 TYR 69 HD1 TYR 69 23.758 8.338 -2.946 494 HE1 TYR 69 HE2 TYR 69 24.755 12.932 -1.496 495 HE2 TYR 69 HE1 TYR 69 22.675 10.239 -4.070 496 HH TYR 69 HH TYR 69 22.824 13.437 -2.826 497 H LYS 70 H LYS 70 28.249 8.003 1.139 498 HA LYS 70 HA LYS 70 28.530 5.095 0.757 499 HB2 LYS 70 HB2 LYS 70 30.687 5.343 2.091 500 HB3 LYS 70 HB3 LYS 70 30.714 5.923 0.431 501 HG2 LYS 70 HG2 LYS 70 29.920 8.098 2.032 502 HG3 LYS 70 HG3 LYS 70 31.289 7.333 2.844 503 HD2 LYS 70 HD2 LYS 70 32.155 8.985 1.351 504 HD3 LYS 70 HD3 LYS 70 32.514 7.400 0.664 505 HE2 LYS 70 HE2 LYS 70 29.955 8.600 -0.165 506 HE3 LYS 70 HE3 LYS 70 31.402 9.441 -0.717 507 HZ1 LYS 70 HZ1 LYS 70 30.262 7.164 -1.801 508 HZ2 LYS 70 HZ2 LYS 70 31.705 6.657 -1.080 509 HZ3 LYS 70 HZ3 LYS 70 31.726 7.887 -2.241 510 H VAL 71 H VAL 71 27.049 4.288 2.123 511 HA VAL 71 HA VAL 71 26.706 5.470 4.769 512 HB VAL 71 HB VAL 71 25.185 3.254 3.390 513 HG11 VAL 71 HG11 VAL 71 25.146 2.905 5.781 514 HG12 VAL 71 HG12 VAL 71 24.697 4.590 6.050 515 HG13 VAL 71 HG13 VAL 71 23.573 3.495 5.244 516 HG21 VAL 71 HG21 VAL 71 24.761 5.376 2.352 517 HG22 VAL 71 HG22 VAL 71 23.361 4.947 3.337 518 HG23 VAL 71 HG23 VAL 71 24.517 6.146 3.921 519 H GLU 72 H GLU 72 27.240 4.487 6.660 520 HA GLU 72 HA GLU 72 28.570 1.863 6.472 521 HB2 GLU 72 HB2 GLU 72 30.408 3.104 6.981 522 HB3 GLU 72 HB3 GLU 72 29.464 4.403 7.698 523 HG2 GLU 72 HG2 GLU 72 29.376 3.377 9.766 524 HG3 GLU 72 HG3 GLU 72 29.709 1.779 9.100 525 H ILE 73 H ILE 73 28.081 0.357 7.998 526 HA ILE 73 HA ILE 73 26.112 1.140 10.048 527 HB ILE 73 HB ILE 73 26.284 -1.527 8.641 528 HG12 ILE 73 HG12 ILE 73 23.820 -0.032 8.293 529 HG13 ILE 73 HG13 ILE 73 25.207 0.873 7.695 530 HG21 ILE 73 HG21 ILE 73 25.472 -1.585 10.986 531 HG22 ILE 73 HG22 ILE 73 24.180 -0.479 10.526 532 HG23 ILE 73 HG23 ILE 73 24.259 -2.088 9.809 533 HD11 ILE 73 HD11 ILE 73 23.804 -1.110 6.366 534 HD12 ILE 73 HD12 ILE 73 25.348 -0.403 5.891 535 HD13 ILE 73 HD13 ILE 73 25.313 -1.881 6.851 536 H ASP 74 H ASP 74 26.424 0.447 12.105 537 HA ASP 74 HA ASP 74 28.932 -0.992 12.633 538 HB2 ASP 74 HB2 ASP 74 27.977 1.384 13.685 539 HB3 ASP 74 HB3 ASP 74 27.616 0.210 14.947 540 H THR 75 H THR 75 28.069 -3.078 12.295 541 HA THR 75 HA THR 75 26.033 -3.947 14.231 542 HB THR 75 HB THR 75 25.349 -5.585 12.783 543 HG1 THR 75 HG1 THR 75 26.798 -6.884 11.972 544 HG21 THR 75 HG21 THR 75 26.619 -3.631 10.861 545 HG22 THR 75 HG22 THR 75 25.061 -3.411 11.659 546 HG23 THR 75 HG23 THR 75 25.284 -4.728 10.507 547 H LYS 76 H LYS 76 29.054 -3.560 14.555 548 HA LYS 76 HA LYS 76 29.983 -6.251 15.096 549 HB2 LYS 76 HB2 LYS 76 32.053 -5.107 15.862 550 HB3 LYS 76 HB3 LYS 76 31.592 -4.683 14.218 551 HG2 LYS 76 HG2 LYS 76 31.972 -2.589 14.914 552 HG3 LYS 76 HG3 LYS 76 30.351 -2.722 15.600 553 HD2 LYS 76 HD2 LYS 76 31.443 -2.054 17.475 554 HD3 LYS 76 HD3 LYS 76 31.750 -3.787 17.614 555 HE2 LYS 76 HE2 LYS 76 33.872 -2.981 17.893 556 HE3 LYS 76 HE3 LYS 76 33.850 -3.189 16.142 557 HZ1 LYS 76 HZ1 LYS 76 32.864 -0.628 16.913 558 HZ2 LYS 76 HZ2 LYS 76 34.116 -1.019 15.844 559 HZ3 LYS 76 HZ3 LYS 76 34.430 -0.884 17.502 560 H SER 77 H SER 77 29.181 -3.335 16.954 561 HA SER 77 HA SER 77 29.468 -4.798 19.456 562 HB2 SER 77 HB2 SER 77 29.148 -1.926 18.701 563 HB3 SER 77 HB3 SER 77 28.640 -2.426 20.313 564 HG SER 77 HG SER 77 30.684 -2.990 20.801 565 H TYR 78 H TYR 78 26.945 -3.008 17.701 566 HA TYR 78 HA TYR 78 24.829 -3.365 19.429 567 HB2 TYR 78 HB2 TYR 78 24.923 -3.231 16.420 568 HB3 TYR 78 HB3 TYR 78 23.402 -3.335 17.300 569 HD1 TYR 78 HD1 TYR 78 26.445 -1.262 16.862 570 HD2 TYR 78 HD2 TYR 78 22.438 -1.422 18.281 571 HE1 TYR 78 HE1 TYR 78 26.465 1.178 17.173 572 HE2 TYR 78 HE2 TYR 78 22.446 1.019 18.594 573 HH TYR 78 HH TYR 78 25.356 2.902 18.278 574 H TRP 79 H TRP 79 26.379 -5.689 17.380 575 HA TRP 79 HA TRP 79 24.280 -7.614 17.353 576 HB2 TRP 79 HB2 TRP 79 27.021 -7.421 16.390 577 HB3 TRP 79 HB3 TRP 79 26.658 -9.022 17.030 578 HD1 TRP 79 HD1 TRP 79 26.546 -10.278 14.733 579 HE1 TRP 79 HE1 TRP 79 24.925 -10.189 12.736 580 HE3 TRP 79 HE3 TRP 79 23.986 -6.025 15.956 581 HZ2 TRP 79 HZ2 TRP 79 22.837 -8.534 11.803 582 HZ3 TRP 79 HZ3 TRP 79 22.191 -5.257 14.458 583 HH2 TRP 79 HH2 TRP 79 21.631 -6.486 12.424 584 H LYS 80 H LYS 80 27.072 -7.040 19.429 585 HA LYS 80 HA LYS 80 26.840 -9.421 20.947 586 HB2 LYS 80 HB2 LYS 80 28.522 -8.558 22.301 587 HB3 LYS 80 HB3 LYS 80 28.818 -7.749 20.767 588 HG2 LYS 80 HG2 LYS 80 28.837 -5.858 21.933 589 HG3 LYS 80 HG3 LYS 80 27.085 -6.040 22.054 590 HD2 LYS 80 HD2 LYS 80 27.974 -5.671 24.256 591 HD3 LYS 80 HD3 LYS 80 27.424 -7.345 24.145 592 HE2 LYS 80 HE2 LYS 80 29.565 -8.190 24.156 593 HE3 LYS 80 HE3 LYS 80 30.268 -6.706 23.514 594 HZ1 LYS 80 HZ1 LYS 80 30.899 -6.883 25.777 595 HZ2 LYS 80 HZ2 LYS 80 29.314 -7.193 26.279 596 HZ3 LYS 80 HZ3 LYS 80 29.732 -5.661 25.695 597 H ALA 81 H ALA 81 25.023 -6.540 20.892 598 HA ALA 81 HA ALA 81 24.141 -6.578 23.616 599 HB1 ALA 81 HB1 ALA 81 23.444 -4.546 23.074 600 HB2 ALA 81 HB2 ALA 81 23.884 -4.843 21.392 601 HB3 ALA 81 HB3 ALA 81 22.261 -5.234 21.961 602 H LEU 82 H LEU 82 22.791 -7.684 20.530 603 HA LEU 82 HA LEU 82 20.508 -8.862 21.916 604 HB2 LEU 82 HB2 LEU 82 21.163 -8.729 18.976 605 HB3 LEU 82 HB3 LEU 82 19.666 -9.353 19.666 606 HG LEU 82 HG LEU 82 19.079 -7.233 18.932 607 HD11 LEU 82 HD11 LEU 82 19.930 -6.599 21.741 608 HD12 LEU 82 HD12 LEU 82 18.606 -7.705 21.383 609 HD13 LEU 82 HD13 LEU 82 18.513 -6.023 20.863 610 HD21 LEU 82 HD21 LEU 82 20.409 -5.302 18.984 611 HD22 LEU 82 HD22 LEU 82 21.518 -6.599 18.537 612 HD23 LEU 82 HD23 LEU 82 21.502 -5.980 20.190 613 H GLY 83 H GLY 83 23.455 -9.820 21.855 614 HA2 GLY 83 HA2 GLY 83 24.546 -11.838 21.898 615 HA3 GLY 83 HA3 GLY 83 22.960 -12.545 22.173 616 H ILE 84 H ILE 84 24.264 -10.833 19.346 617 HA ILE 84 HA ILE 84 23.333 -13.010 17.651 618 HB ILE 84 HB ILE 84 24.648 -10.462 16.730 619 HG12 ILE 84 HG12 ILE 84 22.757 -9.870 18.166 620 HG13 ILE 84 HG13 ILE 84 22.385 -9.524 16.480 621 HG21 ILE 84 HG21 ILE 84 23.079 -10.969 14.752 622 HG22 ILE 84 HG22 ILE 84 24.538 -11.941 14.938 623 HG23 ILE 84 HG23 ILE 84 22.977 -12.588 15.442 624 HD11 ILE 84 HD11 ILE 84 21.134 -11.662 16.380 625 HD12 ILE 84 HD12 ILE 84 21.411 -11.853 18.113 626 HD13 ILE 84 HD13 ILE 84 20.464 -10.491 17.516 627 H SER 85 H SER 85 24.704 -13.890 15.961 628 HA SER 85 HA SER 85 27.032 -15.033 16.849 629 HB2 SER 85 HB2 SER 85 25.899 -14.531 14.133 630 HB3 SER 85 HB3 SER 85 27.563 -15.105 14.247 631 HG SER 85 HG SER 85 25.623 -16.661 14.198 632 HA PRO 86 HA PRO 86 30.286 -12.098 16.662 633 HB2 PRO 86 HB2 PRO 86 32.355 -13.586 15.730 634 HB3 PRO 86 HB3 PRO 86 31.700 -13.767 17.362 635 HG2 PRO 86 HG2 PRO 86 31.177 -15.415 14.919 636 HG3 PRO 86 HG3 PRO 86 31.461 -15.946 16.586 637 HD2 PRO 86 HD2 PRO 86 28.984 -15.808 15.503 638 HD3 PRO 86 HD3 PRO 86 29.290 -15.513 17.226 639 H MET 87 H MET 87 29.218 -13.656 13.796 640 HA MET 87 HA MET 87 30.904 -12.692 11.838 641 HB2 MET 87 HB2 MET 87 29.164 -14.233 11.262 642 HB3 MET 87 HB3 MET 87 27.916 -13.112 11.789 643 HG2 MET 87 HG2 MET 87 28.119 -13.270 9.340 644 HG3 MET 87 HG3 MET 87 28.381 -11.640 9.958 645 HE1 MET 87 HE1 MET 87 31.616 -14.571 8.656 646 HE2 MET 87 HE2 MET 87 31.682 -14.105 10.356 647 HE3 MET 87 HE3 MET 87 30.230 -14.869 9.706 648 H HIS 88 H HIS 88 31.590 -10.684 11.525 649 HA HIS 88 HA HIS 88 29.757 -8.452 12.069 650 HB2 HIS 88 HB2 HIS 88 32.763 -8.374 11.751 651 HB3 HIS 88 HB3 HIS 88 31.727 -7.048 12.270 652 HD1 HIS 88 HD1 HIS 88 34.042 -9.176 13.696 653 HD2 HIS 88 HD2 HIS 88 30.134 -8.206 14.721 654 HE1 HIS 88 HE1 HIS 88 33.827 -9.740 16.138 655 H GLU 89 H GLU 89 28.735 -9.002 9.965 656 HA GLU 89 HA GLU 89 30.298 -8.166 7.634 657 HB2 GLU 89 HB2 GLU 89 28.036 -9.959 8.078 658 HB3 GLU 89 HB3 GLU 89 27.788 -8.874 6.718 659 HG2 GLU 89 HG2 GLU 89 30.291 -10.496 7.026 660 HG3 GLU 89 HG3 GLU 89 28.847 -11.129 6.237 661 H HIS 90 H HIS 90 30.316 -5.924 8.213 662 HA HIS 90 HA HIS 90 27.841 -4.474 8.426 663 HB2 HIS 90 HB2 HIS 90 30.508 -3.196 7.895 664 HB3 HIS 90 HB3 HIS 90 29.148 -2.569 8.822 665 HD1 HIS 90 HD1 HIS 90 32.395 -3.722 9.381 666 HD2 HIS 90 HD2 HIS 90 28.744 -4.524 11.196 667 HE1 HIS 90 HE1 HIS 90 32.960 -4.624 11.660 668 H ALA 91 H ALA 91 27.144 -5.498 6.292 669 HA ALA 91 HA ALA 91 28.187 -4.854 3.821 670 HB1 ALA 91 HB1 ALA 91 25.485 -4.775 3.359 671 HB2 ALA 91 HB2 ALA 91 26.478 -6.233 3.405 672 HB3 ALA 91 HB3 ALA 91 25.597 -5.720 4.843 673 H GLU 92 H GLU 92 28.778 -2.898 3.141 674 HA GLU 92 HA GLU 92 27.059 -0.599 3.777 675 HB2 GLU 92 HB2 GLU 92 29.127 0.720 3.030 676 HB3 GLU 92 HB3 GLU 92 29.215 -0.128 4.568 677 HG2 GLU 92 HG2 GLU 92 31.269 -0.410 3.336 678 HG3 GLU 92 HG3 GLU 92 30.432 -1.954 3.489 679 H VAL 93 H VAL 93 27.103 1.149 2.043 680 HA VAL 93 HA VAL 93 26.976 -0.066 -0.638 681 HB VAL 93 HB VAL 93 25.037 1.937 0.527 682 HG11 VAL 93 HG11 VAL 93 24.767 2.594 -1.590 683 HG12 VAL 93 HG12 VAL 93 25.714 1.243 -2.217 684 HG13 VAL 93 HG13 VAL 93 24.001 1.029 -1.858 685 HG21 VAL 93 HG21 VAL 93 24.936 -0.997 0.036 686 HG22 VAL 93 HG22 VAL 93 24.285 -0.054 1.376 687 HG23 VAL 93 HG23 VAL 93 23.464 -0.051 -0.184 688 H VAL 94 H VAL 94 28.587 0.802 -1.769 689 HA VAL 94 HA VAL 94 28.976 3.721 -1.617 690 HB VAL 94 HB VAL 94 31.115 1.626 -2.026 691 HG11 VAL 94 HG11 VAL 94 31.728 3.481 -3.346 692 HG12 VAL 94 HG12 VAL 94 31.193 4.630 -2.120 693 HG13 VAL 94 HG13 VAL 94 32.633 3.650 -1.842 694 HG21 VAL 94 HG21 VAL 94 31.414 3.508 0.178 695 HG22 VAL 94 HG22 VAL 94 29.992 2.477 0.336 696 HG23 VAL 94 HG23 VAL 94 31.590 1.753 0.156 697 H PHE 95 H PHE 95 28.160 4.532 -3.440 698 HA PHE 95 HA PHE 95 29.007 3.332 -5.983 699 HB2 PHE 95 HB2 PHE 95 26.219 4.155 -5.188 700 HB3 PHE 95 HB3 PHE 95 26.706 4.013 -6.874 701 HD1 PHE 95 HD2 PHE 95 27.802 1.736 -7.536 702 HD2 PHE 95 HD1 PHE 95 25.342 2.322 -4.111 703 HE1 PHE 95 HE2 PHE 95 27.325 -0.677 -7.469 704 HE2 PHE 95 HE1 PHE 95 24.862 -0.091 -4.039 705 HZ PHE 95 HZ PHE 95 25.854 -1.593 -5.720 706 H THR 96 H THR 96 29.195 4.786 -7.736 707 HA THR 96 HA THR 96 29.259 7.626 -6.948 708 HB THR 96 HB THR 96 31.529 6.909 -7.190 709 HG1 THR 96 HG1 THR 96 32.131 8.204 -9.052 710 HG21 THR 96 HG21 THR 96 32.071 6.114 -9.701 711 HG22 THR 96 HG22 THR 96 30.452 5.440 -9.518 712 HG23 THR 96 HG23 THR 96 31.727 4.992 -8.386 713 H ALA 97 H ALA 97 28.583 9.152 -8.445 714 HA ALA 97 HA ALA 97 26.714 8.195 -10.416 715 HB1 ALA 97 HB1 ALA 97 25.729 10.161 -10.097 716 HB2 ALA 97 HB2 ALA 97 26.953 10.500 -8.872 717 HB3 ALA 97 HB3 ALA 97 27.196 11.037 -10.535 718 H ASN 98 H ASN 98 26.712 8.939 -12.651 719 HA ASN 98 HA ASN 98 27.652 9.168 -14.709 720 HB2 ASN 98 HB2 ASN 98 30.116 10.366 -13.487 721 HB3 ASN 98 HB3 ASN 98 29.320 10.772 -15.005 722 HD21 ASN 98 HD21 ASN 98 29.759 11.632 -11.811 723 HD22 ASN 98 HD22 ASN 98 28.482 12.788 -11.671 724 H ASP 99 H ASP 99 27.960 6.718 -13.484 725 HA ASP 99 HA ASP 99 30.453 5.811 -14.712 726 HB2 ASP 99 HB2 ASP 99 30.498 6.132 -12.070 727 HB3 ASP 99 HB3 ASP 99 29.717 4.554 -12.113 728 H SER 100 H SER 100 30.441 3.233 -14.474 729 HA SER 100 HA SER 100 28.168 2.380 -15.974 730 HB2 SER 100 HB2 SER 100 30.458 0.793 -14.788 731 HB3 SER 100 HB3 SER 100 29.267 0.151 -15.919 732 HG SER 100 HG SER 100 30.132 1.303 -17.515 733 H GLY 101 H GLY 101 29.058 2.310 -12.625 734 HA2 GLY 101 HA2 GLY 101 27.517 0.183 -11.686 735 HA3 GLY 101 HA3 GLY 101 27.923 1.618 -10.755 736 HA PRO 102 HA PRO 102 23.298 1.348 -11.836 737 HB2 PRO 102 HB2 PRO 102 22.368 0.632 -9.388 738 HB3 PRO 102 HB3 PRO 102 22.811 -0.545 -10.630 739 HG2 PRO 102 HG2 PRO 102 24.387 0.398 -8.266 740 HG3 PRO 102 HG3 PRO 102 24.190 -1.249 -8.895 741 HD2 PRO 102 HD2 PRO 102 26.393 0.243 -9.389 742 HD3 PRO 102 HD3 PRO 102 25.763 -0.941 -10.551 743 H ARG 103 H ARG 103 21.520 2.362 -10.178 744 HA ARG 103 HA ARG 103 22.605 4.565 -8.644 745 HB2 ARG 103 HB2 ARG 103 21.077 4.981 -11.210 746 HB3 ARG 103 HB3 ARG 103 21.177 6.216 -9.961 747 HG2 ARG 103 HG2 ARG 103 23.746 5.841 -10.190 748 HG3 ARG 103 HG3 ARG 103 23.308 5.160 -11.758 749 HD2 ARG 103 HD2 ARG 103 22.671 7.929 -10.747 750 HD3 ARG 103 HD3 ARG 103 23.839 7.508 -11.999 751 HE ARG 103 HE ARG 103 21.306 6.538 -12.734 752 HH11 ARG 103 HH11 ARG 103 23.027 9.540 -12.353 753 HH12 ARG 103 HH12 ARG 103 22.097 10.376 -13.551 754 HH21 ARG 103 HH21 ARG 103 20.074 7.627 -14.314 755 HH22 ARG 103 HH22 ARG 103 20.416 9.287 -14.665 756 H ARG 104 H ARG 104 21.509 4.120 -6.826 757 HA ARG 104 HA ARG 104 18.572 4.008 -7.010 758 HB2 ARG 104 HB2 ARG 104 20.467 2.215 -5.595 759 HB3 ARG 104 HB3 ARG 104 18.988 2.635 -4.741 760 HG2 ARG 104 HG2 ARG 104 18.338 0.728 -5.817 761 HG3 ARG 104 HG3 ARG 104 17.851 1.948 -6.995 762 HD2 ARG 104 HD2 ARG 104 19.587 1.444 -8.431 763 HD3 ARG 104 HD3 ARG 104 20.584 0.756 -7.150 764 HE ARG 104 HE ARG 104 19.558 -1.273 -7.479 765 HH11 ARG 104 HH11 ARG 104 17.777 1.216 -9.137 766 HH12 ARG 104 HH12 ARG 104 16.755 0.103 -9.984 767 HH21 ARG 104 HH21 ARG 104 18.219 -2.749 -8.588 768 HH22 ARG 104 HH22 ARG 104 17.006 -2.153 -9.670 769 H TYR 105 H TYR 105 17.626 4.373 -4.686 770 HA TYR 105 HA TYR 105 19.001 6.723 -3.559 771 HB2 TYR 105 HB2 TYR 105 16.637 7.369 -2.807 772 HB3 TYR 105 HB3 TYR 105 17.004 7.521 -4.521 773 HD1 TYR 105 HD1 TYR 105 15.119 5.638 -2.003 774 HD2 TYR 105 HD2 TYR 105 15.970 6.056 -6.151 775 HE1 TYR 105 HE1 TYR 105 13.186 4.215 -2.537 776 HE2 TYR 105 HE2 TYR 105 14.038 4.635 -6.696 777 HH TYR 105 HH TYR 105 12.628 2.986 -5.703 778 H THR 106 H THR 106 17.106 3.843 -2.826 779 HA THR 106 HA THR 106 17.432 4.214 0.035 780 HB THR 106 HB THR 106 16.194 1.904 -1.477 781 HG1 THR 106 HG1 THR 106 14.232 2.929 -0.931 782 HG21 THR 106 HG21 THR 106 16.432 2.576 1.433 783 HG22 THR 106 HG22 THR 106 16.686 1.032 0.620 784 HG23 THR 106 HG23 THR 106 15.051 1.653 0.842 785 H ILE 107 H ILE 107 18.883 3.206 1.301 786 HA ILE 107 HA ILE 107 20.985 1.681 0.007 787 HB ILE 107 HB ILE 107 20.682 2.714 2.824 788 HG12 ILE 107 HG12 ILE 107 22.969 3.777 1.768 789 HG13 ILE 107 HG13 ILE 107 21.944 3.669 0.341 790 HG21 ILE 107 HG21 ILE 107 22.433 0.648 1.766 791 HG22 ILE 107 HG22 ILE 107 23.317 1.977 2.516 792 HG23 ILE 107 HG23 ILE 107 22.095 1.100 3.437 793 HD11 ILE 107 HD11 ILE 107 21.807 5.844 1.482 794 HD12 ILE 107 HD12 ILE 107 20.254 5.010 1.406 795 HD13 ILE 107 HD13 ILE 107 21.172 5.029 2.912 796 H ALA 108 H ALA 108 20.689 -0.428 -0.274 797 HA ALA 108 HA ALA 108 19.061 -1.949 1.605 798 HB1 ALA 108 HB1 ALA 108 18.960 -2.096 -0.981 799 HB2 ALA 108 HB2 ALA 108 20.377 -3.132 -0.805 800 HB3 ALA 108 HB3 ALA 108 18.858 -3.577 -0.026 801 H ALA 109 H ALA 109 20.053 -2.708 3.355 802 HA ALA 109 HA ALA 109 22.725 -3.909 3.031 803 HB1 ALA 109 HB1 ALA 109 23.034 -1.867 4.232 804 HB2 ALA 109 HB2 ALA 109 21.708 -2.250 5.330 805 HB3 ALA 109 HB3 ALA 109 23.193 -3.200 5.377 806 H MET 110 H MET 110 22.546 -6.037 3.249 807 HA MET 110 HA MET 110 20.546 -7.109 5.118 808 HB2 MET 110 HB2 MET 110 21.864 -8.255 2.668 809 HB3 MET 110 HB3 MET 110 21.052 -9.287 3.838 810 HG2 MET 110 HG2 MET 110 19.021 -7.795 3.503 811 HG3 MET 110 HG3 MET 110 19.870 -7.151 2.100 812 HE1 MET 110 HE1 MET 110 17.227 -10.150 2.902 813 HE2 MET 110 HE2 MET 110 18.469 -11.400 2.839 814 HE3 MET 110 HE3 MET 110 18.624 -10.058 3.975 815 H LEU 111 H LEU 111 21.218 -7.961 6.968 816 HA LEU 111 HA LEU 111 24.039 -8.269 7.488 817 HB2 LEU 111 HB2 LEU 111 21.658 -8.861 9.241 818 HB3 LEU 111 HB3 LEU 111 23.340 -8.813 9.765 819 HG LEU 111 HG LEU 111 22.501 -6.780 10.491 820 HD11 LEU 111 HD11 LEU 111 23.540 -6.126 7.739 821 HD12 LEU 111 HD12 LEU 111 24.554 -6.540 9.122 822 HD13 LEU 111 HD13 LEU 111 23.560 -5.084 9.163 823 HD21 LEU 111 HD21 LEU 111 20.392 -7.166 8.971 824 HD22 LEU 111 HD22 LEU 111 21.231 -6.045 7.898 825 HD23 LEU 111 HD23 LEU 111 20.816 -5.551 9.540 826 H SER 112 H SER 112 24.352 -9.979 5.878 827 HA SER 112 HA SER 112 23.170 -12.470 5.874 828 HB2 SER 112 HB2 SER 112 24.609 -12.459 4.134 829 HB3 SER 112 HB3 SER 112 25.712 -11.343 4.939 830 HG SER 112 HG SER 112 26.531 -13.526 4.547 831 HA PRO 113 HA PRO 113 24.372 -14.595 9.520 832 HB2 PRO 113 HB2 PRO 113 24.744 -17.121 8.597 833 HB3 PRO 113 HB3 PRO 113 23.147 -16.382 8.754 834 HG2 PRO 113 HG2 PRO 113 24.863 -16.684 6.321 835 HG3 PRO 113 HG3 PRO 113 23.117 -16.936 6.495 836 HD2 PRO 113 HD2 PRO 113 24.163 -14.679 5.427 837 HD3 PRO 113 HD3 PRO 113 22.650 -14.684 6.357 838 H TYR 114 H TYR 114 26.430 -15.280 6.705 839 HA TYR 114 HA TYR 114 28.798 -14.851 8.316 840 HB2 TYR 114 HB2 TYR 114 28.195 -17.517 7.033 841 HB3 TYR 114 HB3 TYR 114 29.811 -17.031 7.533 842 HD1 TYR 114 HD2 TYR 114 30.383 -16.856 9.895 843 HD2 TYR 114 HD1 TYR 114 26.496 -18.076 8.669 844 HE1 TYR 114 HE2 TYR 114 29.928 -17.672 12.170 845 HE2 TYR 114 HE1 TYR 114 26.029 -18.895 10.941 846 HH TYR 114 HH TYR 114 28.396 -18.506 13.555 847 H SER 115 H SER 115 30.804 -14.995 6.938 848 HA SER 115 HA SER 115 30.386 -14.673 4.085 849 HB2 SER 115 HB2 SER 115 31.118 -12.413 5.912 850 HB3 SER 115 HB3 SER 115 31.787 -12.455 4.281 851 HG SER 115 HG SER 115 29.906 -11.917 3.516 852 H TYR 116 H TYR 116 32.053 -15.486 2.985 853 HA TYR 116 HA TYR 116 34.563 -15.963 4.450 854 HB2 TYR 116 HB2 TYR 116 33.097 -17.569 2.386 855 HB3 TYR 116 HB3 TYR 116 34.839 -17.749 2.558 856 HD1 TYR 116 HD1 TYR 116 35.643 -18.114 5.068 857 HD2 TYR 116 HD2 TYR 116 31.738 -18.972 3.613 858 HE1 TYR 116 HE1 TYR 116 35.301 -19.683 6.931 859 HE2 TYR 116 HE2 TYR 116 31.384 -20.542 5.473 860 HH TYR 116 HH TYR 116 33.500 -21.941 7.126 861 H SER 117 H SER 117 33.814 -13.544 2.958 862 HA SER 117 HA SER 117 36.157 -13.449 1.224 863 HB2 SER 117 HB2 SER 117 34.101 -13.976 -0.178 864 HB3 SER 117 HB3 SER 117 33.506 -12.373 0.255 865 HG SER 117 HG SER 117 34.763 -12.601 -1.774 866 H THR 118 H THR 118 35.930 -10.944 0.215 867 HA THR 118 HA THR 118 35.737 -9.256 2.625 868 HB THR 118 HB THR 118 38.055 -9.468 1.958 869 HG1 THR 118 HG1 THR 118 38.411 -7.168 1.429 870 HG21 THR 118 HG21 THR 118 37.801 -10.091 -0.363 871 HG22 THR 118 HG22 THR 118 38.801 -8.641 -0.264 872 HG23 THR 118 HG23 THR 118 37.109 -8.516 -0.748 873 H THR 119 H THR 119 34.791 -7.248 2.457 874 HA THR 119 HA THR 119 32.794 -6.918 0.488 875 HB THR 119 HB THR 119 32.333 -4.769 1.504 876 HG1 THR 119 HG1 THR 119 34.854 -5.141 2.781 877 HG21 THR 119 HG21 THR 119 32.425 -7.216 2.903 878 HG22 THR 119 HG22 THR 119 31.390 -5.823 3.224 879 HG23 THR 119 HG23 THR 119 32.951 -5.968 4.032 880 H ALA 120 H ALA 120 32.592 -4.718 -0.692 881 HA ALA 120 HA ALA 120 35.014 -4.407 -2.305 882 HB1 ALA 120 HB1 ALA 120 33.476 -4.599 -3.914 883 HB2 ALA 120 HB2 ALA 120 32.147 -4.221 -2.818 884 HB3 ALA 120 HB3 ALA 120 33.083 -2.919 -3.549 885 H VAL 121 H VAL 121 36.347 -2.933 -1.420 886 HA VAL 121 HA VAL 121 35.366 -0.203 -1.172 887 HB VAL 121 HB VAL 121 35.112 -1.094 1.096 888 HG11 VAL 121 HG11 VAL 121 38.082 -1.614 0.982 889 HG12 VAL 121 HG12 VAL 121 37.034 -1.838 2.384 890 HG13 VAL 121 HG13 VAL 121 36.825 -2.850 0.954 891 HG21 VAL 121 HG21 VAL 121 35.755 1.260 0.747 892 HG22 VAL 121 HG22 VAL 121 36.368 0.615 2.269 893 HG23 VAL 121 HG23 VAL 121 37.452 0.800 0.890 894 H VAL 122 H VAL 122 36.848 1.285 -1.774 895 HA VAL 122 HA VAL 122 39.354 0.319 -2.850 896 HB VAL 122 HB VAL 122 39.648 2.579 -3.724 897 HG11 VAL 122 HG11 VAL 122 37.025 2.555 -4.661 898 HG12 VAL 122 HG12 VAL 122 38.421 1.761 -5.391 899 HG13 VAL 122 HG13 VAL 122 37.385 0.873 -4.273 900 HG21 VAL 122 HG21 VAL 122 37.749 4.216 -3.387 901 HG22 VAL 122 HG22 VAL 122 37.216 3.187 -2.058 902 HG23 VAL 122 HG23 VAL 122 38.802 3.955 -1.995 903 H THR 123 H THR 123 41.308 1.848 -2.516 904 HA THR 123 HA THR 123 41.528 2.531 0.342 905 HB THR 123 HB THR 123 42.725 0.446 -0.033 906 HG1 THR 123 HG1 THR 123 43.689 1.942 1.402 907 HG21 THR 123 HG21 THR 123 43.120 0.897 -2.494 908 HG22 THR 123 HG22 THR 123 44.473 0.186 -1.616 909 HG23 THR 123 HG23 THR 123 44.477 1.907 -2.000 910 H ASN 124 H ASN 124 42.963 4.229 0.875 911 HA ASN 124 HA ASN 124 43.630 5.980 -1.401 912 HB2 ASN 124 HB2 ASN 124 43.544 7.765 0.551 913 HB3 ASN 124 HB3 ASN 124 42.075 7.249 -0.272 914 HD21 ASN 124 HD21 ASN 124 40.457 6.719 0.991 915 HD22 ASN 124 HD22 ASN 124 40.573 6.164 2.623 916 HA PRO 125 HA PRO 125 47.859 6.026 -0.235 917 HB2 PRO 125 HB2 PRO 125 48.558 8.612 -0.676 918 HB3 PRO 125 HB3 PRO 125 48.226 7.470 -1.984 919 HG2 PRO 125 HG2 PRO 125 46.443 9.563 -0.802 920 HG3 PRO 125 HG3 PRO 125 46.692 9.138 -2.504 921 HD2 PRO 125 HD2 PRO 125 44.548 8.285 -1.088 922 HD3 PRO 125 HD3 PRO 125 45.279 7.321 -2.388 923 H LYS 126 H LYS 126 49.511 7.439 1.059 924 HA LYS 126 HA LYS 126 48.542 7.581 3.739 925 HB2 LYS 126 HB2 LYS 126 50.758 7.858 4.378 926 HB3 LYS 126 HB3 LYS 126 50.914 6.969 2.869 927 HG2 LYS 126 HG2 LYS 126 51.182 9.956 3.142 928 HG3 LYS 126 HG3 LYS 126 52.528 8.816 3.080 929 HD2 LYS 126 HD2 LYS 126 50.455 9.181 0.917 930 HD3 LYS 126 HD3 LYS 126 52.079 9.872 0.896 931 HE2 LYS 126 HE2 LYS 126 51.376 6.939 0.936 932 HE3 LYS 126 HE3 LYS 126 51.997 7.846 -0.442 933 HZ1 LYS 126 HZ1 LYS 126 53.852 8.344 1.429 934 HZ2 LYS 126 HZ2 LYS 126 53.967 7.109 0.281 935 HZ3 LYS 126 HZ3 LYS 126 53.402 6.765 1.839 936 H GLU 127 H GLU 127 48.622 9.791 1.170 937 HA GLU 127 HA GLU 127 48.427 12.085 3.001 938 HB2 GLU 127 HB2 GLU 127 49.288 11.798 0.153 939 HB3 GLU 127 HB3 GLU 127 48.593 13.325 0.676 940 HG2 GLU 127 HG2 GLU 127 50.300 13.577 2.358 941 HG3 GLU 127 HG3 GLU 127 50.959 11.989 1.970
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