NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
24095 | 2k0d | 15645 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLU 2 H GLU 2 60.144 1.086 8.709 2 HA GLU 2 HA GLU 2 59.342 2.891 7.327 3 HB2 GLU 2 HB2 GLU 2 59.198 2.977 9.841 4 HB3 GLU 2 HB3 GLU 2 60.699 3.887 9.851 5 HG2 GLU 2 HG2 GLU 2 59.565 5.642 8.515 6 HG3 GLU 2 HG3 GLU 2 58.064 4.730 8.685 7 H LEU 3 H LEU 3 59.854 4.976 6.338 8 HA LEU 3 HA LEU 3 62.631 4.943 5.501 9 HB2 LEU 3 HB2 LEU 3 60.350 6.579 4.453 10 HB3 LEU 3 HB3 LEU 3 61.926 6.416 3.709 11 HG LEU 3 HG LEU 3 59.736 4.365 3.891 12 HD11 LEU 3 HD11 LEU 3 61.179 5.565 1.525 13 HD12 LEU 3 HD12 LEU 3 59.539 5.939 2.032 14 HD13 LEU 3 HD13 LEU 3 59.934 4.329 1.442 15 HD21 LEU 3 HD21 LEU 3 61.777 3.213 4.423 16 HD22 LEU 3 HD22 LEU 3 62.592 3.967 3.064 17 HD23 LEU 3 HD23 LEU 3 61.301 2.789 2.770 18 H LYS 4 H LYS 4 64.018 6.373 6.077 19 HA LYS 4 HA LYS 4 63.234 8.593 7.839 20 HB2 LYS 4 HB2 LYS 4 66.033 7.752 7.107 21 HB3 LYS 4 HB3 LYS 4 65.503 8.665 8.516 22 HG2 LYS 4 HG2 LYS 4 65.365 5.726 7.952 23 HG3 LYS 4 HG3 LYS 4 66.151 6.519 9.299 24 HD2 LYS 4 HD2 LYS 4 63.740 7.278 9.856 25 HD3 LYS 4 HD3 LYS 4 63.289 5.960 8.796 26 HE2 LYS 4 HE2 LYS 4 64.959 4.541 10.184 27 HE3 LYS 4 HE3 LYS 4 64.844 5.821 11.354 28 HZ1 LYS 4 HZ1 LYS 4 62.322 5.445 11.290 29 HZ2 LYS 4 HZ2 LYS 4 63.260 4.354 12.084 30 HZ3 LYS 4 HZ3 LYS 4 62.686 3.937 10.582 31 H ASN 5 H ASN 5 65.260 10.372 7.317 32 HA ASN 5 HA ASN 5 64.805 10.912 4.489 33 HB2 ASN 5 HB2 ASN 5 65.251 12.866 6.739 34 HB3 ASN 5 HB3 ASN 5 65.432 13.329 5.048 35 HD21 ASN 5 HD21 ASN 5 63.555 14.263 7.037 36 HD22 ASN 5 HD22 ASN 5 61.976 13.961 6.414 37 H SER 6 H SER 6 67.240 10.595 6.926 38 HA SER 6 HA SER 6 69.229 10.692 4.784 39 HB2 SER 6 HB2 SER 6 70.853 11.590 6.431 40 HB3 SER 6 HB3 SER 6 69.517 12.706 6.112 41 HG SER 6 HG SER 6 68.661 12.276 8.011 42 H ILE 7 H ILE 7 71.262 9.530 5.441 43 HA ILE 7 HA ILE 7 70.718 6.817 6.033 44 HB ILE 7 HB ILE 7 72.581 7.750 4.611 45 HG12 ILE 7 HG12 ILE 7 74.316 6.003 5.338 46 HG13 ILE 7 HG13 ILE 7 73.232 5.676 6.694 47 HG21 ILE 7 HG21 ILE 7 73.944 8.277 7.243 48 HG22 ILE 7 HG22 ILE 7 73.433 9.479 6.070 49 HG23 ILE 7 HG23 ILE 7 74.722 8.346 5.666 50 HD11 ILE 7 HD11 ILE 7 73.023 4.164 4.802 51 HD12 ILE 7 HD12 ILE 7 72.481 5.513 3.808 52 HD13 ILE 7 HD13 ILE 7 71.515 4.990 5.194 53 H SER 8 H SER 8 71.228 9.496 8.049 54 HA SER 8 HA SER 8 72.700 8.135 10.083 55 HB2 SER 8 HB2 SER 8 71.635 10.933 9.904 56 HB3 SER 8 HB3 SER 8 72.767 10.342 11.137 57 HG SER 8 HG SER 8 74.079 9.700 9.264 58 H ASP 9 H ASP 9 69.396 8.467 9.342 59 HA ASP 9 HA ASP 9 68.772 7.994 12.176 60 HB2 ASP 9 HB2 ASP 9 67.314 9.687 10.704 61 HB3 ASP 9 HB3 ASP 9 66.693 8.220 10.064 62 H TYR 10 H TYR 10 69.712 6.376 9.673 63 HA TYR 10 HA TYR 10 67.694 4.284 9.693 64 HB2 TYR 10 HB2 TYR 10 69.892 4.993 7.796 65 HB3 TYR 10 HB3 TYR 10 69.425 3.306 7.924 66 HD1 TYR 10 HD1 TYR 10 67.004 2.714 7.499 67 HD2 TYR 10 HD2 TYR 10 68.639 6.490 6.442 68 HE1 TYR 10 HE1 TYR 10 65.151 3.059 5.923 69 HE2 TYR 10 HE2 TYR 10 66.778 6.852 4.854 70 HH TYR 10 HH TYR 10 65.072 5.613 3.672 71 H THR 11 H THR 11 67.935 2.728 11.065 72 HA THR 11 HA THR 11 70.525 2.112 12.153 73 HB THR 11 HB THR 11 69.292 0.380 13.376 74 HG1 THR 11 HG1 THR 11 67.068 0.136 13.002 75 HG21 THR 11 HG21 THR 11 69.205 2.623 14.299 76 HG22 THR 11 HG22 THR 11 67.690 1.775 14.598 77 HG23 THR 11 HG23 THR 11 67.783 2.989 13.321 78 H GLU 12 H GLU 12 71.140 -0.319 11.915 79 HA GLU 12 HA GLU 12 71.349 -0.832 9.198 80 HB2 GLU 12 HB2 GLU 12 72.049 -3.191 9.943 81 HB3 GLU 12 HB3 GLU 12 73.032 -1.831 10.452 82 HG2 GLU 12 HG2 GLU 12 72.038 -1.880 12.630 83 HG3 GLU 12 HG3 GLU 12 70.950 -3.172 12.180 84 H ALA 13 H ALA 13 69.079 -2.199 11.530 85 HA ALA 13 HA ALA 13 67.802 -3.848 9.578 86 HB1 ALA 13 HB1 ALA 13 66.098 -4.253 11.262 87 HB2 ALA 13 HB2 ALA 13 66.683 -2.887 12.213 88 HB3 ALA 13 HB3 ALA 13 67.694 -4.318 12.013 89 H GLU 14 H GLU 14 67.087 -0.540 10.754 90 HA GLU 14 HA GLU 14 64.692 -0.327 9.256 91 HB2 GLU 14 HB2 GLU 14 66.553 1.687 10.437 92 HB3 GLU 14 HB3 GLU 14 65.323 2.242 9.315 93 HG2 GLU 14 HG2 GLU 14 64.795 0.667 11.829 94 HG3 GLU 14 HG3 GLU 14 64.640 2.420 11.677 95 H PHE 15 H PHE 15 68.031 0.105 8.444 96 HA PHE 15 HA PHE 15 67.503 1.205 5.904 97 HB2 PHE 15 HB2 PHE 15 69.737 1.267 7.191 98 HB3 PHE 15 HB3 PHE 15 69.944 -0.380 6.636 99 HD1 PHE 15 HD1 PHE 15 69.046 2.939 5.225 100 HD2 PHE 15 HD2 PHE 15 71.123 -0.715 4.739 101 HE1 PHE 15 HE1 PHE 15 69.966 3.742 3.095 102 HE2 PHE 15 HE2 PHE 15 72.036 0.079 2.607 103 HZ PHE 15 HZ PHE 15 71.452 2.316 1.797 104 H VAL 16 H VAL 16 68.128 -2.096 7.106 105 HA VAL 16 HA VAL 16 67.915 -3.250 4.570 106 HB VAL 16 HB VAL 16 67.842 -5.381 5.479 107 HG11 VAL 16 HG11 VAL 16 69.336 -3.813 7.457 108 HG12 VAL 16 HG12 VAL 16 69.854 -4.451 5.899 109 HG13 VAL 16 HG13 VAL 16 69.450 -5.562 7.215 110 HG21 VAL 16 HG21 VAL 16 65.910 -5.298 6.736 111 HG22 VAL 16 HG22 VAL 16 66.666 -4.305 7.994 112 HG23 VAL 16 HG23 VAL 16 67.199 -5.998 7.720 113 H GLN 17 H GLN 17 65.448 -2.219 6.815 114 HA GLN 17 HA GLN 17 63.265 -3.494 5.717 115 HB2 GLN 17 HB2 GLN 17 63.496 -2.153 7.882 116 HB3 GLN 17 HB3 GLN 17 63.364 -0.717 6.893 117 HG2 GLN 17 HG2 GLN 17 61.311 -2.833 6.799 118 HG3 GLN 17 HG3 GLN 17 61.317 -1.639 8.101 119 HE21 GLN 17 HE21 GLN 17 59.342 -2.116 5.984 120 HE22 GLN 17 HE22 GLN 17 59.190 -0.631 5.126 121 H LEU 18 H LEU 18 64.790 -0.383 4.964 122 HA LEU 18 HA LEU 18 63.195 0.412 2.776 123 HB2 LEU 18 HB2 LEU 18 64.745 1.906 3.798 124 HB3 LEU 18 HB3 LEU 18 66.086 0.893 3.485 125 HG LEU 18 HG LEU 18 65.683 1.232 0.999 126 HD11 LEU 18 HD11 LEU 18 64.507 3.152 0.250 127 HD12 LEU 18 HD12 LEU 18 64.075 3.569 1.896 128 HD13 LEU 18 HD13 LEU 18 63.407 2.104 1.157 129 HD21 LEU 18 HD21 LEU 18 67.514 2.252 2.154 130 HD22 LEU 18 HD22 LEU 18 66.482 3.599 2.658 131 HD23 LEU 18 HD23 LEU 18 66.849 3.350 0.944 132 H LEU 19 H LEU 19 66.155 -1.348 2.982 133 HA LEU 19 HA LEU 19 66.730 -1.901 0.294 134 HB2 LEU 19 HB2 LEU 19 67.156 -3.299 2.799 135 HB3 LEU 19 HB3 LEU 19 67.979 -3.830 1.308 136 HG LEU 19 HG LEU 19 68.282 -1.331 2.953 137 HD11 LEU 19 HD11 LEU 19 70.160 -3.408 2.001 138 HD12 LEU 19 HD12 LEU 19 69.668 -3.056 3.662 139 HD13 LEU 19 HD13 LEU 19 70.647 -1.899 2.747 140 HD21 LEU 19 HD21 LEU 19 69.801 -0.469 1.263 141 HD22 LEU 19 HD22 LEU 19 68.110 -0.510 0.770 142 HD23 LEU 19 HD23 LEU 19 69.244 -1.728 0.144 143 H LYS 20 H LYS 20 64.722 -3.681 2.585 144 HA LYS 20 HA LYS 20 64.105 -5.794 0.802 145 HB2 LYS 20 HB2 LYS 20 62.739 -4.806 3.272 146 HB3 LYS 20 HB3 LYS 20 62.194 -6.224 2.367 147 HG2 LYS 20 HG2 LYS 20 64.435 -7.248 2.791 148 HG3 LYS 20 HG3 LYS 20 64.838 -5.836 3.733 149 HD2 LYS 20 HD2 LYS 20 63.118 -6.229 5.349 150 HD3 LYS 20 HD3 LYS 20 62.450 -7.546 4.390 151 HE2 LYS 20 HE2 LYS 20 65.238 -7.590 5.518 152 HE3 LYS 20 HE3 LYS 20 63.849 -8.210 6.402 153 HZ1 LYS 20 HZ1 LYS 20 63.467 -9.790 4.621 154 HZ2 LYS 20 HZ2 LYS 20 65.034 -9.961 5.193 155 HZ3 LYS 20 HZ3 LYS 20 64.755 -9.193 3.735 156 H GLU 21 H GLU 21 62.600 -2.689 1.528 157 HA GLU 21 HA GLU 21 60.365 -3.224 -0.109 158 HB2 GLU 21 HB2 GLU 21 61.492 -0.602 0.882 159 HB3 GLU 21 HB3 GLU 21 60.000 -0.721 -0.034 160 HG2 GLU 21 HG2 GLU 21 60.560 -1.886 2.686 161 HG3 GLU 21 HG3 GLU 21 59.491 -0.539 2.306 162 H ILE 22 H ILE 22 63.506 -1.742 -0.656 163 HA ILE 22 HA ILE 22 63.087 -1.022 -3.330 164 HB ILE 22 HB ILE 22 65.697 -1.980 -2.093 165 HG12 ILE 22 HG12 ILE 22 64.537 0.802 -2.332 166 HG13 ILE 22 HG13 ILE 22 64.702 -0.116 -0.850 167 HG21 ILE 22 HG21 ILE 22 66.731 -0.645 -3.876 168 HG22 ILE 22 HG22 ILE 22 65.126 -0.292 -4.523 169 HG23 ILE 22 HG23 ILE 22 65.735 -1.947 -4.529 170 HD11 ILE 22 HD11 ILE 22 67.132 -0.073 -1.083 171 HD12 ILE 22 HD12 ILE 22 66.442 1.550 -1.032 172 HD13 ILE 22 HD13 ILE 22 66.966 0.863 -2.568 173 H GLU 23 H GLU 23 64.159 -4.093 -1.864 174 HA GLU 23 HA GLU 23 64.663 -5.678 -4.063 175 HB2 GLU 23 HB2 GLU 23 65.206 -6.556 -2.007 176 HB3 GLU 23 HB3 GLU 23 63.785 -5.883 -1.243 177 HG2 GLU 23 HG2 GLU 23 63.202 -7.976 -1.098 178 HG3 GLU 23 HG3 GLU 23 62.595 -7.713 -2.690 179 H LYS 24 H LYS 24 61.743 -5.005 -2.266 180 HA LYS 24 HA LYS 24 59.930 -6.681 -3.550 181 HB2 LYS 24 HB2 LYS 24 59.631 -5.615 -1.354 182 HB3 LYS 24 HB3 LYS 24 59.483 -4.063 -2.153 183 HG2 LYS 24 HG2 LYS 24 57.483 -4.952 -3.335 184 HG3 LYS 24 HG3 LYS 24 57.685 -6.399 -2.313 185 HD2 LYS 24 HD2 LYS 24 57.308 -5.174 -0.326 186 HD3 LYS 24 HD3 LYS 24 57.463 -3.634 -1.165 187 HE2 LYS 24 HE2 LYS 24 55.241 -5.635 -1.521 188 HE3 LYS 24 HE3 LYS 24 55.132 -4.106 -0.649 189 HZ1 LYS 24 HZ1 LYS 24 55.485 -4.512 -3.557 190 HZ2 LYS 24 HZ2 LYS 24 55.838 -3.061 -2.854 191 HZ3 LYS 24 HZ3 LYS 24 54.264 -3.667 -2.774 192 H GLU 25 H GLU 25 60.482 -3.143 -4.002 193 HA GLU 25 HA GLU 25 58.595 -3.007 -6.081 194 HB2 GLU 25 HB2 GLU 25 60.727 -1.002 -5.305 195 HB3 GLU 25 HB3 GLU 25 59.347 -0.717 -6.342 196 HG2 GLU 25 HG2 GLU 25 59.283 -1.352 -3.406 197 HG3 GLU 25 HG3 GLU 25 58.935 0.196 -4.166 198 H ASN 26 H ASN 26 61.999 -3.687 -5.985 199 HA ASN 26 HA ASN 26 62.522 -3.157 -8.743 200 HB2 ASN 26 HB2 ASN 26 64.341 -3.222 -7.079 201 HB3 ASN 26 HB3 ASN 26 64.023 -4.923 -6.788 202 HD21 ASN 26 HD21 ASN 26 64.119 -3.329 -10.005 203 HD22 ASN 26 HD22 ASN 26 65.496 -4.212 -10.524 204 H VAL 27 H VAL 27 61.809 -6.134 -6.899 205 HA VAL 27 HA VAL 27 61.849 -7.709 -9.282 206 HB VAL 27 HB VAL 27 61.038 -9.597 -7.956 207 HG11 VAL 27 HG11 VAL 27 63.404 -9.141 -7.942 208 HG12 VAL 27 HG12 VAL 27 62.898 -9.775 -6.378 209 HG13 VAL 27 HG13 VAL 27 63.211 -8.050 -6.570 210 HG21 VAL 27 HG21 VAL 27 60.796 -7.627 -5.674 211 HG22 VAL 27 HG22 VAL 27 60.645 -9.376 -5.522 212 HG23 VAL 27 HG23 VAL 27 59.466 -8.466 -6.472 213 H ALA 28 H ALA 28 59.391 -5.951 -7.617 214 HA ALA 28 HA ALA 28 57.247 -7.147 -9.135 215 HB1 ALA 28 HB1 ALA 28 57.314 -4.577 -7.542 216 HB2 ALA 28 HB2 ALA 28 56.821 -6.153 -6.926 217 HB3 ALA 28 HB3 ALA 28 55.862 -5.354 -8.175 218 H ALA 29 H ALA 29 59.484 -4.598 -9.429 219 HA ALA 29 HA ALA 29 60.066 -3.136 -10.926 220 HB1 ALA 29 HB1 ALA 29 58.484 -4.719 -12.948 221 HB2 ALA 29 HB2 ALA 29 60.147 -5.068 -12.453 222 HB3 ALA 29 HB3 ALA 29 59.767 -3.547 -13.266 223 H THR 30 H THR 30 58.727 -1.815 -9.574 224 HA THR 30 HA THR 30 56.400 -0.759 -10.964 225 HB THR 30 HB THR 30 55.962 0.419 -8.824 226 HG1 THR 30 HG1 THR 30 57.338 -0.387 -7.001 227 HG21 THR 30 HG21 THR 30 55.478 -1.537 -7.483 228 HG22 THR 30 HG22 THR 30 56.601 -2.472 -8.486 229 HG23 THR 30 HG23 THR 30 55.107 -1.840 -9.194 230 H ASP 31 H ASP 31 56.495 1.909 -10.221 231 HA ASP 31 HA ASP 31 59.182 2.684 -11.058 232 HB2 ASP 31 HB2 ASP 31 58.552 4.133 -12.755 233 HB3 ASP 31 HB3 ASP 31 57.526 2.731 -13.027 234 H ASP 32 H ASP 32 56.182 3.827 -9.572 235 HA ASP 32 HA ASP 32 57.291 6.386 -8.997 236 HB2 ASP 32 HB2 ASP 32 54.823 5.917 -9.090 237 HB3 ASP 32 HB3 ASP 32 54.993 5.096 -7.544 238 H VAL 33 H VAL 33 56.864 3.606 -6.945 239 HA VAL 33 HA VAL 33 58.340 5.008 -4.959 240 HB VAL 33 HB VAL 33 56.949 2.332 -4.995 241 HG11 VAL 33 HG11 VAL 33 57.526 2.200 -2.648 242 HG12 VAL 33 HG12 VAL 33 58.425 3.742 -2.844 243 HG13 VAL 33 HG13 VAL 33 58.967 2.289 -3.698 244 HG21 VAL 33 HG21 VAL 33 55.566 4.268 -4.897 245 HG22 VAL 33 HG22 VAL 33 56.632 4.913 -3.635 246 HG23 VAL 33 HG23 VAL 33 55.638 3.474 -3.291 247 H LEU 34 H LEU 34 58.782 2.537 -7.320 248 HA LEU 34 HA LEU 34 61.159 1.449 -6.385 249 HB2 LEU 34 HB2 LEU 34 59.715 0.640 -8.351 250 HB3 LEU 34 HB3 LEU 34 60.368 1.967 -9.230 251 HG LEU 34 HG LEU 34 61.326 -0.409 -9.606 252 HD11 LEU 34 HD11 LEU 34 61.957 1.505 -10.786 253 HD12 LEU 34 HD12 LEU 34 63.394 0.569 -10.351 254 HD13 LEU 34 HD13 LEU 34 62.994 2.058 -9.465 255 HD21 LEU 34 HD21 LEU 34 63.030 0.569 -7.314 256 HD22 LEU 34 HD22 LEU 34 63.398 -0.805 -8.356 257 HD23 LEU 34 HD23 LEU 34 61.988 -0.854 -7.297 258 H ASP 35 H ASP 35 60.566 4.258 -8.555 259 HA ASP 35 HA ASP 35 63.271 4.921 -8.603 260 HB2 ASP 35 HB2 ASP 35 60.773 6.330 -9.408 261 HB3 ASP 35 HB3 ASP 35 62.305 7.171 -9.368 262 H VAL 36 H VAL 36 60.767 5.619 -6.308 263 HA VAL 36 HA VAL 36 62.051 7.879 -5.153 264 HB VAL 36 HB VAL 36 60.538 5.741 -3.653 265 HG11 VAL 36 HG11 VAL 36 61.963 7.046 -2.285 266 HG12 VAL 36 HG12 VAL 36 60.271 7.496 -1.942 267 HG13 VAL 36 HG13 VAL 36 61.315 8.538 -2.953 268 HG21 VAL 36 HG21 VAL 36 58.734 7.150 -3.658 269 HG22 VAL 36 HG22 VAL 36 59.242 6.784 -5.334 270 HG23 VAL 36 HG23 VAL 36 59.598 8.389 -4.600 271 H LEU 37 H LEU 37 62.056 4.474 -4.544 272 HA LEU 37 HA LEU 37 63.682 4.658 -2.281 273 HB2 LEU 37 HB2 LEU 37 63.174 2.187 -3.881 274 HB3 LEU 37 HB3 LEU 37 63.692 2.452 -2.219 275 HG LEU 37 HG LEU 37 60.982 3.230 -3.179 276 HD11 LEU 37 HD11 LEU 37 61.194 0.824 -3.257 277 HD12 LEU 37 HD12 LEU 37 60.104 1.357 -1.989 278 HD13 LEU 37 HD13 LEU 37 61.732 0.801 -1.567 279 HD21 LEU 37 HD21 LEU 37 60.475 3.433 -0.787 280 HD22 LEU 37 HD22 LEU 37 61.752 4.538 -1.287 281 HD23 LEU 37 HD23 LEU 37 62.156 3.064 -0.405 282 H LEU 38 H LEU 38 64.266 3.825 -5.587 283 HA LEU 38 HA LEU 38 66.928 3.036 -5.320 284 HB2 LEU 38 HB2 LEU 38 65.336 4.298 -7.441 285 HB3 LEU 38 HB3 LEU 38 67.024 3.928 -7.780 286 HG LEU 38 HG LEU 38 64.574 2.263 -7.602 287 HD11 LEU 38 HD11 LEU 38 67.040 2.135 -9.262 288 HD12 LEU 38 HD12 LEU 38 65.499 2.869 -9.719 289 HD13 LEU 38 HD13 LEU 38 65.617 1.116 -9.477 290 HD21 LEU 38 HD21 LEU 38 67.283 1.107 -6.914 291 HD22 LEU 38 HD22 LEU 38 65.821 0.181 -7.241 292 HD23 LEU 38 HD23 LEU 38 65.898 1.234 -5.831 293 H GLU 39 H GLU 39 65.548 6.217 -5.938 294 HA GLU 39 HA GLU 39 68.058 7.525 -5.990 295 HB2 GLU 39 HB2 GLU 39 65.268 8.489 -5.588 296 HB3 GLU 39 HB3 GLU 39 66.688 9.522 -5.679 297 HG2 GLU 39 HG2 GLU 39 65.672 7.677 -7.836 298 HG3 GLU 39 HG3 GLU 39 65.491 9.438 -7.734 299 H HIS 40 H HIS 40 65.607 7.007 -3.586 300 HA HIS 40 HA HIS 40 66.493 8.713 -1.638 301 HB2 HIS 40 HB2 HIS 40 64.330 7.560 -1.633 302 HB3 HIS 40 HB3 HIS 40 65.095 6.039 -1.356 303 HD1 HIS 40 HD1 HIS 40 63.507 8.739 0.479 304 HD2 HIS 40 HD2 HIS 40 66.454 5.917 1.249 305 HE1 HIS 40 HE1 HIS 40 63.698 8.574 2.972 306 H PHE 41 H PHE 41 67.184 5.349 -2.251 307 HA PHE 41 HA PHE 41 68.884 4.777 -0.143 308 HB2 PHE 41 HB2 PHE 41 67.912 3.045 -1.354 309 HB3 PHE 41 HB3 PHE 41 68.454 3.693 -2.889 310 HD1 PHE 41 HD1 PHE 41 69.626 2.171 0.280 311 HD2 PHE 41 HD2 PHE 41 70.438 2.852 -3.831 312 HE1 PHE 41 HE1 PHE 41 71.573 0.669 0.414 313 HE2 PHE 41 HE2 PHE 41 72.385 1.365 -3.682 314 HZ PHE 41 HZ PHE 41 72.948 0.275 -1.568 315 H VAL 42 H VAL 42 69.639 5.723 -3.466 316 HA VAL 42 HA VAL 42 72.409 5.869 -2.904 317 HB VAL 42 HB VAL 42 71.616 5.338 -5.110 318 HG11 VAL 42 HG11 VAL 42 70.873 6.900 -6.660 319 HG12 VAL 42 HG12 VAL 42 70.583 8.074 -5.332 320 HG13 VAL 42 HG13 VAL 42 69.760 6.480 -5.367 321 HG21 VAL 42 HG21 VAL 42 73.879 6.209 -4.941 322 HG22 VAL 42 HG22 VAL 42 73.258 7.843 -5.173 323 HG23 VAL 42 HG23 VAL 42 73.135 6.663 -6.474 324 H LYS 43 H LYS 43 69.970 8.219 -2.694 325 HA LYS 43 HA LYS 43 71.877 10.372 -2.381 326 HB2 LYS 43 HB2 LYS 43 70.104 11.813 -2.158 327 HB3 LYS 43 HB3 LYS 43 69.202 10.457 -2.809 328 HG2 LYS 43 HG2 LYS 43 68.526 9.836 -0.426 329 HG3 LYS 43 HG3 LYS 43 69.438 11.232 0.101 330 HD2 LYS 43 HD2 LYS 43 68.018 12.676 -1.372 331 HD3 LYS 43 HD3 LYS 43 66.992 11.270 -1.644 332 HE2 LYS 43 HE2 LYS 43 67.577 12.533 1.044 333 HE3 LYS 43 HE3 LYS 43 66.111 12.762 0.104 334 HZ1 LYS 43 HZ1 LYS 43 67.035 10.196 1.296 335 HZ2 LYS 43 HZ2 LYS 43 65.637 10.409 0.347 336 HZ3 LYS 43 HZ3 LYS 43 65.763 11.172 1.831 337 H ILE 44 H ILE 44 70.457 8.153 -0.104 338 HA ILE 44 HA ILE 44 71.546 9.698 2.077 339 HB ILE 44 HB ILE 44 70.681 7.903 3.573 340 HG12 ILE 44 HG12 ILE 44 69.634 6.724 0.996 341 HG13 ILE 44 HG13 ILE 44 70.874 6.001 1.999 342 HG21 ILE 44 HG21 ILE 44 68.326 8.419 3.230 343 HG22 ILE 44 HG22 ILE 44 68.678 8.951 1.589 344 HG23 ILE 44 HG23 ILE 44 69.322 9.855 2.954 345 HD11 ILE 44 HD11 ILE 44 68.031 6.502 2.810 346 HD12 ILE 44 HD12 ILE 44 69.250 5.668 3.773 347 HD13 ILE 44 HD13 ILE 44 68.670 4.966 2.254 348 H THR 45 H THR 45 72.375 6.802 0.330 349 HA THR 45 HA THR 45 74.544 6.166 2.106 350 HB THR 45 HB THR 45 75.107 4.461 0.420 351 HG1 THR 45 HG1 THR 45 72.778 5.073 -1.016 352 HG21 THR 45 HG21 THR 45 72.151 4.588 1.008 353 HG22 THR 45 HG22 THR 45 73.379 4.017 2.129 354 HG23 THR 45 HG23 THR 45 73.077 3.136 0.627 355 H GLU 46 H GLU 46 73.985 7.775 -0.911 356 HA GLU 46 HA GLU 46 75.095 9.093 -2.261 357 HB2 GLU 46 HB2 GLU 46 76.990 9.262 0.019 358 HB3 GLU 46 HB3 GLU 46 77.051 10.362 -1.376 359 HG2 GLU 46 HG2 GLU 46 74.753 11.028 -0.744 360 HG3 GLU 46 HG3 GLU 46 74.902 10.009 0.675 361 H HIS 47 H HIS 47 75.581 6.250 -2.007 362 HA HIS 47 HA HIS 47 78.276 5.756 -2.699 363 HB2 HIS 47 HB2 HIS 47 76.630 4.068 -1.691 364 HB3 HIS 47 HB3 HIS 47 75.909 3.956 -3.295 365 HD1 HIS 47 HD1 HIS 47 77.004 2.228 -4.856 366 HD2 HIS 47 HD2 HIS 47 79.378 3.276 -1.634 367 HE1 HIS 47 HE1 HIS 47 79.132 0.900 -5.067 368 HA PRO 48 HA PRO 48 77.938 7.317 -6.899 369 HB2 PRO 48 HB2 PRO 48 80.057 5.341 -7.455 370 HB3 PRO 48 HB3 PRO 48 80.080 7.095 -7.727 371 HG2 PRO 48 HG2 PRO 48 81.428 5.838 -5.896 372 HG3 PRO 48 HG3 PRO 48 80.673 7.406 -5.435 373 HD2 PRO 48 HD2 PRO 48 79.859 4.573 -4.917 374 HD3 PRO 48 HD3 PRO 48 79.820 5.932 -3.789 375 H ASP 49 H ASP 49 77.648 4.098 -6.043 376 HA ASP 49 HA ASP 49 76.899 3.436 -8.660 377 HB2 ASP 49 HB2 ASP 49 78.470 1.774 -6.703 378 HB3 ASP 49 HB3 ASP 49 77.691 1.011 -8.067 379 H GLY 50 H GLY 50 75.431 4.471 -6.477 380 HA2 GLY 50 HA2 GLY 50 74.191 2.953 -4.482 381 HA3 GLY 50 HA3 GLY 50 73.430 4.231 -5.398 382 H THR 51 H THR 51 73.063 3.312 -7.688 383 HA THR 51 HA THR 51 71.297 1.278 -6.819 384 HB THR 51 HB THR 51 70.290 1.640 -9.278 385 HG1 THR 51 HG1 THR 51 70.131 4.076 -9.155 386 HG21 THR 51 HG21 THR 51 68.543 2.800 -8.032 387 HG22 THR 51 HG22 THR 51 69.666 3.031 -6.685 388 HG23 THR 51 HG23 THR 51 69.189 1.408 -7.176 389 H ALA 52 H ALA 52 74.016 1.440 -8.648 390 HA ALA 52 HA ALA 52 73.701 -1.032 -10.036 391 HB1 ALA 52 HB1 ALA 52 76.133 -1.011 -10.201 392 HB2 ALA 52 HB2 ALA 52 76.208 0.272 -8.990 393 HB3 ALA 52 HB3 ALA 52 75.502 0.595 -10.571 394 H LEU 53 H LEU 53 74.541 -0.166 -6.760 395 HA LEU 53 HA LEU 53 75.168 -2.798 -5.939 396 HB2 LEU 53 HB2 LEU 53 74.122 -0.494 -4.327 397 HB3 LEU 53 HB3 LEU 53 74.545 -2.041 -3.639 398 HG LEU 53 HG LEU 53 76.363 0.026 -4.835 399 HD11 LEU 53 HD11 LEU 53 75.736 0.356 -2.573 400 HD12 LEU 53 HD12 LEU 53 77.433 -0.117 -2.674 401 HD13 LEU 53 HD13 LEU 53 76.214 -1.289 -2.161 402 HD21 LEU 53 HD21 LEU 53 77.048 -2.824 -4.096 403 HD22 LEU 53 HD22 LEU 53 78.216 -1.553 -4.445 404 HD23 LEU 53 HD23 LEU 53 77.134 -2.119 -5.714 405 H ILE 54 H ILE 54 72.136 -1.071 -6.223 406 HA ILE 54 HA ILE 54 70.616 -3.077 -4.819 407 HB ILE 54 HB ILE 54 69.706 -1.029 -6.872 408 HG12 ILE 54 HG12 ILE 54 70.287 0.129 -4.823 409 HG13 ILE 54 HG13 ILE 54 68.529 -0.019 -4.821 410 HG21 ILE 54 HG21 ILE 54 67.955 -2.877 -5.264 411 HG22 ILE 54 HG22 ILE 54 68.188 -2.893 -7.013 412 HG23 ILE 54 HG23 ILE 54 67.386 -1.525 -6.245 413 HD11 ILE 54 HD11 ILE 54 70.393 -1.760 -3.371 414 HD12 ILE 54 HD12 ILE 54 68.621 -1.876 -3.392 415 HD13 ILE 54 HD13 ILE 54 69.417 -0.449 -2.689 416 H TYR 55 H TYR 55 71.260 -2.361 -8.133 417 HA TYR 55 HA TYR 55 69.839 -4.472 -9.120 418 HB2 TYR 55 HB2 TYR 55 71.742 -2.546 -10.256 419 HB3 TYR 55 HB3 TYR 55 71.285 -3.927 -11.236 420 HD1 TYR 55 HD1 TYR 55 69.979 -1.021 -9.360 421 HD2 TYR 55 HD2 TYR 55 69.074 -4.017 -12.229 422 HE1 TYR 55 HE1 TYR 55 67.882 0.092 -9.812 423 HE2 TYR 55 HE2 TYR 55 66.931 -2.899 -12.710 424 HH TYR 55 HH TYR 55 65.354 -1.343 -11.587 425 H GLU 56 H GLU 56 73.312 -4.258 -8.332 426 HA GLU 56 HA GLU 56 73.733 -6.875 -9.325 427 HB2 GLU 56 HB2 GLU 56 75.884 -6.910 -8.070 428 HB3 GLU 56 HB3 GLU 56 75.734 -5.571 -9.186 429 HG2 GLU 56 HG2 GLU 56 75.487 -4.048 -7.512 430 HG3 GLU 56 HG3 GLU 56 75.116 -5.206 -6.260 431 H ALA 57 H ALA 57 72.820 -5.605 -6.180 432 HA ALA 57 HA ALA 57 73.184 -7.935 -4.695 433 HB1 ALA 57 HB1 ALA 57 72.608 -5.768 -3.679 434 HB2 ALA 57 HB2 ALA 57 71.521 -7.049 -3.142 435 HB3 ALA 57 HB3 ALA 57 70.985 -5.890 -4.357 436 H ALA 58 H ALA 58 70.505 -6.929 -6.719 437 HA ALA 58 HA ALA 58 68.803 -9.105 -6.195 438 HB1 ALA 58 HB1 ALA 58 67.666 -8.487 -8.275 439 HB2 ALA 58 HB2 ALA 58 69.031 -7.460 -8.719 440 HB3 ALA 58 HB3 ALA 58 68.043 -7.056 -7.315 441 H ALA 59 H ALA 59 71.218 -8.612 -8.756 442 HA ALA 59 HA ALA 59 70.860 -11.142 -9.988 443 HB1 ALA 59 HB1 ALA 59 71.948 -9.248 -11.125 444 HB2 ALA 59 HB2 ALA 59 72.968 -10.686 -11.144 445 HB3 ALA 59 HB3 ALA 59 73.313 -9.375 -10.017 446 H ARG 60 H ARG 60 73.051 -9.994 -7.509 447 HA ARG 60 HA ARG 60 74.560 -12.347 -7.166 448 HB2 ARG 60 HB2 ARG 60 73.988 -10.079 -5.244 449 HB3 ARG 60 HB3 ARG 60 75.132 -11.371 -4.913 450 HG2 ARG 60 HG2 ARG 60 76.542 -10.680 -6.721 451 HG3 ARG 60 HG3 ARG 60 75.329 -9.541 -7.295 452 HD2 ARG 60 HD2 ARG 60 77.100 -8.359 -6.126 453 HD3 ARG 60 HD3 ARG 60 75.591 -8.235 -5.231 454 HE ARG 60 HE ARG 60 76.983 -10.409 -4.227 455 HH11 ARG 60 HH11 ARG 60 77.526 -6.903 -4.461 456 HH12 ARG 60 HH12 ARG 60 78.374 -6.796 -2.979 457 HH21 ARG 60 HH21 ARG 60 78.163 -10.263 -2.193 458 HH22 ARG 60 HH22 ARG 60 78.761 -8.755 -1.685 459 H ALA 61 H ALA 61 71.475 -11.307 -5.914 460 HA ALA 61 HA ALA 61 71.196 -13.438 -4.034 461 HB1 ALA 61 HB1 ALA 61 68.877 -12.741 -3.892 462 HB2 ALA 61 HB2 ALA 61 69.066 -11.740 -5.331 463 HB3 ALA 61 HB3 ALA 61 69.936 -11.332 -3.851 464 H ALA 62 H ALA 62 70.106 -12.841 -7.325 465 HA ALA 62 HA ALA 62 68.573 -15.133 -7.694 466 HB1 ALA 62 HB1 ALA 62 70.170 -13.604 -9.741 467 HB2 ALA 62 HB2 ALA 62 68.540 -13.206 -9.199 468 HB3 ALA 62 HB3 ALA 62 68.838 -14.710 -10.072 469 H ALA 63 H ALA 63 71.989 -14.558 -8.387 470 HA ALA 63 HA ALA 63 72.451 -17.275 -9.198 471 HB1 ALA 63 HB1 ALA 63 73.815 -15.422 -10.067 472 HB2 ALA 63 HB2 ALA 63 74.810 -16.635 -9.263 473 HB3 ALA 63 HB3 ALA 63 74.430 -15.121 -8.442 474 H ASN 64 H ASN 64 73.221 -15.337 -6.373 475 HA ASN 64 HA ASN 64 73.856 -15.704 -4.309 476 HB2 ASN 64 HB2 ASN 64 71.527 -16.608 -4.252 477 HB3 ASN 64 HB3 ASN 64 72.196 -18.219 -4.465 478 HD21 ASN 64 HD21 ASN 64 70.630 -17.014 -2.288 479 HD22 ASN 64 HD22 ASN 64 71.553 -17.245 -0.849 480 HA PRO 65 HA PRO 65 77.300 -18.544 -4.959 481 HB2 PRO 65 HB2 PRO 65 78.990 -16.434 -3.917 482 HB3 PRO 65 HB3 PRO 65 78.974 -17.117 -5.543 483 HG2 PRO 65 HG2 PRO 65 78.171 -14.565 -4.963 484 HG3 PRO 65 HG3 PRO 65 77.577 -15.490 -6.349 485 HD2 PRO 65 HD2 PRO 65 76.268 -15.009 -3.695 486 HD3 PRO 65 HD3 PRO 65 75.559 -15.032 -5.326 487 H GLY 66 H GLY 66 77.626 -16.163 -2.282 488 HA2 GLY 66 HA2 GLY 66 77.641 -18.445 -0.432 489 HA3 GLY 66 HA3 GLY 66 78.872 -17.187 -0.347 490 H GLY 67 H GLY 67 75.465 -16.736 -1.024 491 HA2 GLY 67 HA2 GLY 67 73.768 -15.877 0.222 492 HA3 GLY 67 HA3 GLY 67 74.776 -16.036 1.648 493 H ASP 68 H ASP 68 76.708 -14.393 1.503 494 HA ASP 68 HA ASP 68 75.552 -11.928 2.023 495 HB2 ASP 68 HB2 ASP 68 78.445 -12.635 1.722 496 HB3 ASP 68 HB3 ASP 68 77.925 -10.986 2.052 497 H GLY 69 H GLY 69 75.040 -10.260 1.046 498 HA2 GLY 69 HA2 GLY 69 75.178 -8.543 -0.564 499 HA3 GLY 69 HA3 GLY 69 76.225 -9.574 -1.532 500 H GLY 70 H GLY 70 74.124 -11.747 -0.887 501 HA2 GLY 70 HA2 GLY 70 72.546 -11.165 -3.255 502 HA3 GLY 70 HA3 GLY 70 72.771 -12.742 -2.501 503 H GLY 71 H GLY 71 71.393 -9.544 -1.828 504 HA2 GLY 71 HA2 GLY 71 68.891 -10.034 -1.422 505 HA3 GLY 71 HA3 GLY 71 69.572 -10.720 0.051 506 HA PRO 72 HA PRO 72 68.803 -6.038 0.242 507 HB2 PRO 72 HB2 PRO 72 67.151 -6.218 2.433 508 HB3 PRO 72 HB3 PRO 72 66.635 -6.128 0.739 509 HG2 PRO 72 HG2 PRO 72 66.959 -8.532 2.483 510 HG3 PRO 72 HG3 PRO 72 65.641 -8.126 1.373 511 HD2 PRO 72 HD2 PRO 72 67.557 -9.860 0.669 512 HD3 PRO 72 HD3 PRO 72 66.940 -8.728 -0.538 513 H GLU 73 H GLU 73 69.240 -8.425 2.844 514 HA GLU 73 HA GLU 73 70.501 -6.476 4.404 515 HB2 GLU 73 HB2 GLU 73 70.418 -9.462 4.771 516 HB3 GLU 73 HB3 GLU 73 71.131 -8.337 5.919 517 HG2 GLU 73 HG2 GLU 73 68.897 -7.193 6.030 518 HG3 GLU 73 HG3 GLU 73 68.272 -8.493 5.064 519 H GLY 74 H GLY 74 71.662 -7.779 1.702 520 HA2 GLY 74 HA2 GLY 74 74.298 -7.414 2.820 521 HA3 GLY 74 HA3 GLY 74 74.059 -8.409 1.344 522 H ILE 75 H ILE 75 72.117 -5.746 1.200 523 HA ILE 75 HA ILE 75 73.896 -4.333 -0.598 524 HB ILE 75 HB ILE 75 71.449 -3.000 0.507 525 HG12 ILE 75 HG12 ILE 75 71.312 -5.502 -1.266 526 HG13 ILE 75 HG13 ILE 75 70.622 -5.179 0.266 527 HG21 ILE 75 HG21 ILE 75 71.238 -2.194 -1.735 528 HG22 ILE 75 HG22 ILE 75 72.527 -3.263 -2.290 529 HG23 ILE 75 HG23 ILE 75 72.890 -1.944 -1.171 530 HD11 ILE 75 HD11 ILE 75 69.023 -3.668 -0.525 531 HD12 ILE 75 HD12 ILE 75 68.956 -5.088 -1.552 532 HD13 ILE 75 HD13 ILE 75 69.751 -3.617 -2.129 533 H VAL 76 H VAL 76 72.361 -3.856 2.440 534 HA VAL 76 HA VAL 76 73.420 -1.468 3.385 535 HB VAL 76 HB VAL 76 71.624 -2.469 4.422 536 HG11 VAL 76 HG11 VAL 76 71.446 -4.453 3.937 537 HG12 VAL 76 HG12 VAL 76 71.701 -4.564 5.694 538 HG13 VAL 76 HG13 VAL 76 73.013 -4.969 4.571 539 HG21 VAL 76 HG21 VAL 76 73.877 -2.745 6.398 540 HG22 VAL 76 HG22 VAL 76 72.168 -2.642 6.824 541 HG23 VAL 76 HG23 VAL 76 72.974 -1.268 6.069 542 H LYS 77 H LYS 77 74.497 -4.632 3.764 543 HA LYS 77 HA LYS 77 76.786 -4.234 5.303 544 HB2 LYS 77 HB2 LYS 77 75.878 -6.439 4.955 545 HB3 LYS 77 HB3 LYS 77 76.255 -6.362 3.243 546 HG2 LYS 77 HG2 LYS 77 78.643 -6.351 3.763 547 HG3 LYS 77 HG3 LYS 77 78.260 -6.416 5.481 548 HD2 LYS 77 HD2 LYS 77 77.254 -8.441 3.546 549 HD3 LYS 77 HD3 LYS 77 78.828 -8.638 4.330 550 HE2 LYS 77 HE2 LYS 77 76.158 -8.342 5.728 551 HE3 LYS 77 HE3 LYS 77 77.004 -9.864 5.470 552 HZ1 LYS 77 HZ1 LYS 77 77.368 -9.066 7.674 553 HZ2 LYS 77 HZ2 LYS 77 77.956 -7.589 7.155 554 HZ3 LYS 77 HZ3 LYS 77 78.822 -9.004 6.844 555 H GLU 78 H GLU 78 76.379 -3.956 1.816 556 HA GLU 78 HA GLU 78 79.165 -3.601 1.255 557 HB2 GLU 78 HB2 GLU 78 77.120 -4.226 -0.307 558 HB3 GLU 78 HB3 GLU 78 76.982 -2.489 -0.501 559 HG2 GLU 78 HG2 GLU 78 78.273 -3.222 -2.296 560 HG3 GLU 78 HG3 GLU 78 79.427 -2.525 -1.156 561 H ILE 79 H ILE 79 76.426 -1.545 1.926 562 HA ILE 79 HA ILE 79 77.649 0.959 1.361 563 HB ILE 79 HB ILE 79 75.245 0.379 3.140 564 HG12 ILE 79 HG12 ILE 79 74.959 -0.315 0.736 565 HG13 ILE 79 HG13 ILE 79 73.885 1.003 1.214 566 HG21 ILE 79 HG21 ILE 79 76.135 3.012 2.024 567 HG22 ILE 79 HG22 ILE 79 76.243 2.498 3.704 568 HG23 ILE 79 HG23 ILE 79 74.662 2.691 2.948 569 HD11 ILE 79 HD11 ILE 79 74.744 1.362 -0.967 570 HD12 ILE 79 HD12 ILE 79 76.405 1.168 -0.404 571 HD13 ILE 79 HD13 ILE 79 75.447 2.558 0.123 572 H LYS 80 H LYS 80 77.385 -0.926 4.327 573 HA LYS 80 HA LYS 80 78.173 1.130 6.073 574 HB2 LYS 80 HB2 LYS 80 78.549 -0.585 7.758 575 HB3 LYS 80 HB3 LYS 80 77.129 -1.030 6.838 576 HG2 LYS 80 HG2 LYS 80 78.611 -2.539 5.487 577 HG3 LYS 80 HG3 LYS 80 79.851 -2.209 6.687 578 HD2 LYS 80 HD2 LYS 80 77.138 -3.346 7.322 579 HD3 LYS 80 HD3 LYS 80 78.597 -4.309 7.119 580 HE2 LYS 80 HE2 LYS 80 79.622 -3.082 9.005 581 HE3 LYS 80 HE3 LYS 80 78.122 -2.178 9.198 582 HZ1 LYS 80 HZ1 LYS 80 78.240 -4.011 10.737 583 HZ2 LYS 80 HZ2 LYS 80 78.411 -5.119 9.496 584 HZ3 LYS 80 HZ3 LYS 80 76.976 -4.257 9.673 585 H GLU 81 H GLU 81 80.077 -1.170 4.205 586 HA GLU 81 HA GLU 81 82.499 -0.441 5.463 587 HB2 GLU 81 HB2 GLU 81 82.128 -1.810 2.812 588 HB3 GLU 81 HB3 GLU 81 83.611 -1.758 3.756 589 HG2 GLU 81 HG2 GLU 81 82.323 -2.911 5.598 590 HG3 GLU 81 HG3 GLU 81 81.052 -3.178 4.407 591 H TRP 82 H TRP 82 80.850 0.589 2.560 592 HA TRP 82 HA TRP 82 82.955 2.153 1.461 593 HB2 TRP 82 HB2 TRP 82 80.761 1.441 0.310 594 HB3 TRP 82 HB3 TRP 82 80.070 2.768 1.268 595 HD1 TRP 82 HD1 TRP 82 82.747 2.289 -1.482 596 HE1 TRP 82 HE1 TRP 82 82.839 4.459 -2.879 597 HE3 TRP 82 HE3 TRP 82 79.505 5.147 1.237 598 HZ2 TRP 82 HZ2 TRP 82 81.679 6.993 -2.859 599 HZ3 TRP 82 HZ3 TRP 82 79.063 7.434 0.502 600 HH2 TRP 82 HH2 TRP 82 80.133 8.357 -1.495 601 H ARG 83 H ARG 83 80.172 2.879 3.474 602 HA ARG 83 HA ARG 83 80.456 5.656 3.601 603 HB2 ARG 83 HB2 ARG 83 78.547 3.951 4.546 604 HB3 ARG 83 HB3 ARG 83 79.604 4.176 5.951 605 HG2 ARG 83 HG2 ARG 83 77.968 5.743 6.287 606 HG3 ARG 83 HG3 ARG 83 79.420 6.529 5.658 607 HD2 ARG 83 HD2 ARG 83 78.427 6.766 3.454 608 HD3 ARG 83 HD3 ARG 83 76.988 5.897 3.994 609 HE ARG 83 HE ARG 83 77.031 7.820 5.778 610 HH11 ARG 83 HH11 ARG 83 77.162 8.145 2.202 611 HH12 ARG 83 HH12 ARG 83 76.813 9.811 2.284 612 HH21 ARG 83 HH21 ARG 83 76.504 10.068 5.741 613 HH22 ARG 83 HH22 ARG 83 76.395 10.885 4.252 614 H ALA 84 H ALA 84 81.609 3.032 5.705 615 HA ALA 84 HA ALA 84 82.906 4.621 7.611 616 HB1 ALA 84 HB1 ALA 84 83.995 2.553 8.303 617 HB2 ALA 84 HB2 ALA 84 83.486 1.775 6.802 618 HB3 ALA 84 HB3 ALA 84 82.282 2.279 7.978 619 H ALA 85 H ALA 85 84.161 2.974 4.707 620 HA ALA 85 HA ALA 85 86.850 3.714 5.048 621 HB1 ALA 85 HB1 ALA 85 85.388 3.101 2.485 622 HB2 ALA 85 HB2 ALA 85 86.140 1.913 3.551 623 HB3 ALA 85 HB3 ALA 85 87.137 3.095 2.704 624 H ASN 86 H ASN 86 84.213 5.263 3.349 625 HA ASN 86 HA ASN 86 85.738 7.382 2.220 626 HB2 ASN 86 HB2 ASN 86 83.360 6.645 1.584 627 HB3 ASN 86 HB3 ASN 86 82.824 7.555 2.992 628 HD21 ASN 86 HD21 ASN 86 83.714 7.704 -0.252 629 HD22 ASN 86 HD22 ASN 86 83.705 9.406 -0.452 630 H GLY 87 H GLY 87 84.285 6.778 5.298 631 HA2 GLY 87 HA2 GLY 87 84.838 7.812 7.305 632 HA3 GLY 87 HA3 GLY 87 85.532 9.154 6.400 633 H LYS 88 H LYS 88 82.296 7.767 5.841 634 HA LYS 88 HA LYS 88 81.183 10.365 6.367 635 HB2 LYS 88 HB2 LYS 88 80.657 8.032 4.620 636 HB3 LYS 88 HB3 LYS 88 79.342 9.088 5.059 637 HG2 LYS 88 HG2 LYS 88 80.483 10.956 3.963 638 HG3 LYS 88 HG3 LYS 88 81.884 9.929 3.663 639 HD2 LYS 88 HD2 LYS 88 80.609 8.501 2.202 640 HD3 LYS 88 HD3 LYS 88 79.122 9.357 2.599 641 HE2 LYS 88 HE2 LYS 88 81.477 10.698 1.337 642 HE3 LYS 88 HE3 LYS 88 80.260 9.912 0.353 643 HZ1 LYS 88 HZ1 LYS 88 79.744 12.257 0.552 644 HZ2 LYS 88 HZ2 LYS 88 79.897 12.228 2.219 645 HZ3 LYS 88 HZ3 LYS 88 78.601 11.471 1.497 646 HA PRO 89 HA PRO 89 79.059 8.368 9.804 647 HB2 PRO 89 HB2 PRO 89 76.720 10.050 9.319 648 HB3 PRO 89 HB3 PRO 89 77.833 10.079 10.687 649 HG2 PRO 89 HG2 PRO 89 77.704 12.057 8.817 650 HG3 PRO 89 HG3 PRO 89 79.154 11.671 9.747 651 HD2 PRO 89 HD2 PRO 89 78.484 11.019 6.923 652 HD3 PRO 89 HD3 PRO 89 80.052 11.396 7.669 653 H GLY 90 H GLY 90 78.121 6.452 9.605 654 HA2 GLY 90 HA2 GLY 90 76.352 6.025 7.333 655 HA3 GLY 90 HA3 GLY 90 77.147 4.766 8.272 656 H PHE 91 H PHE 91 75.750 3.609 9.232 657 HA PHE 91 HA PHE 91 73.041 4.472 9.613 658 HB2 PHE 91 HB2 PHE 91 74.312 1.882 10.506 659 HB3 PHE 91 HB3 PHE 91 72.607 2.209 10.249 660 HD1 PHE 91 HD1 PHE 91 72.180 3.239 7.736 661 HD2 PHE 91 HD2 PHE 91 75.309 0.581 8.907 662 HE1 PHE 91 HE1 PHE 91 72.397 2.455 5.445 663 HE2 PHE 91 HE2 PHE 91 75.511 -0.164 6.573 664 HZ PHE 91 HZ PHE 91 74.061 0.773 4.859 665 H LYS 92 H LYS 92 71.933 4.337 11.643 666 HA LYS 92 HA LYS 92 73.626 4.922 13.898 667 HB2 LYS 92 HB2 LYS 92 71.951 6.270 14.613 668 HB3 LYS 92 HB3 LYS 92 71.702 6.340 12.930 669 HG2 LYS 92 HG2 LYS 92 69.852 4.931 12.964 670 HG3 LYS 92 HG3 LYS 92 70.208 4.399 14.614 671 HD2 LYS 92 HD2 LYS 92 69.844 6.715 15.387 672 HD3 LYS 92 HD3 LYS 92 69.335 7.162 13.761 673 HE2 LYS 92 HE2 LYS 92 67.659 5.361 13.898 674 HE3 LYS 92 HE3 LYS 92 68.158 5.138 15.577 675 HZ1 LYS 92 HZ1 LYS 92 66.965 7.652 14.455 676 HZ2 LYS 92 HZ2 LYS 92 67.447 7.439 16.059 677 HZ3 LYS 92 HZ3 LYS 92 66.160 6.558 15.446 678 H GLN 93 H GLN 93 72.460 4.163 15.918 679 HA GLN 93 HA GLN 93 72.000 1.315 15.639 680 HB2 GLN 93 HB2 GLN 93 73.067 3.171 17.621 681 HB3 GLN 93 HB3 GLN 93 72.505 1.594 18.189 682 HG2 GLN 93 HG2 GLN 93 74.893 1.412 17.918 683 HG3 GLN 93 HG3 GLN 93 74.203 0.617 16.514 684 HE21 GLN 93 HE21 GLN 93 74.501 4.141 16.904 685 HE22 GLN 93 HE22 GLN 93 75.662 4.329 15.651 686 H GLY 94 H GLY 94 70.185 0.492 16.656 687 HA2 GLY 94 HA2 GLY 94 68.466 1.582 18.410 688 HA3 GLY 94 HA3 GLY 94 67.966 2.258 16.857 Start of MODEL 2 1 H GLU 2 H GLU 2 61.147 1.342 8.057 2 HA GLU 2 HA GLU 2 59.633 3.254 7.920 3 HB2 GLU 2 HB2 GLU 2 61.330 4.240 10.216 4 HB3 GLU 2 HB3 GLU 2 60.146 5.185 9.336 5 HG2 GLU 2 HG2 GLU 2 58.357 3.838 10.197 6 HG3 GLU 2 HG3 GLU 2 59.503 2.751 10.983 7 H LEU 3 H LEU 3 60.269 5.010 6.655 8 HA LEU 3 HA LEU 3 63.002 4.811 5.691 9 HB2 LEU 3 HB2 LEU 3 60.678 6.445 4.644 10 HB3 LEU 3 HB3 LEU 3 62.227 6.233 3.859 11 HG LEU 3 HG LEU 3 60.106 4.151 4.271 12 HD11 LEU 3 HD11 LEU 3 59.650 5.694 2.408 13 HD12 LEU 3 HD12 LEU 3 60.058 4.098 1.795 14 HD13 LEU 3 HD13 LEU 3 61.249 5.382 1.744 15 HD21 LEU 3 HD21 LEU 3 62.230 3.099 4.591 16 HD22 LEU 3 HD22 LEU 3 62.886 3.887 3.165 17 HD23 LEU 3 HD23 LEU 3 61.628 2.650 2.991 18 H LYS 4 H LYS 4 64.463 6.302 6.206 19 HA LYS 4 HA LYS 4 63.600 8.572 7.853 20 HB2 LYS 4 HB2 LYS 4 66.438 7.710 7.442 21 HB3 LYS 4 HB3 LYS 4 65.728 8.569 8.803 22 HG2 LYS 4 HG2 LYS 4 65.559 5.654 8.103 23 HG3 LYS 4 HG3 LYS 4 66.384 6.343 9.477 24 HD2 LYS 4 HD2 LYS 4 63.947 7.203 9.994 25 HD3 LYS 4 HD3 LYS 4 63.524 5.842 8.982 26 HE2 LYS 4 HE2 LYS 4 65.090 4.404 10.327 27 HE3 LYS 4 HE3 LYS 4 65.230 5.727 11.450 28 HZ1 LYS 4 HZ1 LYS 4 62.950 3.983 10.934 29 HZ2 LYS 4 HZ2 LYS 4 62.666 5.531 11.606 30 HZ3 LYS 4 HZ3 LYS 4 63.633 4.410 12.406 31 H ASN 5 H ASN 5 64.989 10.593 7.502 32 HA ASN 5 HA ASN 5 65.019 11.224 4.681 33 HB2 ASN 5 HB2 ASN 5 64.205 12.898 6.337 34 HB3 ASN 5 HB3 ASN 5 65.821 12.976 7.021 35 HD21 ASN 5 HD21 ASN 5 63.856 13.761 4.267 36 HD22 ASN 5 HD22 ASN 5 64.952 14.874 3.531 37 H SER 6 H SER 6 67.284 10.402 7.127 38 HA SER 6 HA SER 6 69.428 10.629 5.184 39 HB2 SER 6 HB2 SER 6 70.889 11.268 7.121 40 HB3 SER 6 HB3 SER 6 69.800 12.521 6.519 41 HG SER 6 HG SER 6 69.923 11.398 8.977 42 H ILE 7 H ILE 7 71.307 9.357 5.794 43 HA ILE 7 HA ILE 7 70.653 6.643 6.302 44 HB ILE 7 HB ILE 7 72.489 7.593 4.851 45 HG12 ILE 7 HG12 ILE 7 74.214 5.769 5.544 46 HG13 ILE 7 HG13 ILE 7 72.985 5.328 6.733 47 HG21 ILE 7 HG21 ILE 7 73.479 9.187 6.328 48 HG22 ILE 7 HG22 ILE 7 74.693 8.009 5.834 49 HG23 ILE 7 HG23 ILE 7 73.970 7.910 7.439 50 HD11 ILE 7 HD11 ILE 7 72.809 4.019 4.718 51 HD12 ILE 7 HD12 ILE 7 72.638 5.490 3.771 52 HD13 ILE 7 HD13 ILE 7 71.373 5.033 4.923 53 H SER 8 H SER 8 71.349 9.276 8.336 54 HA SER 8 HA SER 8 72.874 7.998 10.337 55 HB2 SER 8 HB2 SER 8 72.485 10.266 11.426 56 HB3 SER 8 HB3 SER 8 73.274 10.248 9.837 57 HG SER 8 HG SER 8 71.722 11.794 9.931 58 H ASP 9 H ASP 9 69.538 8.219 9.668 59 HA ASP 9 HA ASP 9 68.869 7.676 12.491 60 HB2 ASP 9 HB2 ASP 9 67.598 9.443 10.904 61 HB3 ASP 9 HB3 ASP 9 66.826 8.004 10.352 62 H TYR 10 H TYR 10 69.888 6.080 9.995 63 HA TYR 10 HA TYR 10 67.825 4.001 9.870 64 HB2 TYR 10 HB2 TYR 10 69.974 4.872 8.004 65 HB3 TYR 10 HB3 TYR 10 69.637 3.155 8.081 66 HD1 TYR 10 HD1 TYR 10 67.353 2.351 7.523 67 HD2 TYR 10 HD2 TYR 10 68.568 6.346 6.789 68 HE1 TYR 10 HE1 TYR 10 65.517 2.593 5.913 69 HE2 TYR 10 HE2 TYR 10 66.718 6.609 5.182 70 HH TYR 10 HH TYR 10 65.180 5.322 3.854 71 H THR 11 H THR 11 68.161 2.339 11.242 72 HA THR 11 HA THR 11 70.846 1.664 11.999 73 HB THR 11 HB THR 11 69.799 -0.371 12.987 74 HG1 THR 11 HG1 THR 11 67.507 -0.544 12.887 75 HG21 THR 11 HG21 THR 11 68.273 0.692 14.623 76 HG22 THR 11 HG22 THR 11 68.288 2.164 13.646 77 HG23 THR 11 HG23 THR 11 69.774 1.580 14.402 78 H GLU 12 H GLU 12 71.674 -0.533 11.257 79 HA GLU 12 HA GLU 12 71.451 -0.678 8.499 80 HB2 GLU 12 HB2 GLU 12 72.581 -2.965 8.770 81 HB3 GLU 12 HB3 GLU 12 73.446 -1.547 9.340 82 HG2 GLU 12 HG2 GLU 12 72.834 -2.021 11.578 83 HG3 GLU 12 HG3 GLU 12 71.861 -3.397 11.122 84 H ALA 13 H ALA 13 69.641 -2.353 10.974 85 HA ALA 13 HA ALA 13 68.254 -4.087 9.183 86 HB1 ALA 13 HB1 ALA 13 67.454 -3.147 11.929 87 HB2 ALA 13 HB2 ALA 13 68.417 -4.582 11.558 88 HB3 ALA 13 HB3 ALA 13 66.735 -4.493 11.051 89 H GLU 14 H GLU 14 67.419 -0.825 10.487 90 HA GLU 14 HA GLU 14 64.869 -0.584 9.295 91 HB2 GLU 14 HB2 GLU 14 67.006 1.399 10.002 92 HB3 GLU 14 HB3 GLU 14 65.622 1.958 9.093 93 HG2 GLU 14 HG2 GLU 14 65.506 0.602 11.782 94 HG3 GLU 14 HG3 GLU 14 65.457 2.344 11.520 95 H PHE 15 H PHE 15 68.058 -0.174 8.094 96 HA PHE 15 HA PHE 15 67.274 0.843 5.583 97 HB2 PHE 15 HB2 PHE 15 69.462 1.216 6.773 98 HB3 PHE 15 HB3 PHE 15 69.889 -0.425 6.324 99 HD1 PHE 15 HD1 PHE 15 68.799 2.800 4.848 100 HD2 PHE 15 HD2 PHE 15 70.935 -0.802 4.374 101 HE1 PHE 15 HE1 PHE 15 69.730 3.631 2.720 102 HE2 PHE 15 HE2 PHE 15 71.864 0.012 2.242 103 HZ PHE 15 HZ PHE 15 71.248 2.234 1.435 104 H VAL 16 H VAL 16 68.159 -2.409 6.815 105 HA VAL 16 HA VAL 16 68.094 -3.595 4.275 106 HB VAL 16 HB VAL 16 68.060 -5.758 5.191 107 HG11 VAL 16 HG11 VAL 16 69.737 -5.820 6.918 108 HG12 VAL 16 HG12 VAL 16 69.619 -4.058 7.011 109 HG13 VAL 16 HG13 VAL 16 70.080 -4.841 5.495 110 HG21 VAL 16 HG21 VAL 16 67.029 -4.649 7.750 111 HG22 VAL 16 HG22 VAL 16 67.563 -6.335 7.457 112 HG23 VAL 16 HG23 VAL 16 66.191 -5.661 6.565 113 H GLN 17 H GLN 17 65.490 -2.786 6.455 114 HA GLN 17 HA GLN 17 63.387 -4.216 5.334 115 HB2 GLN 17 HB2 GLN 17 63.254 -2.852 7.372 116 HB3 GLN 17 HB3 GLN 17 63.532 -1.400 6.420 117 HG2 GLN 17 HG2 GLN 17 61.531 -2.084 5.107 118 HG3 GLN 17 HG3 GLN 17 61.203 -3.214 6.431 119 HE21 GLN 17 HE21 GLN 17 59.748 -0.911 5.451 120 HE22 GLN 17 HE22 GLN 17 59.490 0.145 6.802 121 H LEU 18 H LEU 18 64.691 -1.029 4.609 122 HA LEU 18 HA LEU 18 63.097 -0.385 2.409 123 HB2 LEU 18 HB2 LEU 18 64.361 1.228 3.496 124 HB3 LEU 18 HB3 LEU 18 65.873 0.496 3.254 125 HG LEU 18 HG LEU 18 65.525 0.806 0.744 126 HD11 LEU 18 HD11 LEU 18 64.033 2.569 0.026 127 HD12 LEU 18 HD12 LEU 18 63.351 2.654 1.651 128 HD13 LEU 18 HD13 LEU 18 63.170 1.184 0.691 129 HD21 LEU 18 HD21 LEU 18 67.071 2.152 1.983 130 HD22 LEU 18 HD22 LEU 18 65.771 3.265 2.451 131 HD23 LEU 18 HD23 LEU 18 66.248 3.107 0.751 132 H LEU 19 H LEU 19 66.190 -1.847 2.664 133 HA LEU 19 HA LEU 19 66.938 -2.271 0.002 134 HB2 LEU 19 HB2 LEU 19 67.331 -3.682 2.483 135 HB3 LEU 19 HB3 LEU 19 68.230 -4.183 1.023 136 HG LEU 19 HG LEU 19 68.373 -1.681 2.681 137 HD11 LEU 19 HD11 LEU 19 69.814 -3.366 3.387 138 HD12 LEU 19 HD12 LEU 19 70.768 -2.155 2.500 139 HD13 LEU 19 HD13 LEU 19 70.326 -3.677 1.738 140 HD21 LEU 19 HD21 LEU 19 69.423 -2.010 -0.105 141 HD22 LEU 19 HD22 LEU 19 69.881 -0.740 1.038 142 HD23 LEU 19 HD23 LEU 19 68.214 -0.843 0.473 143 H LYS 20 H LYS 20 65.119 -4.384 2.168 144 HA LYS 20 HA LYS 20 64.705 -6.534 0.427 145 HB2 LYS 20 HB2 LYS 20 62.996 -5.458 2.650 146 HB3 LYS 20 HB3 LYS 20 62.671 -6.963 1.825 147 HG2 LYS 20 HG2 LYS 20 64.849 -7.807 2.599 148 HG3 LYS 20 HG3 LYS 20 65.096 -6.288 3.462 149 HD2 LYS 20 HD2 LYS 20 63.095 -6.690 4.768 150 HD3 LYS 20 HD3 LYS 20 62.822 -8.212 3.920 151 HE2 LYS 20 HE2 LYS 20 65.026 -8.988 4.757 152 HE3 LYS 20 HE3 LYS 20 65.152 -7.494 5.684 153 HZ1 LYS 20 HZ1 LYS 20 64.332 -9.252 7.054 154 HZ2 LYS 20 HZ2 LYS 20 63.079 -9.579 5.975 155 HZ3 LYS 20 HZ3 LYS 20 63.096 -8.116 6.832 156 H GLU 21 H GLU 21 62.808 -3.665 1.129 157 HA GLU 21 HA GLU 21 60.710 -4.319 -0.580 158 HB2 GLU 21 HB2 GLU 21 61.489 -1.658 0.599 159 HB3 GLU 21 HB3 GLU 21 59.999 -1.951 -0.285 160 HG2 GLU 21 HG2 GLU 21 59.420 -3.697 1.410 161 HG3 GLU 21 HG3 GLU 21 60.832 -3.182 2.332 162 H ILE 22 H ILE 22 63.612 -2.350 -1.050 163 HA ILE 22 HA ILE 22 62.956 -1.392 -3.575 164 HB ILE 22 HB ILE 22 65.756 -2.117 -2.640 165 HG12 ILE 22 HG12 ILE 22 64.219 0.469 -2.406 166 HG13 ILE 22 HG13 ILE 22 64.627 -0.594 -1.071 167 HG21 ILE 22 HG21 ILE 22 65.492 -1.719 -5.047 168 HG22 ILE 22 HG22 ILE 22 66.421 -0.442 -4.250 169 HG23 ILE 22 HG23 ILE 22 64.739 -0.156 -4.699 170 HD11 ILE 22 HD11 ILE 22 66.118 1.339 -1.177 171 HD12 ILE 22 HD12 ILE 22 66.613 0.866 -2.801 172 HD13 ILE 22 HD13 ILE 22 66.998 -0.169 -1.426 173 H GLU 23 H GLU 23 64.588 -4.430 -2.645 174 HA GLU 23 HA GLU 23 65.209 -5.410 -5.194 175 HB2 GLU 23 HB2 GLU 23 64.212 -6.880 -2.787 176 HB3 GLU 23 HB3 GLU 23 64.793 -7.704 -4.201 177 HG2 GLU 23 HG2 GLU 23 67.004 -6.503 -3.766 178 HG3 GLU 23 HG3 GLU 23 66.266 -6.055 -2.202 179 H LYS 24 H LYS 24 62.343 -5.667 -3.280 180 HA LYS 24 HA LYS 24 60.889 -7.455 -4.826 181 HB2 LYS 24 HB2 LYS 24 60.431 -7.044 -2.536 182 HB3 LYS 24 HB3 LYS 24 60.044 -5.363 -2.848 183 HG2 LYS 24 HG2 LYS 24 58.015 -6.597 -2.487 184 HG3 LYS 24 HG3 LYS 24 58.105 -6.089 -4.173 185 HD2 LYS 24 HD2 LYS 24 58.856 -8.326 -4.812 186 HD3 LYS 24 HD3 LYS 24 58.791 -8.840 -3.123 187 HE2 LYS 24 HE2 LYS 24 56.464 -7.917 -4.815 188 HE3 LYS 24 HE3 LYS 24 56.807 -9.571 -4.311 189 HZ1 LYS 24 HZ1 LYS 24 56.186 -7.313 -2.503 190 HZ2 LYS 24 HZ2 LYS 24 56.500 -8.896 -2.024 191 HZ3 LYS 24 HZ3 LYS 24 55.123 -8.550 -2.922 192 H GLU 25 H GLU 25 60.804 -3.858 -4.832 193 HA GLU 25 HA GLU 25 58.888 -4.070 -6.956 194 HB2 GLU 25 HB2 GLU 25 58.805 -1.495 -6.822 195 HB3 GLU 25 HB3 GLU 25 58.227 -2.372 -5.389 196 HG2 GLU 25 HG2 GLU 25 59.434 -0.529 -4.662 197 HG3 GLU 25 HG3 GLU 25 60.594 -1.863 -4.518 198 H ASN 26 H ASN 26 62.268 -3.336 -6.644 199 HA ASN 26 HA ASN 26 62.640 -2.177 -9.172 200 HB2 ASN 26 HB2 ASN 26 64.356 -2.131 -7.359 201 HB3 ASN 26 HB3 ASN 26 64.644 -3.844 -7.628 202 HD21 ASN 26 HD21 ASN 26 64.099 -1.382 -10.102 203 HD22 ASN 26 HD22 ASN 26 65.661 -1.501 -10.826 204 H VAL 27 H VAL 27 62.797 -5.585 -8.148 205 HA VAL 27 HA VAL 27 63.563 -6.458 -10.752 206 HB VAL 27 HB VAL 27 63.163 -8.753 -10.028 207 HG11 VAL 27 HG11 VAL 27 65.259 -7.762 -9.413 208 HG12 VAL 27 HG12 VAL 27 64.714 -8.837 -8.123 209 HG13 VAL 27 HG13 VAL 27 64.550 -7.091 -7.944 210 HG21 VAL 27 HG21 VAL 27 62.349 -9.266 -7.761 211 HG22 VAL 27 HG22 VAL 27 61.120 -8.446 -8.729 212 HG23 VAL 27 HG23 VAL 27 62.016 -7.554 -7.503 213 H ALA 28 H ALA 28 60.551 -5.715 -9.353 214 HA ALA 28 HA ALA 28 59.040 -7.111 -11.409 215 HB1 ALA 28 HB1 ALA 28 58.119 -5.200 -9.266 216 HB2 ALA 28 HB2 ALA 28 58.148 -6.955 -9.130 217 HB3 ALA 28 HB3 ALA 28 57.076 -6.176 -10.298 218 H ALA 29 H ALA 29 60.384 -4.071 -10.711 219 HA ALA 29 HA ALA 29 60.633 -2.149 -11.710 220 HB1 ALA 29 HB1 ALA 29 59.398 -3.352 -14.195 221 HB2 ALA 29 HB2 ALA 29 61.108 -3.436 -13.784 222 HB3 ALA 29 HB3 ALA 29 60.358 -1.873 -14.111 223 H THR 30 H THR 30 59.311 -1.116 -10.321 224 HA THR 30 HA THR 30 56.579 -0.708 -11.218 225 HB THR 30 HB THR 30 56.181 0.290 -9.012 226 HG1 THR 30 HG1 THR 30 58.867 -0.160 -8.073 227 HG21 THR 30 HG21 THR 30 57.824 -2.197 -8.778 228 HG22 THR 30 HG22 THR 30 56.097 -2.138 -9.156 229 HG23 THR 30 HG23 THR 30 56.683 -1.612 -7.565 230 H ASP 31 H ASP 31 56.598 2.007 -9.897 231 HA ASP 31 HA ASP 31 58.452 3.394 -11.653 232 HB2 ASP 31 HB2 ASP 31 56.501 3.186 -13.051 233 HB3 ASP 31 HB3 ASP 31 55.497 3.813 -11.749 234 H ASP 32 H ASP 32 55.679 4.196 -9.633 235 HA ASP 32 HA ASP 32 56.797 6.688 -8.919 236 HB2 ASP 32 HB2 ASP 32 54.358 6.216 -8.950 237 HB3 ASP 32 HB3 ASP 32 54.578 5.200 -7.530 238 H VAL 33 H VAL 33 56.538 3.608 -7.238 239 HA VAL 33 HA VAL 33 57.892 4.756 -4.941 240 HB VAL 33 HB VAL 33 56.122 3.068 -4.633 241 HG11 VAL 33 HG11 VAL 33 56.561 1.545 -6.418 242 HG12 VAL 33 HG12 VAL 33 56.625 0.679 -4.872 243 HG13 VAL 33 HG13 VAL 33 58.120 1.130 -5.701 244 HG21 VAL 33 HG21 VAL 33 57.640 3.496 -2.812 245 HG22 VAL 33 HG22 VAL 33 58.775 2.302 -3.447 246 HG23 VAL 33 HG23 VAL 33 57.205 1.787 -2.839 247 H LEU 34 H LEU 34 58.621 2.882 -7.651 248 HA LEU 34 HA LEU 34 61.203 1.869 -7.110 249 HB2 LEU 34 HB2 LEU 34 59.800 1.249 -8.970 250 HB3 LEU 34 HB3 LEU 34 59.790 2.813 -9.609 251 HG LEU 34 HG LEU 34 61.094 1.178 -10.929 252 HD11 LEU 34 HD11 LEU 34 61.614 3.436 -11.228 253 HD12 LEU 34 HD12 LEU 34 63.104 2.474 -11.296 254 HD13 LEU 34 HD13 LEU 34 62.718 3.422 -9.851 255 HD21 LEU 34 HD21 LEU 34 63.250 0.363 -10.146 256 HD22 LEU 34 HD22 LEU 34 61.928 -0.192 -9.114 257 HD23 LEU 34 HD23 LEU 34 62.970 1.122 -8.579 258 H ASP 35 H ASP 35 60.264 4.948 -8.631 259 HA ASP 35 HA ASP 35 62.941 5.841 -8.469 260 HB2 ASP 35 HB2 ASP 35 60.381 7.042 -9.333 261 HB3 ASP 35 HB3 ASP 35 61.710 8.110 -8.926 262 H VAL 36 H VAL 36 60.435 5.839 -6.172 263 HA VAL 36 HA VAL 36 61.608 7.926 -4.574 264 HB VAL 36 HB VAL 36 60.156 5.447 -3.630 265 HG11 VAL 36 HG11 VAL 36 60.714 8.034 -2.248 266 HG12 VAL 36 HG12 VAL 36 61.496 6.469 -1.975 267 HG13 VAL 36 HG13 VAL 36 59.768 6.668 -1.602 268 HG21 VAL 36 HG21 VAL 36 58.311 6.773 -3.291 269 HG22 VAL 36 HG22 VAL 36 58.782 6.672 -5.016 270 HG23 VAL 36 HG23 VAL 36 59.095 8.175 -4.067 271 H LEU 37 H LEU 37 61.780 4.445 -4.657 272 HA LEU 37 HA LEU 37 63.396 4.380 -2.372 273 HB2 LEU 37 HB2 LEU 37 63.080 2.171 -4.325 274 HB3 LEU 37 HB3 LEU 37 63.587 2.207 -2.643 275 HG LEU 37 HG LEU 37 60.776 2.781 -3.509 276 HD11 LEU 37 HD11 LEU 37 60.202 0.740 -2.301 277 HD12 LEU 37 HD12 LEU 37 61.910 0.448 -1.988 278 HD13 LEU 37 HD13 LEU 37 61.299 0.420 -3.644 279 HD21 LEU 37 HD21 LEU 37 61.994 2.694 -0.747 280 HD22 LEU 37 HD22 LEU 37 60.277 2.861 -1.108 281 HD23 LEU 37 HD23 LEU 37 61.402 4.131 -1.583 282 H LEU 38 H LEU 38 64.015 3.964 -5.732 283 HA LEU 38 HA LEU 38 66.695 3.299 -5.482 284 HB2 LEU 38 HB2 LEU 38 65.120 4.642 -7.616 285 HB3 LEU 38 HB3 LEU 38 66.791 4.174 -7.902 286 HG LEU 38 HG LEU 38 64.272 2.595 -7.682 287 HD11 LEU 38 HD11 LEU 38 65.120 3.291 -9.831 288 HD12 LEU 38 HD12 LEU 38 65.159 1.520 -9.650 289 HD13 LEU 38 HD13 LEU 38 66.635 2.467 -9.447 290 HD21 LEU 38 HD21 LEU 38 65.707 1.486 -6.056 291 HD22 LEU 38 HD22 LEU 38 67.007 1.401 -7.250 292 HD23 LEU 38 HD23 LEU 38 65.515 0.498 -7.502 293 H GLU 39 H GLU 39 65.150 6.480 -5.799 294 HA GLU 39 HA GLU 39 67.646 7.832 -5.700 295 HB2 GLU 39 HB2 GLU 39 64.828 8.675 -5.338 296 HB3 GLU 39 HB3 GLU 39 66.201 9.746 -5.084 297 HG2 GLU 39 HG2 GLU 39 65.451 8.339 -7.648 298 HG3 GLU 39 HG3 GLU 39 65.255 10.055 -7.247 299 H HIS 40 H HIS 40 65.195 6.993 -3.362 300 HA HIS 40 HA HIS 40 66.028 8.548 -1.261 301 HB2 HIS 40 HB2 HIS 40 63.891 7.311 -1.407 302 HB3 HIS 40 HB3 HIS 40 64.729 5.810 -1.176 303 HD1 HIS 40 HD1 HIS 40 62.885 8.252 0.683 304 HD2 HIS 40 HD2 HIS 40 66.099 5.757 1.468 305 HE1 HIS 40 HE1 HIS 40 63.035 8.072 3.171 306 H PHE 41 H PHE 41 66.817 5.291 -2.170 307 HA PHE 41 HA PHE 41 68.544 4.627 -0.105 308 HB2 PHE 41 HB2 PHE 41 67.648 2.943 -1.456 309 HB3 PHE 41 HB3 PHE 41 68.142 3.745 -2.933 310 HD1 PHE 41 HD1 PHE 41 69.392 1.958 0.047 311 HD2 PHE 41 HD2 PHE 41 70.133 3.150 -3.950 312 HE1 PHE 41 HE1 PHE 41 71.403 0.528 -0.003 313 HE2 PHE 41 HE2 PHE 41 72.129 1.753 -3.994 314 HZ PHE 41 HZ PHE 41 72.773 0.433 -2.037 315 H VAL 42 H VAL 42 69.270 5.900 -3.325 316 HA VAL 42 HA VAL 42 72.020 6.152 -2.684 317 HB VAL 42 HB VAL 42 71.271 5.719 -4.921 318 HG11 VAL 42 HG11 VAL 42 70.240 8.478 -5.046 319 HG12 VAL 42 HG12 VAL 42 69.388 6.902 -5.121 320 HG13 VAL 42 HG13 VAL 42 70.529 7.340 -6.390 321 HG21 VAL 42 HG21 VAL 42 72.896 8.208 -4.662 322 HG22 VAL 42 HG22 VAL 42 72.793 7.222 -6.121 323 HG23 VAL 42 HG23 VAL 42 73.490 6.550 -4.644 324 H LYS 43 H LYS 43 69.501 8.393 -2.351 325 HA LYS 43 HA LYS 43 71.287 10.631 -1.965 326 HB2 LYS 43 HB2 LYS 43 69.396 11.908 -1.198 327 HB3 LYS 43 HB3 LYS 43 68.797 10.853 -2.463 328 HG2 LYS 43 HG2 LYS 43 68.003 9.256 -0.598 329 HG3 LYS 43 HG3 LYS 43 68.478 10.516 0.495 330 HD2 LYS 43 HD2 LYS 43 66.505 11.039 -1.697 331 HD3 LYS 43 HD3 LYS 43 66.026 10.458 -0.110 332 HE2 LYS 43 HE2 LYS 43 67.523 13.007 -0.696 333 HE3 LYS 43 HE3 LYS 43 65.816 12.884 -0.290 334 HZ1 LYS 43 HZ1 LYS 43 66.546 11.882 1.880 335 HZ2 LYS 43 HZ2 LYS 43 66.957 13.493 1.645 336 HZ3 LYS 43 HZ3 LYS 43 68.141 12.314 1.473 337 H ILE 44 H ILE 44 70.070 8.231 0.265 338 HA ILE 44 HA ILE 44 71.179 9.688 2.527 339 HB ILE 44 HB ILE 44 70.412 7.732 3.874 340 HG12 ILE 44 HG12 ILE 44 69.414 6.738 1.194 341 HG13 ILE 44 HG13 ILE 44 70.620 5.960 2.203 342 HG21 ILE 44 HG21 ILE 44 68.955 9.668 3.482 343 HG22 ILE 44 HG22 ILE 44 68.027 8.176 3.616 344 HG23 ILE 44 HG23 ILE 44 68.322 8.889 2.031 345 HD11 ILE 44 HD11 ILE 44 68.379 4.906 2.266 346 HD12 ILE 44 HD12 ILE 44 67.756 6.390 2.985 347 HD13 ILE 44 HD13 ILE 44 68.960 5.436 3.847 348 H THR 45 H THR 45 72.065 7.014 0.466 349 HA THR 45 HA THR 45 74.327 6.307 2.112 350 HB THR 45 HB THR 45 74.854 4.721 0.297 351 HG1 THR 45 HG1 THR 45 72.435 5.308 -0.976 352 HG21 THR 45 HG21 THR 45 71.932 4.707 1.041 353 HG22 THR 45 HG22 THR 45 73.233 4.129 2.071 354 HG23 THR 45 HG23 THR 45 72.892 3.313 0.541 355 H GLU 46 H GLU 46 73.614 8.097 -0.796 356 HA GLU 46 HA GLU 46 74.673 9.430 -2.170 357 HB2 GLU 46 HB2 GLU 46 76.544 9.569 0.120 358 HB3 GLU 46 HB3 GLU 46 76.703 10.653 -1.283 359 HG2 GLU 46 HG2 GLU 46 74.418 11.440 -0.720 360 HG3 GLU 46 HG3 GLU 46 74.454 10.390 0.680 361 H HIS 47 H HIS 47 75.145 6.616 -2.087 362 HA HIS 47 HA HIS 47 77.854 6.100 -2.783 363 HB2 HIS 47 HB2 HIS 47 76.064 4.438 -1.869 364 HB3 HIS 47 HB3 HIS 47 75.504 4.348 -3.534 365 HD1 HIS 47 HD1 HIS 47 76.967 2.889 -5.177 366 HD2 HIS 47 HD2 HIS 47 78.546 3.325 -1.372 367 HE1 HIS 47 HE1 HIS 47 79.008 1.424 -5.084 368 HA PRO 48 HA PRO 48 77.415 7.754 -6.987 369 HB2 PRO 48 HB2 PRO 48 79.596 5.916 -7.602 370 HB3 PRO 48 HB3 PRO 48 79.542 7.674 -7.793 371 HG2 PRO 48 HG2 PRO 48 80.978 6.375 -6.011 372 HG3 PRO 48 HG3 PRO 48 80.208 7.916 -5.511 373 HD2 PRO 48 HD2 PRO 48 79.448 5.069 -4.979 374 HD3 PRO 48 HD3 PRO 48 79.374 6.467 -3.889 375 H ASP 49 H ASP 49 77.080 4.604 -6.104 376 HA ASP 49 HA ASP 49 76.572 3.804 -8.777 377 HB2 ASP 49 HB2 ASP 49 77.909 2.060 -6.679 378 HB3 ASP 49 HB3 ASP 49 77.531 1.555 -8.309 379 H GLY 50 H GLY 50 74.957 4.800 -6.612 380 HA2 GLY 50 HA2 GLY 50 73.809 3.184 -4.634 381 HA3 GLY 50 HA3 GLY 50 73.024 4.468 -5.505 382 H THR 51 H THR 51 72.599 3.685 -7.774 383 HA THR 51 HA THR 51 70.536 1.837 -7.106 384 HB THR 51 HB THR 51 70.789 2.632 -9.955 385 HG1 THR 51 HG1 THR 51 69.691 4.675 -8.609 386 HG21 THR 51 HG21 THR 51 68.584 2.767 -7.862 387 HG22 THR 51 HG22 THR 51 68.826 1.442 -8.966 388 HG23 THR 51 HG23 THR 51 68.412 3.050 -9.586 389 H ALA 52 H ALA 52 73.535 1.728 -8.811 390 HA ALA 52 HA ALA 52 73.239 -0.772 -10.145 391 HB1 ALA 52 HB1 ALA 52 75.765 0.524 -9.129 392 HB2 ALA 52 HB2 ALA 52 75.026 0.846 -10.697 393 HB3 ALA 52 HB3 ALA 52 75.653 -0.759 -10.335 394 H LEU 53 H LEU 53 74.245 0.108 -6.909 395 HA LEU 53 HA LEU 53 74.980 -2.494 -6.097 396 HB2 LEU 53 HB2 LEU 53 73.811 -0.294 -4.438 397 HB3 LEU 53 HB3 LEU 53 74.427 -1.796 -3.792 398 HG LEU 53 HG LEU 53 75.943 0.460 -5.060 399 HD11 LEU 53 HD11 LEU 53 77.157 0.388 -2.974 400 HD12 LEU 53 HD12 LEU 53 76.131 -0.940 -2.428 401 HD13 LEU 53 HD13 LEU 53 75.430 0.650 -2.750 402 HD21 LEU 53 HD21 LEU 53 77.976 -0.918 -4.847 403 HD22 LEU 53 HD22 LEU 53 76.861 -1.567 -6.043 404 HD23 LEU 53 HD23 LEU 53 76.974 -2.315 -4.449 405 H ILE 54 H ILE 54 71.870 -0.963 -6.238 406 HA ILE 54 HA ILE 54 70.486 -3.094 -4.877 407 HB ILE 54 HB ILE 54 69.460 -1.008 -6.816 408 HG12 ILE 54 HG12 ILE 54 68.674 -1.213 -3.972 409 HG13 ILE 54 HG13 ILE 54 70.239 -0.514 -4.270 410 HG21 ILE 54 HG21 ILE 54 68.069 -2.995 -6.974 411 HG22 ILE 54 HG22 ILE 54 67.211 -1.659 -6.214 412 HG23 ILE 54 HG23 ILE 54 67.836 -2.981 -5.223 413 HD11 ILE 54 HD11 ILE 54 69.193 1.185 -5.671 414 HD12 ILE 54 HD12 ILE 54 68.460 1.162 -4.066 415 HD13 ILE 54 HD13 ILE 54 67.632 0.425 -5.444 416 H TYR 55 H TYR 55 71.016 -2.234 -8.210 417 HA TYR 55 HA TYR 55 69.688 -4.345 -9.385 418 HB2 TYR 55 HB2 TYR 55 71.804 -2.478 -10.252 419 HB3 TYR 55 HB3 TYR 55 71.458 -3.844 -11.284 420 HD1 TYR 55 HD1 TYR 55 69.012 -4.118 -12.067 421 HD2 TYR 55 HD2 TYR 55 70.459 -0.560 -10.259 422 HE1 TYR 55 HE1 TYR 55 67.084 -2.879 -12.962 423 HE2 TYR 55 HE2 TYR 55 68.542 0.682 -11.145 424 HH TYR 55 HH TYR 55 66.932 0.523 -12.918 425 H GLU 56 H GLU 56 73.122 -4.153 -8.451 426 HA GLU 56 HA GLU 56 73.583 -6.803 -9.344 427 HB2 GLU 56 HB2 GLU 56 75.636 -6.730 -7.904 428 HB3 GLU 56 HB3 GLU 56 75.570 -5.523 -9.189 429 HG2 GLU 56 HG2 GLU 56 75.135 -3.832 -7.695 430 HG3 GLU 56 HG3 GLU 56 74.725 -4.893 -6.372 431 H ALA 57 H ALA 57 72.699 -5.423 -6.207 432 HA ALA 57 HA ALA 57 73.011 -7.753 -4.710 433 HB1 ALA 57 HB1 ALA 57 72.641 -5.568 -3.697 434 HB2 ALA 57 HB2 ALA 57 71.484 -6.766 -3.108 435 HB3 ALA 57 HB3 ALA 57 70.984 -5.571 -4.304 436 H ALA 58 H ALA 58 70.288 -6.583 -6.589 437 HA ALA 58 HA ALA 58 68.458 -8.584 -5.999 438 HB1 ALA 58 HB1 ALA 58 67.900 -6.571 -7.293 439 HB2 ALA 58 HB2 ALA 58 67.406 -8.035 -8.144 440 HB3 ALA 58 HB3 ALA 58 68.862 -7.173 -8.641 441 H ALA 59 H ALA 59 71.057 -8.533 -8.390 442 HA ALA 59 HA ALA 59 70.489 -11.133 -9.442 443 HB1 ALA 59 HB1 ALA 59 72.659 -10.923 -10.566 444 HB2 ALA 59 HB2 ALA 59 73.033 -9.509 -9.580 445 HB3 ALA 59 HB3 ALA 59 71.711 -9.446 -10.744 446 H ARG 60 H ARG 60 72.721 -9.837 -7.081 447 HA ARG 60 HA ARG 60 74.158 -12.161 -6.479 448 HB2 ARG 60 HB2 ARG 60 73.586 -9.694 -4.820 449 HB3 ARG 60 HB3 ARG 60 74.707 -10.950 -4.308 450 HG2 ARG 60 HG2 ARG 60 76.154 -10.471 -6.142 451 HG3 ARG 60 HG3 ARG 60 74.965 -9.394 -6.870 452 HD2 ARG 60 HD2 ARG 60 76.691 -8.069 -5.819 453 HD3 ARG 60 HD3 ARG 60 75.202 -7.884 -4.908 454 HE ARG 60 HE ARG 60 76.561 -9.904 -3.660 455 HH11 ARG 60 HH11 ARG 60 77.342 -6.472 -4.438 456 HH12 ARG 60 HH12 ARG 60 78.328 -6.268 -3.069 457 HH21 ARG 60 HH21 ARG 60 77.959 -9.581 -1.817 458 HH22 ARG 60 HH22 ARG 60 78.691 -8.079 -1.536 459 H ALA 61 H ALA 61 71.147 -10.895 -5.147 460 HA ALA 61 HA ALA 61 70.840 -13.056 -3.277 461 HB1 ALA 61 HB1 ALA 61 69.865 -10.846 -2.877 462 HB2 ALA 61 HB2 ALA 61 68.638 -12.112 -2.875 463 HB3 ALA 61 HB3 ALA 61 68.815 -11.056 -4.279 464 H ALA 62 H ALA 62 69.892 -12.418 -6.544 465 HA ALA 62 HA ALA 62 67.929 -14.421 -6.760 466 HB1 ALA 62 HB1 ALA 62 68.149 -14.133 -9.184 467 HB2 ALA 62 HB2 ALA 62 69.657 -13.246 -8.936 468 HB3 ALA 62 HB3 ALA 62 68.140 -12.572 -8.354 469 H ALA 63 H ALA 63 71.384 -14.403 -7.517 470 HA ALA 63 HA ALA 63 71.430 -17.221 -8.110 471 HB1 ALA 63 HB1 ALA 63 73.061 -15.722 -9.152 472 HB2 ALA 63 HB2 ALA 63 73.876 -16.947 -8.179 473 HB3 ALA 63 HB3 ALA 63 73.701 -15.304 -7.564 474 H ASN 64 H ASN 64 72.387 -15.140 -5.469 475 HA ASN 64 HA ASN 64 72.812 -15.399 -3.329 476 HB2 ASN 64 HB2 ASN 64 70.603 -16.390 -3.123 477 HB3 ASN 64 HB3 ASN 64 71.226 -17.966 -3.583 478 HD21 ASN 64 HD21 ASN 64 70.902 -15.638 -1.027 479 HD22 ASN 64 HD22 ASN 64 71.481 -16.646 0.238 480 HA PRO 65 HA PRO 65 76.481 -18.018 -3.722 481 HB2 PRO 65 HB2 PRO 65 78.216 -16.205 -2.686 482 HB3 PRO 65 HB3 PRO 65 77.739 -16.172 -4.386 483 HG2 PRO 65 HG2 PRO 65 76.774 -14.493 -2.113 484 HG3 PRO 65 HG3 PRO 65 77.118 -14.023 -3.786 485 HD2 PRO 65 HD2 PRO 65 74.604 -14.494 -2.809 486 HD3 PRO 65 HD3 PRO 65 75.043 -14.678 -4.517 487 H GLY 66 H GLY 66 74.771 -16.452 -1.293 488 HA2 GLY 66 HA2 GLY 66 74.297 -17.617 0.769 489 HA3 GLY 66 HA3 GLY 66 75.999 -18.097 0.807 490 H GLY 67 H GLY 67 76.027 -17.212 2.892 491 HA2 GLY 67 HA2 GLY 67 76.874 -15.652 4.306 492 HA3 GLY 67 HA3 GLY 67 77.343 -14.779 2.852 493 H ASP 68 H ASP 68 76.610 -12.869 2.793 494 HA ASP 68 HA ASP 68 73.946 -12.219 3.867 495 HB2 ASP 68 HB2 ASP 68 74.816 -9.969 4.448 496 HB3 ASP 68 HB3 ASP 68 75.629 -11.241 5.346 497 H GLY 69 H GLY 69 76.300 -11.866 1.349 498 HA2 GLY 69 HA2 GLY 69 75.050 -9.739 -0.055 499 HA3 GLY 69 HA3 GLY 69 76.308 -10.798 -0.663 500 H GLY 70 H GLY 70 74.173 -12.923 0.304 501 HA2 GLY 70 HA2 GLY 70 72.910 -13.129 -2.313 502 HA3 GLY 70 HA3 GLY 70 72.914 -14.370 -1.059 503 H GLY 71 H GLY 71 72.084 -10.991 -0.494 504 HA2 GLY 71 HA2 GLY 71 69.358 -11.181 -0.750 505 HA3 GLY 71 HA3 GLY 71 69.805 -11.515 0.919 506 HA PRO 72 HA PRO 72 69.587 -6.911 0.118 507 HB2 PRO 72 HB2 PRO 72 67.759 -6.372 2.052 508 HB3 PRO 72 HB3 PRO 72 67.325 -6.790 0.394 509 HG2 PRO 72 HG2 PRO 72 67.229 -8.464 2.845 510 HG3 PRO 72 HG3 PRO 72 66.204 -8.494 1.400 511 HD2 PRO 72 HD2 PRO 72 68.245 -10.277 1.954 512 HD3 PRO 72 HD3 PRO 72 67.575 -10.009 0.344 513 H GLU 73 H GLU 73 70.097 -8.802 2.983 514 HA GLU 73 HA GLU 73 70.995 -6.587 4.478 515 HB2 GLU 73 HB2 GLU 73 71.575 -9.501 4.958 516 HB3 GLU 73 HB3 GLU 73 71.832 -8.194 6.096 517 HG2 GLU 73 HG2 GLU 73 69.409 -7.731 6.076 518 HG3 GLU 73 HG3 GLU 73 69.192 -9.102 5.005 519 H GLY 74 H GLY 74 72.380 -7.903 1.850 520 HA2 GLY 74 HA2 GLY 74 74.942 -7.111 2.907 521 HA3 GLY 74 HA3 GLY 74 74.807 -8.130 1.438 522 H ILE 75 H ILE 75 72.531 -5.852 1.001 523 HA ILE 75 HA ILE 75 74.171 -4.220 -0.722 524 HB ILE 75 HB ILE 75 71.601 -3.036 0.220 525 HG12 ILE 75 HG12 ILE 75 71.649 -5.735 -1.204 526 HG13 ILE 75 HG13 ILE 75 70.898 -5.228 0.274 527 HG21 ILE 75 HG21 ILE 75 72.757 -3.520 -2.524 528 HG22 ILE 75 HG22 ILE 75 72.847 -2.029 -1.591 529 HG23 ILE 75 HG23 ILE 75 71.288 -2.604 -2.180 530 HD11 ILE 75 HD11 ILE 75 69.983 -4.183 -2.383 531 HD12 ILE 75 HD12 ILE 75 69.234 -3.937 -0.802 532 HD13 ILE 75 HD13 ILE 75 69.254 -5.540 -1.520 533 H VAL 76 H VAL 76 72.583 -3.891 2.278 534 HA VAL 76 HA VAL 76 73.344 -1.327 3.117 535 HB VAL 76 HB VAL 76 71.632 -2.477 4.209 536 HG11 VAL 76 HG11 VAL 76 71.729 -4.478 3.834 537 HG12 VAL 76 HG12 VAL 76 71.923 -4.434 5.602 538 HG13 VAL 76 HG13 VAL 76 73.319 -4.764 4.557 539 HG21 VAL 76 HG21 VAL 76 73.896 -2.336 6.182 540 HG22 VAL 76 HG22 VAL 76 72.183 -2.393 6.599 541 HG23 VAL 76 HG23 VAL 76 72.837 -0.999 5.741 542 H LYS 77 H LYS 77 74.723 -4.344 3.722 543 HA LYS 77 HA LYS 77 76.942 -3.532 5.245 544 HB2 LYS 77 HB2 LYS 77 76.248 -5.881 5.126 545 HB3 LYS 77 HB3 LYS 77 76.720 -5.923 3.434 546 HG2 LYS 77 HG2 LYS 77 79.032 -5.698 3.997 547 HG3 LYS 77 HG3 LYS 77 78.638 -5.438 5.698 548 HD2 LYS 77 HD2 LYS 77 77.814 -7.652 5.930 549 HD3 LYS 77 HD3 LYS 77 77.894 -7.924 4.191 550 HE2 LYS 77 HE2 LYS 77 80.319 -7.728 4.283 551 HE3 LYS 77 HE3 LYS 77 80.229 -7.459 6.021 552 HZ1 LYS 77 HZ1 LYS 77 79.395 -9.649 6.339 553 HZ2 LYS 77 HZ2 LYS 77 80.755 -9.790 5.360 554 HZ3 LYS 77 HZ3 LYS 77 79.201 -9.908 4.697 555 H GLU 78 H GLU 78 76.608 -4.000 1.750 556 HA GLU 78 HA GLU 78 79.196 -3.343 0.934 557 HB2 GLU 78 HB2 GLU 78 77.254 -4.260 -0.461 558 HB3 GLU 78 HB3 GLU 78 76.635 -2.629 -0.571 559 HG2 GLU 78 HG2 GLU 78 77.799 -3.045 -2.539 560 HG3 GLU 78 HG3 GLU 78 78.823 -1.980 -1.573 561 H ILE 79 H ILE 79 76.383 -1.353 1.653 562 HA ILE 79 HA ILE 79 77.479 1.175 0.970 563 HB ILE 79 HB ILE 79 75.219 0.477 2.869 564 HG12 ILE 79 HG12 ILE 79 74.725 -0.129 0.510 565 HG13 ILE 79 HG13 ILE 79 73.729 1.201 1.072 566 HG21 ILE 79 HG21 ILE 79 74.524 2.784 2.790 567 HG22 ILE 79 HG22 ILE 79 75.940 3.197 1.824 568 HG23 ILE 79 HG23 ILE 79 76.140 2.627 3.480 569 HD11 ILE 79 HD11 ILE 79 74.464 1.617 -1.163 570 HD12 ILE 79 HD12 ILE 79 76.148 1.410 -0.693 571 HD13 ILE 79 HD13 ILE 79 75.224 2.777 -0.074 572 H LYS 80 H LYS 80 77.262 -0.521 4.089 573 HA LYS 80 HA LYS 80 78.256 1.694 5.513 574 HB2 LYS 80 HB2 LYS 80 78.389 0.358 7.470 575 HB3 LYS 80 HB3 LYS 80 77.007 -0.242 6.590 576 HG2 LYS 80 HG2 LYS 80 78.388 -2.123 5.792 577 HG3 LYS 80 HG3 LYS 80 79.707 -1.530 6.802 578 HD2 LYS 80 HD2 LYS 80 78.118 -1.632 8.757 579 HD3 LYS 80 HD3 LYS 80 76.996 -2.486 7.701 580 HE2 LYS 80 HE2 LYS 80 78.200 -4.107 8.973 581 HE3 LYS 80 HE3 LYS 80 78.769 -4.183 7.308 582 HZ1 LYS 80 HZ1 LYS 80 80.159 -2.844 9.573 583 HZ2 LYS 80 HZ2 LYS 80 80.720 -2.846 7.983 584 HZ3 LYS 80 HZ3 LYS 80 80.603 -4.284 8.836 585 H GLU 81 H GLU 81 79.867 -0.965 3.954 586 HA GLU 81 HA GLU 81 82.383 -0.397 5.019 587 HB2 GLU 81 HB2 GLU 81 81.678 -1.786 2.433 588 HB3 GLU 81 HB3 GLU 81 83.299 -1.734 3.112 589 HG2 GLU 81 HG2 GLU 81 82.439 -2.883 5.134 590 HG3 GLU 81 HG3 GLU 81 80.867 -3.004 4.355 591 H TRP 82 H TRP 82 80.740 0.752 2.151 592 HA TRP 82 HA TRP 82 82.852 2.248 0.990 593 HB2 TRP 82 HB2 TRP 82 80.626 1.637 -0.089 594 HB3 TRP 82 HB3 TRP 82 79.954 2.878 0.989 595 HD1 TRP 82 HD1 TRP 82 82.372 2.634 -2.007 596 HE1 TRP 82 HE1 TRP 82 82.317 4.878 -3.256 597 HE3 TRP 82 HE3 TRP 82 79.395 5.264 1.204 598 HZ2 TRP 82 HZ2 TRP 82 81.155 7.409 -2.944 599 HZ3 TRP 82 HZ3 TRP 82 78.864 7.600 0.669 600 HH2 TRP 82 HH2 TRP 82 79.718 8.662 -1.326 601 H ARG 83 H ARG 83 80.197 3.042 3.131 602 HA ARG 83 HA ARG 83 80.509 5.825 3.277 603 HB2 ARG 83 HB2 ARG 83 78.604 4.138 4.188 604 HB3 ARG 83 HB3 ARG 83 79.686 4.289 5.590 605 HG2 ARG 83 HG2 ARG 83 78.095 5.861 6.065 606 HG3 ARG 83 HG3 ARG 83 79.503 6.674 5.370 607 HD2 ARG 83 HD2 ARG 83 78.342 6.999 3.246 608 HD3 ARG 83 HD3 ARG 83 76.976 6.069 3.852 609 HE ARG 83 HE ARG 83 77.166 7.923 5.732 610 HH11 ARG 83 HH11 ARG 83 76.820 8.371 2.190 611 HH12 ARG 83 HH12 ARG 83 76.283 9.977 2.392 612 HH21 ARG 83 HH21 ARG 83 76.367 10.007 5.904 613 HH22 ARG 83 HH22 ARG 83 75.975 10.920 4.525 614 H ALA 84 H ALA 84 81.660 3.192 5.379 615 HA ALA 84 HA ALA 84 82.971 4.818 7.267 616 HB1 ALA 84 HB1 ALA 84 82.275 2.527 7.758 617 HB2 ALA 84 HB2 ALA 84 84.002 2.741 8.051 618 HB3 ALA 84 HB3 ALA 84 83.449 1.918 6.594 619 H ALA 85 H ALA 85 84.146 3.087 4.395 620 HA ALA 85 HA ALA 85 86.869 3.755 4.761 621 HB1 ALA 85 HB1 ALA 85 86.140 1.900 3.326 622 HB2 ALA 85 HB2 ALA 85 87.175 3.028 2.449 623 HB3 ALA 85 HB3 ALA 85 85.430 3.056 2.199 624 H ASN 86 H ASN 86 84.200 5.456 3.393 625 HA ASN 86 HA ASN 86 85.845 7.481 2.104 626 HB2 ASN 86 HB2 ASN 86 83.382 6.714 1.452 627 HB3 ASN 86 HB3 ASN 86 82.928 7.820 2.730 628 HD21 ASN 86 HD21 ASN 86 82.228 8.056 0.003 629 HD22 ASN 86 HD22 ASN 86 82.925 9.515 -0.594 630 H GLY 87 H GLY 87 84.783 6.772 5.205 631 HA2 GLY 87 HA2 GLY 87 85.048 7.879 7.188 632 HA3 GLY 87 HA3 GLY 87 85.789 9.205 6.299 633 H LYS 88 H LYS 88 82.455 7.853 5.816 634 HA LYS 88 HA LYS 88 81.493 10.448 6.539 635 HB2 LYS 88 HB2 LYS 88 80.992 8.497 4.354 636 HB3 LYS 88 HB3 LYS 88 79.707 9.566 4.874 637 HG2 LYS 88 HG2 LYS 88 80.939 11.504 4.209 638 HG3 LYS 88 HG3 LYS 88 82.444 10.600 4.135 639 HD2 LYS 88 HD2 LYS 88 81.680 11.158 1.900 640 HD3 LYS 88 HD3 LYS 88 81.631 9.425 2.139 641 HE2 LYS 88 HE2 LYS 88 79.729 10.192 0.916 642 HE3 LYS 88 HE3 LYS 88 79.227 9.521 2.445 643 HZ1 LYS 88 HZ1 LYS 88 78.020 11.616 2.014 644 HZ2 LYS 88 HZ2 LYS 88 79.468 12.395 1.691 645 HZ3 LYS 88 HZ3 LYS 88 79.121 11.938 3.257 646 HA PRO 89 HA PRO 89 79.333 8.162 9.686 647 HB2 PRO 89 HB2 PRO 89 77.161 9.848 9.975 648 HB3 PRO 89 HB3 PRO 89 78.729 10.129 10.735 649 HG2 PRO 89 HG2 PRO 89 77.595 11.313 8.234 650 HG3 PRO 89 HG3 PRO 89 78.563 12.086 9.502 651 HD2 PRO 89 HD2 PRO 89 79.616 11.342 7.138 652 HD3 PRO 89 HD3 PRO 89 80.551 11.271 8.645 653 H GLY 90 H GLY 90 77.997 6.463 9.498 654 HA2 GLY 90 HA2 GLY 90 76.206 6.508 7.181 655 HA3 GLY 90 HA3 GLY 90 77.021 5.074 7.782 656 H PHE 91 H PHE 91 75.970 3.827 9.052 657 HA PHE 91 HA PHE 91 73.192 4.446 9.546 658 HB2 PHE 91 HB2 PHE 91 74.743 1.910 10.058 659 HB3 PHE 91 HB3 PHE 91 72.999 2.103 10.138 660 HD1 PHE 91 HD1 PHE 91 71.840 2.894 7.977 661 HD2 PHE 91 HD2 PHE 91 75.740 1.222 8.111 662 HE1 PHE 91 HE1 PHE 91 71.674 2.314 5.620 663 HE2 PHE 91 HE2 PHE 91 75.565 0.662 5.701 664 HZ PHE 91 HZ PHE 91 73.534 1.204 4.481 665 H LYS 92 H LYS 92 72.205 4.286 11.572 666 HA LYS 92 HA LYS 92 73.928 4.804 13.779 667 HB2 LYS 92 HB2 LYS 92 71.937 5.257 14.949 668 HB3 LYS 92 HB3 LYS 92 71.808 6.050 13.417 669 HG2 LYS 92 HG2 LYS 92 70.289 4.332 12.626 670 HG3 LYS 92 HG3 LYS 92 70.565 3.405 14.103 671 HD2 LYS 92 HD2 LYS 92 69.309 6.154 14.008 672 HD3 LYS 92 HD3 LYS 92 68.398 4.648 14.090 673 HE2 LYS 92 HE2 LYS 92 69.544 4.132 16.234 674 HE3 LYS 92 HE3 LYS 92 70.343 5.695 16.154 675 HZ1 LYS 92 HZ1 LYS 92 68.384 5.816 17.558 676 HZ2 LYS 92 HZ2 LYS 92 67.422 5.235 16.310 677 HZ3 LYS 92 HZ3 LYS 92 68.121 6.747 16.170 678 H GLN 93 H GLN 93 73.357 3.493 15.736 679 HA GLN 93 HA GLN 93 73.208 0.703 14.952 680 HB2 GLN 93 HB2 GLN 93 74.231 2.290 17.167 681 HB3 GLN 93 HB3 GLN 93 74.260 0.513 17.241 682 HG2 GLN 93 HG2 GLN 93 75.770 2.434 15.469 683 HG3 GLN 93 HG3 GLN 93 76.454 1.280 16.616 684 HE21 GLN 93 HE21 GLN 93 75.230 1.758 13.421 685 HE22 GLN 93 HE22 GLN 93 75.647 0.203 12.807 686 H GLY 94 H GLY 94 71.643 -0.532 15.897 687 HA2 GLY 94 HA2 GLY 94 70.469 -0.194 18.298 688 HA3 GLY 94 HA3 GLY 94 69.460 0.714 17.168 Start of MODEL 3 1 H GLU 2 H GLU 2 59.582 1.971 4.456 2 HA GLU 2 HA GLU 2 58.512 3.900 5.501 3 HB2 GLU 2 HB2 GLU 2 60.212 3.092 7.862 4 HB3 GLU 2 HB3 GLU 2 59.259 4.557 7.722 5 HG2 GLU 2 HG2 GLU 2 57.223 3.202 7.666 6 HG3 GLU 2 HG3 GLU 2 58.209 1.749 7.844 7 H LEU 3 H LEU 3 59.596 5.915 5.395 8 HA LEU 3 HA LEU 3 62.412 5.706 4.590 9 HB2 LEU 3 HB2 LEU 3 60.276 7.688 3.864 10 HB3 LEU 3 HB3 LEU 3 61.954 7.839 3.420 11 HG LEU 3 HG LEU 3 60.236 5.539 2.569 12 HD11 LEU 3 HD11 LEU 3 61.023 8.061 1.082 13 HD12 LEU 3 HD12 LEU 3 59.393 7.671 1.630 14 HD13 LEU 3 HD13 LEU 3 60.165 6.689 0.379 15 HD21 LEU 3 HD21 LEU 3 62.609 5.166 2.678 16 HD22 LEU 3 HD22 LEU 3 62.894 6.578 1.668 17 HD23 LEU 3 HD23 LEU 3 62.049 5.169 0.998 18 H LYS 4 H LYS 4 63.818 7.028 5.539 19 HA LYS 4 HA LYS 4 62.832 8.897 7.580 20 HB2 LYS 4 HB2 LYS 4 65.742 8.212 7.025 21 HB3 LYS 4 HB3 LYS 4 65.058 8.944 8.475 22 HG2 LYS 4 HG2 LYS 4 65.185 6.123 7.543 23 HG3 LYS 4 HG3 LYS 4 65.692 6.736 9.084 24 HD2 LYS 4 HD2 LYS 4 63.123 7.212 9.341 25 HD3 LYS 4 HD3 LYS 4 63.093 6.042 8.014 26 HE2 LYS 4 HE2 LYS 4 64.610 4.578 9.400 27 HE3 LYS 4 HE3 LYS 4 64.248 5.617 10.742 28 HZ1 LYS 4 HZ1 LYS 4 61.904 5.080 10.637 29 HZ2 LYS 4 HZ2 LYS 4 62.766 3.611 10.670 30 HZ3 LYS 4 HZ3 LYS 4 62.148 4.181 9.240 31 H ASN 5 H ASN 5 65.045 10.732 7.349 32 HA ASN 5 HA ASN 5 64.709 11.532 4.547 33 HB2 ASN 5 HB2 ASN 5 65.086 13.326 6.944 34 HB3 ASN 5 HB3 ASN 5 65.226 13.885 5.278 35 HD21 ASN 5 HD21 ASN 5 63.378 13.924 3.972 36 HD22 ASN 5 HD22 ASN 5 61.798 13.864 4.654 37 H SER 6 H SER 6 66.933 10.765 6.978 38 HA SER 6 HA SER 6 69.008 10.936 4.984 39 HB2 SER 6 HB2 SER 6 70.585 11.884 6.647 40 HB3 SER 6 HB3 SER 6 69.311 13.015 6.180 41 HG SER 6 HG SER 6 68.209 12.077 8.157 42 H ILE 7 H ILE 7 70.964 9.763 5.762 43 HA ILE 7 HA ILE 7 70.364 7.116 6.476 44 HB ILE 7 HB ILE 7 72.318 7.906 5.125 45 HG12 ILE 7 HG12 ILE 7 73.996 6.292 6.116 46 HG13 ILE 7 HG13 ILE 7 72.896 6.106 7.477 47 HG21 ILE 7 HG21 ILE 7 73.497 8.712 7.781 48 HG22 ILE 7 HG22 ILE 7 73.055 9.790 6.464 49 HG23 ILE 7 HG23 ILE 7 74.377 8.645 6.256 50 HD11 ILE 7 HD11 ILE 7 71.214 5.176 6.027 51 HD12 ILE 7 HD12 ILE 7 72.756 4.325 5.793 52 HD13 ILE 7 HD13 ILE 7 72.222 5.515 4.619 53 H SER 8 H SER 8 70.812 9.878 8.373 54 HA SER 8 HA SER 8 72.102 8.714 10.610 55 HB2 SER 8 HB2 SER 8 70.780 11.392 10.245 56 HB3 SER 8 HB3 SER 8 71.959 10.945 11.502 57 HG SER 8 HG SER 8 72.503 11.950 9.190 58 H ASP 9 H ASP 9 68.924 8.564 9.560 59 HA ASP 9 HA ASP 9 67.946 8.158 12.336 60 HB2 ASP 9 HB2 ASP 9 66.666 9.767 10.616 61 HB3 ASP 9 HB3 ASP 9 66.210 8.280 9.914 62 H TYR 10 H TYR 10 69.237 6.611 9.821 63 HA TYR 10 HA TYR 10 67.376 4.391 9.804 64 HB2 TYR 10 HB2 TYR 10 69.642 5.153 7.966 65 HB3 TYR 10 HB3 TYR 10 69.099 3.489 8.033 66 HD1 TYR 10 HD1 TYR 10 66.682 2.999 7.430 67 HD2 TYR 10 HD2 TYR 10 68.500 6.762 6.630 68 HE1 TYR 10 HE1 TYR 10 64.923 3.499 5.773 69 HE2 TYR 10 HE2 TYR 10 66.747 7.252 4.960 70 HH TYR 10 HH TYR 10 65.094 6.152 3.632 71 H THR 11 H THR 11 67.819 2.917 11.389 72 HA THR 11 HA THR 11 70.489 2.542 12.351 73 HB THR 11 HB THR 11 69.588 0.584 13.560 74 HG1 THR 11 HG1 THR 11 67.203 0.200 13.215 75 HG21 THR 11 HG21 THR 11 67.607 2.866 13.622 76 HG22 THR 11 HG22 THR 11 69.056 2.702 14.624 77 HG23 THR 11 HG23 THR 11 67.714 1.583 14.822 78 H GLU 12 H GLU 12 71.370 0.196 12.078 79 HA GLU 12 HA GLU 12 71.737 -0.354 9.395 80 HB2 GLU 12 HB2 GLU 12 72.389 -2.717 10.352 81 HB3 GLU 12 HB3 GLU 12 73.378 -1.302 10.693 82 HG2 GLU 12 HG2 GLU 12 72.264 -1.057 12.847 83 HG3 GLU 12 HG3 GLU 12 71.297 -2.466 12.565 84 H ALA 13 H ALA 13 69.421 -1.773 11.654 85 HA ALA 13 HA ALA 13 68.280 -3.493 9.701 86 HB1 ALA 13 HB1 ALA 13 67.068 -2.561 12.302 87 HB2 ALA 13 HB2 ALA 13 68.120 -3.965 12.112 88 HB3 ALA 13 HB3 ALA 13 66.537 -3.936 11.334 89 H GLU 14 H GLU 14 67.390 -0.200 10.830 90 HA GLU 14 HA GLU 14 64.972 0.022 9.392 91 HB2 GLU 14 HB2 GLU 14 67.019 2.149 9.993 92 HB3 GLU 14 HB3 GLU 14 65.485 2.556 9.273 93 HG2 GLU 14 HG2 GLU 14 66.048 1.468 12.023 94 HG3 GLU 14 HG3 GLU 14 65.339 3.022 11.588 95 H PHE 15 H PHE 15 68.287 0.404 8.435 96 HA PHE 15 HA PHE 15 67.783 1.355 5.841 97 HB2 PHE 15 HB2 PHE 15 70.064 1.249 7.207 98 HB3 PHE 15 HB3 PHE 15 70.133 -0.349 6.529 99 HD1 PHE 15 HD1 PHE 15 69.373 3.072 5.265 100 HD2 PHE 15 HD2 PHE 15 71.396 -0.607 4.678 101 HE1 PHE 15 HE1 PHE 15 70.381 3.959 3.198 102 HE2 PHE 15 HE2 PHE 15 72.402 0.272 2.613 103 HZ PHE 15 HZ PHE 15 71.893 2.558 1.879 104 H VAL 16 H VAL 16 68.445 -1.904 7.160 105 HA VAL 16 HA VAL 16 68.244 -3.187 4.668 106 HB VAL 16 HB VAL 16 68.382 -5.262 5.693 107 HG11 VAL 16 HG11 VAL 16 69.632 -3.585 7.749 108 HG12 VAL 16 HG12 VAL 16 70.243 -3.921 6.148 109 HG13 VAL 16 HG13 VAL 16 70.033 -5.257 7.301 110 HG21 VAL 16 HG21 VAL 16 67.096 -4.187 8.162 111 HG22 VAL 16 HG22 VAL 16 67.740 -5.843 7.937 112 HG23 VAL 16 HG23 VAL 16 66.404 -5.257 6.932 113 H GLN 17 H GLN 17 65.756 -2.378 7.017 114 HA GLN 17 HA GLN 17 63.591 -3.758 6.005 115 HB2 GLN 17 HB2 GLN 17 63.789 -2.505 8.146 116 HB3 GLN 17 HB3 GLN 17 63.864 -1.012 7.251 117 HG2 GLN 17 HG2 GLN 17 61.523 -2.839 7.180 118 HG3 GLN 17 HG3 GLN 17 61.744 -1.604 8.427 119 HE21 GLN 17 HE21 GLN 17 60.898 -2.226 5.140 120 HE22 GLN 17 HE22 GLN 17 60.435 -0.641 4.673 121 H LEU 18 H LEU 18 64.888 -0.576 5.245 122 HA LEU 18 HA LEU 18 62.976 0.070 3.305 123 HB2 LEU 18 HB2 LEU 18 64.503 1.568 4.634 124 HB3 LEU 18 HB3 LEU 18 65.787 1.154 3.575 125 HG LEU 18 HG LEU 18 64.712 3.353 3.076 126 HD11 LEU 18 HD11 LEU 18 64.707 3.133 0.687 127 HD12 LEU 18 HD12 LEU 18 64.652 1.378 0.856 128 HD13 LEU 18 HD13 LEU 18 66.068 2.273 1.416 129 HD21 LEU 18 HD21 LEU 18 62.449 1.611 2.143 130 HD22 LEU 18 HD22 LEU 18 62.618 3.324 1.821 131 HD23 LEU 18 HD23 LEU 18 62.407 2.761 3.484 132 H LEU 19 H LEU 19 66.156 -1.287 3.219 133 HA LEU 19 HA LEU 19 66.631 -1.516 0.507 134 HB2 LEU 19 HB2 LEU 19 67.293 -3.181 2.811 135 HB3 LEU 19 HB3 LEU 19 68.035 -3.469 1.219 136 HG LEU 19 HG LEU 19 68.333 -1.203 3.152 137 HD11 LEU 19 HD11 LEU 19 70.712 -1.650 2.676 138 HD12 LEU 19 HD12 LEU 19 70.148 -3.122 1.848 139 HD13 LEU 19 HD13 LEU 19 69.821 -2.889 3.557 140 HD21 LEU 19 HD21 LEU 19 67.961 -0.124 1.085 141 HD22 LEU 19 HD22 LEU 19 69.116 -1.192 0.267 142 HD23 LEU 19 HD23 LEU 19 69.676 -0.038 1.497 143 H LYS 20 H LYS 20 64.832 -3.595 2.726 144 HA LYS 20 HA LYS 20 64.387 -5.687 0.901 145 HB2 LYS 20 HB2 LYS 20 62.919 -4.985 3.440 146 HB3 LYS 20 HB3 LYS 20 62.583 -6.441 2.530 147 HG2 LYS 20 HG2 LYS 20 65.204 -6.751 2.763 148 HG3 LYS 20 HG3 LYS 20 64.960 -5.666 4.094 149 HD2 LYS 20 HD2 LYS 20 63.501 -7.128 5.245 150 HD3 LYS 20 HD3 LYS 20 63.350 -8.199 3.845 151 HE2 LYS 20 HE2 LYS 20 65.777 -8.645 3.986 152 HE3 LYS 20 HE3 LYS 20 65.850 -7.674 5.445 153 HZ1 LYS 20 HZ1 LYS 20 64.267 -10.184 5.139 154 HZ2 LYS 20 HZ2 LYS 20 64.457 -9.279 6.568 155 HZ3 LYS 20 HZ3 LYS 20 65.769 -10.035 5.887 156 H GLU 21 H GLU 21 62.570 -2.778 1.635 157 HA GLU 21 HA GLU 21 60.545 -3.698 -0.092 158 HB2 GLU 21 HB2 GLU 21 59.506 -1.437 0.085 159 HB3 GLU 21 HB3 GLU 21 59.717 -2.263 1.615 160 HG2 GLU 21 HG2 GLU 21 61.676 -0.851 2.039 161 HG3 GLU 21 HG3 GLU 21 61.340 0.016 0.536 162 H ILE 22 H ILE 22 63.334 -1.712 -0.510 163 HA ILE 22 HA ILE 22 62.794 -0.831 -3.144 164 HB ILE 22 HB ILE 22 65.516 -1.771 -2.196 165 HG12 ILE 22 HG12 ILE 22 64.277 0.954 -1.986 166 HG13 ILE 22 HG13 ILE 22 64.605 -0.122 -0.634 167 HG21 ILE 22 HG21 ILE 22 66.341 -0.171 -3.864 168 HG22 ILE 22 HG22 ILE 22 64.677 0.209 -4.309 169 HG23 ILE 22 HG23 ILE 22 65.315 -1.409 -4.593 170 HD11 ILE 22 HD11 ILE 22 66.674 1.121 -2.440 171 HD12 ILE 22 HD12 ILE 22 67.009 0.006 -1.117 172 HD13 ILE 22 HD13 ILE 22 66.312 1.593 -0.779 173 H GLU 23 H GLU 23 64.334 -3.734 -1.908 174 HA GLU 23 HA GLU 23 64.807 -4.969 -4.363 175 HB2 GLU 23 HB2 GLU 23 65.004 -5.633 -1.549 176 HB3 GLU 23 HB3 GLU 23 64.609 -7.021 -2.550 177 HG2 GLU 23 HG2 GLU 23 66.888 -5.150 -3.167 178 HG3 GLU 23 HG3 GLU 23 67.068 -6.590 -2.156 179 H LYS 24 H LYS 24 62.029 -5.024 -2.264 180 HA LYS 24 HA LYS 24 60.766 -7.214 -3.529 181 HB2 LYS 24 HB2 LYS 24 60.265 -6.140 -1.237 182 HB3 LYS 24 HB3 LYS 24 59.341 -4.975 -2.173 183 HG2 LYS 24 HG2 LYS 24 57.844 -6.688 -1.341 184 HG3 LYS 24 HG3 LYS 24 57.957 -6.768 -3.097 185 HD2 LYS 24 HD2 LYS 24 58.021 -9.004 -2.120 186 HD3 LYS 24 HD3 LYS 24 59.543 -8.638 -2.917 187 HE2 LYS 24 HE2 LYS 24 60.505 -8.030 -0.691 188 HE3 LYS 24 HE3 LYS 24 58.984 -8.517 0.053 189 HZ1 LYS 24 HZ1 LYS 24 60.653 -10.230 0.171 190 HZ2 LYS 24 HZ2 LYS 24 60.827 -10.232 -1.482 191 HZ3 LYS 24 HZ3 LYS 24 59.367 -10.759 -0.790 192 H GLU 25 H GLU 25 60.247 -3.685 -3.730 193 HA GLU 25 HA GLU 25 58.482 -3.920 -5.875 194 HB2 GLU 25 HB2 GLU 25 59.933 -1.442 -4.784 195 HB3 GLU 25 HB3 GLU 25 58.844 -1.487 -6.082 196 HG2 GLU 25 HG2 GLU 25 57.752 -0.809 -3.945 197 HG3 GLU 25 HG3 GLU 25 56.958 -2.055 -4.889 198 H ASN 26 H ASN 26 61.871 -3.982 -5.698 199 HA ASN 26 HA ASN 26 62.552 -3.183 -8.347 200 HB2 ASN 26 HB2 ASN 26 64.233 -3.270 -6.557 201 HB3 ASN 26 HB3 ASN 26 63.993 -5.000 -6.400 202 HD21 ASN 26 HD21 ASN 26 66.139 -5.494 -6.792 203 HD22 ASN 26 HD22 ASN 26 66.850 -5.306 -8.340 204 H VAL 27 H VAL 27 62.172 -6.397 -6.845 205 HA VAL 27 HA VAL 27 62.427 -7.661 -9.388 206 HB VAL 27 HB VAL 27 61.803 -9.778 -8.280 207 HG11 VAL 27 HG11 VAL 27 63.855 -8.141 -6.813 208 HG12 VAL 27 HG12 VAL 27 64.110 -9.065 -8.296 209 HG13 VAL 27 HG13 VAL 27 63.731 -9.900 -6.791 210 HG21 VAL 27 HG21 VAL 27 61.512 -8.079 -5.803 211 HG22 VAL 27 HG22 VAL 27 61.473 -9.844 -5.866 212 HG23 VAL 27 HG23 VAL 27 60.205 -8.906 -6.652 213 H ALA 28 H ALA 28 59.754 -6.399 -7.636 214 HA ALA 28 HA ALA 28 57.781 -7.716 -9.285 215 HB1 ALA 28 HB1 ALA 28 57.524 -5.328 -7.456 216 HB2 ALA 28 HB2 ALA 28 57.261 -7.005 -6.988 217 HB3 ALA 28 HB3 ALA 28 56.185 -6.237 -8.155 218 H ALA 29 H ALA 29 59.999 -5.409 -9.787 219 HA ALA 29 HA ALA 29 60.403 -3.696 -11.090 220 HB1 ALA 29 HB1 ALA 29 59.928 -3.943 -13.393 221 HB2 ALA 29 HB2 ALA 29 58.663 -5.140 -13.063 222 HB3 ALA 29 HB3 ALA 29 60.363 -5.515 -12.715 223 H THR 30 H THR 30 59.035 -2.590 -9.516 224 HA THR 30 HA THR 30 56.704 -1.370 -10.728 225 HB THR 30 HB THR 30 56.578 -0.107 -8.550 226 HG1 THR 30 HG1 THR 30 58.799 -1.734 -7.862 227 HG21 THR 30 HG21 THR 30 55.452 -2.282 -8.748 228 HG22 THR 30 HG22 THR 30 56.086 -2.025 -7.120 229 HG23 THR 30 HG23 THR 30 56.942 -3.081 -8.244 230 H ASP 31 H ASP 31 56.908 1.288 -10.172 231 HA ASP 31 HA ASP 31 59.511 2.012 -11.278 232 HB2 ASP 31 HB2 ASP 31 58.050 1.801 -13.192 233 HB3 ASP 31 HB3 ASP 31 56.884 2.840 -12.372 234 H ASP 32 H ASP 32 56.468 3.540 -10.361 235 HA ASP 32 HA ASP 32 57.667 5.980 -9.811 236 HB2 ASP 32 HB2 ASP 32 55.031 4.897 -8.841 237 HB3 ASP 32 HB3 ASP 32 55.572 6.544 -8.546 238 H VAL 33 H VAL 33 56.840 3.416 -7.535 239 HA VAL 33 HA VAL 33 58.024 5.019 -5.418 240 HB VAL 33 HB VAL 33 56.052 3.653 -4.929 241 HG11 VAL 33 HG11 VAL 33 57.881 1.271 -5.156 242 HG12 VAL 33 HG12 VAL 33 56.491 1.623 -6.179 243 HG13 VAL 33 HG13 VAL 33 56.256 1.228 -4.477 244 HG21 VAL 33 HG21 VAL 33 57.397 4.413 -3.090 245 HG22 VAL 33 HG22 VAL 33 58.463 3.018 -3.250 246 HG23 VAL 33 HG23 VAL 33 56.794 2.795 -2.731 247 H LEU 34 H LEU 34 58.810 2.331 -7.368 248 HA LEU 34 HA LEU 34 61.108 1.375 -6.029 249 HB2 LEU 34 HB2 LEU 34 59.813 0.335 -8.055 250 HB3 LEU 34 HB3 LEU 34 60.627 1.511 -8.972 251 HG LEU 34 HG LEU 34 61.539 -0.913 -8.899 252 HD11 LEU 34 HD11 LEU 34 63.244 1.534 -8.944 253 HD12 LEU 34 HD12 LEU 34 62.347 0.823 -10.287 254 HD13 LEU 34 HD13 LEU 34 63.696 -0.059 -9.565 255 HD21 LEU 34 HD21 LEU 34 63.453 -1.128 -7.393 256 HD22 LEU 34 HD22 LEU 34 61.947 -0.996 -6.487 257 HD23 LEU 34 HD23 LEU 34 63.021 0.397 -6.618 258 H ASP 35 H ASP 35 60.701 3.895 -8.467 259 HA ASP 35 HA ASP 35 63.461 4.502 -8.447 260 HB2 ASP 35 HB2 ASP 35 62.073 5.058 -10.402 261 HB3 ASP 35 HB3 ASP 35 61.160 6.197 -9.425 262 H VAL 36 H VAL 36 60.799 5.648 -6.583 263 HA VAL 36 HA VAL 36 61.959 7.886 -5.308 264 HB VAL 36 HB VAL 36 60.205 5.722 -4.096 265 HG11 VAL 36 HG11 VAL 36 61.416 6.917 -2.452 266 HG12 VAL 36 HG12 VAL 36 59.698 7.416 -2.398 267 HG13 VAL 36 HG13 VAL 36 60.940 8.457 -3.159 268 HG21 VAL 36 HG21 VAL 36 59.294 6.816 -5.899 269 HG22 VAL 36 HG22 VAL 36 59.620 8.407 -5.101 270 HG23 VAL 36 HG23 VAL 36 58.499 7.202 -4.357 271 H LEU 37 H LEU 37 61.924 4.518 -4.585 272 HA LEU 37 HA LEU 37 63.391 4.734 -2.220 273 HB2 LEU 37 HB2 LEU 37 63.092 2.283 -3.892 274 HB3 LEU 37 HB3 LEU 37 63.474 2.569 -2.196 275 HG LEU 37 HG LEU 37 60.777 3.246 -3.268 276 HD11 LEU 37 HD11 LEU 37 59.959 1.209 -2.190 277 HD12 LEU 37 HD12 LEU 37 61.620 0.735 -1.833 278 HD13 LEU 37 HD13 LEU 37 61.076 0.852 -3.506 279 HD21 LEU 37 HD21 LEU 37 61.447 4.433 -1.245 280 HD22 LEU 37 HD22 LEU 37 61.851 2.904 -0.467 281 HD23 LEU 37 HD23 LEU 37 60.176 3.266 -0.883 282 H LEU 38 H LEU 38 64.167 3.879 -5.486 283 HA LEU 38 HA LEU 38 66.833 3.123 -5.160 284 HB2 LEU 38 HB2 LEU 38 65.298 4.403 -7.326 285 HB3 LEU 38 HB3 LEU 38 66.980 4.006 -7.602 286 HG LEU 38 HG LEU 38 64.518 2.348 -7.412 287 HD11 LEU 38 HD11 LEU 38 65.470 1.338 -9.422 288 HD12 LEU 38 HD12 LEU 38 66.868 2.396 -9.252 289 HD13 LEU 38 HD13 LEU 38 65.271 3.088 -9.551 290 HD21 LEU 38 HD21 LEU 38 66.038 1.274 -5.798 291 HD22 LEU 38 HD22 LEU 38 67.282 1.175 -7.050 292 HD23 LEU 38 HD23 LEU 38 65.777 0.289 -7.230 293 H GLU 39 H GLU 39 65.468 6.278 -5.889 294 HA GLU 39 HA GLU 39 67.952 7.609 -5.871 295 HB2 GLU 39 HB2 GLU 39 65.173 8.614 -5.444 296 HB3 GLU 39 HB3 GLU 39 66.625 9.594 -5.590 297 HG2 GLU 39 HG2 GLU 39 65.418 7.795 -7.679 298 HG3 GLU 39 HG3 GLU 39 65.413 9.560 -7.659 299 H HIS 40 H HIS 40 65.440 7.120 -3.479 300 HA HIS 40 HA HIS 40 66.483 8.855 -1.591 301 HB2 HIS 40 HB2 HIS 40 64.234 7.992 -1.550 302 HB3 HIS 40 HB3 HIS 40 64.730 6.406 -1.142 303 HD1 HIS 40 HD1 HIS 40 64.097 9.742 0.421 304 HD2 HIS 40 HD2 HIS 40 65.823 6.119 1.498 305 HE1 HIS 40 HE1 HIS 40 64.371 9.811 2.903 306 H PHE 41 H PHE 41 66.913 5.445 -2.060 307 HA PHE 41 HA PHE 41 68.610 4.857 0.020 308 HB2 PHE 41 HB2 PHE 41 67.703 3.144 -1.214 309 HB3 PHE 41 HB3 PHE 41 68.201 3.865 -2.737 310 HD1 PHE 41 HD1 PHE 41 69.516 2.329 0.386 311 HD2 PHE 41 HD2 PHE 41 70.167 3.007 -3.753 312 HE1 PHE 41 HE1 PHE 41 71.509 0.886 0.464 313 HE2 PHE 41 HE2 PHE 41 72.161 1.576 -3.663 314 HZ PHE 41 HZ PHE 41 72.830 0.516 -1.562 315 H VAL 42 H VAL 42 69.454 5.885 -3.274 316 HA VAL 42 HA VAL 42 72.212 6.073 -2.606 317 HB VAL 42 HB VAL 42 71.526 5.511 -4.837 318 HG11 VAL 42 HG11 VAL 42 70.502 8.255 -5.200 319 HG12 VAL 42 HG12 VAL 42 69.667 6.668 -5.218 320 HG13 VAL 42 HG13 VAL 42 70.853 7.043 -6.459 321 HG21 VAL 42 HG21 VAL 42 73.103 6.909 -6.123 322 HG22 VAL 42 HG22 VAL 42 73.763 6.321 -4.593 323 HG23 VAL 42 HG23 VAL 42 73.208 7.987 -4.733 324 H LYS 43 H LYS 43 69.779 8.405 -2.487 325 HA LYS 43 HA LYS 43 71.705 10.514 -2.030 326 HB2 LYS 43 HB2 LYS 43 69.898 11.978 -1.497 327 HB3 LYS 43 HB3 LYS 43 69.267 10.907 -2.738 328 HG2 LYS 43 HG2 LYS 43 68.259 9.527 -0.735 329 HG3 LYS 43 HG3 LYS 43 68.706 10.920 0.193 330 HD2 LYS 43 HD2 LYS 43 66.974 11.206 -2.233 331 HD3 LYS 43 HD3 LYS 43 66.329 10.910 -0.620 332 HE2 LYS 43 HE2 LYS 43 67.316 12.941 0.198 333 HE3 LYS 43 HE3 LYS 43 68.125 13.222 -1.344 334 HZ1 LYS 43 HZ1 LYS 43 66.023 13.500 -2.394 335 HZ2 LYS 43 HZ2 LYS 43 66.058 14.535 -1.076 336 HZ3 LYS 43 HZ3 LYS 43 65.179 13.096 -1.004 337 H ILE 44 H ILE 44 70.071 8.258 0.110 338 HA ILE 44 HA ILE 44 71.083 9.664 2.399 339 HB ILE 44 HB ILE 44 70.247 7.771 3.777 340 HG12 ILE 44 HG12 ILE 44 69.268 6.690 1.133 341 HG13 ILE 44 HG13 ILE 44 70.548 5.973 2.082 342 HG21 ILE 44 HG21 ILE 44 67.862 8.201 3.375 343 HG22 ILE 44 HG22 ILE 44 68.272 8.930 1.824 344 HG23 ILE 44 HG23 ILE 44 68.829 9.675 3.321 345 HD11 ILE 44 HD11 ILE 44 68.915 5.503 3.857 346 HD12 ILE 44 HD12 ILE 44 68.473 4.757 2.319 347 HD13 ILE 44 HD13 ILE 44 67.657 6.223 2.858 348 H THR 45 H THR 45 72.077 6.812 0.563 349 HA THR 45 HA THR 45 74.285 6.527 2.388 350 HB THR 45 HB THR 45 73.445 4.422 1.537 351 HG1 THR 45 HG1 THR 45 76.038 5.291 1.057 352 HG21 THR 45 HG21 THR 45 72.652 5.152 -0.673 353 HG22 THR 45 HG22 THR 45 73.746 3.777 -0.827 354 HG23 THR 45 HG23 THR 45 74.317 5.403 -1.194 355 H GLU 46 H GLU 46 73.754 8.080 -0.664 356 HA GLU 46 HA GLU 46 74.993 9.378 -1.974 357 HB2 GLU 46 HB2 GLU 46 76.769 9.395 0.416 358 HB3 GLU 46 HB3 GLU 46 76.930 10.548 -0.920 359 HG2 GLU 46 HG2 GLU 46 74.632 11.291 -0.349 360 HG3 GLU 46 HG3 GLU 46 74.675 10.193 1.009 361 H HIS 47 H HIS 47 75.384 6.553 -1.964 362 HA HIS 47 HA HIS 47 78.180 6.013 -2.398 363 HB2 HIS 47 HB2 HIS 47 76.605 4.343 -1.350 364 HB3 HIS 47 HB3 HIS 47 75.775 4.218 -2.894 365 HD1 HIS 47 HD1 HIS 47 76.668 2.399 -4.450 366 HD2 HIS 47 HD2 HIS 47 79.342 3.427 -1.449 367 HE1 HIS 47 HE1 HIS 47 78.678 0.913 -4.724 368 HA PRO 48 HA PRO 48 77.948 7.290 -6.707 369 HB2 PRO 48 HB2 PRO 48 80.147 5.486 -7.234 370 HB3 PRO 48 HB3 PRO 48 80.088 7.245 -7.344 371 HG2 PRO 48 HG2 PRO 48 81.428 5.821 -5.546 372 HG3 PRO 48 HG3 PRO 48 80.723 7.400 -5.048 373 HD2 PRO 48 HD2 PRO 48 79.784 4.582 -4.649 374 HD3 PRO 48 HD3 PRO 48 79.753 5.891 -3.471 375 H ASP 49 H ASP 49 77.283 4.255 -5.748 376 HA ASP 49 HA ASP 49 76.886 3.537 -8.397 377 HB2 ASP 49 HB2 ASP 49 78.249 1.737 -6.396 378 HB3 ASP 49 HB3 ASP 49 77.580 1.090 -7.874 379 H GLY 50 H GLY 50 75.243 4.548 -6.403 380 HA2 GLY 50 HA2 GLY 50 73.983 2.996 -4.426 381 HA3 GLY 50 HA3 GLY 50 73.257 4.326 -5.307 382 H THR 51 H THR 51 72.893 3.442 -7.678 383 HA THR 51 HA THR 51 71.068 1.450 -6.859 384 HB THR 51 HB THR 51 70.173 1.737 -9.318 385 HG1 THR 51 HG1 THR 51 70.390 4.373 -8.968 386 HG21 THR 51 HG21 THR 51 69.043 1.813 -7.208 387 HG22 THR 51 HG22 THR 51 68.478 3.081 -8.266 388 HG23 THR 51 HG23 THR 51 69.567 3.467 -6.917 389 H ALA 52 H ALA 52 73.901 1.522 -8.614 390 HA ALA 52 HA ALA 52 73.568 -0.911 -10.020 391 HB1 ALA 52 HB1 ALA 52 76.005 -1.033 -10.030 392 HB2 ALA 52 HB2 ALA 52 76.082 0.205 -8.778 393 HB3 ALA 52 HB3 ALA 52 75.503 0.622 -10.391 394 H LEU 53 H LEU 53 74.406 -0.141 -6.716 395 HA LEU 53 HA LEU 53 74.822 -2.794 -5.881 396 HB2 LEU 53 HB2 LEU 53 73.819 -0.454 -4.311 397 HB3 LEU 53 HB3 LEU 53 74.162 -2.020 -3.608 398 HG LEU 53 HG LEU 53 76.110 -0.082 -4.832 399 HD11 LEU 53 HD11 LEU 53 75.445 0.346 -2.561 400 HD12 LEU 53 HD12 LEU 53 77.125 -0.191 -2.634 401 HD13 LEU 53 HD13 LEU 53 75.864 -1.305 -2.104 402 HD21 LEU 53 HD21 LEU 53 77.857 -1.742 -4.325 403 HD22 LEU 53 HD22 LEU 53 76.771 -2.281 -5.594 404 HD23 LEU 53 HD23 LEU 53 76.606 -2.934 -3.959 405 H ILE 54 H ILE 54 71.819 -0.969 -6.151 406 HA ILE 54 HA ILE 54 70.261 -3.014 -4.861 407 HB ILE 54 HB ILE 54 69.280 -0.940 -6.865 408 HG12 ILE 54 HG12 ILE 54 70.027 0.290 -4.905 409 HG13 ILE 54 HG13 ILE 54 68.275 0.141 -4.750 410 HG21 ILE 54 HG21 ILE 54 67.751 -2.799 -6.804 411 HG22 ILE 54 HG22 ILE 54 67.021 -1.388 -6.043 412 HG23 ILE 54 HG23 ILE 54 67.651 -2.698 -5.044 413 HD11 ILE 54 HD11 ILE 54 70.251 -1.551 -3.387 414 HD12 ILE 54 HD12 ILE 54 68.482 -1.660 -3.289 415 HD13 ILE 54 HD13 ILE 54 69.322 -0.206 -2.705 416 H TYR 55 H TYR 55 70.978 -2.175 -8.140 417 HA TYR 55 HA TYR 55 69.437 -4.108 -9.326 418 HB2 TYR 55 HB2 TYR 55 71.551 -2.277 -10.217 419 HB3 TYR 55 HB3 TYR 55 71.094 -3.568 -11.313 420 HD1 TYR 55 HD1 TYR 55 69.661 -0.880 -9.199 421 HD2 TYR 55 HD2 TYR 55 69.166 -3.264 -12.672 422 HE1 TYR 55 HE1 TYR 55 67.700 0.391 -9.738 423 HE2 TYR 55 HE2 TYR 55 67.148 -1.989 -13.258 424 HH TYR 55 HH TYR 55 65.479 -0.654 -12.099 425 H GLU 56 H GLU 56 72.885 -4.157 -8.465 426 HA GLU 56 HA GLU 56 73.244 -6.748 -9.531 427 HB2 GLU 56 HB2 GLU 56 75.339 -6.888 -8.193 428 HB3 GLU 56 HB3 GLU 56 75.259 -5.472 -9.222 429 HG2 GLU 56 HG2 GLU 56 74.956 -4.058 -7.478 430 HG3 GLU 56 HG3 GLU 56 74.484 -5.288 -6.330 431 H ALA 57 H ALA 57 72.170 -5.539 -6.445 432 HA ALA 57 HA ALA 57 72.449 -7.817 -4.887 433 HB1 ALA 57 HB1 ALA 57 70.687 -6.918 -3.498 434 HB2 ALA 57 HB2 ALA 57 70.193 -5.835 -4.800 435 HB3 ALA 57 HB3 ALA 57 71.768 -5.630 -4.033 436 H ALA 58 H ALA 58 69.856 -6.883 -7.073 437 HA ALA 58 HA ALA 58 68.153 -9.033 -6.561 438 HB1 ALA 58 HB1 ALA 58 67.150 -8.549 -8.747 439 HB2 ALA 58 HB2 ALA 58 68.538 -7.542 -9.157 440 HB3 ALA 58 HB3 ALA 58 67.462 -7.069 -7.841 441 H ALA 59 H ALA 59 70.680 -8.650 -8.982 442 HA ALA 59 HA ALA 59 70.461 -11.218 -10.161 443 HB1 ALA 59 HB1 ALA 59 72.655 -10.751 -11.139 444 HB2 ALA 59 HB2 ALA 59 72.871 -9.399 -10.028 445 HB3 ALA 59 HB3 ALA 59 71.605 -9.340 -11.257 446 H ARG 60 H ARG 60 72.440 -9.962 -7.587 447 HA ARG 60 HA ARG 60 73.950 -12.297 -7.095 448 HB2 ARG 60 HB2 ARG 60 73.367 -9.916 -5.333 449 HB3 ARG 60 HB3 ARG 60 74.478 -11.215 -4.908 450 HG2 ARG 60 HG2 ARG 60 75.939 -10.646 -6.730 451 HG3 ARG 60 HG3 ARG 60 74.770 -9.487 -7.353 452 HD2 ARG 60 HD2 ARG 60 76.635 -8.416 -6.113 453 HD3 ARG 60 HD3 ARG 60 75.051 -8.065 -5.428 454 HE ARG 60 HE ARG 60 76.048 -10.287 -4.114 455 HH11 ARG 60 HH11 ARG 60 77.005 -6.863 -4.446 456 HH12 ARG 60 HH12 ARG 60 77.677 -6.769 -2.886 457 HH21 ARG 60 HH21 ARG 60 76.920 -10.145 -2.020 458 HH22 ARG 60 HH22 ARG 60 77.623 -8.700 -1.432 459 H ALA 61 H ALA 61 70.824 -11.226 -5.929 460 HA ALA 61 HA ALA 61 70.649 -13.344 -3.987 461 HB1 ALA 61 HB1 ALA 61 69.420 -11.238 -3.656 462 HB2 ALA 61 HB2 ALA 61 68.330 -12.626 -3.693 463 HB3 ALA 61 HB3 ALA 61 68.469 -11.575 -5.103 464 H ALA 62 H ALA 62 69.420 -12.761 -7.250 465 HA ALA 62 HA ALA 62 67.847 -15.068 -7.470 466 HB1 ALA 62 HB1 ALA 62 67.923 -14.700 -9.876 467 HB2 ALA 62 HB2 ALA 62 69.281 -13.592 -9.678 468 HB3 ALA 62 HB3 ALA 62 67.697 -13.171 -9.027 469 H ALA 63 H ALA 63 71.207 -14.515 -8.315 470 HA ALA 63 HA ALA 63 71.552 -17.412 -8.117 471 HB1 ALA 63 HB1 ALA 63 71.805 -16.805 -10.467 472 HB2 ALA 63 HB2 ALA 63 73.373 -17.246 -9.770 473 HB3 ALA 63 HB3 ALA 63 72.970 -15.554 -10.025 474 H ASN 64 H ASN 64 71.992 -17.016 -5.924 475 HA ASN 64 HA ASN 64 74.171 -15.337 -5.301 476 HB2 ASN 64 HB2 ASN 64 73.908 -16.167 -2.938 477 HB3 ASN 64 HB3 ASN 64 72.569 -15.292 -3.651 478 HD21 ASN 64 HD21 ASN 64 71.009 -16.108 -2.317 479 HD22 ASN 64 HD22 ASN 64 70.540 -17.766 -2.290 480 HA PRO 65 HA PRO 65 77.107 -18.421 -5.550 481 HB2 PRO 65 HB2 PRO 65 79.321 -16.928 -5.276 482 HB3 PRO 65 HB3 PRO 65 78.279 -16.793 -6.702 483 HG2 PRO 65 HG2 PRO 65 78.439 -15.009 -4.307 484 HG3 PRO 65 HG3 PRO 65 78.200 -14.574 -6.005 485 HD2 PRO 65 HD2 PRO 65 76.163 -14.831 -4.089 486 HD3 PRO 65 HD3 PRO 65 75.944 -14.821 -5.850 487 H GLY 66 H GLY 66 76.205 -16.838 -2.800 488 HA2 GLY 66 HA2 GLY 66 76.398 -18.140 -0.702 489 HA3 GLY 66 HA3 GLY 66 78.102 -18.335 -1.115 490 H GLY 67 H GLY 67 78.263 -17.505 1.070 491 HA2 GLY 67 HA2 GLY 67 79.121 -15.810 2.371 492 HA3 GLY 67 HA3 GLY 67 79.158 -14.883 0.867 493 H ASP 68 H ASP 68 78.048 -13.106 0.933 494 HA ASP 68 HA ASP 68 75.810 -12.849 2.787 495 HB2 ASP 68 HB2 ASP 68 77.261 -10.779 1.111 496 HB3 ASP 68 HB3 ASP 68 75.856 -10.421 2.106 497 H GLY 69 H GLY 69 76.433 -13.612 -0.400 498 HA2 GLY 69 HA2 GLY 69 75.113 -14.041 -2.169 499 HA3 GLY 69 HA3 GLY 69 73.727 -13.858 -1.107 500 H GLY 70 H GLY 70 72.518 -12.149 -1.293 501 HA2 GLY 70 HA2 GLY 70 73.458 -9.714 -2.482 502 HA3 GLY 70 HA3 GLY 70 72.352 -10.663 -3.486 503 H GLY 71 H GLY 71 70.663 -9.229 -3.397 504 HA2 GLY 71 HA2 GLY 71 68.732 -8.491 -2.602 505 HA3 GLY 71 HA3 GLY 71 68.941 -9.607 -1.264 506 HA PRO 72 HA PRO 72 68.831 -5.364 0.361 507 HB2 PRO 72 HB2 PRO 72 67.477 -6.058 2.620 508 HB3 PRO 72 HB3 PRO 72 66.715 -5.609 1.100 509 HG2 PRO 72 HG2 PRO 72 67.071 -8.280 2.323 510 HG3 PRO 72 HG3 PRO 72 65.817 -7.724 1.208 511 HD2 PRO 72 HD2 PRO 72 67.992 -9.309 0.581 512 HD3 PRO 72 HD3 PRO 72 67.016 -8.428 -0.600 513 H GLU 73 H GLU 73 69.231 -8.085 2.641 514 HA GLU 73 HA GLU 73 70.722 -6.547 4.430 515 HB2 GLU 73 HB2 GLU 73 70.388 -9.531 4.279 516 HB3 GLU 73 HB3 GLU 73 71.096 -8.661 5.634 517 HG2 GLU 73 HG2 GLU 73 69.030 -7.414 5.932 518 HG3 GLU 73 HG3 GLU 73 68.320 -8.264 4.577 519 H GLY 74 H GLY 74 71.824 -7.522 1.561 520 HA2 GLY 74 HA2 GLY 74 74.446 -7.521 2.745 521 HA3 GLY 74 HA3 GLY 74 74.222 -8.359 1.164 522 H ILE 75 H ILE 75 72.619 -5.837 0.410 523 HA ILE 75 HA ILE 75 74.803 -4.308 -0.550 524 HB ILE 75 HB ILE 75 73.040 -2.581 -1.147 525 HG12 ILE 75 HG12 ILE 75 71.262 -4.711 0.051 526 HG13 ILE 75 HG13 ILE 75 71.508 -3.053 0.582 527 HG21 ILE 75 HG21 ILE 75 72.644 -5.405 -2.071 528 HG22 ILE 75 HG22 ILE 75 73.820 -4.245 -2.705 529 HG23 ILE 75 HG23 ILE 75 72.089 -3.950 -2.902 530 HD11 ILE 75 HD11 ILE 75 70.378 -2.225 -1.335 531 HD12 ILE 75 HD12 ILE 75 69.368 -3.439 -0.524 532 HD13 ILE 75 HD13 ILE 75 70.227 -3.854 -2.009 533 H VAL 76 H VAL 76 72.721 -4.015 2.198 534 HA VAL 76 HA VAL 76 73.482 -1.504 3.189 535 HB VAL 76 HB VAL 76 71.698 -2.513 4.170 536 HG11 VAL 76 HG11 VAL 76 71.515 -4.467 3.679 537 HG12 VAL 76 HG12 VAL 76 71.778 -4.658 5.424 538 HG13 VAL 76 HG13 VAL 76 73.093 -5.002 4.270 539 HG21 VAL 76 HG21 VAL 76 73.842 -2.836 6.249 540 HG22 VAL 76 HG22 VAL 76 72.116 -2.767 6.595 541 HG23 VAL 76 HG23 VAL 76 72.937 -1.360 5.923 542 H LYS 77 H LYS 77 74.723 -4.545 3.664 543 HA LYS 77 HA LYS 77 76.891 -3.903 5.356 544 HB2 LYS 77 HB2 LYS 77 76.195 -6.228 5.036 545 HB3 LYS 77 HB3 LYS 77 76.748 -6.163 3.369 546 HG2 LYS 77 HG2 LYS 77 79.035 -5.899 4.089 547 HG3 LYS 77 HG3 LYS 77 78.525 -5.860 5.778 548 HD2 LYS 77 HD2 LYS 77 77.646 -8.113 5.569 549 HD3 LYS 77 HD3 LYS 77 78.125 -8.147 3.874 550 HE2 LYS 77 HE2 LYS 77 80.451 -7.933 4.499 551 HE3 LYS 77 HE3 LYS 77 80.004 -7.808 6.201 552 HZ1 LYS 77 HZ1 LYS 77 79.443 -10.150 4.472 553 HZ2 LYS 77 HZ2 LYS 77 79.117 -10.002 6.124 554 HZ3 LYS 77 HZ3 LYS 77 80.721 -10.037 5.591 555 H GLU 78 H GLU 78 76.804 -4.230 1.807 556 HA GLU 78 HA GLU 78 79.470 -3.474 1.325 557 HB2 GLU 78 HB2 GLU 78 77.845 -4.470 -0.366 558 HB3 GLU 78 HB3 GLU 78 77.110 -2.894 -0.560 559 HG2 GLU 78 HG2 GLU 78 78.614 -3.163 -2.328 560 HG3 GLU 78 HG3 GLU 78 79.378 -2.042 -1.200 561 H ILE 79 H ILE 79 76.547 -1.587 1.678 562 HA ILE 79 HA ILE 79 77.560 0.978 1.192 563 HB ILE 79 HB ILE 79 75.234 -0.013 2.847 564 HG12 ILE 79 HG12 ILE 79 74.929 -0.304 0.477 565 HG13 ILE 79 HG13 ILE 79 73.853 0.962 1.052 566 HG21 ILE 79 HG21 ILE 79 75.882 2.024 3.908 567 HG22 ILE 79 HG22 ILE 79 74.364 2.242 3.039 568 HG23 ILE 79 HG23 ILE 79 75.867 2.876 2.363 569 HD11 ILE 79 HD11 ILE 79 75.448 2.636 0.188 570 HD12 ILE 79 HD12 ILE 79 74.759 1.588 -1.045 571 HD13 ILE 79 HD13 ILE 79 76.409 1.316 -0.493 572 H LYS 80 H LYS 80 77.304 -0.839 4.217 573 HA LYS 80 HA LYS 80 78.226 1.364 5.698 574 HB2 LYS 80 HB2 LYS 80 78.117 0.031 7.667 575 HB3 LYS 80 HB3 LYS 80 76.845 -0.512 6.586 576 HG2 LYS 80 HG2 LYS 80 78.169 -2.463 5.985 577 HG3 LYS 80 HG3 LYS 80 79.432 -1.925 7.097 578 HD2 LYS 80 HD2 LYS 80 77.846 -1.997 8.960 579 HD3 LYS 80 HD3 LYS 80 76.584 -2.547 7.868 580 HE2 LYS 80 HE2 LYS 80 77.457 -4.439 9.070 581 HE3 LYS 80 HE3 LYS 80 77.933 -4.560 7.380 582 HZ1 LYS 80 HZ1 LYS 80 80.181 -3.780 8.020 583 HZ2 LYS 80 HZ2 LYS 80 79.730 -5.130 8.901 584 HZ3 LYS 80 HZ3 LYS 80 79.663 -3.639 9.614 585 H GLU 81 H GLU 81 79.798 -1.383 4.214 586 HA GLU 81 HA GLU 81 82.260 -0.959 5.493 587 HB2 GLU 81 HB2 GLU 81 81.664 -2.445 2.933 588 HB3 GLU 81 HB3 GLU 81 83.231 -2.444 3.732 589 HG2 GLU 81 HG2 GLU 81 82.099 -3.359 5.759 590 HG3 GLU 81 HG3 GLU 81 80.644 -3.545 4.790 591 H TRP 82 H TRP 82 80.935 0.186 2.456 592 HA TRP 82 HA TRP 82 83.266 1.466 1.528 593 HB2 TRP 82 HB2 TRP 82 81.311 0.940 0.125 594 HB3 TRP 82 HB3 TRP 82 80.349 2.088 1.039 595 HD1 TRP 82 HD1 TRP 82 83.120 1.920 -1.574 596 HE1 TRP 82 HE1 TRP 82 83.236 4.174 -2.820 597 HE3 TRP 82 HE3 TRP 82 79.865 4.619 1.306 598 HZ2 TRP 82 HZ2 TRP 82 82.084 6.721 -2.642 599 HZ3 TRP 82 HZ3 TRP 82 79.433 6.969 0.706 600 HH2 TRP 82 HH2 TRP 82 80.520 8.002 -1.209 601 H ARG 83 H ARG 83 80.487 2.598 3.410 602 HA ARG 83 HA ARG 83 81.385 5.283 3.395 603 HB2 ARG 83 HB2 ARG 83 78.980 4.141 3.894 604 HB3 ARG 83 HB3 ARG 83 79.529 4.552 5.519 605 HG2 ARG 83 HG2 ARG 83 79.751 6.808 5.024 606 HG3 ARG 83 HG3 ARG 83 79.517 6.535 3.283 607 HD2 ARG 83 HD2 ARG 83 77.265 5.667 3.848 608 HD3 ARG 83 HD3 ARG 83 77.567 6.174 5.509 609 HE ARG 83 HE ARG 83 78.014 8.410 4.021 610 HH11 ARG 83 HH11 ARG 83 75.354 6.186 4.565 611 HH12 ARG 83 HH12 ARG 83 74.164 7.354 4.135 612 HH21 ARG 83 HH21 ARG 83 76.295 10.007 3.418 613 HH22 ARG 83 HH22 ARG 83 74.702 9.475 3.540 614 H ALA 84 H ALA 84 81.672 2.686 5.759 615 HA ALA 84 HA ALA 84 82.717 4.331 7.813 616 HB1 ALA 84 HB1 ALA 84 81.747 2.116 8.265 617 HB2 ALA 84 HB2 ALA 84 83.384 2.254 8.902 618 HB3 ALA 84 HB3 ALA 84 83.090 1.362 7.407 619 H ALA 85 H ALA 85 84.199 2.470 5.197 620 HA ALA 85 HA ALA 85 86.870 2.943 6.017 621 HB1 ALA 85 HB1 ALA 85 86.216 1.137 4.471 622 HB2 ALA 85 HB2 ALA 85 87.487 2.167 3.823 623 HB3 ALA 85 HB3 ALA 85 85.827 2.351 3.249 624 H ASN 86 H ASN 86 84.567 4.666 4.092 625 HA ASN 86 HA ASN 86 86.354 6.617 3.004 626 HB2 ASN 86 HB2 ASN 86 83.923 6.001 2.156 627 HB3 ASN 86 HB3 ASN 86 83.400 7.015 3.471 628 HD21 ASN 86 HD21 ASN 86 83.029 7.319 0.598 629 HD22 ASN 86 HD22 ASN 86 83.697 8.862 0.213 630 H GLY 87 H GLY 87 84.537 6.265 5.966 631 HA2 GLY 87 HA2 GLY 87 84.896 7.425 7.968 632 HA3 GLY 87 HA3 GLY 87 85.821 8.634 7.076 633 H LYS 88 H LYS 88 82.701 7.545 5.956 634 HA LYS 88 HA LYS 88 81.655 10.173 6.444 635 HB2 LYS 88 HB2 LYS 88 81.475 8.104 4.351 636 HB3 LYS 88 HB3 LYS 88 80.074 9.106 4.626 637 HG2 LYS 88 HG2 LYS 88 81.396 11.100 4.130 638 HG3 LYS 88 HG3 LYS 88 82.859 10.128 4.025 639 HD2 LYS 88 HD2 LYS 88 81.968 10.761 1.797 640 HD3 LYS 88 HD3 LYS 88 82.040 9.024 2.041 641 HE2 LYS 88 HE2 LYS 88 80.023 9.685 0.911 642 HE3 LYS 88 HE3 LYS 88 79.707 8.936 2.468 643 HZ1 LYS 88 HZ1 LYS 88 79.613 11.857 1.781 644 HZ2 LYS 88 HZ2 LYS 88 79.435 11.335 3.341 645 HZ3 LYS 88 HZ3 LYS 88 78.264 10.967 2.199 646 HA PRO 89 HA PRO 89 78.992 8.462 9.598 647 HB2 PRO 89 HB2 PRO 89 77.063 10.292 8.263 648 HB3 PRO 89 HB3 PRO 89 77.367 10.113 9.989 649 HG2 PRO 89 HG2 PRO 89 78.385 12.168 8.673 650 HG3 PRO 89 HG3 PRO 89 79.358 11.309 9.880 651 HD2 PRO 89 HD2 PRO 89 79.565 11.265 6.903 652 HD3 PRO 89 HD3 PRO 89 80.826 11.078 8.134 653 H GLY 90 H GLY 90 78.164 6.564 9.459 654 HA2 GLY 90 HA2 GLY 90 76.580 5.800 7.143 655 HA3 GLY 90 HA3 GLY 90 77.280 4.710 8.336 656 H PHE 91 H PHE 91 75.790 3.743 9.485 657 HA PHE 91 HA PHE 91 73.088 4.810 9.516 658 HB2 PHE 91 HB2 PHE 91 74.054 2.299 10.874 659 HB3 PHE 91 HB3 PHE 91 72.427 2.689 10.340 660 HD1 PHE 91 HD1 PHE 91 72.628 3.417 7.630 661 HD2 PHE 91 HD2 PHE 91 74.894 0.526 9.752 662 HE1 PHE 91 HE1 PHE 91 73.068 2.211 5.527 663 HE2 PHE 91 HE2 PHE 91 75.321 -0.675 7.691 664 HZ PHE 91 HZ PHE 91 74.425 0.170 5.555 665 H LYS 92 H LYS 92 71.890 4.833 11.606 666 HA LYS 92 HA LYS 92 73.523 5.809 13.753 667 HB2 LYS 92 HB2 LYS 92 71.472 6.429 14.724 668 HB3 LYS 92 HB3 LYS 92 71.294 6.782 13.050 669 HG2 LYS 92 HG2 LYS 92 69.863 4.955 12.675 670 HG3 LYS 92 HG3 LYS 92 70.322 4.212 14.211 671 HD2 LYS 92 HD2 LYS 92 68.810 6.823 13.965 672 HD3 LYS 92 HD3 LYS 92 68.041 5.257 14.224 673 HE2 LYS 92 HE2 LYS 92 69.395 5.012 16.318 674 HE3 LYS 92 HE3 LYS 92 70.006 6.640 16.060 675 HZ1 LYS 92 HZ1 LYS 92 67.156 5.939 16.505 676 HZ2 LYS 92 HZ2 LYS 92 67.774 7.481 16.228 677 HZ3 LYS 92 HZ3 LYS 92 68.197 6.662 17.619 678 H GLN 93 H GLN 93 72.577 4.844 15.927 679 HA GLN 93 HA GLN 93 73.129 2.026 15.709 680 HB2 GLN 93 HB2 GLN 93 73.299 4.100 17.760 681 HB3 GLN 93 HB3 GLN 93 73.234 2.420 18.277 682 HG2 GLN 93 HG2 GLN 93 75.544 3.016 18.214 683 HG3 GLN 93 HG3 GLN 93 75.256 2.041 16.780 684 HE21 GLN 93 HE21 GLN 93 74.458 5.455 17.229 685 HE22 GLN 93 HE22 GLN 93 75.537 6.062 16.046 686 H GLY 94 H GLY 94 71.835 0.593 16.318 687 HA2 GLY 94 HA2 GLY 94 69.908 0.408 18.085 688 HA3 GLY 94 HA3 GLY 94 69.085 1.197 16.734 Start of MODEL 4 1 H GLU 2 H GLU 2 59.941 2.107 8.913 2 HA GLU 2 HA GLU 2 59.522 3.370 6.893 3 HB2 GLU 2 HB2 GLU 2 59.255 5.600 8.030 4 HB3 GLU 2 HB3 GLU 2 58.559 4.238 8.897 5 HG2 GLU 2 HG2 GLU 2 60.389 4.185 10.413 6 HG3 GLU 2 HG3 GLU 2 61.267 5.374 9.468 7 H LEU 3 H LEU 3 60.057 5.775 6.207 8 HA LEU 3 HA LEU 3 62.790 5.666 5.299 9 HB2 LEU 3 HB2 LEU 3 60.480 7.452 4.535 10 HB3 LEU 3 HB3 LEU 3 62.085 7.577 3.839 11 HG LEU 3 HG LEU 3 60.238 5.208 3.609 12 HD11 LEU 3 HD11 LEU 3 59.511 7.101 2.224 13 HD12 LEU 3 HD12 LEU 3 60.161 5.815 1.212 14 HD13 LEU 3 HD13 LEU 3 61.131 7.241 1.551 15 HD21 LEU 3 HD21 LEU 3 62.972 5.705 2.479 16 HD22 LEU 3 HD22 LEU 3 61.924 4.340 2.068 17 HD23 LEU 3 HD23 LEU 3 62.535 4.531 3.718 18 H LYS 4 H LYS 4 64.303 7.228 5.791 19 HA LYS 4 HA LYS 4 63.586 9.195 7.843 20 HB2 LYS 4 HB2 LYS 4 66.347 8.175 7.186 21 HB3 LYS 4 HB3 LYS 4 65.855 9.111 8.590 22 HG2 LYS 4 HG2 LYS 4 65.498 6.208 7.965 23 HG3 LYS 4 HG3 LYS 4 66.264 6.921 9.365 24 HD2 LYS 4 HD2 LYS 4 63.796 7.875 9.642 25 HD3 LYS 4 HD3 LYS 4 63.474 6.440 8.702 26 HE2 LYS 4 HE2 LYS 4 64.858 5.083 10.295 27 HE3 LYS 4 HE3 LYS 4 64.949 6.492 11.325 28 HZ1 LYS 4 HZ1 LYS 4 63.236 5.214 12.222 29 HZ2 LYS 4 HZ2 LYS 4 62.650 4.788 10.742 30 HZ3 LYS 4 HZ3 LYS 4 62.377 6.374 11.323 31 H ASN 5 H ASN 5 65.385 11.063 7.651 32 HA ASN 5 HA ASN 5 65.227 11.908 4.880 33 HB2 ASN 5 HB2 ASN 5 66.026 13.455 7.360 34 HB3 ASN 5 HB3 ASN 5 66.101 14.126 5.736 35 HD21 ASN 5 HD21 ASN 5 64.175 14.577 4.668 36 HD22 ASN 5 HD22 ASN 5 62.654 14.666 5.485 37 H SER 6 H SER 6 67.654 11.141 7.309 38 HA SER 6 HA SER 6 69.596 11.027 5.128 39 HB2 SER 6 HB2 SER 6 71.334 11.713 6.747 40 HB3 SER 6 HB3 SER 6 70.141 12.977 6.448 41 HG SER 6 HG SER 6 69.520 12.881 8.417 42 H ILE 7 H ILE 7 71.517 9.603 5.752 43 HA ILE 7 HA ILE 7 70.631 6.973 6.366 44 HB ILE 7 HB ILE 7 72.624 7.725 4.893 45 HG12 ILE 7 HG12 ILE 7 74.069 5.701 5.604 46 HG13 ILE 7 HG13 ILE 7 72.817 5.427 6.813 47 HG21 ILE 7 HG21 ILE 7 74.055 7.750 7.525 48 HG22 ILE 7 HG22 ILE 7 73.694 9.145 6.519 49 HG23 ILE 7 HG23 ILE 7 74.801 7.900 5.929 50 HD11 ILE 7 HD11 ILE 7 72.420 5.580 3.857 51 HD12 ILE 7 HD12 ILE 7 71.160 5.229 5.052 52 HD13 ILE 7 HD13 ILE 7 72.507 4.106 4.809 53 H SER 8 H SER 8 71.446 9.579 8.342 54 HA SER 8 HA SER 8 72.854 8.181 10.385 55 HB2 SER 8 HB2 SER 8 71.793 11.002 10.265 56 HB3 SER 8 HB3 SER 8 72.906 10.369 11.486 57 HG SER 8 HG SER 8 74.420 10.042 9.957 58 H ASP 9 H ASP 9 69.552 8.758 9.676 59 HA ASP 9 HA ASP 9 68.795 8.304 12.489 60 HB2 ASP 9 HB2 ASP 9 67.572 10.012 10.764 61 HB3 ASP 9 HB3 ASP 9 66.832 8.541 10.272 62 H TYR 10 H TYR 10 69.824 6.548 10.102 63 HA TYR 10 HA TYR 10 67.638 4.626 9.958 64 HB2 TYR 10 HB2 TYR 10 69.870 5.312 8.148 65 HB3 TYR 10 HB3 TYR 10 69.525 3.601 8.301 66 HD1 TYR 10 HD1 TYR 10 67.181 2.812 7.806 67 HD2 TYR 10 HD2 TYR 10 68.550 6.688 6.723 68 HE1 TYR 10 HE1 TYR 10 65.377 2.973 6.132 69 HE2 TYR 10 HE2 TYR 10 66.740 6.846 5.041 70 HH TYR 10 HH TYR 10 64.181 4.527 4.951 71 H THR 11 H THR 11 67.703 3.024 11.363 72 HA THR 11 HA THR 11 70.201 2.111 12.436 73 HB THR 11 HB THR 11 68.811 0.289 13.404 74 HG1 THR 11 HG1 THR 11 66.485 0.428 12.926 75 HG21 THR 11 HG21 THR 11 67.176 1.598 14.702 76 HG22 THR 11 HG22 THR 11 67.429 2.966 13.612 77 HG23 THR 11 HG23 THR 11 68.750 2.384 14.628 78 H GLU 12 H GLU 12 70.921 -0.177 11.772 79 HA GLU 12 HA GLU 12 70.740 -0.216 8.980 80 HB2 GLU 12 HB2 GLU 12 71.977 -2.425 9.106 81 HB3 GLU 12 HB3 GLU 12 72.792 -1.002 9.722 82 HG2 GLU 12 HG2 GLU 12 72.300 -1.650 11.960 83 HG3 GLU 12 HG3 GLU 12 71.392 -3.046 11.457 84 H ALA 13 H ALA 13 68.928 -1.847 11.400 85 HA ALA 13 HA ALA 13 67.636 -3.661 9.601 86 HB1 ALA 13 HB1 ALA 13 67.588 -4.018 12.046 87 HB2 ALA 13 HB2 ALA 13 65.961 -3.955 11.374 88 HB3 ALA 13 HB3 ALA 13 66.616 -2.560 12.229 89 H GLU 14 H GLU 14 66.814 -0.326 10.670 90 HA GLU 14 HA GLU 14 64.366 -0.044 9.310 91 HB2 GLU 14 HB2 GLU 14 66.537 1.855 10.101 92 HB3 GLU 14 HB3 GLU 14 65.329 2.443 8.983 93 HG2 GLU 14 HG2 GLU 14 64.725 1.276 11.691 94 HG3 GLU 14 HG3 GLU 14 64.916 2.998 11.365 95 H PHE 15 H PHE 15 67.656 0.243 8.293 96 HA PHE 15 HA PHE 15 67.066 1.136 5.690 97 HB2 PHE 15 HB2 PHE 15 69.260 1.378 7.024 98 HB3 PHE 15 HB3 PHE 15 69.583 -0.266 6.516 99 HD1 PHE 15 HD1 PHE 15 68.627 3.027 5.065 100 HD2 PHE 15 HD2 PHE 15 70.753 -0.601 4.611 101 HE1 PHE 15 HE1 PHE 15 69.620 3.878 2.973 102 HE2 PHE 15 HE2 PHE 15 71.752 0.237 2.520 103 HZ PHE 15 HZ PHE 15 71.180 2.482 1.711 104 H VAL 16 H VAL 16 67.873 -2.084 7.076 105 HA VAL 16 HA VAL 16 67.793 -3.371 4.595 106 HB VAL 16 HB VAL 16 67.846 -5.459 5.593 107 HG11 VAL 16 HG11 VAL 16 69.399 -5.471 7.388 108 HG12 VAL 16 HG12 VAL 16 69.205 -3.716 7.502 109 HG13 VAL 16 HG13 VAL 16 69.782 -4.450 6.003 110 HG21 VAL 16 HG21 VAL 16 65.889 -5.499 6.802 111 HG22 VAL 16 HG22 VAL 16 66.515 -4.384 8.029 112 HG23 VAL 16 HG23 VAL 16 67.202 -6.035 7.854 113 H GLN 17 H GLN 17 65.188 -2.584 6.836 114 HA GLN 17 HA GLN 17 63.124 -4.046 5.745 115 HB2 GLN 17 HB2 GLN 17 63.075 -2.872 7.866 116 HB3 GLN 17 HB3 GLN 17 63.328 -1.343 7.065 117 HG2 GLN 17 HG2 GLN 17 60.945 -2.931 6.438 118 HG3 GLN 17 HG3 GLN 17 61.043 -2.083 7.993 119 HE21 GLN 17 HE21 GLN 17 60.570 -1.725 4.554 120 HE22 GLN 17 HE22 GLN 17 60.264 -0.038 4.569 121 H LEU 18 H LEU 18 64.397 -0.886 4.965 122 HA LEU 18 HA LEU 18 62.639 -0.314 2.841 123 HB2 LEU 18 HB2 LEU 18 63.890 1.279 4.159 124 HB3 LEU 18 HB3 LEU 18 65.391 0.778 3.599 125 HG LEU 18 HG LEU 18 64.531 2.931 2.586 126 HD11 LEU 18 HD11 LEU 18 66.402 1.763 1.620 127 HD12 LEU 18 HD12 LEU 18 65.378 2.467 0.364 128 HD13 LEU 18 HD13 LEU 18 65.296 0.736 0.708 129 HD21 LEU 18 HD21 LEU 18 62.223 2.186 2.198 130 HD22 LEU 18 HD22 LEU 18 62.812 1.056 0.972 131 HD23 LEU 18 HD23 LEU 18 63.013 2.798 0.748 132 H LEU 19 H LEU 19 65.805 -1.640 3.040 133 HA LEU 19 HA LEU 19 66.464 -2.015 0.384 134 HB2 LEU 19 HB2 LEU 19 67.037 -3.449 2.814 135 HB3 LEU 19 HB3 LEU 19 67.877 -3.927 1.310 136 HG LEU 19 HG LEU 19 68.048 -1.451 2.996 137 HD11 LEU 19 HD11 LEU 19 69.566 -3.130 3.559 138 HD12 LEU 19 HD12 LEU 19 70.432 -1.826 2.719 139 HD13 LEU 19 HD13 LEU 19 70.051 -3.327 1.880 140 HD21 LEU 19 HD21 LEU 19 67.720 -0.584 0.821 141 HD22 LEU 19 HD22 LEU 19 68.945 -1.681 0.151 142 HD23 LEU 19 HD23 LEU 19 69.410 -0.403 1.291 143 H LYS 20 H LYS 20 64.842 -4.239 2.567 144 HA LYS 20 HA LYS 20 64.452 -6.405 0.820 145 HB2 LYS 20 HB2 LYS 20 62.855 -5.510 3.229 146 HB3 LYS 20 HB3 LYS 20 62.657 -7.071 2.454 147 HG2 LYS 20 HG2 LYS 20 64.956 -7.665 3.020 148 HG3 LYS 20 HG3 LYS 20 65.208 -6.066 3.694 149 HD2 LYS 20 HD2 LYS 20 64.849 -7.629 5.498 150 HD3 LYS 20 HD3 LYS 20 63.471 -6.535 5.397 151 HE2 LYS 20 HE2 LYS 20 62.187 -8.209 4.244 152 HE3 LYS 20 HE3 LYS 20 63.585 -9.287 4.215 153 HZ1 LYS 20 HZ1 LYS 20 63.514 -9.327 6.647 154 HZ2 LYS 20 HZ2 LYS 20 62.127 -9.937 5.950 155 HZ3 LYS 20 HZ3 LYS 20 62.099 -8.390 6.638 156 H GLU 21 H GLU 21 62.601 -3.495 1.445 157 HA GLU 21 HA GLU 21 60.474 -4.356 -0.180 158 HB2 GLU 21 HB2 GLU 21 61.072 -1.705 1.044 159 HB3 GLU 21 HB3 GLU 21 59.695 -1.924 -0.016 160 HG2 GLU 21 HG2 GLU 21 59.202 -3.935 1.621 161 HG3 GLU 21 HG3 GLU 21 60.191 -2.970 2.719 162 H ILE 22 H ILE 22 63.322 -2.394 -0.756 163 HA ILE 22 HA ILE 22 62.593 -1.444 -3.289 164 HB ILE 22 HB ILE 22 65.407 -2.344 -2.589 165 HG12 ILE 22 HG12 ILE 22 64.134 0.374 -2.172 166 HG13 ILE 22 HG13 ILE 22 64.625 -0.735 -0.901 167 HG21 ILE 22 HG21 ILE 22 65.002 -1.928 -4.956 168 HG22 ILE 22 HG22 ILE 22 66.051 -0.670 -4.288 169 HG23 ILE 22 HG23 ILE 22 64.346 -0.338 -4.578 170 HD11 ILE 22 HD11 ILE 22 66.956 -0.512 -1.577 171 HD12 ILE 22 HD12 ILE 22 66.257 1.065 -1.206 172 HD13 ILE 22 HD13 ILE 22 66.482 0.572 -2.882 173 H GLU 23 H GLU 23 64.101 -4.471 -2.295 174 HA GLU 23 HA GLU 23 64.630 -5.621 -4.790 175 HB2 GLU 23 HB2 GLU 23 63.627 -6.853 -2.290 176 HB3 GLU 23 HB3 GLU 23 64.166 -7.818 -3.632 177 HG2 GLU 23 HG2 GLU 23 66.404 -6.557 -3.282 178 HG3 GLU 23 HG3 GLU 23 65.687 -6.094 -1.729 179 H LYS 24 H LYS 24 61.790 -5.665 -2.808 180 HA LYS 24 HA LYS 24 60.213 -7.461 -4.235 181 HB2 LYS 24 HB2 LYS 24 59.758 -6.954 -1.992 182 HB3 LYS 24 HB3 LYS 24 59.605 -5.239 -2.337 183 HG2 LYS 24 HG2 LYS 24 57.560 -5.670 -3.622 184 HG3 LYS 24 HG3 LYS 24 57.702 -7.391 -3.270 185 HD2 LYS 24 HD2 LYS 24 56.081 -6.246 -1.855 186 HD3 LYS 24 HD3 LYS 24 57.386 -6.971 -0.905 187 HE2 LYS 24 HE2 LYS 24 58.450 -4.729 -0.746 188 HE3 LYS 24 HE3 LYS 24 57.118 -4.046 -1.676 189 HZ1 LYS 24 HZ1 LYS 24 56.880 -3.690 0.715 190 HZ2 LYS 24 HZ2 LYS 24 56.806 -5.353 1.000 191 HZ3 LYS 24 HZ3 LYS 24 55.622 -4.586 0.084 192 H GLU 25 H GLU 25 60.377 -3.889 -4.399 193 HA GLU 25 HA GLU 25 58.400 -4.008 -6.462 194 HB2 GLU 25 HB2 GLU 25 58.580 -1.478 -6.451 195 HB3 GLU 25 HB3 GLU 25 58.062 -2.177 -4.891 196 HG2 GLU 25 HG2 GLU 25 59.482 -0.420 -4.449 197 HG3 GLU 25 HG3 GLU 25 60.585 -1.813 -4.360 198 H ASN 26 H ASN 26 61.821 -3.639 -6.227 199 HA ASN 26 HA ASN 26 62.396 -2.527 -8.724 200 HB2 ASN 26 HB2 ASN 26 64.007 -2.740 -6.839 201 HB3 ASN 26 HB3 ASN 26 64.109 -4.464 -7.161 202 HD21 ASN 26 HD21 ASN 26 64.928 -1.318 -8.225 203 HD22 ASN 26 HD22 ASN 26 66.101 -1.766 -9.416 204 H VAL 27 H VAL 27 61.995 -5.897 -7.784 205 HA VAL 27 HA VAL 27 62.625 -6.781 -10.453 206 HB VAL 27 HB VAL 27 62.055 -9.053 -9.699 207 HG11 VAL 27 HG11 VAL 27 64.301 -8.237 -9.306 208 HG12 VAL 27 HG12 VAL 27 63.802 -9.292 -7.984 209 HG13 VAL 27 HG13 VAL 27 63.803 -7.543 -7.764 210 HG21 VAL 27 HG21 VAL 27 61.326 -7.746 -7.071 211 HG22 VAL 27 HG22 VAL 27 61.426 -9.484 -7.358 212 HG23 VAL 27 HG23 VAL 27 60.206 -8.518 -8.191 213 H ALA 28 H ALA 28 59.965 -5.425 -9.106 214 HA ALA 28 HA ALA 28 58.079 -6.757 -10.918 215 HB1 ALA 28 HB1 ALA 28 56.324 -5.607 -9.602 216 HB2 ALA 28 HB2 ALA 28 57.568 -4.800 -8.652 217 HB3 ALA 28 HB3 ALA 28 57.383 -6.538 -8.544 218 H ALA 29 H ALA 29 59.810 -3.864 -10.316 219 HA ALA 29 HA ALA 29 60.141 -1.920 -11.290 220 HB1 ALA 29 HB1 ALA 29 58.864 -3.119 -13.746 221 HB2 ALA 29 HB2 ALA 29 60.577 -3.238 -13.334 222 HB3 ALA 29 HB3 ALA 29 59.860 -1.666 -13.699 223 H THR 30 H THR 30 58.830 -0.875 -9.884 224 HA THR 30 HA THR 30 56.026 -0.544 -10.521 225 HB THR 30 HB THR 30 55.961 0.576 -8.373 226 HG1 THR 30 HG1 THR 30 58.659 0.061 -7.716 227 HG21 THR 30 HG21 THR 30 55.887 -1.890 -8.497 228 HG22 THR 30 HG22 THR 30 56.634 -1.311 -7.002 229 HG23 THR 30 HG23 THR 30 57.648 -1.898 -8.333 230 H ASP 31 H ASP 31 58.999 1.098 -10.723 231 HA ASP 31 HA ASP 31 59.761 2.914 -11.559 232 HB2 ASP 31 HB2 ASP 31 57.069 3.416 -12.809 233 HB3 ASP 31 HB3 ASP 31 58.634 4.161 -13.172 234 H ASP 32 H ASP 32 56.612 3.665 -10.184 235 HA ASP 32 HA ASP 32 57.406 6.351 -9.582 236 HB2 ASP 32 HB2 ASP 32 54.996 5.655 -9.721 237 HB3 ASP 32 HB3 ASP 32 55.252 4.755 -8.221 238 H VAL 33 H VAL 33 57.000 3.474 -7.558 239 HA VAL 33 HA VAL 33 58.223 4.940 -5.364 240 HB VAL 33 HB VAL 33 56.326 3.326 -4.935 241 HG11 VAL 33 HG11 VAL 33 58.389 1.213 -5.312 242 HG12 VAL 33 HG12 VAL 33 56.939 1.471 -6.277 243 HG13 VAL 33 HG13 VAL 33 56.800 0.967 -4.589 244 HG21 VAL 33 HG21 VAL 33 57.614 4.182 -3.090 245 HG22 VAL 33 HG22 VAL 33 58.818 2.913 -3.308 246 HG23 VAL 33 HG23 VAL 33 57.186 2.498 -2.790 247 H LEU 34 H LEU 34 59.026 2.667 -7.674 248 HA LEU 34 HA LEU 34 61.496 1.653 -6.883 249 HB2 LEU 34 HB2 LEU 34 60.194 0.913 -8.733 250 HB3 LEU 34 HB3 LEU 34 60.234 2.408 -9.520 251 HG LEU 34 HG LEU 34 61.538 0.613 -10.621 252 HD11 LEU 34 HD11 LEU 34 63.187 2.908 -9.704 253 HD12 LEU 34 HD12 LEU 34 62.135 2.816 -11.123 254 HD13 LEU 34 HD13 LEU 34 63.596 1.814 -11.036 255 HD21 LEU 34 HD21 LEU 34 63.614 -0.193 -9.678 256 HD22 LEU 34 HD22 LEU 34 62.247 -0.546 -8.609 257 HD23 LEU 34 HD23 LEU 34 63.341 0.777 -8.230 258 H ASP 35 H ASP 35 60.738 4.608 -8.630 259 HA ASP 35 HA ASP 35 63.460 5.563 -8.578 260 HB2 ASP 35 HB2 ASP 35 61.754 6.378 -10.219 261 HB3 ASP 35 HB3 ASP 35 60.958 7.205 -8.896 262 H VAL 36 H VAL 36 60.832 5.828 -6.383 263 HA VAL 36 HA VAL 36 61.948 7.959 -4.842 264 HB VAL 36 HB VAL 36 60.357 5.654 -3.749 265 HG11 VAL 36 HG11 VAL 36 60.713 8.467 -2.951 266 HG12 VAL 36 HG12 VAL 36 61.463 7.041 -2.200 267 HG13 VAL 36 HG13 VAL 36 59.680 7.280 -2.111 268 HG21 VAL 36 HG21 VAL 36 59.368 8.222 -4.800 269 HG22 VAL 36 HG22 VAL 36 58.462 6.878 -4.010 270 HG23 VAL 36 HG23 VAL 36 59.275 6.620 -5.587 271 H LEU 37 H LEU 37 61.979 4.467 -4.573 272 HA LEU 37 HA LEU 37 63.421 4.516 -2.171 273 HB2 LEU 37 HB2 LEU 37 63.289 2.202 -4.040 274 HB3 LEU 37 HB3 LEU 37 63.563 2.300 -2.311 275 HG LEU 37 HG LEU 37 60.907 2.846 -3.591 276 HD11 LEU 37 HD11 LEU 37 60.157 0.875 -2.374 277 HD12 LEU 37 HD12 LEU 37 61.811 0.592 -1.827 278 HD13 LEU 37 HD13 LEU 37 61.421 0.497 -3.544 279 HD21 LEU 37 HD21 LEU 37 61.687 2.875 -0.677 280 HD22 LEU 37 HD22 LEU 37 60.057 3.068 -1.312 281 HD23 LEU 37 HD23 LEU 37 61.283 4.291 -1.650 282 H LEU 38 H LEU 38 64.261 3.923 -5.471 283 HA LEU 38 HA LEU 38 66.923 3.280 -4.972 284 HB2 LEU 38 HB2 LEU 38 65.448 4.285 -7.345 285 HB3 LEU 38 HB3 LEU 38 67.156 3.879 -7.467 286 HG LEU 38 HG LEU 38 64.764 2.126 -6.945 287 HD11 LEU 38 HD11 LEU 38 65.558 0.930 -8.892 288 HD12 LEU 38 HD12 LEU 38 66.907 2.063 -8.999 289 HD13 LEU 38 HD13 LEU 38 65.257 2.643 -9.241 290 HD21 LEU 38 HD21 LEU 38 67.662 1.349 -6.657 291 HD22 LEU 38 HD22 LEU 38 66.316 0.217 -6.740 292 HD23 LEU 38 HD23 LEU 38 66.433 1.339 -5.389 293 H GLU 39 H GLU 39 65.453 6.386 -5.716 294 HA GLU 39 HA GLU 39 67.933 7.767 -5.643 295 HB2 GLU 39 HB2 GLU 39 65.106 8.609 -5.343 296 HB3 GLU 39 HB3 GLU 39 66.458 9.711 -5.167 297 HG2 GLU 39 HG2 GLU 39 65.703 8.122 -7.612 298 HG3 GLU 39 HG3 GLU 39 65.516 9.863 -7.345 299 H HIS 40 H HIS 40 65.387 7.176 -3.312 300 HA HIS 40 HA HIS 40 66.264 8.869 -1.312 301 HB2 HIS 40 HB2 HIS 40 64.046 7.792 -1.473 302 HB3 HIS 40 HB3 HIS 40 64.702 6.260 -1.021 303 HD1 HIS 40 HD1 HIS 40 63.009 9.085 0.383 304 HD2 HIS 40 HD2 HIS 40 65.944 6.461 1.728 305 HE1 HIS 40 HE1 HIS 40 63.045 9.289 2.884 306 H PHE 41 H PHE 41 66.873 5.496 -1.917 307 HA PHE 41 HA PHE 41 68.587 4.883 0.179 308 HB2 PHE 41 HB2 PHE 41 67.654 3.133 -1.085 309 HB3 PHE 41 HB3 PHE 41 68.118 3.874 -2.600 310 HD1 PHE 41 HD1 PHE 41 69.239 1.890 0.263 311 HD2 PHE 41 HD2 PHE 41 70.291 3.462 -3.530 312 HE1 PHE 41 HE1 PHE 41 71.213 0.414 0.194 313 HE2 PHE 41 HE2 PHE 41 72.259 2.011 -3.586 314 HZ PHE 41 HZ PHE 41 72.719 0.483 -1.752 315 H VAL 42 H VAL 42 69.382 5.892 -3.142 316 HA VAL 42 HA VAL 42 72.130 5.912 -2.504 317 HB VAL 42 HB VAL 42 71.334 5.374 -4.718 318 HG11 VAL 42 HG11 VAL 42 70.691 8.234 -5.109 319 HG12 VAL 42 HG12 VAL 42 69.624 6.793 -5.081 320 HG13 VAL 42 HG13 VAL 42 70.855 6.951 -6.336 321 HG21 VAL 42 HG21 VAL 42 73.643 5.953 -4.435 322 HG22 VAL 42 HG22 VAL 42 73.255 7.656 -4.678 323 HG23 VAL 42 HG23 VAL 42 73.054 6.507 -6.001 324 H LYS 43 H LYS 43 69.854 8.406 -2.385 325 HA LYS 43 HA LYS 43 71.845 10.489 -2.192 326 HB2 LYS 43 HB2 LYS 43 70.140 12.000 -1.668 327 HB3 LYS 43 HB3 LYS 43 69.263 10.772 -2.564 328 HG2 LYS 43 HG2 LYS 43 68.429 9.793 -0.401 329 HG3 LYS 43 HG3 LYS 43 69.416 10.963 0.432 330 HD2 LYS 43 HD2 LYS 43 68.170 12.799 -0.650 331 HD3 LYS 43 HD3 LYS 43 67.070 11.596 -1.322 332 HE2 LYS 43 HE2 LYS 43 67.610 11.950 1.625 333 HE3 LYS 43 HE3 LYS 43 66.260 12.688 0.778 334 HZ1 LYS 43 HZ1 LYS 43 65.433 10.526 0.240 335 HZ2 LYS 43 HZ2 LYS 43 65.604 10.693 1.890 336 HZ3 LYS 43 HZ3 LYS 43 66.729 9.752 1.031 337 H ILE 44 H ILE 44 70.557 8.296 0.183 338 HA ILE 44 HA ILE 44 71.683 9.918 2.292 339 HB ILE 44 HB ILE 44 70.818 8.112 3.843 340 HG12 ILE 44 HG12 ILE 44 69.554 7.133 1.286 341 HG13 ILE 44 HG13 ILE 44 70.769 6.257 2.184 342 HG21 ILE 44 HG21 ILE 44 68.809 9.386 1.990 343 HG22 ILE 44 HG22 ILE 44 69.613 10.197 3.321 344 HG23 ILE 44 HG23 ILE 44 68.510 8.854 3.648 345 HD11 ILE 44 HD11 ILE 44 68.499 5.407 2.513 346 HD12 ILE 44 HD12 ILE 44 68.028 6.972 3.173 347 HD13 ILE 44 HD13 ILE 44 69.214 5.982 4.020 348 H THR 45 H THR 45 72.438 6.917 0.665 349 HA THR 45 HA THR 45 74.759 6.585 2.335 350 HB THR 45 HB THR 45 73.787 4.525 1.589 351 HG1 THR 45 HG1 THR 45 76.334 5.248 0.843 352 HG21 THR 45 HG21 THR 45 74.258 5.489 -1.241 353 HG22 THR 45 HG22 THR 45 72.688 5.315 -0.459 354 HG23 THR 45 HG23 THR 45 73.665 3.889 -0.792 355 H GLU 46 H GLU 46 73.981 7.977 -0.759 356 HA GLU 46 HA GLU 46 75.059 9.143 -2.273 357 HB2 GLU 46 HB2 GLU 46 77.081 9.404 -0.101 358 HB3 GLU 46 HB3 GLU 46 77.033 10.453 -1.531 359 HG2 GLU 46 HG2 GLU 46 74.757 11.112 -0.770 360 HG3 GLU 46 HG3 GLU 46 75.028 10.155 0.669 361 H HIS 47 H HIS 47 75.315 6.435 -2.312 362 HA HIS 47 HA HIS 47 78.049 5.690 -2.813 363 HB2 HIS 47 HB2 HIS 47 76.192 4.170 -1.836 364 HB3 HIS 47 HB3 HIS 47 75.591 4.053 -3.487 365 HD1 HIS 47 HD1 HIS 47 76.756 2.265 -4.975 366 HD2 HIS 47 HD2 HIS 47 78.762 3.091 -1.451 367 HE1 HIS 47 HE1 HIS 47 78.745 0.738 -4.912 368 HA PRO 48 HA PRO 48 77.839 7.088 -7.119 369 HB2 PRO 48 HB2 PRO 48 79.859 5.045 -7.637 370 HB3 PRO 48 HB3 PRO 48 79.959 6.789 -7.881 371 HG2 PRO 48 HG2 PRO 48 81.260 5.449 -6.015 372 HG3 PRO 48 HG3 PRO 48 80.625 7.079 -5.614 373 HD2 PRO 48 HD2 PRO 48 79.589 4.342 -4.951 374 HD3 PRO 48 HD3 PRO 48 79.636 5.779 -3.917 375 H ASP 49 H ASP 49 77.350 3.946 -6.085 376 HA ASP 49 HA ASP 49 76.651 3.168 -8.710 377 HB2 ASP 49 HB2 ASP 49 77.944 1.372 -6.628 378 HB3 ASP 49 HB3 ASP 49 77.371 0.796 -8.171 379 H GLY 50 H GLY 50 75.169 4.320 -6.551 380 HA2 GLY 50 HA2 GLY 50 73.938 2.789 -4.521 381 HA3 GLY 50 HA3 GLY 50 73.197 4.130 -5.372 382 H THR 51 H THR 51 72.771 3.241 -7.681 383 HA THR 51 HA THR 51 70.614 1.501 -6.980 384 HB THR 51 HB THR 51 70.701 1.879 -9.796 385 HG1 THR 51 HG1 THR 51 70.481 4.406 -8.908 386 HG21 THR 51 HG21 THR 51 69.036 3.052 -7.563 387 HG22 THR 51 HG22 THR 51 68.756 1.550 -8.399 388 HG23 THR 51 HG23 THR 51 68.611 3.072 -9.272 389 H ALA 52 H ALA 52 73.568 1.313 -8.765 390 HA ALA 52 HA ALA 52 73.248 -1.217 -9.983 391 HB1 ALA 52 HB1 ALA 52 75.761 0.090 -8.977 392 HB2 ALA 52 HB2 ALA 52 75.052 0.359 -10.573 393 HB3 ALA 52 HB3 ALA 52 75.668 -1.236 -10.134 394 H LEU 53 H LEU 53 74.120 -0.295 -6.736 395 HA LEU 53 HA LEU 53 74.860 -2.851 -5.891 396 HB2 LEU 53 HB2 LEU 53 73.630 -0.622 -4.319 397 HB3 LEU 53 HB3 LEU 53 74.132 -2.135 -3.603 398 HG LEU 53 HG LEU 53 75.877 -0.033 -4.858 399 HD11 LEU 53 HD11 LEU 53 75.114 0.426 -2.640 400 HD12 LEU 53 HD12 LEU 53 76.837 0.037 -2.635 401 HD13 LEU 53 HD13 LEU 53 75.656 -1.159 -2.092 402 HD21 LEU 53 HD21 LEU 53 77.761 -1.492 -4.260 403 HD22 LEU 53 HD22 LEU 53 76.757 -2.205 -5.513 404 HD23 LEU 53 HD23 LEU 53 76.631 -2.780 -3.846 405 H ILE 54 H ILE 54 71.665 -1.327 -5.870 406 HA ILE 54 HA ILE 54 70.510 -3.676 -4.645 407 HB ILE 54 HB ILE 54 68.857 -1.756 -6.349 408 HG12 ILE 54 HG12 ILE 54 68.046 -1.005 -3.975 409 HG13 ILE 54 HG13 ILE 54 69.591 -1.647 -3.445 410 HG21 ILE 54 HG21 ILE 54 67.994 -3.761 -4.288 411 HG22 ILE 54 HG22 ILE 54 67.766 -3.873 -6.035 412 HG23 ILE 54 HG23 ILE 54 66.936 -2.616 -5.115 413 HD11 ILE 54 HD11 ILE 54 69.204 0.486 -5.505 414 HD12 ILE 54 HD12 ILE 54 70.748 -0.131 -4.917 415 HD13 ILE 54 HD13 ILE 54 69.668 0.734 -3.827 416 H TYR 55 H TYR 55 70.907 -2.555 -7.859 417 HA TYR 55 HA TYR 55 69.506 -4.546 -9.122 418 HB2 TYR 55 HB2 TYR 55 71.512 -2.566 -9.930 419 HB3 TYR 55 HB3 TYR 55 71.204 -3.885 -11.044 420 HD1 TYR 55 HD1 TYR 55 69.741 -0.982 -9.328 421 HD2 TYR 55 HD2 TYR 55 69.075 -4.044 -12.188 422 HE1 TYR 55 HE1 TYR 55 67.716 0.160 -10.052 423 HE2 TYR 55 HE2 TYR 55 67.023 -2.912 -12.923 424 HH TYR 55 HH TYR 55 65.413 -1.390 -11.992 425 H GLU 56 H GLU 56 72.987 -4.419 -8.276 426 HA GLU 56 HA GLU 56 73.343 -7.026 -9.310 427 HB2 GLU 56 HB2 GLU 56 75.536 -7.084 -8.093 428 HB3 GLU 56 HB3 GLU 56 75.369 -5.768 -9.245 429 HG2 GLU 56 HG2 GLU 56 75.173 -4.198 -7.569 430 HG3 GLU 56 HG3 GLU 56 74.922 -5.368 -6.295 431 H ALA 57 H ALA 57 72.519 -5.784 -6.143 432 HA ALA 57 HA ALA 57 72.829 -8.140 -4.682 433 HB1 ALA 57 HB1 ALA 57 72.379 -5.955 -3.644 434 HB2 ALA 57 HB2 ALA 57 71.259 -7.192 -3.074 435 HB3 ALA 57 HB3 ALA 57 70.732 -6.008 -4.270 436 H ALA 58 H ALA 58 70.124 -6.998 -6.619 437 HA ALA 58 HA ALA 58 68.306 -9.030 -6.069 438 HB1 ALA 58 HB1 ALA 58 67.260 -8.470 -8.210 439 HB2 ALA 58 HB2 ALA 58 68.709 -7.591 -8.696 440 HB3 ALA 58 HB3 ALA 58 67.733 -7.005 -7.347 441 H ALA 59 H ALA 59 70.849 -8.857 -8.495 442 HA ALA 59 HA ALA 59 70.368 -11.430 -9.602 443 HB1 ALA 59 HB1 ALA 59 72.870 -9.743 -9.706 444 HB2 ALA 59 HB2 ALA 59 71.526 -9.651 -10.842 445 HB3 ALA 59 HB3 ALA 59 72.502 -11.119 -10.746 446 H ARG 60 H ARG 60 72.542 -10.176 -7.180 447 HA ARG 60 HA ARG 60 74.065 -12.472 -6.672 448 HB2 ARG 60 HB2 ARG 60 73.443 -10.012 -5.084 449 HB3 ARG 60 HB3 ARG 60 74.436 -11.292 -4.405 450 HG2 ARG 60 HG2 ARG 60 76.163 -10.897 -5.906 451 HG3 ARG 60 HG3 ARG 60 75.103 -10.068 -7.048 452 HD2 ARG 60 HD2 ARG 60 76.663 -8.555 -5.806 453 HD3 ARG 60 HD3 ARG 60 74.964 -8.140 -5.645 454 HE ARG 60 HE ARG 60 75.436 -9.673 -3.471 455 HH11 ARG 60 HH11 ARG 60 77.006 -6.732 -4.736 456 HH12 ARG 60 HH12 ARG 60 77.547 -6.225 -3.201 457 HH21 ARG 60 HH21 ARG 60 76.140 -8.911 -1.445 458 HH22 ARG 60 HH22 ARG 60 77.078 -7.476 -1.291 459 H ALA 61 H ALA 61 71.055 -11.354 -5.167 460 HA ALA 61 HA ALA 61 71.023 -13.662 -3.457 461 HB1 ALA 61 HB1 ALA 61 70.026 -11.569 -2.732 462 HB2 ALA 61 HB2 ALA 61 68.848 -12.879 -2.706 463 HB3 ALA 61 HB3 ALA 61 68.815 -11.682 -4.011 464 H ALA 62 H ALA 62 69.800 -12.929 -6.603 465 HA ALA 62 HA ALA 62 67.952 -15.109 -6.735 466 HB1 ALA 62 HB1 ALA 62 67.962 -14.729 -9.163 467 HB2 ALA 62 HB2 ALA 62 69.354 -13.660 -8.992 468 HB3 ALA 62 HB3 ALA 62 67.804 -13.204 -8.290 469 H ALA 63 H ALA 63 71.280 -14.618 -7.623 470 HA ALA 63 HA ALA 63 71.644 -17.508 -7.551 471 HB1 ALA 63 HB1 ALA 63 71.818 -16.835 -9.887 472 HB2 ALA 63 HB2 ALA 63 73.409 -17.258 -9.199 473 HB3 ALA 63 HB3 ALA 63 72.972 -15.567 -9.418 474 H ASN 64 H ASN 64 72.264 -17.291 -5.469 475 HA ASN 64 HA ASN 64 74.042 -15.411 -4.497 476 HB2 ASN 64 HB2 ASN 64 73.355 -18.155 -3.480 477 HB3 ASN 64 HB3 ASN 64 74.499 -17.063 -2.707 478 HD21 ASN 64 HD21 ASN 64 71.151 -17.643 -3.428 479 HD22 ASN 64 HD22 ASN 64 70.505 -16.443 -2.376 480 HA PRO 65 HA PRO 65 77.860 -17.128 -6.036 481 HB2 PRO 65 HB2 PRO 65 79.424 -15.034 -5.382 482 HB3 PRO 65 HB3 PRO 65 78.296 -14.953 -6.739 483 HG2 PRO 65 HG2 PRO 65 78.076 -13.767 -4.023 484 HG3 PRO 65 HG3 PRO 65 77.495 -13.141 -5.572 485 HD2 PRO 65 HD2 PRO 65 75.936 -14.465 -3.647 486 HD3 PRO 65 HD3 PRO 65 75.483 -14.173 -5.335 487 H GLY 66 H GLY 66 76.706 -16.915 -3.061 488 HA2 GLY 66 HA2 GLY 66 78.141 -18.646 -1.662 489 HA3 GLY 66 HA3 GLY 66 79.086 -17.172 -1.444 490 H GLY 67 H GLY 67 78.640 -16.292 0.392 491 HA2 GLY 67 HA2 GLY 67 75.830 -15.912 1.041 492 HA3 GLY 67 HA3 GLY 67 76.857 -16.827 2.148 493 H ASP 68 H ASP 68 78.516 -14.358 0.506 494 HA ASP 68 HA ASP 68 79.103 -12.998 2.921 495 HB2 ASP 68 HB2 ASP 68 80.674 -12.996 1.021 496 HB3 ASP 68 HB3 ASP 68 79.533 -12.037 0.083 497 H GLY 69 H GLY 69 76.960 -12.300 0.270 498 HA2 GLY 69 HA2 GLY 69 75.094 -10.875 1.798 499 HA3 GLY 69 HA3 GLY 69 76.140 -9.729 0.952 500 H GLY 70 H GLY 70 73.764 -12.137 0.704 501 HA2 GLY 70 HA2 GLY 70 73.770 -12.290 -2.134 502 HA3 GLY 70 HA3 GLY 70 72.500 -12.868 -1.063 503 H GLY 71 H GLY 71 71.246 -11.009 -0.001 504 HA2 GLY 71 HA2 GLY 71 70.600 -9.158 -2.189 505 HA3 GLY 71 HA3 GLY 71 69.372 -10.009 -1.282 506 HA PRO 72 HA PRO 72 68.756 -6.179 0.550 507 HB2 PRO 72 HB2 PRO 72 67.323 -6.880 2.749 508 HB3 PRO 72 HB3 PRO 72 66.702 -6.831 1.092 509 HG2 PRO 72 HG2 PRO 72 67.681 -9.173 2.670 510 HG3 PRO 72 HG3 PRO 72 66.240 -9.028 1.650 511 HD2 PRO 72 HD2 PRO 72 68.486 -10.225 0.769 512 HD3 PRO 72 HD3 PRO 72 67.447 -9.270 -0.313 513 H GLU 73 H GLU 73 69.571 -8.522 3.164 514 HA GLU 73 HA GLU 73 70.686 -6.413 4.633 515 HB2 GLU 73 HB2 GLU 73 70.960 -9.375 5.088 516 HB3 GLU 73 HB3 GLU 73 71.485 -8.127 6.206 517 HG2 GLU 73 HG2 GLU 73 69.129 -7.309 6.287 518 HG3 GLU 73 HG3 GLU 73 68.684 -8.698 5.318 519 H GLY 74 H GLY 74 71.878 -7.736 1.952 520 HA2 GLY 74 HA2 GLY 74 74.494 -7.164 2.953 521 HA3 GLY 74 HA3 GLY 74 74.263 -8.186 1.486 522 H ILE 75 H ILE 75 72.143 -5.854 0.979 523 HA ILE 75 HA ILE 75 73.865 -4.220 -0.609 524 HB ILE 75 HB ILE 75 71.390 -2.874 0.311 525 HG12 ILE 75 HG12 ILE 75 71.183 -5.598 -1.074 526 HG13 ILE 75 HG13 ILE 75 70.485 -5.040 0.393 527 HG21 ILE 75 HG21 ILE 75 71.120 -2.482 -2.094 528 HG22 ILE 75 HG22 ILE 75 72.496 -3.548 -2.398 529 HG23 ILE 75 HG23 ILE 75 72.730 -2.039 -1.511 530 HD11 ILE 75 HD11 ILE 75 68.963 -3.574 -0.689 531 HD12 ILE 75 HD12 ILE 75 68.830 -5.179 -1.397 532 HD13 ILE 75 HD13 ILE 75 69.691 -3.901 -2.262 533 H VAL 76 H VAL 76 72.284 -3.855 2.435 534 HA VAL 76 HA VAL 76 73.203 -1.350 3.267 535 HB VAL 76 HB VAL 76 71.453 -2.344 4.312 536 HG11 VAL 76 HG11 VAL 76 72.925 -4.773 4.646 537 HG12 VAL 76 HG12 VAL 76 71.289 -4.364 4.021 538 HG13 VAL 76 HG13 VAL 76 71.617 -4.333 5.753 539 HG21 VAL 76 HG21 VAL 76 71.941 -2.363 6.737 540 HG22 VAL 76 HG22 VAL 76 72.695 -1.001 5.908 541 HG23 VAL 76 HG23 VAL 76 73.659 -2.411 6.349 542 H LYS 77 H LYS 77 74.424 -4.435 3.672 543 HA LYS 77 HA LYS 77 76.681 -3.936 5.242 544 HB2 LYS 77 HB2 LYS 77 75.934 -6.196 4.635 545 HB3 LYS 77 HB3 LYS 77 76.475 -5.917 2.990 546 HG2 LYS 77 HG2 LYS 77 78.790 -5.604 3.921 547 HG3 LYS 77 HG3 LYS 77 78.166 -6.192 5.462 548 HD2 LYS 77 HD2 LYS 77 79.031 -8.107 4.402 549 HD3 LYS 77 HD3 LYS 77 77.275 -8.151 4.165 550 HE2 LYS 77 HE2 LYS 77 78.368 -8.734 2.088 551 HE3 LYS 77 HE3 LYS 77 77.555 -7.187 1.906 552 HZ1 LYS 77 HZ1 LYS 77 80.443 -7.751 2.093 553 HZ2 LYS 77 HZ2 LYS 77 79.896 -6.233 2.499 554 HZ3 LYS 77 HZ3 LYS 77 79.608 -6.808 0.944 555 H GLU 78 H GLU 78 76.383 -3.953 1.690 556 HA GLU 78 HA GLU 78 78.980 -3.227 0.937 557 HB2 GLU 78 HB2 GLU 78 76.346 -2.417 -0.233 558 HB3 GLU 78 HB3 GLU 78 77.863 -2.283 -1.075 559 HG2 GLU 78 HG2 GLU 78 76.493 -4.830 -0.162 560 HG3 GLU 78 HG3 GLU 78 76.498 -4.212 -1.804 561 H ILE 79 H ILE 79 76.183 -1.371 1.585 562 HA ILE 79 HA ILE 79 77.152 1.249 1.318 563 HB ILE 79 HB ILE 79 74.887 0.239 3.050 564 HG12 ILE 79 HG12 ILE 79 74.536 -0.254 0.715 565 HG13 ILE 79 HG13 ILE 79 73.448 1.050 1.194 566 HG21 ILE 79 HG21 ILE 79 75.558 2.376 3.897 567 HG22 ILE 79 HG22 ILE 79 74.006 2.510 3.068 568 HG23 ILE 79 HG23 ILE 79 75.479 3.074 2.280 569 HD11 ILE 79 HD11 ILE 79 74.339 1.501 -0.971 570 HD12 ILE 79 HD12 ILE 79 75.977 1.236 -0.410 571 HD13 ILE 79 HD13 ILE 79 75.069 2.636 0.168 572 H LYS 80 H LYS 80 76.957 -0.725 4.280 573 HA LYS 80 HA LYS 80 77.913 1.391 5.900 574 HB2 LYS 80 HB2 LYS 80 78.069 -0.153 7.743 575 HB3 LYS 80 HB3 LYS 80 76.700 -0.674 6.780 576 HG2 LYS 80 HG2 LYS 80 78.008 -2.458 5.819 577 HG3 LYS 80 HG3 LYS 80 79.412 -1.918 6.714 578 HD2 LYS 80 HD2 LYS 80 78.405 -3.778 7.903 579 HD3 LYS 80 HD3 LYS 80 78.239 -2.287 8.830 580 HE2 LYS 80 HE2 LYS 80 75.899 -2.086 8.041 581 HE3 LYS 80 HE3 LYS 80 76.080 -3.607 7.178 582 HZ1 LYS 80 HZ1 LYS 80 75.017 -3.887 9.406 583 HZ2 LYS 80 HZ2 LYS 80 76.392 -3.281 10.108 584 HZ3 LYS 80 HZ3 LYS 80 76.460 -4.741 9.268 585 H GLU 81 H GLU 81 79.509 -1.175 4.159 586 HA GLU 81 HA GLU 81 82.045 -0.677 5.261 587 HB2 GLU 81 HB2 GLU 81 81.273 -2.079 2.704 588 HB3 GLU 81 HB3 GLU 81 82.891 -2.079 3.392 589 HG2 GLU 81 HG2 GLU 81 82.072 -3.222 5.376 590 HG3 GLU 81 HG3 GLU 81 80.429 -3.169 4.746 591 H TRP 82 H TRP 82 80.391 0.481 2.375 592 HA TRP 82 HA TRP 82 82.617 1.888 1.264 593 HB2 TRP 82 HB2 TRP 82 80.392 1.257 0.105 594 HB3 TRP 82 HB3 TRP 82 79.789 2.680 0.985 595 HD1 TRP 82 HD1 TRP 82 82.264 1.805 -1.839 596 HE1 TRP 82 HE1 TRP 82 82.622 3.905 -3.272 597 HE3 TRP 82 HE3 TRP 82 79.665 5.182 1.003 598 HZ2 TRP 82 HZ2 TRP 82 81.905 6.613 -3.223 599 HZ3 TRP 82 HZ3 TRP 82 79.554 7.504 0.249 600 HH2 TRP 82 HH2 TRP 82 80.658 8.224 -1.820 601 H ARG 83 H ARG 83 79.864 2.846 3.255 602 HA ARG 83 HA ARG 83 80.298 5.611 3.257 603 HB2 ARG 83 HB2 ARG 83 78.303 4.096 4.272 604 HB3 ARG 83 HB3 ARG 83 79.393 4.217 5.661 605 HG2 ARG 83 HG2 ARG 83 78.013 5.946 6.117 606 HG3 ARG 83 HG3 ARG 83 79.400 6.613 5.255 607 HD2 ARG 83 HD2 ARG 83 78.131 6.909 3.228 608 HD3 ARG 83 HD3 ARG 83 76.772 6.027 3.922 609 HE ARG 83 HE ARG 83 76.903 7.861 5.707 610 HH11 ARG 83 HH11 ARG 83 77.158 8.450 2.196 611 HH12 ARG 83 HH12 ARG 83 76.753 10.099 2.340 612 HH21 ARG 83 HH21 ARG 83 76.271 10.093 5.837 613 HH22 ARG 83 HH22 ARG 83 76.203 11.033 4.437 614 H ALA 84 H ALA 84 81.321 3.043 5.491 615 HA ALA 84 HA ALA 84 82.765 4.691 7.248 616 HB1 ALA 84 HB1 ALA 84 81.950 2.469 7.870 617 HB2 ALA 84 HB2 ALA 84 83.692 2.586 8.116 618 HB3 ALA 84 HB3 ALA 84 83.047 1.734 6.710 619 H ALA 85 H ALA 85 83.690 2.887 4.353 620 HA ALA 85 HA ALA 85 86.470 3.244 4.620 621 HB1 ALA 85 HB1 ALA 85 85.489 1.498 3.213 622 HB2 ALA 85 HB2 ALA 85 86.622 2.506 2.312 623 HB3 ALA 85 HB3 ALA 85 84.885 2.736 2.114 624 H ASN 86 H ASN 86 84.011 5.049 2.835 625 HA ASN 86 HA ASN 86 85.807 6.914 1.638 626 HB2 ASN 86 HB2 ASN 86 83.309 6.533 0.954 627 HB3 ASN 86 HB3 ASN 86 82.928 7.515 2.353 628 HD21 ASN 86 HD21 ASN 86 83.419 9.775 2.307 629 HD22 ASN 86 HD22 ASN 86 83.816 10.538 0.815 630 H GLY 87 H GLY 87 84.086 6.744 4.644 631 HA2 GLY 87 HA2 GLY 87 84.901 7.793 6.631 632 HA3 GLY 87 HA3 GLY 87 85.594 9.068 5.630 633 H LYS 88 H LYS 88 82.267 7.648 5.585 634 HA LYS 88 HA LYS 88 81.253 10.288 6.094 635 HB2 LYS 88 HB2 LYS 88 80.651 8.060 4.240 636 HB3 LYS 88 HB3 LYS 88 79.347 9.080 4.793 637 HG2 LYS 88 HG2 LYS 88 80.453 11.016 3.809 638 HG3 LYS 88 HG3 LYS 88 81.857 10.028 3.395 639 HD2 LYS 88 HD2 LYS 88 80.561 8.763 1.825 640 HD3 LYS 88 HD3 LYS 88 79.072 9.560 2.328 641 HE2 LYS 88 HE2 LYS 88 81.433 10.967 1.093 642 HE3 LYS 88 HE3 LYS 88 80.041 10.402 0.178 643 HZ1 LYS 88 HZ1 LYS 88 79.877 12.766 0.740 644 HZ2 LYS 88 HZ2 LYS 88 79.981 12.450 2.370 645 HZ3 LYS 88 HZ3 LYS 88 78.629 11.932 1.503 646 HA PRO 89 HA PRO 89 79.341 8.314 9.644 647 HB2 PRO 89 HB2 PRO 89 76.926 9.684 9.617 648 HB3 PRO 89 HB3 PRO 89 78.415 10.304 10.336 649 HG2 PRO 89 HG2 PRO 89 77.211 10.878 7.663 650 HG3 PRO 89 HG3 PRO 89 78.012 11.987 8.789 651 HD2 PRO 89 HD2 PRO 89 79.257 11.056 6.612 652 HD3 PRO 89 HD3 PRO 89 80.133 11.306 8.135 653 H GLY 90 H GLY 90 78.463 6.355 9.678 654 HA2 GLY 90 HA2 GLY 90 76.783 5.479 7.471 655 HA3 GLY 90 HA3 GLY 90 77.513 4.464 8.707 656 H PHE 91 H PHE 91 75.959 3.426 9.656 657 HA PHE 91 HA PHE 91 73.288 4.566 9.827 658 HB2 PHE 91 HB2 PHE 91 74.290 1.814 10.548 659 HB3 PHE 91 HB3 PHE 91 72.608 2.326 10.510 660 HD1 PHE 91 HD1 PHE 91 71.696 3.160 8.297 661 HD2 PHE 91 HD2 PHE 91 75.302 0.959 8.667 662 HE1 PHE 91 HE1 PHE 91 71.570 2.558 5.940 663 HE2 PHE 91 HE2 PHE 91 75.179 0.363 6.283 664 HZ PHE 91 HZ PHE 91 73.315 1.164 4.926 665 H LYS 92 H LYS 92 72.039 4.242 11.855 666 HA LYS 92 HA LYS 92 73.696 4.756 14.132 667 HB2 LYS 92 HB2 LYS 92 71.798 5.670 15.094 668 HB3 LYS 92 HB3 LYS 92 71.769 6.229 13.469 669 HG2 LYS 92 HG2 LYS 92 70.017 4.731 12.870 670 HG3 LYS 92 HG3 LYS 92 70.196 3.854 14.395 671 HD2 LYS 92 HD2 LYS 92 69.335 6.745 14.180 672 HD3 LYS 92 HD3 LYS 92 68.220 5.387 14.337 673 HE2 LYS 92 HE2 LYS 92 69.252 4.795 16.490 674 HE3 LYS 92 HE3 LYS 92 70.363 6.148 16.339 675 HZ1 LYS 92 HZ1 LYS 92 68.524 6.668 17.762 676 HZ2 LYS 92 HZ2 LYS 92 67.415 6.370 16.530 677 HZ3 LYS 92 HZ3 LYS 92 68.513 7.647 16.404 678 H GLN 93 H GLN 93 72.866 3.697 16.088 679 HA GLN 93 HA GLN 93 72.428 0.875 15.585 680 HB2 GLN 93 HB2 GLN 93 73.330 2.627 17.739 681 HB3 GLN 93 HB3 GLN 93 72.793 1.013 18.194 682 HG2 GLN 93 HG2 GLN 93 75.258 1.149 17.997 683 HG3 GLN 93 HG3 GLN 93 74.590 0.050 16.803 684 HE21 GLN 93 HE21 GLN 93 74.742 0.570 14.650 685 HE22 GLN 93 HE22 GLN 93 75.734 1.844 14.047 686 H GLY 94 H GLY 94 70.672 -0.124 16.337 687 HA2 GLY 94 HA2 GLY 94 68.968 0.456 18.334 688 HA3 GLY 94 HA3 GLY 94 68.325 1.364 16.961 Start of MODEL 5 1 H GLU 2 H GLU 2 61.690 2.770 8.837 2 HA GLU 2 HA GLU 2 59.473 3.739 7.153 3 HB2 GLU 2 HB2 GLU 2 60.655 4.836 9.708 4 HB3 GLU 2 HB3 GLU 2 59.294 5.506 8.817 5 HG2 GLU 2 HG2 GLU 2 59.388 2.925 10.359 6 HG3 GLU 2 HG3 GLU 2 58.459 4.369 10.745 7 H LEU 3 H LEU 3 59.966 6.079 6.635 8 HA LEU 3 HA LEU 3 62.617 6.084 5.489 9 HB2 LEU 3 HB2 LEU 3 60.231 7.865 5.050 10 HB3 LEU 3 HB3 LEU 3 61.778 8.075 4.259 11 HG LEU 3 HG LEU 3 59.951 5.704 3.968 12 HD11 LEU 3 HD11 LEU 3 60.687 7.938 2.056 13 HD12 LEU 3 HD12 LEU 3 59.122 7.723 2.833 14 HD13 LEU 3 HD13 LEU 3 59.691 6.542 1.652 15 HD21 LEU 3 HD21 LEU 3 62.597 6.360 2.699 16 HD22 LEU 3 HD22 LEU 3 61.551 5.016 2.230 17 HD23 LEU 3 HD23 LEU 3 62.267 5.070 3.850 18 H LYS 4 H LYS 4 64.141 7.307 6.131 19 HA LYS 4 HA LYS 4 63.629 9.361 8.167 20 HB2 LYS 4 HB2 LYS 4 66.297 8.226 7.294 21 HB3 LYS 4 HB3 LYS 4 65.957 9.160 8.752 22 HG2 LYS 4 HG2 LYS 4 65.442 6.293 8.086 23 HG3 LYS 4 HG3 LYS 4 66.315 6.932 9.458 24 HD2 LYS 4 HD2 LYS 4 63.935 7.946 9.983 25 HD3 LYS 4 HD3 LYS 4 63.460 6.630 8.930 26 HE2 LYS 4 HE2 LYS 4 64.870 5.063 10.325 27 HE3 LYS 4 HE3 LYS 4 65.055 6.363 11.473 28 HZ1 LYS 4 HZ1 LYS 4 62.547 6.391 11.647 29 HZ2 LYS 4 HZ2 LYS 4 63.353 5.061 12.287 30 HZ3 LYS 4 HZ3 LYS 4 62.586 4.897 10.811 31 H ASN 5 H ASN 5 65.875 10.955 7.653 32 HA ASN 5 HA ASN 5 65.444 11.705 4.851 33 HB2 ASN 5 HB2 ASN 5 66.051 13.509 7.200 34 HB3 ASN 5 HB3 ASN 5 66.237 14.036 5.536 35 HD21 ASN 5 HD21 ASN 5 63.857 12.515 4.627 36 HD22 ASN 5 HD22 ASN 5 62.499 13.380 5.190 37 H SER 6 H SER 6 67.777 10.997 7.303 38 HA SER 6 HA SER 6 69.764 10.972 5.180 39 HB2 SER 6 HB2 SER 6 71.458 11.562 6.864 40 HB3 SER 6 HB3 SER 6 70.267 12.846 6.665 41 HG SER 6 HG SER 6 69.559 12.538 8.611 42 H ILE 7 H ILE 7 71.522 9.420 5.672 43 HA ILE 7 HA ILE 7 70.492 6.867 6.314 44 HB ILE 7 HB ILE 7 72.379 7.337 4.707 45 HG12 ILE 7 HG12 ILE 7 72.952 5.325 6.901 46 HG13 ILE 7 HG13 ILE 7 71.962 5.053 5.481 47 HG21 ILE 7 HG21 ILE 7 74.006 7.707 7.219 48 HG22 ILE 7 HG22 ILE 7 73.633 8.946 6.025 49 HG23 ILE 7 HG23 ILE 7 74.660 7.582 5.585 50 HD11 ILE 7 HD11 ILE 7 74.146 4.021 5.235 51 HD12 ILE 7 HD12 ILE 7 74.925 5.583 5.487 52 HD13 ILE 7 HD13 ILE 7 73.932 5.316 4.055 53 H SER 8 H SER 8 71.637 9.377 8.260 54 HA SER 8 HA SER 8 72.933 7.760 10.231 55 HB2 SER 8 HB2 SER 8 73.747 10.036 9.721 56 HB3 SER 8 HB3 SER 8 72.231 10.705 10.327 57 HG SER 8 HG SER 8 72.970 9.217 12.233 58 H ASP 9 H ASP 9 69.725 8.314 9.543 59 HA ASP 9 HA ASP 9 69.054 7.876 12.373 60 HB2 ASP 9 HB2 ASP 9 67.860 9.815 11.011 61 HB3 ASP 9 HB3 ASP 9 67.036 8.497 10.269 62 H TYR 10 H TYR 10 69.830 6.226 9.843 63 HA TYR 10 HA TYR 10 67.606 4.349 9.858 64 HB2 TYR 10 HB2 TYR 10 69.818 4.884 7.926 65 HB3 TYR 10 HB3 TYR 10 69.182 3.250 8.033 66 HD1 TYR 10 HD1 TYR 10 66.764 2.872 7.581 67 HD2 TYR 10 HD2 TYR 10 68.644 6.583 6.743 68 HE1 TYR 10 HE1 TYR 10 64.901 3.462 6.097 69 HE2 TYR 10 HE2 TYR 10 66.787 7.186 5.239 70 HH TYR 10 HH TYR 10 64.984 6.144 3.989 71 H THR 11 H THR 11 67.735 2.710 11.148 72 HA THR 11 HA THR 11 70.276 1.878 12.241 73 HB THR 11 HB THR 11 68.900 0.259 13.482 74 HG1 THR 11 HG1 THR 11 66.576 0.390 13.141 75 HG21 THR 11 HG21 THR 11 67.640 3.002 13.400 76 HG22 THR 11 HG22 THR 11 68.990 2.485 14.421 77 HG23 THR 11 HG23 THR 11 67.387 1.805 14.670 78 H GLU 12 H GLU 12 70.514 -0.689 12.093 79 HA GLU 12 HA GLU 12 71.144 -1.305 9.407 80 HB2 GLU 12 HB2 GLU 12 70.347 -3.448 11.336 81 HB3 GLU 12 HB3 GLU 12 71.602 -3.483 10.117 82 HG2 GLU 12 HG2 GLU 12 71.686 -1.840 12.556 83 HG3 GLU 12 HG3 GLU 12 72.300 -3.481 12.509 84 H ALA 13 H ALA 13 68.531 -2.282 11.519 85 HA ALA 13 HA ALA 13 67.367 -3.828 9.566 86 HB1 ALA 13 HB1 ALA 13 67.160 -4.370 11.861 87 HB2 ALA 13 HB2 ALA 13 65.552 -4.234 11.130 88 HB3 ALA 13 HB3 ALA 13 66.176 -2.935 12.173 89 H GLU 14 H GLU 14 66.630 -0.520 10.745 90 HA GLU 14 HA GLU 14 64.255 -0.029 9.314 91 HB2 GLU 14 HB2 GLU 14 66.474 1.692 10.300 92 HB3 GLU 14 HB3 GLU 14 65.388 2.417 9.136 93 HG2 GLU 14 HG2 GLU 14 64.549 1.165 11.738 94 HG3 GLU 14 HG3 GLU 14 64.821 2.889 11.483 95 H PHE 15 H PHE 15 67.613 0.115 8.362 96 HA PHE 15 HA PHE 15 67.012 1.165 5.810 97 HB2 PHE 15 HB2 PHE 15 69.139 1.480 7.132 98 HB3 PHE 15 HB3 PHE 15 69.537 -0.180 6.727 99 HD1 PHE 15 HD1 PHE 15 68.420 2.929 5.018 100 HD2 PHE 15 HD2 PHE 15 70.895 -0.495 4.980 101 HE1 PHE 15 HE1 PHE 15 69.435 3.691 2.908 102 HE2 PHE 15 HE2 PHE 15 71.918 0.264 2.868 103 HZ PHE 15 HZ PHE 15 71.177 2.361 1.850 104 H VAL 16 H VAL 16 67.956 -2.069 7.045 105 HA VAL 16 HA VAL 16 67.964 -3.312 4.540 106 HB VAL 16 HB VAL 16 67.891 -5.454 5.558 107 HG11 VAL 16 HG11 VAL 16 69.558 -5.423 7.320 108 HG12 VAL 16 HG12 VAL 16 69.483 -3.656 7.276 109 HG13 VAL 16 HG13 VAL 16 69.953 -4.570 5.838 110 HG21 VAL 16 HG21 VAL 16 66.106 -5.502 6.943 111 HG22 VAL 16 HG22 VAL 16 66.669 -4.144 7.893 112 HG23 VAL 16 HG23 VAL 16 67.479 -5.734 8.050 113 H GLN 17 H GLN 17 65.220 -2.714 6.744 114 HA GLN 17 HA GLN 17 63.426 -4.371 5.419 115 HB2 GLN 17 HB2 GLN 17 63.060 -3.675 7.691 116 HB3 GLN 17 HB3 GLN 17 63.090 -1.981 7.222 117 HG2 GLN 17 HG2 GLN 17 60.857 -2.750 7.629 118 HG3 GLN 17 HG3 GLN 17 61.136 -2.262 5.943 119 HE21 GLN 17 HE21 GLN 17 59.466 -3.481 5.114 120 HE22 GLN 17 HE22 GLN 17 59.532 -5.191 4.993 121 H LEU 18 H LEU 18 64.147 -0.922 5.172 122 HA LEU 18 HA LEU 18 62.136 -0.353 3.314 123 HB2 LEU 18 HB2 LEU 18 63.374 1.285 4.713 124 HB3 LEU 18 HB3 LEU 18 64.796 1.058 3.788 125 HG LEU 18 HG LEU 18 63.498 3.168 3.294 126 HD11 LEU 18 HD11 LEU 18 63.876 3.126 0.913 127 HD12 LEU 18 HD12 LEU 18 64.059 1.374 0.977 128 HD13 LEU 18 HD13 LEU 18 65.219 2.413 1.808 129 HD21 LEU 18 HD21 LEU 18 61.250 2.256 3.299 130 HD22 LEU 18 HD22 LEU 18 61.645 1.233 1.917 131 HD23 LEU 18 HD23 LEU 18 61.610 2.982 1.732 132 H LEU 19 H LEU 19 65.434 -1.266 3.037 133 HA LEU 19 HA LEU 19 65.776 -1.216 0.278 134 HB2 LEU 19 HB2 LEU 19 67.079 -2.473 2.525 135 HB3 LEU 19 HB3 LEU 19 67.406 -3.252 0.994 136 HG LEU 19 HG LEU 19 68.250 -1.142 0.090 137 HD11 LEU 19 HD11 LEU 19 68.565 0.787 1.572 138 HD12 LEU 19 HD12 LEU 19 67.596 -0.031 2.801 139 HD13 LEU 19 HD13 LEU 19 66.860 0.440 1.268 140 HD21 LEU 19 HD21 LEU 19 70.193 -0.939 1.484 141 HD22 LEU 19 HD22 LEU 19 69.704 -2.626 1.234 142 HD23 LEU 19 HD23 LEU 19 69.347 -1.820 2.764 143 H LYS 20 H LYS 20 64.423 -3.760 2.301 144 HA LYS 20 HA LYS 20 64.226 -5.786 0.349 145 HB2 LYS 20 HB2 LYS 20 62.307 -5.242 2.626 146 HB3 LYS 20 HB3 LYS 20 62.458 -6.754 1.763 147 HG2 LYS 20 HG2 LYS 20 64.806 -6.933 2.679 148 HG3 LYS 20 HG3 LYS 20 64.470 -5.469 3.536 149 HD2 LYS 20 HD2 LYS 20 62.602 -6.357 4.759 150 HD3 LYS 20 HD3 LYS 20 62.705 -7.884 3.900 151 HE2 LYS 20 HE2 LYS 20 64.943 -6.821 5.613 152 HE3 LYS 20 HE3 LYS 20 63.639 -7.806 6.262 153 HZ1 LYS 20 HZ1 LYS 20 65.619 -9.083 5.713 154 HZ2 LYS 20 HZ2 LYS 20 65.434 -8.722 4.054 155 HZ3 LYS 20 HZ3 LYS 20 64.269 -9.594 4.876 156 H GLU 21 H GLU 21 62.137 -3.151 1.328 157 HA GLU 21 HA GLU 21 59.946 -3.708 -0.334 158 HB2 GLU 21 HB2 GLU 21 60.909 -1.098 0.835 159 HB3 GLU 21 HB3 GLU 21 59.347 -1.318 0.067 160 HG2 GLU 21 HG2 GLU 21 60.247 -2.876 2.477 161 HG3 GLU 21 HG3 GLU 21 59.350 -1.365 2.569 162 H ILE 22 H ILE 22 62.906 -1.913 -0.774 163 HA ILE 22 HA ILE 22 62.283 -0.706 -3.243 164 HB ILE 22 HB ILE 22 65.085 -1.554 -2.469 165 HG12 ILE 22 HG12 ILE 22 63.568 0.935 -1.648 166 HG13 ILE 22 HG13 ILE 22 64.154 -0.322 -0.598 167 HG21 ILE 22 HG21 ILE 22 63.934 0.632 -4.197 168 HG22 ILE 22 HG22 ILE 22 64.846 -0.781 -4.741 169 HG23 ILE 22 HG23 ILE 22 65.633 0.478 -3.774 170 HD11 ILE 22 HD11 ILE 22 66.466 0.217 -1.162 171 HD12 ILE 22 HD12 ILE 22 65.620 1.613 -0.503 172 HD13 ILE 22 HD13 ILE 22 65.904 1.492 -2.239 173 H GLU 23 H GLU 23 63.660 -3.822 -2.411 174 HA GLU 23 HA GLU 23 64.535 -4.745 -4.893 175 HB2 GLU 23 HB2 GLU 23 63.095 -6.211 -2.736 176 HB3 GLU 23 HB3 GLU 23 63.901 -6.998 -4.060 177 HG2 GLU 23 HG2 GLU 23 66.036 -6.045 -3.182 178 HG3 GLU 23 HG3 GLU 23 65.109 -5.397 -1.825 179 H LYS 24 H LYS 24 61.420 -4.900 -3.338 180 HA LYS 24 HA LYS 24 60.159 -6.545 -5.216 181 HB2 LYS 24 HB2 LYS 24 59.527 -6.002 -2.833 182 HB3 LYS 24 HB3 LYS 24 58.778 -4.547 -3.460 183 HG2 LYS 24 HG2 LYS 24 57.070 -6.215 -3.210 184 HG3 LYS 24 HG3 LYS 24 57.358 -5.968 -4.935 185 HD2 LYS 24 HD2 LYS 24 57.138 -8.340 -4.461 186 HD3 LYS 24 HD3 LYS 24 58.792 -7.996 -4.957 187 HE2 LYS 24 HE2 LYS 24 59.461 -7.954 -2.571 188 HE3 LYS 24 HE3 LYS 24 57.810 -8.361 -2.118 189 HZ1 LYS 24 HZ1 LYS 24 59.237 -10.291 -2.137 190 HZ2 LYS 24 HZ2 LYS 24 59.640 -10.050 -3.743 191 HZ3 LYS 24 HZ3 LYS 24 58.060 -10.454 -3.322 192 H GLU 25 H GLU 25 60.182 -2.979 -4.876 193 HA GLU 25 HA GLU 25 58.522 -2.538 -7.124 194 HB2 GLU 25 HB2 GLU 25 60.512 -0.589 -5.849 195 HB3 GLU 25 HB3 GLU 25 59.193 -0.242 -6.913 196 HG2 GLU 25 HG2 GLU 25 58.713 -1.498 -4.238 197 HG3 GLU 25 HG3 GLU 25 58.757 0.239 -4.504 198 H ASN 26 H ASN 26 61.938 -2.938 -6.621 199 HA ASN 26 HA ASN 26 62.779 -1.947 -9.158 200 HB2 ASN 26 HB2 ASN 26 64.249 -1.919 -7.185 201 HB3 ASN 26 HB3 ASN 26 64.288 -3.676 -7.194 202 HD21 ASN 26 HD21 ASN 26 65.340 -0.778 -8.803 203 HD22 ASN 26 HD22 ASN 26 66.571 -1.531 -9.750 204 H VAL 27 H VAL 27 62.327 -5.247 -7.914 205 HA VAL 27 HA VAL 27 63.180 -6.405 -10.368 206 HB VAL 27 HB VAL 27 62.338 -8.560 -9.534 207 HG11 VAL 27 HG11 VAL 27 63.765 -8.743 -7.548 208 HG12 VAL 27 HG12 VAL 27 63.869 -6.984 -7.477 209 HG13 VAL 27 HG13 VAL 27 64.545 -7.850 -8.854 210 HG21 VAL 27 HG21 VAL 27 60.314 -7.824 -8.387 211 HG22 VAL 27 HG22 VAL 27 61.286 -6.970 -7.189 212 HG23 VAL 27 HG23 VAL 27 61.345 -8.729 -7.274 213 H ALA 28 H ALA 28 60.107 -5.311 -9.217 214 HA ALA 28 HA ALA 28 58.731 -6.547 -11.449 215 HB1 ALA 28 HB1 ALA 28 57.616 -6.469 -9.265 216 HB2 ALA 28 HB2 ALA 28 56.704 -5.580 -10.483 217 HB3 ALA 28 HB3 ALA 28 57.679 -4.706 -9.301 218 H ALA 29 H ALA 29 60.586 -3.927 -10.990 219 HA ALA 29 HA ALA 29 60.910 -1.899 -11.835 220 HB1 ALA 29 HB1 ALA 29 61.489 -3.337 -13.752 221 HB2 ALA 29 HB2 ALA 29 60.919 -1.737 -14.232 222 HB3 ALA 29 HB3 ALA 29 59.846 -3.131 -14.372 223 H THR 30 H THR 30 59.110 -1.277 -10.391 224 HA THR 30 HA THR 30 56.691 -0.451 -11.700 225 HB THR 30 HB THR 30 56.115 0.385 -9.425 226 HG1 THR 30 HG1 THR 30 57.568 0.476 -7.927 227 HG21 THR 30 HG21 THR 30 57.281 -2.387 -9.540 228 HG22 THR 30 HG22 THR 30 55.615 -1.938 -9.933 229 HG23 THR 30 HG23 THR 30 56.213 -1.804 -8.272 230 H ASP 31 H ASP 31 56.387 2.136 -10.299 231 HA ASP 31 HA ASP 31 58.554 3.577 -11.617 232 HB2 ASP 31 HB2 ASP 31 56.628 3.485 -13.162 233 HB3 ASP 31 HB3 ASP 31 55.667 4.332 -11.955 234 H ASP 32 H ASP 32 55.676 4.496 -9.792 235 HA ASP 32 HA ASP 32 56.836 6.929 -8.903 236 HB2 ASP 32 HB2 ASP 32 54.411 6.639 -8.910 237 HB3 ASP 32 HB3 ASP 32 54.556 5.405 -7.668 238 H VAL 33 H VAL 33 56.600 3.924 -7.156 239 HA VAL 33 HA VAL 33 57.981 5.262 -5.030 240 HB VAL 33 HB VAL 33 56.669 2.535 -5.180 241 HG11 VAL 33 HG11 VAL 33 58.649 2.459 -3.920 242 HG12 VAL 33 HG12 VAL 33 57.205 2.348 -2.858 243 HG13 VAL 33 HG13 VAL 33 58.143 3.878 -3.000 244 HG21 VAL 33 HG21 VAL 33 55.293 3.527 -3.493 245 HG22 VAL 33 HG22 VAL 33 55.286 4.455 -5.037 246 HG23 VAL 33 HG23 VAL 33 56.267 5.008 -3.659 247 H LEU 34 H LEU 34 58.490 3.141 -7.573 248 HA LEU 34 HA LEU 34 60.911 1.953 -6.841 249 HB2 LEU 34 HB2 LEU 34 59.450 1.400 -8.834 250 HB3 LEU 34 HB3 LEU 34 59.928 2.922 -9.494 251 HG LEU 34 HG LEU 34 60.975 0.762 -10.419 252 HD11 LEU 34 HD11 LEU 34 61.541 2.944 -11.178 253 HD12 LEU 34 HD12 LEU 34 63.000 1.965 -11.011 254 HD13 LEU 34 HD13 LEU 34 62.607 3.187 -9.796 255 HD21 LEU 34 HD21 LEU 34 62.739 1.260 -8.028 256 HD22 LEU 34 HD22 LEU 34 63.105 0.177 -9.368 257 HD23 LEU 34 HD23 LEU 34 61.734 -0.162 -8.309 258 H ASP 35 H ASP 35 60.249 5.027 -8.598 259 HA ASP 35 HA ASP 35 62.971 5.738 -8.447 260 HB2 ASP 35 HB2 ASP 35 60.513 7.229 -9.237 261 HB3 ASP 35 HB3 ASP 35 62.105 7.956 -9.169 262 H VAL 36 H VAL 36 60.430 6.054 -6.185 263 HA VAL 36 HA VAL 36 61.638 8.254 -4.797 264 HB VAL 36 HB VAL 36 60.137 5.967 -3.529 265 HG11 VAL 36 HG11 VAL 36 60.699 8.751 -2.604 266 HG12 VAL 36 HG12 VAL 36 61.459 7.265 -2.037 267 HG13 VAL 36 HG13 VAL 36 59.729 7.549 -1.714 268 HG21 VAL 36 HG21 VAL 36 58.866 7.035 -5.208 269 HG22 VAL 36 HG22 VAL 36 59.109 8.609 -4.379 270 HG23 VAL 36 HG23 VAL 36 58.238 7.263 -3.569 271 H LEU 37 H LEU 37 61.669 4.822 -4.560 272 HA LEU 37 HA LEU 37 63.259 4.736 -2.263 273 HB2 LEU 37 HB2 LEU 37 62.790 2.555 -4.229 274 HB3 LEU 37 HB3 LEU 37 63.370 2.521 -2.585 275 HG LEU 37 HG LEU 37 60.578 3.432 -3.220 276 HD11 LEU 37 HD11 LEU 37 61.426 0.780 -2.077 277 HD12 LEU 37 HD12 LEU 37 60.827 1.061 -3.718 278 HD13 LEU 37 HD13 LEU 37 59.775 1.359 -2.340 279 HD21 LEU 37 HD21 LEU 37 61.474 4.404 -1.186 280 HD22 LEU 37 HD22 LEU 37 61.955 2.808 -0.610 281 HD23 LEU 37 HD23 LEU 37 60.245 3.201 -0.791 282 H LEU 38 H LEU 38 63.896 4.241 -5.638 283 HA LEU 38 HA LEU 38 66.543 3.423 -5.302 284 HB2 LEU 38 HB2 LEU 38 65.138 4.788 -7.552 285 HB3 LEU 38 HB3 LEU 38 66.774 4.150 -7.729 286 HG LEU 38 HG LEU 38 64.127 2.788 -7.455 287 HD11 LEU 38 HD11 LEU 38 64.819 1.659 -9.470 288 HD12 LEU 38 HD12 LEU 38 66.359 2.506 -9.391 289 HD13 LEU 38 HD13 LEU 38 64.871 3.420 -9.654 290 HD21 LEU 38 HD21 LEU 38 65.569 1.607 -5.894 291 HD22 LEU 38 HD22 LEU 38 66.800 1.413 -7.139 292 HD23 LEU 38 HD23 LEU 38 65.238 0.619 -7.312 293 H GLU 39 H GLU 39 65.171 6.645 -5.783 294 HA GLU 39 HA GLU 39 67.729 7.853 -5.746 295 HB2 GLU 39 HB2 GLU 39 64.955 8.871 -5.455 296 HB3 GLU 39 HB3 GLU 39 66.368 9.890 -5.274 297 HG2 GLU 39 HG2 GLU 39 65.515 8.359 -7.729 298 HG3 GLU 39 HG3 GLU 39 65.462 10.106 -7.444 299 H HIS 40 H HIS 40 65.195 7.403 -3.341 300 HA HIS 40 HA HIS 40 66.307 8.995 -1.389 301 HB2 HIS 40 HB2 HIS 40 64.016 8.122 -1.312 302 HB3 HIS 40 HB3 HIS 40 64.596 6.513 -1.031 303 HD1 HIS 40 HD1 HIS 40 63.862 9.689 0.774 304 HD2 HIS 40 HD2 HIS 40 65.698 6.045 1.552 305 HE1 HIS 40 HE1 HIS 40 64.139 9.554 3.269 306 H PHE 41 H PHE 41 66.666 5.609 -2.046 307 HA PHE 41 HA PHE 41 68.296 4.884 0.071 308 HB2 PHE 41 HB2 PHE 41 67.232 3.244 -1.158 309 HB3 PHE 41 HB3 PHE 41 67.758 3.927 -2.681 310 HD1 PHE 41 HD1 PHE 41 69.003 2.305 0.379 311 HD2 PHE 41 HD2 PHE 41 69.546 2.961 -3.757 312 HE1 PHE 41 HE1 PHE 41 70.837 0.668 0.362 313 HE2 PHE 41 HE2 PHE 41 71.372 1.353 -3.777 314 HZ PHE 41 HZ PHE 41 72.020 0.198 -1.744 315 H VAL 42 H VAL 42 69.208 5.820 -3.229 316 HA VAL 42 HA VAL 42 71.932 5.785 -2.553 317 HB VAL 42 HB VAL 42 71.143 5.379 -4.820 318 HG11 VAL 42 HG11 VAL 42 69.443 6.791 -4.978 319 HG12 VAL 42 HG12 VAL 42 70.593 6.987 -6.313 320 HG13 VAL 42 HG13 VAL 42 70.520 8.214 -4.986 321 HG21 VAL 42 HG21 VAL 42 72.878 6.606 -6.041 322 HG22 VAL 42 HG22 VAL 42 73.482 5.955 -4.515 323 HG23 VAL 42 HG23 VAL 42 73.083 7.664 -4.650 324 H LYS 43 H LYS 43 69.611 8.331 -2.425 325 HA LYS 43 HA LYS 43 71.518 10.462 -2.205 326 HB2 LYS 43 HB2 LYS 43 69.770 11.942 -1.529 327 HB3 LYS 43 HB3 LYS 43 69.000 10.812 -2.625 328 HG2 LYS 43 HG2 LYS 43 68.164 9.551 -0.523 329 HG3 LYS 43 HG3 LYS 43 68.837 10.880 0.371 330 HD2 LYS 43 HD2 LYS 43 66.791 11.346 -1.775 331 HD3 LYS 43 HD3 LYS 43 66.355 11.023 -0.098 332 HE2 LYS 43 HE2 LYS 43 68.125 13.289 -1.026 333 HE3 LYS 43 HE3 LYS 43 66.404 13.431 -0.673 334 HZ1 LYS 43 HZ1 LYS 43 66.865 12.797 1.626 335 HZ2 LYS 43 HZ2 LYS 43 67.739 14.159 1.198 336 HZ3 LYS 43 HZ3 LYS 43 68.517 12.681 1.299 337 H ILE 44 H ILE 44 70.119 8.360 0.211 338 HA ILE 44 HA ILE 44 71.307 9.866 2.364 339 HB ILE 44 HB ILE 44 70.473 7.994 3.821 340 HG12 ILE 44 HG12 ILE 44 69.286 7.014 1.227 341 HG13 ILE 44 HG13 ILE 44 70.570 6.200 2.088 342 HG21 ILE 44 HG21 ILE 44 68.104 8.568 3.559 343 HG22 ILE 44 HG22 ILE 44 68.445 9.256 1.976 344 HG23 ILE 44 HG23 ILE 44 69.127 9.999 3.418 345 HD11 ILE 44 HD11 ILE 44 67.792 6.691 3.119 346 HD12 ILE 44 HD12 ILE 44 69.036 5.726 3.921 347 HD13 ILE 44 HD13 ILE 44 68.339 5.200 2.379 348 H THR 45 H THR 45 72.108 6.999 0.537 349 HA THR 45 HA THR 45 74.280 6.364 2.323 350 HB THR 45 HB THR 45 74.827 4.608 0.576 351 HG1 THR 45 HG1 THR 45 72.323 5.121 -0.587 352 HG21 THR 45 HG21 THR 45 73.406 4.078 2.490 353 HG22 THR 45 HG22 THR 45 72.874 3.234 1.036 354 HG23 THR 45 HG23 THR 45 71.993 4.652 1.603 355 H GLU 46 H GLU 46 73.806 7.768 -0.835 356 HA GLU 46 HA GLU 46 75.022 8.673 -2.342 357 HB2 GLU 46 HB2 GLU 46 76.658 9.503 0.030 358 HB3 GLU 46 HB3 GLU 46 77.007 10.104 -1.603 359 HG2 GLU 46 HG2 GLU 46 74.678 10.974 -1.642 360 HG3 GLU 46 HG3 GLU 46 74.505 10.447 0.020 361 H HIS 47 H HIS 47 75.259 6.717 -3.179 362 HA HIS 47 HA HIS 47 77.979 5.650 -3.068 363 HB2 HIS 47 HB2 HIS 47 76.156 4.229 -1.917 364 HB3 HIS 47 HB3 HIS 47 75.475 3.999 -3.518 365 HD1 HIS 47 HD1 HIS 47 76.491 2.039 -4.891 366 HD2 HIS 47 HD2 HIS 47 78.754 3.085 -1.569 367 HE1 HIS 47 HE1 HIS 47 78.393 0.428 -4.777 368 HA PRO 48 HA PRO 48 77.684 6.648 -7.454 369 HB2 PRO 48 HB2 PRO 48 79.572 4.493 -7.929 370 HB3 PRO 48 HB3 PRO 48 79.737 6.220 -8.227 371 HG2 PRO 48 HG2 PRO 48 81.037 4.862 -6.333 372 HG3 PRO 48 HG3 PRO 48 80.550 6.560 -6.031 373 HD2 PRO 48 HD2 PRO 48 79.353 3.978 -5.124 374 HD3 PRO 48 HD3 PRO 48 79.528 5.489 -4.220 375 H ASP 49 H ASP 49 76.882 3.735 -6.157 376 HA ASP 49 HA ASP 49 76.178 2.764 -8.693 377 HB2 ASP 49 HB2 ASP 49 77.510 1.112 -6.535 378 HB3 ASP 49 HB3 ASP 49 76.786 0.377 -7.940 379 H GLY 50 H GLY 50 74.740 4.111 -6.558 380 HA2 GLY 50 HA2 GLY 50 73.513 2.638 -4.450 381 HA3 GLY 50 HA3 GLY 50 72.830 4.019 -5.294 382 H THR 51 H THR 51 72.234 3.244 -7.539 383 HA THR 51 HA THR 51 70.012 1.575 -6.869 384 HB THR 51 HB THR 51 70.559 2.275 -9.712 385 HG1 THR 51 HG1 THR 51 69.476 4.423 -8.577 386 HG21 THR 51 HG21 THR 51 68.450 1.219 -8.882 387 HG22 THR 51 HG22 THR 51 68.204 2.815 -9.602 388 HG23 THR 51 HG23 THR 51 68.196 2.629 -7.862 389 H ALA 52 H ALA 52 73.045 1.143 -8.472 390 HA ALA 52 HA ALA 52 72.576 -1.416 -9.649 391 HB1 ALA 52 HB1 ALA 52 75.175 -0.245 -8.721 392 HB2 ALA 52 HB2 ALA 52 74.442 0.096 -10.286 393 HB3 ALA 52 HB3 ALA 52 74.962 -1.545 -9.891 394 H LEU 53 H LEU 53 73.592 -0.447 -6.437 395 HA LEU 53 HA LEU 53 74.326 -2.936 -5.356 396 HB2 LEU 53 HB2 LEU 53 72.782 -0.677 -4.099 397 HB3 LEU 53 HB3 LEU 53 73.423 -2.039 -3.205 398 HG LEU 53 HG LEU 53 75.122 -0.093 -4.765 399 HD11 LEU 53 HD11 LEU 53 75.682 0.849 -2.590 400 HD12 LEU 53 HD12 LEU 53 74.532 -0.244 -1.820 401 HD13 LEU 53 HD13 LEU 53 73.956 1.009 -2.920 402 HD21 LEU 53 HD21 LEU 53 76.129 -2.302 -4.440 403 HD22 LEU 53 HD22 LEU 53 75.807 -2.194 -2.709 404 HD23 LEU 53 HD23 LEU 53 76.940 -1.079 -3.465 405 H ILE 54 H ILE 54 71.189 -1.473 -5.730 406 HA ILE 54 HA ILE 54 69.756 -3.601 -4.452 407 HB ILE 54 HB ILE 54 68.703 -1.521 -6.400 408 HG12 ILE 54 HG12 ILE 54 68.032 -1.553 -3.533 409 HG13 ILE 54 HG13 ILE 54 69.639 -0.985 -3.885 410 HG21 ILE 54 HG21 ILE 54 66.471 -2.095 -5.583 411 HG22 ILE 54 HG22 ILE 54 67.160 -3.391 -4.604 412 HG23 ILE 54 HG23 ILE 54 67.240 -3.479 -6.363 413 HD11 ILE 54 HD11 ILE 54 67.069 0.072 -5.021 414 HD12 ILE 54 HD12 ILE 54 68.680 0.713 -5.352 415 HD13 ILE 54 HD13 ILE 54 68.011 0.805 -3.723 416 H TYR 55 H TYR 55 70.425 -2.764 -7.782 417 HA TYR 55 HA TYR 55 69.101 -4.854 -9.118 418 HB2 TYR 55 HB2 TYR 55 71.335 -3.030 -9.706 419 HB3 TYR 55 HB3 TYR 55 71.139 -4.390 -10.768 420 HD1 TYR 55 HD1 TYR 55 68.532 -4.646 -11.557 421 HD2 TYR 55 HD2 TYR 55 70.393 -1.037 -10.311 422 HE1 TYR 55 HE1 TYR 55 66.861 -3.358 -12.806 423 HE2 TYR 55 HE2 TYR 55 68.729 0.259 -11.554 424 HH TYR 55 HH TYR 55 67.263 -0.111 -13.498 425 H GLU 56 H GLU 56 72.480 -4.632 -8.054 426 HA GLU 56 HA GLU 56 72.989 -7.229 -8.933 427 HB2 GLU 56 HB2 GLU 56 75.143 -7.110 -7.693 428 HB3 GLU 56 HB3 GLU 56 74.867 -5.784 -8.804 429 HG2 GLU 56 HG2 GLU 56 74.514 -4.279 -7.139 430 HG3 GLU 56 HG3 GLU 56 74.318 -5.471 -5.876 431 H ALA 57 H ALA 57 71.890 -5.996 -5.851 432 HA ALA 57 HA ALA 57 72.304 -8.268 -4.285 433 HB1 ALA 57 HB1 ALA 57 71.466 -6.125 -3.406 434 HB2 ALA 57 HB2 ALA 57 70.465 -7.481 -2.895 435 HB3 ALA 57 HB3 ALA 57 69.917 -6.422 -4.193 436 H ALA 58 H ALA 58 69.716 -7.528 -6.546 437 HA ALA 58 HA ALA 58 68.109 -9.780 -6.018 438 HB1 ALA 58 HB1 ALA 58 68.427 -8.293 -8.633 439 HB2 ALA 58 HB2 ALA 58 67.324 -7.843 -7.335 440 HB3 ALA 58 HB3 ALA 58 67.089 -9.360 -8.204 441 H ALA 59 H ALA 59 70.698 -9.267 -8.325 442 HA ALA 59 HA ALA 59 70.602 -11.914 -9.391 443 HB1 ALA 59 HB1 ALA 59 71.495 -10.023 -10.675 444 HB2 ALA 59 HB2 ALA 59 72.665 -11.336 -10.557 445 HB3 ALA 59 HB3 ALA 59 72.843 -9.901 -9.545 446 H ARG 60 H ARG 60 72.637 -10.349 -6.976 447 HA ARG 60 HA ARG 60 74.481 -12.423 -6.534 448 HB2 ARG 60 HB2 ARG 60 73.544 -10.256 -4.654 449 HB3 ARG 60 HB3 ARG 60 74.901 -11.322 -4.334 450 HG2 ARG 60 HG2 ARG 60 76.108 -10.422 -6.208 451 HG3 ARG 60 HG3 ARG 60 74.711 -9.450 -6.678 452 HD2 ARG 60 HD2 ARG 60 76.273 -8.033 -5.528 453 HD3 ARG 60 HD3 ARG 60 74.870 -8.276 -4.501 454 HE ARG 60 HE ARG 60 76.489 -10.187 -3.633 455 HH11 ARG 60 HH11 ARG 60 77.157 -6.751 -4.276 456 HH12 ARG 60 HH12 ARG 60 78.342 -6.599 -3.072 457 HH21 ARG 60 HH21 ARG 60 78.122 -9.998 -1.999 458 HH22 ARG 60 HH22 ARG 60 78.916 -8.508 -1.739 459 H ALA 61 H ALA 61 71.372 -11.710 -4.998 460 HA ALA 61 HA ALA 61 71.653 -13.906 -3.208 461 HB1 ALA 61 HB1 ALA 61 69.168 -12.364 -3.963 462 HB2 ALA 61 HB2 ALA 61 70.285 -11.968 -2.651 463 HB3 ALA 61 HB3 ALA 61 69.344 -13.457 -2.582 464 H ALA 62 H ALA 62 70.379 -13.495 -6.419 465 HA ALA 62 HA ALA 62 68.838 -15.889 -6.474 466 HB1 ALA 62 HB1 ALA 62 68.699 -15.541 -8.882 467 HB2 ALA 62 HB2 ALA 62 69.998 -14.352 -8.796 468 HB3 ALA 62 HB3 ALA 62 68.448 -14.014 -8.034 469 H ALA 63 H ALA 63 72.050 -15.086 -7.736 470 HA ALA 63 HA ALA 63 72.548 -17.834 -8.457 471 HB1 ALA 63 HB1 ALA 63 74.783 -17.047 -9.083 472 HB2 ALA 63 HB2 ALA 63 74.439 -15.479 -8.352 473 HB3 ALA 63 HB3 ALA 63 73.529 -16.015 -9.765 474 H ASN 64 H ASN 64 73.587 -15.602 -5.969 475 HA ASN 64 HA ASN 64 74.733 -15.725 -4.120 476 HB2 ASN 64 HB2 ASN 64 72.682 -16.879 -3.368 477 HB3 ASN 64 HB3 ASN 64 73.414 -18.428 -3.774 478 HD21 ASN 64 HD21 ASN 64 73.474 -15.727 -1.580 479 HD22 ASN 64 HD22 ASN 64 74.438 -16.483 -0.371 480 HA PRO 65 HA PRO 65 78.337 -18.009 -5.673 481 HB2 PRO 65 HB2 PRO 65 79.717 -15.564 -4.773 482 HB3 PRO 65 HB3 PRO 65 79.749 -16.330 -6.364 483 HG2 PRO 65 HG2 PRO 65 78.485 -13.996 -5.970 484 HG3 PRO 65 HG3 PRO 65 77.856 -15.214 -7.091 485 HD2 PRO 65 HD2 PRO 65 76.991 -14.603 -4.287 486 HD3 PRO 65 HD3 PRO 65 75.996 -14.923 -5.727 487 H GLY 66 H GLY 66 78.052 -15.905 -2.835 488 HA2 GLY 66 HA2 GLY 66 78.114 -17.277 -0.721 489 HA3 GLY 66 HA3 GLY 66 79.692 -17.800 -1.310 490 H GLY 67 H GLY 67 78.349 -15.891 0.847 491 HA2 GLY 67 HA2 GLY 67 80.463 -14.585 1.758 492 HA3 GLY 67 HA3 GLY 67 79.931 -13.514 0.461 493 H ASP 68 H ASP 68 79.296 -11.882 1.901 494 HA ASP 68 HA ASP 68 76.996 -12.594 3.607 495 HB2 ASP 68 HB2 ASP 68 78.853 -10.217 3.796 496 HB3 ASP 68 HB3 ASP 68 77.414 -10.428 4.774 497 H GLY 69 H GLY 69 77.593 -11.465 0.678 498 HA2 GLY 69 HA2 GLY 69 75.591 -9.324 0.770 499 HA3 GLY 69 HA3 GLY 69 76.777 -9.563 -0.508 500 H GLY 70 H GLY 70 73.938 -10.934 1.009 501 HA2 GLY 70 HA2 GLY 70 73.322 -12.356 -1.445 502 HA3 GLY 70 HA3 GLY 70 72.413 -12.426 0.066 503 H GLY 71 H GLY 71 70.942 -10.804 0.561 504 HA2 GLY 71 HA2 GLY 71 70.120 -9.257 -1.786 505 HA3 GLY 71 HA3 GLY 71 69.023 -9.888 -0.569 506 HA PRO 72 HA PRO 72 69.172 -5.545 0.556 507 HB2 PRO 72 HB2 PRO 72 67.438 -5.890 2.721 508 HB3 PRO 72 HB3 PRO 72 66.999 -5.386 1.094 509 HG2 PRO 72 HG2 PRO 72 66.730 -7.995 2.400 510 HG3 PRO 72 HG3 PRO 72 65.834 -7.328 1.032 511 HD2 PRO 72 HD2 PRO 72 67.730 -9.291 0.846 512 HD3 PRO 72 HD3 PRO 72 67.260 -8.226 -0.491 513 H GLU 73 H GLU 73 69.412 -8.117 2.929 514 HA GLU 73 HA GLU 73 70.716 -6.413 4.929 515 HB2 GLU 73 HB2 GLU 73 70.240 -9.404 4.923 516 HB3 GLU 73 HB3 GLU 73 70.495 -8.355 6.315 517 HG2 GLU 73 HG2 GLU 73 68.397 -7.382 6.130 518 HG3 GLU 73 HG3 GLU 73 68.164 -7.964 4.490 519 H GLY 74 H GLY 74 71.712 -7.825 2.184 520 HA2 GLY 74 HA2 GLY 74 74.292 -8.058 3.433 521 HA3 GLY 74 HA3 GLY 74 73.934 -8.962 1.909 522 H ILE 75 H ILE 75 72.698 -6.555 0.752 523 HA ILE 75 HA ILE 75 74.928 -5.116 -0.154 524 HB ILE 75 HB ILE 75 73.242 -3.247 -0.666 525 HG12 ILE 75 HG12 ILE 75 71.313 -5.458 0.068 526 HG13 ILE 75 HG13 ILE 75 71.578 -3.963 0.952 527 HG21 ILE 75 HG21 ILE 75 72.402 -4.425 -2.605 528 HG22 ILE 75 HG22 ILE 75 73.027 -5.946 -1.925 529 HG23 ILE 75 HG23 ILE 75 74.131 -4.611 -2.317 530 HD11 ILE 75 HD11 ILE 75 70.442 -4.155 -1.829 531 HD12 ILE 75 HD12 ILE 75 70.664 -2.692 -0.818 532 HD13 ILE 75 HD13 ILE 75 69.539 -3.939 -0.317 533 H VAL 76 H VAL 76 72.817 -4.603 2.662 534 HA VAL 76 HA VAL 76 73.566 -2.103 3.253 535 HB VAL 76 HB VAL 76 73.020 -2.709 5.488 536 HG11 VAL 76 HG11 VAL 76 71.371 -1.982 3.837 537 HG12 VAL 76 HG12 VAL 76 70.701 -2.888 5.177 538 HG13 VAL 76 HG13 VAL 76 70.930 -3.674 3.606 539 HG21 VAL 76 HG21 VAL 76 73.705 -4.921 5.713 540 HG22 VAL 76 HG22 VAL 76 72.524 -5.462 4.509 541 HG23 VAL 76 HG23 VAL 76 71.987 -4.813 6.071 542 H LYS 77 H LYS 77 75.157 -5.106 4.011 543 HA LYS 77 HA LYS 77 77.114 -3.953 5.641 544 HB2 LYS 77 HB2 LYS 77 76.491 -6.368 5.543 545 HB3 LYS 77 HB3 LYS 77 77.348 -6.472 4.014 546 HG2 LYS 77 HG2 LYS 77 79.425 -5.829 5.124 547 HG3 LYS 77 HG3 LYS 77 78.568 -5.727 6.663 548 HD2 LYS 77 HD2 LYS 77 78.722 -8.147 4.939 549 HD3 LYS 77 HD3 LYS 77 79.795 -7.883 6.331 550 HE2 LYS 77 HE2 LYS 77 76.776 -8.214 6.334 551 HE3 LYS 77 HE3 LYS 77 77.945 -9.398 6.896 552 HZ1 LYS 77 HZ1 LYS 77 77.393 -6.745 8.136 553 HZ2 LYS 77 HZ2 LYS 77 78.569 -7.803 8.667 554 HZ3 LYS 77 HZ3 LYS 77 76.948 -8.236 8.750 555 H GLU 78 H GLU 78 76.959 -4.564 2.123 556 HA GLU 78 HA GLU 78 79.652 -3.750 1.658 557 HB2 GLU 78 HB2 GLU 78 78.296 -5.091 -0.021 558 HB3 GLU 78 HB3 GLU 78 77.382 -3.651 -0.429 559 HG2 GLU 78 HG2 GLU 78 79.346 -2.550 -1.235 560 HG3 GLU 78 HG3 GLU 78 80.370 -3.863 -0.666 561 H ILE 79 H ILE 79 76.643 -2.137 1.929 562 HA ILE 79 HA ILE 79 77.418 0.351 1.019 563 HB ILE 79 HB ILE 79 75.195 -0.520 2.832 564 HG12 ILE 79 HG12 ILE 79 75.224 0.592 0.040 565 HG13 ILE 79 HG13 ILE 79 75.191 -1.116 0.436 566 HG21 ILE 79 HG21 ILE 79 75.744 1.767 3.515 567 HG22 ILE 79 HG22 ILE 79 74.214 1.730 2.634 568 HG23 ILE 79 HG23 ILE 79 75.682 2.294 1.832 569 HD11 ILE 79 HD11 ILE 79 73.043 -0.786 1.535 570 HD12 ILE 79 HD12 ILE 79 73.036 -0.307 -0.162 571 HD13 ILE 79 HD13 ILE 79 73.116 0.928 1.097 572 H LYS 80 H LYS 80 77.339 -1.034 4.294 573 HA LYS 80 HA LYS 80 78.077 1.359 5.566 574 HB2 LYS 80 HB2 LYS 80 78.284 0.087 7.589 575 HB3 LYS 80 HB3 LYS 80 76.926 -0.535 6.677 576 HG2 LYS 80 HG2 LYS 80 78.402 -2.358 5.847 577 HG3 LYS 80 HG3 LYS 80 79.628 -1.791 6.968 578 HD2 LYS 80 HD2 LYS 80 76.862 -2.709 7.727 579 HD3 LYS 80 HD3 LYS 80 78.336 -3.658 7.879 580 HE2 LYS 80 HE2 LYS 80 77.754 -1.058 9.303 581 HE3 LYS 80 HE3 LYS 80 77.632 -2.671 9.990 582 HZ1 LYS 80 HZ1 LYS 80 80.024 -2.953 9.646 583 HZ2 LYS 80 HZ2 LYS 80 79.695 -1.616 10.610 584 HZ3 LYS 80 HZ3 LYS 80 80.132 -1.391 9.008 585 H GLU 81 H GLU 81 79.946 -1.318 4.258 586 HA GLU 81 HA GLU 81 82.362 -0.545 5.479 587 HB2 GLU 81 HB2 GLU 81 81.955 -2.275 3.049 588 HB3 GLU 81 HB3 GLU 81 83.436 -2.160 3.994 589 HG2 GLU 81 HG2 GLU 81 82.173 -2.969 5.969 590 HG3 GLU 81 HG3 GLU 81 80.776 -3.197 4.928 591 H TRP 82 H TRP 82 80.919 0.203 2.370 592 HA TRP 82 HA TRP 82 83.126 1.524 1.204 593 HB2 TRP 82 HB2 TRP 82 80.905 0.744 0.136 594 HB3 TRP 82 HB3 TRP 82 80.238 2.212 0.863 595 HD1 TRP 82 HD1 TRP 82 82.463 1.048 -2.013 596 HE1 TRP 82 HE1 TRP 82 82.774 2.999 -3.644 597 HE3 TRP 82 HE3 TRP 82 80.358 4.751 0.765 598 HZ2 TRP 82 HZ2 TRP 82 82.190 5.755 -3.750 599 HZ3 TRP 82 HZ3 TRP 82 80.265 6.984 -0.133 600 HH2 TRP 82 HH2 TRP 82 81.173 7.516 -2.361 601 H ARG 83 H ARG 83 80.455 2.498 3.202 602 HA ARG 83 HA ARG 83 80.796 5.284 3.245 603 HB2 ARG 83 HB2 ARG 83 79.137 3.337 4.443 604 HB3 ARG 83 HB3 ARG 83 79.804 4.303 5.744 605 HG2 ARG 83 HG2 ARG 83 77.642 5.173 4.992 606 HG3 ARG 83 HG3 ARG 83 78.975 6.297 4.745 607 HD2 ARG 83 HD2 ARG 83 77.298 6.090 2.849 608 HD3 ARG 83 HD3 ARG 83 79.001 5.997 2.425 609 HE ARG 83 HE ARG 83 78.061 3.426 2.914 610 HH11 ARG 83 HH11 ARG 83 77.394 5.974 0.592 611 HH12 ARG 83 HH12 ARG 83 77.286 4.967 -0.748 612 HH21 ARG 83 HH21 ARG 83 77.962 2.021 1.154 613 HH22 ARG 83 HH22 ARG 83 77.592 2.544 -0.425 614 H ALA 84 H ALA 84 81.933 2.742 5.445 615 HA ALA 84 HA ALA 84 83.292 4.413 7.241 616 HB1 ALA 84 HB1 ALA 84 82.633 2.111 7.758 617 HB2 ALA 84 HB2 ALA 84 84.354 2.374 8.046 618 HB3 ALA 84 HB3 ALA 84 83.820 1.514 6.600 619 H ALA 85 H ALA 85 84.355 2.804 4.297 620 HA ALA 85 HA ALA 85 87.094 3.451 4.607 621 HB1 ALA 85 HB1 ALA 85 86.334 1.631 3.151 622 HB2 ALA 85 HB2 ALA 85 87.309 2.799 2.257 623 HB3 ALA 85 HB3 ALA 85 85.553 2.808 2.095 624 H ASN 86 H ASN 86 84.414 4.975 2.940 625 HA ASN 86 HA ASN 86 85.895 7.067 1.705 626 HB2 ASN 86 HB2 ASN 86 83.570 6.375 1.030 627 HB3 ASN 86 HB3 ASN 86 82.975 7.123 2.504 628 HD21 ASN 86 HD21 ASN 86 83.858 7.642 -0.731 629 HD22 ASN 86 HD22 ASN 86 83.761 9.357 -0.743 630 H GLY 87 H GLY 87 84.013 6.897 4.691 631 HA2 GLY 87 HA2 GLY 87 84.811 8.144 6.632 632 HA3 GLY 87 HA3 GLY 87 85.209 9.463 5.532 633 H LYS 88 H LYS 88 82.282 7.689 4.939 634 HA LYS 88 HA LYS 88 80.704 9.978 5.632 635 HB2 LYS 88 HB2 LYS 88 80.477 7.554 3.916 636 HB3 LYS 88 HB3 LYS 88 79.103 8.565 4.287 637 HG2 LYS 88 HG2 LYS 88 80.193 10.442 3.181 638 HG3 LYS 88 HG3 LYS 88 81.636 9.458 2.927 639 HD2 LYS 88 HD2 LYS 88 80.345 7.923 1.558 640 HD3 LYS 88 HD3 LYS 88 78.899 8.909 1.778 641 HE2 LYS 88 HE2 LYS 88 81.475 9.833 0.532 642 HE3 LYS 88 HE3 LYS 88 80.088 9.339 -0.410 643 HZ1 LYS 88 HZ1 LYS 88 78.860 11.222 0.807 644 HZ2 LYS 88 HZ2 LYS 88 80.097 11.727 -0.221 645 HZ3 LYS 88 HZ3 LYS 88 80.357 11.686 1.409 646 HA PRO 89 HA PRO 89 79.062 7.583 9.016 647 HB2 PRO 89 HB2 PRO 89 76.554 8.588 9.201 648 HB3 PRO 89 HB3 PRO 89 77.978 9.490 9.726 649 HG2 PRO 89 HG2 PRO 89 76.413 9.722 7.194 650 HG3 PRO 89 HG3 PRO 89 77.105 11.008 8.197 651 HD2 PRO 89 HD2 PRO 89 78.276 10.118 5.902 652 HD3 PRO 89 HD3 PRO 89 79.198 10.774 7.269 653 H GLY 90 H GLY 90 78.042 5.686 9.286 654 HA2 GLY 90 HA2 GLY 90 76.624 4.646 6.969 655 HA3 GLY 90 HA3 GLY 90 77.287 3.698 8.297 656 H PHE 91 H PHE 91 75.685 2.739 9.294 657 HA PHE 91 HA PHE 91 73.065 4.035 9.441 658 HB2 PHE 91 HB2 PHE 91 73.729 1.256 10.433 659 HB3 PHE 91 HB3 PHE 91 72.182 1.893 9.901 660 HD1 PHE 91 HD1 PHE 91 72.416 2.912 7.362 661 HD2 PHE 91 HD2 PHE 91 74.615 -0.309 9.045 662 HE1 PHE 91 HE1 PHE 91 72.860 2.039 5.117 663 HE2 PHE 91 HE2 PHE 91 75.054 -1.187 6.794 664 HZ PHE 91 HZ PHE 91 74.184 -0.011 4.832 665 H LYS 92 H LYS 92 71.950 4.032 11.571 666 HA LYS 92 HA LYS 92 73.847 4.540 13.651 667 HB2 LYS 92 HB2 LYS 92 72.105 5.662 14.727 668 HB3 LYS 92 HB3 LYS 92 72.042 6.157 13.077 669 HG2 LYS 92 HG2 LYS 92 70.091 4.802 12.678 670 HG3 LYS 92 HG3 LYS 92 70.260 4.059 14.272 671 HD2 LYS 92 HD2 LYS 92 69.835 7.015 13.880 672 HD3 LYS 92 HD3 LYS 92 68.488 5.888 14.090 673 HE2 LYS 92 HE2 LYS 92 69.371 5.290 16.293 674 HE3 LYS 92 HE3 LYS 92 70.749 6.354 16.053 675 HZ1 LYS 92 HZ1 LYS 92 69.265 8.249 16.012 676 HZ2 LYS 92 HZ2 LYS 92 69.017 7.365 17.418 677 HZ3 LYS 92 HZ3 LYS 92 67.908 7.248 16.161 678 H GLN 93 H GLN 93 72.914 3.830 15.817 679 HA GLN 93 HA GLN 93 72.440 1.007 15.595 680 HB2 GLN 93 HB2 GLN 93 73.485 2.861 17.588 681 HB3 GLN 93 HB3 GLN 93 72.901 1.302 18.144 682 HG2 GLN 93 HG2 GLN 93 75.288 1.115 17.853 683 HG3 GLN 93 HG3 GLN 93 74.525 0.218 16.559 684 HE21 GLN 93 HE21 GLN 93 74.984 3.744 16.691 685 HE22 GLN 93 HE22 GLN 93 76.067 3.804 15.352 686 H GLY 94 H GLY 94 70.688 0.145 16.282 687 HA2 GLY 94 HA2 GLY 94 69.000 0.698 18.240 688 HA3 GLY 94 HA3 GLY 94 68.486 1.830 16.988 Start of MODEL 6 1 H GLU 2 H GLU 2 60.892 2.675 7.417 2 HA GLU 2 HA GLU 2 59.543 4.678 7.274 3 HB2 GLU 2 HB2 GLU 2 61.479 5.664 9.365 4 HB3 GLU 2 HB3 GLU 2 60.265 6.613 8.544 5 HG2 GLU 2 HG2 GLU 2 58.517 5.363 9.665 6 HG3 GLU 2 HG3 GLU 2 59.743 4.373 10.471 7 H LEU 3 H LEU 3 60.493 6.697 6.336 8 HA LEU 3 HA LEU 3 63.100 6.123 5.146 9 HB2 LEU 3 HB2 LEU 3 60.956 8.122 4.423 10 HB3 LEU 3 HB3 LEU 3 62.483 7.940 3.585 11 HG LEU 3 HG LEU 3 60.299 5.898 3.753 12 HD11 LEU 3 HD11 LEU 3 61.307 7.612 1.459 13 HD12 LEU 3 HD12 LEU 3 59.774 7.824 2.292 14 HD13 LEU 3 HD13 LEU 3 60.060 6.371 1.328 15 HD21 LEU 3 HD21 LEU 3 62.944 5.876 2.331 16 HD22 LEU 3 HD22 LEU 3 61.667 4.666 2.139 17 HD23 LEU 3 HD23 LEU 3 62.464 4.884 3.706 18 H LYS 4 H LYS 4 64.738 7.304 5.869 19 HA LYS 4 HA LYS 4 64.130 9.642 7.527 20 HB2 LYS 4 HB2 LYS 4 66.849 8.414 7.275 21 HB3 LYS 4 HB3 LYS 4 66.179 9.356 8.599 22 HG2 LYS 4 HG2 LYS 4 65.769 6.467 7.902 23 HG3 LYS 4 HG3 LYS 4 66.524 7.114 9.338 24 HD2 LYS 4 HD2 LYS 4 64.114 8.169 9.628 25 HD3 LYS 4 HD3 LYS 4 63.709 6.813 8.588 26 HE2 LYS 4 HE2 LYS 4 65.033 5.305 10.095 27 HE3 LYS 4 HE3 LYS 4 65.188 6.634 11.196 28 HZ1 LYS 4 HZ1 LYS 4 62.600 6.605 11.310 29 HZ2 LYS 4 HZ2 LYS 4 63.496 5.453 12.067 30 HZ3 LYS 4 HZ3 LYS 4 62.773 5.038 10.619 31 H ASN 5 H ASN 5 65.414 11.546 7.056 32 HA ASN 5 HA ASN 5 65.806 11.729 4.228 33 HB2 ASN 5 HB2 ASN 5 65.967 13.853 6.361 34 HB3 ASN 5 HB3 ASN 5 66.226 14.157 4.643 35 HD21 ASN 5 HD21 ASN 5 64.470 13.959 3.211 36 HD22 ASN 5 HD22 ASN 5 62.853 13.955 3.777 37 H SER 6 H SER 6 67.800 10.991 6.789 38 HA SER 6 HA SER 6 69.998 11.114 4.925 39 HB2 SER 6 HB2 SER 6 71.522 11.864 6.681 40 HB3 SER 6 HB3 SER 6 70.340 13.098 6.245 41 HG SER 6 HG SER 6 69.139 12.510 8.057 42 H ILE 7 H ILE 7 71.806 9.721 5.650 43 HA ILE 7 HA ILE 7 70.823 7.140 6.296 44 HB ILE 7 HB ILE 7 72.801 7.745 4.800 45 HG12 ILE 7 HG12 ILE 7 74.161 5.737 5.458 46 HG13 ILE 7 HG13 ILE 7 73.185 5.624 6.920 47 HG21 ILE 7 HG21 ILE 7 74.232 7.993 7.433 48 HG22 ILE 7 HG22 ILE 7 73.942 9.283 6.270 49 HG23 ILE 7 HG23 ILE 7 75.004 7.940 5.849 50 HD11 ILE 7 HD11 ILE 7 72.470 4.090 5.174 51 HD12 ILE 7 HD12 ILE 7 72.132 5.455 4.110 52 HD13 ILE 7 HD13 ILE 7 71.205 5.237 5.595 53 H SER 8 H SER 8 71.652 9.733 8.246 54 HA SER 8 HA SER 8 73.035 8.312 10.281 55 HB2 SER 8 HB2 SER 8 72.017 11.140 10.177 56 HB3 SER 8 HB3 SER 8 73.081 10.481 11.428 57 HG SER 8 HG SER 8 74.599 10.054 9.887 58 H ASP 9 H ASP 9 69.737 8.910 9.593 59 HA ASP 9 HA ASP 9 69.063 8.247 12.379 60 HB2 ASP 9 HB2 ASP 9 67.819 10.172 10.940 61 HB3 ASP 9 HB3 ASP 9 67.047 8.792 10.270 62 H TYR 10 H TYR 10 70.037 6.688 9.879 63 HA TYR 10 HA TYR 10 67.866 4.762 9.632 64 HB2 TYR 10 HB2 TYR 10 70.107 5.508 7.836 65 HB3 TYR 10 HB3 TYR 10 69.726 3.798 7.915 66 HD1 TYR 10 HD1 TYR 10 67.375 3.062 7.364 67 HD2 TYR 10 HD2 TYR 10 68.788 6.988 6.550 68 HE1 TYR 10 HE1 TYR 10 65.520 3.387 5.757 69 HE2 TYR 10 HE2 TYR 10 66.944 7.322 4.956 70 HH TYR 10 HH TYR 10 65.327 6.082 3.658 71 H THR 11 H THR 11 67.925 3.231 11.040 72 HA THR 11 HA THR 11 70.393 2.279 12.104 73 HB THR 11 HB THR 11 68.983 0.597 13.212 74 HG1 THR 11 HG1 THR 11 66.677 0.629 12.655 75 HG21 THR 11 HG21 THR 11 67.545 3.248 13.102 76 HG22 THR 11 HG22 THR 11 68.813 2.784 14.249 77 HG23 THR 11 HG23 THR 11 67.245 1.988 14.290 78 H GLU 12 H GLU 12 71.111 0.041 11.471 79 HA GLU 12 HA GLU 12 70.904 -0.161 8.685 80 HB2 GLU 12 HB2 GLU 12 72.093 -2.405 9.002 81 HB3 GLU 12 HB3 GLU 12 72.934 -0.930 9.443 82 HG2 GLU 12 HG2 GLU 12 72.414 -1.323 11.766 83 HG3 GLU 12 HG3 GLU 12 71.562 -2.803 11.359 84 H ALA 13 H ALA 13 69.051 -1.533 11.205 85 HA ALA 13 HA ALA 13 67.746 -3.466 9.597 86 HB1 ALA 13 HB1 ALA 13 66.725 -2.110 12.096 87 HB2 ALA 13 HB2 ALA 13 67.698 -3.581 12.054 88 HB3 ALA 13 HB3 ALA 13 66.071 -3.580 11.375 89 H GLU 14 H GLU 14 66.951 -0.072 10.454 90 HA GLU 14 HA GLU 14 64.515 0.189 9.069 91 HB2 GLU 14 HB2 GLU 14 66.724 2.123 9.686 92 HB3 GLU 14 HB3 GLU 14 65.413 2.650 8.665 93 HG2 GLU 14 HG2 GLU 14 65.097 1.584 11.458 94 HG3 GLU 14 HG3 GLU 14 65.211 3.291 11.044 95 H PHE 15 H PHE 15 67.809 0.461 8.040 96 HA PHE 15 HA PHE 15 67.316 1.353 5.429 97 HB2 PHE 15 HB2 PHE 15 69.559 1.219 6.814 98 HB3 PHE 15 HB3 PHE 15 69.621 -0.373 6.125 99 HD1 PHE 15 HD1 PHE 15 68.990 3.098 4.965 100 HD2 PHE 15 HD2 PHE 15 70.747 -0.685 4.203 101 HE1 PHE 15 HE1 PHE 15 69.990 3.987 2.905 102 HE2 PHE 15 HE2 PHE 15 71.749 0.184 2.150 103 HZ PHE 15 HZ PHE 15 71.375 2.533 1.498 104 H VAL 16 H VAL 16 68.206 -1.915 6.619 105 HA VAL 16 HA VAL 16 67.775 -2.968 4.104 106 HB VAL 16 HB VAL 16 69.262 -4.100 5.643 107 HG11 VAL 16 HG11 VAL 16 66.850 -4.811 7.085 108 HG12 VAL 16 HG12 VAL 16 68.251 -3.765 7.563 109 HG13 VAL 16 HG13 VAL 16 68.480 -5.524 7.291 110 HG21 VAL 16 HG21 VAL 16 68.424 -5.428 3.802 111 HG22 VAL 16 HG22 VAL 16 67.013 -5.878 4.761 112 HG23 VAL 16 HG23 VAL 16 68.616 -6.424 5.247 113 H GLN 17 H GLN 17 65.507 -2.494 6.711 114 HA GLN 17 HA GLN 17 63.494 -4.139 5.835 115 HB2 GLN 17 HB2 GLN 17 63.446 -2.924 7.930 116 HB3 GLN 17 HB3 GLN 17 63.439 -1.390 7.071 117 HG2 GLN 17 HG2 GLN 17 61.344 -2.066 6.040 118 HG3 GLN 17 HG3 GLN 17 61.317 -3.460 7.140 119 HE21 GLN 17 HE21 GLN 17 61.010 -0.021 6.856 120 HE22 GLN 17 HE22 GLN 17 60.408 0.260 8.441 121 H LEU 18 H LEU 18 64.414 -0.853 4.961 122 HA LEU 18 HA LEU 18 62.373 -0.426 3.101 123 HB2 LEU 18 HB2 LEU 18 63.698 1.264 4.284 124 HB3 LEU 18 HB3 LEU 18 65.091 0.998 3.373 125 HG LEU 18 HG LEU 18 63.874 2.997 2.635 126 HD11 LEU 18 HD11 LEU 18 63.945 2.646 0.265 127 HD12 LEU 18 HD12 LEU 18 63.989 0.903 0.526 128 HD13 LEU 18 HD13 LEU 18 65.333 1.911 1.072 129 HD21 LEU 18 HD21 LEU 18 61.787 2.772 1.373 130 HD22 LEU 18 HD22 LEU 18 61.599 2.262 3.048 131 HD23 LEU 18 HD23 LEU 18 61.743 1.058 1.767 132 H LEU 19 H LEU 19 65.628 -1.520 2.945 133 HA LEU 19 HA LEU 19 66.084 -1.846 0.257 134 HB2 LEU 19 HB2 LEU 19 66.832 -3.323 2.591 135 HB3 LEU 19 HB3 LEU 19 67.570 -3.763 1.054 136 HG LEU 19 HG LEU 19 67.874 -1.292 2.752 137 HD11 LEU 19 HD11 LEU 19 69.408 -3.046 3.135 138 HD12 LEU 19 HD12 LEU 19 70.244 -1.686 2.372 139 HD13 LEU 19 HD13 LEU 19 69.814 -3.116 1.434 140 HD21 LEU 19 HD21 LEU 19 68.558 -1.428 -0.192 141 HD22 LEU 19 HD22 LEU 19 69.130 -0.204 0.933 142 HD23 LEU 19 HD23 LEU 19 67.412 -0.335 0.598 143 H LYS 20 H LYS 20 64.452 -3.988 2.537 144 HA LYS 20 HA LYS 20 64.145 -6.213 0.832 145 HB2 LYS 20 HB2 LYS 20 62.617 -5.423 3.300 146 HB3 LYS 20 HB3 LYS 20 62.396 -6.967 2.505 147 HG2 LYS 20 HG2 LYS 20 64.839 -7.388 2.850 148 HG3 LYS 20 HG3 LYS 20 64.898 -5.904 3.790 149 HD2 LYS 20 HD2 LYS 20 64.715 -7.662 5.337 150 HD3 LYS 20 HD3 LYS 20 63.123 -6.918 5.258 151 HE2 LYS 20 HE2 LYS 20 62.305 -8.682 3.818 152 HE3 LYS 20 HE3 LYS 20 63.917 -9.385 3.706 153 HZ1 LYS 20 HZ1 LYS 20 62.305 -9.186 6.196 154 HZ2 LYS 20 HZ2 LYS 20 63.835 -9.874 6.061 155 HZ3 LYS 20 HZ3 LYS 20 62.526 -10.571 5.273 156 H GLU 21 H GLU 21 62.143 -3.384 1.391 157 HA GLU 21 HA GLU 21 60.166 -4.514 -0.291 158 HB2 GLU 21 HB2 GLU 21 59.007 -2.317 -0.235 159 HB3 GLU 21 HB3 GLU 21 59.305 -3.016 1.350 160 HG2 GLU 21 HG2 GLU 21 61.226 -1.465 1.564 161 HG3 GLU 21 HG3 GLU 21 60.720 -0.715 0.049 162 H ILE 22 H ILE 22 62.867 -2.442 -0.741 163 HA ILE 22 HA ILE 22 62.459 -1.711 -3.421 164 HB ILE 22 HB ILE 22 65.109 -2.442 -2.128 165 HG12 ILE 22 HG12 ILE 22 63.726 0.241 -2.374 166 HG13 ILE 22 HG13 ILE 22 64.033 -0.661 -0.898 167 HG21 ILE 22 HG21 ILE 22 65.233 -2.425 -4.553 168 HG22 ILE 22 HG22 ILE 22 66.123 -1.073 -3.858 169 HG23 ILE 22 HG23 ILE 22 64.538 -0.802 -4.588 170 HD11 ILE 22 HD11 ILE 22 66.448 -0.384 -1.255 171 HD12 ILE 22 HD12 ILE 22 65.600 1.157 -1.124 172 HD13 ILE 22 HD13 ILE 22 66.099 0.558 -2.705 173 H GLU 23 H GLU 23 63.781 -4.729 -2.032 174 HA GLU 23 HA GLU 23 64.498 -5.961 -4.398 175 HB2 GLU 23 HB2 GLU 23 65.177 -6.985 -2.383 176 HB3 GLU 23 HB3 GLU 23 63.544 -6.959 -1.725 177 HG2 GLU 23 HG2 GLU 23 62.844 -8.480 -3.334 178 HG3 GLU 23 HG3 GLU 23 64.460 -8.644 -4.038 179 H LYS 24 H LYS 24 61.451 -5.653 -2.760 180 HA LYS 24 HA LYS 24 60.085 -7.502 -4.402 181 HB2 LYS 24 HB2 LYS 24 59.479 -6.934 -2.050 182 HB3 LYS 24 HB3 LYS 24 58.944 -5.371 -2.629 183 HG2 LYS 24 HG2 LYS 24 57.016 -6.778 -2.387 184 HG3 LYS 24 HG3 LYS 24 57.351 -6.485 -4.103 185 HD2 LYS 24 HD2 LYS 24 56.732 -8.817 -3.698 186 HD3 LYS 24 HD3 LYS 24 58.378 -8.669 -4.310 187 HE2 LYS 24 HE2 LYS 24 59.248 -8.942 -2.037 188 HE3 LYS 24 HE3 LYS 24 57.599 -9.044 -1.419 189 HZ1 LYS 24 HZ1 LYS 24 58.845 -10.949 -3.322 190 HZ2 LYS 24 HZ2 LYS 24 57.287 -11.050 -2.672 191 HZ3 LYS 24 HZ3 LYS 24 58.622 -11.200 -1.666 192 H GLU 25 H GLU 25 60.191 -3.903 -4.295 193 HA GLU 25 HA GLU 25 58.386 -3.839 -6.495 194 HB2 GLU 25 HB2 GLU 25 58.798 -1.277 -6.441 195 HB3 GLU 25 HB3 GLU 25 57.926 -2.022 -5.110 196 HG2 GLU 25 HG2 GLU 25 59.352 -0.511 -4.115 197 HG3 GLU 25 HG3 GLU 25 60.211 -2.035 -3.946 198 H ASN 26 H ASN 26 61.745 -3.934 -6.289 199 HA ASN 26 HA ASN 26 62.170 -3.082 -8.964 200 HB2 ASN 26 HB2 ASN 26 63.829 -4.211 -6.825 201 HB3 ASN 26 HB3 ASN 26 64.321 -4.687 -8.448 202 HD21 ASN 26 HD21 ASN 26 63.556 -1.863 -6.446 203 HD22 ASN 26 HD22 ASN 26 64.594 -0.797 -7.276 204 H VAL 27 H VAL 27 61.711 -6.282 -7.476 205 HA VAL 27 HA VAL 27 62.007 -7.504 -10.043 206 HB VAL 27 HB VAL 27 61.290 -9.629 -9.054 207 HG11 VAL 27 HG11 VAL 27 63.606 -9.001 -8.835 208 HG12 VAL 27 HG12 VAL 27 63.083 -9.905 -7.412 209 HG13 VAL 27 HG13 VAL 27 63.260 -8.153 -7.327 210 HG21 VAL 27 HG21 VAL 27 60.814 -8.064 -6.513 211 HG22 VAL 27 HG22 VAL 27 60.758 -9.821 -6.659 212 HG23 VAL 27 HG23 VAL 27 59.573 -8.826 -7.508 213 H ALA 28 H ALA 28 59.272 -6.387 -8.173 214 HA ALA 28 HA ALA 28 57.343 -7.470 -10.003 215 HB1 ALA 28 HB1 ALA 28 55.701 -6.175 -8.749 216 HB2 ALA 28 HB2 ALA 28 56.991 -5.305 -7.925 217 HB3 ALA 28 HB3 ALA 28 56.776 -7.032 -7.645 218 H ALA 29 H ALA 29 59.146 -4.548 -9.671 219 HA ALA 29 HA ALA 29 59.548 -2.796 -10.932 220 HB1 ALA 29 HB1 ALA 29 59.116 -2.780 -13.314 221 HB2 ALA 29 HB2 ALA 29 57.991 -4.128 -13.157 222 HB3 ALA 29 HB3 ALA 29 59.711 -4.372 -12.836 223 H THR 30 H THR 30 58.545 -1.285 -9.789 224 HA THR 30 HA THR 30 55.800 -0.613 -10.603 225 HB THR 30 HB THR 30 55.596 0.636 -8.531 226 HG1 THR 30 HG1 THR 30 58.055 -0.063 -7.438 227 HG21 THR 30 HG21 THR 30 56.989 -1.956 -7.975 228 HG22 THR 30 HG22 THR 30 55.265 -1.782 -8.328 229 HG23 THR 30 HG23 THR 30 55.949 -1.101 -6.835 230 H ASP 31 H ASP 31 55.800 2.110 -10.109 231 HA ASP 31 HA ASP 31 58.249 3.063 -11.360 232 HB2 ASP 31 HB2 ASP 31 57.253 4.307 -13.102 233 HB3 ASP 31 HB3 ASP 31 56.475 2.737 -13.161 234 H ASP 32 H ASP 32 55.729 3.632 -9.170 235 HA ASP 32 HA ASP 32 56.525 6.401 -8.876 236 HB2 ASP 32 HB2 ASP 32 54.608 4.778 -7.152 237 HB3 ASP 32 HB3 ASP 32 54.954 6.476 -6.957 238 H VAL 33 H VAL 33 56.500 3.535 -6.854 239 HA VAL 33 HA VAL 33 58.107 4.932 -4.915 240 HB VAL 33 HB VAL 33 56.305 3.291 -4.317 241 HG11 VAL 33 HG11 VAL 33 56.861 0.916 -4.117 242 HG12 VAL 33 HG12 VAL 33 58.352 1.232 -5.004 243 HG13 VAL 33 HG13 VAL 33 56.795 1.470 -5.796 244 HG21 VAL 33 HG21 VAL 33 58.978 2.837 -3.031 245 HG22 VAL 33 HG22 VAL 33 57.413 2.450 -2.312 246 HG23 VAL 33 HG23 VAL 33 57.840 4.128 -2.657 247 H LEU 34 H LEU 34 58.557 2.726 -7.449 248 HA LEU 34 HA LEU 34 61.137 1.684 -7.002 249 HB2 LEU 34 HB2 LEU 34 59.358 1.155 -8.816 250 HB3 LEU 34 HB3 LEU 34 59.943 2.597 -9.580 251 HG LEU 34 HG LEU 34 60.723 0.456 -10.579 252 HD11 LEU 34 HD11 LEU 34 62.991 1.140 -10.958 253 HD12 LEU 34 HD12 LEU 34 62.849 2.304 -9.628 254 HD13 LEU 34 HD13 LEU 34 61.840 2.478 -11.073 255 HD21 LEU 34 HD21 LEU 34 62.390 0.280 -8.090 256 HD22 LEU 34 HD22 LEU 34 62.562 -0.729 -9.524 257 HD23 LEU 34 HD23 LEU 34 61.087 -0.809 -8.561 258 H ASP 35 H ASP 35 60.089 4.737 -8.468 259 HA ASP 35 HA ASP 35 62.851 5.488 -8.940 260 HB2 ASP 35 HB2 ASP 35 60.810 6.375 -10.292 261 HB3 ASP 35 HB3 ASP 35 60.551 7.349 -8.830 262 H VAL 36 H VAL 36 60.540 6.029 -6.470 263 HA VAL 36 HA VAL 36 61.874 8.102 -5.083 264 HB VAL 36 HB VAL 36 60.368 5.829 -3.842 265 HG11 VAL 36 HG11 VAL 36 60.879 8.625 -2.982 266 HG12 VAL 36 HG12 VAL 36 61.652 7.148 -2.381 267 HG13 VAL 36 HG13 VAL 36 59.909 7.427 -2.080 268 HG21 VAL 36 HG21 VAL 36 59.080 6.766 -5.509 269 HG22 VAL 36 HG22 VAL 36 59.342 8.418 -4.839 270 HG23 VAL 36 HG23 VAL 36 58.466 7.159 -3.897 271 H LEU 37 H LEU 37 61.887 4.588 -4.739 272 HA LEU 37 HA LEU 37 63.521 4.699 -2.470 273 HB2 LEU 37 HB2 LEU 37 63.132 2.318 -4.221 274 HB3 LEU 37 HB3 LEU 37 63.660 2.463 -2.564 275 HG LEU 37 HG LEU 37 60.866 3.081 -3.424 276 HD11 LEU 37 HD11 LEU 37 61.303 0.683 -3.304 277 HD12 LEU 37 HD12 LEU 37 60.216 1.208 -2.020 278 HD13 LEU 37 HD13 LEU 37 61.903 0.873 -1.653 279 HD21 LEU 37 HD21 LEU 37 60.424 3.417 -1.029 280 HD22 LEU 37 HD22 LEU 37 61.559 4.599 -1.672 281 HD23 LEU 37 HD23 LEU 37 62.148 3.249 -0.698 282 H LEU 38 H LEU 38 64.067 4.076 -5.809 283 HA LEU 38 HA LEU 38 66.727 3.352 -5.599 284 HB2 LEU 38 HB2 LEU 38 65.068 4.604 -7.686 285 HB3 LEU 38 HB3 LEU 38 66.772 4.315 -8.026 286 HG LEU 38 HG LEU 38 64.377 2.536 -7.752 287 HD11 LEU 38 HD11 LEU 38 65.127 3.187 -9.926 288 HD12 LEU 38 HD12 LEU 38 65.278 1.431 -9.676 289 HD13 LEU 38 HD13 LEU 38 66.703 2.467 -9.563 290 HD21 LEU 38 HD21 LEU 38 65.760 0.504 -7.550 291 HD22 LEU 38 HD22 LEU 38 65.783 1.505 -6.105 292 HD23 LEU 38 HD23 LEU 38 67.164 1.515 -7.205 293 H GLU 39 H GLU 39 65.333 6.587 -6.109 294 HA GLU 39 HA GLU 39 67.926 7.773 -6.060 295 HB2 GLU 39 HB2 GLU 39 66.735 9.943 -5.866 296 HB3 GLU 39 HB3 GLU 39 66.324 9.016 -7.281 297 HG2 GLU 39 HG2 GLU 39 64.209 8.547 -6.571 298 HG3 GLU 39 HG3 GLU 39 64.522 8.776 -4.877 299 H HIS 40 H HIS 40 65.403 7.380 -3.667 300 HA HIS 40 HA HIS 40 66.466 8.990 -1.626 301 HB2 HIS 40 HB2 HIS 40 64.190 8.025 -1.707 302 HB3 HIS 40 HB3 HIS 40 64.837 6.454 -1.397 303 HD1 HIS 40 HD1 HIS 40 64.306 9.762 0.363 304 HD2 HIS 40 HD2 HIS 40 65.451 5.863 1.200 305 HE1 HIS 40 HE1 HIS 40 64.332 9.557 2.867 306 H PHE 41 H PHE 41 66.897 5.593 -2.362 307 HA PHE 41 HA PHE 41 68.484 4.886 -0.213 308 HB2 PHE 41 HB2 PHE 41 67.526 3.196 -1.457 309 HB3 PHE 41 HB3 PHE 41 68.053 3.890 -2.979 310 HD1 PHE 41 HD1 PHE 41 69.195 2.173 0.083 311 HD2 PHE 41 HD2 PHE 41 70.057 3.114 -3.961 312 HE1 PHE 41 HE1 PHE 41 71.130 0.650 0.142 313 HE2 PHE 41 HE2 PHE 41 71.998 1.615 -3.883 314 HZ PHE 41 HZ PHE 41 72.531 0.382 -1.843 315 H VAL 42 H VAL 42 69.456 5.871 -3.483 316 HA VAL 42 HA VAL 42 72.196 5.865 -2.788 317 HB VAL 42 HB VAL 42 71.440 5.513 -5.104 318 HG11 VAL 42 HG11 VAL 42 70.746 8.366 -5.167 319 HG12 VAL 42 HG12 VAL 42 69.704 6.916 -5.294 320 HG13 VAL 42 HG13 VAL 42 70.920 7.249 -6.543 321 HG21 VAL 42 HG21 VAL 42 73.755 6.150 -4.714 322 HG22 VAL 42 HG22 VAL 42 73.306 7.846 -4.856 323 HG23 VAL 42 HG23 VAL 42 73.159 6.773 -6.248 324 H LYS 43 H LYS 43 69.815 8.288 -2.631 325 HA LYS 43 HA LYS 43 71.543 10.465 -2.167 326 HB2 LYS 43 HB2 LYS 43 69.412 11.225 -2.568 327 HB3 LYS 43 HB3 LYS 43 68.665 9.892 -1.715 328 HG2 LYS 43 HG2 LYS 43 68.896 10.911 0.345 329 HG3 LYS 43 HG3 LYS 43 70.042 12.117 -0.199 330 HD2 LYS 43 HD2 LYS 43 68.086 12.869 -1.775 331 HD3 LYS 43 HD3 LYS 43 67.076 11.882 -0.723 332 HE2 LYS 43 HE2 LYS 43 68.766 14.238 0.130 333 HE3 LYS 43 HE3 LYS 43 67.022 14.244 -0.086 334 HZ1 LYS 43 HZ1 LYS 43 66.857 12.640 1.734 335 HZ2 LYS 43 HZ2 LYS 43 67.600 14.077 2.193 336 HZ3 LYS 43 HZ3 LYS 43 68.537 12.720 1.965 337 H ILE 44 H ILE 44 70.097 8.288 0.150 338 HA ILE 44 HA ILE 44 71.322 9.675 2.349 339 HB ILE 44 HB ILE 44 70.494 7.711 3.696 340 HG12 ILE 44 HG12 ILE 44 69.469 6.924 0.969 341 HG13 ILE 44 HG13 ILE 44 70.499 5.966 2.002 342 HG21 ILE 44 HG21 ILE 44 68.135 8.387 3.479 343 HG22 ILE 44 HG22 ILE 44 68.511 9.178 1.949 344 HG23 ILE 44 HG23 ILE 44 69.215 9.784 3.448 345 HD11 ILE 44 HD11 ILE 44 68.616 5.767 3.575 346 HD12 ILE 44 HD12 ILE 44 68.237 5.146 1.949 347 HD13 ILE 44 HD13 ILE 44 67.678 6.751 2.450 348 H THR 45 H THR 45 72.185 6.779 0.512 349 HA THR 45 HA THR 45 74.443 6.459 2.272 350 HB THR 45 HB THR 45 73.570 4.367 1.458 351 HG1 THR 45 HG1 THR 45 76.141 5.183 0.889 352 HG21 THR 45 HG21 THR 45 72.615 5.115 -0.678 353 HG22 THR 45 HG22 THR 45 73.673 3.728 -0.919 354 HG23 THR 45 HG23 THR 45 74.235 5.347 -1.329 355 H GLU 46 H GLU 46 73.859 7.949 -0.827 356 HA GLU 46 HA GLU 46 75.101 9.088 -2.263 357 HB2 GLU 46 HB2 GLU 46 76.645 9.374 0.235 358 HB3 GLU 46 HB3 GLU 46 77.251 10.178 -1.229 359 HG2 GLU 46 HG2 GLU 46 74.541 10.497 0.008 360 HG3 GLU 46 HG3 GLU 46 75.899 11.566 0.390 361 H HIS 47 H HIS 47 75.428 6.289 -2.071 362 HA HIS 47 HA HIS 47 78.167 5.659 -2.657 363 HB2 HIS 47 HB2 HIS 47 76.505 4.003 -1.661 364 HB3 HIS 47 HB3 HIS 47 75.687 3.972 -3.215 365 HD1 HIS 47 HD1 HIS 47 76.716 2.361 -5.013 366 HD2 HIS 47 HD2 HIS 47 79.058 2.818 -1.622 367 HE1 HIS 47 HE1 HIS 47 78.687 0.824 -5.285 368 HA PRO 48 HA PRO 48 77.968 7.251 -6.852 369 HB2 PRO 48 HB2 PRO 48 79.830 5.077 -7.496 370 HB3 PRO 48 HB3 PRO 48 80.042 6.817 -7.727 371 HG2 PRO 48 HG2 PRO 48 81.279 5.359 -5.945 372 HG3 PRO 48 HG3 PRO 48 80.762 7.014 -5.467 373 HD2 PRO 48 HD2 PRO 48 79.619 4.319 -4.858 374 HD3 PRO 48 HD3 PRO 48 79.738 5.719 -3.790 375 H ASP 49 H ASP 49 77.375 4.039 -6.083 376 HA ASP 49 HA ASP 49 76.501 3.515 -8.719 377 HB2 ASP 49 HB2 ASP 49 78.123 1.697 -6.942 378 HB3 ASP 49 HB3 ASP 49 77.266 1.079 -8.337 379 H GLY 50 H GLY 50 75.154 4.490 -6.495 380 HA2 GLY 50 HA2 GLY 50 73.904 2.928 -4.525 381 HA3 GLY 50 HA3 GLY 50 73.189 4.257 -5.388 382 H THR 51 H THR 51 72.768 3.465 -7.713 383 HA THR 51 HA THR 51 70.559 1.757 -7.014 384 HB THR 51 HB THR 51 70.833 2.523 -9.863 385 HG1 THR 51 HG1 THR 51 70.256 4.698 -9.252 386 HG21 THR 51 HG21 THR 51 68.486 3.084 -9.474 387 HG22 THR 51 HG22 THR 51 68.669 2.821 -7.751 388 HG23 THR 51 HG23 THR 51 68.812 1.472 -8.847 389 H ALA 52 H ALA 52 73.557 1.468 -8.648 390 HA ALA 52 HA ALA 52 73.079 -1.007 -9.987 391 HB1 ALA 52 HB1 ALA 52 75.691 0.090 -8.966 392 HB2 ALA 52 HB2 ALA 52 74.984 0.516 -10.525 393 HB3 ALA 52 HB3 ALA 52 75.477 -1.147 -10.204 394 H LEU 53 H LEU 53 74.142 -0.135 -6.770 395 HA LEU 53 HA LEU 53 74.710 -2.753 -5.932 396 HB2 LEU 53 HB2 LEU 53 73.663 -0.484 -4.272 397 HB3 LEU 53 HB3 LEU 53 74.164 -2.021 -3.616 398 HG LEU 53 HG LEU 53 75.858 0.120 -4.843 399 HD11 LEU 53 HD11 LEU 53 75.869 -1.258 -2.194 400 HD12 LEU 53 HD12 LEU 53 75.310 0.378 -2.553 401 HD13 LEU 53 HD13 LEU 53 77.014 -0.028 -2.733 402 HD21 LEU 53 HD21 LEU 53 76.654 -1.980 -5.803 403 HD22 LEU 53 HD22 LEU 53 76.662 -2.722 -4.206 404 HD23 LEU 53 HD23 LEU 53 77.781 -1.408 -4.572 405 H ILE 54 H ILE 54 71.695 -1.075 -6.133 406 HA ILE 54 HA ILE 54 70.200 -3.064 -4.694 407 HB ILE 54 HB ILE 54 69.456 -0.754 -6.461 408 HG12 ILE 54 HG12 ILE 54 68.337 -1.479 -3.791 409 HG13 ILE 54 HG13 ILE 54 69.843 -0.620 -3.844 410 HG21 ILE 54 HG21 ILE 54 67.062 -1.279 -6.304 411 HG22 ILE 54 HG22 ILE 54 67.458 -2.839 -5.581 412 HG23 ILE 54 HG23 ILE 54 67.942 -2.491 -7.240 413 HD11 ILE 54 HD11 ILE 54 67.172 0.279 -4.908 414 HD12 ILE 54 HD12 ILE 54 68.677 1.173 -5.105 415 HD13 ILE 54 HD13 ILE 54 68.030 0.896 -3.492 416 H TYR 55 H TYR 55 70.767 -2.373 -8.045 417 HA TYR 55 HA TYR 55 69.299 -4.520 -9.047 418 HB2 TYR 55 HB2 TYR 55 71.317 -2.658 -10.153 419 HB3 TYR 55 HB3 TYR 55 70.797 -4.020 -11.115 420 HD1 TYR 55 HD1 TYR 55 68.179 -4.260 -11.371 421 HD2 TYR 55 HD2 TYR 55 70.103 -0.662 -10.185 422 HE1 TYR 55 HE1 TYR 55 66.171 -2.987 -11.998 423 HE2 TYR 55 HE2 TYR 55 68.115 0.624 -10.803 424 HH TYR 55 HH TYR 55 65.139 -0.849 -11.338 425 H GLU 56 H GLU 56 72.795 -4.264 -8.411 426 HA GLU 56 HA GLU 56 73.188 -6.914 -9.267 427 HB2 GLU 56 HB2 GLU 56 75.419 -6.829 -8.193 428 HB3 GLU 56 HB3 GLU 56 75.119 -5.507 -9.301 429 HG2 GLU 56 HG2 GLU 56 74.897 -3.976 -7.602 430 HG3 GLU 56 HG3 GLU 56 74.750 -5.172 -6.333 431 H ALA 57 H ALA 57 72.396 -5.574 -6.108 432 HA ALA 57 HA ALA 57 72.971 -7.822 -4.564 433 HB1 ALA 57 HB1 ALA 57 72.358 -5.653 -3.597 434 HB2 ALA 57 HB2 ALA 57 71.375 -6.963 -2.936 435 HB3 ALA 57 HB3 ALA 57 70.702 -5.881 -4.155 436 H ALA 58 H ALA 58 70.100 -7.077 -6.450 437 HA ALA 58 HA ALA 58 68.545 -9.281 -5.647 438 HB1 ALA 58 HB1 ALA 58 68.530 -7.853 -8.312 439 HB2 ALA 58 HB2 ALA 58 67.613 -7.374 -6.884 440 HB3 ALA 58 HB3 ALA 58 67.253 -8.900 -7.694 441 H ALA 59 H ALA 59 70.897 -8.898 -8.238 442 HA ALA 59 HA ALA 59 70.597 -11.546 -9.278 443 HB1 ALA 59 HB1 ALA 59 72.882 -9.601 -9.617 444 HB2 ALA 59 HB2 ALA 59 71.457 -9.697 -10.649 445 HB3 ALA 59 HB3 ALA 59 72.597 -11.042 -10.592 446 H ARG 60 H ARG 60 72.849 -9.992 -7.101 447 HA ARG 60 HA ARG 60 74.555 -12.147 -6.644 448 HB2 ARG 60 HB2 ARG 60 74.001 -9.718 -4.938 449 HB3 ARG 60 HB3 ARG 60 75.224 -10.911 -4.532 450 HG2 ARG 60 HG2 ARG 60 76.448 -10.429 -6.541 451 HG3 ARG 60 HG3 ARG 60 75.172 -9.357 -7.112 452 HD2 ARG 60 HD2 ARG 60 76.974 -8.017 -6.250 453 HD3 ARG 60 HD3 ARG 60 75.607 -7.891 -5.157 454 HE ARG 60 HE ARG 60 77.363 -9.922 -4.275 455 HH11 ARG 60 HH11 ARG 60 77.293 -6.365 -4.566 456 HH12 ARG 60 HH12 ARG 60 78.279 -6.115 -3.185 457 HH21 ARG 60 HH21 ARG 60 78.813 -9.515 -2.405 458 HH22 ARG 60 HH22 ARG 60 79.136 -7.912 -1.970 459 H ALA 61 H ALA 61 71.473 -11.452 -5.218 460 HA ALA 61 HA ALA 61 71.760 -13.447 -3.171 461 HB1 ALA 61 HB1 ALA 61 70.080 -11.675 -2.992 462 HB2 ALA 61 HB2 ALA 61 69.325 -13.270 -2.925 463 HB3 ALA 61 HB3 ALA 61 69.252 -12.314 -4.407 464 H ALA 62 H ALA 62 70.552 -13.427 -6.442 465 HA ALA 62 HA ALA 62 69.565 -16.105 -6.404 466 HB1 ALA 62 HB1 ALA 62 68.688 -14.388 -7.932 467 HB2 ALA 62 HB2 ALA 62 69.250 -15.823 -8.785 468 HB3 ALA 62 HB3 ALA 62 70.240 -14.362 -8.771 469 H ALA 63 H ALA 63 72.451 -14.606 -7.750 470 HA ALA 63 HA ALA 63 73.704 -17.254 -7.700 471 HB1 ALA 63 HB1 ALA 63 75.331 -16.338 -9.324 472 HB2 ALA 63 HB2 ALA 63 74.458 -14.807 -9.329 473 HB3 ALA 63 HB3 ALA 63 73.687 -16.265 -9.964 474 H ASN 64 H ASN 64 73.904 -16.936 -5.477 475 HA ASN 64 HA ASN 64 75.059 -14.625 -4.379 476 HB2 ASN 64 HB2 ASN 64 73.492 -16.163 -3.193 477 HB3 ASN 64 HB3 ASN 64 74.831 -17.289 -2.997 478 HD21 ASN 64 HD21 ASN 64 74.607 -13.773 -2.781 479 HD22 ASN 64 HD22 ASN 64 75.256 -13.634 -1.198 480 HA PRO 65 HA PRO 65 79.365 -15.459 -5.200 481 HB2 PRO 65 HB2 PRO 65 79.602 -13.421 -3.030 482 HB3 PRO 65 HB3 PRO 65 80.406 -13.467 -4.601 483 HG2 PRO 65 HG2 PRO 65 78.389 -11.806 -4.181 484 HG3 PRO 65 HG3 PRO 65 78.532 -12.667 -5.723 485 HD2 PRO 65 HD2 PRO 65 76.703 -13.187 -3.423 486 HD3 PRO 65 HD3 PRO 65 76.407 -13.328 -5.170 487 H GLY 66 H GLY 66 78.017 -15.102 -1.951 488 HA2 GLY 66 HA2 GLY 66 78.414 -17.437 -0.803 489 HA3 GLY 66 HA3 GLY 66 80.072 -16.842 -0.830 490 H GLY 67 H GLY 67 76.810 -15.966 0.202 491 HA2 GLY 67 HA2 GLY 67 76.271 -15.311 2.391 492 HA3 GLY 67 HA3 GLY 67 77.977 -14.980 2.674 493 H ASP 68 H ASP 68 78.727 -13.284 0.840 494 HA ASP 68 HA ASP 68 77.418 -10.854 1.579 495 HB2 ASP 68 HB2 ASP 68 79.040 -9.719 0.150 496 HB3 ASP 68 HB3 ASP 68 79.842 -10.892 1.183 497 H GLY 69 H GLY 69 76.441 -9.357 0.214 498 HA2 GLY 69 HA2 GLY 69 75.021 -8.648 -1.421 499 HA3 GLY 69 HA3 GLY 69 75.739 -9.862 -2.469 500 H GLY 70 H GLY 70 74.079 -10.474 0.568 501 HA2 GLY 70 HA2 GLY 70 72.382 -12.417 -0.750 502 HA3 GLY 70 HA3 GLY 70 72.415 -12.076 0.959 503 H GLY 71 H GLY 71 71.585 -10.521 -1.984 504 HA2 GLY 71 HA2 GLY 71 69.900 -9.513 -2.634 505 HA3 GLY 71 HA3 GLY 71 68.905 -10.280 -1.394 506 HA PRO 72 HA PRO 72 68.424 -6.002 -0.123 507 HB2 PRO 72 HB2 PRO 72 67.000 -6.888 2.161 508 HB3 PRO 72 HB3 PRO 72 66.347 -6.136 0.718 509 HG2 PRO 72 HG2 PRO 72 66.131 -8.848 1.562 510 HG3 PRO 72 HG3 PRO 72 65.508 -8.152 0.057 511 HD2 PRO 72 HD2 PRO 72 67.759 -9.900 0.500 512 HD3 PRO 72 HD3 PRO 72 67.131 -9.356 -1.054 513 H GLU 73 H GLU 73 69.384 -8.659 1.818 514 HA GLU 73 HA GLU 73 70.251 -6.981 3.978 515 HB2 GLU 73 HB2 GLU 73 70.728 -9.942 3.614 516 HB3 GLU 73 HB3 GLU 73 70.787 -9.035 5.119 517 HG2 GLU 73 HG2 GLU 73 68.373 -8.628 4.981 518 HG3 GLU 73 HG3 GLU 73 68.322 -9.477 3.448 519 H GLY 74 H GLY 74 71.558 -7.729 1.042 520 HA2 GLY 74 HA2 GLY 74 74.124 -7.374 2.282 521 HA3 GLY 74 HA3 GLY 74 73.998 -8.175 0.676 522 H ILE 75 H ILE 75 71.918 -5.770 0.457 523 HA ILE 75 HA ILE 75 73.688 -3.939 -0.831 524 HB ILE 75 HB ILE 75 71.256 -2.659 0.179 525 HG12 ILE 75 HG12 ILE 75 70.861 -5.201 -1.490 526 HG13 ILE 75 HG13 ILE 75 70.396 -4.926 0.149 527 HG21 ILE 75 HG21 ILE 75 72.248 -3.236 -2.601 528 HG22 ILE 75 HG22 ILE 75 72.592 -1.797 -1.642 529 HG23 ILE 75 HG23 ILE 75 70.944 -2.124 -2.181 530 HD11 ILE 75 HD11 ILE 75 68.796 -3.402 -0.329 531 HD12 ILE 75 HD12 ILE 75 68.535 -4.689 -1.511 532 HD13 ILE 75 HD13 ILE 75 69.311 -3.167 -1.993 533 H VAL 76 H VAL 76 71.903 -3.934 2.168 534 HA VAL 76 HA VAL 76 72.791 -1.626 3.386 535 HB VAL 76 HB VAL 76 70.988 -2.805 4.205 536 HG11 VAL 76 HG11 VAL 76 71.022 -4.887 5.374 537 HG12 VAL 76 HG12 VAL 76 72.461 -5.242 4.358 538 HG13 VAL 76 HG13 VAL 76 70.911 -4.702 3.646 539 HG21 VAL 76 HG21 VAL 76 73.109 -2.976 6.324 540 HG22 VAL 76 HG22 VAL 76 71.373 -3.039 6.630 541 HG23 VAL 76 HG23 VAL 76 72.101 -1.573 5.972 542 H LYS 77 H LYS 77 73.999 -4.762 3.581 543 HA LYS 77 HA LYS 77 76.218 -4.343 5.242 544 HB2 LYS 77 HB2 LYS 77 75.614 -6.623 4.819 545 HB3 LYS 77 HB3 LYS 77 75.813 -6.398 3.085 546 HG2 LYS 77 HG2 LYS 77 78.208 -6.252 3.324 547 HG3 LYS 77 HG3 LYS 77 78.070 -6.353 5.079 548 HD2 LYS 77 HD2 LYS 77 77.277 -8.593 4.968 549 HD3 LYS 77 HD3 LYS 77 77.059 -8.499 3.221 550 HE2 LYS 77 HE2 LYS 77 79.072 -9.787 3.897 551 HE3 LYS 77 HE3 LYS 77 79.436 -8.403 2.876 552 HZ1 LYS 77 HZ1 LYS 77 80.927 -8.745 4.816 553 HZ2 LYS 77 HZ2 LYS 77 79.678 -8.276 5.847 554 HZ3 LYS 77 HZ3 LYS 77 80.281 -7.216 4.670 555 H GLU 78 H GLU 78 76.069 -4.239 1.687 556 HA GLU 78 HA GLU 78 78.784 -3.688 1.213 557 HB2 GLU 78 HB2 GLU 78 76.960 -4.380 -0.454 558 HB3 GLU 78 HB3 GLU 78 76.461 -2.703 -0.479 559 HG2 GLU 78 HG2 GLU 78 77.825 -2.993 -2.346 560 HG3 GLU 78 HG3 GLU 78 78.827 -2.154 -1.154 561 H ILE 79 H ILE 79 75.993 -1.656 1.837 562 HA ILE 79 HA ILE 79 77.181 0.878 1.459 563 HB ILE 79 HB ILE 79 74.784 0.079 3.127 564 HG12 ILE 79 HG12 ILE 79 74.521 -0.420 0.731 565 HG13 ILE 79 HG13 ILE 79 73.440 0.887 1.229 566 HG21 ILE 79 HG21 ILE 79 75.620 2.839 2.280 567 HG22 ILE 79 HG22 ILE 79 75.612 2.197 3.924 568 HG23 ILE 79 HG23 ILE 79 74.092 2.421 3.058 569 HD11 ILE 79 HD11 ILE 79 75.049 2.461 0.264 570 HD12 ILE 79 HD12 ILE 79 74.350 1.328 -0.890 571 HD13 ILE 79 HD13 ILE 79 76.002 1.083 -0.306 572 H LYS 80 H LYS 80 76.735 -1.086 4.398 573 HA LYS 80 HA LYS 80 77.651 0.927 6.137 574 HB2 LYS 80 HB2 LYS 80 77.847 -0.751 7.906 575 HB3 LYS 80 HB3 LYS 80 76.435 -1.144 6.946 576 HG2 LYS 80 HG2 LYS 80 77.558 -2.930 5.870 577 HG3 LYS 80 HG3 LYS 80 79.077 -2.474 6.617 578 HD2 LYS 80 HD2 LYS 80 78.068 -4.388 7.767 579 HD3 LYS 80 HD3 LYS 80 78.225 -2.981 8.812 580 HE2 LYS 80 HE2 LYS 80 75.843 -2.482 8.505 581 HE3 LYS 80 HE3 LYS 80 75.684 -3.880 7.440 582 HZ1 LYS 80 HZ1 LYS 80 76.556 -4.015 10.264 583 HZ2 LYS 80 HZ2 LYS 80 76.189 -5.334 9.283 584 HZ3 LYS 80 HZ3 LYS 80 74.978 -4.274 9.791 585 H GLU 81 H GLU 81 79.338 -1.616 4.432 586 HA GLU 81 HA GLU 81 81.776 -1.046 5.704 587 HB2 GLU 81 HB2 GLU 81 81.250 -2.649 3.201 588 HB3 GLU 81 HB3 GLU 81 82.782 -2.596 4.066 589 HG2 GLU 81 HG2 GLU 81 81.588 -3.441 6.090 590 HG3 GLU 81 HG3 GLU 81 80.160 -3.652 5.092 591 H TRP 82 H TRP 82 80.336 0.002 2.686 592 HA TRP 82 HA TRP 82 82.651 1.234 1.614 593 HB2 TRP 82 HB2 TRP 82 80.617 0.676 0.302 594 HB3 TRP 82 HB3 TRP 82 79.755 1.951 1.147 595 HD1 TRP 82 HD1 TRP 82 82.525 1.433 -1.449 596 HE1 TRP 82 HE1 TRP 82 82.779 3.533 -2.840 597 HE3 TRP 82 HE3 TRP 82 79.407 4.506 1.205 598 HZ2 TRP 82 HZ2 TRP 82 81.770 6.185 -2.861 599 HZ3 TRP 82 HZ3 TRP 82 79.117 6.823 0.428 600 HH2 TRP 82 HH2 TRP 82 80.282 7.650 -1.549 601 H ARG 83 H ARG 83 79.939 2.507 3.530 602 HA ARG 83 HA ARG 83 80.955 5.130 3.441 603 HB2 ARG 83 HB2 ARG 83 78.545 3.943 4.259 604 HB3 ARG 83 HB3 ARG 83 79.231 4.706 5.698 605 HG2 ARG 83 HG2 ARG 83 79.251 6.760 4.829 606 HG3 ARG 83 HG3 ARG 83 79.129 6.229 3.130 607 HD2 ARG 83 HD2 ARG 83 76.788 5.464 3.840 608 HD3 ARG 83 HD3 ARG 83 77.064 6.428 5.298 609 HE ARG 83 HE ARG 83 76.808 7.390 2.547 610 HH11 ARG 83 HH11 ARG 83 77.287 8.280 5.944 611 HH12 ARG 83 HH12 ARG 83 76.964 9.936 5.670 612 HH21 ARG 83 HH21 ARG 83 76.370 9.660 2.222 613 HH22 ARG 83 HH22 ARG 83 76.428 10.722 3.546 614 H ALA 84 H ALA 84 81.180 2.545 5.798 615 HA ALA 84 HA ALA 84 82.493 4.052 7.771 616 HB1 ALA 84 HB1 ALA 84 82.635 1.079 7.288 617 HB2 ALA 84 HB2 ALA 84 81.395 1.897 8.225 618 HB3 ALA 84 HB3 ALA 84 83.073 1.916 8.777 619 H ALA 85 H ALA 85 83.772 1.989 5.135 620 HA ALA 85 HA ALA 85 86.474 2.278 5.856 621 HB1 ALA 85 HB1 ALA 85 85.675 0.513 4.338 622 HB2 ALA 85 HB2 ALA 85 86.995 1.441 3.625 623 HB3 ALA 85 HB3 ALA 85 85.333 1.736 3.114 624 H ASN 86 H ASN 86 84.371 4.170 3.774 625 HA ASN 86 HA ASN 86 86.317 5.922 2.717 626 HB2 ASN 86 HB2 ASN 86 83.941 5.847 1.903 627 HB3 ASN 86 HB3 ASN 86 83.448 6.607 3.410 628 HD21 ASN 86 HD21 ASN 86 84.586 7.142 0.271 629 HD22 ASN 86 HD22 ASN 86 84.844 8.834 0.402 630 H GLY 87 H GLY 87 84.393 6.014 5.649 631 HA2 GLY 87 HA2 GLY 87 85.385 7.010 7.641 632 HA3 GLY 87 HA3 GLY 87 86.071 8.248 6.591 633 H LYS 88 H LYS 88 82.857 7.190 5.837 634 HA LYS 88 HA LYS 88 81.774 9.715 6.637 635 HB2 LYS 88 HB2 LYS 88 81.066 7.444 4.841 636 HB3 LYS 88 HB3 LYS 88 79.956 8.752 5.187 637 HG2 LYS 88 HG2 LYS 88 81.541 10.298 4.115 638 HG3 LYS 88 HG3 LYS 88 82.644 8.950 3.830 639 HD2 LYS 88 HD2 LYS 88 80.882 7.853 2.463 640 HD3 LYS 88 HD3 LYS 88 79.864 9.272 2.676 641 HE2 LYS 88 HE2 LYS 88 82.576 9.217 1.365 642 HE3 LYS 88 HE3 LYS 88 81.067 9.263 0.494 643 HZ1 LYS 88 HZ1 LYS 88 82.152 11.380 2.291 644 HZ2 LYS 88 HZ2 LYS 88 80.634 11.436 1.591 645 HZ3 LYS 88 HZ3 LYS 88 82.008 11.449 0.612 646 HA PRO 89 HA PRO 89 79.503 7.421 9.751 647 HB2 PRO 89 HB2 PRO 89 77.087 8.711 9.736 648 HB3 PRO 89 HB3 PRO 89 78.512 9.379 10.533 649 HG2 PRO 89 HG2 PRO 89 77.320 10.047 7.888 650 HG3 PRO 89 HG3 PRO 89 78.102 11.113 9.063 651 HD2 PRO 89 HD2 PRO 89 79.326 10.212 6.787 652 HD3 PRO 89 HD3 PRO 89 80.208 10.643 8.262 653 H GLY 90 H GLY 90 78.535 5.511 9.607 654 HA2 GLY 90 HA2 GLY 90 77.093 4.879 7.170 655 HA3 GLY 90 HA3 GLY 90 77.658 3.735 8.380 656 H PHE 91 H PHE 91 76.138 2.847 9.498 657 HA PHE 91 HA PHE 91 73.486 4.071 9.583 658 HB2 PHE 91 HB2 PHE 91 74.390 1.289 10.306 659 HB3 PHE 91 HB3 PHE 91 72.725 1.862 10.300 660 HD1 PHE 91 HD1 PHE 91 71.870 2.832 8.116 661 HD2 PHE 91 HD2 PHE 91 75.280 0.333 8.411 662 HE1 PHE 91 HE1 PHE 91 71.681 2.287 5.752 663 HE2 PHE 91 HE2 PHE 91 75.078 -0.202 6.004 664 HZ PHE 91 HZ PHE 91 73.281 0.775 4.701 665 H LYS 92 H LYS 92 72.315 4.194 11.561 666 HA LYS 92 HA LYS 92 73.989 4.577 13.869 667 HB2 LYS 92 HB2 LYS 92 72.067 5.595 14.796 668 HB3 LYS 92 HB3 LYS 92 72.216 6.201 13.185 669 HG2 LYS 92 HG2 LYS 92 70.420 4.846 12.421 670 HG3 LYS 92 HG3 LYS 92 70.424 3.932 13.935 671 HD2 LYS 92 HD2 LYS 92 69.809 6.880 13.752 672 HD3 LYS 92 HD3 LYS 92 68.569 5.628 13.707 673 HE2 LYS 92 HE2 LYS 92 69.410 4.835 15.933 674 HE3 LYS 92 HE3 LYS 92 70.499 6.216 15.945 675 HZ1 LYS 92 HZ1 LYS 92 67.557 6.443 15.756 676 HZ2 LYS 92 HZ2 LYS 92 68.664 7.708 15.968 677 HZ3 LYS 92 HZ3 LYS 92 68.422 6.585 17.184 678 H GLN 93 H GLN 93 72.768 3.791 15.914 679 HA GLN 93 HA GLN 93 72.477 0.961 15.594 680 HB2 GLN 93 HB2 GLN 93 72.813 2.840 17.851 681 HB3 GLN 93 HB3 GLN 93 72.584 1.115 18.102 682 HG2 GLN 93 HG2 GLN 93 74.919 1.450 18.306 683 HG3 GLN 93 HG3 GLN 93 74.709 0.844 16.663 684 HE21 GLN 93 HE21 GLN 93 74.060 4.149 17.741 685 HE22 GLN 93 HE22 GLN 93 75.300 4.866 16.808 686 H GLY 94 H GLY 94 70.594 -0.010 15.994 687 HA2 GLY 94 HA2 GLY 94 68.582 0.605 17.672 688 HA3 GLY 94 HA3 GLY 94 68.193 1.549 16.236 Start of MODEL 7 1 H GLU 2 H GLU 2 60.447 1.955 8.274 2 HA GLU 2 HA GLU 2 58.502 3.662 6.862 3 HB2 GLU 2 HB2 GLU 2 58.954 5.278 8.689 4 HB3 GLU 2 HB3 GLU 2 58.120 3.829 9.225 5 HG2 GLU 2 HG2 GLU 2 60.116 2.957 10.186 6 HG3 GLU 2 HG3 GLU 2 61.085 4.242 9.465 7 H LEU 3 H LEU 3 59.509 5.921 6.712 8 HA LEU 3 HA LEU 3 62.170 5.580 5.561 9 HB2 LEU 3 HB2 LEU 3 59.967 7.499 4.968 10 HB3 LEU 3 HB3 LEU 3 61.587 7.710 4.350 11 HG LEU 3 HG LEU 3 59.792 5.365 3.742 12 HD11 LEU 3 HD11 LEU 3 59.018 7.447 2.684 13 HD12 LEU 3 HD12 LEU 3 59.714 6.373 1.465 14 HD13 LEU 3 HD13 LEU 3 60.638 7.746 2.067 15 HD21 LEU 3 HD21 LEU 3 61.535 4.826 2.094 16 HD22 LEU 3 HD22 LEU 3 62.128 4.787 3.762 17 HD23 LEU 3 HD23 LEU 3 62.512 6.157 2.732 18 H LYS 4 H LYS 4 63.768 6.835 6.175 19 HA LYS 4 HA LYS 4 63.252 8.922 8.153 20 HB2 LYS 4 HB2 LYS 4 65.941 7.891 7.229 21 HB3 LYS 4 HB3 LYS 4 65.584 8.767 8.720 22 HG2 LYS 4 HG2 LYS 4 65.179 5.909 7.964 23 HG3 LYS 4 HG3 LYS 4 66.098 6.546 9.303 24 HD2 LYS 4 HD2 LYS 4 63.738 7.398 10.065 25 HD3 LYS 4 HD3 LYS 4 63.223 6.160 8.920 26 HE2 LYS 4 HE2 LYS 4 64.729 4.504 10.013 27 HE3 LYS 4 HE3 LYS 4 65.094 5.687 11.210 28 HZ1 LYS 4 HZ1 LYS 4 63.185 3.896 11.590 29 HZ2 LYS 4 HZ2 LYS 4 62.229 5.213 11.046 30 HZ3 LYS 4 HZ3 LYS 4 63.259 5.387 12.334 31 H ASN 5 H ASN 5 65.299 10.666 7.579 32 HA ASN 5 HA ASN 5 64.853 11.241 4.741 33 HB2 ASN 5 HB2 ASN 5 65.350 13.219 6.969 34 HB3 ASN 5 HB3 ASN 5 65.415 13.645 5.263 35 HD21 ASN 5 HD21 ASN 5 63.499 13.529 4.033 36 HD22 ASN 5 HD22 ASN 5 61.956 13.577 4.751 37 H SER 6 H SER 6 67.210 10.661 7.132 38 HA SER 6 HA SER 6 69.200 10.806 5.035 39 HB2 SER 6 HB2 SER 6 70.843 11.607 6.736 40 HB3 SER 6 HB3 SER 6 69.623 12.807 6.307 41 HG SER 6 HG SER 6 68.471 12.144 8.197 42 H ILE 7 H ILE 7 71.165 9.515 5.681 43 HA ILE 7 HA ILE 7 70.336 6.869 6.317 44 HB ILE 7 HB ILE 7 72.203 7.495 4.727 45 HG12 ILE 7 HG12 ILE 7 72.976 5.558 6.930 46 HG13 ILE 7 HG13 ILE 7 71.949 5.181 5.560 47 HG21 ILE 7 HG21 ILE 7 73.281 9.211 6.042 48 HG22 ILE 7 HG22 ILE 7 74.431 7.939 5.635 49 HG23 ILE 7 HG23 ILE 7 73.746 8.020 7.256 50 HD11 ILE 7 HD11 ILE 7 74.216 4.340 5.255 51 HD12 ILE 7 HD12 ILE 7 74.849 5.982 5.392 52 HD13 ILE 7 HD13 ILE 7 73.804 5.545 4.040 53 H SER 8 H SER 8 71.097 9.442 8.297 54 HA SER 8 HA SER 8 72.665 8.103 10.247 55 HB2 SER 8 HB2 SER 8 71.337 10.800 10.244 56 HB3 SER 8 HB3 SER 8 72.513 10.253 11.452 57 HG SER 8 HG SER 8 73.933 9.890 9.675 58 H ASP 9 H ASP 9 69.290 8.377 9.678 59 HA ASP 9 HA ASP 9 68.718 7.671 12.491 60 HB2 ASP 9 HB2 ASP 9 67.370 9.483 11.068 61 HB3 ASP 9 HB3 ASP 9 66.626 8.073 10.409 62 H TYR 10 H TYR 10 69.676 6.191 9.907 63 HA TYR 10 HA TYR 10 67.596 4.150 9.787 64 HB2 TYR 10 HB2 TYR 10 69.725 4.994 7.867 65 HB3 TYR 10 HB3 TYR 10 69.280 3.298 7.890 66 HD1 TYR 10 HD1 TYR 10 66.809 2.740 7.531 67 HD2 TYR 10 HD2 TYR 10 68.469 6.541 6.610 68 HE1 TYR 10 HE1 TYR 10 64.907 3.199 6.032 69 HE2 TYR 10 HE2 TYR 10 66.580 7.006 5.102 70 HH TYR 10 HH TYR 10 64.850 5.837 3.892 71 H THR 11 H THR 11 67.964 2.584 11.287 72 HA THR 11 HA THR 11 70.639 1.841 11.958 73 HB THR 11 HB THR 11 69.633 -0.142 13.035 74 HG1 THR 11 HG1 THR 11 67.241 -0.245 12.932 75 HG21 THR 11 HG21 THR 11 69.494 1.866 14.367 76 HG22 THR 11 HG22 THR 11 68.021 0.927 14.595 77 HG23 THR 11 HG23 THR 11 68.010 2.348 13.549 78 H GLU 12 H GLU 12 71.469 -0.313 11.235 79 HA GLU 12 HA GLU 12 71.132 -0.438 8.490 80 HB2 GLU 12 HB2 GLU 12 72.462 -2.607 8.650 81 HB3 GLU 12 HB3 GLU 12 73.224 -1.122 9.189 82 HG2 GLU 12 HG2 GLU 12 72.614 -1.757 11.516 83 HG3 GLU 12 HG3 GLU 12 72.074 -3.313 10.888 84 H ALA 13 H ALA 13 69.471 -2.169 11.011 85 HA ALA 13 HA ALA 13 68.144 -3.928 9.212 86 HB1 ALA 13 HB1 ALA 13 67.231 -3.040 11.954 87 HB2 ALA 13 HB2 ALA 13 68.315 -4.393 11.627 88 HB3 ALA 13 HB3 ALA 13 66.645 -4.443 11.058 89 H GLU 14 H GLU 14 67.244 -0.663 10.474 90 HA GLU 14 HA GLU 14 64.669 -0.407 9.324 91 HB2 GLU 14 HB2 GLU 14 66.875 1.634 9.629 92 HB3 GLU 14 HB3 GLU 14 65.301 2.108 9.059 93 HG2 GLU 14 HG2 GLU 14 66.028 0.967 11.737 94 HG3 GLU 14 HG3 GLU 14 65.601 2.637 11.382 95 H PHE 15 H PHE 15 67.833 0.066 8.114 96 HA PHE 15 HA PHE 15 67.119 1.079 5.601 97 HB2 PHE 15 HB2 PHE 15 69.259 1.451 6.834 98 HB3 PHE 15 HB3 PHE 15 69.693 -0.208 6.462 99 HD1 PHE 15 HD1 PHE 15 70.274 -0.861 4.255 100 HD2 PHE 15 HD2 PHE 15 69.219 3.140 5.153 101 HE1 PHE 15 HE1 PHE 15 71.237 -0.135 2.130 102 HE2 PHE 15 HE2 PHE 15 70.181 3.874 3.016 103 HZ PHE 15 HZ PHE 15 71.185 2.238 1.516 104 H VAL 16 H VAL 16 68.231 -2.166 6.724 105 HA VAL 16 HA VAL 16 68.193 -3.286 4.213 106 HB VAL 16 HB VAL 16 68.135 -5.495 5.126 107 HG11 VAL 16 HG11 VAL 16 70.216 -4.616 5.269 108 HG12 VAL 16 HG12 VAL 16 69.940 -5.516 6.762 109 HG13 VAL 16 HG13 VAL 16 69.852 -3.754 6.762 110 HG21 VAL 16 HG21 VAL 16 67.910 -5.932 7.584 111 HG22 VAL 16 HG22 VAL 16 66.462 -5.608 6.648 112 HG23 VAL 16 HG23 VAL 16 67.119 -4.336 7.680 113 H GLN 17 H GLN 17 65.549 -2.876 6.542 114 HA GLN 17 HA GLN 17 63.555 -4.426 5.358 115 HB2 GLN 17 HB2 GLN 17 63.100 -3.656 7.491 116 HB3 GLN 17 HB3 GLN 17 63.669 -2.030 7.144 117 HG2 GLN 17 HG2 GLN 17 61.328 -1.963 7.450 118 HG3 GLN 17 HG3 GLN 17 61.708 -1.689 5.755 119 HE21 GLN 17 HE21 GLN 17 59.264 -2.453 6.837 120 HE22 GLN 17 HE22 GLN 17 58.799 -3.965 6.121 121 H LEU 18 H LEU 18 64.347 -1.018 4.905 122 HA LEU 18 HA LEU 18 62.286 -0.551 3.058 123 HB2 LEU 18 HB2 LEU 18 63.475 1.156 4.457 124 HB3 LEU 18 HB3 LEU 18 64.877 1.001 3.488 125 HG LEU 18 HG LEU 18 63.484 3.036 3.027 126 HD11 LEU 18 HD11 LEU 18 63.699 2.992 0.628 127 HD12 LEU 18 HD12 LEU 18 63.946 1.246 0.681 128 HD13 LEU 18 HD13 LEU 18 65.123 2.327 1.427 129 HD21 LEU 18 HD21 LEU 18 61.278 2.039 3.206 130 HD22 LEU 18 HD22 LEU 18 61.603 1.029 1.795 131 HD23 LEU 18 HD23 LEU 18 61.494 2.776 1.617 132 H LEU 19 H LEU 19 65.598 -1.347 2.822 133 HA LEU 19 HA LEU 19 66.134 -1.184 0.084 134 HB2 LEU 19 HB2 LEU 19 67.591 -1.547 2.091 135 HB3 LEU 19 HB3 LEU 19 67.126 -3.194 1.990 136 HG LEU 19 HG LEU 19 68.310 -3.643 0.052 137 HD11 LEU 19 HD11 LEU 19 67.534 -1.718 -1.298 138 HD12 LEU 19 HD12 LEU 19 69.287 -1.867 -1.364 139 HD13 LEU 19 HD13 LEU 19 68.545 -0.644 -0.333 140 HD21 LEU 19 HD21 LEU 19 69.663 -3.295 1.990 141 HD22 LEU 19 HD22 LEU 19 69.752 -1.570 1.624 142 HD23 LEU 19 HD23 LEU 19 70.516 -2.736 0.545 143 H LYS 20 H LYS 20 64.957 -3.856 2.009 144 HA LYS 20 HA LYS 20 64.834 -5.804 0.027 145 HB2 LYS 20 HB2 LYS 20 63.332 -5.303 2.505 146 HB3 LYS 20 HB3 LYS 20 63.075 -6.833 1.615 147 HG2 LYS 20 HG2 LYS 20 65.705 -6.965 1.946 148 HG3 LYS 20 HG3 LYS 20 65.398 -5.723 3.094 149 HD2 LYS 20 HD2 LYS 20 63.809 -7.075 4.350 150 HD3 LYS 20 HD3 LYS 20 64.093 -8.429 3.251 151 HE2 LYS 20 HE2 LYS 20 66.431 -8.483 3.879 152 HE3 LYS 20 HE3 LYS 20 66.212 -7.077 4.913 153 HZ1 LYS 20 HZ1 LYS 20 65.028 -9.783 5.334 154 HZ2 LYS 20 HZ2 LYS 20 64.696 -8.425 6.276 155 HZ3 LYS 20 HZ3 LYS 20 66.253 -9.034 6.229 156 H GLU 21 H GLU 21 62.610 -3.297 1.003 157 HA GLU 21 HA GLU 21 60.451 -4.065 -0.632 158 HB2 GLU 21 HB2 GLU 21 61.207 -1.374 0.503 159 HB3 GLU 21 HB3 GLU 21 59.677 -1.701 -0.295 160 HG2 GLU 21 HG2 GLU 21 60.687 -2.981 2.232 161 HG3 GLU 21 HG3 GLU 21 59.414 -1.762 2.105 162 H ILE 22 H ILE 22 63.200 -1.959 -1.083 163 HA ILE 22 HA ILE 22 62.527 -0.856 -3.561 164 HB ILE 22 HB ILE 22 65.370 -1.583 -2.821 165 HG12 ILE 22 HG12 ILE 22 63.701 0.758 -1.863 166 HG13 ILE 22 HG13 ILE 22 64.423 -0.494 -0.900 167 HG21 ILE 22 HG21 ILE 22 65.062 -0.748 -5.063 168 HG22 ILE 22 HG22 ILE 22 65.785 0.536 -4.069 169 HG23 ILE 22 HG23 ILE 22 64.077 0.581 -4.463 170 HD11 ILE 22 HD11 ILE 22 65.719 1.552 -0.733 171 HD12 ILE 22 HD12 ILE 22 65.968 1.544 -2.477 172 HD13 ILE 22 HD13 ILE 22 66.665 0.267 -1.487 173 H GLU 23 H GLU 23 64.217 -3.824 -2.781 174 HA GLU 23 HA GLU 23 64.813 -4.741 -5.346 175 HB2 GLU 23 HB2 GLU 23 63.964 -6.237 -2.912 176 HB3 GLU 23 HB3 GLU 23 64.588 -7.029 -4.332 177 HG2 GLU 23 HG2 GLU 23 66.710 -5.664 -3.956 178 HG3 GLU 23 HG3 GLU 23 65.976 -5.168 -2.424 179 H LYS 24 H LYS 24 61.911 -5.073 -3.407 180 HA LYS 24 HA LYS 24 60.617 -6.878 -5.136 181 HB2 LYS 24 HB2 LYS 24 60.173 -6.624 -2.753 182 HB3 LYS 24 HB3 LYS 24 59.418 -5.060 -3.085 183 HG2 LYS 24 HG2 LYS 24 57.669 -6.734 -2.826 184 HG3 LYS 24 HG3 LYS 24 57.738 -6.191 -4.499 185 HD2 LYS 24 HD2 LYS 24 59.042 -8.195 -5.093 186 HD3 LYS 24 HD3 LYS 24 58.953 -8.734 -3.414 187 HE2 LYS 24 HE2 LYS 24 56.523 -8.844 -3.584 188 HE3 LYS 24 HE3 LYS 24 56.610 -8.279 -5.250 189 HZ1 LYS 24 HZ1 LYS 24 57.692 -10.854 -4.208 190 HZ2 LYS 24 HZ2 LYS 24 57.913 -10.284 -5.775 191 HZ3 LYS 24 HZ3 LYS 24 56.382 -10.641 -5.251 192 H GLU 25 H GLU 25 60.263 -3.329 -4.633 193 HA GLU 25 HA GLU 25 58.388 -3.092 -6.686 194 HB2 GLU 25 HB2 GLU 25 60.103 -0.829 -5.479 195 HB3 GLU 25 HB3 GLU 25 58.878 -0.740 -6.619 196 HG2 GLU 25 HG2 GLU 25 58.096 -0.172 -4.360 197 HG3 GLU 25 HG3 GLU 25 57.103 -1.283 -5.289 198 H ASN 26 H ASN 26 61.776 -3.474 -6.754 199 HA ASN 26 HA ASN 26 62.036 -2.290 -9.375 200 HB2 ASN 26 HB2 ASN 26 63.925 -2.203 -7.745 201 HB3 ASN 26 HB3 ASN 26 64.078 -3.952 -7.887 202 HD21 ASN 26 HD21 ASN 26 63.363 -1.684 -10.540 203 HD22 ASN 26 HD22 ASN 26 64.803 -2.008 -11.401 204 H VAL 27 H VAL 27 62.118 -5.584 -8.022 205 HA VAL 27 HA VAL 27 62.602 -6.818 -10.510 206 HB VAL 27 HB VAL 27 61.920 -8.963 -9.466 207 HG11 VAL 27 HG11 VAL 27 64.194 -8.182 -9.216 208 HG12 VAL 27 HG12 VAL 27 63.668 -9.020 -7.755 209 HG13 VAL 27 HG13 VAL 27 63.741 -7.259 -7.780 210 HG21 VAL 27 HG21 VAL 27 60.114 -8.190 -8.035 211 HG22 VAL 27 HG22 VAL 27 61.259 -7.245 -7.082 212 HG23 VAL 27 HG23 VAL 27 61.341 -9.006 -7.060 213 H ALA 28 H ALA 28 59.603 -5.909 -8.982 214 HA ALA 28 HA ALA 28 58.047 -7.191 -11.076 215 HB1 ALA 28 HB1 ALA 28 57.158 -7.127 -8.791 216 HB2 ALA 28 HB2 ALA 28 56.101 -6.256 -9.903 217 HB3 ALA 28 HB3 ALA 28 57.178 -5.361 -8.831 218 H ALA 29 H ALA 29 59.830 -4.520 -10.770 219 HA ALA 29 HA ALA 29 60.092 -2.532 -11.665 220 HB1 ALA 29 HB1 ALA 29 58.713 -3.732 -14.051 221 HB2 ALA 29 HB2 ALA 29 60.428 -3.902 -13.649 222 HB3 ALA 29 HB3 ALA 29 59.758 -2.311 -14.027 223 H THR 30 H THR 30 58.831 -1.540 -10.192 224 HA THR 30 HA THR 30 56.228 -0.617 -11.079 225 HB THR 30 HB THR 30 56.167 0.523 -8.843 226 HG1 THR 30 HG1 THR 30 58.638 -0.810 -8.429 227 HG21 THR 30 HG21 THR 30 56.983 -2.364 -8.761 228 HG22 THR 30 HG22 THR 30 55.332 -1.753 -8.975 229 HG23 THR 30 HG23 THR 30 56.189 -1.500 -7.449 230 H ASP 31 H ASP 31 56.382 2.073 -10.056 231 HA ASP 31 HA ASP 31 58.556 3.123 -11.685 232 HB2 ASP 31 HB2 ASP 31 56.593 3.056 -13.128 233 HB3 ASP 31 HB3 ASP 31 55.714 3.962 -11.893 234 H ASP 32 H ASP 32 55.850 4.576 -9.925 235 HA ASP 32 HA ASP 32 57.335 6.858 -9.246 236 HB2 ASP 32 HB2 ASP 32 54.868 6.822 -9.182 237 HB3 ASP 32 HB3 ASP 32 54.950 5.748 -7.787 238 H VAL 33 H VAL 33 56.535 4.032 -7.378 239 HA VAL 33 HA VAL 33 57.911 5.043 -5.059 240 HB VAL 33 HB VAL 33 55.993 3.583 -4.768 241 HG11 VAL 33 HG11 VAL 33 56.204 2.126 -6.629 242 HG12 VAL 33 HG12 VAL 33 56.137 1.172 -5.135 243 HG13 VAL 33 HG13 VAL 33 57.681 1.441 -5.954 244 HG21 VAL 33 HG21 VAL 33 56.883 2.069 -3.044 245 HG22 VAL 33 HG22 VAL 33 57.572 3.691 -2.943 246 HG23 VAL 33 HG23 VAL 33 58.509 2.377 -3.654 247 H LEU 34 H LEU 34 58.608 2.871 -7.591 248 HA LEU 34 HA LEU 34 61.083 1.774 -6.736 249 HB2 LEU 34 HB2 LEU 34 59.592 1.093 -8.729 250 HB3 LEU 34 HB3 LEU 34 60.107 2.559 -9.427 251 HG LEU 34 HG LEU 34 61.190 0.332 -10.184 252 HD11 LEU 34 HD11 LEU 34 63.149 1.546 -10.879 253 HD12 LEU 34 HD12 LEU 34 62.716 2.853 -9.761 254 HD13 LEU 34 HD13 LEU 34 61.645 2.446 -11.109 255 HD21 LEU 34 HD21 LEU 34 62.933 1.098 -7.848 256 HD22 LEU 34 HD22 LEU 34 63.328 -0.097 -9.083 257 HD23 LEU 34 HD23 LEU 34 61.971 -0.372 -7.989 258 H ASP 35 H ASP 35 60.361 4.708 -8.601 259 HA ASP 35 HA ASP 35 63.072 5.533 -8.645 260 HB2 ASP 35 HB2 ASP 35 61.432 6.488 -10.217 261 HB3 ASP 35 HB3 ASP 35 60.606 7.259 -8.873 262 H VAL 36 H VAL 36 60.519 6.208 -6.414 263 HA VAL 36 HA VAL 36 61.801 8.094 -4.769 264 HB VAL 36 HB VAL 36 60.068 5.759 -3.935 265 HG11 VAL 36 HG11 VAL 36 61.321 6.609 -2.166 266 HG12 VAL 36 HG12 VAL 36 59.591 7.036 -1.975 267 HG13 VAL 36 HG13 VAL 36 60.790 8.263 -2.517 268 HG21 VAL 36 HG21 VAL 36 59.411 8.571 -4.500 269 HG22 VAL 36 HG22 VAL 36 58.374 7.297 -3.766 270 HG23 VAL 36 HG23 VAL 36 58.998 7.097 -5.438 271 H LEU 37 H LEU 37 61.761 4.650 -4.687 272 HA LEU 37 HA LEU 37 63.299 4.484 -2.372 273 HB2 LEU 37 HB2 LEU 37 62.923 2.377 -4.431 274 HB3 LEU 37 HB3 LEU 37 63.438 2.334 -2.760 275 HG LEU 37 HG LEU 37 60.644 3.166 -3.474 276 HD11 LEU 37 HD11 LEU 37 60.963 0.816 -4.050 277 HD12 LEU 37 HD12 LEU 37 59.898 1.010 -2.657 278 HD13 LEU 37 HD13 LEU 37 61.568 0.508 -2.418 279 HD21 LEU 37 HD21 LEU 37 60.230 2.851 -1.074 280 HD22 LEU 37 HD22 LEU 37 61.459 4.080 -1.367 281 HD23 LEU 37 HD23 LEU 37 61.935 2.465 -0.837 282 H LEU 38 H LEU 38 64.019 4.119 -5.751 283 HA LEU 38 HA LEU 38 66.691 3.322 -5.427 284 HB2 LEU 38 HB2 LEU 38 65.261 4.723 -7.639 285 HB3 LEU 38 HB3 LEU 38 66.927 4.153 -7.821 286 HG LEU 38 HG LEU 38 64.311 2.711 -7.685 287 HD11 LEU 38 HD11 LEU 38 65.115 1.699 -9.711 288 HD12 LEU 38 HD12 LEU 38 66.645 2.540 -9.472 289 HD13 LEU 38 HD13 LEU 38 65.180 3.477 -9.809 290 HD21 LEU 38 HD21 LEU 38 67.006 1.406 -7.326 291 HD22 LEU 38 HD22 LEU 38 65.478 0.574 -7.604 292 HD23 LEU 38 HD23 LEU 38 65.716 1.501 -6.126 293 H GLU 39 H GLU 39 65.273 6.497 -5.881 294 HA GLU 39 HA GLU 39 67.785 7.789 -5.849 295 HB2 GLU 39 HB2 GLU 39 64.987 8.701 -5.443 296 HB3 GLU 39 HB3 GLU 39 66.382 9.758 -5.422 297 HG2 GLU 39 HG2 GLU 39 65.430 8.061 -7.735 298 HG3 GLU 39 HG3 GLU 39 65.235 9.806 -7.525 299 H HIS 40 H HIS 40 65.302 7.176 -3.425 300 HA HIS 40 HA HIS 40 66.328 8.826 -1.459 301 HB2 HIS 40 HB2 HIS 40 64.090 7.857 -1.375 302 HB3 HIS 40 HB3 HIS 40 64.723 6.262 -1.169 303 HD1 HIS 40 HD1 HIS 40 63.584 9.142 0.781 304 HD2 HIS 40 HD2 HIS 40 66.087 5.888 1.388 305 HE1 HIS 40 HE1 HIS 40 63.932 8.960 3.264 306 H PHE 41 H PHE 41 66.819 5.467 -2.161 307 HA PHE 41 HA PHE 41 68.452 4.743 -0.056 308 HB2 PHE 41 HB2 PHE 41 67.420 3.117 -1.320 309 HB3 PHE 41 HB3 PHE 41 67.966 3.811 -2.833 310 HD1 PHE 41 HD1 PHE 41 69.009 1.982 0.180 311 HD2 PHE 41 HD2 PHE 41 69.950 3.034 -3.810 312 HE1 PHE 41 HE1 PHE 41 70.863 0.369 0.190 313 HE2 PHE 41 HE2 PHE 41 71.799 1.451 -3.783 314 HZ PHE 41 HZ PHE 41 72.262 0.111 -1.798 315 H VAL 42 H VAL 42 69.361 5.771 -3.325 316 HA VAL 42 HA VAL 42 72.131 5.780 -2.693 317 HB VAL 42 HB VAL 42 71.269 5.421 -4.971 318 HG11 VAL 42 HG11 VAL 42 70.584 8.256 -4.955 319 HG12 VAL 42 HG12 VAL 42 69.543 6.805 -4.990 320 HG13 VAL 42 HG13 VAL 42 70.635 7.140 -6.357 321 HG21 VAL 42 HG21 VAL 42 73.623 6.074 -4.668 322 HG22 VAL 42 HG22 VAL 42 73.149 7.765 -4.794 323 HG23 VAL 42 HG23 VAL 42 72.957 6.694 -6.178 324 H LYS 43 H LYS 43 69.746 8.254 -2.458 325 HA LYS 43 HA LYS 43 71.670 10.362 -2.152 326 HB2 LYS 43 HB2 LYS 43 69.929 11.818 -1.589 327 HB3 LYS 43 HB3 LYS 43 69.154 10.670 -2.656 328 HG2 LYS 43 HG2 LYS 43 68.241 9.527 -0.520 329 HG3 LYS 43 HG3 LYS 43 68.929 10.885 0.334 330 HD2 LYS 43 HD2 LYS 43 67.595 12.466 -0.984 331 HD3 LYS 43 HD3 LYS 43 66.848 11.118 -1.832 332 HE2 LYS 43 HE2 LYS 43 65.917 10.295 0.281 333 HE3 LYS 43 HE3 LYS 43 66.682 11.627 1.142 334 HZ1 LYS 43 HZ1 LYS 43 65.318 13.178 -0.154 335 HZ2 LYS 43 HZ2 LYS 43 64.332 12.097 0.673 336 HZ3 LYS 43 HZ3 LYS 43 64.597 11.893 -0.959 337 H ILE 44 H ILE 44 70.131 8.264 0.177 338 HA ILE 44 HA ILE 44 71.381 9.626 2.361 339 HB ILE 44 HB ILE 44 70.488 7.766 3.773 340 HG12 ILE 44 HG12 ILE 44 69.358 6.777 1.157 341 HG13 ILE 44 HG13 ILE 44 70.631 5.969 2.042 342 HG21 ILE 44 HG21 ILE 44 69.173 9.769 3.315 343 HG22 ILE 44 HG22 ILE 44 68.145 8.346 3.488 344 HG23 ILE 44 HG23 ILE 44 68.490 8.996 1.885 345 HD11 ILE 44 HD11 ILE 44 69.050 5.585 3.889 346 HD12 ILE 44 HD12 ILE 44 68.460 4.904 2.367 347 HD13 ILE 44 HD13 ILE 44 67.806 6.424 2.970 348 H THR 45 H THR 45 72.205 6.895 0.337 349 HA THR 45 HA THR 45 74.341 6.085 2.104 350 HB THR 45 HB THR 45 74.924 4.488 0.266 351 HG1 THR 45 HG1 THR 45 72.474 5.082 -0.934 352 HG21 THR 45 HG21 THR 45 72.055 4.502 1.175 353 HG22 THR 45 HG22 THR 45 73.421 3.829 2.070 354 HG23 THR 45 HG23 THR 45 72.922 3.114 0.530 355 H GLU 46 H GLU 46 74.013 7.817 -0.956 356 HA GLU 46 HA GLU 46 75.360 9.049 -2.186 357 HB2 GLU 46 HB2 GLU 46 76.566 9.245 0.467 358 HB3 GLU 46 HB3 GLU 46 77.621 9.754 -0.866 359 HG2 GLU 46 HG2 GLU 46 74.826 10.707 -0.534 360 HG3 GLU 46 HG3 GLU 46 76.161 11.512 0.321 361 H HIS 47 H HIS 47 75.608 6.148 -1.914 362 HA HIS 47 HA HIS 47 78.325 5.587 -2.628 363 HB2 HIS 47 HB2 HIS 47 76.739 3.956 -1.430 364 HB3 HIS 47 HB3 HIS 47 75.919 3.760 -2.973 365 HD1 HIS 47 HD1 HIS 47 77.034 2.111 -4.669 366 HD2 HIS 47 HD2 HIS 47 79.350 2.937 -1.329 367 HE1 HIS 47 HE1 HIS 47 79.067 0.647 -4.836 368 HA PRO 48 HA PRO 48 77.618 6.942 -6.870 369 HB2 PRO 48 HB2 PRO 48 79.782 5.132 -7.602 370 HB3 PRO 48 HB3 PRO 48 79.675 6.885 -7.777 371 HG2 PRO 48 HG2 PRO 48 81.228 5.598 -6.084 372 HG3 PRO 48 HG3 PRO 48 80.501 7.161 -5.571 373 HD2 PRO 48 HD2 PRO 48 79.757 4.323 -4.939 374 HD3 PRO 48 HD3 PRO 48 79.773 5.721 -3.854 375 H ASP 49 H ASP 49 77.125 3.909 -5.857 376 HA ASP 49 HA ASP 49 76.548 3.081 -8.474 377 HB2 ASP 49 HB2 ASP 49 77.825 1.357 -6.346 378 HB3 ASP 49 HB3 ASP 49 77.086 0.648 -7.756 379 H GLY 50 H GLY 50 75.093 4.281 -6.269 380 HA2 GLY 50 HA2 GLY 50 73.678 2.823 -4.349 381 HA3 GLY 50 HA3 GLY 50 73.052 4.172 -5.265 382 H THR 51 H THR 51 72.565 3.417 -7.526 383 HA THR 51 HA THR 51 70.376 1.714 -6.894 384 HB THR 51 HB THR 51 70.856 2.433 -9.741 385 HG1 THR 51 HG1 THR 51 69.820 4.575 -8.798 386 HG21 THR 51 HG21 THR 51 68.473 2.879 -9.572 387 HG22 THR 51 HG22 THR 51 68.514 2.673 -7.827 388 HG23 THR 51 HG23 THR 51 68.797 1.295 -8.864 389 H ALA 52 H ALA 52 73.426 1.315 -8.466 390 HA ALA 52 HA ALA 52 72.986 -1.268 -9.670 391 HB1 ALA 52 HB1 ALA 52 75.562 -0.026 -8.756 392 HB2 ALA 52 HB2 ALA 52 74.822 0.272 -10.327 393 HB3 ALA 52 HB3 ALA 52 75.368 -1.350 -9.905 394 H LEU 53 H LEU 53 73.851 -0.246 -6.479 395 HA LEU 53 HA LEU 53 74.581 -2.770 -5.446 396 HB2 LEU 53 HB2 LEU 53 73.119 -0.514 -4.091 397 HB3 LEU 53 HB3 LEU 53 73.834 -1.881 -3.269 398 HG LEU 53 HG LEU 53 75.340 0.208 -4.834 399 HD11 LEU 53 HD11 LEU 53 75.110 -0.298 -1.884 400 HD12 LEU 53 HD12 LEU 53 74.407 1.060 -2.767 401 HD13 LEU 53 HD13 LEU 53 76.159 0.896 -2.646 402 HD21 LEU 53 HD21 LEU 53 77.337 -0.862 -3.880 403 HD22 LEU 53 HD22 LEU 53 76.453 -1.958 -4.937 404 HD23 LEU 53 HD23 LEU 53 76.318 -2.123 -3.184 405 H ILE 54 H ILE 54 71.511 -1.240 -5.920 406 HA ILE 54 HA ILE 54 69.938 -3.275 -4.629 407 HB ILE 54 HB ILE 54 69.200 -1.117 -6.622 408 HG12 ILE 54 HG12 ILE 54 68.315 -1.312 -3.790 409 HG13 ILE 54 HG13 ILE 54 69.902 -0.657 -4.111 410 HG21 ILE 54 HG21 ILE 54 66.844 -1.592 -6.111 411 HG22 ILE 54 HG22 ILE 54 67.329 -2.973 -5.126 412 HG23 ILE 54 HG23 ILE 54 67.617 -2.989 -6.865 413 HD11 ILE 54 HD11 ILE 54 67.316 0.335 -5.240 414 HD12 ILE 54 HD12 ILE 54 68.913 1.058 -5.483 415 HD13 ILE 54 HD13 ILE 54 68.186 1.037 -3.873 416 H TYR 55 H TYR 55 70.769 -2.494 -7.920 417 HA TYR 55 HA TYR 55 69.454 -4.553 -9.236 418 HB2 TYR 55 HB2 TYR 55 71.894 -2.965 -9.866 419 HB3 TYR 55 HB3 TYR 55 71.342 -4.207 -10.953 420 HD1 TYR 55 HD1 TYR 55 68.555 -3.904 -11.283 421 HD2 TYR 55 HD2 TYR 55 71.379 -0.816 -10.539 422 HE1 TYR 55 HE1 TYR 55 67.036 -2.253 -12.279 423 HE2 TYR 55 HE2 TYR 55 69.882 0.817 -11.527 424 HH TYR 55 HH TYR 55 66.621 0.157 -12.243 425 H GLU 56 H GLU 56 72.837 -4.458 -8.057 426 HA GLU 56 HA GLU 56 73.269 -7.117 -8.851 427 HB2 GLU 56 HB2 GLU 56 75.372 -7.050 -7.479 428 HB3 GLU 56 HB3 GLU 56 75.240 -5.792 -8.693 429 HG2 GLU 56 HG2 GLU 56 74.789 -4.159 -7.110 430 HG3 GLU 56 HG3 GLU 56 74.598 -5.273 -5.787 431 H ALA 57 H ALA 57 72.169 -5.743 -5.831 432 HA ALA 57 HA ALA 57 72.408 -8.065 -4.281 433 HB1 ALA 57 HB1 ALA 57 70.724 -7.094 -2.820 434 HB2 ALA 57 HB2 ALA 57 70.292 -5.928 -4.074 435 HB3 ALA 57 HB3 ALA 57 71.893 -5.878 -3.325 436 H ALA 58 H ALA 58 69.689 -6.871 -6.199 437 HA ALA 58 HA ALA 58 67.929 -8.963 -5.680 438 HB1 ALA 58 HB1 ALA 58 66.691 -8.194 -7.638 439 HB2 ALA 58 HB2 ALA 58 68.083 -7.240 -8.151 440 HB3 ALA 58 HB3 ALA 58 67.234 -6.831 -6.660 441 H ALA 59 H ALA 59 70.341 -8.585 -8.219 442 HA ALA 59 HA ALA 59 69.653 -10.985 -9.578 443 HB1 ALA 59 HB1 ALA 59 71.693 -10.620 -10.859 444 HB2 ALA 59 HB2 ALA 59 72.215 -9.400 -9.700 445 HB3 ALA 59 HB3 ALA 59 70.788 -9.114 -10.695 446 H ARG 60 H ARG 60 72.147 -10.153 -7.223 447 HA ARG 60 HA ARG 60 73.409 -12.668 -7.307 448 HB2 ARG 60 HB2 ARG 60 73.561 -10.439 -5.286 449 HB3 ARG 60 HB3 ARG 60 74.531 -11.907 -5.170 450 HG2 ARG 60 HG2 ARG 60 75.696 -11.428 -7.155 451 HG3 ARG 60 HG3 ARG 60 74.527 -10.196 -7.629 452 HD2 ARG 60 HD2 ARG 60 76.579 -9.161 -6.879 453 HD3 ARG 60 HD3 ARG 60 75.271 -8.793 -5.765 454 HE ARG 60 HE ARG 60 76.879 -11.058 -5.024 455 HH11 ARG 60 HH11 ARG 60 76.605 -7.496 -4.792 456 HH12 ARG 60 HH12 ARG 60 77.517 -7.442 -3.374 457 HH21 ARG 60 HH21 ARG 60 78.130 -10.873 -3.069 458 HH22 ARG 60 HH22 ARG 60 78.386 -9.342 -2.377 459 H ALA 61 H ALA 61 70.965 -11.345 -5.102 460 HA ALA 61 HA ALA 61 70.942 -13.638 -3.414 461 HB1 ALA 61 HB1 ALA 61 68.875 -12.699 -2.484 462 HB2 ALA 61 HB2 ALA 61 68.828 -11.517 -3.800 463 HB3 ALA 61 HB3 ALA 61 70.151 -11.496 -2.630 464 H ALA 62 H ALA 62 69.503 -12.968 -6.455 465 HA ALA 62 HA ALA 62 67.428 -14.852 -6.404 466 HB1 ALA 62 HB1 ALA 62 67.520 -14.746 -8.849 467 HB2 ALA 62 HB2 ALA 62 69.072 -13.914 -8.754 468 HB3 ALA 62 HB3 ALA 62 67.617 -13.134 -8.138 469 H ALA 63 H ALA 63 70.831 -15.098 -7.237 470 HA ALA 63 HA ALA 63 70.598 -17.960 -7.750 471 HB1 ALA 63 HB1 ALA 63 72.031 -16.618 -9.202 472 HB2 ALA 63 HB2 ALA 63 72.974 -17.834 -8.339 473 HB3 ALA 63 HB3 ALA 63 73.011 -16.150 -7.816 474 H ASN 64 H ASN 64 71.825 -15.742 -5.387 475 HA ASN 64 HA ASN 64 72.539 -15.847 -3.327 476 HB2 ASN 64 HB2 ASN 64 70.548 -17.028 -2.677 477 HB3 ASN 64 HB3 ASN 64 71.193 -18.557 -3.263 478 HD21 ASN 64 HD21 ASN 64 71.417 -16.139 -0.739 479 HD22 ASN 64 HD22 ASN 64 72.235 -17.124 0.406 480 HA PRO 65 HA PRO 65 76.393 -18.032 -3.881 481 HB2 PRO 65 HB2 PRO 65 77.821 -15.581 -3.775 482 HB3 PRO 65 HB3 PRO 65 77.486 -16.519 -5.224 483 HG2 PRO 65 HG2 PRO 65 76.432 -13.978 -4.683 484 HG3 PRO 65 HG3 PRO 65 75.808 -15.121 -5.878 485 HD2 PRO 65 HD2 PRO 65 74.856 -14.590 -3.092 486 HD3 PRO 65 HD3 PRO 65 73.921 -14.929 -4.570 487 H GLY 66 H GLY 66 76.656 -18.893 -1.915 488 HA2 GLY 66 HA2 GLY 66 76.217 -17.740 0.557 489 HA3 GLY 66 HA3 GLY 66 77.201 -19.165 0.278 490 H GLY 67 H GLY 67 77.179 -16.090 1.435 491 HA2 GLY 67 HA2 GLY 67 79.701 -15.910 2.361 492 HA3 GLY 67 HA3 GLY 67 79.816 -15.252 0.724 493 H ASP 68 H ASP 68 79.475 -13.142 0.558 494 HA ASP 68 HA ASP 68 77.573 -11.922 2.432 495 HB2 ASP 68 HB2 ASP 68 80.190 -10.725 1.492 496 HB3 ASP 68 HB3 ASP 68 78.965 -9.858 2.401 497 H GLY 69 H GLY 69 76.465 -10.127 1.564 498 HA2 GLY 69 HA2 GLY 69 75.797 -8.680 -0.190 499 HA3 GLY 69 HA3 GLY 69 76.867 -9.567 -1.259 500 H GLY 70 H GLY 70 74.635 -11.247 0.790 501 HA2 GLY 70 HA2 GLY 70 73.397 -12.412 -1.564 502 HA3 GLY 70 HA3 GLY 70 73.124 -12.894 0.098 503 H GLY 71 H GLY 71 72.751 -9.903 -1.665 504 HA2 GLY 71 HA2 GLY 71 70.692 -9.280 -2.351 505 HA3 GLY 71 HA3 GLY 71 69.981 -10.043 -0.943 506 HA PRO 72 HA PRO 72 69.764 -5.651 0.058 507 HB2 PRO 72 HB2 PRO 72 68.077 -6.126 2.202 508 HB3 PRO 72 HB3 PRO 72 67.570 -5.841 0.538 509 HG2 PRO 72 HG2 PRO 72 67.696 -8.374 2.056 510 HG3 PRO 72 HG3 PRO 72 66.693 -7.940 0.666 511 HD2 PRO 72 HD2 PRO 72 68.901 -9.558 0.633 512 HD3 PRO 72 HD3 PRO 72 68.232 -8.808 -0.811 513 H GLU 73 H GLU 73 70.014 -8.102 2.598 514 HA GLU 73 HA GLU 73 71.307 -6.288 4.427 515 HB2 GLU 73 HB2 GLU 73 71.040 -9.286 4.673 516 HB3 GLU 73 HB3 GLU 73 71.244 -8.101 5.954 517 HG2 GLU 73 HG2 GLU 73 69.047 -7.208 5.526 518 HG3 GLU 73 HG3 GLU 73 68.817 -8.339 4.194 519 H GLY 74 H GLY 74 72.429 -7.746 1.737 520 HA2 GLY 74 HA2 GLY 74 74.977 -7.883 3.054 521 HA3 GLY 74 HA3 GLY 74 74.692 -8.747 1.489 522 H ILE 75 H ILE 75 73.441 -6.344 0.326 523 HA ILE 75 HA ILE 75 75.719 -4.858 -0.418 524 HB ILE 75 HB ILE 75 73.977 -3.024 -0.983 525 HG12 ILE 75 HG12 ILE 75 72.178 -5.424 -0.677 526 HG13 ILE 75 HG13 ILE 75 72.259 -4.025 0.392 527 HG21 ILE 75 HG21 ILE 75 75.177 -4.172 -2.585 528 HG22 ILE 75 HG22 ILE 75 73.480 -4.108 -3.081 529 HG23 ILE 75 HG23 ILE 75 74.166 -5.624 -2.445 530 HD11 ILE 75 HD11 ILE 75 71.453 -3.922 -2.499 531 HD12 ILE 75 HD12 ILE 75 71.455 -2.617 -1.269 532 HD13 ILE 75 HD13 ILE 75 70.386 -4.005 -1.079 533 H VAL 76 H VAL 76 73.482 -4.483 2.274 534 HA VAL 76 HA VAL 76 74.103 -1.934 2.912 535 HB VAL 76 HB VAL 76 73.423 -2.587 5.090 536 HG11 VAL 76 HG11 VAL 76 71.589 -3.631 3.016 537 HG12 VAL 76 HG12 VAL 76 71.835 -1.943 3.424 538 HG13 VAL 76 HG13 VAL 76 71.131 -3.032 4.617 539 HG21 VAL 76 HG21 VAL 76 72.527 -4.782 5.583 540 HG22 VAL 76 HG22 VAL 76 74.277 -4.739 5.344 541 HG23 VAL 76 HG23 VAL 76 73.225 -5.345 4.060 542 H LYS 77 H LYS 77 75.719 -4.891 3.609 543 HA LYS 77 HA LYS 77 77.721 -3.892 5.319 544 HB2 LYS 77 HB2 LYS 77 77.259 -6.310 5.071 545 HB3 LYS 77 HB3 LYS 77 77.864 -6.229 3.422 546 HG2 LYS 77 HG2 LYS 77 80.087 -5.799 4.171 547 HG3 LYS 77 HG3 LYS 77 79.539 -5.607 5.834 548 HD2 LYS 77 HD2 LYS 77 78.864 -7.954 5.896 549 HD3 LYS 77 HD3 LYS 77 79.368 -8.147 4.220 550 HE2 LYS 77 HE2 LYS 77 81.657 -7.761 4.787 551 HE3 LYS 77 HE3 LYS 77 81.214 -7.278 6.424 552 HZ1 LYS 77 HZ1 LYS 77 80.649 -9.982 5.369 553 HZ2 LYS 77 HZ2 LYS 77 80.649 -9.469 6.979 554 HZ3 LYS 77 HZ3 LYS 77 82.099 -9.617 6.140 555 H GLU 78 H GLU 78 77.560 -4.310 1.839 556 HA GLU 78 HA GLU 78 80.085 -3.367 1.052 557 HB2 GLU 78 HB2 GLU 78 78.569 -4.435 -0.543 558 HB3 GLU 78 HB3 GLU 78 77.347 -3.207 -0.354 559 HG2 GLU 78 HG2 GLU 78 78.323 -2.800 -2.391 560 HG3 GLU 78 HG3 GLU 78 79.009 -1.592 -1.306 561 H ILE 79 H ILE 79 77.074 -1.719 1.683 562 HA ILE 79 HA ILE 79 77.892 0.821 0.987 563 HB ILE 79 HB ILE 79 75.688 -0.037 2.861 564 HG12 ILE 79 HG12 ILE 79 75.596 0.816 -0.045 565 HG13 ILE 79 HG13 ILE 79 75.527 -0.837 0.539 566 HG21 ILE 79 HG21 ILE 79 76.268 2.267 3.341 567 HG22 ILE 79 HG22 ILE 79 74.708 2.175 2.525 568 HG23 ILE 79 HG23 ILE 79 76.145 2.682 1.626 569 HD11 ILE 79 HD11 ILE 79 73.344 0.025 -0.056 570 HD12 ILE 79 HD12 ILE 79 73.522 1.307 1.140 571 HD13 ILE 79 HD13 ILE 79 73.434 -0.373 1.658 572 H LYS 80 H LYS 80 77.708 -0.840 4.140 573 HA LYS 80 HA LYS 80 78.358 1.416 5.682 574 HB2 LYS 80 HB2 LYS 80 78.528 -0.066 7.612 575 HB3 LYS 80 HB3 LYS 80 77.164 -0.552 6.624 576 HG2 LYS 80 HG2 LYS 80 78.745 -2.286 5.635 577 HG3 LYS 80 HG3 LYS 80 79.786 -1.918 6.996 578 HD2 LYS 80 HD2 LYS 80 76.905 -2.832 7.262 579 HD3 LYS 80 HD3 LYS 80 78.306 -3.876 7.453 580 HE2 LYS 80 HE2 LYS 80 79.052 -2.464 9.339 581 HE3 LYS 80 HE3 LYS 80 77.601 -1.483 9.142 582 HZ1 LYS 80 HZ1 LYS 80 77.429 -3.175 10.911 583 HZ2 LYS 80 HZ2 LYS 80 77.591 -4.395 9.801 584 HZ3 LYS 80 HZ3 LYS 80 76.228 -3.407 9.768 585 H GLU 81 H GLU 81 80.399 -1.073 4.245 586 HA GLU 81 HA GLU 81 82.688 -0.155 5.626 587 HB2 GLU 81 HB2 GLU 81 82.565 -1.756 3.076 588 HB3 GLU 81 HB3 GLU 81 84.020 -1.481 4.024 589 HG2 GLU 81 HG2 GLU 81 82.786 -2.600 5.937 590 HG3 GLU 81 HG3 GLU 81 81.597 -3.094 4.736 591 H TRP 82 H TRP 82 81.268 0.653 2.546 592 HA TRP 82 HA TRP 82 83.401 2.174 1.443 593 HB2 TRP 82 HB2 TRP 82 81.224 1.343 0.307 594 HB3 TRP 82 HB3 TRP 82 80.519 2.750 1.141 595 HD1 TRP 82 HD1 TRP 82 83.170 2.023 -1.594 596 HE1 TRP 82 HE1 TRP 82 83.274 4.076 -3.155 597 HE3 TRP 82 HE3 TRP 82 79.991 5.125 0.928 598 HZ2 TRP 82 HZ2 TRP 82 82.142 6.628 -3.312 599 HZ3 TRP 82 HZ3 TRP 82 79.566 7.355 0.016 600 HH2 TRP 82 HH2 TRP 82 80.627 8.100 -2.054 601 H ARG 83 H ARG 83 80.537 2.974 3.269 602 HA ARG 83 HA ARG 83 80.709 5.766 3.328 603 HB2 ARG 83 HB2 ARG 83 78.814 4.028 4.114 604 HB3 ARG 83 HB3 ARG 83 79.778 4.179 5.595 605 HG2 ARG 83 HG2 ARG 83 78.047 5.640 5.944 606 HG3 ARG 83 HG3 ARG 83 79.522 6.507 5.501 607 HD2 ARG 83 HD2 ARG 83 78.682 7.043 3.325 608 HD3 ARG 83 HD3 ARG 83 77.267 6.000 3.554 609 HE ARG 83 HE ARG 83 77.048 7.671 5.629 610 HH11 ARG 83 HH11 ARG 83 77.178 8.361 2.150 611 HH12 ARG 83 HH12 ARG 83 76.628 9.963 2.337 612 HH21 ARG 83 HH21 ARG 83 76.212 9.816 5.839 613 HH22 ARG 83 HH22 ARG 83 76.015 10.797 4.464 614 H ALA 84 H ALA 84 81.820 3.238 5.597 615 HA ALA 84 HA ALA 84 82.922 4.998 7.504 616 HB1 ALA 84 HB1 ALA 84 82.192 2.726 8.044 617 HB2 ALA 84 HB2 ALA 84 83.868 3.001 8.521 618 HB3 ALA 84 HB3 ALA 84 83.503 2.075 7.064 619 H ALA 85 H ALA 85 84.340 3.222 4.782 620 HA ALA 85 HA ALA 85 87.030 3.772 5.320 621 HB1 ALA 85 HB1 ALA 85 87.452 3.206 2.992 622 HB2 ALA 85 HB2 ALA 85 85.736 3.366 2.626 623 HB3 ALA 85 HB3 ALA 85 86.291 2.084 3.701 624 H ASN 86 H ASN 86 84.592 5.649 3.707 625 HA ASN 86 HA ASN 86 86.430 7.720 2.870 626 HB2 ASN 86 HB2 ASN 86 84.246 7.382 1.712 627 HB3 ASN 86 HB3 ASN 86 83.419 7.864 3.189 628 HD21 ASN 86 HD21 ASN 86 84.933 8.912 0.365 629 HD22 ASN 86 HD22 ASN 86 84.842 10.607 0.641 630 H GLY 87 H GLY 87 84.023 7.301 5.408 631 HA2 GLY 87 HA2 GLY 87 84.536 8.095 7.645 632 HA3 GLY 87 HA3 GLY 87 85.273 9.516 6.898 633 H LYS 88 H LYS 88 82.209 7.955 5.871 634 HA LYS 88 HA LYS 88 80.884 10.443 6.346 635 HB2 LYS 88 HB2 LYS 88 80.515 8.015 4.639 636 HB3 LYS 88 HB3 LYS 88 79.310 9.264 4.795 637 HG2 LYS 88 HG2 LYS 88 80.811 10.845 3.711 638 HG3 LYS 88 HG3 LYS 88 82.111 9.649 3.721 639 HD2 LYS 88 HD2 LYS 88 80.742 8.179 2.287 640 HD3 LYS 88 HD3 LYS 88 79.490 9.406 2.223 641 HE2 LYS 88 HE2 LYS 88 82.306 9.713 1.211 642 HE3 LYS 88 HE3 LYS 88 80.894 9.404 0.212 643 HZ1 LYS 88 HZ1 LYS 88 81.465 11.678 0.147 644 HZ2 LYS 88 HZ2 LYS 88 81.442 11.854 1.809 645 HZ3 LYS 88 HZ3 LYS 88 80.007 11.556 0.962 646 HA PRO 89 HA PRO 89 78.812 8.157 9.662 647 HB2 PRO 89 HB2 PRO 89 76.415 9.763 9.005 648 HB3 PRO 89 HB3 PRO 89 77.291 9.651 10.534 649 HG2 PRO 89 HG2 PRO 89 77.456 11.847 9.020 650 HG3 PRO 89 HG3 PRO 89 78.856 11.226 9.912 651 HD2 PRO 89 HD2 PRO 89 78.219 10.976 6.997 652 HD3 PRO 89 HD3 PRO 89 79.773 11.304 7.800 653 H GLY 90 H GLY 90 78.051 6.189 9.385 654 HA2 GLY 90 HA2 GLY 90 76.409 5.617 7.037 655 HA3 GLY 90 HA3 GLY 90 77.263 4.426 8.017 656 H PHE 91 H PHE 91 75.761 3.119 8.718 657 HA PHE 91 HA PHE 91 73.090 4.003 9.288 658 HB2 PHE 91 HB2 PHE 91 74.335 1.314 9.888 659 HB3 PHE 91 HB3 PHE 91 72.627 1.690 9.736 660 HD1 PHE 91 HD1 PHE 91 72.149 2.923 7.329 661 HD2 PHE 91 HD2 PHE 91 75.203 0.096 8.185 662 HE1 PHE 91 HE1 PHE 91 72.259 2.317 4.952 663 HE2 PHE 91 HE2 PHE 91 75.310 -0.509 5.799 664 HZ PHE 91 HZ PHE 91 73.837 0.600 4.190 665 H LYS 92 H LYS 92 72.139 4.057 11.351 666 HA LYS 92 HA LYS 92 73.965 4.417 13.510 667 HB2 LYS 92 HB2 LYS 92 72.010 5.121 14.707 668 HB3 LYS 92 HB3 LYS 92 72.055 5.939 13.180 669 HG2 LYS 92 HG2 LYS 92 70.269 4.617 12.357 670 HG3 LYS 92 HG3 LYS 92 70.457 3.466 13.681 671 HD2 LYS 92 HD2 LYS 92 69.596 6.340 14.053 672 HD3 LYS 92 HD3 LYS 92 68.475 4.988 13.901 673 HE2 LYS 92 HE2 LYS 92 69.567 3.941 15.889 674 HE3 LYS 92 HE3 LYS 92 70.548 5.387 16.074 675 HZ1 LYS 92 HZ1 LYS 92 68.485 6.665 16.387 676 HZ2 LYS 92 HZ2 LYS 92 68.652 5.435 17.526 677 HZ3 LYS 92 HZ3 LYS 92 67.594 5.238 16.243 678 H GLN 93 H GLN 93 73.090 3.350 15.615 679 HA GLN 93 HA GLN 93 72.399 0.598 15.031 680 HB2 GLN 93 HB2 GLN 93 74.041 2.003 16.967 681 HB3 GLN 93 HB3 GLN 93 73.552 0.335 17.299 682 HG2 GLN 93 HG2 GLN 93 75.311 1.413 15.079 683 HG3 GLN 93 HG3 GLN 93 75.806 0.364 16.406 684 HE21 GLN 93 HE21 GLN 93 74.222 0.511 13.304 685 HE22 GLN 93 HE22 GLN 93 74.236 -1.190 13.016 686 H GLY 94 H GLY 94 70.712 -0.176 16.184 687 HA2 GLY 94 HA2 GLY 94 69.742 1.059 18.502 688 HA3 GLY 94 HA3 GLY 94 68.700 1.352 17.097 Start of MODEL 8 1 H GLU 2 H GLU 2 59.833 2.139 8.226 2 HA GLU 2 HA GLU 2 59.463 3.664 6.364 3 HB2 GLU 2 HB2 GLU 2 60.145 4.913 9.018 4 HB3 GLU 2 HB3 GLU 2 59.246 5.714 7.733 5 HG2 GLU 2 HG2 GLU 2 58.425 3.274 9.285 6 HG3 GLU 2 HG3 GLU 2 57.688 4.879 9.314 7 H LEU 3 H LEU 3 60.029 5.952 5.758 8 HA LEU 3 HA LEU 3 62.768 5.859 4.811 9 HB2 LEU 3 HB2 LEU 3 60.444 7.636 4.106 10 HB3 LEU 3 HB3 LEU 3 62.039 7.778 3.404 11 HG LEU 3 HG LEU 3 60.172 5.438 3.120 12 HD11 LEU 3 HD11 LEU 3 60.101 6.127 0.754 13 HD12 LEU 3 HD12 LEU 3 61.165 7.483 1.118 14 HD13 LEU 3 HD13 LEU 3 59.545 7.438 1.797 15 HD21 LEU 3 HD21 LEU 3 62.439 4.689 3.208 16 HD22 LEU 3 HD22 LEU 3 62.936 5.922 2.060 17 HD23 LEU 3 HD23 LEU 3 61.874 4.610 1.532 18 H LYS 4 H LYS 4 64.290 7.085 5.560 19 HA LYS 4 HA LYS 4 63.593 9.339 7.310 20 HB2 LYS 4 HB2 LYS 4 66.337 8.144 7.135 21 HB3 LYS 4 HB3 LYS 4 65.581 9.043 8.443 22 HG2 LYS 4 HG2 LYS 4 65.288 6.153 7.681 23 HG3 LYS 4 HG3 LYS 4 65.962 6.790 9.159 24 HD2 LYS 4 HD2 LYS 4 63.498 7.789 9.309 25 HD3 LYS 4 HD3 LYS 4 63.218 6.391 8.284 26 HE2 LYS 4 HE2 LYS 4 64.541 5.003 9.940 27 HE3 LYS 4 HE3 LYS 4 64.488 6.381 11.002 28 HZ1 LYS 4 HZ1 LYS 4 62.758 4.973 11.684 29 HZ2 LYS 4 HZ2 LYS 4 62.241 4.686 10.159 30 HZ3 LYS 4 HZ3 LYS 4 61.969 6.228 10.870 31 H ASN 5 H ASN 5 64.886 11.281 6.894 32 HA ASN 5 HA ASN 5 65.395 11.487 4.057 33 HB2 ASN 5 HB2 ASN 5 65.495 13.650 6.168 34 HB3 ASN 5 HB3 ASN 5 65.687 13.918 4.437 35 HD21 ASN 5 HD21 ASN 5 63.869 13.675 3.068 36 HD22 ASN 5 HD22 ASN 5 62.274 13.636 3.697 37 H SER 6 H SER 6 67.288 10.704 6.664 38 HA SER 6 HA SER 6 69.631 11.008 5.003 39 HB2 SER 6 HB2 SER 6 70.975 11.924 6.827 40 HB3 SER 6 HB3 SER 6 69.673 13.028 6.390 41 HG SER 6 HG SER 6 68.815 12.795 8.287 42 H ILE 7 H ILE 7 71.438 9.706 5.825 43 HA ILE 7 HA ILE 7 70.598 7.084 6.474 44 HB ILE 7 HB ILE 7 72.603 7.639 5.071 45 HG12 ILE 7 HG12 ILE 7 74.127 5.905 6.048 46 HG13 ILE 7 HG13 ILE 7 73.073 5.863 7.455 47 HG21 ILE 7 HG21 ILE 7 74.726 8.179 6.122 48 HG22 ILE 7 HG22 ILE 7 73.930 8.292 7.689 49 HG23 ILE 7 HG23 ILE 7 73.544 9.457 6.426 50 HD11 ILE 7 HD11 ILE 7 71.227 5.099 6.053 51 HD12 ILE 7 HD12 ILE 7 72.663 4.060 5.912 52 HD13 ILE 7 HD13 ILE 7 72.295 5.207 4.642 53 H SER 8 H SER 8 71.345 9.754 8.405 54 HA SER 8 HA SER 8 72.555 8.395 10.586 55 HB2 SER 8 HB2 SER 8 73.024 10.767 10.036 56 HB3 SER 8 HB3 SER 8 71.370 11.179 10.470 57 HG SER 8 HG SER 8 72.741 9.767 12.380 58 H ASP 9 H ASP 9 69.342 8.681 9.555 59 HA ASP 9 HA ASP 9 68.316 8.200 12.286 60 HB2 ASP 9 HB2 ASP 9 67.221 9.961 10.548 61 HB3 ASP 9 HB3 ASP 9 66.651 8.487 9.870 62 H TYR 10 H TYR 10 69.535 6.553 9.831 63 HA TYR 10 HA TYR 10 67.481 4.485 9.652 64 HB2 TYR 10 HB2 TYR 10 69.765 5.250 7.901 65 HB3 TYR 10 HB3 TYR 10 69.331 3.552 7.966 66 HD1 TYR 10 HD1 TYR 10 66.986 2.894 7.344 67 HD2 TYR 10 HD2 TYR 10 68.540 6.770 6.569 68 HE1 TYR 10 HE1 TYR 10 65.204 3.261 5.684 69 HE2 TYR 10 HE2 TYR 10 66.764 7.144 4.896 70 HH TYR 10 HH TYR 10 65.173 5.960 3.563 71 H THR 11 H THR 11 67.663 2.875 11.059 72 HA THR 11 HA THR 11 70.217 2.087 12.140 73 HB THR 11 HB THR 11 68.882 0.136 12.953 74 HG1 THR 11 HG1 THR 11 66.514 0.497 12.710 75 HG21 THR 11 HG21 THR 11 67.458 1.372 14.542 76 HG22 THR 11 HG22 THR 11 67.683 2.837 13.583 77 HG23 THR 11 HG23 THR 11 69.061 2.086 14.391 78 H GLU 12 H GLU 12 70.810 -0.153 11.809 79 HA GLU 12 HA GLU 12 71.305 -0.613 9.112 80 HB2 GLU 12 HB2 GLU 12 72.274 -2.744 9.833 81 HB3 GLU 12 HB3 GLU 12 72.821 -1.413 10.822 82 HG2 GLU 12 HG2 GLU 12 70.939 -3.664 11.622 83 HG3 GLU 12 HG3 GLU 12 72.552 -3.196 12.186 84 H ALA 13 H ALA 13 68.953 -2.009 11.333 85 HA ALA 13 HA ALA 13 67.830 -3.708 9.359 86 HB1 ALA 13 HB1 ALA 13 66.070 -4.161 10.941 87 HB2 ALA 13 HB2 ALA 13 66.606 -2.811 11.960 88 HB3 ALA 13 HB3 ALA 13 67.656 -4.215 11.701 89 H GLU 14 H GLU 14 66.862 -0.389 10.444 90 HA GLU 14 HA GLU 14 64.498 -0.204 8.925 91 HB2 GLU 14 HB2 GLU 14 66.487 1.797 9.898 92 HB3 GLU 14 HB3 GLU 14 65.399 2.343 8.643 93 HG2 GLU 14 HG2 GLU 14 64.540 1.176 11.282 94 HG3 GLU 14 HG3 GLU 14 64.674 2.899 10.942 95 H PHE 15 H PHE 15 67.825 0.233 8.076 96 HA PHE 15 HA PHE 15 67.311 1.080 5.441 97 HB2 PHE 15 HB2 PHE 15 69.392 1.417 6.899 98 HB3 PHE 15 HB3 PHE 15 69.836 -0.209 6.418 99 HD1 PHE 15 HD1 PHE 15 69.012 3.144 5.079 100 HD2 PHE 15 HD2 PHE 15 70.938 -0.563 4.446 101 HE1 PHE 15 HE1 PHE 15 70.103 4.070 3.068 102 HE2 PHE 15 HE2 PHE 15 72.042 0.344 2.433 103 HZ PHE 15 HZ PHE 15 71.620 2.669 1.757 104 H VAL 16 H VAL 16 68.275 -2.122 6.847 105 HA VAL 16 HA VAL 16 68.280 -3.466 4.379 106 HB VAL 16 HB VAL 16 68.275 -5.554 5.454 107 HG11 VAL 16 HG11 VAL 16 69.783 -5.483 7.345 108 HG12 VAL 16 HG12 VAL 16 69.684 -3.718 7.266 109 HG13 VAL 16 HG13 VAL 16 70.267 -4.648 5.879 110 HG21 VAL 16 HG21 VAL 16 66.897 -4.361 7.823 111 HG22 VAL 16 HG22 VAL 16 67.660 -5.964 7.822 112 HG23 VAL 16 HG23 VAL 16 66.337 -5.611 6.705 113 H GLN 17 H GLN 17 65.610 -2.802 6.590 114 HA GLN 17 HA GLN 17 63.636 -4.384 5.452 115 HB2 GLN 17 HB2 GLN 17 63.429 -3.386 7.621 116 HB3 GLN 17 HB3 GLN 17 63.603 -1.778 6.943 117 HG2 GLN 17 HG2 GLN 17 61.561 -2.123 5.700 118 HG3 GLN 17 HG3 GLN 17 61.361 -3.680 6.527 119 HE21 GLN 17 HE21 GLN 17 61.367 -0.258 6.861 120 HE22 GLN 17 HE22 GLN 17 60.607 -0.195 8.412 121 H LEU 18 H LEU 18 64.560 -1.024 4.866 122 HA LEU 18 HA LEU 18 62.528 -0.561 3.008 123 HB2 LEU 18 HB2 LEU 18 63.802 1.148 4.281 124 HB3 LEU 18 HB3 LEU 18 65.185 0.901 3.296 125 HG LEU 18 HG LEU 18 63.775 2.941 2.757 126 HD11 LEU 18 HD11 LEU 18 64.261 1.013 0.514 127 HD12 LEU 18 HD12 LEU 18 65.430 2.152 1.187 128 HD13 LEU 18 HD13 LEU 18 63.999 2.750 0.347 129 HD21 LEU 18 HD21 LEU 18 61.926 0.855 1.612 130 HD22 LEU 18 HD22 LEU 18 61.781 2.589 1.366 131 HD23 LEU 18 HD23 LEU 18 61.577 1.909 2.980 132 H LEU 19 H LEU 19 65.804 -1.560 2.819 133 HA LEU 19 HA LEU 19 66.083 -1.605 0.063 134 HB2 LEU 19 HB2 LEU 19 67.522 -2.706 2.319 135 HB3 LEU 19 HB3 LEU 19 67.828 -3.532 0.809 136 HG LEU 19 HG LEU 19 68.593 -1.468 -0.213 137 HD11 LEU 19 HD11 LEU 19 68.830 0.586 1.093 138 HD12 LEU 19 HD12 LEU 19 67.909 -0.149 2.410 139 HD13 LEU 19 HD13 LEU 19 67.139 0.150 0.847 140 HD21 LEU 19 HD21 LEU 19 70.524 -1.056 1.116 141 HD22 LEU 19 HD22 LEU 19 70.104 -2.787 1.064 142 HD23 LEU 19 HD23 LEU 19 69.727 -1.820 2.499 143 H LYS 20 H LYS 20 64.871 -4.070 2.231 144 HA LYS 20 HA LYS 20 64.566 -6.138 0.359 145 HB2 LYS 20 HB2 LYS 20 62.791 -5.531 2.744 146 HB3 LYS 20 HB3 LYS 20 62.807 -7.067 1.912 147 HG2 LYS 20 HG2 LYS 20 65.352 -7.058 2.555 148 HG3 LYS 20 HG3 LYS 20 64.848 -5.839 3.685 149 HD2 LYS 20 HD2 LYS 20 63.666 -8.617 3.584 150 HD3 LYS 20 HD3 LYS 20 64.854 -8.057 4.753 151 HE2 LYS 20 HE2 LYS 20 63.221 -6.372 5.549 152 HE3 LYS 20 HE3 LYS 20 62.044 -7.010 4.398 153 HZ1 LYS 20 HZ1 LYS 20 62.181 -9.153 5.560 154 HZ2 LYS 20 HZ2 LYS 20 61.666 -7.925 6.572 155 HZ3 LYS 20 HZ3 LYS 20 63.240 -8.491 6.685 156 H GLU 21 H GLU 21 62.636 -3.335 1.103 157 HA GLU 21 HA GLU 21 60.399 -3.967 -0.551 158 HB2 GLU 21 HB2 GLU 21 61.343 -1.276 0.449 159 HB3 GLU 21 HB3 GLU 21 59.747 -1.653 -0.179 160 HG2 GLU 21 HG2 GLU 21 60.952 -2.794 2.333 161 HG3 GLU 21 HG3 GLU 21 59.788 -1.475 2.268 162 H ILE 22 H ILE 22 63.449 -2.273 -1.051 163 HA ILE 22 HA ILE 22 62.724 -1.166 -3.547 164 HB ILE 22 HB ILE 22 65.588 -1.956 -2.884 165 HG12 ILE 22 HG12 ILE 22 64.106 0.575 -2.146 166 HG13 ILE 22 HG13 ILE 22 64.632 -0.652 -1.012 167 HG21 ILE 22 HG21 ILE 22 66.091 -0.065 -4.368 168 HG22 ILE 22 HG22 ILE 22 64.374 0.278 -4.519 169 HG23 ILE 22 HG23 ILE 22 65.025 -1.208 -5.198 170 HD11 ILE 22 HD11 ILE 22 66.433 1.052 -2.726 171 HD12 ILE 22 HD12 ILE 22 66.973 -0.183 -1.591 172 HD13 ILE 22 HD13 ILE 22 66.143 1.259 -1.000 173 H GLU 23 H GLU 23 64.203 -4.234 -2.681 174 HA GLU 23 HA GLU 23 64.622 -5.360 -5.232 175 HB2 GLU 23 HB2 GLU 23 63.580 -6.605 -2.746 176 HB3 GLU 23 HB3 GLU 23 64.140 -7.545 -4.096 177 HG2 GLU 23 HG2 GLU 23 66.400 -6.452 -3.660 178 HG3 GLU 23 HG3 GLU 23 65.623 -5.814 -2.194 179 H LYS 24 H LYS 24 61.920 -5.300 -3.068 180 HA LYS 24 HA LYS 24 60.152 -6.963 -4.366 181 HB2 LYS 24 HB2 LYS 24 60.082 -6.255 -2.045 182 HB3 LYS 24 HB3 LYS 24 59.676 -4.628 -2.586 183 HG2 LYS 24 HG2 LYS 24 57.692 -5.750 -1.762 184 HG3 LYS 24 HG3 LYS 24 57.578 -5.425 -3.490 185 HD2 LYS 24 HD2 LYS 24 58.077 -7.715 -4.013 186 HD3 LYS 24 HD3 LYS 24 58.387 -8.081 -2.311 187 HE2 LYS 24 HE2 LYS 24 55.766 -7.165 -3.473 188 HE3 LYS 24 HE3 LYS 24 56.155 -8.828 -3.024 189 HZ1 LYS 24 HZ1 LYS 24 56.383 -8.145 -0.740 190 HZ2 LYS 24 HZ2 LYS 24 54.875 -7.623 -1.292 191 HZ3 LYS 24 HZ3 LYS 24 56.137 -6.537 -1.118 192 H GLU 25 H GLU 25 60.263 -3.418 -4.234 193 HA GLU 25 HA GLU 25 58.302 -2.939 -6.106 194 HB2 GLU 25 HB2 GLU 25 60.517 -1.268 -4.937 195 HB3 GLU 25 HB3 GLU 25 59.567 -0.690 -6.250 196 HG2 GLU 25 HG2 GLU 25 58.698 0.041 -4.028 197 HG3 GLU 25 HG3 GLU 25 57.572 -0.768 -5.111 198 H ASN 26 H ASN 26 61.630 -3.735 -6.531 199 HA ASN 26 HA ASN 26 61.734 -2.946 -9.286 200 HB2 ASN 26 HB2 ASN 26 63.823 -3.000 -8.066 201 HB3 ASN 26 HB3 ASN 26 63.581 -4.690 -7.647 202 HD21 ASN 26 HD21 ASN 26 64.411 -2.469 -10.220 203 HD22 ASN 26 HD22 ASN 26 65.069 -3.666 -11.270 204 H VAL 27 H VAL 27 61.411 -6.054 -7.590 205 HA VAL 27 HA VAL 27 61.200 -7.498 -10.033 206 HB VAL 27 HB VAL 27 60.605 -9.474 -8.727 207 HG11 VAL 27 HG11 VAL 27 62.941 -8.921 -8.929 208 HG12 VAL 27 HG12 VAL 27 62.626 -9.635 -7.344 209 HG13 VAL 27 HG13 VAL 27 62.848 -7.893 -7.499 210 HG21 VAL 27 HG21 VAL 27 59.162 -8.462 -7.032 211 HG22 VAL 27 HG22 VAL 27 60.554 -7.634 -6.333 212 HG23 VAL 27 HG23 VAL 27 60.453 -9.393 -6.265 213 H ALA 28 H ALA 28 58.890 -5.869 -8.080 214 HA ALA 28 HA ALA 28 56.670 -7.058 -9.515 215 HB1 ALA 28 HB1 ALA 28 56.741 -4.709 -7.611 216 HB2 ALA 28 HB2 ALA 28 56.378 -6.376 -7.172 217 HB3 ALA 28 HB3 ALA 28 55.285 -5.486 -8.234 218 H ALA 29 H ALA 29 58.909 -4.593 -9.923 219 HA ALA 29 HA ALA 29 59.224 -2.839 -11.226 220 HB1 ALA 29 HB1 ALA 29 59.006 -4.538 -13.010 221 HB2 ALA 29 HB2 ALA 29 58.483 -2.936 -13.531 222 HB3 ALA 29 HB3 ALA 29 57.282 -4.167 -13.128 223 H THR 30 H THR 30 58.107 -1.756 -9.475 224 HA THR 30 HA THR 30 55.429 -0.825 -9.961 225 HB THR 30 HB THR 30 55.760 0.446 -7.871 226 HG1 THR 30 HG1 THR 30 58.002 -0.378 -6.968 227 HG21 THR 30 HG21 THR 30 55.196 -1.970 -7.774 228 HG22 THR 30 HG22 THR 30 56.160 -1.434 -6.390 229 HG23 THR 30 HG23 THR 30 56.932 -2.307 -7.722 230 H ASP 31 H ASP 31 58.663 0.202 -10.337 231 HA ASP 31 HA ASP 31 59.740 1.829 -11.338 232 HB2 ASP 31 HB2 ASP 31 58.325 1.342 -13.279 233 HB3 ASP 31 HB3 ASP 31 57.129 2.487 -12.673 234 H ASP 32 H ASP 32 56.662 3.284 -10.509 235 HA ASP 32 HA ASP 32 57.629 5.875 -10.094 236 HB2 ASP 32 HB2 ASP 32 55.298 4.498 -8.765 237 HB3 ASP 32 HB3 ASP 32 55.632 6.219 -8.640 238 H VAL 33 H VAL 33 56.956 3.421 -7.688 239 HA VAL 33 HA VAL 33 58.185 5.114 -5.689 240 HB VAL 33 HB VAL 33 56.217 3.975 -5.040 241 HG11 VAL 33 HG11 VAL 33 56.249 1.995 -6.335 242 HG12 VAL 33 HG12 VAL 33 56.148 1.519 -4.634 243 HG13 VAL 33 HG13 VAL 33 57.683 1.414 -5.496 244 HG21 VAL 33 HG21 VAL 33 57.731 4.484 -3.246 245 HG22 VAL 33 HG22 VAL 33 58.581 2.959 -3.481 246 HG23 VAL 33 HG23 VAL 33 56.918 2.959 -2.888 247 H LEU 34 H LEU 34 58.918 2.389 -7.473 248 HA LEU 34 HA LEU 34 61.326 1.490 -6.224 249 HB2 LEU 34 HB2 LEU 34 59.987 0.417 -8.172 250 HB3 LEU 34 HB3 LEU 34 60.705 1.679 -9.114 251 HG LEU 34 HG LEU 34 61.715 -0.733 -9.145 252 HD11 LEU 34 HD11 LEU 34 63.786 0.208 -9.884 253 HD12 LEU 34 HD12 LEU 34 63.281 1.781 -9.219 254 HD13 LEU 34 HD13 LEU 34 62.354 1.020 -10.522 255 HD21 LEU 34 HD21 LEU 34 62.236 -0.859 -6.763 256 HD22 LEU 34 HD22 LEU 34 63.230 0.592 -6.900 257 HD23 LEU 34 HD23 LEU 34 63.709 -0.883 -7.732 258 H ASP 35 H ASP 35 60.774 4.017 -8.660 259 HA ASP 35 HA ASP 35 63.490 4.749 -8.735 260 HB2 ASP 35 HB2 ASP 35 61.999 5.461 -10.545 261 HB3 ASP 35 HB3 ASP 35 61.074 6.428 -9.399 262 H VAL 36 H VAL 36 60.883 5.817 -6.750 263 HA VAL 36 HA VAL 36 62.065 7.940 -5.368 264 HB VAL 36 HB VAL 36 60.415 5.721 -4.166 265 HG11 VAL 36 HG11 VAL 36 61.561 7.046 -2.594 266 HG12 VAL 36 HG12 VAL 36 59.811 7.396 -2.518 267 HG13 VAL 36 HG13 VAL 36 60.944 8.525 -3.330 268 HG21 VAL 36 HG21 VAL 36 58.590 7.074 -4.472 269 HG22 VAL 36 HG22 VAL 36 59.425 6.661 -6.009 270 HG23 VAL 36 HG23 VAL 36 59.588 8.311 -5.301 271 H LEU 37 H LEU 37 62.052 4.517 -4.790 272 HA LEU 37 HA LEU 37 63.467 4.598 -2.393 273 HB2 LEU 37 HB2 LEU 37 63.394 2.288 -4.278 274 HB3 LEU 37 HB3 LEU 37 63.682 2.410 -2.550 275 HG LEU 37 HG LEU 37 60.984 3.025 -3.696 276 HD11 LEU 37 HD11 LEU 37 61.455 0.671 -3.997 277 HD12 LEU 37 HD12 LEU 37 60.252 0.917 -2.733 278 HD13 LEU 37 HD13 LEU 37 61.917 0.535 -2.300 279 HD21 LEU 37 HD21 LEU 37 60.280 2.919 -1.347 280 HD22 LEU 37 HD22 LEU 37 61.478 4.182 -1.606 281 HD23 LEU 37 HD23 LEU 37 61.953 2.653 -0.861 282 H LEU 38 H LEU 38 64.368 3.983 -5.678 283 HA LEU 38 HA LEU 38 67.030 3.305 -5.286 284 HB2 LEU 38 HB2 LEU 38 65.518 4.550 -7.512 285 HB3 LEU 38 HB3 LEU 38 67.233 4.160 -7.697 286 HG LEU 38 HG LEU 38 64.769 2.462 -7.443 287 HD11 LEU 38 HD11 LEU 38 65.375 3.218 -9.626 288 HD12 LEU 38 HD12 LEU 38 65.652 1.464 -9.481 289 HD13 LEU 38 HD13 LEU 38 67.006 2.591 -9.373 290 HD21 LEU 38 HD21 LEU 38 66.412 1.443 -5.924 291 HD22 LEU 38 HD22 LEU 38 67.591 1.406 -7.241 292 HD23 LEU 38 HD23 LEU 38 66.120 0.450 -7.345 293 H GLU 39 H GLU 39 65.578 6.473 -5.980 294 HA GLU 39 HA GLU 39 68.098 7.780 -5.894 295 HB2 GLU 39 HB2 GLU 39 66.844 9.871 -6.047 296 HB3 GLU 39 HB3 GLU 39 66.351 8.724 -7.259 297 HG2 GLU 39 HG2 GLU 39 64.274 9.167 -6.671 298 HG3 GLU 39 HG3 GLU 39 64.571 8.215 -5.244 299 H HIS 40 H HIS 40 65.575 7.202 -3.619 300 HA HIS 40 HA HIS 40 66.400 8.940 -1.584 301 HB2 HIS 40 HB2 HIS 40 64.198 7.882 -1.783 302 HB3 HIS 40 HB3 HIS 40 64.845 6.328 -1.439 303 HD1 HIS 40 HD1 HIS 40 63.476 9.300 0.187 304 HD2 HIS 40 HD2 HIS 40 65.855 6.078 1.262 305 HE1 HIS 40 HE1 HIS 40 63.507 9.258 2.702 306 H PHE 41 H PHE 41 67.001 5.588 -2.234 307 HA PHE 41 HA PHE 41 68.569 4.949 -0.065 308 HB2 PHE 41 HB2 PHE 41 67.711 3.235 -1.366 309 HB3 PHE 41 HB3 PHE 41 68.291 3.958 -2.856 310 HD1 PHE 41 HD1 PHE 41 69.347 2.270 0.236 311 HD2 PHE 41 HD2 PHE 41 70.328 3.291 -3.744 312 HE1 PHE 41 HE1 PHE 41 71.322 0.785 0.347 313 HE2 PHE 41 HE2 PHE 41 72.293 1.846 -3.633 314 HZ PHE 41 HZ PHE 41 72.798 0.589 -1.623 315 H VAL 42 H VAL 42 69.594 5.995 -3.294 316 HA VAL 42 HA VAL 42 72.314 6.049 -2.523 317 HB VAL 42 HB VAL 42 71.679 5.662 -4.837 318 HG11 VAL 42 HG11 VAL 42 69.826 6.944 -5.043 319 HG12 VAL 42 HG12 VAL 42 71.019 7.262 -6.304 320 HG13 VAL 42 HG13 VAL 42 70.776 8.456 -4.992 321 HG21 VAL 42 HG21 VAL 42 73.353 8.130 -4.518 322 HG22 VAL 42 HG22 VAL 42 73.288 7.129 -5.966 323 HG23 VAL 42 HG23 VAL 42 73.924 6.464 -4.460 324 H LYS 43 H LYS 43 69.904 8.463 -2.414 325 HA LYS 43 HA LYS 43 71.813 10.600 -1.970 326 HB2 LYS 43 HB2 LYS 43 70.006 12.071 -1.684 327 HB3 LYS 43 HB3 LYS 43 69.413 10.885 -2.831 328 HG2 LYS 43 HG2 LYS 43 68.331 9.751 -0.699 329 HG3 LYS 43 HG3 LYS 43 68.687 11.293 0.035 330 HD2 LYS 43 HD2 LYS 43 67.462 12.494 -1.687 331 HD3 LYS 43 HD3 LYS 43 67.060 10.970 -2.469 332 HE2 LYS 43 HE2 LYS 43 65.905 10.298 -0.310 333 HE3 LYS 43 HE3 LYS 43 66.184 11.941 0.237 334 HZ1 LYS 43 HZ1 LYS 43 64.719 11.250 -2.234 335 HZ2 LYS 43 HZ2 LYS 43 64.868 12.788 -1.561 336 HZ3 LYS 43 HZ3 LYS 43 63.983 11.598 -0.764 337 H ILE 44 H ILE 44 70.202 8.382 0.149 338 HA ILE 44 HA ILE 44 71.023 9.902 2.467 339 HB ILE 44 HB ILE 44 70.136 7.972 3.806 340 HG12 ILE 44 HG12 ILE 44 69.357 6.929 1.080 341 HG13 ILE 44 HG13 ILE 44 70.533 6.191 2.142 342 HG21 ILE 44 HG21 ILE 44 67.770 8.391 3.271 343 HG22 ILE 44 HG22 ILE 44 68.262 9.153 1.760 344 HG23 ILE 44 HG23 ILE 44 68.720 9.877 3.302 345 HD11 ILE 44 HD11 ILE 44 68.431 4.996 2.155 346 HD12 ILE 44 HD12 ILE 44 67.586 6.466 2.639 347 HD13 ILE 44 HD13 ILE 44 68.741 5.710 3.736 348 H THR 45 H THR 45 72.095 6.993 0.786 349 HA THR 45 HA THR 45 74.190 6.682 2.735 350 HB THR 45 HB THR 45 73.172 4.627 1.829 351 HG1 THR 45 HG1 THR 45 75.919 5.082 1.299 352 HG21 THR 45 HG21 THR 45 73.738 3.868 -0.443 353 HG22 THR 45 HG22 THR 45 74.534 5.413 -0.756 354 HG23 THR 45 HG23 THR 45 72.793 5.357 -0.487 355 H GLU 46 H GLU 46 73.845 8.159 -0.391 356 HA GLU 46 HA GLU 46 75.180 9.289 -1.706 357 HB2 GLU 46 HB2 GLU 46 76.604 9.516 0.893 358 HB3 GLU 46 HB3 GLU 46 77.227 10.361 -0.540 359 HG2 GLU 46 HG2 GLU 46 74.462 10.595 0.567 360 HG3 GLU 46 HG3 GLU 46 75.771 11.732 0.967 361 H HIS 47 H HIS 47 75.346 6.631 -1.859 362 HA HIS 47 HA HIS 47 78.150 5.918 -2.186 363 HB2 HIS 47 HB2 HIS 47 76.509 4.349 -1.086 364 HB3 HIS 47 HB3 HIS 47 75.700 4.179 -2.640 365 HD1 HIS 47 HD1 HIS 47 76.724 2.416 -4.238 366 HD2 HIS 47 HD2 HIS 47 79.120 3.360 -0.997 367 HE1 HIS 47 HE1 HIS 47 78.759 0.929 -4.373 368 HA PRO 48 HA PRO 48 77.861 7.215 -6.493 369 HB2 PRO 48 HB2 PRO 48 80.025 5.351 -7.050 370 HB3 PRO 48 HB3 PRO 48 79.993 7.106 -7.210 371 HG2 PRO 48 HG2 PRO 48 81.376 5.786 -5.359 372 HG3 PRO 48 HG3 PRO 48 80.632 7.361 -4.943 373 HD2 PRO 48 HD2 PRO 48 79.747 4.558 -4.369 374 HD3 PRO 48 HD3 PRO 48 79.715 5.952 -3.283 375 H ASP 49 H ASP 49 77.613 3.991 -5.547 376 HA ASP 49 HA ASP 49 77.021 3.271 -8.230 377 HB2 ASP 49 HB2 ASP 49 78.144 1.397 -6.113 378 HB3 ASP 49 HB3 ASP 49 77.751 0.935 -7.748 379 H GLY 50 H GLY 50 75.453 4.408 -6.163 380 HA2 GLY 50 HA2 GLY 50 73.976 2.928 -4.286 381 HA3 GLY 50 HA3 GLY 50 73.406 4.283 -5.227 382 H THR 51 H THR 51 73.169 3.438 -7.542 383 HA THR 51 HA THR 51 70.901 1.805 -6.899 384 HB THR 51 HB THR 51 71.234 2.585 -9.748 385 HG1 THR 51 HG1 THR 51 70.140 4.636 -8.424 386 HG21 THR 51 HG21 THR 51 68.987 2.762 -7.714 387 HG22 THR 51 HG22 THR 51 69.287 1.394 -8.733 388 HG23 THR 51 HG23 THR 51 68.851 2.952 -9.460 389 H ALA 52 H ALA 52 73.899 1.401 -8.520 390 HA ALA 52 HA ALA 52 73.547 -1.169 -9.764 391 HB1 ALA 52 HB1 ALA 52 75.979 -0.049 -8.370 392 HB2 ALA 52 HB2 ALA 52 75.574 0.276 -10.056 393 HB3 ALA 52 HB3 ALA 52 75.940 -1.371 -9.535 394 H LEU 53 H LEU 53 74.413 -0.272 -6.481 395 HA LEU 53 HA LEU 53 74.702 -2.881 -5.617 396 HB2 LEU 53 HB2 LEU 53 73.736 -0.533 -4.037 397 HB3 LEU 53 HB3 LEU 53 74.122 -2.092 -3.333 398 HG LEU 53 HG LEU 53 76.004 -0.156 -4.669 399 HD11 LEU 53 HD11 LEU 53 75.905 -1.335 -1.919 400 HD12 LEU 53 HD12 LEU 53 75.455 0.309 -2.390 401 HD13 LEU 53 HD13 LEU 53 77.131 -0.223 -2.535 402 HD21 LEU 53 HD21 LEU 53 76.567 -2.988 -3.782 403 HD22 LEU 53 HD22 LEU 53 77.786 -1.788 -4.200 404 HD23 LEU 53 HD23 LEU 53 76.665 -2.358 -5.433 405 H ILE 54 H ILE 54 71.641 -1.098 -5.807 406 HA ILE 54 HA ILE 54 70.243 -3.342 -4.605 407 HB ILE 54 HB ILE 54 68.817 -1.440 -6.486 408 HG12 ILE 54 HG12 ILE 54 68.027 -0.494 -4.119 409 HG13 ILE 54 HG13 ILE 54 69.632 -1.044 -3.657 410 HG21 ILE 54 HG21 ILE 54 67.611 -3.460 -5.981 411 HG22 ILE 54 HG22 ILE 54 66.828 -2.082 -5.211 412 HG23 ILE 54 HG23 ILE 54 67.811 -3.184 -4.249 413 HD11 ILE 54 HD11 ILE 54 70.623 0.313 -5.371 414 HD12 ILE 54 HD12 ILE 54 69.618 1.285 -4.297 415 HD13 ILE 54 HD13 ILE 54 69.027 0.843 -5.897 416 H TYR 55 H TYR 55 70.740 -2.237 -7.871 417 HA TYR 55 HA TYR 55 69.222 -4.140 -9.189 418 HB2 TYR 55 HB2 TYR 55 71.378 -2.278 -9.915 419 HB3 TYR 55 HB3 TYR 55 71.005 -3.532 -11.071 420 HD1 TYR 55 HD1 TYR 55 68.243 -3.787 -11.237 421 HD2 TYR 55 HD2 TYR 55 70.382 -0.232 -10.342 422 HE1 TYR 55 HE1 TYR 55 66.325 -2.454 -11.985 423 HE2 TYR 55 HE2 TYR 55 68.460 1.111 -11.089 424 HH TYR 55 HH TYR 55 66.480 0.811 -12.613 425 H GLU 56 H GLU 56 72.670 -4.159 -8.400 426 HA GLU 56 HA GLU 56 73.237 -6.657 -9.519 427 HB2 GLU 56 HB2 GLU 56 74.532 -5.281 -7.160 428 HB3 GLU 56 HB3 GLU 56 75.183 -6.561 -8.105 429 HG2 GLU 56 HG2 GLU 56 74.574 -3.932 -9.359 430 HG3 GLU 56 HG3 GLU 56 76.136 -4.329 -8.656 431 H ALA 57 H ALA 57 72.220 -5.615 -6.254 432 HA ALA 57 HA ALA 57 72.457 -8.071 -4.961 433 HB1 ALA 57 HB1 ALA 57 72.071 -5.961 -3.796 434 HB2 ALA 57 HB2 ALA 57 70.908 -7.194 -3.303 435 HB3 ALA 57 HB3 ALA 57 70.425 -5.916 -4.419 436 H ALA 58 H ALA 58 69.732 -6.736 -6.743 437 HA ALA 58 HA ALA 58 67.871 -8.733 -6.212 438 HB1 ALA 58 HB1 ALA 58 66.744 -8.057 -8.273 439 HB2 ALA 58 HB2 ALA 58 68.201 -7.214 -8.803 440 HB3 ALA 58 HB3 ALA 58 67.316 -6.642 -7.388 441 H ALA 59 H ALA 59 70.280 -8.586 -8.787 442 HA ALA 59 HA ALA 59 69.666 -11.161 -9.838 443 HB1 ALA 59 HB1 ALA 59 71.687 -10.869 -11.181 444 HB2 ALA 59 HB2 ALA 59 72.138 -9.474 -10.199 445 HB3 ALA 59 HB3 ALA 59 70.693 -9.413 -11.208 446 H ARG 60 H ARG 60 72.121 -9.876 -7.691 447 HA ARG 60 HA ARG 60 73.680 -12.165 -7.423 448 HB2 ARG 60 HB2 ARG 60 73.464 -9.652 -5.788 449 HB3 ARG 60 HB3 ARG 60 74.531 -10.963 -5.278 450 HG2 ARG 60 HG2 ARG 60 75.765 -10.757 -7.340 451 HG3 ARG 60 HG3 ARG 60 74.603 -9.581 -7.948 452 HD2 ARG 60 HD2 ARG 60 76.585 -8.432 -7.187 453 HD3 ARG 60 HD3 ARG 60 75.244 -8.048 -6.118 454 HE ARG 60 HE ARG 60 76.316 -9.930 -4.695 455 HH11 ARG 60 HH11 ARG 60 78.066 -7.470 -6.587 456 HH12 ARG 60 HH12 ARG 60 79.388 -7.422 -5.533 457 HH21 ARG 60 HH21 ARG 60 78.223 -9.891 -3.294 458 HH22 ARG 60 HH22 ARG 60 79.501 -8.830 -3.647 459 H ALA 61 H ALA 61 70.915 -11.085 -5.508 460 HA ALA 61 HA ALA 61 71.202 -13.222 -3.630 461 HB1 ALA 61 HB1 ALA 61 68.844 -11.410 -4.124 462 HB2 ALA 61 HB2 ALA 61 70.192 -11.103 -3.022 463 HB3 ALA 61 HB3 ALA 61 69.097 -12.447 -2.711 464 H ALA 62 H ALA 62 69.510 -12.748 -6.629 465 HA ALA 62 HA ALA 62 67.633 -14.821 -6.435 466 HB1 ALA 62 HB1 ALA 62 67.519 -13.097 -8.173 467 HB2 ALA 62 HB2 ALA 62 67.510 -14.710 -8.886 468 HB3 ALA 62 HB3 ALA 62 68.983 -13.739 -8.914 469 H ALA 63 H ALA 63 70.936 -14.780 -7.634 470 HA ALA 63 HA ALA 63 70.896 -17.664 -7.971 471 HB1 ALA 63 HB1 ALA 63 73.160 -15.686 -8.314 472 HB2 ALA 63 HB2 ALA 63 72.136 -16.329 -9.601 473 HB3 ALA 63 HB3 ALA 63 73.225 -17.399 -8.724 474 H ASN 64 H ASN 64 73.162 -15.501 -6.352 475 HA ASN 64 HA ASN 64 74.547 -15.721 -4.613 476 HB2 ASN 64 HB2 ASN 64 72.535 -14.811 -3.577 477 HB3 ASN 64 HB3 ASN 64 71.972 -16.443 -3.226 478 HD21 ASN 64 HD21 ASN 64 71.899 -15.984 -1.032 479 HD22 ASN 64 HD22 ASN 64 73.303 -15.839 -0.048 480 HA PRO 65 HA PRO 65 75.605 -20.169 -4.741 481 HB2 PRO 65 HB2 PRO 65 78.163 -18.713 -4.218 482 HB3 PRO 65 HB3 PRO 65 77.871 -20.092 -5.285 483 HG2 PRO 65 HG2 PRO 65 78.163 -17.704 -6.348 484 HG3 PRO 65 HG3 PRO 65 76.861 -18.757 -6.923 485 HD2 PRO 65 HD2 PRO 65 76.703 -16.411 -5.076 486 HD3 PRO 65 HD3 PRO 65 75.613 -16.887 -6.393 487 H GLY 66 H GLY 66 77.152 -17.727 -2.614 488 HA2 GLY 66 HA2 GLY 66 76.062 -18.167 -0.247 489 HA3 GLY 66 HA3 GLY 66 77.065 -19.606 -0.400 490 H GLY 67 H GLY 67 77.361 -16.114 -0.918 491 HA2 GLY 67 HA2 GLY 67 79.810 -16.182 0.698 492 HA3 GLY 67 HA3 GLY 67 79.826 -15.420 -0.887 493 H ASP 68 H ASP 68 79.721 -13.296 -0.751 494 HA ASP 68 HA ASP 68 77.891 -12.149 1.202 495 HB2 ASP 68 HB2 ASP 68 80.716 -11.304 0.627 496 HB3 ASP 68 HB3 ASP 68 79.539 -10.149 1.237 497 H GLY 69 H GLY 69 77.039 -10.136 0.697 498 HA2 GLY 69 HA2 GLY 69 76.059 -8.619 -0.717 499 HA3 GLY 69 HA3 GLY 69 77.227 -9.080 -1.965 500 H GLY 70 H GLY 70 74.716 -10.732 -0.130 501 HA2 GLY 70 HA2 GLY 70 73.781 -11.989 -2.544 502 HA3 GLY 70 HA3 GLY 70 73.115 -12.192 -0.922 503 H GLY 71 H GLY 71 71.715 -10.597 -0.085 504 HA2 GLY 71 HA2 GLY 71 70.574 -8.915 -2.177 505 HA3 GLY 71 HA3 GLY 71 69.588 -9.814 -1.038 506 HA PRO 72 HA PRO 72 69.450 -5.667 0.646 507 HB2 PRO 72 HB2 PRO 72 67.848 -6.404 2.804 508 HB3 PRO 72 HB3 PRO 72 67.278 -5.842 1.234 509 HG2 PRO 72 HG2 PRO 72 67.487 -8.606 2.294 510 HG3 PRO 72 HG3 PRO 72 66.327 -7.927 1.146 511 HD2 PRO 72 HD2 PRO 72 68.349 -9.537 0.438 512 HD3 PRO 72 HD3 PRO 72 67.705 -8.310 -0.657 513 H GLU 73 H GLU 73 69.807 -8.383 2.926 514 HA GLU 73 HA GLU 73 71.206 -6.692 4.805 515 HB2 GLU 73 HB2 GLU 73 70.830 -9.694 4.852 516 HB3 GLU 73 HB3 GLU 73 71.394 -8.695 6.175 517 HG2 GLU 73 HG2 GLU 73 69.170 -7.510 6.103 518 HG3 GLU 73 HG3 GLU 73 68.656 -8.720 4.946 519 H GLY 74 H GLY 74 72.229 -7.979 1.988 520 HA2 GLY 74 HA2 GLY 74 74.845 -8.057 3.188 521 HA3 GLY 74 HA3 GLY 74 74.545 -8.910 1.622 522 H ILE 75 H ILE 75 73.128 -6.563 0.564 523 HA ILE 75 HA ILE 75 75.282 -4.949 -0.252 524 HB ILE 75 HB ILE 75 73.461 -3.198 -0.762 525 HG12 ILE 75 HG12 ILE 75 71.709 -5.611 -0.317 526 HG13 ILE 75 HG13 ILE 75 71.806 -4.238 0.772 527 HG21 ILE 75 HG21 ILE 75 72.847 -4.353 -2.791 528 HG22 ILE 75 HG22 ILE 75 73.530 -5.855 -2.134 529 HG23 ILE 75 HG23 ILE 75 74.567 -4.442 -2.417 530 HD11 ILE 75 HD11 ILE 75 69.863 -4.171 -0.603 531 HD12 ILE 75 HD12 ILE 75 70.858 -4.147 -2.082 532 HD13 ILE 75 HD13 ILE 75 70.941 -2.816 -0.892 533 H VAL 76 H VAL 76 73.108 -4.671 2.521 534 HA VAL 76 HA VAL 76 73.727 -2.125 3.202 535 HB VAL 76 HB VAL 76 73.190 -2.863 5.397 536 HG11 VAL 76 HG11 VAL 76 70.827 -3.009 4.991 537 HG12 VAL 76 HG12 VAL 76 71.141 -3.840 3.476 538 HG13 VAL 76 HG13 VAL 76 71.538 -2.137 3.618 539 HG21 VAL 76 HG21 VAL 76 73.912 -5.077 5.449 540 HG22 VAL 76 HG22 VAL 76 72.727 -5.534 4.222 541 HG23 VAL 76 HG23 VAL 76 72.196 -5.018 5.836 542 H LYS 77 H LYS 77 75.392 -5.064 3.712 543 HA LYS 77 HA LYS 77 77.342 -4.104 5.529 544 HB2 LYS 77 HB2 LYS 77 76.992 -6.515 5.251 545 HB3 LYS 77 HB3 LYS 77 77.462 -6.416 3.564 546 HG2 LYS 77 HG2 LYS 77 79.753 -5.780 4.289 547 HG3 LYS 77 HG3 LYS 77 79.249 -6.013 5.962 548 HD2 LYS 77 HD2 LYS 77 78.715 -8.361 5.481 549 HD3 LYS 77 HD3 LYS 77 79.195 -8.128 3.803 550 HE2 LYS 77 HE2 LYS 77 81.024 -7.819 6.195 551 HE3 LYS 77 HE3 LYS 77 80.933 -9.245 5.169 552 HZ1 LYS 77 HZ1 LYS 77 81.669 -7.847 3.287 553 HZ2 LYS 77 HZ2 LYS 77 82.785 -7.898 4.517 554 HZ3 LYS 77 HZ3 LYS 77 81.845 -6.523 4.316 555 H GLU 78 H GLU 78 77.276 -4.501 2.002 556 HA GLU 78 HA GLU 78 79.854 -3.487 1.473 557 HB2 GLU 78 HB2 GLU 78 78.279 -4.775 -0.114 558 HB3 GLU 78 HB3 GLU 78 77.492 -3.260 -0.495 559 HG2 GLU 78 HG2 GLU 78 79.142 -3.820 -2.146 560 HG3 GLU 78 HG3 GLU 78 79.612 -2.358 -1.276 561 H ILE 79 H ILE 79 76.752 -2.003 1.809 562 HA ILE 79 HA ILE 79 77.387 0.612 1.156 563 HB ILE 79 HB ILE 79 75.192 -0.746 2.640 564 HG12 ILE 79 HG12 ILE 79 75.168 -0.650 0.191 565 HG13 ILE 79 HG13 ILE 79 73.773 0.149 0.903 566 HG21 ILE 79 HG21 ILE 79 75.413 2.233 2.580 567 HG22 ILE 79 HG22 ILE 79 75.459 1.190 4.000 568 HG23 ILE 79 HG23 ILE 79 73.981 1.318 3.048 569 HD11 ILE 79 HD11 ILE 79 76.212 1.485 -0.261 570 HD12 ILE 79 HD12 ILE 79 74.909 2.317 0.580 571 HD13 ILE 79 HD13 ILE 79 74.576 1.467 -0.926 572 H LYS 80 H LYS 80 77.368 -1.071 4.316 573 HA LYS 80 HA LYS 80 77.798 1.321 5.767 574 HB2 LYS 80 HB2 LYS 80 77.819 -0.006 7.782 575 HB3 LYS 80 HB3 LYS 80 76.667 -0.707 6.659 576 HG2 LYS 80 HG2 LYS 80 78.271 -2.434 6.079 577 HG3 LYS 80 HG3 LYS 80 79.386 -1.785 7.281 578 HD2 LYS 80 HD2 LYS 80 77.705 -2.129 9.038 579 HD3 LYS 80 HD3 LYS 80 76.589 -2.779 7.842 580 HE2 LYS 80 HE2 LYS 80 77.559 -4.599 8.992 581 HE3 LYS 80 HE3 LYS 80 78.264 -4.583 7.379 582 HZ1 LYS 80 HZ1 LYS 80 80.238 -3.453 8.417 583 HZ2 LYS 80 HZ2 LYS 80 79.952 -5.011 8.949 584 HZ3 LYS 80 HZ3 LYS 80 79.519 -3.725 9.928 585 H GLU 81 H GLU 81 79.896 -1.208 4.642 586 HA GLU 81 HA GLU 81 82.189 -0.397 6.057 587 HB2 GLU 81 HB2 GLU 81 81.984 -1.943 3.475 588 HB3 GLU 81 HB3 GLU 81 83.404 -1.866 4.510 589 HG2 GLU 81 HG2 GLU 81 82.174 -2.946 6.306 590 HG3 GLU 81 HG3 GLU 81 80.728 -2.992 5.306 591 H TRP 82 H TRP 82 80.745 0.560 3.059 592 HA TRP 82 HA TRP 82 82.975 1.866 1.966 593 HB2 TRP 82 HB2 TRP 82 80.910 1.176 0.697 594 HB3 TRP 82 HB3 TRP 82 80.090 2.540 1.441 595 HD1 TRP 82 HD1 TRP 82 82.895 1.765 -1.045 596 HE1 TRP 82 HE1 TRP 82 83.273 3.823 -2.520 597 HE3 TRP 82 HE3 TRP 82 79.797 5.027 1.344 598 HZ2 TRP 82 HZ2 TRP 82 82.363 6.485 -2.672 599 HZ3 TRP 82 HZ3 TRP 82 79.601 7.299 0.487 600 HH2 TRP 82 HH2 TRP 82 80.863 8.030 -1.485 601 H ARG 83 H ARG 83 80.219 3.114 3.895 602 HA ARG 83 HA ARG 83 81.235 5.777 3.844 603 HB2 ARG 83 HB2 ARG 83 79.280 4.578 5.805 604 HB3 ARG 83 HB3 ARG 83 79.865 6.220 5.937 605 HG2 ARG 83 HG2 ARG 83 77.939 6.569 4.905 606 HG3 ARG 83 HG3 ARG 83 78.954 6.365 3.470 607 HD2 ARG 83 HD2 ARG 83 76.873 5.095 3.298 608 HD3 ARG 83 HD3 ARG 83 78.258 4.011 3.322 609 HE ARG 83 HE ARG 83 77.802 3.742 5.744 610 HH11 ARG 83 HH11 ARG 83 75.238 4.434 3.462 611 HH12 ARG 83 HH12 ARG 83 73.990 3.953 4.512 612 HH21 ARG 83 HH21 ARG 83 76.207 3.044 7.118 613 HH22 ARG 83 HH22 ARG 83 74.554 3.112 6.703 614 H ALA 84 H ALA 84 81.693 3.098 6.008 615 HA ALA 84 HA ALA 84 82.952 4.476 8.078 616 HB1 ALA 84 HB1 ALA 84 82.126 2.184 8.297 617 HB2 ALA 84 HB2 ALA 84 83.826 2.299 8.758 618 HB3 ALA 84 HB3 ALA 84 83.378 1.628 7.188 619 H ALA 85 H ALA 85 84.255 2.925 5.188 620 HA ALA 85 HA ALA 85 86.952 3.591 5.804 621 HB1 ALA 85 HB1 ALA 85 87.453 2.759 3.579 622 HB2 ALA 85 HB2 ALA 85 85.732 2.746 3.188 623 HB3 ALA 85 HB3 ALA 85 86.362 1.662 4.426 624 H ASN 86 H ASN 86 84.391 5.119 3.981 625 HA ASN 86 HA ASN 86 86.116 6.973 2.622 626 HB2 ASN 86 HB2 ASN 86 83.751 6.254 1.859 627 HB3 ASN 86 HB3 ASN 86 83.161 7.383 3.068 628 HD21 ASN 86 HD21 ASN 86 83.500 9.674 2.714 629 HD22 ASN 86 HD22 ASN 86 83.928 10.210 1.139 630 H GLY 87 H GLY 87 84.142 7.080 5.533 631 HA2 GLY 87 HA2 GLY 87 84.748 8.486 7.386 632 HA3 GLY 87 HA3 GLY 87 85.393 9.658 6.238 633 H LYS 88 H LYS 88 82.310 7.964 5.873 634 HA LYS 88 HA LYS 88 80.917 10.489 5.942 635 HB2 LYS 88 HB2 LYS 88 80.801 7.971 4.403 636 HB3 LYS 88 HB3 LYS 88 79.335 8.886 4.636 637 HG2 LYS 88 HG2 LYS 88 80.418 10.818 3.559 638 HG3 LYS 88 HG3 LYS 88 81.895 9.866 3.395 639 HD2 LYS 88 HD2 LYS 88 80.796 8.317 1.940 640 HD3 LYS 88 HD3 LYS 88 79.248 9.135 2.163 641 HE2 LYS 88 HE2 LYS 88 81.703 10.410 0.980 642 HE3 LYS 88 HE3 LYS 88 80.431 9.665 0.023 643 HZ1 LYS 88 HZ1 LYS 88 80.150 12.031 1.827 644 HZ2 LYS 88 HZ2 LYS 88 78.870 11.293 1.072 645 HZ3 LYS 88 HZ3 LYS 88 80.048 12.048 0.148 646 HA PRO 89 HA PRO 89 78.475 8.846 9.273 647 HB2 PRO 89 HB2 PRO 89 75.959 9.575 7.921 648 HB3 PRO 89 HB3 PRO 89 76.631 10.194 9.432 649 HG2 PRO 89 HG2 PRO 89 76.572 11.699 7.211 650 HG3 PRO 89 HG3 PRO 89 77.912 11.791 8.366 651 HD2 PRO 89 HD2 PRO 89 77.773 10.360 5.739 652 HD3 PRO 89 HD3 PRO 89 79.090 11.338 6.420 653 H GLY 90 H GLY 90 77.524 7.022 9.895 654 HA2 GLY 90 HA2 GLY 90 76.801 5.169 7.749 655 HA3 GLY 90 HA3 GLY 90 77.469 4.715 9.317 656 H PHE 91 H PHE 91 75.752 3.269 9.634 657 HA PHE 91 HA PHE 91 73.032 4.245 9.665 658 HB2 PHE 91 HB2 PHE 91 74.165 1.666 10.785 659 HB3 PHE 91 HB3 PHE 91 72.466 2.037 10.584 660 HD1 PHE 91 HD1 PHE 91 72.181 2.982 7.936 661 HD2 PHE 91 HD2 PHE 91 74.803 -0.010 9.404 662 HE1 PHE 91 HE1 PHE 91 72.224 1.929 5.728 663 HE2 PHE 91 HE2 PHE 91 74.848 -1.069 7.195 664 HZ PHE 91 HZ PHE 91 73.567 -0.097 5.347 665 H LYS 92 H LYS 92 71.800 4.522 11.614 666 HA LYS 92 HA LYS 92 73.414 5.234 13.823 667 HB2 LYS 92 HB2 LYS 92 71.409 5.919 14.832 668 HB3 LYS 92 HB3 LYS 92 71.379 6.497 13.200 669 HG2 LYS 92 HG2 LYS 92 69.722 4.961 12.558 670 HG3 LYS 92 HG3 LYS 92 70.029 3.943 13.969 671 HD2 LYS 92 HD2 LYS 92 68.885 6.733 14.116 672 HD3 LYS 92 HD3 LYS 92 67.903 5.267 14.095 673 HE2 LYS 92 HE2 LYS 92 69.114 4.493 16.141 674 HE3 LYS 92 HE3 LYS 92 69.974 6.006 16.190 675 HZ1 LYS 92 HZ1 LYS 92 67.835 7.170 16.416 676 HZ2 LYS 92 HZ2 LYS 92 68.067 6.079 17.679 677 HZ3 LYS 92 HZ3 LYS 92 67.026 5.705 16.416 678 H GLN 93 H GLN 93 72.918 4.292 15.867 679 HA GLN 93 HA GLN 93 72.697 1.409 15.679 680 HB2 GLN 93 HB2 GLN 93 73.540 3.443 17.602 681 HB3 GLN 93 HB3 GLN 93 73.311 1.798 18.159 682 HG2 GLN 93 HG2 GLN 93 75.682 2.309 17.744 683 HG3 GLN 93 HG3 GLN 93 75.085 1.041 16.664 684 HE21 GLN 93 HE21 GLN 93 75.097 1.410 14.483 685 HE22 GLN 93 HE22 GLN 93 75.783 2.797 13.736 686 H GLY 94 H GLY 94 70.970 0.431 16.476 687 HA2 GLY 94 HA2 GLY 94 69.232 1.666 18.394 688 HA3 GLY 94 HA3 GLY 94 68.511 1.443 16.799 Start of MODEL 9 1 H GLU 2 H GLU 2 61.301 2.140 6.610 2 HA GLU 2 HA GLU 2 59.691 3.905 6.257 3 HB2 GLU 2 HB2 GLU 2 60.882 4.987 8.826 4 HB3 GLU 2 HB3 GLU 2 59.817 5.885 7.761 5 HG2 GLU 2 HG2 GLU 2 59.037 3.335 9.152 6 HG3 GLU 2 HG3 GLU 2 58.748 4.948 9.792 7 H LEU 3 H LEU 3 60.339 6.113 5.522 8 HA LEU 3 HA LEU 3 63.084 5.997 4.586 9 HB2 LEU 3 HB2 LEU 3 60.732 7.698 3.810 10 HB3 LEU 3 HB3 LEU 3 62.333 7.893 3.133 11 HG LEU 3 HG LEU 3 60.678 5.393 2.913 12 HD11 LEU 3 HD11 LEU 3 60.396 6.101 0.538 13 HD12 LEU 3 HD12 LEU 3 61.239 7.606 0.905 14 HD13 LEU 3 HD13 LEU 3 59.681 7.271 1.648 15 HD21 LEU 3 HD21 LEU 3 63.241 6.275 1.621 16 HD22 LEU 3 HD22 LEU 3 62.386 4.761 1.282 17 HD23 LEU 3 HD23 LEU 3 63.069 5.076 2.891 18 H LYS 4 H LYS 4 64.599 7.265 5.360 19 HA LYS 4 HA LYS 4 63.817 9.411 7.195 20 HB2 LYS 4 HB2 LYS 4 66.565 8.220 6.877 21 HB3 LYS 4 HB3 LYS 4 65.973 9.221 8.194 22 HG2 LYS 4 HG2 LYS 4 65.591 6.327 7.592 23 HG3 LYS 4 HG3 LYS 4 66.219 7.056 9.052 24 HD2 LYS 4 HD2 LYS 4 63.770 8.044 9.097 25 HD3 LYS 4 HD3 LYS 4 63.512 6.622 8.095 26 HE2 LYS 4 HE2 LYS 4 64.691 5.210 9.793 27 HE3 LYS 4 HE3 LYS 4 64.777 6.607 10.833 28 HZ1 LYS 4 HZ1 LYS 4 62.987 5.432 11.598 29 HZ2 LYS 4 HZ2 LYS 4 62.432 5.036 10.092 30 HZ3 LYS 4 HZ3 LYS 4 62.245 6.643 10.675 31 H ASN 5 H ASN 5 65.081 11.402 6.974 32 HA ASN 5 HA ASN 5 65.476 11.948 4.195 33 HB2 ASN 5 HB2 ASN 5 65.700 13.769 6.593 34 HB3 ASN 5 HB3 ASN 5 65.998 14.307 4.945 35 HD21 ASN 5 HD21 ASN 5 63.849 12.571 3.847 36 HD22 ASN 5 HD22 ASN 5 62.362 13.306 4.283 37 H SER 6 H SER 6 67.490 11.095 6.794 38 HA SER 6 HA SER 6 69.717 11.167 4.960 39 HB2 SER 6 HB2 SER 6 71.220 12.061 6.711 40 HB3 SER 6 HB3 SER 6 70.032 13.238 6.156 41 HG SER 6 HG SER 6 68.734 12.430 8.015 42 H ILE 7 H ILE 7 71.564 9.894 5.847 43 HA ILE 7 HA ILE 7 70.676 7.289 6.515 44 HB ILE 7 HB ILE 7 72.661 7.863 5.094 45 HG12 ILE 7 HG12 ILE 7 74.179 6.084 5.952 46 HG13 ILE 7 HG13 ILE 7 73.220 6.020 7.431 47 HG21 ILE 7 HG21 ILE 7 74.797 8.380 6.155 48 HG22 ILE 7 HG22 ILE 7 73.984 8.500 7.714 49 HG23 ILE 7 HG23 ILE 7 73.596 9.645 6.433 50 HD11 ILE 7 HD11 ILE 7 71.290 5.289 6.140 51 HD12 ILE 7 HD12 ILE 7 72.677 4.229 5.870 52 HD13 ILE 7 HD13 ILE 7 72.231 5.417 4.654 53 H SER 8 H SER 8 71.436 9.954 8.481 54 HA SER 8 HA SER 8 72.652 8.576 10.656 55 HB2 SER 8 HB2 SER 8 73.176 10.921 10.174 56 HB3 SER 8 HB3 SER 8 71.509 11.381 10.489 57 HG SER 8 HG SER 8 71.950 11.445 12.495 58 H ASP 9 H ASP 9 69.430 8.927 9.642 59 HA ASP 9 HA ASP 9 68.418 8.358 12.359 60 HB2 ASP 9 HB2 ASP 9 67.313 10.161 10.690 61 HB3 ASP 9 HB3 ASP 9 66.714 8.731 9.947 62 H TYR 10 H TYR 10 69.738 6.741 9.990 63 HA TYR 10 HA TYR 10 67.678 4.708 9.690 64 HB2 TYR 10 HB2 TYR 10 69.889 5.594 7.971 65 HB3 TYR 10 HB3 TYR 10 69.701 3.851 8.086 66 HD1 TYR 10 HD1 TYR 10 67.310 2.957 7.741 67 HD2 TYR 10 HD2 TYR 10 68.607 6.766 6.412 68 HE1 TYR 10 HE1 TYR 10 65.452 3.007 6.135 69 HE2 TYR 10 HE2 TYR 10 66.747 6.828 4.795 70 HH TYR 10 HH TYR 10 64.179 4.564 4.944 71 H THR 11 H THR 11 67.746 3.217 11.153 72 HA THR 11 HA THR 11 70.212 2.421 12.351 73 HB THR 11 HB THR 11 68.853 0.733 13.493 74 HG1 THR 11 HG1 THR 11 66.606 0.520 12.882 75 HG21 THR 11 HG21 THR 11 68.554 2.979 14.381 76 HG22 THR 11 HG22 THR 11 67.044 2.078 14.490 77 HG23 THR 11 HG23 THR 11 67.263 3.283 13.220 78 H GLU 12 H GLU 12 71.099 0.233 11.877 79 HA GLU 12 HA GLU 12 71.248 -0.165 9.126 80 HB2 GLU 12 HB2 GLU 12 72.438 -2.307 9.676 81 HB3 GLU 12 HB3 GLU 12 73.107 -0.860 10.409 82 HG2 GLU 12 HG2 GLU 12 71.795 -1.502 12.483 83 HG3 GLU 12 HG3 GLU 12 71.546 -3.064 11.706 84 H ALA 13 H ALA 13 69.200 -1.780 11.460 85 HA ALA 13 HA ALA 13 68.113 -3.551 9.510 86 HB1 ALA 13 HB1 ALA 13 66.437 -4.122 11.162 87 HB2 ALA 13 HB2 ALA 13 66.914 -2.737 12.162 88 HB3 ALA 13 HB3 ALA 13 68.044 -4.073 11.885 89 H GLU 14 H GLU 14 67.055 -0.307 10.660 90 HA GLU 14 HA GLU 14 64.604 -0.137 9.254 91 HB2 GLU 14 HB2 GLU 14 66.509 1.751 10.419 92 HB3 GLU 14 HB3 GLU 14 65.767 2.415 8.979 93 HG2 GLU 14 HG2 GLU 14 64.271 1.316 11.353 94 HG3 GLU 14 HG3 GLU 14 64.614 3.020 11.065 95 H PHE 15 H PHE 15 67.884 0.442 8.335 96 HA PHE 15 HA PHE 15 67.366 1.330 5.728 97 HB2 PHE 15 HB2 PHE 15 69.456 1.649 7.151 98 HB3 PHE 15 HB3 PHE 15 69.892 0.009 6.701 99 HD1 PHE 15 HD1 PHE 15 68.861 3.224 5.122 100 HD2 PHE 15 HD2 PHE 15 71.265 -0.254 4.916 101 HE1 PHE 15 HE1 PHE 15 69.976 4.127 3.118 102 HE2 PHE 15 HE2 PHE 15 72.388 0.636 2.903 103 HZ PHE 15 HZ PHE 15 71.737 2.831 2.015 104 H VAL 16 H VAL 16 68.490 -1.862 6.975 105 HA VAL 16 HA VAL 16 68.440 -3.126 4.478 106 HB VAL 16 HB VAL 16 68.566 -5.223 5.494 107 HG11 VAL 16 HG11 VAL 16 70.572 -4.262 5.791 108 HG12 VAL 16 HG12 VAL 16 70.207 -5.067 7.319 109 HG13 VAL 16 HG13 VAL 16 70.039 -3.314 7.174 110 HG21 VAL 16 HG21 VAL 16 66.788 -5.332 6.796 111 HG22 VAL 16 HG22 VAL 16 67.316 -4.023 7.846 112 HG23 VAL 16 HG23 VAL 16 68.147 -5.632 7.910 113 H GLN 17 H GLN 17 65.786 -2.581 6.778 114 HA GLN 17 HA GLN 17 63.922 -4.376 5.693 115 HB2 GLN 17 HB2 GLN 17 63.901 -3.143 7.916 116 HB3 GLN 17 HB3 GLN 17 63.369 -1.735 7.003 117 HG2 GLN 17 HG2 GLN 17 61.527 -3.181 6.133 118 HG3 GLN 17 HG3 GLN 17 62.015 -4.345 7.372 119 HE21 GLN 17 HE21 GLN 17 62.042 -0.840 7.709 120 HE22 GLN 17 HE22 GLN 17 60.839 -0.744 8.898 121 H LEU 18 H LEU 18 64.718 -0.999 5.219 122 HA LEU 18 HA LEU 18 62.679 -0.339 3.455 123 HB2 LEU 18 HB2 LEU 18 64.295 1.127 4.784 124 HB3 LEU 18 HB3 LEU 18 65.464 0.881 3.549 125 HG LEU 18 HG LEU 18 64.385 3.039 3.341 126 HD11 LEU 18 HD11 LEU 18 63.772 3.005 0.999 127 HD12 LEU 18 HD12 LEU 18 63.707 1.243 1.053 128 HD13 LEU 18 HD13 LEU 18 65.236 2.079 1.330 129 HD21 LEU 18 HD21 LEU 18 61.849 1.485 2.895 130 HD22 LEU 18 HD22 LEU 18 62.044 3.219 2.664 131 HD23 LEU 18 HD23 LEU 18 62.226 2.525 4.272 132 H LEU 19 H LEU 19 65.896 -1.530 3.116 133 HA LEU 19 HA LEU 19 66.113 -1.575 0.327 134 HB2 LEU 19 HB2 LEU 19 67.370 -3.165 2.478 135 HB3 LEU 19 HB3 LEU 19 67.995 -3.173 0.830 136 HG LEU 19 HG LEU 19 67.904 -0.956 2.857 137 HD11 LEU 19 HD11 LEU 19 70.231 -0.791 2.514 138 HD12 LEU 19 HD12 LEU 19 70.172 -2.053 1.297 139 HD13 LEU 19 HD13 LEU 19 69.782 -2.429 2.977 140 HD21 LEU 19 HD21 LEU 19 68.483 -0.691 -0.050 141 HD22 LEU 19 HD22 LEU 19 68.842 0.509 1.207 142 HD23 LEU 19 HD23 LEU 19 67.164 0.049 0.887 143 H LYS 20 H LYS 20 64.824 -3.947 2.610 144 HA LYS 20 HA LYS 20 64.511 -6.016 0.721 145 HB2 LYS 20 HB2 LYS 20 62.886 -5.540 3.225 146 HB3 LYS 20 HB3 LYS 20 62.824 -6.995 2.258 147 HG2 LYS 20 HG2 LYS 20 65.402 -7.063 2.763 148 HG3 LYS 20 HG3 LYS 20 64.940 -5.995 4.070 149 HD2 LYS 20 HD2 LYS 20 63.327 -7.557 4.938 150 HD3 LYS 20 HD3 LYS 20 63.610 -8.661 3.597 151 HE2 LYS 20 HE2 LYS 20 64.802 -9.511 5.465 152 HE3 LYS 20 HE3 LYS 20 65.988 -8.820 4.365 153 HZ1 LYS 20 HZ1 LYS 20 66.506 -8.164 6.585 154 HZ2 LYS 20 HZ2 LYS 20 64.949 -7.653 6.860 155 HZ3 LYS 20 HZ3 LYS 20 65.924 -6.770 5.805 156 H GLU 21 H GLU 21 62.443 -3.331 1.710 157 HA GLU 21 HA GLU 21 60.328 -4.284 0.126 158 HB2 GLU 21 HB2 GLU 21 59.213 -2.099 0.511 159 HB3 GLU 21 HB3 GLU 21 59.702 -2.903 1.999 160 HG2 GLU 21 HG2 GLU 21 61.662 -1.407 2.053 161 HG3 GLU 21 HG3 GLU 21 61.021 -0.579 0.642 162 H ILE 22 H ILE 22 62.977 -2.142 -0.499 163 HA ILE 22 HA ILE 22 62.122 -1.262 -3.063 164 HB ILE 22 HB ILE 22 65.018 -1.832 -2.342 165 HG12 ILE 22 HG12 ILE 22 63.397 0.666 -1.806 166 HG13 ILE 22 HG13 ILE 22 64.045 -0.424 -0.606 167 HG21 ILE 22 HG21 ILE 22 64.699 -1.394 -4.684 168 HG22 ILE 22 HG22 ILE 22 65.392 0.075 -3.967 169 HG23 ILE 22 HG23 ILE 22 63.681 -0.008 -4.330 170 HD11 ILE 22 HD11 ILE 22 65.383 1.596 -0.779 171 HD12 ILE 22 HD12 ILE 22 65.685 1.257 -2.482 172 HD13 ILE 22 HD13 ILE 22 66.313 0.169 -1.242 173 H GLU 23 H GLU 23 64.026 -4.081 -2.003 174 HA GLU 23 HA GLU 23 64.574 -5.172 -4.466 175 HB2 GLU 23 HB2 GLU 23 65.695 -6.006 -2.570 176 HB3 GLU 23 HB3 GLU 23 64.191 -6.307 -1.712 177 HG2 GLU 23 HG2 GLU 23 63.610 -7.931 -3.284 178 HG3 GLU 23 HG3 GLU 23 65.154 -7.782 -4.139 179 H LYS 24 H LYS 24 61.810 -5.486 -2.341 180 HA LYS 24 HA LYS 24 60.453 -7.547 -3.642 181 HB2 LYS 24 HB2 LYS 24 59.946 -6.703 -1.352 182 HB3 LYS 24 HB3 LYS 24 59.251 -5.260 -2.072 183 HG2 LYS 24 HG2 LYS 24 57.419 -6.668 -1.570 184 HG3 LYS 24 HG3 LYS 24 57.716 -6.777 -3.316 185 HD2 LYS 24 HD2 LYS 24 58.956 -8.856 -2.984 186 HD3 LYS 24 HD3 LYS 24 58.613 -8.780 -1.257 187 HE2 LYS 24 HE2 LYS 24 56.589 -9.023 -3.478 188 HE3 LYS 24 HE3 LYS 24 57.080 -10.306 -2.380 189 HZ1 LYS 24 HZ1 LYS 24 56.132 -8.988 -0.537 190 HZ2 LYS 24 HZ2 LYS 24 54.993 -9.360 -1.733 191 HZ3 LYS 24 HZ3 LYS 24 55.604 -7.822 -1.651 192 H GLU 25 H GLU 25 60.183 -3.994 -4.026 193 HA GLU 25 HA GLU 25 58.255 -4.415 -6.080 194 HB2 GLU 25 HB2 GLU 25 58.338 -1.860 -6.311 195 HB3 GLU 25 HB3 GLU 25 57.752 -2.482 -4.748 196 HG2 GLU 25 HG2 GLU 25 59.113 -0.696 -4.240 197 HG3 GLU 25 HG3 GLU 25 60.244 -2.046 -4.106 198 H ASN 26 H ASN 26 61.651 -3.942 -5.969 199 HA ASN 26 HA ASN 26 62.069 -3.224 -8.655 200 HB2 ASN 26 HB2 ASN 26 63.900 -3.115 -7.025 201 HB3 ASN 26 HB3 ASN 26 63.847 -4.860 -6.816 202 HD21 ASN 26 HD21 ASN 26 65.975 -5.146 -7.442 203 HD22 ASN 26 HD22 ASN 26 66.491 -4.985 -9.081 204 H VAL 27 H VAL 27 61.785 -6.408 -7.114 205 HA VAL 27 HA VAL 27 62.108 -7.725 -9.629 206 HB VAL 27 HB VAL 27 61.574 -9.849 -8.482 207 HG11 VAL 27 HG11 VAL 27 63.567 -8.121 -7.032 208 HG12 VAL 27 HG12 VAL 27 63.860 -9.073 -8.487 209 HG13 VAL 27 HG13 VAL 27 63.506 -9.882 -6.961 210 HG21 VAL 27 HG21 VAL 27 61.204 -8.144 -6.013 211 HG22 VAL 27 HG22 VAL 27 61.229 -9.909 -6.051 212 HG23 VAL 27 HG23 VAL 27 59.933 -9.025 -6.858 213 H ALA 28 H ALA 28 59.331 -6.777 -7.688 214 HA ALA 28 HA ALA 28 57.369 -8.040 -9.317 215 HB1 ALA 28 HB1 ALA 28 55.791 -6.474 -8.249 216 HB2 ALA 28 HB2 ALA 28 57.147 -5.552 -7.607 217 HB3 ALA 28 HB3 ALA 28 56.867 -7.203 -7.057 218 H ALA 29 H ALA 29 59.130 -5.128 -9.418 219 HA ALA 29 HA ALA 29 59.757 -3.754 -10.916 220 HB1 ALA 29 HB1 ALA 29 59.437 -3.961 -13.233 221 HB2 ALA 29 HB2 ALA 29 58.089 -5.084 -13.020 222 HB3 ALA 29 HB3 ALA 29 59.736 -5.573 -12.574 223 H THR 30 H THR 30 58.888 -2.120 -9.812 224 HA THR 30 HA THR 30 56.492 -1.014 -11.073 225 HB THR 30 HB THR 30 56.109 0.281 -9.105 226 HG1 THR 30 HG1 THR 30 58.639 -0.337 -7.870 227 HG21 THR 30 HG21 THR 30 56.272 -1.260 -7.200 228 HG22 THR 30 HG22 THR 30 57.348 -2.277 -8.167 229 HG23 THR 30 HG23 THR 30 55.662 -2.061 -8.660 230 H ASP 31 H ASP 31 56.797 1.504 -11.188 231 HA ASP 31 HA ASP 31 59.616 2.131 -11.426 232 HB2 ASP 31 HB2 ASP 31 59.445 3.269 -13.493 233 HB3 ASP 31 HB3 ASP 31 58.742 1.687 -13.740 234 H ASP 32 H ASP 32 56.754 2.792 -10.060 235 HA ASP 32 HA ASP 32 57.158 5.636 -9.900 236 HB2 ASP 32 HB2 ASP 32 55.095 5.699 -8.573 237 HB3 ASP 32 HB3 ASP 32 54.820 4.805 -10.057 238 H VAL 33 H VAL 33 56.905 3.010 -7.567 239 HA VAL 33 HA VAL 33 58.171 4.722 -5.630 240 HB VAL 33 HB VAL 33 56.323 3.216 -5.028 241 HG11 VAL 33 HG11 VAL 33 56.830 1.254 -6.268 242 HG12 VAL 33 HG12 VAL 33 56.754 0.846 -4.543 243 HG13 VAL 33 HG13 VAL 33 58.319 1.026 -5.347 244 HG21 VAL 33 HG21 VAL 33 58.846 2.805 -3.456 245 HG22 VAL 33 HG22 VAL 33 57.226 2.475 -2.856 246 HG23 VAL 33 HG23 VAL 33 57.693 4.126 -3.275 247 H LEU 34 H LEU 34 58.981 2.172 -7.722 248 HA LEU 34 HA LEU 34 61.507 1.363 -6.824 249 HB2 LEU 34 HB2 LEU 34 60.252 0.313 -8.605 250 HB3 LEU 34 HB3 LEU 34 60.294 1.658 -9.601 251 HG LEU 34 HG LEU 34 61.702 -0.219 -10.332 252 HD11 LEU 34 HD11 LEU 34 63.692 1.044 -10.918 253 HD12 LEU 34 HD12 LEU 34 63.162 2.315 -9.801 254 HD13 LEU 34 HD13 LEU 34 62.166 1.888 -11.198 255 HD21 LEU 34 HD21 LEU 34 62.452 -1.034 -8.179 256 HD22 LEU 34 HD22 LEU 34 63.386 0.437 -7.922 257 HD23 LEU 34 HD23 LEU 34 63.835 -0.680 -9.214 258 H ASP 35 H ASP 35 60.587 4.037 -8.866 259 HA ASP 35 HA ASP 35 63.253 5.119 -9.145 260 HB2 ASP 35 HB2 ASP 35 61.223 5.859 -10.561 261 HB3 ASP 35 HB3 ASP 35 60.753 6.710 -9.080 262 H VAL 36 H VAL 36 60.753 5.750 -6.859 263 HA VAL 36 HA VAL 36 62.014 7.875 -5.495 264 HB VAL 36 HB VAL 36 60.361 5.709 -4.250 265 HG11 VAL 36 HG11 VAL 36 59.721 7.432 -2.707 266 HG12 VAL 36 HG12 VAL 36 60.815 8.548 -3.595 267 HG13 VAL 36 HG13 VAL 36 61.480 7.125 -2.762 268 HG21 VAL 36 HG21 VAL 36 59.498 8.189 -5.588 269 HG22 VAL 36 HG22 VAL 36 58.518 7.062 -4.581 270 HG23 VAL 36 HG23 VAL 36 59.264 6.491 -6.104 271 H LEU 37 H LEU 37 61.918 4.420 -4.903 272 HA LEU 37 HA LEU 37 63.345 4.609 -2.502 273 HB2 LEU 37 HB2 LEU 37 63.036 2.220 -4.238 274 HB3 LEU 37 HB3 LEU 37 63.471 2.377 -2.551 275 HG LEU 37 HG LEU 37 60.757 3.219 -3.486 276 HD11 LEU 37 HD11 LEU 37 61.482 0.676 -2.021 277 HD12 LEU 37 HD12 LEU 37 60.991 0.782 -3.707 278 HD13 LEU 37 HD13 LEU 37 59.860 1.222 -2.431 279 HD21 LEU 37 HD21 LEU 37 60.239 3.235 -1.077 280 HD22 LEU 37 HD22 LEU 37 61.509 4.377 -1.494 281 HD23 LEU 37 HD23 LEU 37 61.921 2.841 -0.727 282 H LEU 38 H LEU 38 64.185 3.746 -5.753 283 HA LEU 38 HA LEU 38 66.807 3.028 -5.277 284 HB2 LEU 38 HB2 LEU 38 65.321 4.126 -7.570 285 HB3 LEU 38 HB3 LEU 38 67.029 3.848 -7.772 286 HG LEU 38 HG LEU 38 64.699 1.997 -7.433 287 HD11 LEU 38 HD11 LEU 38 65.394 2.593 -9.647 288 HD12 LEU 38 HD12 LEU 38 65.647 0.869 -9.336 289 HD13 LEU 38 HD13 LEU 38 67.016 1.982 -9.300 290 HD21 LEU 38 HD21 LEU 38 66.185 0.055 -7.132 291 HD22 LEU 38 HD22 LEU 38 66.223 1.137 -5.750 292 HD23 LEU 38 HD23 LEU 38 67.555 1.137 -6.907 293 H GLU 39 H GLU 39 65.509 6.249 -6.162 294 HA GLU 39 HA GLU 39 68.104 7.376 -5.889 295 HB2 GLU 39 HB2 GLU 39 66.996 9.583 -6.061 296 HB3 GLU 39 HB3 GLU 39 66.719 8.505 -7.408 297 HG2 GLU 39 HG2 GLU 39 64.529 8.215 -6.919 298 HG3 GLU 39 HG3 GLU 39 64.627 8.689 -5.247 299 H HIS 40 H HIS 40 65.412 7.066 -3.750 300 HA HIS 40 HA HIS 40 66.300 8.891 -1.786 301 HB2 HIS 40 HB2 HIS 40 64.011 7.842 -2.131 302 HB3 HIS 40 HB3 HIS 40 64.550 6.451 -1.274 303 HD1 HIS 40 HD1 HIS 40 62.892 9.578 -0.727 304 HD2 HIS 40 HD2 HIS 40 65.560 7.266 1.463 305 HE1 HIS 40 HE1 HIS 40 62.689 10.331 1.668 306 H PHE 41 H PHE 41 66.822 5.498 -2.294 307 HA PHE 41 HA PHE 41 68.324 4.971 -0.012 308 HB2 PHE 41 HB2 PHE 41 67.528 3.158 -1.202 309 HB3 PHE 41 HB3 PHE 41 68.092 3.801 -2.734 310 HD1 PHE 41 HD1 PHE 41 69.343 2.516 0.521 311 HD2 PHE 41 HD2 PHE 41 70.023 2.919 -3.640 312 HE1 PHE 41 HE1 PHE 41 71.342 1.092 0.708 313 HE2 PHE 41 HE2 PHE 41 72.012 1.520 -3.448 314 HZ PHE 41 HZ PHE 41 72.678 0.599 -1.295 315 H VAL 42 H VAL 42 69.410 5.892 -3.274 316 HA VAL 42 HA VAL 42 72.103 6.020 -2.399 317 HB VAL 42 HB VAL 42 71.698 5.471 -4.659 318 HG11 VAL 42 HG11 VAL 42 70.498 8.135 -5.082 319 HG12 VAL 42 HG12 VAL 42 69.778 6.494 -5.146 320 HG13 VAL 42 HG13 VAL 42 71.015 6.959 -6.319 321 HG21 VAL 42 HG21 VAL 42 73.226 6.969 -5.855 322 HG22 VAL 42 HG22 VAL 42 73.823 6.507 -4.262 323 HG23 VAL 42 HG23 VAL 42 73.119 8.103 -4.511 324 H LYS 43 H LYS 43 69.714 8.403 -2.521 325 HA LYS 43 HA LYS 43 71.539 10.577 -2.072 326 HB2 LYS 43 HB2 LYS 43 69.661 11.978 -1.551 327 HB3 LYS 43 HB3 LYS 43 69.104 10.860 -2.789 328 HG2 LYS 43 HG2 LYS 43 68.155 9.441 -0.845 329 HG3 LYS 43 HG3 LYS 43 68.555 10.808 0.147 330 HD2 LYS 43 HD2 LYS 43 66.759 11.051 -2.240 331 HD3 LYS 43 HD3 LYS 43 66.168 10.735 -0.613 332 HE2 LYS 43 HE2 LYS 43 67.328 12.845 0.102 333 HE3 LYS 43 HE3 LYS 43 67.659 13.148 -1.604 334 HZ1 LYS 43 HZ1 LYS 43 65.671 14.299 -0.899 335 HZ2 LYS 43 HZ2 LYS 43 64.986 12.853 -0.376 336 HZ3 LYS 43 HZ3 LYS 43 65.274 13.106 -2.021 337 H ILE 44 H ILE 44 70.117 8.315 0.149 338 HA ILE 44 HA ILE 44 71.020 9.862 2.422 339 HB ILE 44 HB ILE 44 70.195 7.890 3.793 340 HG12 ILE 44 HG12 ILE 44 69.258 7.003 1.070 341 HG13 ILE 44 HG13 ILE 44 70.397 6.150 2.079 342 HG21 ILE 44 HG21 ILE 44 68.233 9.207 1.918 343 HG22 ILE 44 HG22 ILE 44 68.839 9.886 3.426 344 HG23 ILE 44 HG23 ILE 44 67.827 8.439 3.453 345 HD11 ILE 44 HD11 ILE 44 67.472 6.583 2.575 346 HD12 ILE 44 HD12 ILE 44 68.564 5.770 3.692 347 HD13 ILE 44 HD13 ILE 44 68.248 5.073 2.099 348 H THR 45 H THR 45 72.045 6.866 0.816 349 HA THR 45 HA THR 45 74.255 6.701 2.667 350 HB THR 45 HB THR 45 73.393 4.559 1.954 351 HG1 THR 45 HG1 THR 45 75.983 5.325 1.436 352 HG21 THR 45 HG21 THR 45 72.511 5.197 -0.255 353 HG22 THR 45 HG22 THR 45 73.549 3.779 -0.376 354 HG23 THR 45 HG23 THR 45 74.156 5.361 -0.866 355 H GLU 46 H GLU 46 73.679 7.972 -0.496 356 HA GLU 46 HA GLU 46 74.804 9.160 -1.939 357 HB2 GLU 46 HB2 GLU 46 76.601 9.583 0.396 358 HB3 GLU 46 HB3 GLU 46 76.699 10.543 -1.091 359 HG2 GLU 46 HG2 GLU 46 74.389 11.250 -0.677 360 HG3 GLU 46 HG3 GLU 46 74.388 10.294 0.791 361 H HIS 47 H HIS 47 75.361 6.390 -1.630 362 HA HIS 47 HA HIS 47 78.107 5.914 -2.262 363 HB2 HIS 47 HB2 HIS 47 76.471 4.238 -1.220 364 HB3 HIS 47 HB3 HIS 47 75.732 4.098 -2.807 365 HD1 HIS 47 HD1 HIS 47 76.876 2.444 -4.444 366 HD2 HIS 47 HD2 HIS 47 79.104 3.276 -1.057 367 HE1 HIS 47 HE1 HIS 47 78.940 1.004 -4.566 368 HA PRO 48 HA PRO 48 77.629 7.395 -6.505 369 HB2 PRO 48 HB2 PRO 48 79.805 5.546 -7.144 370 HB3 PRO 48 HB3 PRO 48 79.746 7.300 -7.360 371 HG2 PRO 48 HG2 PRO 48 81.209 6.039 -5.601 372 HG3 PRO 48 HG3 PRO 48 80.435 7.574 -5.086 373 HD2 PRO 48 HD2 PRO 48 79.679 4.713 -4.577 374 HD3 PRO 48 HD3 PRO 48 79.647 6.058 -3.431 375 H ASP 49 H ASP 49 77.478 4.195 -5.611 376 HA ASP 49 HA ASP 49 76.716 3.453 -8.236 377 HB2 ASP 49 HB2 ASP 49 78.098 1.631 -6.238 378 HB3 ASP 49 HB3 ASP 49 77.618 1.163 -7.851 379 H GLY 50 H GLY 50 75.293 4.485 -5.955 380 HA2 GLY 50 HA2 GLY 50 74.086 2.834 -4.015 381 HA3 GLY 50 HA3 GLY 50 73.374 4.234 -4.775 382 H THR 51 H THR 51 72.871 3.586 -7.093 383 HA THR 51 HA THR 51 70.640 1.894 -6.483 384 HB THR 51 HB THR 51 71.109 2.851 -9.294 385 HG1 THR 51 HG1 THR 51 71.418 4.804 -8.309 386 HG21 THR 51 HG21 THR 51 69.147 1.501 -8.658 387 HG22 THR 51 HG22 THR 51 68.678 3.130 -9.144 388 HG23 THR 51 HG23 THR 51 68.716 2.695 -7.454 389 H ALA 52 H ALA 52 73.624 1.638 -8.190 390 HA ALA 52 HA ALA 52 73.240 -0.732 -9.642 391 HB1 ALA 52 HB1 ALA 52 75.655 -0.882 -9.652 392 HB2 ALA 52 HB2 ALA 52 75.749 0.322 -8.367 393 HB3 ALA 52 HB3 ALA 52 75.147 0.780 -9.963 394 H LEU 53 H LEU 53 74.295 -0.165 -6.324 395 HA LEU 53 HA LEU 53 74.868 -2.827 -5.620 396 HB2 LEU 53 HB2 LEU 53 73.831 -0.618 -3.878 397 HB3 LEU 53 HB3 LEU 53 74.371 -2.168 -3.272 398 HG LEU 53 HG LEU 53 76.016 -0.017 -4.577 399 HD11 LEU 53 HD11 LEU 53 76.157 -1.375 -1.904 400 HD12 LEU 53 HD12 LEU 53 75.553 0.249 -2.234 401 HD13 LEU 53 HD13 LEU 53 77.257 -0.127 -2.494 402 HD21 LEU 53 HD21 LEU 53 76.862 -2.841 -3.909 403 HD22 LEU 53 HD22 LEU 53 77.951 -1.526 -4.336 404 HD23 LEU 53 HD23 LEU 53 76.795 -2.121 -5.522 405 H ILE 54 H ILE 54 71.782 -1.151 -5.557 406 HA ILE 54 HA ILE 54 70.413 -3.359 -4.304 407 HB ILE 54 HB ILE 54 69.322 -0.993 -5.850 408 HG12 ILE 54 HG12 ILE 54 69.019 -1.784 -2.960 409 HG13 ILE 54 HG13 ILE 54 70.201 -0.617 -3.494 410 HG21 ILE 54 HG21 ILE 54 67.798 -2.862 -6.276 411 HG22 ILE 54 HG22 ILE 54 67.044 -1.677 -5.209 412 HG23 ILE 54 HG23 ILE 54 67.685 -3.180 -4.544 413 HD11 ILE 54 HD11 ILE 54 68.310 0.513 -2.611 414 HD12 ILE 54 HD12 ILE 54 67.230 -0.428 -3.638 415 HD13 ILE 54 HD13 ILE 54 68.323 0.755 -4.363 416 H TYR 55 H TYR 55 70.866 -2.327 -7.570 417 HA TYR 55 HA TYR 55 69.339 -4.286 -8.829 418 HB2 TYR 55 HB2 TYR 55 71.512 -2.461 -9.621 419 HB3 TYR 55 HB3 TYR 55 71.119 -3.757 -10.719 420 HD1 TYR 55 HD1 TYR 55 68.407 -3.957 -11.038 421 HD2 TYR 55 HD2 TYR 55 70.519 -0.423 -10.003 422 HE1 TYR 55 HE1 TYR 55 66.555 -2.613 -11.897 423 HE2 TYR 55 HE2 TYR 55 68.684 0.944 -10.850 424 HH TYR 55 HH TYR 55 66.816 0.675 -12.515 425 H GLU 56 H GLU 56 72.801 -4.263 -7.967 426 HA GLU 56 HA GLU 56 73.195 -6.785 -9.155 427 HB2 GLU 56 HB2 GLU 56 75.422 -6.799 -8.113 428 HB3 GLU 56 HB3 GLU 56 75.109 -5.311 -8.983 429 HG2 GLU 56 HG2 GLU 56 75.998 -4.360 -7.145 430 HG3 GLU 56 HG3 GLU 56 74.384 -4.603 -6.502 431 H ALA 57 H ALA 57 72.388 -5.768 -5.926 432 HA ALA 57 HA ALA 57 72.710 -8.163 -4.577 433 HB1 ALA 57 HB1 ALA 57 70.491 -6.165 -4.194 434 HB2 ALA 57 HB2 ALA 57 72.112 -6.029 -3.519 435 HB3 ALA 57 HB3 ALA 57 71.053 -7.347 -3.007 436 H ALA 58 H ALA 58 69.929 -6.994 -6.402 437 HA ALA 58 HA ALA 58 68.304 -9.251 -5.920 438 HB1 ALA 58 HB1 ALA 58 66.894 -8.400 -7.729 439 HB2 ALA 58 HB2 ALA 58 68.180 -7.285 -8.203 440 HB3 ALA 58 HB3 ALA 58 67.386 -7.101 -6.640 441 H ALA 59 H ALA 59 70.540 -8.441 -8.519 442 HA ALA 59 HA ALA 59 69.943 -10.668 -10.164 443 HB1 ALA 59 HB1 ALA 59 71.983 -10.092 -11.352 444 HB2 ALA 59 HB2 ALA 59 72.484 -9.059 -10.013 445 HB3 ALA 59 HB3 ALA 59 71.061 -8.637 -10.962 446 H ARG 60 H ARG 60 72.452 -10.077 -7.761 447 HA ARG 60 HA ARG 60 73.765 -12.559 -8.057 448 HB2 ARG 60 HB2 ARG 60 73.805 -10.556 -5.803 449 HB3 ARG 60 HB3 ARG 60 74.853 -11.972 -5.887 450 HG2 ARG 60 HG2 ARG 60 75.932 -11.142 -7.828 451 HG3 ARG 60 HG3 ARG 60 74.751 -9.840 -7.997 452 HD2 ARG 60 HD2 ARG 60 76.845 -9.020 -7.050 453 HD3 ARG 60 HD3 ARG 60 75.518 -8.864 -5.902 454 HE ARG 60 HE ARG 60 76.968 -11.291 -5.592 455 HH11 ARG 60 HH11 ARG 60 77.045 -7.818 -4.782 456 HH12 ARG 60 HH12 ARG 60 77.995 -8.035 -3.399 457 HH21 ARG 60 HH21 ARG 60 78.275 -11.572 -3.734 458 HH22 ARG 60 HH22 ARG 60 78.736 -10.237 -2.774 459 H ALA 61 H ALA 61 71.082 -11.507 -6.093 460 HA ALA 61 HA ALA 61 71.085 -13.825 -4.442 461 HB1 ALA 61 HB1 ALA 61 70.046 -11.753 -3.732 462 HB2 ALA 61 HB2 ALA 61 68.882 -13.079 -3.706 463 HB3 ALA 61 HB3 ALA 61 68.843 -11.891 -5.017 464 H ALA 62 H ALA 62 69.589 -12.958 -7.487 465 HA ALA 62 HA ALA 62 67.731 -15.022 -7.718 466 HB1 ALA 62 HB1 ALA 62 67.780 -14.607 -10.125 467 HB2 ALA 62 HB2 ALA 62 69.289 -13.706 -9.948 468 HB3 ALA 62 HB3 ALA 62 67.802 -13.082 -9.237 469 H ALA 63 H ALA 63 71.122 -14.922 -8.623 470 HA ALA 63 HA ALA 63 71.097 -17.842 -8.578 471 HB1 ALA 63 HB1 ALA 63 72.798 -17.891 -10.348 472 HB2 ALA 63 HB2 ALA 63 72.689 -16.139 -10.507 473 HB3 ALA 63 HB3 ALA 63 71.304 -17.150 -10.935 474 H ASN 64 H ASN 64 71.610 -17.353 -6.366 475 HA ASN 64 HA ASN 64 74.021 -15.938 -5.842 476 HB2 ASN 64 HB2 ASN 64 73.732 -16.510 -3.453 477 HB3 ASN 64 HB3 ASN 64 72.361 -15.713 -4.200 478 HD21 ASN 64 HD21 ASN 64 70.405 -16.796 -4.292 479 HD22 ASN 64 HD22 ASN 64 70.132 -18.308 -3.519 480 HA PRO 65 HA PRO 65 76.476 -19.388 -6.127 481 HB2 PRO 65 HB2 PRO 65 78.919 -18.124 -5.889 482 HB3 PRO 65 HB3 PRO 65 77.992 -18.213 -7.390 483 HG2 PRO 65 HG2 PRO 65 78.304 -15.949 -5.496 484 HG3 PRO 65 HG3 PRO 65 77.997 -15.918 -7.235 485 HD2 PRO 65 HD2 PRO 65 76.107 -15.524 -5.198 486 HD3 PRO 65 HD3 PRO 65 75.764 -15.827 -6.913 487 H GLY 66 H GLY 66 76.780 -16.935 -3.673 488 HA2 GLY 66 HA2 GLY 66 77.720 -18.923 -1.716 489 HA3 GLY 66 HA3 GLY 66 78.046 -17.192 -1.599 490 H GLY 67 H GLY 67 76.363 -15.788 -1.056 491 HA2 GLY 67 HA2 GLY 67 73.745 -16.191 -0.715 492 HA3 GLY 67 HA3 GLY 67 74.444 -17.142 0.597 493 H ASP 68 H ASP 68 76.651 -15.340 1.066 494 HA ASP 68 HA ASP 68 75.401 -13.535 2.868 495 HB2 ASP 68 HB2 ASP 68 77.659 -14.418 3.281 496 HB3 ASP 68 HB3 ASP 68 78.262 -13.566 1.861 497 H GLY 69 H GLY 69 76.721 -13.245 -0.317 498 HA2 GLY 69 HA2 GLY 69 75.926 -10.427 -0.452 499 HA3 GLY 69 HA3 GLY 69 76.950 -11.267 -1.627 500 H GLY 70 H GLY 70 74.578 -9.727 -2.092 501 HA2 GLY 70 HA2 GLY 70 72.973 -10.078 -3.756 502 HA3 GLY 70 HA3 GLY 70 73.014 -11.805 -3.398 503 H GLY 71 H GLY 71 72.271 -8.720 -1.746 504 HA2 GLY 71 HA2 GLY 71 69.689 -9.284 -1.282 505 HA3 GLY 71 HA3 GLY 71 70.524 -10.049 0.056 506 HA PRO 72 HA PRO 72 69.405 -5.445 0.542 507 HB2 PRO 72 HB2 PRO 72 67.618 -5.897 2.599 508 HB3 PRO 72 HB3 PRO 72 67.212 -5.721 0.883 509 HG2 PRO 72 HG2 PRO 72 67.552 -8.225 2.476 510 HG3 PRO 72 HG3 PRO 72 66.336 -7.822 1.250 511 HD2 PRO 72 HD2 PRO 72 68.431 -9.366 0.707 512 HD3 PRO 72 HD3 PRO 72 67.790 -8.250 -0.506 513 H GLU 73 H GLU 73 70.143 -8.020 2.832 514 HA GLU 73 HA GLU 73 71.319 -6.096 4.728 515 HB2 GLU 73 HB2 GLU 73 71.016 -9.100 4.967 516 HB3 GLU 73 HB3 GLU 73 71.450 -7.967 6.242 517 HG2 GLU 73 HG2 GLU 73 69.257 -6.931 6.069 518 HG3 GLU 73 HG3 GLU 73 68.803 -8.090 4.822 519 H GLY 74 H GLY 74 72.301 -7.557 1.991 520 HA2 GLY 74 HA2 GLY 74 74.913 -7.638 3.183 521 HA3 GLY 74 HA3 GLY 74 74.587 -8.472 1.608 522 H ILE 75 H ILE 75 73.165 -6.107 0.649 523 HA ILE 75 HA ILE 75 75.220 -4.496 -0.319 524 HB ILE 75 HB ILE 75 73.410 -2.734 -0.670 525 HG12 ILE 75 HG12 ILE 75 71.678 -4.975 0.359 526 HG13 ILE 75 HG13 ILE 75 71.935 -3.422 1.135 527 HG21 ILE 75 HG21 ILE 75 72.324 -3.999 -2.424 528 HG22 ILE 75 HG22 ILE 75 73.073 -5.478 -1.787 529 HG23 ILE 75 HG23 ILE 75 74.083 -4.157 -2.414 530 HD11 ILE 75 HD11 ILE 75 69.815 -3.564 0.044 531 HD12 ILE 75 HD12 ILE 75 70.591 -3.859 -1.521 532 HD13 ILE 75 HD13 ILE 75 70.826 -2.311 -0.667 533 H VAL 76 H VAL 76 73.400 -4.262 2.700 534 HA VAL 76 HA VAL 76 74.077 -1.710 3.350 535 HB VAL 76 HB VAL 76 73.570 -2.436 5.568 536 HG11 VAL 76 HG11 VAL 76 71.269 -2.595 5.235 537 HG12 VAL 76 HG12 VAL 76 71.527 -3.444 3.716 538 HG13 VAL 76 HG13 VAL 76 71.920 -1.734 3.835 539 HG21 VAL 76 HG21 VAL 76 74.308 -4.655 5.629 540 HG22 VAL 76 HG22 VAL 76 73.096 -5.122 4.432 541 HG23 VAL 76 HG23 VAL 76 72.600 -4.565 6.042 542 H LYS 77 H LYS 77 75.672 -4.712 3.843 543 HA LYS 77 HA LYS 77 77.698 -3.809 5.575 544 HB2 LYS 77 HB2 LYS 77 77.045 -6.180 5.175 545 HB3 LYS 77 HB3 LYS 77 77.737 -6.068 3.570 546 HG2 LYS 77 HG2 LYS 77 79.947 -5.614 4.613 547 HG3 LYS 77 HG3 LYS 77 79.193 -5.885 6.185 548 HD2 LYS 77 HD2 LYS 77 79.174 -7.875 3.952 549 HD3 LYS 77 HD3 LYS 77 80.375 -7.890 5.255 550 HE2 LYS 77 HE2 LYS 77 77.378 -8.203 5.535 551 HE3 LYS 77 HE3 LYS 77 78.562 -9.495 5.649 552 HZ1 LYS 77 HZ1 LYS 77 77.875 -8.754 7.832 553 HZ2 LYS 77 HZ2 LYS 77 78.342 -7.185 7.522 554 HZ3 LYS 77 HZ3 LYS 77 79.500 -8.408 7.600 555 H GLU 78 H GLU 78 77.344 -4.000 2.069 556 HA GLU 78 HA GLU 78 79.974 -3.147 1.429 557 HB2 GLU 78 HB2 GLU 78 78.205 -4.326 -0.085 558 HB3 GLU 78 HB3 GLU 78 77.566 -2.743 -0.445 559 HG2 GLU 78 HG2 GLU 78 79.086 -3.388 -2.148 560 HG3 GLU 78 HG3 GLU 78 79.811 -2.068 -1.224 561 H ILE 79 H ILE 79 76.897 -1.544 1.859 562 HA ILE 79 HA ILE 79 77.582 1.071 1.224 563 HB ILE 79 HB ILE 79 75.497 -0.097 3.044 564 HG12 ILE 79 HG12 ILE 79 75.152 -0.427 0.657 565 HG13 ILE 79 HG13 ILE 79 73.914 0.628 1.322 566 HG21 ILE 79 HG21 ILE 79 75.952 2.033 4.040 567 HG22 ILE 79 HG22 ILE 79 74.388 2.082 3.227 568 HG23 ILE 79 HG23 ILE 79 75.793 2.836 2.476 569 HD11 ILE 79 HD11 ILE 79 76.296 1.450 -0.326 570 HD12 ILE 79 HD12 ILE 79 75.181 2.562 0.453 571 HD13 ILE 79 HD13 ILE 79 74.596 1.477 -0.805 572 H LYS 80 H LYS 80 77.661 -0.611 4.359 573 HA LYS 80 HA LYS 80 78.345 1.693 5.793 574 HB2 LYS 80 HB2 LYS 80 78.607 0.307 7.736 575 HB3 LYS 80 HB3 LYS 80 77.340 -0.408 6.754 576 HG2 LYS 80 HG2 LYS 80 78.859 -2.076 5.938 577 HG3 LYS 80 HG3 LYS 80 80.163 -1.374 6.885 578 HD2 LYS 80 HD2 LYS 80 78.797 -1.764 8.931 579 HD3 LYS 80 HD3 LYS 80 77.627 -2.627 7.928 580 HE2 LYS 80 HE2 LYS 80 79.060 -4.241 8.908 581 HE3 LYS 80 HE3 LYS 80 79.473 -4.122 7.200 582 HZ1 LYS 80 HZ1 LYS 80 81.333 -2.567 7.926 583 HZ2 LYS 80 HZ2 LYS 80 81.488 -4.171 8.381 584 HZ3 LYS 80 HZ3 LYS 80 80.991 -3.045 9.509 585 H GLU 81 H GLU 81 80.276 -0.878 4.343 586 HA GLU 81 HA GLU 81 82.688 -0.050 5.468 587 HB2 GLU 81 HB2 GLU 81 82.136 -1.805 3.090 588 HB3 GLU 81 HB3 GLU 81 83.762 -1.488 3.677 589 HG2 GLU 81 HG2 GLU 81 83.140 -2.433 5.866 590 HG3 GLU 81 HG3 GLU 81 81.533 -2.783 5.239 591 H TRP 82 H TRP 82 81.041 0.944 2.625 592 HA TRP 82 HA TRP 82 83.247 2.307 1.439 593 HB2 TRP 82 HB2 TRP 82 81.290 1.600 0.160 594 HB3 TRP 82 HB3 TRP 82 80.267 2.650 1.121 595 HD1 TRP 82 HD1 TRP 82 82.860 2.735 -1.673 596 HE1 TRP 82 HE1 TRP 82 82.677 4.984 -2.884 597 HE3 TRP 82 HE3 TRP 82 79.612 5.116 1.481 598 HZ2 TRP 82 HZ2 TRP 82 81.336 7.412 -2.592 599 HZ3 TRP 82 HZ3 TRP 82 78.935 7.418 0.953 600 HH2 TRP 82 HH2 TRP 82 79.778 8.558 -1.017 601 H ARG 83 H ARG 83 80.491 3.296 3.424 602 HA ARG 83 HA ARG 83 81.215 6.047 3.369 603 HB2 ARG 83 HB2 ARG 83 78.854 4.832 3.897 604 HB3 ARG 83 HB3 ARG 83 79.560 5.005 5.517 605 HG2 ARG 83 HG2 ARG 83 79.427 7.236 5.590 606 HG3 ARG 83 HG3 ARG 83 79.476 7.419 3.839 607 HD2 ARG 83 HD2 ARG 83 77.200 6.861 3.605 608 HD3 ARG 83 HD3 ARG 83 77.115 6.179 5.230 609 HE ARG 83 HE ARG 83 77.182 8.325 6.135 610 HH11 ARG 83 HH11 ARG 83 76.613 8.472 2.581 611 HH12 ARG 83 HH12 ARG 83 76.099 10.099 2.668 612 HH21 ARG 83 HH21 ARG 83 76.404 10.540 6.117 613 HH22 ARG 83 HH22 ARG 83 75.945 11.253 4.672 614 H ALA 84 H ALA 84 81.716 3.429 5.658 615 HA ALA 84 HA ALA 84 82.879 4.997 7.689 616 HB1 ALA 84 HB1 ALA 84 83.749 2.904 8.584 617 HB2 ALA 84 HB2 ALA 84 83.367 2.085 7.069 618 HB3 ALA 84 HB3 ALA 84 82.069 2.717 8.085 619 H ALA 85 H ALA 85 84.242 3.388 4.856 620 HA ALA 85 HA ALA 85 86.948 3.946 5.478 621 HB1 ALA 85 HB1 ALA 85 85.713 3.496 2.771 622 HB2 ALA 85 HB2 ALA 85 86.309 2.235 3.853 623 HB3 ALA 85 HB3 ALA 85 87.431 3.409 3.162 624 H ASN 86 H ASN 86 84.392 5.880 3.982 625 HA ASN 86 HA ASN 86 86.060 7.919 3.037 626 HB2 ASN 86 HB2 ASN 86 83.122 7.576 3.599 627 HB3 ASN 86 HB3 ASN 86 83.810 9.147 3.368 628 HD21 ASN 86 HD21 ASN 86 82.596 9.490 1.564 629 HD22 ASN 86 HD22 ASN 86 82.890 8.720 0.063 630 H GLY 87 H GLY 87 84.948 6.909 6.115 631 HA2 GLY 87 HA2 GLY 87 85.054 7.876 8.212 632 HA3 GLY 87 HA3 GLY 87 85.983 9.199 7.482 633 H LYS 88 H LYS 88 82.735 7.882 6.905 634 HA LYS 88 HA LYS 88 81.647 10.555 7.193 635 HB2 LYS 88 HB2 LYS 88 82.292 10.000 4.889 636 HB3 LYS 88 HB3 LYS 88 81.395 8.516 4.991 637 HG2 LYS 88 HG2 LYS 88 79.329 9.697 4.878 638 HG3 LYS 88 HG3 LYS 88 80.170 11.256 5.053 639 HD2 LYS 88 HD2 LYS 88 81.258 11.045 2.989 640 HD3 LYS 88 HD3 LYS 88 80.898 9.330 2.866 641 HE2 LYS 88 HE2 LYS 88 79.617 10.625 1.317 642 HE3 LYS 88 HE3 LYS 88 78.613 9.806 2.487 643 HZ1 LYS 88 HZ1 LYS 88 78.569 12.090 3.705 644 HZ2 LYS 88 HZ2 LYS 88 77.739 12.019 2.255 645 HZ3 LYS 88 HZ3 LYS 88 79.263 12.713 2.296 646 HA PRO 89 HA PRO 89 79.217 8.252 10.154 647 HB2 PRO 89 HB2 PRO 89 76.902 9.793 9.957 648 HB3 PRO 89 HB3 PRO 89 78.287 10.139 10.995 649 HG2 PRO 89 HG2 PRO 89 77.640 11.217 8.284 650 HG3 PRO 89 HG3 PRO 89 78.302 12.065 9.696 651 HD2 PRO 89 HD2 PRO 89 79.853 11.392 7.681 652 HD3 PRO 89 HD3 PRO 89 80.434 11.196 9.351 653 H GLY 90 H GLY 90 78.376 6.346 9.783 654 HA2 GLY 90 HA2 GLY 90 76.690 5.915 7.451 655 HA3 GLY 90 HA3 GLY 90 77.463 4.672 8.419 656 H PHE 91 H PHE 91 76.036 3.451 9.414 657 HA PHE 91 HA PHE 91 73.272 4.276 9.668 658 HB2 PHE 91 HB2 PHE 91 74.530 1.730 10.688 659 HB3 PHE 91 HB3 PHE 91 72.830 2.032 10.391 660 HD1 PHE 91 HD1 PHE 91 72.775 3.131 7.727 661 HD2 PHE 91 HD2 PHE 91 75.231 0.064 9.337 662 HE1 PHE 91 HE1 PHE 91 73.045 2.158 5.484 663 HE2 PHE 91 HE2 PHE 91 75.499 -0.905 7.101 664 HZ PHE 91 HZ PHE 91 74.405 0.141 5.175 665 H LYS 92 H LYS 92 72.099 4.417 11.640 666 HA LYS 92 HA LYS 92 73.718 4.861 13.966 667 HB2 LYS 92 HB2 LYS 92 71.750 5.763 14.897 668 HB3 LYS 92 HB3 LYS 92 71.892 6.448 13.312 669 HG2 LYS 92 HG2 LYS 92 70.151 5.018 12.486 670 HG3 LYS 92 HG3 LYS 92 70.171 4.093 13.988 671 HD2 LYS 92 HD2 LYS 92 69.407 7.014 13.795 672 HD3 LYS 92 HD3 LYS 92 68.245 5.687 13.797 673 HE2 LYS 92 HE2 LYS 92 69.076 4.985 16.007 674 HE3 LYS 92 HE3 LYS 92 70.206 6.330 16.004 675 HZ1 LYS 92 HZ1 LYS 92 68.330 7.855 15.968 676 HZ2 LYS 92 HZ2 LYS 92 68.262 6.829 17.297 677 HZ3 LYS 92 HZ3 LYS 92 67.248 6.557 15.983 678 H GLN 93 H GLN 93 72.400 3.960 15.971 679 HA GLN 93 HA GLN 93 71.937 1.154 15.474 680 HB2 GLN 93 HB2 GLN 93 72.912 2.801 17.689 681 HB3 GLN 93 HB3 GLN 93 72.441 1.118 17.953 682 HG2 GLN 93 HG2 GLN 93 74.662 2.196 16.201 683 HG3 GLN 93 HG3 GLN 93 74.847 1.250 17.684 684 HE21 GLN 93 HE21 GLN 93 74.056 1.154 14.306 685 HE22 GLN 93 HE22 GLN 93 74.096 -0.546 14.095 686 H GLY 94 H GLY 94 70.081 0.292 16.245 687 HA2 GLY 94 HA2 GLY 94 68.469 0.926 18.219 688 HA3 GLY 94 HA3 GLY 94 67.963 2.082 16.981 Start of MODEL 10 1 H GLU 2 H GLU 2 61.825 1.938 6.431 2 HA GLU 2 HA GLU 2 59.818 3.076 5.919 3 HB2 GLU 2 HB2 GLU 2 60.169 4.191 8.709 4 HB3 GLU 2 HB3 GLU 2 59.024 4.802 7.514 5 HG2 GLU 2 HG2 GLU 2 59.030 2.097 8.817 6 HG3 GLU 2 HG3 GLU 2 57.840 3.389 9.023 7 H LEU 3 H LEU 3 59.838 5.705 5.810 8 HA LEU 3 HA LEU 3 62.516 6.091 4.797 9 HB2 LEU 3 HB2 LEU 3 59.980 7.632 4.299 10 HB3 LEU 3 HB3 LEU 3 61.542 8.069 3.643 11 HG LEU 3 HG LEU 3 59.986 5.561 3.043 12 HD11 LEU 3 HD11 LEU 3 60.650 7.995 1.345 13 HD12 LEU 3 HD12 LEU 3 59.053 7.568 1.937 14 HD13 LEU 3 HD13 LEU 3 59.846 6.555 0.737 15 HD21 LEU 3 HD21 LEU 3 61.774 5.117 1.410 16 HD22 LEU 3 HD22 LEU 3 62.352 5.152 3.087 17 HD23 LEU 3 HD23 LEU 3 62.650 6.523 2.036 18 H LYS 4 H LYS 4 63.891 7.273 5.604 19 HA LYS 4 HA LYS 4 63.210 9.309 7.625 20 HB2 LYS 4 HB2 LYS 4 65.957 8.255 6.869 21 HB3 LYS 4 HB3 LYS 4 65.528 9.209 8.291 22 HG2 LYS 4 HG2 LYS 4 65.237 6.307 7.681 23 HG3 LYS 4 HG3 LYS 4 65.929 7.044 9.104 24 HD2 LYS 4 HD2 LYS 4 63.440 7.863 9.414 25 HD3 LYS 4 HD3 LYS 4 63.168 6.505 8.324 26 HE2 LYS 4 HE2 LYS 4 64.588 5.090 9.891 27 HE3 LYS 4 HE3 LYS 4 64.498 6.406 11.027 28 HZ1 LYS 4 HZ1 LYS 4 62.297 4.697 10.087 29 HZ2 LYS 4 HZ2 LYS 4 61.978 6.174 10.841 30 HZ3 LYS 4 HZ3 LYS 4 62.789 4.952 11.683 31 H ASN 5 H ASN 5 65.455 10.940 7.138 32 HA ASN 5 HA ASN 5 65.043 11.582 4.317 33 HB2 ASN 5 HB2 ASN 5 65.403 13.594 6.553 34 HB3 ASN 5 HB3 ASN 5 65.446 14.004 4.836 35 HD21 ASN 5 HD21 ASN 5 63.502 13.764 3.595 36 HD22 ASN 5 HD22 ASN 5 61.968 13.716 4.361 37 H SER 6 H SER 6 67.275 11.317 6.918 38 HA SER 6 HA SER 6 69.372 11.248 4.883 39 HB2 SER 6 HB2 SER 6 70.973 11.999 6.588 40 HB3 SER 6 HB3 SER 6 69.797 13.253 6.213 41 HG SER 6 HG SER 6 68.726 12.814 8.101 42 H ILE 7 H ILE 7 71.293 9.875 5.733 43 HA ILE 7 HA ILE 7 70.040 7.434 6.579 44 HB ILE 7 HB ILE 7 71.861 7.654 4.685 45 HG12 ILE 7 HG12 ILE 7 72.321 5.455 6.677 46 HG13 ILE 7 HG13 ILE 7 70.802 5.566 5.798 47 HG21 ILE 7 HG21 ILE 7 73.656 7.449 7.079 48 HG22 ILE 7 HG22 ILE 7 73.522 8.847 6.022 49 HG23 ILE 7 HG23 ILE 7 74.146 7.328 5.395 50 HD11 ILE 7 HD11 ILE 7 73.534 5.296 4.586 51 HD12 ILE 7 HD12 ILE 7 72.017 5.417 3.700 52 HD13 ILE 7 HD13 ILE 7 72.323 4.028 4.739 53 H SER 8 H SER 8 71.098 9.923 8.223 54 HA SER 8 HA SER 8 72.460 8.579 10.350 55 HB2 SER 8 HB2 SER 8 71.332 11.364 10.146 56 HB3 SER 8 HB3 SER 8 72.459 10.790 11.390 57 HG SER 8 HG SER 8 73.784 10.170 9.469 58 H ASP 9 H ASP 9 69.213 8.885 9.442 59 HA ASP 9 HA ASP 9 68.339 8.336 12.215 60 HB2 ASP 9 HB2 ASP 9 67.104 10.119 10.600 61 HB3 ASP 9 HB3 ASP 9 66.482 8.676 9.917 62 H TYR 10 H TYR 10 69.518 6.791 9.750 63 HA TYR 10 HA TYR 10 67.507 4.686 9.563 64 HB2 TYR 10 HB2 TYR 10 69.632 5.609 7.703 65 HB3 TYR 10 HB3 TYR 10 69.316 3.887 7.748 66 HD1 TYR 10 HD1 TYR 10 66.804 3.212 7.489 67 HD2 TYR 10 HD2 TYR 10 68.363 6.963 6.205 68 HE1 TYR 10 HE1 TYR 10 64.919 3.484 5.949 69 HE2 TYR 10 HE2 TYR 10 66.507 7.222 4.659 70 HH TYR 10 HH TYR 10 64.843 5.941 3.539 71 H THR 11 H THR 11 67.807 3.140 10.981 72 HA THR 11 HA THR 11 70.435 2.450 11.895 73 HB THR 11 HB THR 11 69.248 0.607 13.042 74 HG1 THR 11 HG1 THR 11 67.039 0.385 12.800 75 HG21 THR 11 HG21 THR 11 67.866 3.269 13.310 76 HG22 THR 11 HG22 THR 11 69.253 2.681 14.248 77 HG23 THR 11 HG23 THR 11 67.674 1.929 14.431 78 H GLU 12 H GLU 12 71.236 0.187 11.372 79 HA GLU 12 HA GLU 12 71.032 -0.179 8.600 80 HB2 GLU 12 HB2 GLU 12 72.252 -2.334 8.973 81 HB3 GLU 12 HB3 GLU 12 73.054 -0.876 9.518 82 HG2 GLU 12 HG2 GLU 12 72.479 -1.368 11.786 83 HG3 GLU 12 HG3 GLU 12 71.579 -2.799 11.341 84 H ALA 13 H ALA 13 69.291 -1.744 11.202 85 HA ALA 13 HA ALA 13 68.018 -3.594 9.444 86 HB1 ALA 13 HB1 ALA 13 66.492 -4.044 11.277 87 HB2 ALA 13 HB2 ALA 13 67.068 -2.615 12.135 88 HB3 ALA 13 HB3 ALA 13 68.156 -3.981 11.859 89 H GLU 14 H GLU 14 67.078 -0.310 10.554 90 HA GLU 14 HA GLU 14 64.502 -0.223 9.380 91 HB2 GLU 14 HB2 GLU 14 66.417 1.704 10.406 92 HB3 GLU 14 HB3 GLU 14 65.663 2.329 8.962 93 HG2 GLU 14 HG2 GLU 14 64.205 1.309 11.379 94 HG3 GLU 14 HG3 GLU 14 64.516 3.004 10.995 95 H PHE 15 H PHE 15 67.667 0.419 8.219 96 HA PHE 15 HA PHE 15 66.947 1.262 5.665 97 HB2 PHE 15 HB2 PHE 15 69.072 1.749 6.863 98 HB3 PHE 15 HB3 PHE 15 69.548 0.083 6.586 99 HD1 PHE 15 HD1 PHE 15 68.905 3.317 5.053 100 HD2 PHE 15 HD2 PHE 15 70.221 -0.665 4.453 101 HE1 PHE 15 HE1 PHE 15 69.842 3.956 2.876 102 HE2 PHE 15 HE2 PHE 15 71.163 -0.031 2.285 103 HZ PHE 15 HZ PHE 15 70.967 2.283 1.505 104 H VAL 16 H VAL 16 68.159 -1.916 6.907 105 HA VAL 16 HA VAL 16 68.085 -3.152 4.429 106 HB VAL 16 HB VAL 16 68.136 -5.312 5.423 107 HG11 VAL 16 HG11 VAL 16 69.889 -5.249 7.102 108 HG12 VAL 16 HG12 VAL 16 69.797 -3.483 7.006 109 HG13 VAL 16 HG13 VAL 16 70.164 -4.447 5.568 110 HG21 VAL 16 HG21 VAL 16 67.069 -4.148 7.948 111 HG22 VAL 16 HG22 VAL 16 67.912 -5.708 7.866 112 HG23 VAL 16 HG23 VAL 16 66.433 -5.457 6.938 113 H GLN 17 H GLN 17 65.507 -2.762 6.825 114 HA GLN 17 HA GLN 17 63.548 -4.371 5.703 115 HB2 GLN 17 HB2 GLN 17 63.603 -3.266 7.945 116 HB3 GLN 17 HB3 GLN 17 63.241 -1.749 7.140 117 HG2 GLN 17 HG2 GLN 17 61.234 -2.848 6.216 118 HG3 GLN 17 HG3 GLN 17 61.586 -4.188 7.328 119 HE21 GLN 17 HE21 GLN 17 60.506 -0.943 7.038 120 HE22 GLN 17 HE22 GLN 17 59.999 -0.726 8.681 121 H LEU 18 H LEU 18 64.239 -0.928 5.309 122 HA LEU 18 HA LEU 18 62.155 -0.337 3.509 123 HB2 LEU 18 HB2 LEU 18 63.519 1.247 4.944 124 HB3 LEU 18 HB3 LEU 18 64.828 1.039 3.821 125 HG LEU 18 HG LEU 18 63.570 3.180 3.589 126 HD11 LEU 18 HD11 LEU 18 63.423 3.214 1.176 127 HD12 LEU 18 HD12 LEU 18 63.551 1.454 1.149 128 HD13 LEU 18 HD13 LEU 18 64.894 2.427 1.750 129 HD21 LEU 18 HD21 LEU 18 61.358 1.406 2.580 130 HD22 LEU 18 HD22 LEU 18 61.389 3.164 2.486 131 HD23 LEU 18 HD23 LEU 18 61.337 2.370 4.058 132 H LEU 19 H LEU 19 65.483 -1.206 3.138 133 HA LEU 19 HA LEU 19 65.909 -1.015 0.388 134 HB2 LEU 19 HB2 LEU 19 67.414 -1.437 2.365 135 HB3 LEU 19 HB3 LEU 19 66.913 -3.070 2.235 136 HG LEU 19 HG LEU 19 67.998 -3.466 0.200 137 HD11 LEU 19 HD11 LEU 19 68.390 -0.466 0.053 138 HD12 LEU 19 HD12 LEU 19 67.350 -1.432 -1.010 139 HD13 LEU 19 HD13 LEU 19 69.097 -1.643 -1.044 140 HD21 LEU 19 HD21 LEU 19 69.389 -3.353 2.131 141 HD22 LEU 19 HD22 LEU 19 69.581 -1.612 1.892 142 HD23 LEU 19 HD23 LEU 19 70.260 -2.741 0.717 143 H LYS 20 H LYS 20 64.837 -3.708 2.357 144 HA LYS 20 HA LYS 20 64.586 -5.611 0.352 145 HB2 LYS 20 HB2 LYS 20 63.119 -5.148 2.858 146 HB3 LYS 20 HB3 LYS 20 62.918 -6.649 1.891 147 HG2 LYS 20 HG2 LYS 20 65.469 -6.899 2.329 148 HG3 LYS 20 HG3 LYS 20 65.250 -5.569 3.412 149 HD2 LYS 20 HD2 LYS 20 63.487 -6.706 4.675 150 HD3 LYS 20 HD3 LYS 20 63.728 -8.145 3.694 151 HE2 LYS 20 HE2 LYS 20 65.988 -8.365 4.526 152 HE3 LYS 20 HE3 LYS 20 65.826 -6.863 5.433 153 HZ1 LYS 20 HZ1 LYS 20 65.482 -8.761 6.881 154 HZ2 LYS 20 HZ2 LYS 20 64.277 -9.363 5.897 155 HZ3 LYS 20 HZ3 LYS 20 64.037 -7.917 6.728 156 H GLU 21 H GLU 21 62.403 -3.107 1.531 157 HA GLU 21 HA GLU 21 60.192 -3.893 -0.016 158 HB2 GLU 21 HB2 GLU 21 60.872 -1.186 1.137 159 HB3 GLU 21 HB3 GLU 21 59.323 -1.631 0.428 160 HG2 GLU 21 HG2 GLU 21 60.560 -2.902 2.849 161 HG3 GLU 21 HG3 GLU 21 59.277 -1.697 2.869 162 H ILE 22 H ILE 22 62.882 -1.721 -0.565 163 HA ILE 22 HA ILE 22 62.085 -0.738 -3.086 164 HB ILE 22 HB ILE 22 64.968 -1.372 -2.362 165 HG12 ILE 22 HG12 ILE 22 63.346 1.086 -1.610 166 HG13 ILE 22 HG13 ILE 22 63.995 -0.113 -0.518 167 HG21 ILE 22 HG21 ILE 22 64.674 -0.743 -4.651 168 HG22 ILE 22 HG22 ILE 22 65.332 0.674 -3.803 169 HG23 ILE 22 HG23 ILE 22 63.624 0.592 -4.197 170 HD11 ILE 22 HD11 ILE 22 65.640 1.725 -2.235 171 HD12 ILE 22 HD12 ILE 22 66.270 0.533 -1.098 172 HD13 ILE 22 HD13 ILE 22 65.340 1.911 -0.508 173 H GLU 23 H GLU 23 63.907 -3.549 -2.119 174 HA GLU 23 HA GLU 23 64.436 -4.743 -4.578 175 HB2 GLU 23 HB2 GLU 23 64.571 -5.393 -1.819 176 HB3 GLU 23 HB3 GLU 23 63.833 -6.743 -2.661 177 HG2 GLU 23 HG2 GLU 23 66.491 -5.484 -3.286 178 HG3 GLU 23 HG3 GLU 23 66.147 -7.018 -2.456 179 H LYS 24 H LYS 24 61.581 -4.794 -2.557 180 HA LYS 24 HA LYS 24 60.199 -6.825 -3.966 181 HB2 LYS 24 HB2 LYS 24 59.697 -6.035 -1.598 182 HB3 LYS 24 HB3 LYS 24 59.006 -4.601 -2.363 183 HG2 LYS 24 HG2 LYS 24 57.254 -5.793 -3.335 184 HG3 LYS 24 HG3 LYS 24 58.030 -7.347 -3.038 185 HD2 LYS 24 HD2 LYS 24 56.202 -7.056 -1.489 186 HD3 LYS 24 HD3 LYS 24 57.723 -7.001 -0.611 187 HE2 LYS 24 HE2 LYS 24 56.190 -5.307 0.210 188 HE3 LYS 24 HE3 LYS 24 57.587 -4.551 -0.551 189 HZ1 LYS 24 HZ1 LYS 24 56.316 -3.963 -2.422 190 HZ2 LYS 24 HZ2 LYS 24 55.337 -3.596 -1.099 191 HZ3 LYS 24 HZ3 LYS 24 55.044 -4.996 -1.993 192 H GLU 25 H GLU 25 59.911 -3.269 -3.938 193 HA GLU 25 HA GLU 25 58.135 -3.108 -6.067 194 HB2 GLU 25 HB2 GLU 25 60.036 -1.094 -4.830 195 HB3 GLU 25 HB3 GLU 25 59.092 -0.742 -6.226 196 HG2 GLU 25 HG2 GLU 25 58.048 0.072 -4.195 197 HG3 GLU 25 HG3 GLU 25 57.023 -1.037 -5.101 198 H ASN 26 H ASN 26 61.544 -3.523 -5.970 199 HA ASN 26 HA ASN 26 62.242 -2.860 -8.618 200 HB2 ASN 26 HB2 ASN 26 63.926 -3.140 -6.856 201 HB3 ASN 26 HB3 ASN 26 63.486 -4.830 -6.676 202 HD21 ASN 26 HD21 ASN 26 65.573 -5.563 -7.103 203 HD22 ASN 26 HD22 ASN 26 66.239 -5.488 -8.689 204 H VAL 27 H VAL 27 61.576 -6.035 -7.121 205 HA VAL 27 HA VAL 27 61.602 -7.325 -9.665 206 HB VAL 27 HB VAL 27 60.870 -9.374 -8.521 207 HG11 VAL 27 HG11 VAL 27 62.807 -9.640 -7.049 208 HG12 VAL 27 HG12 VAL 27 63.061 -7.894 -7.093 209 HG13 VAL 27 HG13 VAL 27 63.220 -8.846 -8.570 210 HG21 VAL 27 HG21 VAL 27 60.721 -7.657 -6.039 211 HG22 VAL 27 HG22 VAL 27 60.574 -9.414 -6.074 212 HG23 VAL 27 HG23 VAL 27 59.354 -8.410 -6.857 213 H ALA 28 H ALA 28 59.148 -5.781 -7.848 214 HA ALA 28 HA ALA 28 57.040 -6.954 -9.429 215 HB1 ALA 28 HB1 ALA 28 55.556 -5.410 -8.229 216 HB2 ALA 28 HB2 ALA 28 56.960 -4.617 -7.511 217 HB3 ALA 28 HB3 ALA 28 56.594 -6.293 -7.110 218 H ALA 29 H ALA 29 59.338 -4.554 -9.827 219 HA ALA 29 HA ALA 29 59.718 -2.832 -11.201 220 HB1 ALA 29 HB1 ALA 29 57.930 -4.411 -13.050 221 HB2 ALA 29 HB2 ALA 29 59.656 -4.676 -12.821 222 HB3 ALA 29 HB3 ALA 29 59.083 -3.170 -13.539 223 H THR 30 H THR 30 58.226 -1.834 -9.487 224 HA THR 30 HA THR 30 55.617 -1.031 -10.354 225 HB THR 30 HB THR 30 55.588 0.227 -8.233 226 HG1 THR 30 HG1 THR 30 57.552 -0.232 -6.922 227 HG21 THR 30 HG21 THR 30 55.858 -1.665 -6.755 228 HG22 THR 30 HG22 THR 30 56.844 -2.481 -7.968 229 HG23 THR 30 HG23 THR 30 55.127 -2.203 -8.275 230 H ASP 31 H ASP 31 58.785 0.218 -10.537 231 HA ASP 31 HA ASP 31 59.789 1.923 -11.331 232 HB2 ASP 31 HB2 ASP 31 57.278 2.447 -12.883 233 HB3 ASP 31 HB3 ASP 31 58.828 3.288 -13.025 234 H ASP 32 H ASP 32 56.598 3.272 -10.622 235 HA ASP 32 HA ASP 32 57.593 5.882 -10.235 236 HB2 ASP 32 HB2 ASP 32 55.136 5.322 -10.419 237 HB3 ASP 32 HB3 ASP 32 55.261 4.741 -8.749 238 H VAL 33 H VAL 33 56.802 3.503 -7.813 239 HA VAL 33 HA VAL 33 57.969 5.224 -5.791 240 HB VAL 33 HB VAL 33 56.009 4.042 -5.170 241 HG11 VAL 33 HG11 VAL 33 57.561 1.515 -5.572 242 HG12 VAL 33 HG12 VAL 33 56.153 2.051 -6.481 243 HG13 VAL 33 HG13 VAL 33 55.987 1.588 -4.782 244 HG21 VAL 33 HG21 VAL 33 56.701 3.051 -3.020 245 HG22 VAL 33 HG22 VAL 33 57.509 4.583 -3.366 246 HG23 VAL 33 HG23 VAL 33 58.370 3.061 -3.589 247 H LEU 34 H LEU 34 58.762 2.468 -7.511 248 HA LEU 34 HA LEU 34 61.125 1.554 -6.188 249 HB2 LEU 34 HB2 LEU 34 59.768 0.459 -8.129 250 HB3 LEU 34 HB3 LEU 34 60.509 1.691 -9.080 251 HG LEU 34 HG LEU 34 61.468 -0.751 -9.047 252 HD11 LEU 34 HD11 LEU 34 63.524 0.128 -9.868 253 HD12 LEU 34 HD12 LEU 34 63.116 1.716 -9.192 254 HD13 LEU 34 HD13 LEU 34 62.122 1.016 -10.472 255 HD21 LEU 34 HD21 LEU 34 63.034 0.635 -6.873 256 HD22 LEU 34 HD22 LEU 34 63.465 -0.891 -7.644 257 HD23 LEU 34 HD23 LEU 34 62.005 -0.781 -6.659 258 H ASP 35 H ASP 35 60.661 3.981 -8.722 259 HA ASP 35 HA ASP 35 63.369 4.692 -8.808 260 HB2 ASP 35 HB2 ASP 35 61.812 5.186 -10.622 261 HB3 ASP 35 HB3 ASP 35 60.933 6.275 -9.574 262 H VAL 36 H VAL 36 60.714 5.849 -6.916 263 HA VAL 36 HA VAL 36 61.848 8.105 -5.672 264 HB VAL 36 HB VAL 36 60.201 5.920 -4.366 265 HG11 VAL 36 HG11 VAL 36 61.368 7.262 -2.857 266 HG12 VAL 36 HG12 VAL 36 59.598 7.599 -2.805 267 HG13 VAL 36 HG13 VAL 36 60.735 8.724 -3.637 268 HG21 VAL 36 HG21 VAL 36 59.388 8.493 -5.523 269 HG22 VAL 36 HG22 VAL 36 58.437 7.295 -4.573 270 HG23 VAL 36 HG23 VAL 36 59.117 6.839 -6.179 271 H LEU 37 H LEU 37 61.868 4.755 -4.894 272 HA LEU 37 HA LEU 37 63.311 4.968 -2.527 273 HB2 LEU 37 HB2 LEU 37 62.972 2.598 -4.284 274 HB3 LEU 37 HB3 LEU 37 63.428 2.708 -2.606 275 HG LEU 37 HG LEU 37 60.695 3.587 -3.501 276 HD11 LEU 37 HD11 LEU 37 60.925 1.175 -3.840 277 HD12 LEU 37 HD12 LEU 37 59.804 1.568 -2.542 278 HD13 LEU 37 HD13 LEU 37 61.417 0.990 -2.151 279 HD21 LEU 37 HD21 LEU 37 60.187 3.519 -1.101 280 HD22 LEU 37 HD22 LEU 37 61.478 4.660 -1.463 281 HD23 LEU 37 HD23 LEU 37 61.862 3.087 -0.761 282 H LEU 38 H LEU 38 64.158 4.044 -5.785 283 HA LEU 38 HA LEU 38 66.805 3.342 -5.307 284 HB2 LEU 38 HB2 LEU 38 65.406 4.463 -7.687 285 HB3 LEU 38 HB3 LEU 38 67.085 3.902 -7.776 286 HG LEU 38 HG LEU 38 64.506 2.413 -7.415 287 HD11 LEU 38 HD11 LEU 38 66.761 2.173 -9.334 288 HD12 LEU 38 HD12 LEU 38 65.202 2.940 -9.651 289 HD13 LEU 38 HD13 LEU 38 65.302 1.194 -9.347 290 HD21 LEU 38 HD21 LEU 38 66.037 1.440 -5.782 291 HD22 LEU 38 HD22 LEU 38 67.272 1.256 -7.028 292 HD23 LEU 38 HD23 LEU 38 65.774 0.338 -7.130 293 H GLU 39 H GLU 39 65.401 6.459 -6.125 294 HA GLU 39 HA GLU 39 67.842 7.911 -6.133 295 HB2 GLU 39 HB2 GLU 39 64.978 8.643 -5.677 296 HB3 GLU 39 HB3 GLU 39 66.273 9.823 -5.691 297 HG2 GLU 39 HG2 GLU 39 65.660 7.987 -7.989 298 HG3 GLU 39 HG3 GLU 39 64.927 9.582 -7.762 299 H HIS 40 H HIS 40 65.353 7.326 -3.730 300 HA HIS 40 HA HIS 40 66.318 9.025 -1.771 301 HB2 HIS 40 HB2 HIS 40 64.094 8.123 -1.777 302 HB3 HIS 40 HB3 HIS 40 64.614 6.509 -1.521 303 HD1 HIS 40 HD1 HIS 40 63.740 9.597 0.294 304 HD2 HIS 40 HD2 HIS 40 65.709 6.045 1.136 305 HE1 HIS 40 HE1 HIS 40 63.848 9.430 2.812 306 H PHE 41 H PHE 41 66.800 5.645 -2.345 307 HA PHE 41 HA PHE 41 68.383 4.953 -0.206 308 HB2 PHE 41 HB2 PHE 41 67.357 3.327 -1.490 309 HB3 PHE 41 HB3 PHE 41 67.993 3.981 -2.985 310 HD1 PHE 41 HD1 PHE 41 68.789 2.142 0.089 311 HD2 PHE 41 HD2 PHE 41 70.086 3.196 -3.798 312 HE1 PHE 41 HE1 PHE 41 70.618 0.506 0.254 313 HE2 PHE 41 HE2 PHE 41 71.914 1.579 -3.616 314 HZ PHE 41 HZ PHE 41 72.182 0.235 -1.612 315 H VAL 42 H VAL 42 69.402 5.966 -3.479 316 HA VAL 42 HA VAL 42 72.140 5.904 -2.749 317 HB VAL 42 HB VAL 42 71.376 5.612 -5.098 318 HG11 VAL 42 HG11 VAL 42 70.866 7.394 -6.460 319 HG12 VAL 42 HG12 VAL 42 70.628 8.416 -4.990 320 HG13 VAL 42 HG13 VAL 42 69.680 6.921 -5.245 321 HG21 VAL 42 HG21 VAL 42 73.285 7.917 -4.749 322 HG22 VAL 42 HG22 VAL 42 73.122 6.927 -6.199 323 HG23 VAL 42 HG23 VAL 42 73.725 6.212 -4.701 324 H LYS 43 H LYS 43 69.796 8.446 -2.638 325 HA LYS 43 HA LYS 43 71.766 10.498 -2.182 326 HB2 LYS 43 HB2 LYS 43 69.999 12.016 -1.774 327 HB3 LYS 43 HB3 LYS 43 69.374 10.907 -2.981 328 HG2 LYS 43 HG2 LYS 43 68.240 9.672 -0.954 329 HG3 LYS 43 HG3 LYS 43 68.726 11.084 -0.072 330 HD2 LYS 43 HD2 LYS 43 67.036 11.278 -2.550 331 HD3 LYS 43 HD3 LYS 43 66.385 11.228 -0.917 332 HE2 LYS 43 HE2 LYS 43 68.262 13.329 -2.026 333 HE3 LYS 43 HE3 LYS 43 66.537 13.515 -1.738 334 HZ1 LYS 43 HZ1 LYS 43 68.561 12.996 0.371 335 HZ2 LYS 43 HZ2 LYS 43 66.911 13.244 0.619 336 HZ3 LYS 43 HZ3 LYS 43 67.868 14.480 0.018 337 H ILE 44 H ILE 44 70.096 8.339 -0.032 338 HA ILE 44 HA ILE 44 71.136 9.730 2.300 339 HB ILE 44 HB ILE 44 70.164 7.811 3.605 340 HG12 ILE 44 HG12 ILE 44 69.089 6.986 0.923 341 HG13 ILE 44 HG13 ILE 44 70.359 6.107 1.733 342 HG21 ILE 44 HG21 ILE 44 68.882 9.836 3.242 343 HG22 ILE 44 HG22 ILE 44 67.823 8.427 3.200 344 HG23 ILE 44 HG23 ILE 44 68.304 9.212 1.699 345 HD11 ILE 44 HD11 ILE 44 68.740 5.643 3.564 346 HD12 ILE 44 HD12 ILE 44 68.228 5.004 1.998 347 HD13 ILE 44 HD13 ILE 44 67.511 6.488 2.628 348 H THR 45 H THR 45 71.986 6.871 0.405 349 HA THR 45 HA THR 45 73.995 6.074 2.283 350 HB THR 45 HB THR 45 74.787 4.549 0.434 351 HG1 THR 45 HG1 THR 45 72.460 5.181 -0.984 352 HG21 THR 45 HG21 THR 45 72.817 3.110 0.458 353 HG22 THR 45 HG22 THR 45 71.842 4.458 1.043 354 HG23 THR 45 HG23 THR 45 73.127 3.796 2.055 355 H GLU 46 H GLU 46 73.883 7.834 -0.746 356 HA GLU 46 HA GLU 46 75.254 9.011 -1.918 357 HB2 GLU 46 HB2 GLU 46 76.503 9.482 0.765 358 HB3 GLU 46 HB3 GLU 46 76.994 10.392 -0.682 359 HG2 GLU 46 HG2 GLU 46 74.556 11.019 -0.882 360 HG3 GLU 46 HG3 GLU 46 74.335 10.305 0.698 361 H HIS 47 H HIS 47 75.593 6.316 -1.639 362 HA HIS 47 HA HIS 47 78.414 5.794 -1.984 363 HB2 HIS 47 HB2 HIS 47 76.696 4.179 -0.907 364 HB3 HIS 47 HB3 HIS 47 76.070 3.947 -2.530 365 HD1 HIS 47 HD1 HIS 47 78.095 2.914 -4.309 366 HD2 HIS 47 HD2 HIS 47 78.627 2.544 -0.209 367 HE1 HIS 47 HE1 HIS 47 79.699 1.052 -4.001 368 HA PRO 48 HA PRO 48 77.765 7.059 -6.271 369 HB2 PRO 48 HB2 PRO 48 80.061 5.471 -6.957 370 HB3 PRO 48 HB3 PRO 48 79.843 7.214 -7.044 371 HG2 PRO 48 HG2 PRO 48 81.438 5.882 -5.343 372 HG3 PRO 48 HG3 PRO 48 80.694 7.434 -4.833 373 HD2 PRO 48 HD2 PRO 48 79.985 4.595 -4.214 374 HD3 PRO 48 HD3 PRO 48 79.895 6.000 -3.145 375 H ASP 49 H ASP 49 76.878 4.246 -5.327 376 HA ASP 49 HA ASP 49 76.953 3.213 -7.908 377 HB2 ASP 49 HB2 ASP 49 77.812 1.566 -5.521 378 HB3 ASP 49 HB3 ASP 49 77.478 0.872 -7.071 379 H GLY 50 H GLY 50 75.123 4.415 -5.942 380 HA2 GLY 50 HA2 GLY 50 73.609 2.978 -4.116 381 HA3 GLY 50 HA3 GLY 50 73.025 4.263 -5.136 382 H THR 51 H THR 51 72.551 3.525 -7.334 383 HA THR 51 HA THR 51 70.518 1.678 -6.771 384 HB THR 51 HB THR 51 70.877 2.322 -9.620 385 HG1 THR 51 HG1 THR 51 71.184 4.423 -9.139 386 HG21 THR 51 HG21 THR 51 68.898 1.262 -8.619 387 HG22 THR 51 HG22 THR 51 68.513 2.858 -9.277 388 HG23 THR 51 HG23 THR 51 68.683 2.633 -7.557 389 H ALA 52 H ALA 52 73.663 1.398 -8.202 390 HA ALA 52 HA ALA 52 73.323 -1.093 -9.576 391 HB1 ALA 52 HB1 ALA 52 75.239 0.447 -9.990 392 HB2 ALA 52 HB2 ALA 52 75.749 -1.186 -9.558 393 HB3 ALA 52 HB3 ALA 52 75.814 0.108 -8.360 394 H LEU 53 H LEU 53 74.122 -0.207 -6.310 395 HA LEU 53 HA LEU 53 74.758 -2.731 -5.296 396 HB2 LEU 53 HB2 LEU 53 73.339 -0.456 -3.934 397 HB3 LEU 53 HB3 LEU 53 74.039 -1.835 -3.114 398 HG LEU 53 HG LEU 53 75.580 0.210 -4.711 399 HD11 LEU 53 HD11 LEU 53 76.418 0.934 -2.536 400 HD12 LEU 53 HD12 LEU 53 75.326 -0.211 -1.752 401 HD13 LEU 53 HD13 LEU 53 74.670 1.144 -2.672 402 HD21 LEU 53 HD21 LEU 53 77.561 -0.858 -3.717 403 HD22 LEU 53 HD22 LEU 53 76.673 -1.965 -4.755 404 HD23 LEU 53 HD23 LEU 53 76.528 -2.095 -3.000 405 H ILE 54 H ILE 54 71.616 -1.171 -5.624 406 HA ILE 54 HA ILE 54 70.201 -3.321 -4.327 407 HB ILE 54 HB ILE 54 69.212 -1.034 -6.048 408 HG12 ILE 54 HG12 ILE 54 68.654 -1.712 -3.177 409 HG13 ILE 54 HG13 ILE 54 69.933 -0.613 -3.610 410 HG21 ILE 54 HG21 ILE 54 66.894 -1.704 -5.526 411 HG22 ILE 54 HG22 ILE 54 67.496 -3.181 -4.771 412 HG23 ILE 54 HG23 ILE 54 67.717 -2.926 -6.499 413 HD11 ILE 54 HD11 ILE 54 67.005 -0.302 -4.106 414 HD12 ILE 54 HD12 ILE 54 68.234 0.837 -4.664 415 HD13 ILE 54 HD13 ILE 54 67.981 0.585 -2.933 416 H TYR 55 H TYR 55 70.729 -2.398 -7.634 417 HA TYR 55 HA TYR 55 69.298 -4.482 -8.761 418 HB2 TYR 55 HB2 TYR 55 71.286 -2.532 -9.704 419 HB3 TYR 55 HB3 TYR 55 70.916 -3.881 -10.750 420 HD1 TYR 55 HD1 TYR 55 68.318 -4.272 -11.132 421 HD2 TYR 55 HD2 TYR 55 70.001 -0.610 -9.808 422 HE1 TYR 55 HE1 TYR 55 66.299 -3.086 -11.877 423 HE2 TYR 55 HE2 TYR 55 68.016 0.594 -10.532 424 HH TYR 55 HH TYR 55 66.139 0.319 -12.076 425 H GLU 56 H GLU 56 72.748 -4.317 -7.861 426 HA GLU 56 HA GLU 56 73.200 -6.894 -8.938 427 HB2 GLU 56 HB2 GLU 56 75.357 -6.909 -7.687 428 HB3 GLU 56 HB3 GLU 56 75.156 -5.536 -8.764 429 HG2 GLU 56 HG2 GLU 56 74.790 -4.078 -7.024 430 HG3 GLU 56 HG3 GLU 56 74.627 -5.321 -5.810 431 H ALA 57 H ALA 57 72.260 -5.736 -5.772 432 HA ALA 57 HA ALA 57 72.527 -8.121 -4.355 433 HB1 ALA 57 HB1 ALA 57 71.954 -5.969 -3.312 434 HB2 ALA 57 HB2 ALA 57 70.820 -7.236 -2.852 435 HB3 ALA 57 HB3 ALA 57 70.359 -6.038 -4.062 436 H ALA 58 H ALA 58 69.944 -6.963 -6.429 437 HA ALA 58 HA ALA 58 68.134 -9.076 -6.104 438 HB1 ALA 58 HB1 ALA 58 67.555 -6.970 -7.209 439 HB2 ALA 58 HB2 ALA 58 67.202 -8.344 -8.259 440 HB3 ALA 58 HB3 ALA 58 68.639 -7.365 -8.540 441 H ALA 59 H ALA 59 70.727 -8.599 -8.449 442 HA ALA 59 HA ALA 59 70.307 -11.021 -9.870 443 HB1 ALA 59 HB1 ALA 59 71.445 -9.073 -10.852 444 HB2 ALA 59 HB2 ALA 59 72.421 -10.537 -10.969 445 HB3 ALA 59 HB3 ALA 59 72.796 -9.322 -9.747 446 H ARG 60 H ARG 60 72.555 -10.123 -7.325 447 HA ARG 60 HA ARG 60 73.899 -12.580 -7.325 448 HB2 ARG 60 HB2 ARG 60 73.799 -10.464 -5.171 449 HB3 ARG 60 HB3 ARG 60 74.899 -11.835 -5.166 450 HG2 ARG 60 HG2 ARG 60 75.852 -11.099 -7.292 451 HG3 ARG 60 HG3 ARG 60 74.766 -9.714 -7.303 452 HD2 ARG 60 HD2 ARG 60 76.951 -9.023 -6.575 453 HD3 ARG 60 HD3 ARG 60 75.837 -8.935 -5.211 454 HE ARG 60 HE ARG 60 76.997 -10.542 -4.156 455 HH11 ARG 60 HH11 ARG 60 77.999 -10.707 -7.576 456 HH12 ARG 60 HH12 ARG 60 79.469 -11.472 -7.256 457 HH21 ARG 60 HH21 ARG 60 79.051 -11.652 -3.742 458 HH22 ARG 60 HH22 ARG 60 80.090 -12.013 -5.037 459 H ALA 61 H ALA 61 71.026 -11.512 -5.696 460 HA ALA 61 HA ALA 61 70.919 -13.866 -4.044 461 HB1 ALA 61 HB1 ALA 61 69.868 -11.777 -3.325 462 HB2 ALA 61 HB2 ALA 61 68.715 -13.105 -3.404 463 HB3 ALA 61 HB3 ALA 61 68.741 -11.881 -4.681 464 H ALA 62 H ALA 62 69.716 -12.950 -7.196 465 HA ALA 62 HA ALA 62 67.765 -14.923 -7.602 466 HB1 ALA 62 HB1 ALA 62 68.160 -13.042 -9.170 467 HB2 ALA 62 HB2 ALA 62 68.142 -14.600 -9.993 468 HB3 ALA 62 HB3 ALA 62 69.675 -13.797 -9.658 469 H ALA 63 H ALA 63 71.196 -14.958 -8.181 470 HA ALA 63 HA ALA 63 71.190 -17.827 -7.778 471 HB1 ALA 63 HB1 ALA 63 72.818 -18.121 -9.534 472 HB2 ALA 63 HB2 ALA 63 72.638 -16.430 -10.008 473 HB3 ALA 63 HB3 ALA 63 71.277 -17.561 -10.204 474 H ASN 64 H ASN 64 72.053 -17.534 -5.832 475 HA ASN 64 HA ASN 64 74.014 -15.715 -5.119 476 HB2 ASN 64 HB2 ASN 64 73.560 -18.448 -3.906 477 HB3 ASN 64 HB3 ASN 64 74.568 -17.147 -3.290 478 HD21 ASN 64 HD21 ASN 64 72.595 -15.037 -3.948 479 HD22 ASN 64 HD22 ASN 64 71.366 -15.249 -2.744 480 HA PRO 65 HA PRO 65 77.500 -17.649 -7.182 481 HB2 PRO 65 HB2 PRO 65 79.228 -15.611 -6.880 482 HB3 PRO 65 HB3 PRO 65 77.886 -15.516 -8.027 483 HG2 PRO 65 HG2 PRO 65 78.145 -14.310 -5.310 484 HG3 PRO 65 HG3 PRO 65 77.434 -13.622 -6.776 485 HD2 PRO 65 HD2 PRO 65 75.993 -14.767 -4.709 486 HD3 PRO 65 HD3 PRO 65 75.399 -14.584 -6.369 487 H GLY 66 H GLY 66 76.968 -17.081 -3.999 488 HA2 GLY 66 HA2 GLY 66 78.921 -18.852 -3.043 489 HA3 GLY 66 HA3 GLY 66 79.417 -17.190 -2.710 490 H GLY 67 H GLY 67 79.007 -16.756 -0.709 491 HA2 GLY 67 HA2 GLY 67 76.295 -16.985 0.225 492 HA3 GLY 67 HA3 GLY 67 77.460 -18.081 0.972 493 H ASP 68 H ASP 68 77.780 -14.751 -0.100 494 HA ASP 68 HA ASP 68 78.884 -14.060 2.537 495 HB2 ASP 68 HB2 ASP 68 78.863 -12.467 -0.033 496 HB3 ASP 68 HB3 ASP 68 79.627 -11.967 1.467 497 H GLY 69 H GLY 69 76.324 -13.426 0.327 498 HA2 GLY 69 HA2 GLY 69 74.237 -12.872 1.657 499 HA3 GLY 69 HA3 GLY 69 75.166 -11.453 2.164 500 H GLY 70 H GLY 70 73.607 -13.089 -0.434 501 HA2 GLY 70 HA2 GLY 70 73.952 -10.752 -2.157 502 HA3 GLY 70 HA3 GLY 70 73.291 -12.318 -2.637 503 H GLY 71 H GLY 71 72.489 -9.155 -1.495 504 HA2 GLY 71 HA2 GLY 71 69.989 -9.041 -2.028 505 HA3 GLY 71 HA3 GLY 71 69.936 -10.043 -0.584 506 HA PRO 72 HA PRO 72 69.526 -5.452 0.384 507 HB2 PRO 72 HB2 PRO 72 67.882 -6.360 2.544 508 HB3 PRO 72 HB3 PRO 72 67.435 -5.440 1.108 509 HG2 PRO 72 HG2 PRO 72 67.134 -8.300 1.639 510 HG3 PRO 72 HG3 PRO 72 66.317 -7.283 0.450 511 HD2 PRO 72 HD2 PRO 72 68.210 -9.154 -0.148 512 HD3 PRO 72 HD3 PRO 72 67.946 -7.776 -1.197 513 H GLU 73 H GLU 73 69.683 -8.087 2.772 514 HA GLU 73 HA GLU 73 71.102 -6.452 4.693 515 HB2 GLU 73 HB2 GLU 73 70.695 -9.438 4.777 516 HB3 GLU 73 HB3 GLU 73 70.935 -8.339 6.125 517 HG2 GLU 73 HG2 GLU 73 68.741 -7.301 5.638 518 HG3 GLU 73 HG3 GLU 73 68.522 -8.461 4.343 519 H GLY 74 H GLY 74 72.246 -7.830 1.937 520 HA2 GLY 74 HA2 GLY 74 74.757 -8.060 3.322 521 HA3 GLY 74 HA3 GLY 74 74.504 -8.920 1.752 522 H ILE 75 H ILE 75 73.292 -6.519 0.558 523 HA ILE 75 HA ILE 75 75.566 -5.036 -0.172 524 HB ILE 75 HB ILE 75 73.827 -3.168 -0.681 525 HG12 ILE 75 HG12 ILE 75 72.018 -5.580 -0.467 526 HG13 ILE 75 HG13 ILE 75 72.079 -4.225 0.654 527 HG21 ILE 75 HG21 ILE 75 75.049 -4.256 -2.303 528 HG22 ILE 75 HG22 ILE 75 73.363 -4.183 -2.828 529 HG23 ILE 75 HG23 ILE 75 74.046 -5.712 -2.228 530 HD11 ILE 75 HD11 ILE 75 70.212 -4.117 -0.829 531 HD12 ILE 75 HD12 ILE 75 71.294 -4.036 -2.243 532 HD13 ILE 75 HD13 ILE 75 71.307 -2.754 -0.996 533 H VAL 76 H VAL 76 73.277 -4.568 2.478 534 HA VAL 76 HA VAL 76 73.985 -2.043 3.130 535 HB VAL 76 HB VAL 76 73.296 -2.741 5.341 536 HG11 VAL 76 HG11 VAL 76 70.943 -2.879 4.779 537 HG12 VAL 76 HG12 VAL 76 71.381 -3.418 3.160 538 HG13 VAL 76 HG13 VAL 76 71.779 -1.782 3.678 539 HG21 VAL 76 HG21 VAL 76 72.156 -4.798 5.686 540 HG22 VAL 76 HG22 VAL 76 73.877 -4.998 5.360 541 HG23 VAL 76 HG23 VAL 76 72.691 -5.346 4.092 542 H LYS 77 H LYS 77 75.529 -5.030 3.812 543 HA LYS 77 HA LYS 77 77.417 -4.079 5.670 544 HB2 LYS 77 HB2 LYS 77 76.892 -6.467 5.274 545 HB3 LYS 77 HB3 LYS 77 77.654 -6.347 3.698 546 HG2 LYS 77 HG2 LYS 77 79.801 -5.840 4.800 547 HG3 LYS 77 HG3 LYS 77 79.017 -6.065 6.366 548 HD2 LYS 77 HD2 LYS 77 79.067 -8.129 4.203 549 HD3 LYS 77 HD3 LYS 77 80.263 -8.082 5.509 550 HE2 LYS 77 HE2 LYS 77 77.262 -8.437 5.812 551 HE3 LYS 77 HE3 LYS 77 78.461 -9.720 5.916 552 HZ1 LYS 77 HZ1 LYS 77 79.426 -8.550 7.837 553 HZ2 LYS 77 HZ2 LYS 77 77.849 -9.042 8.097 554 HZ3 LYS 77 HZ3 LYS 77 78.165 -7.424 7.788 555 H GLU 78 H GLU 78 77.441 -4.412 2.118 556 HA GLU 78 HA GLU 78 80.040 -3.429 1.588 557 HB2 GLU 78 HB2 GLU 78 78.476 -4.559 -0.086 558 HB3 GLU 78 HB3 GLU 78 77.552 -3.092 -0.201 559 HG2 GLU 78 HG2 GLU 78 79.018 -3.244 -2.052 560 HG3 GLU 78 HG3 GLU 78 79.536 -1.916 -1.013 561 H ILE 79 H ILE 79 76.937 -1.915 1.928 562 HA ILE 79 HA ILE 79 77.665 0.660 1.303 563 HB ILE 79 HB ILE 79 75.351 -0.269 3.030 564 HG12 ILE 79 HG12 ILE 79 75.456 0.528 0.133 565 HG13 ILE 79 HG13 ILE 79 75.432 -1.132 0.702 566 HG21 ILE 79 HG21 ILE 79 74.311 1.887 2.510 567 HG22 ILE 79 HG22 ILE 79 75.778 2.396 1.675 568 HG23 ILE 79 HG23 ILE 79 75.807 2.104 3.415 569 HD11 ILE 79 HD11 ILE 79 73.245 -0.474 -0.036 570 HD12 ILE 79 HD12 ILE 79 73.264 0.924 1.036 571 HD13 ILE 79 HD13 ILE 79 73.214 -0.705 1.712 572 H LYS 80 H LYS 80 77.475 -0.995 4.514 573 HA LYS 80 HA LYS 80 77.978 1.347 5.989 574 HB2 LYS 80 HB2 LYS 80 78.276 -0.113 7.944 575 HB3 LYS 80 HB3 LYS 80 76.926 -0.684 6.974 576 HG2 LYS 80 HG2 LYS 80 78.216 -2.439 6.073 577 HG3 LYS 80 HG3 LYS 80 79.657 -1.853 6.879 578 HD2 LYS 80 HD2 LYS 80 78.694 -3.733 8.058 579 HD3 LYS 80 HD3 LYS 80 78.672 -2.262 9.047 580 HE2 LYS 80 HE2 LYS 80 76.257 -1.994 8.434 581 HE3 LYS 80 HE3 LYS 80 76.342 -3.534 7.585 582 HZ1 LYS 80 HZ1 LYS 80 76.856 -3.130 10.479 583 HZ2 LYS 80 HZ2 LYS 80 76.922 -4.607 9.693 584 HZ3 LYS 80 HZ3 LYS 80 75.446 -3.798 9.854 585 H GLU 81 H GLU 81 80.097 -1.193 4.726 586 HA GLU 81 HA GLU 81 82.347 -0.269 6.103 587 HB2 GLU 81 HB2 GLU 81 82.242 -2.017 3.643 588 HB3 GLU 81 HB3 GLU 81 83.653 -1.779 4.666 589 HG2 GLU 81 HG2 GLU 81 82.335 -2.714 6.566 590 HG3 GLU 81 HG3 GLU 81 81.057 -3.096 5.420 591 H TRP 82 H TRP 82 80.975 0.564 3.040 592 HA TRP 82 HA TRP 82 83.258 1.848 1.977 593 HB2 TRP 82 HB2 TRP 82 81.227 1.168 0.654 594 HB3 TRP 82 HB3 TRP 82 80.373 2.513 1.394 595 HD1 TRP 82 HD1 TRP 82 82.960 1.709 -1.266 596 HE1 TRP 82 HE1 TRP 82 83.356 3.790 -2.708 597 HE3 TRP 82 HE3 TRP 82 80.393 5.124 1.502 598 HZ2 TRP 82 HZ2 TRP 82 82.656 6.523 -2.695 599 HZ3 TRP 82 HZ3 TRP 82 80.299 7.435 0.738 600 HH2 TRP 82 HH2 TRP 82 81.403 8.141 -1.289 601 H ARG 83 H ARG 83 80.459 3.089 3.786 602 HA ARG 83 HA ARG 83 81.530 5.734 3.770 603 HB2 ARG 83 HB2 ARG 83 79.200 4.570 5.224 604 HB3 ARG 83 HB3 ARG 83 79.846 6.123 5.720 605 HG2 ARG 83 HG2 ARG 83 78.184 6.736 4.323 606 HG3 ARG 83 HG3 ARG 83 79.556 6.748 3.217 607 HD2 ARG 83 HD2 ARG 83 77.608 5.685 2.170 608 HD3 ARG 83 HD3 ARG 83 78.876 4.492 2.427 609 HE ARG 83 HE ARG 83 77.604 3.395 3.807 610 HH11 ARG 83 HH11 ARG 83 76.127 6.552 3.250 611 HH12 ARG 83 HH12 ARG 83 74.832 6.330 4.312 612 HH21 ARG 83 HH21 ARG 83 75.752 3.015 5.246 613 HH22 ARG 83 HH22 ARG 83 74.630 4.261 5.512 614 H ALA 84 H ALA 84 81.675 3.100 6.049 615 HA ALA 84 HA ALA 84 82.667 4.556 8.212 616 HB1 ALA 84 HB1 ALA 84 83.440 2.409 9.086 617 HB2 ALA 84 HB2 ALA 84 83.209 1.673 7.500 618 HB3 ALA 84 HB3 ALA 84 81.817 2.261 8.410 619 H ALA 85 H ALA 85 84.364 2.861 5.591 620 HA ALA 85 HA ALA 85 86.940 3.638 6.551 621 HB1 ALA 85 HB1 ALA 85 87.785 2.684 4.485 622 HB2 ALA 85 HB2 ALA 85 86.148 2.609 3.837 623 HB3 ALA 85 HB3 ALA 85 86.595 1.604 5.216 624 H ASN 86 H ASN 86 84.586 5.054 4.476 625 HA ASN 86 HA ASN 86 86.402 6.823 3.102 626 HB2 ASN 86 HB2 ASN 86 84.068 6.067 2.265 627 HB3 ASN 86 HB3 ASN 86 83.440 7.259 3.384 628 HD21 ASN 86 HD21 ASN 86 83.769 9.465 2.962 629 HD22 ASN 86 HD22 ASN 86 84.278 9.981 1.400 630 H GLY 87 H GLY 87 84.473 6.948 5.988 631 HA2 GLY 87 HA2 GLY 87 84.784 8.451 7.777 632 HA3 GLY 87 HA3 GLY 87 85.647 9.537 6.689 633 H LYS 88 H LYS 88 82.472 7.990 6.222 634 HA LYS 88 HA LYS 88 81.243 10.597 6.173 635 HB2 LYS 88 HB2 LYS 88 81.627 8.567 4.129 636 HB3 LYS 88 HB3 LYS 88 79.964 9.070 4.327 637 HG2 LYS 88 HG2 LYS 88 80.616 11.405 3.870 638 HG3 LYS 88 HG3 LYS 88 82.314 10.915 3.879 639 HD2 LYS 88 HD2 LYS 88 81.389 11.288 1.599 640 HD3 LYS 88 HD3 LYS 88 82.049 9.676 1.855 641 HE2 LYS 88 HE2 LYS 88 80.003 9.543 0.615 642 HE3 LYS 88 HE3 LYS 88 79.794 8.832 2.203 643 HZ1 LYS 88 HZ1 LYS 88 78.700 10.923 2.903 644 HZ2 LYS 88 HZ2 LYS 88 77.908 10.196 1.650 645 HZ3 LYS 88 HZ3 LYS 88 78.898 11.533 1.351 646 HA PRO 89 HA PRO 89 78.092 8.801 8.789 647 HB2 PRO 89 HB2 PRO 89 76.093 9.788 6.813 648 HB3 PRO 89 HB3 PRO 89 76.188 10.084 8.554 649 HG2 PRO 89 HG2 PRO 89 76.869 11.976 6.823 650 HG3 PRO 89 HG3 PRO 89 77.786 11.737 8.323 651 HD2 PRO 89 HD2 PRO 89 78.484 10.971 5.525 652 HD3 PRO 89 HD3 PRO 89 79.525 11.560 6.834 653 H GLY 90 H GLY 90 77.518 6.762 8.943 654 HA2 GLY 90 HA2 GLY 90 76.822 5.333 6.488 655 HA3 GLY 90 HA3 GLY 90 77.584 4.560 7.893 656 H PHE 91 H PHE 91 76.220 3.935 9.596 657 HA PHE 91 HA PHE 91 73.349 4.471 9.220 658 HB2 PHE 91 HB2 PHE 91 74.571 1.821 10.047 659 HB3 PHE 91 HB3 PHE 91 72.858 2.185 10.032 660 HD1 PHE 91 HD1 PHE 91 71.881 2.875 7.735 661 HD2 PHE 91 HD2 PHE 91 75.554 0.799 8.236 662 HE1 PHE 91 HE1 PHE 91 71.738 2.052 5.433 663 HE2 PHE 91 HE2 PHE 91 75.398 -0.027 5.921 664 HZ PHE 91 HZ PHE 91 73.493 0.601 4.526 665 H LYS 92 H LYS 92 72.186 4.663 11.214 666 HA LYS 92 HA LYS 92 73.904 5.180 13.422 667 HB2 LYS 92 HB2 LYS 92 71.936 5.943 14.505 668 HB3 LYS 92 HB3 LYS 92 71.969 6.643 12.919 669 HG2 LYS 92 HG2 LYS 92 70.262 5.126 12.176 670 HG3 LYS 92 HG3 LYS 92 70.409 4.204 13.675 671 HD2 LYS 92 HD2 LYS 92 69.502 7.081 13.550 672 HD3 LYS 92 HD3 LYS 92 68.401 5.705 13.549 673 HE2 LYS 92 HE2 LYS 92 69.411 5.002 15.739 674 HE3 LYS 92 HE3 LYS 92 70.336 6.501 15.732 675 HZ1 LYS 92 HZ1 LYS 92 68.244 7.735 15.716 676 HZ2 LYS 92 HZ2 LYS 92 68.356 6.741 17.060 677 HZ3 LYS 92 HZ3 LYS 92 67.362 6.296 15.777 678 H GLN 93 H GLN 93 73.223 4.207 15.482 679 HA GLN 93 HA GLN 93 72.858 1.387 15.102 680 HB2 GLN 93 HB2 GLN 93 73.797 3.192 17.209 681 HB3 GLN 93 HB3 GLN 93 73.521 1.492 17.587 682 HG2 GLN 93 HG2 GLN 93 75.872 1.681 17.203 683 HG3 GLN 93 HG3 GLN 93 75.227 1.006 15.718 684 HE21 GLN 93 HE21 GLN 93 75.091 4.420 16.671 685 HE22 GLN 93 HE22 GLN 93 76.101 4.979 15.401 686 H GLY 94 H GLY 94 71.132 0.407 15.878 687 HA2 GLY 94 HA2 GLY 94 69.432 1.305 17.916 688 HA3 GLY 94 HA3 GLY 94 68.725 1.709 16.350 Start of MODEL 11 1 H GLU 2 H GLU 2 61.171 2.669 9.583 2 HA GLU 2 HA GLU 2 59.246 2.978 7.361 3 HB2 GLU 2 HB2 GLU 2 59.653 4.771 9.763 4 HB3 GLU 2 HB3 GLU 2 58.688 5.178 8.348 5 HG2 GLU 2 HG2 GLU 2 58.162 2.974 10.326 6 HG3 GLU 2 HG3 GLU 2 57.229 4.457 10.104 7 H LEU 3 H LEU 3 59.700 5.301 6.411 8 HA LEU 3 HA LEU 3 62.513 5.144 5.708 9 HB2 LEU 3 HB2 LEU 3 60.347 6.877 4.530 10 HB3 LEU 3 HB3 LEU 3 61.951 6.631 3.875 11 HG LEU 3 HG LEU 3 59.697 4.655 3.995 12 HD11 LEU 3 HD11 LEU 3 59.929 4.659 1.522 13 HD12 LEU 3 HD12 LEU 3 61.194 5.866 1.648 14 HD13 LEU 3 HD13 LEU 3 59.557 6.265 2.135 15 HD21 LEU 3 HD21 LEU 3 61.224 3.066 2.910 16 HD22 LEU 3 HD22 LEU 3 61.731 3.507 4.545 17 HD23 LEU 3 HD23 LEU 3 62.548 4.219 3.156 18 H LYS 4 H LYS 4 63.919 6.697 6.146 19 HA LYS 4 HA LYS 4 63.068 8.780 7.993 20 HB2 LYS 4 HB2 LYS 4 65.891 8.068 7.186 21 HB3 LYS 4 HB3 LYS 4 65.388 8.985 8.598 22 HG2 LYS 4 HG2 LYS 4 65.288 6.044 8.075 23 HG3 LYS 4 HG3 LYS 4 66.062 6.884 9.406 24 HD2 LYS 4 HD2 LYS 4 63.638 7.609 9.950 25 HD3 LYS 4 HD3 LYS 4 63.211 6.277 8.909 26 HE2 LYS 4 HE2 LYS 4 64.752 4.805 10.252 27 HE3 LYS 4 HE3 LYS 4 64.875 6.109 11.401 28 HZ1 LYS 4 HZ1 LYS 4 62.287 5.959 11.456 29 HZ2 LYS 4 HZ2 LYS 4 63.237 4.864 12.301 30 HZ3 LYS 4 HZ3 LYS 4 62.573 4.379 10.845 31 H ASN 5 H ASN 5 65.191 10.567 7.430 32 HA ASN 5 HA ASN 5 64.575 11.346 4.668 33 HB2 ASN 5 HB2 ASN 5 65.117 13.125 7.052 34 HB3 ASN 5 HB3 ASN 5 65.097 13.699 5.390 35 HD21 ASN 5 HD21 ASN 5 63.151 13.778 4.303 36 HD22 ASN 5 HD22 ASN 5 61.622 13.712 5.102 37 H SER 6 H SER 6 67.040 10.782 7.028 38 HA SER 6 HA SER 6 68.990 10.971 4.886 39 HB2 SER 6 HB2 SER 6 70.626 11.980 6.408 40 HB3 SER 6 HB3 SER 6 69.216 13.026 6.257 41 HG SER 6 HG SER 6 68.551 12.456 8.254 42 H ILE 7 H ILE 7 71.036 9.737 5.598 43 HA ILE 7 HA ILE 7 70.273 7.120 6.300 44 HB ILE 7 HB ILE 7 72.244 7.741 4.805 45 HG12 ILE 7 HG12 ILE 7 72.928 5.883 7.105 46 HG13 ILE 7 HG13 ILE 7 71.954 5.440 5.709 47 HG21 ILE 7 HG21 ILE 7 73.213 9.500 6.190 48 HG22 ILE 7 HG22 ILE 7 74.397 8.243 5.844 49 HG23 ILE 7 HG23 ILE 7 73.619 8.311 7.423 50 HD11 ILE 7 HD11 ILE 7 73.882 5.823 4.252 51 HD12 ILE 7 HD12 ILE 7 74.238 4.626 5.501 52 HD13 ILE 7 HD13 ILE 7 74.852 6.271 5.655 53 H SER 8 H SER 8 70.781 9.778 8.234 54 HA SER 8 HA SER 8 72.436 8.652 10.275 55 HB2 SER 8 HB2 SER 8 72.389 11.086 9.572 56 HB3 SER 8 HB3 SER 8 70.836 11.207 10.382 57 HG SER 8 HG SER 8 71.924 11.561 12.087 58 H ASP 9 H ASP 9 68.991 8.919 9.710 59 HA ASP 9 HA ASP 9 68.597 8.104 12.485 60 HB2 ASP 9 HB2 ASP 9 67.045 9.869 11.329 61 HB3 ASP 9 HB3 ASP 9 66.374 8.492 10.525 62 H TYR 10 H TYR 10 69.295 6.729 9.683 63 HA TYR 10 HA TYR 10 67.434 4.527 9.734 64 HB2 TYR 10 HB2 TYR 10 69.650 5.328 7.903 65 HB3 TYR 10 HB3 TYR 10 69.240 3.625 7.997 66 HD1 TYR 10 HD1 TYR 10 66.906 2.922 7.433 67 HD2 TYR 10 HD2 TYR 10 68.339 6.836 6.634 68 HE1 TYR 10 HE1 TYR 10 65.076 3.250 5.834 69 HE2 TYR 10 HE2 TYR 10 66.514 7.183 5.028 70 HH TYR 10 HH TYR 10 64.941 5.967 3.722 71 H THR 11 H THR 11 67.681 3.037 11.239 72 HA THR 11 HA THR 11 70.288 2.332 12.175 73 HB THR 11 HB THR 11 69.154 0.488 13.329 74 HG1 THR 11 HG1 THR 11 66.766 0.400 12.968 75 HG21 THR 11 HG21 THR 11 67.448 1.694 14.627 76 HG22 THR 11 HG22 THR 11 67.435 2.968 13.408 77 HG23 THR 11 HG23 THR 11 68.889 2.673 14.362 78 H GLU 12 H GLU 12 71.156 0.107 11.591 79 HA GLU 12 HA GLU 12 71.032 -0.099 8.813 80 HB2 GLU 12 HB2 GLU 12 72.278 -2.280 9.092 81 HB3 GLU 12 HB3 GLU 12 73.040 -0.824 9.696 82 HG2 GLU 12 HG2 GLU 12 72.499 -1.395 11.924 83 HG3 GLU 12 HG3 GLU 12 71.579 -2.803 11.438 84 H ALA 13 H ALA 13 69.215 -1.776 11.240 85 HA ALA 13 HA ALA 13 68.046 -3.594 9.405 86 HB1 ALA 13 HB1 ALA 13 66.457 -4.110 11.135 87 HB2 ALA 13 HB2 ALA 13 66.925 -2.667 12.032 88 HB3 ALA 13 HB3 ALA 13 68.074 -3.996 11.829 89 H GLU 14 H GLU 14 67.044 -0.342 10.551 90 HA GLU 14 HA GLU 14 64.577 -0.185 9.210 91 HB2 GLU 14 HB2 GLU 14 66.646 1.879 9.921 92 HB3 GLU 14 HB3 GLU 14 65.271 2.345 8.941 93 HG2 GLU 14 HG2 GLU 14 65.113 1.104 11.673 94 HG3 GLU 14 HG3 GLU 14 65.008 2.831 11.335 95 H PHE 15 H PHE 15 67.821 0.283 8.188 96 HA PHE 15 HA PHE 15 67.251 1.209 5.591 97 HB2 PHE 15 HB2 PHE 15 69.324 1.597 6.966 98 HB3 PHE 15 HB3 PHE 15 69.774 -0.061 6.619 99 HD1 PHE 15 HD1 PHE 15 68.975 3.172 5.027 100 HD2 PHE 15 HD2 PHE 15 70.926 -0.568 4.718 101 HE1 PHE 15 HE1 PHE 15 70.104 3.940 2.979 102 HE2 PHE 15 HE2 PHE 15 72.074 0.198 2.657 103 HZ PHE 15 HZ PHE 15 71.644 2.448 1.811 104 H VAL 16 H VAL 16 68.178 -2.002 6.937 105 HA VAL 16 HA VAL 16 68.204 -3.296 4.450 106 HB VAL 16 HB VAL 16 68.232 -5.402 5.492 107 HG11 VAL 16 HG11 VAL 16 69.666 -3.509 7.219 108 HG12 VAL 16 HG12 VAL 16 70.259 -4.538 5.898 109 HG13 VAL 16 HG13 VAL 16 69.763 -5.247 7.428 110 HG21 VAL 16 HG21 VAL 16 66.955 -4.243 7.950 111 HG22 VAL 16 HG22 VAL 16 67.668 -5.865 7.846 112 HG23 VAL 16 HG23 VAL 16 66.305 -5.432 6.817 113 H GLN 17 H GLN 17 65.551 -2.639 6.662 114 HA GLN 17 HA GLN 17 63.541 -4.205 5.557 115 HB2 GLN 17 HB2 GLN 17 63.719 -2.732 7.682 116 HB3 GLN 17 HB3 GLN 17 63.222 -1.435 6.625 117 HG2 GLN 17 HG2 GLN 17 61.635 -3.920 7.087 118 HG3 GLN 17 HG3 GLN 17 61.439 -2.451 8.033 119 HE21 GLN 17 HE21 GLN 17 60.532 -0.670 7.031 120 HE22 GLN 17 HE22 GLN 17 59.572 -0.743 5.605 121 H LEU 18 H LEU 18 64.519 -0.857 4.919 122 HA LEU 18 HA LEU 18 62.743 -0.201 2.866 123 HB2 LEU 18 HB2 LEU 18 63.989 1.506 3.848 124 HB3 LEU 18 HB3 LEU 18 65.505 0.740 3.625 125 HG LEU 18 HG LEU 18 65.361 1.146 1.180 126 HD11 LEU 18 HD11 LEU 18 62.971 1.288 0.906 127 HD12 LEU 18 HD12 LEU 18 63.775 2.735 0.299 128 HD13 LEU 18 HD13 LEU 18 62.936 2.778 1.848 129 HD21 LEU 18 HD21 LEU 18 65.830 3.548 1.292 130 HD22 LEU 18 HD22 LEU 18 66.614 2.652 2.593 131 HD23 LEU 18 HD23 LEU 18 65.157 3.588 2.923 132 H LEU 19 H LEU 19 65.930 -1.454 2.763 133 HA LEU 19 HA LEU 19 66.234 -1.766 -0.022 134 HB2 LEU 19 HB2 LEU 19 67.532 -2.764 2.362 135 HB3 LEU 19 HB3 LEU 19 67.855 -3.668 0.881 136 HG LEU 19 HG LEU 19 68.736 -1.656 -0.174 137 HD11 LEU 19 HD11 LEU 19 68.037 -0.298 2.405 138 HD12 LEU 19 HD12 LEU 19 67.289 -0.002 0.827 139 HD13 LEU 19 HD13 LEU 19 68.994 0.401 1.096 140 HD21 LEU 19 HD21 LEU 19 70.631 -1.283 1.210 141 HD22 LEU 19 HD22 LEU 19 70.152 -2.995 1.181 142 HD23 LEU 19 HD23 LEU 19 69.763 -1.987 2.583 143 H LYS 20 H LYS 20 64.982 -4.040 2.354 144 HA LYS 20 HA LYS 20 64.666 -6.151 0.580 145 HB2 LYS 20 HB2 LYS 20 63.006 -5.470 2.993 146 HB3 LYS 20 HB3 LYS 20 62.924 -7.020 2.151 147 HG2 LYS 20 HG2 LYS 20 65.490 -7.050 2.650 148 HG3 LYS 20 HG3 LYS 20 65.064 -5.864 3.850 149 HD2 LYS 20 HD2 LYS 20 63.439 -7.354 4.870 150 HD3 LYS 20 HD3 LYS 20 63.821 -8.603 3.682 151 HE2 LYS 20 HE2 LYS 20 66.173 -8.560 4.501 152 HE3 LYS 20 HE3 LYS 20 65.670 -7.444 5.764 153 HZ1 LYS 20 HZ1 LYS 20 64.069 -9.203 6.497 154 HZ2 LYS 20 HZ2 LYS 20 65.674 -9.609 6.678 155 HZ3 LYS 20 HZ3 LYS 20 64.803 -10.267 5.419 156 H GLU 21 H GLU 21 62.666 -3.399 1.369 157 HA GLU 21 HA GLU 21 60.420 -4.160 -0.161 158 HB2 GLU 21 HB2 GLU 21 61.317 -1.466 0.838 159 HB3 GLU 21 HB3 GLU 21 59.807 -1.711 -0.020 160 HG2 GLU 21 HG2 GLU 21 60.591 -2.974 2.593 161 HG3 GLU 21 HG3 GLU 21 59.461 -1.639 2.379 162 H ILE 22 H ILE 22 63.236 -2.184 -0.800 163 HA ILE 22 HA ILE 22 62.525 -1.325 -3.365 164 HB ILE 22 HB ILE 22 65.385 -1.890 -2.485 165 HG12 ILE 22 HG12 ILE 22 63.681 0.577 -2.044 166 HG13 ILE 22 HG13 ILE 22 64.273 -0.503 -0.808 167 HG21 ILE 22 HG21 ILE 22 65.876 -0.080 -4.087 168 HG22 ILE 22 HG22 ILE 22 64.162 0.028 -4.472 169 HG23 ILE 22 HG23 ILE 22 65.057 -1.436 -4.867 170 HD11 ILE 22 HD11 ILE 22 65.997 1.216 -2.569 171 HD12 ILE 22 HD12 ILE 22 66.561 0.153 -1.280 172 HD13 ILE 22 HD13 ILE 22 65.566 1.558 -0.896 173 H GLU 23 H GLU 23 64.248 -4.200 -2.268 174 HA GLU 23 HA GLU 23 64.926 -5.341 -4.723 175 HB2 GLU 23 HB2 GLU 23 63.990 -6.591 -2.186 176 HB3 GLU 23 HB3 GLU 23 64.609 -7.556 -3.490 177 HG2 GLU 23 HG2 GLU 23 66.762 -6.227 -3.235 178 HG3 GLU 23 HG3 GLU 23 66.020 -5.535 -1.787 179 H LYS 24 H LYS 24 62.018 -5.594 -2.841 180 HA LYS 24 HA LYS 24 60.670 -7.480 -4.385 181 HB2 LYS 24 HB2 LYS 24 60.073 -7.054 -2.141 182 HB3 LYS 24 HB3 LYS 24 59.721 -5.370 -2.490 183 HG2 LYS 24 HG2 LYS 24 57.796 -6.036 -3.856 184 HG3 LYS 24 HG3 LYS 24 58.160 -7.733 -3.544 185 HD2 LYS 24 HD2 LYS 24 56.337 -6.911 -2.108 186 HD3 LYS 24 HD3 LYS 24 57.742 -7.418 -1.178 187 HE2 LYS 24 HE2 LYS 24 58.428 -5.097 -0.891 188 HE3 LYS 24 HE3 LYS 24 57.083 -4.557 -1.895 189 HZ1 LYS 24 HZ1 LYS 24 56.739 -6.036 0.671 190 HZ2 LYS 24 HZ2 LYS 24 55.544 -5.236 -0.218 191 HZ3 LYS 24 HZ3 LYS 24 56.773 -4.362 0.535 192 H GLU 25 H GLU 25 60.396 -3.917 -4.395 193 HA GLU 25 HA GLU 25 58.574 -4.131 -6.578 194 HB2 GLU 25 HB2 GLU 25 58.565 -1.574 -6.470 195 HB3 GLU 25 HB3 GLU 25 57.950 -2.426 -5.030 196 HG2 GLU 25 HG2 GLU 25 59.211 -0.661 -4.242 197 HG3 GLU 25 HG3 GLU 25 60.380 -1.985 -4.206 198 H ASN 26 H ASN 26 61.951 -3.646 -6.294 199 HA ASN 26 HA ASN 26 62.423 -2.652 -8.909 200 HB2 ASN 26 HB2 ASN 26 64.169 -2.594 -7.165 201 HB3 ASN 26 HB3 ASN 26 64.190 -4.350 -7.115 202 HD21 ASN 26 HD21 ASN 26 66.336 -4.488 -7.616 203 HD22 ASN 26 HD22 ASN 26 66.955 -4.163 -9.192 204 H VAL 27 H VAL 27 62.335 -5.929 -7.558 205 HA VAL 27 HA VAL 27 62.806 -7.226 -10.047 206 HB VAL 27 HB VAL 27 61.626 -8.325 -7.458 207 HG11 VAL 27 HG11 VAL 27 62.679 -9.846 -9.843 208 HG12 VAL 27 HG12 VAL 27 60.982 -9.720 -9.384 209 HG13 VAL 27 HG13 VAL 27 62.125 -10.552 -8.323 210 HG21 VAL 27 HG21 VAL 27 64.405 -8.531 -8.615 211 HG22 VAL 27 HG22 VAL 27 63.850 -9.287 -7.119 212 HG23 VAL 27 HG23 VAL 27 63.919 -7.529 -7.248 213 H ALA 28 H ALA 28 59.905 -6.183 -8.376 214 HA ALA 28 HA ALA 28 58.127 -7.392 -10.326 215 HB1 ALA 28 HB1 ALA 28 57.415 -7.184 -7.990 216 HB2 ALA 28 HB2 ALA 28 56.343 -6.272 -9.056 217 HB3 ALA 28 HB3 ALA 28 57.558 -5.431 -8.098 218 H ALA 29 H ALA 29 60.058 -4.770 -10.220 219 HA ALA 29 HA ALA 29 60.365 -2.852 -11.257 220 HB1 ALA 29 HB1 ALA 29 60.560 -4.410 -13.145 221 HB2 ALA 29 HB2 ALA 29 60.028 -2.793 -13.620 222 HB3 ALA 29 HB3 ALA 29 58.860 -4.113 -13.532 223 H THR 30 H THR 30 59.138 -1.563 -9.843 224 HA THR 30 HA THR 30 56.638 -0.622 -11.037 225 HB THR 30 HB THR 30 56.150 0.483 -8.961 226 HG1 THR 30 HG1 THR 30 58.741 -0.054 -7.786 227 HG21 THR 30 HG21 THR 30 55.879 -1.924 -8.814 228 HG22 THR 30 HG22 THR 30 56.398 -1.267 -7.250 229 HG23 THR 30 HG23 THR 30 57.561 -2.078 -8.306 230 H ASP 31 H ASP 31 56.687 2.031 -10.490 231 HA ASP 31 HA ASP 31 59.357 2.924 -11.224 232 HB2 ASP 31 HB2 ASP 31 58.741 4.305 -13.016 233 HB3 ASP 31 HB3 ASP 31 57.974 2.759 -13.325 234 H ASP 32 H ASP 32 56.343 3.639 -9.763 235 HA ASP 32 HA ASP 32 57.009 6.329 -9.108 236 HB2 ASP 32 HB2 ASP 32 55.015 4.478 -7.780 237 HB3 ASP 32 HB3 ASP 32 55.174 6.186 -7.414 238 H VAL 33 H VAL 33 56.864 3.445 -7.111 239 HA VAL 33 HA VAL 33 58.218 4.908 -5.037 240 HB VAL 33 HB VAL 33 56.413 3.284 -4.577 241 HG11 VAL 33 HG11 VAL 33 58.467 1.208 -5.180 242 HG12 VAL 33 HG12 VAL 33 56.943 1.482 -6.033 243 HG13 VAL 33 HG13 VAL 33 56.937 0.891 -4.361 244 HG21 VAL 33 HG21 VAL 33 57.797 4.048 -2.766 245 HG22 VAL 33 HG22 VAL 33 58.988 2.791 -3.109 246 HG23 VAL 33 HG23 VAL 33 57.389 2.350 -2.517 247 H LEU 34 H LEU 34 58.978 2.637 -7.464 248 HA LEU 34 HA LEU 34 61.536 1.739 -6.766 249 HB2 LEU 34 HB2 LEU 34 60.104 0.936 -8.564 250 HB3 LEU 34 HB3 LEU 34 60.226 2.362 -9.438 251 HG LEU 34 HG LEU 34 61.489 0.450 -10.372 252 HD11 LEU 34 HD11 LEU 34 62.105 2.606 -11.051 253 HD12 LEU 34 HD12 LEU 34 63.555 1.604 -10.880 254 HD13 LEU 34 HD13 LEU 34 63.148 2.809 -9.642 255 HD21 LEU 34 HD21 LEU 34 63.591 -0.258 -9.359 256 HD22 LEU 34 HD22 LEU 34 62.214 -0.584 -8.303 257 HD23 LEU 34 HD23 LEU 34 63.274 0.783 -7.972 258 H ASP 35 H ASP 35 60.581 4.669 -8.502 259 HA ASP 35 HA ASP 35 63.368 5.499 -8.523 260 HB2 ASP 35 HB2 ASP 35 61.762 6.304 -10.307 261 HB3 ASP 35 HB3 ASP 35 60.993 7.284 -9.060 262 H VAL 36 H VAL 36 60.792 5.917 -6.333 263 HA VAL 36 HA VAL 36 62.009 8.056 -4.871 264 HB VAL 36 HB VAL 36 60.427 5.770 -3.702 265 HG11 VAL 36 HG11 VAL 36 59.925 7.310 -1.907 266 HG12 VAL 36 HG12 VAL 36 60.975 8.518 -2.709 267 HG13 VAL 36 HG13 VAL 36 61.660 6.990 -2.131 268 HG21 VAL 36 HG21 VAL 36 59.168 6.802 -5.370 269 HG22 VAL 36 HG22 VAL 36 59.440 8.409 -4.583 270 HG23 VAL 36 HG23 VAL 36 58.576 7.087 -3.720 271 H LEU 37 H LEU 37 62.026 4.578 -4.570 272 HA LEU 37 HA LEU 37 63.535 4.663 -2.210 273 HB2 LEU 37 HB2 LEU 37 63.246 2.312 -3.993 274 HB3 LEU 37 HB3 LEU 37 63.618 2.465 -2.283 275 HG LEU 37 HG LEU 37 60.921 3.121 -3.406 276 HD11 LEU 37 HD11 LEU 37 61.314 0.714 -3.388 277 HD12 LEU 37 HD12 LEU 37 60.097 1.184 -2.206 278 HD13 LEU 37 HD13 LEU 37 61.722 0.789 -1.671 279 HD21 LEU 37 HD21 LEU 37 61.902 3.101 -0.549 280 HD22 LEU 37 HD22 LEU 37 60.233 3.348 -1.055 281 HD23 LEU 37 HD23 LEU 37 61.468 4.524 -1.498 282 H LEU 38 H LEU 38 64.275 3.925 -5.524 283 HA LEU 38 HA LEU 38 66.924 3.221 -5.071 284 HB2 LEU 38 HB2 LEU 38 65.438 4.271 -7.405 285 HB3 LEU 38 HB3 LEU 38 67.140 3.885 -7.566 286 HG LEU 38 HG LEU 38 64.768 2.103 -7.104 287 HD11 LEU 38 HD11 LEU 38 65.290 2.638 -9.381 288 HD12 LEU 38 HD12 LEU 38 65.654 0.936 -9.056 289 HD13 LEU 38 HD13 LEU 38 66.957 2.125 -9.136 290 HD21 LEU 38 HD21 LEU 38 66.338 0.191 -6.891 291 HD22 LEU 38 HD22 LEU 38 66.363 1.290 -5.525 292 HD23 LEU 38 HD23 LEU 38 67.669 1.336 -6.695 293 H GLU 39 H GLU 39 65.488 6.346 -5.824 294 HA GLU 39 HA GLU 39 68.001 7.643 -5.830 295 HB2 GLU 39 HB2 GLU 39 65.180 8.500 -5.690 296 HB3 GLU 39 HB3 GLU 39 66.480 9.655 -5.469 297 HG2 GLU 39 HG2 GLU 39 65.983 7.915 -7.886 298 HG3 GLU 39 HG3 GLU 39 65.631 9.641 -7.694 299 H HIS 40 H HIS 40 65.526 7.097 -3.408 300 HA HIS 40 HA HIS 40 66.499 8.887 -1.516 301 HB2 HIS 40 HB2 HIS 40 64.253 7.906 -1.448 302 HB3 HIS 40 HB3 HIS 40 64.887 6.340 -1.098 303 HD1 HIS 40 HD1 HIS 40 63.475 9.201 0.617 304 HD2 HIS 40 HD2 HIS 40 66.331 6.315 1.521 305 HE1 HIS 40 HE1 HIS 40 63.747 9.232 3.103 306 H PHE 41 H PHE 41 67.008 5.491 -2.018 307 HA PHE 41 HA PHE 41 68.688 4.916 0.108 308 HB2 PHE 41 HB2 PHE 41 67.723 3.163 -1.059 309 HB3 PHE 41 HB3 PHE 41 68.193 3.824 -2.611 310 HD1 PHE 41 HD1 PHE 41 69.442 2.202 0.439 311 HD2 PHE 41 HD2 PHE 41 70.195 3.084 -3.620 312 HE1 PHE 41 HE1 PHE 41 71.377 0.663 0.463 313 HE2 PHE 41 HE2 PHE 41 72.113 1.574 -3.596 314 HZ PHE 41 HZ PHE 41 72.709 0.363 -1.583 315 H VAL 42 H VAL 42 69.517 5.785 -3.234 316 HA VAL 42 HA VAL 42 72.232 5.890 -2.563 317 HB VAL 42 HB VAL 42 71.445 5.335 -4.793 318 HG11 VAL 42 HG11 VAL 42 70.804 8.181 -5.174 319 HG12 VAL 42 HG12 VAL 42 69.752 6.731 -5.186 320 HG13 VAL 42 HG13 VAL 42 71.003 6.925 -6.420 321 HG21 VAL 42 HG21 VAL 42 73.415 7.592 -4.721 322 HG22 VAL 42 HG22 VAL 42 73.213 6.464 -6.059 323 HG23 VAL 42 HG23 VAL 42 73.773 5.887 -4.489 324 H LYS 43 H LYS 43 69.816 8.325 -2.535 325 HA LYS 43 HA LYS 43 71.598 10.551 -2.454 326 HB2 LYS 43 HB2 LYS 43 69.773 11.935 -1.906 327 HB3 LYS 43 HB3 LYS 43 69.000 10.613 -2.760 328 HG2 LYS 43 HG2 LYS 43 68.317 9.616 -0.564 329 HG3 LYS 43 HG3 LYS 43 69.170 10.911 0.226 330 HD2 LYS 43 HD2 LYS 43 67.675 12.559 -0.817 331 HD3 LYS 43 HD3 LYS 43 66.754 11.235 -1.533 332 HE2 LYS 43 HE2 LYS 43 66.201 10.385 0.691 333 HE3 LYS 43 HE3 LYS 43 67.183 11.635 1.441 334 HZ1 LYS 43 HZ1 LYS 43 65.691 13.295 0.459 335 HZ2 LYS 43 HZ2 LYS 43 64.886 12.260 1.496 336 HZ3 LYS 43 HZ3 LYS 43 64.728 12.057 -0.153 337 H ILE 44 H ILE 44 70.491 8.407 0.057 338 HA ILE 44 HA ILE 44 71.644 10.108 2.109 339 HB ILE 44 HB ILE 44 70.803 8.404 3.721 340 HG12 ILE 44 HG12 ILE 44 69.605 7.115 1.263 341 HG13 ILE 44 HG13 ILE 44 70.939 6.433 2.168 342 HG21 ILE 44 HG21 ILE 44 68.737 9.368 1.759 343 HG22 ILE 44 HG22 ILE 44 69.464 10.337 3.030 344 HG23 ILE 44 HG23 ILE 44 68.461 8.946 3.451 345 HD11 ILE 44 HD11 ILE 44 68.170 6.940 3.220 346 HD12 ILE 44 HD12 ILE 44 69.481 6.144 4.095 347 HD13 ILE 44 HD13 ILE 44 68.775 5.391 2.659 348 H THR 45 H THR 45 72.422 7.202 0.388 349 HA THR 45 HA THR 45 74.662 6.634 2.114 350 HB THR 45 HB THR 45 75.163 4.827 0.463 351 HG1 THR 45 HG1 THR 45 72.670 5.317 -0.729 352 HG21 THR 45 HG21 THR 45 73.210 3.479 0.973 353 HG22 THR 45 HG22 THR 45 72.306 4.926 1.416 354 HG23 THR 45 HG23 THR 45 73.691 4.417 2.387 355 H GLU 46 H GLU 46 74.018 8.131 -0.968 356 HA GLU 46 HA GLU 46 75.152 9.064 -2.555 357 HB2 GLU 46 HB2 GLU 46 76.737 9.826 -0.165 358 HB3 GLU 46 HB3 GLU 46 77.292 10.357 -1.766 359 HG2 GLU 46 HG2 GLU 46 74.627 10.898 -0.480 360 HG3 GLU 46 HG3 GLU 46 75.949 12.060 -0.647 361 H HIS 47 H HIS 47 75.516 6.395 -2.100 362 HA HIS 47 HA HIS 47 78.240 5.674 -2.525 363 HB2 HIS 47 HB2 HIS 47 76.423 4.244 -1.421 364 HB3 HIS 47 HB3 HIS 47 75.776 3.977 -3.034 365 HD1 HIS 47 HD1 HIS 47 76.781 1.974 -4.275 366 HD2 HIS 47 HD2 HIS 47 79.084 3.243 -1.081 367 HE1 HIS 47 HE1 HIS 47 78.742 0.400 -4.131 368 HA PRO 48 HA PRO 48 78.136 6.589 -6.958 369 HB2 PRO 48 HB2 PRO 48 80.220 4.570 -7.230 370 HB3 PRO 48 HB3 PRO 48 80.288 6.299 -7.580 371 HG2 PRO 48 HG2 PRO 48 81.530 5.095 -5.578 372 HG3 PRO 48 HG3 PRO 48 80.858 6.734 -5.307 373 HD2 PRO 48 HD2 PRO 48 79.803 4.025 -4.569 374 HD3 PRO 48 HD3 PRO 48 79.827 5.483 -3.576 375 H ASP 49 H ASP 49 77.447 3.657 -5.646 376 HA ASP 49 HA ASP 49 76.976 2.625 -8.203 377 HB2 ASP 49 HB2 ASP 49 78.022 1.032 -5.858 378 HB3 ASP 49 HB3 ASP 49 77.429 0.246 -7.286 379 H GLY 50 H GLY 50 75.386 4.051 -6.271 380 HA2 GLY 50 HA2 GLY 50 73.919 2.713 -4.242 381 HA3 GLY 50 HA3 GLY 50 73.349 4.052 -5.214 382 H THR 51 H THR 51 72.928 3.220 -7.468 383 HA THR 51 HA THR 51 70.762 1.459 -6.862 384 HB THR 51 HB THR 51 70.718 1.942 -9.637 385 HG1 THR 51 HG1 THR 51 72.009 3.655 -9.670 386 HG21 THR 51 HG21 THR 51 69.257 3.241 -7.304 387 HG22 THR 51 HG22 THR 51 68.775 1.815 -8.172 388 HG23 THR 51 HG23 THR 51 68.761 3.361 -8.985 389 H ALA 52 H ALA 52 73.819 1.259 -8.373 390 HA ALA 52 HA ALA 52 73.501 -1.178 -9.797 391 HB1 ALA 52 HB1 ALA 52 75.423 0.335 -10.107 392 HB2 ALA 52 HB2 ALA 52 75.928 -1.311 -9.708 393 HB3 ALA 52 HB3 ALA 52 75.949 -0.049 -8.475 394 H LEU 53 H LEU 53 74.391 -0.513 -6.438 395 HA LEU 53 HA LEU 53 74.914 -3.160 -5.705 396 HB2 LEU 53 HB2 LEU 53 73.784 -0.926 -4.071 397 HB3 LEU 53 HB3 LEU 53 74.228 -2.481 -3.411 398 HG LEU 53 HG LEU 53 76.020 -0.372 -4.568 399 HD11 LEU 53 HD11 LEU 53 75.351 -0.119 -2.283 400 HD12 LEU 53 HD12 LEU 53 77.066 -0.523 -2.392 401 HD13 LEU 53 HD13 LEU 53 75.894 -1.756 -1.910 402 HD21 LEU 53 HD21 LEU 53 77.890 -1.927 -4.185 403 HD22 LEU 53 HD22 LEU 53 76.810 -2.463 -5.465 404 HD23 LEU 53 HD23 LEU 53 76.730 -3.225 -3.870 405 H ILE 54 H ILE 54 71.845 -1.418 -5.659 406 HA ILE 54 HA ILE 54 70.523 -3.681 -4.523 407 HB ILE 54 HB ILE 54 69.300 -1.235 -5.835 408 HG12 ILE 54 HG12 ILE 54 69.443 -2.126 -2.952 409 HG13 ILE 54 HG13 ILE 54 70.500 -0.919 -3.643 410 HG21 ILE 54 HG21 ILE 54 67.142 -1.974 -4.924 411 HG22 ILE 54 HG22 ILE 54 67.884 -3.475 -4.370 412 HG23 ILE 54 HG23 ILE 54 67.764 -3.138 -6.098 413 HD11 ILE 54 HD11 ILE 54 68.498 0.452 -4.126 414 HD12 ILE 54 HD12 ILE 54 68.795 0.143 -2.415 415 HD13 ILE 54 HD13 ILE 54 67.543 -0.764 -3.266 416 H TYR 55 H TYR 55 70.853 -2.426 -7.756 417 HA TYR 55 HA TYR 55 69.242 -4.254 -9.069 418 HB2 TYR 55 HB2 TYR 55 71.432 -2.444 -9.803 419 HB3 TYR 55 HB3 TYR 55 71.090 -3.707 -10.954 420 HD1 TYR 55 HD1 TYR 55 68.820 -3.722 -12.081 421 HD2 TYR 55 HD2 TYR 55 69.963 -0.591 -9.447 422 HE1 TYR 55 HE1 TYR 55 66.986 -2.320 -12.949 423 HE2 TYR 55 HE2 TYR 55 68.150 0.809 -10.303 424 HH TYR 55 HH TYR 55 66.806 1.025 -12.240 425 H GLU 56 H GLU 56 72.741 -4.408 -8.341 426 HA GLU 56 HA GLU 56 72.934 -6.966 -9.518 427 HB2 GLU 56 HB2 GLU 56 75.230 -7.101 -8.598 428 HB3 GLU 56 HB3 GLU 56 74.925 -5.620 -9.485 429 HG2 GLU 56 HG2 GLU 56 74.826 -4.352 -7.551 430 HG3 GLU 56 HG3 GLU 56 74.848 -5.741 -6.489 431 H ALA 57 H ALA 57 72.364 -5.871 -6.253 432 HA ALA 57 HA ALA 57 72.718 -8.276 -4.907 433 HB1 ALA 57 HB1 ALA 57 70.615 -6.180 -4.356 434 HB2 ALA 57 HB2 ALA 57 72.279 -6.137 -3.778 435 HB3 ALA 57 HB3 ALA 57 71.186 -7.405 -3.221 436 H ALA 58 H ALA 58 69.881 -7.021 -6.579 437 HA ALA 58 HA ALA 58 68.119 -9.108 -6.000 438 HB1 ALA 58 HB1 ALA 58 66.829 -8.340 -7.930 439 HB2 ALA 58 HB2 ALA 58 68.217 -7.397 -8.484 440 HB3 ALA 58 HB3 ALA 58 67.411 -6.975 -6.974 441 H ALA 59 H ALA 59 70.328 -8.717 -8.730 442 HA ALA 59 HA ALA 59 69.599 -11.146 -10.021 443 HB1 ALA 59 HB1 ALA 59 72.140 -9.542 -10.317 444 HB2 ALA 59 HB2 ALA 59 70.649 -9.279 -11.222 445 HB3 ALA 59 HB3 ALA 59 71.557 -10.777 -11.436 446 H ARG 60 H ARG 60 72.241 -10.272 -7.856 447 HA ARG 60 HA ARG 60 73.500 -12.805 -7.883 448 HB2 ARG 60 HB2 ARG 60 73.688 -10.531 -5.891 449 HB3 ARG 60 HB3 ARG 60 74.698 -11.974 -5.846 450 HG2 ARG 60 HG2 ARG 60 75.763 -11.422 -7.880 451 HG3 ARG 60 HG3 ARG 60 74.575 -10.171 -8.247 452 HD2 ARG 60 HD2 ARG 60 76.699 -9.202 -7.499 453 HD3 ARG 60 HD3 ARG 60 75.392 -8.825 -6.383 454 HE ARG 60 HE ARG 60 76.696 -11.142 -5.509 455 HH11 ARG 60 HH11 ARG 60 77.416 -7.613 -5.802 456 HH12 ARG 60 HH12 ARG 60 78.450 -7.643 -4.467 457 HH21 ARG 60 HH21 ARG 60 78.142 -11.087 -3.736 458 HH22 ARG 60 HH22 ARG 60 78.922 -9.645 -3.277 459 H ALA 61 H ALA 61 70.902 -11.461 -5.949 460 HA ALA 61 HA ALA 61 70.894 -13.626 -4.086 461 HB1 ALA 61 HB1 ALA 61 70.088 -11.418 -3.485 462 HB2 ALA 61 HB2 ALA 61 68.838 -12.639 -3.233 463 HB3 ALA 61 HB3 ALA 61 68.764 -11.563 -4.640 464 H ALA 62 H ALA 62 69.306 -12.919 -7.120 465 HA ALA 62 HA ALA 62 67.259 -14.815 -7.078 466 HB1 ALA 62 HB1 ALA 62 67.343 -14.724 -9.543 467 HB2 ALA 62 HB2 ALA 62 68.903 -13.902 -9.449 468 HB3 ALA 62 HB3 ALA 62 67.455 -13.112 -8.833 469 H ALA 63 H ALA 63 70.598 -15.114 -8.088 470 HA ALA 63 HA ALA 63 70.392 -17.984 -7.582 471 HB1 ALA 63 HB1 ALA 63 70.639 -17.673 -10.003 472 HB2 ALA 63 HB2 ALA 63 72.110 -18.361 -9.299 473 HB3 ALA 63 HB3 ALA 63 72.058 -16.653 -9.728 474 H ASN 64 H ASN 64 71.063 -17.618 -5.519 475 HA ASN 64 HA ASN 64 73.448 -16.053 -5.113 476 HB2 ASN 64 HB2 ASN 64 73.004 -16.284 -2.686 477 HB3 ASN 64 HB3 ASN 64 71.774 -15.482 -3.651 478 HD21 ASN 64 HD21 ASN 64 69.727 -16.449 -3.834 479 HD22 ASN 64 HD22 ASN 64 69.261 -17.790 -2.862 480 HA PRO 65 HA PRO 65 75.718 -19.620 -4.966 481 HB2 PRO 65 HB2 PRO 65 78.224 -18.527 -4.888 482 HB3 PRO 65 HB3 PRO 65 77.232 -18.591 -6.348 483 HG2 PRO 65 HG2 PRO 65 77.699 -16.304 -4.481 484 HG3 PRO 65 HG3 PRO 65 77.491 -16.294 -6.237 485 HD2 PRO 65 HD2 PRO 65 75.523 -15.670 -4.386 486 HD3 PRO 65 HD3 PRO 65 75.239 -16.142 -6.077 487 H GLY 66 H GLY 66 75.693 -17.204 -2.543 488 HA2 GLY 66 HA2 GLY 66 75.562 -18.026 -0.239 489 HA3 GLY 66 HA3 GLY 66 76.947 -19.041 -0.616 490 H GLY 67 H GLY 67 76.029 -16.240 0.862 491 HA2 GLY 67 HA2 GLY 67 78.210 -15.428 1.981 492 HA3 GLY 67 HA3 GLY 67 78.557 -14.893 0.340 493 H ASP 68 H ASP 68 78.461 -12.740 0.587 494 HA ASP 68 HA ASP 68 75.884 -11.621 1.438 495 HB2 ASP 68 HB2 ASP 68 78.600 -10.328 1.839 496 HB3 ASP 68 HB3 ASP 68 77.050 -9.636 2.278 497 H GLY 69 H GLY 69 75.209 -9.863 0.255 498 HA2 GLY 69 HA2 GLY 69 75.976 -8.089 -1.359 499 HA3 GLY 69 HA3 GLY 69 76.704 -9.437 -2.250 500 H GLY 70 H GLY 70 74.876 -11.327 -2.126 501 HA2 GLY 70 HA2 GLY 70 72.809 -10.227 -3.805 502 HA3 GLY 70 HA3 GLY 70 73.115 -11.935 -3.486 503 H GLY 71 H GLY 71 72.078 -8.984 -1.888 504 HA2 GLY 71 HA2 GLY 71 69.648 -9.669 -1.085 505 HA3 GLY 71 HA3 GLY 71 70.643 -10.448 0.128 506 HA PRO 72 HA PRO 72 69.615 -5.869 0.801 507 HB2 PRO 72 HB2 PRO 72 68.138 -6.296 3.089 508 HB3 PRO 72 HB3 PRO 72 67.494 -6.090 1.454 509 HG2 PRO 72 HG2 PRO 72 67.937 -8.611 3.006 510 HG3 PRO 72 HG3 PRO 72 66.650 -8.212 1.857 511 HD2 PRO 72 HD2 PRO 72 68.703 -9.793 1.216 512 HD3 PRO 72 HD3 PRO 72 67.878 -8.749 0.052 513 H GLU 73 H GLU 73 70.172 -8.333 3.296 514 HA GLU 73 HA GLU 73 71.532 -6.434 4.964 515 HB2 GLU 73 HB2 GLU 73 71.110 -9.401 5.302 516 HB3 GLU 73 HB3 GLU 73 71.827 -8.339 6.514 517 HG2 GLU 73 HG2 GLU 73 69.748 -7.002 6.502 518 HG3 GLU 73 HG3 GLU 73 69.050 -8.158 5.390 519 H GLY 74 H GLY 74 72.589 -7.935 2.294 520 HA2 GLY 74 HA2 GLY 74 75.212 -7.751 3.474 521 HA3 GLY 74 HA3 GLY 74 74.971 -8.748 1.988 522 H ILE 75 H ILE 75 73.369 -6.473 0.832 523 HA ILE 75 HA ILE 75 75.470 -4.826 -0.101 524 HB ILE 75 HB ILE 75 73.547 -3.182 -0.669 525 HG12 ILE 75 HG12 ILE 75 71.943 -5.692 -0.263 526 HG13 ILE 75 HG13 ILE 75 71.959 -4.346 0.867 527 HG21 ILE 75 HG21 ILE 75 74.759 -4.367 -2.281 528 HG22 ILE 75 HG22 ILE 75 73.035 -4.407 -2.681 529 HG23 ILE 75 HG23 ILE 75 73.825 -5.847 -1.997 530 HD11 ILE 75 HD11 ILE 75 71.038 -4.228 -1.997 531 HD12 ILE 75 HD12 ILE 75 71.078 -2.917 -0.780 532 HD13 ILE 75 HD13 ILE 75 70.034 -4.307 -0.525 533 H VAL 76 H VAL 76 73.320 -4.546 2.689 534 HA VAL 76 HA VAL 76 73.845 -1.934 3.230 535 HB VAL 76 HB VAL 76 73.320 -2.532 5.436 536 HG11 VAL 76 HG11 VAL 76 71.617 -2.031 3.720 537 HG12 VAL 76 HG12 VAL 76 70.998 -2.912 5.104 538 HG13 VAL 76 HG13 VAL 76 71.322 -3.764 3.584 539 HG21 VAL 76 HG21 VAL 76 73.104 -5.324 4.512 540 HG22 VAL 76 HG22 VAL 76 72.420 -4.731 6.039 541 HG23 VAL 76 HG23 VAL 76 74.158 -4.664 5.761 542 H LYS 77 H LYS 77 75.549 -4.821 3.927 543 HA LYS 77 HA LYS 77 77.519 -3.722 5.603 544 HB2 LYS 77 HB2 LYS 77 77.197 -6.136 5.477 545 HB3 LYS 77 HB3 LYS 77 77.652 -6.134 3.783 546 HG2 LYS 77 HG2 LYS 77 79.929 -5.496 4.380 547 HG3 LYS 77 HG3 LYS 77 79.472 -5.446 6.085 548 HD2 LYS 77 HD2 LYS 77 78.950 -7.814 6.042 549 HD3 LYS 77 HD3 LYS 77 79.304 -7.884 4.318 550 HE2 LYS 77 HE2 LYS 77 81.297 -7.123 6.447 551 HE3 LYS 77 HE3 LYS 77 81.141 -8.737 5.762 552 HZ1 LYS 77 HZ1 LYS 77 81.931 -6.265 4.257 553 HZ2 LYS 77 HZ2 LYS 77 81.697 -7.783 3.572 554 HZ3 LYS 77 HZ3 LYS 77 82.911 -7.558 4.686 555 H GLU 78 H GLU 78 77.238 -4.103 2.109 556 HA GLU 78 HA GLU 78 79.827 -3.176 1.446 557 HB2 GLU 78 HB2 GLU 78 78.158 -4.424 -0.075 558 HB3 GLU 78 HB3 GLU 78 77.394 -2.889 -0.422 559 HG2 GLU 78 HG2 GLU 78 78.931 -3.345 -2.135 560 HG3 GLU 78 HG3 GLU 78 79.613 -2.045 -1.153 561 H ILE 79 H ILE 79 76.746 -1.613 1.926 562 HA ILE 79 HA ILE 79 77.506 0.947 1.200 563 HB ILE 79 HB ILE 79 75.343 0.006 3.079 564 HG12 ILE 79 HG12 ILE 79 75.061 -0.552 0.713 565 HG13 ILE 79 HG13 ILE 79 73.820 0.567 1.263 566 HG21 ILE 79 HG21 ILE 79 75.940 2.238 3.800 567 HG22 ILE 79 HG22 ILE 79 74.368 2.260 3.001 568 HG23 ILE 79 HG23 ILE 79 75.800 2.836 2.147 569 HD11 ILE 79 HD11 ILE 79 76.235 1.227 -0.420 570 HD12 ILE 79 HD12 ILE 79 75.098 2.413 0.216 571 HD13 ILE 79 HD13 ILE 79 74.548 1.196 -0.934 572 H LYS 80 H LYS 80 77.493 -0.696 4.375 573 HA LYS 80 HA LYS 80 78.211 1.629 5.819 574 HB2 LYS 80 HB2 LYS 80 78.413 0.263 7.810 575 HB3 LYS 80 HB3 LYS 80 77.064 -0.336 6.860 576 HG2 LYS 80 HG2 LYS 80 78.411 -2.160 6.048 577 HG3 LYS 80 HG3 LYS 80 79.782 -1.566 6.959 578 HD2 LYS 80 HD2 LYS 80 78.706 -3.392 8.181 579 HD3 LYS 80 HD3 LYS 80 78.576 -1.881 9.072 580 HE2 LYS 80 HE2 LYS 80 76.252 -1.634 8.317 581 HE3 LYS 80 HE3 LYS 80 76.385 -3.126 7.386 582 HZ1 LYS 80 HZ1 LYS 80 75.302 -3.549 9.559 583 HZ2 LYS 80 HZ2 LYS 80 76.621 -2.887 10.339 584 HZ3 LYS 80 HZ3 LYS 80 76.806 -4.304 9.478 585 H GLU 81 H GLU 81 80.163 -0.967 4.457 586 HA GLU 81 HA GLU 81 82.511 -0.101 5.744 587 HB2 GLU 81 HB2 GLU 81 82.211 -1.832 3.285 588 HB3 GLU 81 HB3 GLU 81 83.714 -1.600 4.165 589 HG2 GLU 81 HG2 GLU 81 82.658 -2.561 6.179 590 HG3 GLU 81 HG3 GLU 81 81.192 -2.838 5.248 591 H TRP 82 H TRP 82 81.038 0.713 2.700 592 HA TRP 82 HA TRP 82 83.194 2.163 1.528 593 HB2 TRP 82 HB2 TRP 82 81.021 1.413 0.397 594 HB3 TRP 82 HB3 TRP 82 80.294 2.744 1.321 595 HD1 TRP 82 HD1 TRP 82 82.852 2.230 -1.521 596 HE1 TRP 82 HE1 TRP 82 82.870 4.371 -2.959 597 HE3 TRP 82 HE3 TRP 82 79.749 5.153 1.304 598 HZ2 TRP 82 HZ2 TRP 82 81.731 6.897 -2.923 599 HZ3 TRP 82 HZ3 TRP 82 79.271 7.436 0.535 600 HH2 TRP 82 HH2 TRP 82 80.241 8.302 -1.520 601 H ARG 83 H ARG 83 80.391 3.008 3.417 602 HA ARG 83 HA ARG 83 80.584 5.800 3.419 603 HB2 ARG 83 HB2 ARG 83 78.708 4.091 4.273 604 HB3 ARG 83 HB3 ARG 83 79.711 4.284 5.726 605 HG2 ARG 83 HG2 ARG 83 77.977 5.759 6.042 606 HG3 ARG 83 HG3 ARG 83 79.464 6.601 5.597 607 HD2 ARG 83 HD2 ARG 83 78.667 7.105 3.424 608 HD3 ARG 83 HD3 ARG 83 77.252 6.058 3.626 609 HE ARG 83 HE ARG 83 77.050 7.734 5.699 610 HH11 ARG 83 HH11 ARG 83 77.140 8.379 2.188 611 HH12 ARG 83 HH12 ARG 83 76.440 9.916 2.381 612 HH21 ARG 83 HH21 ARG 83 76.093 9.776 5.861 613 HH22 ARG 83 HH22 ARG 83 75.827 10.726 4.478 614 H ALA 84 H ALA 84 81.669 3.322 5.706 615 HA ALA 84 HA ALA 84 82.757 5.090 7.591 616 HB1 ALA 84 HB1 ALA 84 83.683 3.124 8.635 617 HB2 ALA 84 HB2 ALA 84 83.379 2.172 7.180 618 HB3 ALA 84 HB3 ALA 84 82.028 2.803 8.117 619 H ALA 85 H ALA 85 84.204 3.251 4.918 620 HA ALA 85 HA ALA 85 86.886 3.925 5.449 621 HB1 ALA 85 HB1 ALA 85 85.558 3.215 2.840 622 HB2 ALA 85 HB2 ALA 85 86.289 2.083 3.979 623 HB3 ALA 85 HB3 ALA 85 87.295 3.251 3.117 624 H ASN 86 H ASN 86 84.378 5.465 3.555 625 HA ASN 86 HA ASN 86 85.972 7.517 2.388 626 HB2 ASN 86 HB2 ASN 86 83.602 6.813 1.713 627 HB3 ASN 86 HB3 ASN 86 83.042 7.728 3.103 628 HD21 ASN 86 HD21 ASN 86 83.976 7.858 -0.121 629 HD22 ASN 86 HD22 ASN 86 83.951 9.567 -0.342 630 H GLY 87 H GLY 87 84.172 7.166 5.364 631 HA2 GLY 87 HA2 GLY 87 84.824 8.272 7.382 632 HA3 GLY 87 HA3 GLY 87 85.402 9.620 6.408 633 H LYS 88 H LYS 88 82.239 8.021 5.824 634 HA LYS 88 HA LYS 88 80.989 10.531 6.415 635 HB2 LYS 88 HB2 LYS 88 80.546 8.188 4.626 636 HB3 LYS 88 HB3 LYS 88 79.264 9.312 4.981 637 HG2 LYS 88 HG2 LYS 88 80.548 11.107 3.889 638 HG3 LYS 88 HG3 LYS 88 81.909 10.004 3.680 639 HD2 LYS 88 HD2 LYS 88 80.583 8.580 2.228 640 HD3 LYS 88 HD3 LYS 88 79.170 9.595 2.465 641 HE2 LYS 88 HE2 LYS 88 81.744 10.573 1.264 642 HE3 LYS 88 HE3 LYS 88 80.442 9.924 0.285 643 HZ1 LYS 88 HZ1 LYS 88 80.377 12.377 2.000 644 HZ2 LYS 88 HZ2 LYS 88 79.018 11.747 1.234 645 HZ3 LYS 88 HZ3 LYS 88 80.312 12.299 0.323 646 HA PRO 89 HA PRO 89 79.002 8.265 9.797 647 HB2 PRO 89 HB2 PRO 89 76.537 9.783 9.178 648 HB3 PRO 89 HB3 PRO 89 77.480 9.761 10.672 649 HG2 PRO 89 HG2 PRO 89 77.492 11.898 9.054 650 HG3 PRO 89 HG3 PRO 89 78.947 11.388 9.923 651 HD2 PRO 89 HD2 PRO 89 78.210 10.972 7.053 652 HD3 PRO 89 HD3 PRO 89 79.777 11.405 7.771 653 H GLY 90 H GLY 90 78.034 6.319 9.810 654 HA2 GLY 90 HA2 GLY 90 76.653 5.515 7.362 655 HA3 GLY 90 HA3 GLY 90 77.373 4.432 8.552 656 H PHE 91 H PHE 91 75.850 3.272 9.455 657 HA PHE 91 HA PHE 91 73.145 4.314 9.545 658 HB2 PHE 91 HB2 PHE 91 74.163 1.606 10.403 659 HB3 PHE 91 HB3 PHE 91 72.490 2.071 10.127 660 HD1 PHE 91 HD1 PHE 91 72.400 3.345 7.621 661 HD2 PHE 91 HD2 PHE 91 74.882 0.118 8.840 662 HE1 PHE 91 HE1 PHE 91 72.609 2.620 5.293 663 HE2 PHE 91 HE2 PHE 91 75.090 -0.607 6.506 664 HZ PHE 91 HZ PHE 91 73.955 0.642 4.736 665 H LYS 92 H LYS 92 71.933 4.328 11.469 666 HA LYS 92 HA LYS 92 73.542 4.815 13.790 667 HB2 LYS 92 HB2 LYS 92 71.918 6.258 14.339 668 HB3 LYS 92 HB3 LYS 92 71.387 5.978 12.739 669 HG2 LYS 92 HG2 LYS 92 69.741 4.491 13.322 670 HG3 LYS 92 HG3 LYS 92 70.381 4.287 14.964 671 HD2 LYS 92 HD2 LYS 92 69.918 6.680 15.378 672 HD3 LYS 92 HD3 LYS 92 69.208 6.799 13.769 673 HE2 LYS 92 HE2 LYS 92 67.593 5.113 14.381 674 HE3 LYS 92 HE3 LYS 92 68.324 5.041 15.989 675 HZ1 LYS 92 HZ1 LYS 92 66.363 6.456 16.021 676 HZ2 LYS 92 HZ2 LYS 92 67.008 7.475 14.824 677 HZ3 LYS 92 HZ3 LYS 92 67.743 7.351 16.332 678 H GLN 93 H GLN 93 72.798 3.937 15.799 679 HA GLN 93 HA GLN 93 72.531 1.086 15.583 680 HB2 GLN 93 HB2 GLN 93 72.955 3.115 17.597 681 HB3 GLN 93 HB3 GLN 93 72.642 1.469 18.160 682 HG2 GLN 93 HG2 GLN 93 75.006 1.734 18.222 683 HG3 GLN 93 HG3 GLN 93 74.693 0.860 16.725 684 HE21 GLN 93 HE21 GLN 93 75.502 3.940 18.099 685 HE22 GLN 93 HE22 GLN 93 76.155 4.647 16.675 686 H GLY 94 H GLY 94 70.799 0.009 16.218 687 HA2 GLY 94 HA2 GLY 94 68.418 1.536 16.824 688 HA3 GLY 94 HA3 GLY 94 68.455 -0.176 16.375 Start of MODEL 12 1 H GLU 2 H GLU 2 60.681 1.956 7.591 2 HA GLU 2 HA GLU 2 59.331 3.933 7.708 3 HB2 GLU 2 HB2 GLU 2 61.344 4.862 9.765 4 HB3 GLU 2 HB3 GLU 2 59.904 5.695 9.215 5 HG2 GLU 2 HG2 GLU 2 58.506 4.069 10.356 6 HG3 GLU 2 HG3 GLU 2 59.942 3.181 10.863 7 H LEU 3 H LEU 3 60.036 5.703 6.463 8 HA LEU 3 HA LEU 3 62.684 5.307 5.319 9 HB2 LEU 3 HB2 LEU 3 60.438 7.146 4.491 10 HB3 LEU 3 HB3 LEU 3 61.925 6.888 3.613 11 HG LEU 3 HG LEU 3 59.745 4.894 4.071 12 HD11 LEU 3 HD11 LEU 3 59.193 6.569 2.385 13 HD12 LEU 3 HD12 LEU 3 59.552 5.045 1.564 14 HD13 LEU 3 HD13 LEU 3 60.744 6.334 1.597 15 HD21 LEU 3 HD21 LEU 3 61.887 3.800 4.125 16 HD22 LEU 3 HD22 LEU 3 62.364 4.595 2.626 17 HD23 LEU 3 HD23 LEU 3 61.049 3.408 2.620 18 H LYS 4 H LYS 4 64.274 6.649 5.818 19 HA LYS 4 HA LYS 4 63.666 8.867 7.607 20 HB2 LYS 4 HB2 LYS 4 66.370 7.789 6.887 21 HB3 LYS 4 HB3 LYS 4 65.942 8.792 8.277 22 HG2 LYS 4 HG2 LYS 4 65.521 5.901 7.707 23 HG3 LYS 4 HG3 LYS 4 66.409 6.600 9.033 24 HD2 LYS 4 HD2 LYS 4 64.046 7.544 9.629 25 HD3 LYS 4 HD3 LYS 4 63.535 6.213 8.603 26 HE2 LYS 4 HE2 LYS 4 65.153 4.733 9.854 27 HE3 LYS 4 HE3 LYS 4 65.292 6.025 11.007 28 HZ1 LYS 4 HZ1 LYS 4 62.786 5.809 11.341 29 HZ2 LYS 4 HZ2 LYS 4 63.817 4.630 11.910 30 HZ3 LYS 4 HZ3 LYS 4 62.961 4.300 10.520 31 H ASN 5 H ASN 5 65.460 10.660 7.304 32 HA ASN 5 HA ASN 5 65.462 11.318 4.473 33 HB2 ASN 5 HB2 ASN 5 65.600 13.116 6.885 34 HB3 ASN 5 HB3 ASN 5 65.936 13.694 5.258 35 HD21 ASN 5 HD21 ASN 5 63.906 11.983 4.013 36 HD22 ASN 5 HD22 ASN 5 62.380 12.629 4.414 37 H SER 6 H SER 6 67.523 10.276 6.902 38 HA SER 6 HA SER 6 69.743 10.698 5.102 39 HB2 SER 6 HB2 SER 6 71.206 11.348 6.996 40 HB3 SER 6 HB3 SER 6 69.966 12.552 6.640 41 HG SER 6 HG SER 6 70.363 11.926 8.910 42 H ILE 7 H ILE 7 71.571 9.267 5.638 43 HA ILE 7 HA ILE 7 70.665 6.611 6.090 44 HB ILE 7 HB ILE 7 72.547 7.265 4.563 45 HG12 ILE 7 HG12 ILE 7 73.233 5.117 6.638 46 HG13 ILE 7 HG13 ILE 7 72.330 4.929 5.149 47 HG21 ILE 7 HG21 ILE 7 73.671 8.894 5.946 48 HG22 ILE 7 HG22 ILE 7 74.794 7.621 5.473 49 HG23 ILE 7 HG23 ILE 7 74.119 7.639 7.101 50 HD11 ILE 7 HD11 ILE 7 74.303 5.387 3.855 51 HD12 ILE 7 HD12 ILE 7 74.608 4.094 5.011 52 HD13 ILE 7 HD13 ILE 7 75.213 5.722 5.324 53 H SER 8 H SER 8 71.845 9.055 8.177 54 HA SER 8 HA SER 8 72.905 7.223 10.129 55 HB2 SER 8 HB2 SER 8 74.032 9.383 9.699 56 HB3 SER 8 HB3 SER 8 72.604 10.231 10.287 57 HG SER 8 HG SER 8 72.959 8.861 12.236 58 H ASP 9 H ASP 9 69.846 8.190 9.350 59 HA ASP 9 HA ASP 9 68.873 8.130 12.137 60 HB2 ASP 9 HB2 ASP 9 67.925 9.687 10.075 61 HB3 ASP 9 HB3 ASP 9 67.084 8.224 9.779 62 H TYR 10 H TYR 10 69.851 6.105 9.877 63 HA TYR 10 HA TYR 10 67.585 4.244 9.896 64 HB2 TYR 10 HB2 TYR 10 69.799 4.750 7.967 65 HB3 TYR 10 HB3 TYR 10 69.316 3.082 8.188 66 HD1 TYR 10 HD1 TYR 10 66.866 2.533 7.824 67 HD2 TYR 10 HD2 TYR 10 68.621 6.147 6.464 68 HE1 TYR 10 HE1 TYR 10 65.004 2.823 6.218 69 HE2 TYR 10 HE2 TYR 10 66.761 6.433 4.849 70 HH TYR 10 HH TYR 10 65.002 5.177 3.767 71 H THR 11 H THR 11 67.751 2.661 11.389 72 HA THR 11 HA THR 11 70.323 1.803 12.289 73 HB THR 11 HB THR 11 69.050 -0.138 13.253 74 HG1 THR 11 HG1 THR 11 66.703 -0.018 12.999 75 HG21 THR 11 HG21 THR 11 67.714 2.523 13.761 76 HG22 THR 11 HG22 THR 11 69.122 1.879 14.614 77 HG23 THR 11 HG23 THR 11 67.554 1.097 14.782 78 H GLU 12 H GLU 12 71.103 -0.414 11.611 79 HA GLU 12 HA GLU 12 70.968 -0.467 8.819 80 HB2 GLU 12 HB2 GLU 12 72.280 -2.574 8.961 81 HB3 GLU 12 HB3 GLU 12 72.978 -1.187 9.775 82 HG2 GLU 12 HG2 GLU 12 72.121 -2.052 11.907 83 HG3 GLU 12 HG3 GLU 12 71.536 -3.489 11.067 84 H ALA 13 H ALA 13 69.207 -2.277 11.203 85 HA ALA 13 HA ALA 13 67.933 -4.035 9.322 86 HB1 ALA 13 HB1 ALA 13 68.034 -4.541 11.738 87 HB2 ALA 13 HB2 ALA 13 66.376 -4.541 11.139 88 HB3 ALA 13 HB3 ALA 13 66.981 -3.164 12.059 89 H GLU 14 H GLU 14 67.022 -0.820 10.623 90 HA GLU 14 HA GLU 14 64.549 -0.569 9.311 91 HB2 GLU 14 HB2 GLU 14 66.559 1.259 10.435 92 HB3 GLU 14 HB3 GLU 14 65.605 1.985 9.158 93 HG2 GLU 14 HG2 GLU 14 64.436 0.606 11.555 94 HG3 GLU 14 HG3 GLU 14 64.748 2.340 11.459 95 H PHE 15 H PHE 15 67.804 -0.144 8.264 96 HA PHE 15 HA PHE 15 67.122 0.900 5.724 97 HB2 PHE 15 HB2 PHE 15 69.330 1.206 7.010 98 HB3 PHE 15 HB3 PHE 15 69.712 -0.408 6.470 99 HD1 PHE 15 HD1 PHE 15 68.767 2.935 5.184 100 HD2 PHE 15 HD2 PHE 15 70.698 -0.755 4.452 101 HE1 PHE 15 HE1 PHE 15 69.699 3.837 3.093 102 HE2 PHE 15 HE2 PHE 15 71.628 0.136 2.360 103 HZ PHE 15 HZ PHE 15 71.121 2.437 1.689 104 H VAL 16 H VAL 16 68.000 -2.346 6.935 105 HA VAL 16 HA VAL 16 68.019 -3.500 4.381 106 HB VAL 16 HB VAL 16 67.985 -5.666 5.288 107 HG11 VAL 16 HG11 VAL 16 69.956 -4.601 5.685 108 HG12 VAL 16 HG12 VAL 16 69.618 -5.735 7.001 109 HG13 VAL 16 HG13 VAL 16 69.416 -3.992 7.247 110 HG21 VAL 16 HG21 VAL 16 66.062 -5.603 6.564 111 HG22 VAL 16 HG22 VAL 16 66.806 -4.549 7.770 112 HG23 VAL 16 HG23 VAL 16 67.382 -6.238 7.559 113 H GLN 17 H GLN 17 65.332 -2.807 6.525 114 HA GLN 17 HA GLN 17 63.380 -4.268 5.150 115 HB2 GLN 17 HB2 GLN 17 63.062 -3.226 7.359 116 HB3 GLN 17 HB3 GLN 17 63.184 -1.637 6.602 117 HG2 GLN 17 HG2 GLN 17 61.361 -2.290 5.143 118 HG3 GLN 17 HG3 GLN 17 61.140 -3.734 6.152 119 HE21 GLN 17 HE21 GLN 17 62.011 -0.545 7.333 120 HE22 GLN 17 HE22 GLN 17 60.540 -0.265 8.161 121 H LEU 18 H LEU 18 64.594 -0.983 4.897 122 HA LEU 18 HA LEU 18 62.977 -0.102 2.884 123 HB2 LEU 18 HB2 LEU 18 64.313 1.355 4.225 124 HB3 LEU 18 HB3 LEU 18 65.775 0.692 3.727 125 HG LEU 18 HG LEU 18 65.206 3.021 2.831 126 HD11 LEU 18 HD11 LEU 18 66.151 0.884 0.955 127 HD12 LEU 18 HD12 LEU 18 67.132 1.806 2.099 128 HD13 LEU 18 HD13 LEU 18 66.372 2.622 0.733 129 HD21 LEU 18 HD21 LEU 18 62.956 2.531 2.013 130 HD22 LEU 18 HD22 LEU 18 63.625 1.367 0.869 131 HD23 LEU 18 HD23 LEU 18 64.008 3.083 0.710 132 H LEU 19 H LEU 19 66.072 -1.579 2.870 133 HA LEU 19 HA LEU 19 66.720 -1.827 0.171 134 HB2 LEU 19 HB2 LEU 19 67.185 -3.427 2.537 135 HB3 LEU 19 HB3 LEU 19 67.985 -3.875 1.003 136 HG LEU 19 HG LEU 19 68.302 -1.459 2.768 137 HD11 LEU 19 HD11 LEU 19 70.178 -3.499 1.710 138 HD12 LEU 19 HD12 LEU 19 69.688 -3.236 3.390 139 HD13 LEU 19 HD13 LEU 19 70.657 -2.030 2.534 140 HD21 LEU 19 HD21 LEU 19 68.127 -0.561 0.602 141 HD22 LEU 19 HD22 LEU 19 69.249 -1.776 -0.043 142 HD23 LEU 19 HD23 LEU 19 69.818 -0.553 1.112 143 H LYS 20 H LYS 20 64.776 -3.987 2.213 144 HA LYS 20 HA LYS 20 64.305 -5.868 0.175 145 HB2 LYS 20 HB2 LYS 20 62.608 -5.362 2.618 146 HB3 LYS 20 HB3 LYS 20 62.577 -6.750 1.487 147 HG2 LYS 20 HG2 LYS 20 64.763 -7.430 2.158 148 HG3 LYS 20 HG3 LYS 20 64.956 -6.002 3.167 149 HD2 LYS 20 HD2 LYS 20 63.143 -6.802 4.607 150 HD3 LYS 20 HD3 LYS 20 62.988 -8.246 3.602 151 HE2 LYS 20 HE2 LYS 20 65.310 -8.848 4.123 152 HE3 LYS 20 HE3 LYS 20 65.455 -7.408 5.125 153 HZ1 LYS 20 HZ1 LYS 20 65.022 -9.318 6.493 154 HZ2 LYS 20 HZ2 LYS 20 63.660 -9.710 5.581 155 HZ3 LYS 20 HZ3 LYS 20 63.652 -8.313 6.518 156 H GLU 21 H GLU 21 62.636 -3.015 1.278 157 HA GLU 21 HA GLU 21 60.366 -3.208 -0.324 158 HB2 GLU 21 HB2 GLU 21 61.870 -0.797 0.687 159 HB3 GLU 21 HB3 GLU 21 60.344 -0.702 -0.182 160 HG2 GLU 21 HG2 GLU 21 60.665 -2.300 2.328 161 HG3 GLU 21 HG3 GLU 21 60.215 -0.594 2.329 162 H ILE 22 H ILE 22 63.549 -1.870 -0.950 163 HA ILE 22 HA ILE 22 63.059 -1.013 -3.597 164 HB ILE 22 HB ILE 22 65.740 -2.018 -2.596 165 HG12 ILE 22 HG12 ILE 22 64.447 0.702 -2.187 166 HG13 ILE 22 HG13 ILE 22 64.932 -0.446 -0.975 167 HG21 ILE 22 HG21 ILE 22 66.607 -0.390 -4.225 168 HG22 ILE 22 HG22 ILE 22 64.953 0.024 -4.674 169 HG23 ILE 22 HG23 ILE 22 65.573 -1.594 -4.993 170 HD11 ILE 22 HD11 ILE 22 66.501 1.387 -1.122 171 HD12 ILE 22 HD12 ILE 22 66.836 0.971 -2.804 172 HD13 ILE 22 HD13 ILE 22 67.259 -0.156 -1.514 173 H GLU 23 H GLU 23 64.165 -4.069 -2.190 174 HA GLU 23 HA GLU 23 64.784 -5.568 -4.367 175 HB2 GLU 23 HB2 GLU 23 65.178 -6.246 -2.091 176 HB3 GLU 23 HB3 GLU 23 63.467 -6.124 -1.718 177 HG2 GLU 23 HG2 GLU 23 63.190 -7.837 -3.498 178 HG3 GLU 23 HG3 GLU 23 64.929 -8.152 -3.253 179 H LYS 24 H LYS 24 61.728 -5.027 -2.662 180 HA LYS 24 HA LYS 24 60.089 -6.706 -4.183 181 HB2 LYS 24 HB2 LYS 24 59.797 -5.113 -1.921 182 HB3 LYS 24 HB3 LYS 24 58.710 -4.393 -3.089 183 HG2 LYS 24 HG2 LYS 24 57.503 -6.008 -1.789 184 HG3 LYS 24 HG3 LYS 24 57.654 -6.596 -3.445 185 HD2 LYS 24 HD2 LYS 24 58.084 -8.426 -1.934 186 HD3 LYS 24 HD3 LYS 24 59.598 -7.994 -2.713 187 HE2 LYS 24 HE2 LYS 24 60.223 -6.676 -0.703 188 HE3 LYS 24 HE3 LYS 24 58.724 -7.189 0.069 189 HZ1 LYS 24 HZ1 LYS 24 61.044 -8.873 -0.713 190 HZ2 LYS 24 HZ2 LYS 24 59.562 -9.522 -0.256 191 HZ3 LYS 24 HZ3 LYS 24 60.435 -8.626 0.837 192 H GLU 25 H GLU 25 60.620 -3.176 -4.428 193 HA GLU 25 HA GLU 25 58.839 -2.873 -6.574 194 HB2 GLU 25 HB2 GLU 25 61.093 -1.071 -5.649 195 HB3 GLU 25 HB3 GLU 25 59.863 -0.665 -6.819 196 HG2 GLU 25 HG2 GLU 25 59.326 -1.352 -3.950 197 HG3 GLU 25 HG3 GLU 25 59.346 0.266 -4.651 198 H ASN 26 H ASN 26 62.242 -3.665 -6.419 199 HA ASN 26 HA ASN 26 62.648 -3.150 -9.207 200 HB2 ASN 26 HB2 ASN 26 64.483 -2.968 -7.504 201 HB3 ASN 26 HB3 ASN 26 64.445 -4.717 -7.345 202 HD21 ASN 26 HD21 ASN 26 64.086 -2.953 -10.423 203 HD22 ASN 26 HD22 ASN 26 65.546 -3.511 -11.090 204 H VAL 27 H VAL 27 62.201 -6.111 -7.238 205 HA VAL 27 HA VAL 27 62.513 -7.792 -9.520 206 HB VAL 27 HB VAL 27 61.786 -9.679 -8.178 207 HG11 VAL 27 HG11 VAL 27 63.644 -7.871 -6.668 208 HG12 VAL 27 HG12 VAL 27 64.071 -9.027 -7.931 209 HG13 VAL 27 HG13 VAL 27 63.454 -9.599 -6.379 210 HG21 VAL 27 HG21 VAL 27 61.092 -7.680 -6.018 211 HG22 VAL 27 HG22 VAL 27 61.096 -9.433 -5.817 212 HG23 VAL 27 HG23 VAL 27 59.950 -8.674 -6.921 213 H ALA 28 H ALA 28 59.775 -6.164 -8.171 214 HA ALA 28 HA ALA 28 58.000 -7.644 -9.956 215 HB1 ALA 28 HB1 ALA 28 57.205 -7.143 -7.680 216 HB2 ALA 28 HB2 ALA 28 56.188 -6.379 -8.903 217 HB3 ALA 28 HB3 ALA 28 57.368 -5.420 -8.015 218 H ALA 29 H ALA 29 60.081 -5.175 -10.134 219 HA ALA 29 HA ALA 29 60.409 -3.282 -11.232 220 HB1 ALA 29 HB1 ALA 29 60.785 -4.990 -12.953 221 HB2 ALA 29 HB2 ALA 29 60.281 -3.426 -13.598 222 HB3 ALA 29 HB3 ALA 29 59.123 -4.756 -13.519 223 H THR 30 H THR 30 59.101 -2.022 -10.015 224 HA THR 30 HA THR 30 56.533 -1.303 -11.155 225 HB THR 30 HB THR 30 56.208 -0.183 -8.990 226 HG1 THR 30 HG1 THR 30 57.818 -0.349 -7.445 227 HG21 THR 30 HG21 THR 30 55.665 -2.563 -9.188 228 HG22 THR 30 HG22 THR 30 56.270 -2.164 -7.565 229 HG23 THR 30 HG23 THR 30 57.332 -2.945 -8.745 230 H ASP 31 H ASP 31 56.548 1.386 -10.090 231 HA ASP 31 HA ASP 31 58.801 2.579 -11.494 232 HB2 ASP 31 HB2 ASP 31 57.111 2.545 -13.206 233 HB3 ASP 31 HB3 ASP 31 55.951 3.267 -12.092 234 H ASP 32 H ASP 32 55.899 3.679 -9.797 235 HA ASP 32 HA ASP 32 56.960 6.152 -8.981 236 HB2 ASP 32 HB2 ASP 32 54.898 4.449 -7.603 237 HB3 ASP 32 HB3 ASP 32 55.318 6.077 -7.103 238 H VAL 33 H VAL 33 56.822 3.253 -7.085 239 HA VAL 33 HA VAL 33 58.302 4.637 -5.089 240 HB VAL 33 HB VAL 33 57.059 1.879 -5.126 241 HG11 VAL 33 HG11 VAL 33 58.282 3.478 -2.949 242 HG12 VAL 33 HG12 VAL 33 59.033 2.095 -3.763 243 HG13 VAL 33 HG13 VAL 33 57.552 1.856 -2.778 244 HG21 VAL 33 HG21 VAL 33 56.462 4.446 -3.837 245 HG22 VAL 33 HG22 VAL 33 55.585 2.920 -3.539 246 HG23 VAL 33 HG23 VAL 33 55.538 3.705 -5.157 247 H LEU 34 H LEU 34 58.765 2.358 -7.576 248 HA LEU 34 HA LEU 34 61.217 1.318 -6.798 249 HB2 LEU 34 HB2 LEU 34 59.789 0.582 -8.792 250 HB3 LEU 34 HB3 LEU 34 60.288 2.042 -9.559 251 HG LEU 34 HG LEU 34 61.409 -0.162 -10.254 252 HD11 LEU 34 HD11 LEU 34 62.955 2.339 -9.795 253 HD12 LEU 34 HD12 LEU 34 61.897 1.940 -11.155 254 HD13 LEU 34 HD13 LEU 34 63.392 1.023 -10.903 255 HD21 LEU 34 HD21 LEU 34 63.521 -0.609 -9.101 256 HD22 LEU 34 HD22 LEU 34 62.141 -0.882 -8.039 257 HD23 LEU 34 HD23 LEU 34 63.106 0.586 -7.872 258 H ASP 35 H ASP 35 60.378 4.244 -8.630 259 HA ASP 35 HA ASP 35 63.082 5.140 -8.748 260 HB2 ASP 35 HB2 ASP 35 61.260 6.070 -10.285 261 HB3 ASP 35 HB3 ASP 35 60.686 6.905 -8.830 262 H VAL 36 H VAL 36 60.485 5.811 -6.503 263 HA VAL 36 HA VAL 36 61.719 7.810 -5.019 264 HB VAL 36 HB VAL 36 60.284 5.505 -3.749 265 HG11 VAL 36 HG11 VAL 36 60.724 8.321 -2.907 266 HG12 VAL 36 HG12 VAL 36 61.551 6.881 -2.316 267 HG13 VAL 36 HG13 VAL 36 59.807 7.103 -1.975 268 HG21 VAL 36 HG21 VAL 36 58.371 6.763 -3.786 269 HG22 VAL 36 HG22 VAL 36 58.987 6.475 -5.449 270 HG23 VAL 36 HG23 VAL 36 59.175 8.086 -4.669 271 H LEU 37 H LEU 37 61.839 4.345 -4.644 272 HA LEU 37 HA LEU 37 63.450 4.494 -2.369 273 HB2 LEU 37 HB2 LEU 37 63.089 2.093 -4.090 274 HB3 LEU 37 HB3 LEU 37 63.632 2.318 -2.437 275 HG LEU 37 HG LEU 37 60.850 2.988 -3.245 276 HD11 LEU 37 HD11 LEU 37 61.187 0.607 -3.452 277 HD12 LEU 37 HD12 LEU 37 60.113 1.020 -2.127 278 HD13 LEU 37 HD13 LEU 37 61.785 0.535 -1.786 279 HD21 LEU 37 HD21 LEU 37 62.156 2.757 -0.539 280 HD22 LEU 37 HD22 LEU 37 60.439 3.038 -0.820 281 HD23 LEU 37 HD23 LEU 37 61.620 4.246 -1.322 282 H LEU 38 H LEU 38 64.088 3.932 -5.737 283 HA LEU 38 HA LEU 38 66.761 3.207 -5.468 284 HB2 LEU 38 HB2 LEU 38 65.142 4.501 -7.545 285 HB3 LEU 38 HB3 LEU 38 66.861 4.303 -7.866 286 HG LEU 38 HG LEU 38 64.543 2.440 -7.847 287 HD11 LEU 38 HD11 LEU 38 65.667 1.481 -9.760 288 HD12 LEU 38 HD12 LEU 38 67.038 2.547 -9.454 289 HD13 LEU 38 HD13 LEU 38 65.473 3.238 -9.903 290 HD21 LEU 38 HD21 LEU 38 65.915 1.408 -6.105 291 HD22 LEU 38 HD22 LEU 38 67.306 1.410 -7.192 292 HD23 LEU 38 HD23 LEU 38 65.894 0.433 -7.570 293 H GLU 39 H GLU 39 65.286 6.423 -5.986 294 HA GLU 39 HA GLU 39 67.823 7.698 -5.778 295 HB2 GLU 39 HB2 GLU 39 66.547 9.815 -5.685 296 HB3 GLU 39 HB3 GLU 39 66.133 8.796 -7.049 297 HG2 GLU 39 HG2 GLU 39 64.065 8.412 -6.379 298 HG3 GLU 39 HG3 GLU 39 64.381 8.495 -4.672 299 H HIS 40 H HIS 40 65.312 6.914 -3.543 300 HA HIS 40 HA HIS 40 66.029 8.528 -1.365 301 HB2 HIS 40 HB2 HIS 40 63.942 7.227 -1.584 302 HB3 HIS 40 HB3 HIS 40 64.779 5.748 -1.375 303 HD1 HIS 40 HD1 HIS 40 63.300 8.550 0.521 304 HD2 HIS 40 HD2 HIS 40 65.775 5.307 1.266 305 HE1 HIS 40 HE1 HIS 40 63.338 8.258 3.004 306 H PHE 41 H PHE 41 66.925 5.316 -2.316 307 HA PHE 41 HA PHE 41 68.625 4.686 -0.228 308 HB2 PHE 41 HB2 PHE 41 67.744 3.025 -1.627 309 HB3 PHE 41 HB3 PHE 41 68.358 3.805 -3.072 310 HD1 PHE 41 HD1 PHE 41 69.404 2.133 0.061 311 HD2 PHE 41 HD2 PHE 41 70.390 3.071 -3.956 312 HE1 PHE 41 HE1 PHE 41 71.389 0.688 0.216 313 HE2 PHE 41 HE2 PHE 41 72.383 1.638 -3.791 314 HZ PHE 41 HZ PHE 41 72.876 0.446 -1.713 315 H VAL 42 H VAL 42 69.406 5.938 -3.464 316 HA VAL 42 HA VAL 42 72.125 6.206 -2.761 317 HB VAL 42 HB VAL 42 71.582 5.799 -5.019 318 HG11 VAL 42 HG11 VAL 42 70.679 7.391 -6.519 319 HG12 VAL 42 HG12 VAL 42 70.076 8.325 -5.108 320 HG13 VAL 42 HG13 VAL 42 69.603 6.617 -5.378 321 HG21 VAL 42 HG21 VAL 42 72.838 8.513 -4.781 322 HG22 VAL 42 HG22 VAL 42 72.923 7.480 -6.209 323 HG23 VAL 42 HG23 VAL 42 73.669 6.961 -4.697 324 H LYS 43 H LYS 43 69.550 8.432 -2.554 325 HA LYS 43 HA LYS 43 71.235 10.706 -2.099 326 HB2 LYS 43 HB2 LYS 43 69.333 11.961 -1.370 327 HB3 LYS 43 HB3 LYS 43 68.741 10.887 -2.626 328 HG2 LYS 43 HG2 LYS 43 67.875 9.361 -0.715 329 HG3 LYS 43 HG3 LYS 43 68.402 10.629 0.339 330 HD2 LYS 43 HD2 LYS 43 66.458 11.207 -1.865 331 HD3 LYS 43 HD3 LYS 43 65.954 10.678 -0.264 332 HE2 LYS 43 HE2 LYS 43 67.621 13.141 -0.844 333 HE3 LYS 43 HE3 LYS 43 65.891 13.140 -0.521 334 HZ1 LYS 43 HZ1 LYS 43 67.170 13.705 1.452 335 HZ2 LYS 43 HZ2 LYS 43 68.003 12.256 1.395 336 HZ3 LYS 43 HZ3 LYS 43 66.343 12.272 1.704 337 H ILE 44 H ILE 44 69.831 8.405 0.175 338 HA ILE 44 HA ILE 44 70.851 9.880 2.425 339 HB ILE 44 HB ILE 44 70.118 7.927 3.787 340 HG12 ILE 44 HG12 ILE 44 69.359 6.805 1.079 341 HG13 ILE 44 HG13 ILE 44 70.497 6.120 2.224 342 HG21 ILE 44 HG21 ILE 44 68.578 9.760 3.343 343 HG22 ILE 44 HG22 ILE 44 67.711 8.224 3.403 344 HG23 ILE 44 HG23 ILE 44 68.060 8.979 1.848 345 HD11 ILE 44 HD11 ILE 44 68.365 4.927 2.143 346 HD12 ILE 44 HD12 ILE 44 67.545 6.399 2.655 347 HD13 ILE 44 HD13 ILE 44 68.687 5.609 3.739 348 H THR 45 H THR 45 71.933 7.192 0.500 349 HA THR 45 HA THR 45 74.059 6.640 2.356 350 HB THR 45 HB THR 45 74.800 4.952 0.702 351 HG1 THR 45 HG1 THR 45 72.458 5.445 -0.773 352 HG21 THR 45 HG21 THR 45 72.884 3.479 0.914 353 HG22 THR 45 HG22 THR 45 71.836 4.852 1.237 354 HG23 THR 45 HG23 THR 45 73.079 4.401 2.407 355 H GLU 46 H GLU 46 73.619 8.241 -0.710 356 HA GLU 46 HA GLU 46 74.874 9.189 -2.145 357 HB2 GLU 46 HB2 GLU 46 76.312 10.000 0.328 358 HB3 GLU 46 HB3 GLU 46 76.859 10.551 -1.265 359 HG2 GLU 46 HG2 GLU 46 74.570 11.458 -1.584 360 HG3 GLU 46 HG3 GLU 46 74.233 11.027 0.085 361 H HIS 47 H HIS 47 75.191 7.270 -2.981 362 HA HIS 47 HA HIS 47 77.979 6.442 -2.920 363 HB2 HIS 47 HB2 HIS 47 76.268 4.777 -1.940 364 HB3 HIS 47 HB3 HIS 47 75.645 4.624 -3.580 365 HD1 HIS 47 HD1 HIS 47 76.930 3.000 -5.133 366 HD2 HIS 47 HD2 HIS 47 78.918 3.854 -1.595 367 HE1 HIS 47 HE1 HIS 47 79.039 1.641 -5.138 368 HA PRO 48 HA PRO 48 77.666 8.007 -7.134 369 HB2 PRO 48 HB2 PRO 48 79.774 6.045 -7.714 370 HB3 PRO 48 HB3 PRO 48 79.790 7.793 -7.948 371 HG2 PRO 48 HG2 PRO 48 81.161 6.522 -6.109 372 HG3 PRO 48 HG3 PRO 48 80.437 8.107 -5.685 373 HD2 PRO 48 HD2 PRO 48 79.601 5.308 -5.046 374 HD3 PRO 48 HD3 PRO 48 79.539 6.726 -3.995 375 H ASP 49 H ASP 49 77.412 4.793 -6.264 376 HA ASP 49 HA ASP 49 76.716 4.028 -8.894 377 HB2 ASP 49 HB2 ASP 49 78.297 2.387 -6.886 378 HB3 ASP 49 HB3 ASP 49 77.774 1.787 -8.445 379 H GLY 50 H GLY 50 75.215 5.023 -6.719 380 HA2 GLY 50 HA2 GLY 50 74.148 3.438 -4.683 381 HA3 GLY 50 HA3 GLY 50 73.275 4.682 -5.561 382 H THR 51 H THR 51 72.889 3.706 -7.861 383 HA THR 51 HA THR 51 71.249 1.592 -6.934 384 HB THR 51 HB THR 51 70.133 1.707 -9.289 385 HG1 THR 51 HG1 THR 51 71.275 3.270 -10.263 386 HG21 THR 51 HG21 THR 51 68.508 3.215 -8.223 387 HG22 THR 51 HG22 THR 51 69.720 3.635 -7.005 388 HG23 THR 51 HG23 THR 51 69.133 1.983 -7.140 389 H ALA 52 H ALA 52 73.979 1.876 -8.764 390 HA ALA 52 HA ALA 52 73.853 -0.618 -10.154 391 HB1 ALA 52 HB1 ALA 52 76.265 0.735 -8.968 392 HB2 ALA 52 HB2 ALA 52 75.635 1.075 -10.585 393 HB3 ALA 52 HB3 ALA 52 76.288 -0.521 -10.203 394 H LEU 53 H LEU 53 74.654 0.263 -6.877 395 HA LEU 53 HA LEU 53 75.270 -2.363 -6.063 396 HB2 LEU 53 HB2 LEU 53 74.088 -0.147 -4.405 397 HB3 LEU 53 HB3 LEU 53 74.661 -1.667 -3.763 398 HG LEU 53 HG LEU 53 76.274 0.564 -4.955 399 HD11 LEU 53 HD11 LEU 53 76.303 -0.782 -2.281 400 HD12 LEU 53 HD12 LEU 53 75.649 0.813 -2.660 401 HD13 LEU 53 HD13 LEU 53 77.379 0.514 -2.805 402 HD21 LEU 53 HD21 LEU 53 77.193 -2.225 -4.253 403 HD22 LEU 53 HD22 LEU 53 78.255 -0.863 -4.602 404 HD23 LEU 53 HD23 LEU 53 77.197 -1.496 -5.860 405 H ILE 54 H ILE 54 72.220 -0.678 -6.321 406 HA ILE 54 HA ILE 54 70.697 -2.771 -5.059 407 HB ILE 54 HB ILE 54 69.833 -0.503 -6.878 408 HG12 ILE 54 HG12 ILE 54 70.375 0.236 -4.615 409 HG13 ILE 54 HG13 ILE 54 68.623 0.279 -4.792 410 HG21 ILE 54 HG21 ILE 54 67.485 -1.073 -6.455 411 HG22 ILE 54 HG22 ILE 54 67.998 -2.552 -5.646 412 HG23 ILE 54 HG23 ILE 54 68.325 -2.330 -7.366 413 HD11 ILE 54 HD11 ILE 54 68.413 -1.793 -3.675 414 HD12 ILE 54 HD12 ILE 54 69.222 -0.567 -2.682 415 HD13 ILE 54 HD13 ILE 54 70.161 -1.864 -3.442 416 H TYR 55 H TYR 55 71.415 -1.929 -8.313 417 HA TYR 55 HA TYR 55 69.893 -3.858 -9.491 418 HB2 TYR 55 HB2 TYR 55 72.096 -2.112 -10.359 419 HB3 TYR 55 HB3 TYR 55 71.616 -3.398 -11.442 420 HD1 TYR 55 HD1 TYR 55 69.736 -1.078 -9.195 421 HD2 TYR 55 HD2 TYR 55 70.272 -2.491 -13.161 422 HE1 TYR 55 HE1 TYR 55 67.935 0.360 -9.906 423 HE2 TYR 55 HE2 TYR 55 68.438 -1.034 -13.918 424 HH TYR 55 HH TYR 55 66.474 0.094 -12.959 425 H GLU 56 H GLU 56 73.359 -3.903 -8.585 426 HA GLU 56 HA GLU 56 73.657 -6.546 -9.563 427 HB2 GLU 56 HB2 GLU 56 75.793 -6.647 -8.266 428 HB3 GLU 56 HB3 GLU 56 75.703 -5.306 -9.398 429 HG2 GLU 56 HG2 GLU 56 75.418 -3.764 -7.719 430 HG3 GLU 56 HG3 GLU 56 75.071 -4.939 -6.477 431 H ALA 57 H ALA 57 72.796 -5.195 -6.444 432 HA ALA 57 HA ALA 57 73.005 -7.514 -4.930 433 HB1 ALA 57 HB1 ALA 57 70.987 -5.307 -4.589 434 HB2 ALA 57 HB2 ALA 57 72.628 -5.307 -3.944 435 HB3 ALA 57 HB3 ALA 57 71.455 -6.489 -3.369 436 H ALA 58 H ALA 58 70.366 -6.349 -6.943 437 HA ALA 58 HA ALA 58 68.447 -8.270 -6.337 438 HB1 ALA 58 HB1 ALA 58 67.994 -6.309 -7.733 439 HB2 ALA 58 HB2 ALA 58 67.500 -7.793 -8.551 440 HB3 ALA 58 HB3 ALA 58 68.999 -6.986 -9.015 441 H ALA 59 H ALA 59 71.034 -8.372 -8.740 442 HA ALA 59 HA ALA 59 70.444 -11.011 -9.652 443 HB1 ALA 59 HB1 ALA 59 71.656 -9.392 -11.043 444 HB2 ALA 59 HB2 ALA 59 72.592 -10.871 -10.822 445 HB3 ALA 59 HB3 ALA 59 73.002 -9.422 -9.906 446 H ARG 60 H ARG 60 72.777 -9.645 -7.393 447 HA ARG 60 HA ARG 60 74.151 -11.987 -6.712 448 HB2 ARG 60 HB2 ARG 60 73.689 -9.454 -5.128 449 HB3 ARG 60 HB3 ARG 60 74.746 -10.746 -4.579 450 HG2 ARG 60 HG2 ARG 60 76.217 -10.409 -6.438 451 HG3 ARG 60 HG3 ARG 60 75.101 -9.261 -7.177 452 HD2 ARG 60 HD2 ARG 60 76.962 -8.097 -6.109 453 HD3 ARG 60 HD3 ARG 60 75.451 -7.723 -5.292 454 HE ARG 60 HE ARG 60 76.597 -9.861 -3.957 455 HH11 ARG 60 HH11 ARG 60 77.511 -6.454 -4.597 456 HH12 ARG 60 HH12 ARG 60 78.350 -6.274 -3.121 457 HH21 ARG 60 HH21 ARG 60 77.778 -9.602 -1.986 458 HH22 ARG 60 HH22 ARG 60 78.496 -8.103 -1.591 459 H ALA 61 H ALA 61 71.164 -10.657 -5.474 460 HA ALA 61 HA ALA 61 70.933 -12.657 -3.412 461 HB1 ALA 61 HB1 ALA 61 68.885 -10.720 -4.489 462 HB2 ALA 61 HB2 ALA 61 70.000 -10.445 -3.139 463 HB3 ALA 61 HB3 ALA 61 68.748 -11.680 -3.008 464 H ALA 62 H ALA 62 69.675 -12.237 -6.661 465 HA ALA 62 HA ALA 62 67.859 -14.387 -6.629 466 HB1 ALA 62 HB1 ALA 62 67.868 -12.685 -8.395 467 HB2 ALA 62 HB2 ALA 62 68.023 -14.307 -9.074 468 HB3 ALA 62 HB3 ALA 62 69.440 -13.266 -8.941 469 H ALA 63 H ALA 63 71.268 -14.171 -7.309 470 HA ALA 63 HA ALA 63 71.558 -16.977 -7.903 471 HB1 ALA 63 HB1 ALA 63 73.012 -15.317 -8.960 472 HB2 ALA 63 HB2 ALA 63 73.950 -16.451 -7.983 473 HB3 ALA 63 HB3 ALA 63 73.613 -14.834 -7.375 474 H ASN 64 H ASN 64 72.463 -14.769 -5.317 475 HA ASN 64 HA ASN 64 73.228 -14.935 -3.294 476 HB2 ASN 64 HB2 ASN 64 71.045 -15.961 -2.788 477 HB3 ASN 64 HB3 ASN 64 71.703 -17.551 -3.144 478 HD21 ASN 64 HD21 ASN 64 71.559 -14.942 -0.892 479 HD22 ASN 64 HD22 ASN 64 72.403 -15.698 0.399 480 HA PRO 65 HA PRO 65 76.786 -17.208 -4.816 481 HB2 PRO 65 HB2 PRO 65 78.238 -15.211 -3.208 482 HB3 PRO 65 HB3 PRO 65 78.393 -15.584 -4.920 483 HG2 PRO 65 HG2 PRO 65 77.226 -13.317 -4.115 484 HG3 PRO 65 HG3 PRO 65 76.627 -14.209 -5.524 485 HD2 PRO 65 HD2 PRO 65 75.548 -14.139 -2.736 486 HD3 PRO 65 HD3 PRO 65 74.699 -14.069 -4.300 487 H GLY 66 H GLY 66 77.225 -15.818 -1.546 488 HA2 GLY 66 HA2 GLY 66 77.666 -18.573 -0.599 489 HA3 GLY 66 HA3 GLY 66 78.826 -17.297 -0.225 490 H GLY 67 H GLY 67 75.310 -17.352 -0.288 491 HA2 GLY 67 HA2 GLY 67 73.830 -17.214 1.473 492 HA3 GLY 67 HA3 GLY 67 75.233 -17.361 2.538 493 H ASP 68 H ASP 68 76.447 -15.542 2.997 494 HA ASP 68 HA ASP 68 74.844 -13.194 3.394 495 HB2 ASP 68 HB2 ASP 68 76.359 -14.019 5.160 496 HB3 ASP 68 HB3 ASP 68 77.735 -13.736 4.106 497 H GLY 69 H GLY 69 74.709 -11.567 2.097 498 HA2 GLY 69 HA2 GLY 69 75.531 -9.863 0.671 499 HA3 GLY 69 HA3 GLY 69 76.890 -10.910 0.212 500 H GLY 70 H GLY 70 73.730 -12.143 0.470 501 HA2 GLY 70 HA2 GLY 70 73.301 -11.949 -2.415 502 HA3 GLY 70 HA3 GLY 70 73.201 -13.512 -1.597 503 H GLY 71 H GLY 71 72.087 -10.208 -0.793 504 HA2 GLY 71 HA2 GLY 71 69.443 -10.629 -1.104 505 HA3 GLY 71 HA3 GLY 71 69.859 -11.047 0.559 506 HA PRO 72 HA PRO 72 69.222 -6.375 -0.037 507 HB2 PRO 72 HB2 PRO 72 67.463 -6.394 2.128 508 HB3 PRO 72 HB3 PRO 72 67.020 -6.331 0.416 509 HG2 PRO 72 HG2 PRO 72 67.100 -8.658 2.255 510 HG3 PRO 72 HG3 PRO 72 65.965 -8.292 0.952 511 HD2 PRO 72 HD2 PRO 72 67.897 -10.116 0.644 512 HD3 PRO 72 HD3 PRO 72 67.470 -9.091 -0.718 513 H GLU 73 H GLU 73 69.632 -8.533 2.760 514 HA GLU 73 HA GLU 73 70.705 -6.468 4.315 515 HB2 GLU 73 HB2 GLU 73 71.053 -9.431 4.721 516 HB3 GLU 73 HB3 GLU 73 71.446 -8.188 5.894 517 HG2 GLU 73 HG2 GLU 73 68.985 -7.534 5.784 518 HG3 GLU 73 HG3 GLU 73 68.748 -9.020 4.905 519 H GLY 74 H GLY 74 72.069 -7.726 1.651 520 HA2 GLY 74 HA2 GLY 74 74.629 -7.160 2.841 521 HA3 GLY 74 HA3 GLY 74 74.492 -8.127 1.331 522 H ILE 75 H ILE 75 72.381 -5.657 1.017 523 HA ILE 75 HA ILE 75 74.173 -4.107 -0.647 524 HB ILE 75 HB ILE 75 71.616 -2.875 0.264 525 HG12 ILE 75 HG12 ILE 75 71.689 -5.474 -1.332 526 HG13 ILE 75 HG13 ILE 75 70.863 -5.069 0.117 527 HG21 ILE 75 HG21 ILE 75 72.865 -3.237 -2.462 528 HG22 ILE 75 HG22 ILE 75 73.072 -1.841 -1.408 529 HG23 ILE 75 HG23 ILE 75 71.480 -2.211 -2.067 530 HD11 ILE 75 HD11 ILE 75 70.153 -3.765 -2.473 531 HD12 ILE 75 HD12 ILE 75 69.310 -3.633 -0.927 532 HD13 ILE 75 HD13 ILE 75 69.330 -5.169 -1.795 533 H VAL 76 H VAL 76 72.435 -3.723 2.275 534 HA VAL 76 HA VAL 76 73.287 -1.271 3.271 535 HB VAL 76 HB VAL 76 71.553 -2.396 4.253 536 HG11 VAL 76 HG11 VAL 76 71.786 -4.487 5.540 537 HG12 VAL 76 HG12 VAL 76 73.090 -4.796 4.352 538 HG13 VAL 76 HG13 VAL 76 71.448 -4.353 3.828 539 HG21 VAL 76 HG21 VAL 76 72.742 -1.129 5.946 540 HG22 VAL 76 HG22 VAL 76 73.746 -2.536 6.298 541 HG23 VAL 76 HG23 VAL 76 72.019 -2.568 6.660 542 H LYS 77 H LYS 77 74.598 -4.335 3.626 543 HA LYS 77 HA LYS 77 76.814 -3.835 5.253 544 HB2 LYS 77 HB2 LYS 77 75.991 -6.057 4.696 545 HB3 LYS 77 HB3 LYS 77 76.511 -5.845 3.036 546 HG2 LYS 77 HG2 LYS 77 78.863 -5.620 3.969 547 HG3 LYS 77 HG3 LYS 77 78.192 -6.232 5.486 548 HD2 LYS 77 HD2 LYS 77 77.968 -7.560 2.817 549 HD3 LYS 77 HD3 LYS 77 79.125 -8.039 4.073 550 HE2 LYS 77 HE2 LYS 77 76.104 -8.093 4.308 551 HE3 LYS 77 HE3 LYS 77 77.109 -9.485 3.946 552 HZ1 LYS 77 HZ1 LYS 77 77.234 -7.914 6.472 553 HZ2 LYS 77 HZ2 LYS 77 78.142 -9.289 6.096 554 HZ3 LYS 77 HZ3 LYS 77 76.485 -9.402 6.254 555 H GLU 78 H GLU 78 76.570 -3.922 1.694 556 HA GLU 78 HA GLU 78 79.210 -3.209 1.072 557 HB2 GLU 78 HB2 GLU 78 77.295 -4.085 -0.428 558 HB3 GLU 78 HB3 GLU 78 76.772 -2.415 -0.537 559 HG2 GLU 78 HG2 GLU 78 78.043 -2.874 -2.457 560 HG3 GLU 78 HG3 GLU 78 79.053 -1.870 -1.413 561 H ILE 79 H ILE 79 76.324 -1.362 1.757 562 HA ILE 79 HA ILE 79 77.334 1.196 1.202 563 HB ILE 79 HB ILE 79 74.991 0.402 2.982 564 HG12 ILE 79 HG12 ILE 79 74.775 -0.108 0.547 565 HG13 ILE 79 HG13 ILE 79 73.599 1.074 1.118 566 HG21 ILE 79 HG21 ILE 79 75.826 2.510 3.737 567 HG22 ILE 79 HG22 ILE 79 74.274 2.692 2.921 568 HG23 ILE 79 HG23 ILE 79 75.764 3.148 2.094 569 HD11 ILE 79 HD11 ILE 79 76.109 1.617 -0.461 570 HD12 ILE 79 HD12 ILE 79 75.022 2.853 0.169 571 HD13 ILE 79 HD13 ILE 79 74.444 1.710 -1.040 572 H LYS 80 H LYS 80 77.186 -0.614 4.240 573 HA LYS 80 HA LYS 80 78.068 1.541 5.820 574 HB2 LYS 80 HB2 LYS 80 78.363 -0.027 7.658 575 HB3 LYS 80 HB3 LYS 80 76.947 -0.519 6.747 576 HG2 LYS 80 HG2 LYS 80 78.156 -2.303 5.714 577 HG3 LYS 80 HG3 LYS 80 79.636 -1.786 6.497 578 HD2 LYS 80 HD2 LYS 80 78.671 -3.670 7.692 579 HD3 LYS 80 HD3 LYS 80 78.661 -2.219 8.695 580 HE2 LYS 80 HE2 LYS 80 76.267 -1.904 8.173 581 HE3 LYS 80 HE3 LYS 80 76.296 -3.376 7.204 582 HZ1 LYS 80 HZ1 LYS 80 75.436 -3.808 9.464 583 HZ2 LYS 80 HZ2 LYS 80 76.855 -3.182 10.104 584 HZ3 LYS 80 HZ3 LYS 80 76.911 -4.611 9.229 585 H GLU 81 H GLU 81 79.817 -0.918 4.050 586 HA GLU 81 HA GLU 81 82.289 -0.353 5.268 587 HB2 GLU 81 HB2 GLU 81 81.758 -1.688 2.643 588 HB3 GLU 81 HB3 GLU 81 83.285 -1.707 3.509 589 HG2 GLU 81 HG2 GLU 81 82.043 -2.789 5.404 590 HG3 GLU 81 HG3 GLU 81 80.702 -2.997 4.277 591 H TRP 82 H TRP 82 80.879 0.690 2.195 592 HA TRP 82 HA TRP 82 83.115 2.115 1.235 593 HB2 TRP 82 HB2 TRP 82 80.940 1.495 0.010 594 HB3 TRP 82 HB3 TRP 82 80.248 2.882 0.851 595 HD1 TRP 82 HD1 TRP 82 82.562 2.002 -2.057 596 HE1 TRP 82 HE1 TRP 82 82.899 4.115 -3.499 597 HE3 TRP 82 HE3 TRP 82 80.399 5.440 1.017 598 HZ2 TRP 82 HZ2 TRP 82 82.311 6.856 -3.358 599 HZ3 TRP 82 HZ3 TRP 82 80.319 7.758 0.327 600 HH2 TRP 82 HH2 TRP 82 81.262 8.488 -1.820 601 H ARG 83 H ARG 83 80.416 3.004 3.259 602 HA ARG 83 HA ARG 83 80.942 5.748 3.589 603 HB2 ARG 83 HB2 ARG 83 79.134 3.801 4.651 604 HB3 ARG 83 HB3 ARG 83 79.802 4.733 5.975 605 HG2 ARG 83 HG2 ARG 83 77.712 5.742 5.209 606 HG3 ARG 83 HG3 ARG 83 79.102 6.766 4.944 607 HD2 ARG 83 HD2 ARG 83 77.401 6.612 3.030 608 HD3 ARG 83 HD3 ARG 83 79.115 6.521 2.646 609 HE ARG 83 HE ARG 83 78.173 3.937 3.040 610 HH11 ARG 83 HH11 ARG 83 77.382 6.528 0.771 611 HH12 ARG 83 HH12 ARG 83 77.400 5.571 -0.603 612 HH21 ARG 83 HH21 ARG 83 78.239 2.593 1.178 613 HH22 ARG 83 HH22 ARG 83 77.865 3.188 -0.372 614 H ALA 84 H ALA 84 81.918 2.914 5.500 615 HA ALA 84 HA ALA 84 83.299 4.322 7.496 616 HB1 ALA 84 HB1 ALA 84 83.706 1.485 6.552 617 HB2 ALA 84 HB2 ALA 84 82.514 2.004 7.738 618 HB3 ALA 84 HB3 ALA 84 84.236 2.158 8.096 619 H ALA 85 H ALA 85 84.342 2.917 4.440 620 HA ALA 85 HA ALA 85 87.093 3.424 4.742 621 HB1 ALA 85 HB1 ALA 85 85.469 3.224 2.213 622 HB2 ALA 85 HB2 ALA 85 86.189 1.871 3.085 623 HB3 ALA 85 HB3 ALA 85 87.222 3.088 2.333 624 H ASN 86 H ASN 86 84.500 5.283 3.242 625 HA ASN 86 HA ASN 86 86.119 7.417 2.318 626 HB2 ASN 86 HB2 ASN 86 83.806 6.934 1.488 627 HB3 ASN 86 HB3 ASN 86 83.178 7.520 3.022 628 HD21 ASN 86 HD21 ASN 86 84.293 8.379 -0.068 629 HD22 ASN 86 HD22 ASN 86 84.186 10.083 0.089 630 H GLY 87 H GLY 87 84.179 7.002 5.260 631 HA2 GLY 87 HA2 GLY 87 84.979 8.001 7.330 632 HA3 GLY 87 HA3 GLY 87 85.560 9.363 6.376 633 H LYS 88 H LYS 88 82.502 7.933 5.566 634 HA LYS 88 HA LYS 88 81.109 10.293 6.408 635 HB2 LYS 88 HB2 LYS 88 80.778 8.106 4.408 636 HB3 LYS 88 HB3 LYS 88 79.425 9.090 4.894 637 HG2 LYS 88 HG2 LYS 88 80.519 11.067 3.975 638 HG3 LYS 88 HG3 LYS 88 81.987 10.133 3.672 639 HD2 LYS 88 HD2 LYS 88 80.755 8.707 2.105 640 HD3 LYS 88 HD3 LYS 88 79.296 9.654 2.375 641 HE2 LYS 88 HE2 LYS 88 81.874 10.794 1.321 642 HE3 LYS 88 HE3 LYS 88 80.613 10.208 0.262 643 HZ1 LYS 88 HZ1 LYS 88 80.402 12.483 2.204 644 HZ2 LYS 88 HZ2 LYS 88 79.120 11.901 1.282 645 HZ3 LYS 88 HZ3 LYS 88 80.434 12.586 0.520 646 HA PRO 89 HA PRO 89 79.195 7.676 9.507 647 HB2 PRO 89 HB2 PRO 89 76.750 8.947 9.624 648 HB3 PRO 89 HB3 PRO 89 78.179 9.462 10.519 649 HG2 PRO 89 HG2 PRO 89 77.024 10.551 8.004 650 HG3 PRO 89 HG3 PRO 89 77.844 11.399 9.323 651 HD2 PRO 89 HD2 PRO 89 79.047 10.843 6.951 652 HD3 PRO 89 HD3 PRO 89 79.935 10.954 8.481 653 H GLY 90 H GLY 90 78.244 5.844 9.337 654 HA2 GLY 90 HA2 GLY 90 76.717 5.238 6.950 655 HA3 GLY 90 HA3 GLY 90 77.354 4.078 8.114 656 H PHE 91 H PHE 91 75.917 3.167 9.367 657 HA PHE 91 HA PHE 91 73.249 4.351 9.485 658 HB2 PHE 91 HB2 PHE 91 74.144 1.563 10.224 659 HB3 PHE 91 HB3 PHE 91 72.487 2.138 10.064 660 HD1 PHE 91 HD1 PHE 91 71.852 3.099 7.764 661 HD2 PHE 91 HD2 PHE 91 75.162 0.541 8.452 662 HE1 PHE 91 HE1 PHE 91 71.902 2.518 5.389 663 HE2 PHE 91 HE2 PHE 91 75.214 -0.037 6.078 664 HZ PHE 91 HZ PHE 91 73.585 0.957 4.543 665 H LYS 92 H LYS 92 72.094 4.052 11.564 666 HA LYS 92 HA LYS 92 73.851 4.516 13.776 667 HB2 LYS 92 HB2 LYS 92 71.887 5.260 14.874 668 HB3 LYS 92 HB3 LYS 92 71.890 5.976 13.305 669 HG2 LYS 92 HG2 LYS 92 70.222 4.398 12.546 670 HG3 LYS 92 HG3 LYS 92 70.318 3.542 14.082 671 HD2 LYS 92 HD2 LYS 92 69.395 6.404 13.737 672 HD3 LYS 92 HD3 LYS 92 68.332 5.013 13.927 673 HE2 LYS 92 HE2 LYS 92 69.349 4.580 16.143 674 HE3 LYS 92 HE3 LYS 92 70.340 6.024 15.943 675 HZ1 LYS 92 HZ1 LYS 92 68.459 6.576 17.254 676 HZ2 LYS 92 HZ2 LYS 92 67.389 5.894 16.152 677 HZ3 LYS 92 HZ3 LYS 92 68.218 7.296 15.747 678 H GLN 93 H GLN 93 72.870 3.308 15.799 679 HA GLN 93 HA GLN 93 72.392 0.569 14.991 680 HB2 GLN 93 HB2 GLN 93 73.944 1.942 16.977 681 HB3 GLN 93 HB3 GLN 93 73.580 0.225 17.240 682 HG2 GLN 93 HG2 GLN 93 75.105 1.492 14.943 683 HG3 GLN 93 HG3 GLN 93 75.814 0.517 16.237 684 HE21 GLN 93 HE21 GLN 93 73.853 0.427 13.333 685 HE22 GLN 93 HE22 GLN 93 74.004 -1.275 13.071 686 H GLY 94 H GLY 94 70.783 -0.415 15.951 687 HA2 GLY 94 HA2 GLY 94 69.676 0.434 18.400 688 HA3 GLY 94 HA3 GLY 94 68.626 0.772 17.013 Start of MODEL 13 1 H GLU 2 H GLU 2 60.069 2.006 6.305 2 HA GLU 2 HA GLU 2 58.821 4.532 7.175 3 HB2 GLU 2 HB2 GLU 2 60.825 2.818 8.646 4 HB3 GLU 2 HB3 GLU 2 59.974 4.226 9.260 5 HG2 GLU 2 HG2 GLU 2 58.821 1.539 8.609 6 HG3 GLU 2 HG3 GLU 2 58.982 2.280 10.200 7 H LEU 3 H LEU 3 59.682 5.969 5.970 8 HA LEU 3 HA LEU 3 62.435 5.803 5.086 9 HB2 LEU 3 HB2 LEU 3 60.196 7.685 4.468 10 HB3 LEU 3 HB3 LEU 3 61.768 7.718 3.681 11 HG LEU 3 HG LEU 3 59.882 5.373 3.587 12 HD11 LEU 3 HD11 LEU 3 58.917 7.318 2.417 13 HD12 LEU 3 HD12 LEU 3 59.402 6.042 1.301 14 HD13 LEU 3 HD13 LEU 3 60.411 7.481 1.480 15 HD21 LEU 3 HD21 LEU 3 61.315 4.655 1.734 16 HD22 LEU 3 HD22 LEU 3 62.191 4.768 3.259 17 HD23 LEU 3 HD23 LEU 3 62.375 6.028 2.039 18 H LYS 4 H LYS 4 63.815 7.653 5.323 19 HA LYS 4 HA LYS 4 63.341 9.129 7.842 20 HB2 LYS 4 HB2 LYS 4 65.718 7.619 6.856 21 HB3 LYS 4 HB3 LYS 4 65.982 9.041 7.839 22 HG2 LYS 4 HG2 LYS 4 66.034 6.806 9.018 23 HG3 LYS 4 HG3 LYS 4 64.954 8.025 9.707 24 HD2 LYS 4 HD2 LYS 4 63.203 7.111 8.951 25 HD3 LYS 4 HD3 LYS 4 63.951 5.990 7.791 26 HE2 LYS 4 HE2 LYS 4 64.980 4.859 9.804 27 HE3 LYS 4 HE3 LYS 4 64.036 5.915 10.834 28 HZ1 LYS 4 HZ1 LYS 4 62.807 4.065 8.850 29 HZ2 LYS 4 HZ2 LYS 4 62.029 5.012 10.030 30 HZ3 LYS 4 HZ3 LYS 4 62.956 3.716 10.500 31 H ASN 5 H ASN 5 65.118 10.908 7.966 32 HA ASN 5 HA ASN 5 64.910 12.453 5.555 33 HB2 ASN 5 HB2 ASN 5 65.978 14.281 6.822 34 HB3 ASN 5 HB3 ASN 5 64.625 13.610 7.713 35 HD21 ASN 5 HD21 ASN 5 66.824 15.173 8.666 36 HD22 ASN 5 HD22 ASN 5 67.653 14.262 9.868 37 H SER 6 H SER 6 67.483 10.955 7.450 38 HA SER 6 HA SER 6 69.126 10.926 5.061 39 HB2 SER 6 HB2 SER 6 71.089 11.597 6.513 40 HB3 SER 6 HB3 SER 6 69.928 12.875 6.150 41 HG SER 6 HG SER 6 69.938 13.119 8.187 42 H ILE 7 H ILE 7 71.118 9.502 5.448 43 HA ILE 7 HA ILE 7 70.270 6.920 6.150 44 HB ILE 7 HB ILE 7 72.139 7.395 4.532 45 HG12 ILE 7 HG12 ILE 7 72.955 5.585 6.825 46 HG13 ILE 7 HG13 ILE 7 71.878 5.134 5.510 47 HG21 ILE 7 HG21 ILE 7 73.761 8.027 6.997 48 HG22 ILE 7 HG22 ILE 7 73.278 9.170 5.747 49 HG23 ILE 7 HG23 ILE 7 74.394 7.862 5.359 50 HD11 ILE 7 HD11 ILE 7 74.121 4.251 5.181 51 HD12 ILE 7 HD12 ILE 7 74.781 5.889 5.220 52 HD13 ILE 7 HD13 ILE 7 73.696 5.406 3.918 53 H SER 8 H SER 8 71.373 9.469 8.056 54 HA SER 8 HA SER 8 72.689 7.937 10.074 55 HB2 SER 8 HB2 SER 8 71.965 10.851 9.918 56 HB3 SER 8 HB3 SER 8 73.086 10.115 11.065 57 HG SER 8 HG SER 8 74.154 9.301 9.051 58 H ASP 9 H ASP 9 69.491 8.555 9.334 59 HA ASP 9 HA ASP 9 68.639 8.403 12.166 60 HB2 ASP 9 HB2 ASP 9 67.448 9.930 10.047 61 HB3 ASP 9 HB3 ASP 9 66.744 8.418 10.002 62 H TYR 10 H TYR 10 69.686 6.480 9.936 63 HA TYR 10 HA TYR 10 67.502 4.535 9.915 64 HB2 TYR 10 HB2 TYR 10 69.554 5.281 7.911 65 HB3 TYR 10 HB3 TYR 10 69.232 3.573 8.085 66 HD1 TYR 10 HD1 TYR 10 66.777 2.848 7.859 67 HD2 TYR 10 HD2 TYR 10 68.215 6.592 6.482 68 HE1 TYR 10 HE1 TYR 10 64.882 2.987 6.299 69 HE2 TYR 10 HE2 TYR 10 66.321 6.742 4.907 70 HH TYR 10 HH TYR 10 63.647 4.564 5.129 71 H THR 11 H THR 11 67.825 2.984 11.338 72 HA THR 11 HA THR 11 70.479 2.341 12.198 73 HB THR 11 HB THR 11 69.429 0.752 13.658 74 HG1 THR 11 HG1 THR 11 67.455 -0.095 13.310 75 HG21 THR 11 HG21 THR 11 68.870 3.005 14.353 76 HG22 THR 11 HG22 THR 11 67.506 1.936 14.672 77 HG23 THR 11 HG23 THR 11 67.471 3.015 13.282 78 H GLU 12 H GLU 12 71.219 -0.020 11.769 79 HA GLU 12 HA GLU 12 71.175 -0.393 9.016 80 HB2 GLU 12 HB2 GLU 12 72.182 -2.643 9.404 81 HB3 GLU 12 HB3 GLU 12 73.009 -1.337 10.235 82 HG2 GLU 12 HG2 GLU 12 72.013 -1.990 12.324 83 HG3 GLU 12 HG3 GLU 12 71.054 -3.232 11.517 84 H ALA 13 H ALA 13 69.194 -1.897 11.468 85 HA ALA 13 HA ALA 13 67.809 -3.619 9.655 86 HB1 ALA 13 HB1 ALA 13 66.933 -2.658 12.372 87 HB2 ALA 13 HB2 ALA 13 67.958 -4.063 12.068 88 HB3 ALA 13 HB3 ALA 13 66.289 -4.044 11.488 89 H GLU 14 H GLU 14 67.071 -0.330 10.877 90 HA GLU 14 HA GLU 14 64.516 -0.073 9.650 91 HB2 GLU 14 HB2 GLU 14 66.663 2.008 10.127 92 HB3 GLU 14 HB3 GLU 14 65.058 2.394 9.551 93 HG2 GLU 14 HG2 GLU 14 65.732 1.147 12.203 94 HG3 GLU 14 HG3 GLU 14 65.338 2.841 11.928 95 H PHE 15 H PHE 15 67.753 0.249 8.485 96 HA PHE 15 HA PHE 15 67.005 1.333 5.986 97 HB2 PHE 15 HB2 PHE 15 69.196 1.671 7.184 98 HB3 PHE 15 HB3 PHE 15 69.609 0.027 6.733 99 HD1 PHE 15 HD1 PHE 15 68.658 3.315 5.337 100 HD2 PHE 15 HD2 PHE 15 70.556 -0.417 4.689 101 HE1 PHE 15 HE1 PHE 15 69.546 4.141 3.190 102 HE2 PHE 15 HE2 PHE 15 71.446 0.409 2.543 103 HZ PHE 15 HZ PHE 15 70.930 2.685 1.817 104 H VAL 16 H VAL 16 67.948 -1.918 7.146 105 HA VAL 16 HA VAL 16 67.964 -3.139 4.673 106 HB VAL 16 HB VAL 16 67.771 -5.283 5.669 107 HG11 VAL 16 HG11 VAL 16 69.283 -3.501 7.445 108 HG12 VAL 16 HG12 VAL 16 69.841 -4.600 6.159 109 HG13 VAL 16 HG13 VAL 16 69.224 -5.238 7.674 110 HG21 VAL 16 HG21 VAL 16 65.806 -5.074 6.878 111 HG22 VAL 16 HG22 VAL 16 66.564 -4.008 8.062 112 HG23 VAL 16 HG23 VAL 16 67.058 -5.730 7.949 113 H GLN 17 H GLN 17 65.223 -2.318 6.778 114 HA GLN 17 HA GLN 17 63.154 -3.758 5.680 115 HB2 GLN 17 HB2 GLN 17 63.078 -2.585 7.786 116 HB3 GLN 17 HB3 GLN 17 63.398 -1.061 6.999 117 HG2 GLN 17 HG2 GLN 17 60.973 -2.569 6.304 118 HG3 GLN 17 HG3 GLN 17 61.065 -1.729 7.865 119 HE21 GLN 17 HE21 GLN 17 60.706 -1.333 4.413 120 HE22 GLN 17 HE22 GLN 17 60.454 0.372 4.403 121 H LEU 18 H LEU 18 64.377 -0.564 4.940 122 HA LEU 18 HA LEU 18 62.583 0.062 2.868 123 HB2 LEU 18 HB2 LEU 18 63.894 1.658 4.111 124 HB3 LEU 18 HB3 LEU 18 65.371 1.087 3.549 125 HG LEU 18 HG LEU 18 64.563 3.284 2.512 126 HD11 LEU 18 HD11 LEU 18 65.464 2.776 0.312 127 HD12 LEU 18 HD12 LEU 18 65.327 1.053 0.665 128 HD13 LEU 18 HD13 LEU 18 66.442 2.057 1.597 129 HD21 LEU 18 HD21 LEU 18 62.830 1.387 0.939 130 HD22 LEU 18 HD22 LEU 18 63.111 3.087 0.560 131 HD23 LEU 18 HD23 LEU 18 62.271 2.644 2.045 132 H LEU 19 H LEU 19 65.672 -1.331 2.952 133 HA LEU 19 HA LEU 19 66.195 -1.664 0.224 134 HB2 LEU 19 HB2 LEU 19 66.917 -3.124 2.624 135 HB3 LEU 19 HB3 LEU 19 67.737 -3.487 1.073 136 HG LEU 19 HG LEU 19 67.843 -1.132 2.925 137 HD11 LEU 19 HD11 LEU 19 69.426 -2.871 3.268 138 HD12 LEU 19 HD12 LEU 19 70.211 -1.407 2.678 139 HD13 LEU 19 HD13 LEU 19 69.941 -2.765 1.589 140 HD21 LEU 19 HD21 LEU 19 69.113 0.080 1.277 141 HD22 LEU 19 HD22 LEU 19 67.414 -0.146 0.852 142 HD23 LEU 19 HD23 LEU 19 68.670 -1.132 0.055 143 H LYS 20 H LYS 20 64.619 -3.831 2.517 144 HA LYS 20 HA LYS 20 64.275 -5.964 0.751 145 HB2 LYS 20 HB2 LYS 20 62.677 -5.187 3.189 146 HB3 LYS 20 HB3 LYS 20 62.481 -6.741 2.395 147 HG2 LYS 20 HG2 LYS 20 65.051 -6.938 2.781 148 HG3 LYS 20 HG3 LYS 20 64.793 -5.655 3.921 149 HD2 LYS 20 HD2 LYS 20 63.206 -6.973 5.200 150 HD3 LYS 20 HD3 LYS 20 63.346 -8.304 4.047 151 HE2 LYS 20 HE2 LYS 20 65.782 -8.433 4.561 152 HE3 LYS 20 HE3 LYS 20 65.557 -7.200 5.789 153 HZ1 LYS 20 HZ1 LYS 20 65.637 -9.424 6.702 154 HZ2 LYS 20 HZ2 LYS 20 64.300 -9.903 5.805 155 HZ3 LYS 20 HZ3 LYS 20 64.137 -8.721 7.020 156 H GLU 21 H GLU 21 62.366 -3.138 1.452 157 HA GLU 21 HA GLU 21 60.156 -3.864 -0.101 158 HB2 GLU 21 HB2 GLU 21 61.112 -1.181 0.845 159 HB3 GLU 21 HB3 GLU 21 59.612 -1.374 -0.038 160 HG2 GLU 21 HG2 GLU 21 60.322 -2.562 2.638 161 HG3 GLU 21 HG3 GLU 21 59.144 -1.293 2.318 162 H ILE 22 H ILE 22 63.152 -2.250 -0.873 163 HA ILE 22 HA ILE 22 62.415 -1.428 -3.490 164 HB ILE 22 HB ILE 22 65.231 -2.244 -2.710 165 HG12 ILE 22 HG12 ILE 22 63.881 0.442 -2.317 166 HG13 ILE 22 HG13 ILE 22 64.424 -0.638 -1.050 167 HG21 ILE 22 HG21 ILE 22 65.853 -0.599 -4.445 168 HG22 ILE 22 HG22 ILE 22 64.144 -0.296 -4.744 169 HG23 ILE 22 HG23 ILE 22 64.827 -1.884 -5.088 170 HD11 ILE 22 HD11 ILE 22 66.739 -0.333 -1.738 171 HD12 ILE 22 HD12 ILE 22 65.979 1.217 -1.371 172 HD13 ILE 22 HD13 ILE 22 66.215 0.725 -3.046 173 H GLU 23 H GLU 23 63.869 -4.373 -2.212 174 HA GLU 23 HA GLU 23 64.530 -5.740 -4.569 175 HB2 GLU 23 HB2 GLU 23 63.393 -6.732 -2.006 176 HB3 GLU 23 HB3 GLU 23 63.986 -7.812 -3.230 177 HG2 GLU 23 HG2 GLU 23 66.227 -6.624 -2.933 178 HG3 GLU 23 HG3 GLU 23 65.483 -5.817 -1.550 179 H LYS 24 H LYS 24 61.576 -5.392 -2.862 180 HA LYS 24 HA LYS 24 60.035 -7.386 -4.080 181 HB2 LYS 24 HB2 LYS 24 59.575 -6.468 -1.977 182 HB3 LYS 24 HB3 LYS 24 59.324 -4.865 -2.644 183 HG2 LYS 24 HG2 LYS 24 57.408 -5.862 -3.995 184 HG3 LYS 24 HG3 LYS 24 57.573 -7.298 -2.985 185 HD2 LYS 24 HD2 LYS 24 57.022 -4.508 -2.027 186 HD3 LYS 24 HD3 LYS 24 55.829 -5.796 -2.183 187 HE2 LYS 24 HE2 LYS 24 57.021 -7.137 -0.503 188 HE3 LYS 24 HE3 LYS 24 58.271 -5.900 -0.401 189 HZ1 LYS 24 HZ1 LYS 24 56.663 -5.865 1.418 190 HZ2 LYS 24 HZ2 LYS 24 55.430 -5.421 0.359 191 HZ3 LYS 24 HZ3 LYS 24 56.771 -4.405 0.624 192 H GLU 25 H GLU 25 60.149 -3.830 -4.661 193 HA GLU 25 HA GLU 25 58.468 -4.429 -6.923 194 HB2 GLU 25 HB2 GLU 25 58.050 -1.920 -6.992 195 HB3 GLU 25 HB3 GLU 25 57.368 -2.779 -5.564 196 HG2 GLU 25 HG2 GLU 25 58.229 -0.843 -4.758 197 HG3 GLU 25 HG3 GLU 25 59.688 -1.851 -4.664 198 H ASN 26 H ASN 26 61.693 -3.736 -6.363 199 HA ASN 26 HA ASN 26 62.419 -2.350 -8.684 200 HB2 ASN 26 HB2 ASN 26 64.018 -2.792 -6.886 201 HB3 ASN 26 HB3 ASN 26 63.954 -4.514 -7.220 202 HD21 ASN 26 HD21 ASN 26 66.140 -4.651 -7.582 203 HD22 ASN 26 HD22 ASN 26 66.893 -3.992 -8.997 204 H VAL 27 H VAL 27 61.773 -5.760 -8.226 205 HA VAL 27 HA VAL 27 62.572 -6.438 -10.892 206 HB VAL 27 HB VAL 27 61.596 -8.670 -10.474 207 HG11 VAL 27 HG11 VAL 27 63.863 -8.237 -9.740 208 HG12 VAL 27 HG12 VAL 27 63.054 -9.334 -8.623 209 HG13 VAL 27 HG13 VAL 27 63.267 -7.637 -8.192 210 HG21 VAL 27 HG21 VAL 27 59.657 -8.020 -9.130 211 HG22 VAL 27 HG22 VAL 27 60.719 -7.525 -7.815 212 HG23 VAL 27 HG23 VAL 27 60.626 -9.224 -8.282 213 H ALA 28 H ALA 28 59.796 -5.168 -9.494 214 HA ALA 28 HA ALA 28 57.986 -5.959 -11.627 215 HB1 ALA 28 HB1 ALA 28 56.311 -4.701 -10.313 216 HB2 ALA 28 HB2 ALA 28 57.578 -4.175 -9.209 217 HB3 ALA 28 HB3 ALA 28 57.160 -5.870 -9.303 218 H ALA 29 H ALA 29 59.666 -3.188 -10.364 219 HA ALA 29 HA ALA 29 60.156 -1.164 -11.005 220 HB1 ALA 29 HB1 ALA 29 61.158 -2.236 -12.995 221 HB2 ALA 29 HB2 ALA 29 60.505 -0.641 -13.370 222 HB3 ALA 29 HB3 ALA 29 59.614 -2.091 -13.835 223 H THR 30 H THR 30 58.316 -0.540 -9.802 224 HA THR 30 HA THR 30 55.813 -0.129 -11.148 225 HB THR 30 HB THR 30 55.073 0.864 -9.059 226 HG1 THR 30 HG1 THR 30 57.624 0.586 -7.842 227 HG21 THR 30 HG21 THR 30 55.632 -0.972 -7.486 228 HG22 THR 30 HG22 THR 30 56.904 -1.478 -8.610 229 HG23 THR 30 HG23 THR 30 55.215 -1.570 -9.099 230 H ASP 31 H ASP 31 58.693 1.497 -10.640 231 HA ASP 31 HA ASP 31 59.593 3.450 -11.231 232 HB2 ASP 31 HB2 ASP 31 58.582 3.382 -13.387 233 HB3 ASP 31 HB3 ASP 31 57.015 3.821 -12.707 234 H ASP 32 H ASP 32 56.317 3.848 -10.187 235 HA ASP 32 HA ASP 32 56.703 6.448 -9.168 236 HB2 ASP 32 HB2 ASP 32 54.457 5.650 -9.653 237 HB3 ASP 32 HB3 ASP 32 54.647 4.394 -8.437 238 H VAL 33 H VAL 33 56.708 3.402 -7.375 239 HA VAL 33 HA VAL 33 57.783 5.029 -5.201 240 HB VAL 33 HB VAL 33 55.981 3.501 -4.639 241 HG11 VAL 33 HG11 VAL 33 56.374 1.643 -6.083 242 HG12 VAL 33 HG12 VAL 33 56.365 1.073 -4.410 243 HG13 VAL 33 HG13 VAL 33 57.894 1.289 -5.266 244 HG21 VAL 33 HG21 VAL 33 58.547 2.848 -3.223 245 HG22 VAL 33 HG22 VAL 33 56.937 2.521 -2.589 246 HG23 VAL 33 HG23 VAL 33 57.453 4.184 -2.869 247 H LEU 34 H LEU 34 58.585 2.759 -7.490 248 HA LEU 34 HA LEU 34 61.097 1.775 -6.727 249 HB2 LEU 34 HB2 LEU 34 59.789 0.971 -8.556 250 HB3 LEU 34 HB3 LEU 34 59.810 2.420 -9.378 251 HG LEU 34 HG LEU 34 61.187 0.625 -10.413 252 HD11 LEU 34 HD11 LEU 34 61.641 2.839 -11.040 253 HD12 LEU 34 HD12 LEU 34 63.151 1.925 -10.935 254 HD13 LEU 34 HD13 LEU 34 62.709 3.066 -9.655 255 HD21 LEU 34 HD21 LEU 34 63.328 -0.003 -9.457 256 HD22 LEU 34 HD22 LEU 34 62.005 -0.400 -8.348 257 HD23 LEU 34 HD23 LEU 34 63.010 1.014 -8.054 258 H ASP 35 H ASP 35 60.273 4.727 -8.470 259 HA ASP 35 HA ASP 35 63.006 5.648 -8.639 260 HB2 ASP 35 HB2 ASP 35 60.974 6.637 -9.920 261 HB3 ASP 35 HB3 ASP 35 60.643 7.402 -8.373 262 H VAL 36 H VAL 36 60.526 6.095 -6.341 263 HA VAL 36 HA VAL 36 61.788 8.030 -4.732 264 HB VAL 36 HB VAL 36 60.037 5.774 -3.771 265 HG11 VAL 36 HG11 VAL 36 61.185 7.007 -2.114 266 HG12 VAL 36 HG12 VAL 36 59.418 7.359 -2.096 267 HG13 VAL 36 HG13 VAL 36 60.586 8.508 -2.842 268 HG21 VAL 36 HG21 VAL 36 58.276 7.268 -4.004 269 HG22 VAL 36 HG22 VAL 36 59.076 6.768 -5.522 270 HG23 VAL 36 HG23 VAL 36 59.362 8.419 -4.853 271 H LEU 37 H LEU 37 61.666 4.534 -4.539 272 HA LEU 37 HA LEU 37 63.072 4.364 -2.131 273 HB2 LEU 37 HB2 LEU 37 62.991 2.232 -4.222 274 HB3 LEU 37 HB3 LEU 37 63.248 2.217 -2.483 275 HG LEU 37 HG LEU 37 60.583 2.898 -3.650 276 HD11 LEU 37 HD11 LEU 37 61.085 0.567 -4.058 277 HD12 LEU 37 HD12 LEU 37 59.856 0.727 -2.804 278 HD13 LEU 37 HD13 LEU 37 61.520 0.348 -2.362 279 HD21 LEU 37 HD21 LEU 37 61.482 2.390 -0.813 280 HD22 LEU 37 HD22 LEU 37 59.819 2.664 -1.329 281 HD23 LEU 37 HD23 LEU 37 61.012 3.951 -1.491 282 H LEU 38 H LEU 38 63.943 4.035 -5.466 283 HA LEU 38 HA LEU 38 66.574 3.249 -5.057 284 HB2 LEU 38 HB2 LEU 38 65.076 4.510 -7.280 285 HB3 LEU 38 HB3 LEU 38 66.787 4.161 -7.489 286 HG LEU 38 HG LEU 38 64.366 2.432 -7.187 287 HD11 LEU 38 HD11 LEU 38 65.218 1.377 -9.210 288 HD12 LEU 38 HD12 LEU 38 66.556 2.533 -9.185 289 HD13 LEU 38 HD13 LEU 38 64.902 3.108 -9.377 290 HD21 LEU 38 HD21 LEU 38 65.894 1.390 -5.642 291 HD22 LEU 38 HD22 LEU 38 67.200 1.433 -6.814 292 HD23 LEU 38 HD23 LEU 38 65.796 0.408 -7.097 293 H GLU 39 H GLU 39 65.221 6.487 -5.704 294 HA GLU 39 HA GLU 39 67.819 7.601 -5.489 295 HB2 GLU 39 HB2 GLU 39 66.788 9.811 -5.630 296 HB3 GLU 39 HB3 GLU 39 66.268 8.736 -6.902 297 HG2 GLU 39 HG2 GLU 39 64.147 8.516 -6.074 298 HG3 GLU 39 HG3 GLU 39 64.538 9.115 -4.478 299 H HIS 40 H HIS 40 65.170 7.226 -3.255 300 HA HIS 40 HA HIS 40 66.098 8.916 -1.210 301 HB2 HIS 40 HB2 HIS 40 63.851 7.854 -1.359 302 HB3 HIS 40 HB3 HIS 40 64.494 6.320 -0.903 303 HD1 HIS 40 HD1 HIS 40 62.831 9.164 0.517 304 HD2 HIS 40 HD2 HIS 40 65.838 6.599 1.839 305 HE1 HIS 40 HE1 HIS 40 62.942 9.431 2.999 306 H PHE 41 H PHE 41 66.676 5.545 -1.893 307 HA PHE 41 HA PHE 41 68.391 4.949 0.218 308 HB2 PHE 41 HB2 PHE 41 67.447 3.156 -0.939 309 HB3 PHE 41 HB3 PHE 41 67.834 3.857 -2.498 310 HD1 PHE 41 HD1 PHE 41 69.296 2.239 0.479 311 HD2 PHE 41 HD2 PHE 41 69.772 3.200 -3.617 312 HE1 PHE 41 HE1 PHE 41 71.296 0.796 0.374 313 HE2 PHE 41 HE2 PHE 41 71.746 1.781 -3.729 314 HZ PHE 41 HZ PHE 41 72.521 0.569 -1.739 315 H VAL 42 H VAL 42 69.211 5.777 -3.152 316 HA VAL 42 HA VAL 42 71.957 5.847 -2.509 317 HB VAL 42 HB VAL 42 71.243 5.198 -4.696 318 HG11 VAL 42 HG11 VAL 42 69.429 6.501 -5.073 319 HG12 VAL 42 HG12 VAL 42 70.605 6.614 -6.378 320 HG13 VAL 42 HG13 VAL 42 70.417 7.982 -5.236 321 HG21 VAL 42 HG21 VAL 42 73.522 5.945 -4.497 322 HG22 VAL 42 HG22 VAL 42 73.025 7.609 -4.796 323 HG23 VAL 42 HG23 VAL 42 72.878 6.401 -6.074 324 H LYS 43 H LYS 43 69.641 8.328 -2.540 325 HA LYS 43 HA LYS 43 71.560 10.444 -2.439 326 HB2 LYS 43 HB2 LYS 43 69.846 11.941 -1.981 327 HB3 LYS 43 HB3 LYS 43 68.947 10.632 -2.732 328 HG2 LYS 43 HG2 LYS 43 68.256 9.835 -0.439 329 HG3 LYS 43 HG3 LYS 43 69.226 11.131 0.216 330 HD2 LYS 43 HD2 LYS 43 67.867 12.788 -1.003 331 HD3 LYS 43 HD3 LYS 43 66.795 11.481 -1.507 332 HE2 LYS 43 HE2 LYS 43 67.420 12.241 1.342 333 HE3 LYS 43 HE3 LYS 43 65.950 12.688 0.478 334 HZ1 LYS 43 HZ1 LYS 43 65.617 10.802 1.902 335 HZ2 LYS 43 HZ2 LYS 43 66.804 9.899 1.098 336 HZ3 LYS 43 HZ3 LYS 43 65.388 10.381 0.297 337 H ILE 44 H ILE 44 70.378 8.324 0.030 338 HA ILE 44 HA ILE 44 71.652 9.985 2.035 339 HB ILE 44 HB ILE 44 70.706 8.406 3.719 340 HG12 ILE 44 HG12 ILE 44 69.385 7.167 1.300 341 HG13 ILE 44 HG13 ILE 44 70.601 6.382 2.285 342 HG21 ILE 44 HG21 ILE 44 69.532 10.440 3.065 343 HG22 ILE 44 HG22 ILE 44 68.412 9.142 3.474 344 HG23 ILE 44 HG23 ILE 44 68.705 9.550 1.786 345 HD11 ILE 44 HD11 ILE 44 68.318 5.619 2.756 346 HD12 ILE 44 HD12 ILE 44 67.891 7.261 3.230 347 HD13 ILE 44 HD13 ILE 44 69.082 6.357 4.163 348 H THR 45 H THR 45 72.171 6.944 0.427 349 HA THR 45 HA THR 45 74.400 6.273 2.122 350 HB THR 45 HB THR 45 74.808 4.503 0.398 351 HG1 THR 45 HG1 THR 45 72.309 5.061 -0.727 352 HG21 THR 45 HG21 THR 45 71.995 4.702 1.464 353 HG22 THR 45 HG22 THR 45 73.392 4.052 2.327 354 HG23 THR 45 HG23 THR 45 72.775 3.230 0.894 355 H GLU 46 H GLU 46 73.796 7.747 -0.968 356 HA GLU 46 HA GLU 46 74.930 8.782 -2.488 357 HB2 GLU 46 HB2 GLU 46 76.645 9.361 -0.124 358 HB3 GLU 46 HB3 GLU 46 76.972 10.103 -1.706 359 HG2 GLU 46 HG2 GLU 46 74.685 11.031 -1.630 360 HG3 GLU 46 HG3 GLU 46 74.478 10.313 -0.046 361 H HIS 47 H HIS 47 75.316 6.051 -2.042 362 HA HIS 47 HA HIS 47 77.990 5.368 -2.724 363 HB2 HIS 47 HB2 HIS 47 76.256 3.838 -1.600 364 HB3 HIS 47 HB3 HIS 47 75.499 3.689 -3.181 365 HD1 HIS 47 HD1 HIS 47 76.779 2.167 -4.953 366 HD2 HIS 47 HD2 HIS 47 78.596 2.473 -1.241 367 HE1 HIS 47 HE1 HIS 47 78.712 0.568 -4.977 368 HA PRO 48 HA PRO 48 77.519 6.810 -6.971 369 HB2 PRO 48 HB2 PRO 48 79.578 4.835 -7.610 370 HB3 PRO 48 HB3 PRO 48 79.588 6.591 -7.830 371 HG2 PRO 48 HG2 PRO 48 81.009 5.240 -6.058 372 HG3 PRO 48 HG3 PRO 48 80.389 6.870 -5.633 373 HD2 PRO 48 HD2 PRO 48 79.455 4.139 -4.845 374 HD3 PRO 48 HD3 PRO 48 79.481 5.617 -3.886 375 H ASP 49 H ASP 49 77.149 3.642 -6.017 376 HA ASP 49 HA ASP 49 76.330 2.942 -8.628 377 HB2 ASP 49 HB2 ASP 49 77.751 1.087 -6.689 378 HB3 ASP 49 HB3 ASP 49 77.058 0.548 -8.196 379 H GLY 50 H GLY 50 74.945 4.032 -6.408 380 HA2 GLY 50 HA2 GLY 50 73.690 2.482 -4.428 381 HA3 GLY 50 HA3 GLY 50 72.978 3.849 -5.259 382 H THR 51 H THR 51 72.557 2.971 -7.598 383 HA THR 51 HA THR 51 70.290 1.302 -6.890 384 HB THR 51 HB THR 51 70.757 1.922 -9.759 385 HG1 THR 51 HG1 THR 51 69.939 4.105 -9.251 386 HG21 THR 51 HG21 THR 51 68.415 2.386 -7.915 387 HG22 THR 51 HG22 THR 51 68.732 0.858 -8.682 388 HG23 THR 51 HG23 THR 51 68.392 2.285 -9.677 389 H ALA 52 H ALA 52 73.270 1.000 -8.637 390 HA ALA 52 HA ALA 52 72.886 -1.556 -9.785 391 HB1 ALA 52 HB1 ALA 52 75.436 -0.359 -8.764 392 HB2 ALA 52 HB2 ALA 52 74.746 -0.012 -10.347 393 HB3 ALA 52 HB3 ALA 52 75.282 -1.652 -9.954 394 H LEU 53 H LEU 53 73.892 -0.558 -6.585 395 HA LEU 53 HA LEU 53 74.603 -3.083 -5.657 396 HB2 LEU 53 HB2 LEU 53 73.420 -0.795 -4.142 397 HB3 LEU 53 HB3 LEU 53 73.920 -2.287 -3.379 398 HG LEU 53 HG LEU 53 75.671 -0.276 -4.777 399 HD11 LEU 53 HD11 LEU 53 75.522 -1.259 -1.943 400 HD12 LEU 53 HD12 LEU 53 74.958 0.300 -2.547 401 HD13 LEU 53 HD13 LEU 53 76.676 -0.087 -2.579 402 HD21 LEU 53 HD21 LEU 53 76.502 -2.506 -5.316 403 HD22 LEU 53 HD22 LEU 53 76.400 -2.970 -3.618 404 HD23 LEU 53 HD23 LEU 53 77.551 -1.735 -4.127 405 H ILE 54 H ILE 54 71.408 -1.625 -5.799 406 HA ILE 54 HA ILE 54 70.269 -3.823 -4.361 407 HB ILE 54 HB ILE 54 68.656 -2.115 -6.313 408 HG12 ILE 54 HG12 ILE 54 67.749 -1.217 -3.990 409 HG13 ILE 54 HG13 ILE 54 69.336 -1.721 -3.431 410 HG21 ILE 54 HG21 ILE 54 66.685 -2.890 -5.092 411 HG22 ILE 54 HG22 ILE 54 67.714 -3.934 -4.113 412 HG23 ILE 54 HG23 ILE 54 67.570 -4.217 -5.847 413 HD11 ILE 54 HD11 ILE 54 69.293 0.618 -4.004 414 HD12 ILE 54 HD12 ILE 54 68.791 0.217 -5.647 415 HD13 ILE 54 HD13 ILE 54 70.382 -0.274 -5.060 416 H TYR 55 H TYR 55 70.739 -3.067 -7.683 417 HA TYR 55 HA TYR 55 69.406 -5.223 -8.838 418 HB2 TYR 55 HB2 TYR 55 71.468 -3.309 -9.714 419 HB3 TYR 55 HB3 TYR 55 71.171 -4.694 -10.730 420 HD1 TYR 55 HD1 TYR 55 68.722 -5.041 -11.499 421 HD2 TYR 55 HD2 TYR 55 70.139 -1.414 -9.813 422 HE1 TYR 55 HE1 TYR 55 66.829 -3.842 -12.498 423 HE2 TYR 55 HE2 TYR 55 68.259 -0.203 -10.793 424 HH TYR 55 HH TYR 55 65.569 -1.784 -12.067 425 H GLU 56 H GLU 56 72.895 -4.819 -8.104 426 HA GLU 56 HA GLU 56 73.479 -7.419 -8.981 427 HB2 GLU 56 HB2 GLU 56 75.674 -7.182 -7.799 428 HB3 GLU 56 HB3 GLU 56 75.335 -5.946 -8.999 429 HG2 GLU 56 HG2 GLU 56 74.941 -4.339 -7.373 430 HG3 GLU 56 HG3 GLU 56 74.891 -5.490 -6.054 431 H ALA 57 H ALA 57 72.594 -6.143 -5.846 432 HA ALA 57 HA ALA 57 73.163 -8.388 -4.300 433 HB1 ALA 57 HB1 ALA 57 71.482 -7.583 -2.756 434 HB2 ALA 57 HB2 ALA 57 70.798 -6.553 -4.017 435 HB3 ALA 57 HB3 ALA 57 72.418 -6.230 -3.400 436 H ALA 58 H ALA 58 70.379 -7.630 -6.293 437 HA ALA 58 HA ALA 58 68.793 -9.832 -5.633 438 HB1 ALA 58 HB1 ALA 58 67.941 -7.914 -6.907 439 HB2 ALA 58 HB2 ALA 58 67.620 -9.433 -7.746 440 HB3 ALA 58 HB3 ALA 58 68.937 -8.390 -8.283 441 H ALA 59 H ALA 59 71.242 -9.463 -8.157 442 HA ALA 59 HA ALA 59 70.948 -12.108 -9.184 443 HB1 ALA 59 HB1 ALA 59 71.927 -10.302 -10.522 444 HB2 ALA 59 HB2 ALA 59 73.054 -11.654 -10.373 445 HB3 ALA 59 HB3 ALA 59 73.280 -10.201 -9.398 446 H ARG 60 H ARG 60 73.136 -10.587 -6.908 447 HA ARG 60 HA ARG 60 74.779 -12.771 -6.352 448 HB2 ARG 60 HB2 ARG 60 74.074 -10.335 -4.707 449 HB3 ARG 60 HB3 ARG 60 75.287 -11.505 -4.194 450 HG2 ARG 60 HG2 ARG 60 76.679 -10.986 -6.062 451 HG3 ARG 60 HG3 ARG 60 75.397 -10.061 -6.832 452 HD2 ARG 60 HD2 ARG 60 77.027 -8.545 -5.895 453 HD3 ARG 60 HD3 ARG 60 75.522 -8.409 -5.002 454 HE ARG 60 HE ARG 60 77.082 -10.236 -3.663 455 HH11 ARG 60 HH11 ARG 60 77.412 -6.767 -4.557 456 HH12 ARG 60 HH12 ARG 60 78.258 -6.373 -3.136 457 HH21 ARG 60 HH21 ARG 60 78.294 -9.592 -1.709 458 HH22 ARG 60 HH22 ARG 60 78.756 -7.965 -1.486 459 H ALA 61 H ALA 61 71.692 -11.822 -4.937 460 HA ALA 61 HA ALA 61 71.705 -13.991 -3.047 461 HB1 ALA 61 HB1 ALA 61 69.405 -12.262 -3.956 462 HB2 ALA 61 HB2 ALA 61 70.477 -11.908 -2.596 463 HB3 ALA 61 HB3 ALA 61 69.423 -13.320 -2.543 464 H ALA 62 H ALA 62 70.271 -13.447 -6.220 465 HA ALA 62 HA ALA 62 68.598 -15.709 -6.159 466 HB1 ALA 62 HB1 ALA 62 68.317 -15.366 -8.529 467 HB2 ALA 62 HB2 ALA 62 69.727 -14.310 -8.565 468 HB3 ALA 62 HB3 ALA 62 68.285 -13.816 -7.686 469 H ALA 63 H ALA 63 71.790 -15.241 -7.613 470 HA ALA 63 HA ALA 63 71.829 -18.078 -8.293 471 HB1 ALA 63 HB1 ALA 63 73.765 -15.887 -9.006 472 HB2 ALA 63 HB2 ALA 63 72.430 -16.452 -10.009 473 HB3 ALA 63 HB3 ALA 63 73.772 -17.534 -9.638 474 H ASN 64 H ASN 64 72.840 -16.068 -5.770 475 HA ASN 64 HA ASN 64 74.515 -15.892 -4.440 476 HB2 ASN 64 HB2 ASN 64 73.751 -18.783 -3.995 477 HB3 ASN 64 HB3 ASN 64 74.906 -17.801 -3.097 478 HD21 ASN 64 HD21 ASN 64 73.600 -15.385 -2.925 479 HD22 ASN 64 HD22 ASN 64 72.221 -15.645 -1.916 480 HA PRO 65 HA PRO 65 78.250 -17.377 -6.624 481 HB2 PRO 65 HB2 PRO 65 78.947 -14.525 -6.249 482 HB3 PRO 65 HB3 PRO 65 79.070 -15.507 -7.711 483 HG2 PRO 65 HG2 PRO 65 77.231 -13.580 -7.504 484 HG3 PRO 65 HG3 PRO 65 76.871 -15.107 -8.329 485 HD2 PRO 65 HD2 PRO 65 76.147 -14.242 -5.555 486 HD3 PRO 65 HD3 PRO 65 75.144 -15.073 -6.769 487 H GLY 66 H GLY 66 77.288 -15.277 -4.091 488 HA2 GLY 66 HA2 GLY 66 78.852 -16.625 -2.138 489 HA3 GLY 66 HA3 GLY 66 79.209 -14.904 -2.360 490 H GLY 67 H GLY 67 77.821 -16.320 -0.126 491 HA2 GLY 67 HA2 GLY 67 75.123 -15.340 -0.265 492 HA3 GLY 67 HA3 GLY 67 75.924 -15.950 1.183 493 H ASP 68 H ASP 68 78.164 -14.134 0.494 494 HA ASP 68 HA ASP 68 77.612 -11.901 2.117 495 HB2 ASP 68 HB2 ASP 68 79.883 -12.817 1.676 496 HB3 ASP 68 HB3 ASP 68 79.765 -12.236 0.024 497 H GLY 69 H GLY 69 76.209 -10.388 1.561 498 HA2 GLY 69 HA2 GLY 69 75.529 -8.470 0.431 499 HA3 GLY 69 HA3 GLY 69 76.591 -8.906 -0.897 500 H GLY 70 H GLY 70 74.804 -11.548 -0.053 501 HA2 GLY 70 HA2 GLY 70 73.162 -11.233 -2.405 502 HA3 GLY 70 HA3 GLY 70 73.326 -12.689 -1.430 503 H GLY 71 H GLY 71 72.025 -9.372 -1.233 504 HA2 GLY 71 HA2 GLY 71 69.538 -9.676 -0.941 505 HA3 GLY 71 HA3 GLY 71 70.042 -10.397 0.586 506 HA PRO 72 HA PRO 72 69.219 -5.787 0.873 507 HB2 PRO 72 HB2 PRO 72 67.520 -6.029 3.006 508 HB3 PRO 72 HB3 PRO 72 67.001 -6.072 1.317 509 HG2 PRO 72 HG2 PRO 72 67.486 -8.341 3.205 510 HG3 PRO 72 HG3 PRO 72 66.212 -8.155 1.989 511 HD2 PRO 72 HD2 PRO 72 68.369 -9.689 1.615 512 HD3 PRO 72 HD3 PRO 72 67.595 -8.861 0.266 513 H GLU 73 H GLU 73 69.662 -8.146 3.438 514 HA GLU 73 HA GLU 73 70.919 -6.222 5.231 515 HB2 GLU 73 HB2 GLU 73 70.420 -9.198 5.569 516 HB3 GLU 73 HB3 GLU 73 70.880 -8.057 6.827 517 HG2 GLU 73 HG2 GLU 73 68.796 -6.863 6.577 518 HG3 GLU 73 HG3 GLU 73 68.323 -7.913 5.252 519 H GLY 74 H GLY 74 71.923 -7.869 2.638 520 HA2 GLY 74 HA2 GLY 74 74.545 -7.859 3.820 521 HA3 GLY 74 HA3 GLY 74 74.211 -8.780 2.303 522 H ILE 75 H ILE 75 72.769 -6.408 1.184 523 HA ILE 75 HA ILE 75 74.972 -4.901 0.277 524 HB ILE 75 HB ILE 75 73.190 -3.128 -0.333 525 HG12 ILE 75 HG12 ILE 75 71.368 -5.490 0.021 526 HG13 ILE 75 HG13 ILE 75 71.527 -4.226 1.228 527 HG21 ILE 75 HG21 ILE 75 73.280 -5.841 -1.582 528 HG22 ILE 75 HG22 ILE 75 74.316 -4.450 -1.939 529 HG23 ILE 75 HG23 ILE 75 72.597 -4.396 -2.333 530 HD11 ILE 75 HD11 ILE 75 70.779 -2.615 -0.297 531 HD12 ILE 75 HD12 ILE 75 69.609 -3.928 -0.130 532 HD13 ILE 75 HD13 ILE 75 70.615 -3.814 -1.603 533 H VAL 76 H VAL 76 73.034 -4.560 3.151 534 HA VAL 76 HA VAL 76 73.609 -1.955 3.665 535 HB VAL 76 HB VAL 76 73.138 -2.562 5.904 536 HG11 VAL 76 HG11 VAL 76 71.178 -3.865 4.172 537 HG12 VAL 76 HG12 VAL 76 71.420 -2.143 4.345 538 HG13 VAL 76 HG13 VAL 76 70.913 -3.083 5.744 539 HG21 VAL 76 HG21 VAL 76 74.187 -4.664 6.191 540 HG22 VAL 76 HG22 VAL 76 73.053 -5.401 5.059 541 HG23 VAL 76 HG23 VAL 76 72.477 -4.785 6.610 542 H LYS 77 H LYS 77 75.312 -4.868 4.290 543 HA LYS 77 HA LYS 77 77.540 -3.859 5.664 544 HB2 LYS 77 HB2 LYS 77 77.124 -6.211 5.671 545 HB3 LYS 77 HB3 LYS 77 77.140 -6.277 3.926 546 HG2 LYS 77 HG2 LYS 77 79.518 -5.941 3.879 547 HG3 LYS 77 HG3 LYS 77 79.549 -5.692 5.629 548 HD2 LYS 77 HD2 LYS 77 79.030 -7.913 6.083 549 HD3 LYS 77 HD3 LYS 77 78.413 -8.196 4.460 550 HE2 LYS 77 HE2 LYS 77 80.565 -9.292 4.810 551 HE3 LYS 77 HE3 LYS 77 80.633 -8.054 3.563 552 HZ1 LYS 77 HZ1 LYS 77 81.745 -6.588 5.019 553 HZ2 LYS 77 HZ2 LYS 77 82.549 -8.044 5.104 554 HZ3 LYS 77 HZ3 LYS 77 81.513 -7.593 6.353 555 H GLU 78 H GLU 78 76.913 -4.377 2.237 556 HA GLU 78 HA GLU 78 79.340 -3.546 1.094 557 HB2 GLU 78 HB2 GLU 78 76.504 -3.139 0.192 558 HB3 GLU 78 HB3 GLU 78 77.826 -2.877 -0.888 559 HG2 GLU 78 HG2 GLU 78 77.054 -5.508 0.409 560 HG3 GLU 78 HG3 GLU 78 76.610 -5.016 -1.219 561 H ILE 79 H ILE 79 76.463 -1.754 1.862 562 HA ILE 79 HA ILE 79 77.295 0.855 1.217 563 HB ILE 79 HB ILE 79 75.228 -0.081 3.207 564 HG12 ILE 79 HG12 ILE 79 74.740 -0.585 0.849 565 HG13 ILE 79 HG13 ILE 79 73.595 0.576 1.519 566 HG21 ILE 79 HG21 ILE 79 75.955 2.120 3.913 567 HG22 ILE 79 HG22 ILE 79 74.320 2.185 3.263 568 HG23 ILE 79 HG23 ILE 79 75.678 2.754 2.288 569 HD11 ILE 79 HD11 ILE 79 74.201 1.208 -0.703 570 HD12 ILE 79 HD12 ILE 79 75.915 1.158 -0.297 571 HD13 ILE 79 HD13 ILE 79 74.869 2.379 0.437 572 H LYS 80 H LYS 80 77.395 -0.850 4.330 573 HA LYS 80 HA LYS 80 78.274 1.438 5.734 574 HB2 LYS 80 HB2 LYS 80 78.505 0.071 7.663 575 HB3 LYS 80 HB3 LYS 80 77.107 -0.526 6.802 576 HG2 LYS 80 HG2 LYS 80 78.675 -2.287 5.826 577 HG3 LYS 80 HG3 LYS 80 79.827 -1.767 7.040 578 HD2 LYS 80 HD2 LYS 80 77.059 -2.857 7.590 579 HD3 LYS 80 HD3 LYS 80 78.581 -3.709 7.841 580 HE2 LYS 80 HE2 LYS 80 77.718 -1.188 9.207 581 HE3 LYS 80 HE3 LYS 80 77.602 -2.791 9.915 582 HZ1 LYS 80 HZ1 LYS 80 79.535 -1.664 10.729 583 HZ2 LYS 80 HZ2 LYS 80 80.129 -1.383 9.178 584 HZ3 LYS 80 HZ3 LYS 80 80.045 -2.956 9.772 585 H GLU 81 H GLU 81 79.982 -1.200 4.159 586 HA GLU 81 HA GLU 81 82.418 -0.385 5.292 587 HB2 GLU 81 HB2 GLU 81 81.941 -2.206 2.952 588 HB3 GLU 81 HB3 GLU 81 83.507 -1.947 3.721 589 HG2 GLU 81 HG2 GLU 81 82.305 -2.619 5.887 590 HG3 GLU 81 HG3 GLU 81 81.064 -3.243 4.827 591 H TRP 82 H TRP 82 80.806 0.364 2.318 592 HA TRP 82 HA TRP 82 82.882 1.782 1.020 593 HB2 TRP 82 HB2 TRP 82 80.554 1.187 0.097 594 HB3 TRP 82 HB3 TRP 82 80.002 2.539 1.105 595 HD1 TRP 82 HD1 TRP 82 82.127 1.888 -2.032 596 HE1 TRP 82 HE1 TRP 82 82.211 4.032 -3.414 597 HE3 TRP 82 HE3 TRP 82 79.768 5.051 1.231 598 HZ2 TRP 82 HZ2 TRP 82 81.392 6.695 -3.192 599 HZ3 TRP 82 HZ3 TRP 82 79.465 7.400 0.569 600 HH2 TRP 82 HH2 TRP 82 80.257 8.218 -1.577 601 H ARG 83 H ARG 83 80.351 2.689 3.220 602 HA ARG 83 HA ARG 83 80.809 5.466 3.267 603 HB2 ARG 83 HB2 ARG 83 78.760 3.952 4.069 604 HB3 ARG 83 HB3 ARG 83 79.730 4.004 5.554 605 HG2 ARG 83 HG2 ARG 83 78.116 5.671 5.766 606 HG3 ARG 83 HG3 ARG 83 79.723 6.349 5.474 607 HD2 ARG 83 HD2 ARG 83 79.170 6.896 3.207 608 HD3 ARG 83 HD3 ARG 83 77.593 6.098 3.357 609 HE ARG 83 HE ARG 83 77.686 7.880 5.404 610 HH11 ARG 83 HH11 ARG 83 77.487 8.208 1.853 611 HH12 ARG 83 HH12 ARG 83 77.057 9.855 1.973 612 HH21 ARG 83 HH21 ARG 83 77.077 10.060 5.466 613 HH22 ARG 83 HH22 ARG 83 76.806 10.913 4.033 614 H ALA 84 H ALA 84 81.728 2.815 5.477 615 HA ALA 84 HA ALA 84 83.086 4.450 7.332 616 HB1 ALA 84 HB1 ALA 84 83.376 1.489 6.878 617 HB2 ALA 84 HB2 ALA 84 82.177 2.255 7.920 618 HB3 ALA 84 HB3 ALA 84 83.892 2.386 8.306 619 H ALA 85 H ALA 85 84.226 2.535 4.558 620 HA ALA 85 HA ALA 85 86.972 2.964 5.049 621 HB1 ALA 85 HB1 ALA 85 86.167 1.219 3.513 622 HB2 ALA 85 HB2 ALA 85 87.322 2.295 2.721 623 HB3 ALA 85 HB3 ALA 85 85.595 2.468 2.407 624 H ASN 86 H ASN 86 84.534 4.758 3.329 625 HA ASN 86 HA ASN 86 86.350 6.706 2.300 626 HB2 ASN 86 HB2 ASN 86 83.851 6.112 1.520 627 HB3 ASN 86 HB3 ASN 86 83.454 7.275 2.759 628 HD21 ASN 86 HD21 ASN 86 82.944 7.501 -0.042 629 HD22 ASN 86 HD22 ASN 86 83.801 8.889 -0.598 630 H GLY 87 H GLY 87 84.726 6.141 5.275 631 HA2 GLY 87 HA2 GLY 87 85.106 7.118 7.338 632 HA3 GLY 87 HA3 GLY 87 86.054 8.359 6.531 633 H LYS 88 H LYS 88 82.636 7.388 5.930 634 HA LYS 88 HA LYS 88 81.875 10.077 6.569 635 HB2 LYS 88 HB2 LYS 88 81.336 8.133 4.377 636 HB3 LYS 88 HB3 LYS 88 80.226 9.444 4.707 637 HG2 LYS 88 HG2 LYS 88 81.908 11.086 4.166 638 HG3 LYS 88 HG3 LYS 88 83.182 9.889 4.286 639 HD2 LYS 88 HD2 LYS 88 82.882 10.454 1.988 640 HD3 LYS 88 HD3 LYS 88 82.305 8.824 2.234 641 HE2 LYS 88 HE2 LYS 88 80.965 10.144 0.733 642 HE3 LYS 88 HE3 LYS 88 80.055 9.526 2.096 643 HZ1 LYS 88 HZ1 LYS 88 79.564 11.901 1.542 644 HZ2 LYS 88 HZ2 LYS 88 81.156 12.319 1.840 645 HZ3 LYS 88 HZ3 LYS 88 80.182 11.784 3.090 646 HA PRO 89 HA PRO 89 79.206 7.995 9.509 647 HB2 PRO 89 HB2 PRO 89 77.056 9.711 9.500 648 HB3 PRO 89 HB3 PRO 89 78.564 10.056 10.352 649 HG2 PRO 89 HG2 PRO 89 77.644 10.998 7.664 650 HG3 PRO 89 HG3 PRO 89 78.444 11.914 8.955 651 HD2 PRO 89 HD2 PRO 89 79.800 11.033 6.819 652 HD3 PRO 89 HD3 PRO 89 80.529 11.060 8.439 653 H GLY 90 H GLY 90 77.956 6.257 9.228 654 HA2 GLY 90 HA2 GLY 90 76.237 6.225 6.855 655 HA3 GLY 90 HA3 GLY 90 77.020 4.803 7.526 656 H PHE 91 H PHE 91 75.927 3.613 8.920 657 HA PHE 91 HA PHE 91 73.157 4.348 9.385 658 HB2 PHE 91 HB2 PHE 91 74.575 1.824 10.272 659 HB3 PHE 91 HB3 PHE 91 72.850 2.109 10.216 660 HD1 PHE 91 HD1 PHE 91 72.293 3.148 7.648 661 HD2 PHE 91 HD2 PHE 91 75.185 0.247 8.771 662 HE1 PHE 91 HE1 PHE 91 72.205 2.188 5.398 663 HE2 PHE 91 HE2 PHE 91 75.097 -0.719 6.514 664 HZ PHE 91 HZ PHE 91 73.610 0.255 4.827 665 H LYS 92 H LYS 92 72.171 4.163 11.498 666 HA LYS 92 HA LYS 92 73.993 4.674 13.684 667 HB2 LYS 92 HB2 LYS 92 72.033 5.511 14.769 668 HB3 LYS 92 HB3 LYS 92 72.236 6.369 13.262 669 HG2 LYS 92 HG2 LYS 92 70.462 5.073 12.298 670 HG3 LYS 92 HG3 LYS 92 70.472 4.023 13.722 671 HD2 LYS 92 HD2 LYS 92 69.778 6.958 13.822 672 HD3 LYS 92 HD3 LYS 92 68.578 5.679 13.652 673 HE2 LYS 92 HE2 LYS 92 69.421 4.683 15.777 674 HE3 LYS 92 HE3 LYS 92 70.497 6.060 15.955 675 HZ1 LYS 92 HZ1 LYS 92 67.544 6.171 15.851 676 HZ2 LYS 92 HZ2 LYS 92 68.574 7.511 15.991 677 HZ3 LYS 92 HZ3 LYS 92 68.505 6.359 17.222 678 H GLN 93 H GLN 93 73.003 3.648 15.713 679 HA GLN 93 HA GLN 93 72.186 0.933 15.071 680 HB2 GLN 93 HB2 GLN 93 73.607 2.325 17.189 681 HB3 GLN 93 HB3 GLN 93 72.900 0.766 17.572 682 HG2 GLN 93 HG2 GLN 93 75.339 0.600 17.040 683 HG3 GLN 93 HG3 GLN 93 74.355 -0.309 15.903 684 HE21 GLN 93 HE21 GLN 93 76.245 2.557 16.362 685 HE22 GLN 93 HE22 GLN 93 76.506 2.922 14.696 686 H GLY 94 H GLY 94 70.341 0.198 15.977 687 HA2 GLY 94 HA2 GLY 94 69.004 1.169 18.176 688 HA3 GLY 94 HA3 GLY 94 68.390 2.055 16.781 Start of MODEL 14 1 H GLU 2 H GLU 2 60.111 1.852 7.021 2 HA GLU 2 HA GLU 2 58.835 3.417 5.835 3 HB2 GLU 2 HB2 GLU 2 58.327 5.621 6.885 4 HB3 GLU 2 HB3 GLU 2 57.417 4.270 7.543 5 HG2 GLU 2 HG2 GLU 2 58.855 4.200 9.482 6 HG3 GLU 2 HG3 GLU 2 59.869 5.469 8.798 7 H LEU 3 H LEU 3 59.744 5.656 5.130 8 HA LEU 3 HA LEU 3 62.568 5.141 5.121 9 HB2 LEU 3 HB2 LEU 3 60.982 7.128 3.516 10 HB3 LEU 3 HB3 LEU 3 62.645 6.672 3.234 11 HG LEU 3 HG LEU 3 60.198 4.972 2.835 12 HD11 LEU 3 HD11 LEU 3 62.242 6.023 0.902 13 HD12 LEU 3 HD12 LEU 3 60.576 6.574 1.075 14 HD13 LEU 3 HD13 LEU 3 60.909 4.939 0.504 15 HD21 LEU 3 HD21 LEU 3 61.767 3.241 2.001 16 HD22 LEU 3 HD22 LEU 3 61.902 3.554 3.729 17 HD23 LEU 3 HD23 LEU 3 63.102 4.222 2.625 18 H LYS 4 H LYS 4 64.084 6.709 5.605 19 HA LYS 4 HA LYS 4 63.207 8.848 7.416 20 HB2 LYS 4 HB2 LYS 4 66.040 7.897 6.873 21 HB3 LYS 4 HB3 LYS 4 65.479 8.881 8.236 22 HG2 LYS 4 HG2 LYS 4 65.349 5.965 7.652 23 HG3 LYS 4 HG3 LYS 4 65.953 6.738 9.092 24 HD2 LYS 4 HD2 LYS 4 63.490 7.438 9.403 25 HD3 LYS 4 HD3 LYS 4 63.237 6.211 8.182 26 HE2 LYS 4 HE2 LYS 4 64.773 4.731 9.631 27 HE3 LYS 4 HE3 LYS 4 64.342 5.833 10.906 28 HZ1 LYS 4 HZ1 LYS 4 61.993 5.354 10.584 29 HZ2 LYS 4 HZ2 LYS 4 62.871 3.949 10.916 30 HZ3 LYS 4 HZ3 LYS 4 62.381 4.250 9.344 31 H ASN 5 H ASN 5 65.461 10.562 7.087 32 HA ASN 5 HA ASN 5 65.307 11.262 4.237 33 HB2 ASN 5 HB2 ASN 5 65.623 13.163 6.584 34 HB3 ASN 5 HB3 ASN 5 65.847 13.609 4.895 35 HD21 ASN 5 HD21 ASN 5 63.665 11.993 3.885 36 HD22 ASN 5 HD22 ASN 5 62.221 12.773 4.400 37 H SER 6 H SER 6 67.359 10.427 6.831 38 HA SER 6 HA SER 6 69.616 10.744 5.023 39 HB2 SER 6 HB2 SER 6 71.040 11.410 6.885 40 HB3 SER 6 HB3 SER 6 69.759 12.594 6.623 41 HG SER 6 HG SER 6 68.605 11.593 8.340 42 H ILE 7 H ILE 7 71.422 9.336 5.606 43 HA ILE 7 HA ILE 7 70.619 6.659 6.039 44 HB ILE 7 HB ILE 7 72.571 7.423 4.657 45 HG12 ILE 7 HG12 ILE 7 73.244 5.306 6.766 46 HG13 ILE 7 HG13 ILE 7 72.431 5.074 5.235 47 HG21 ILE 7 HG21 ILE 7 74.732 7.902 5.725 48 HG22 ILE 7 HG22 ILE 7 73.949 7.858 7.302 49 HG23 ILE 7 HG23 ILE 7 73.507 9.104 6.141 50 HD11 ILE 7 HD11 ILE 7 74.440 5.647 4.043 51 HD12 ILE 7 HD12 ILE 7 74.750 4.357 5.205 52 HD13 ILE 7 HD13 ILE 7 75.260 6.007 5.561 53 H SER 8 H SER 8 71.518 9.174 8.174 54 HA SER 8 HA SER 8 72.509 7.440 10.227 55 HB2 SER 8 HB2 SER 8 72.129 10.427 10.180 56 HB3 SER 8 HB3 SER 8 73.017 9.515 11.413 57 HG SER 8 HG SER 8 74.104 8.655 9.332 58 H ASP 9 H ASP 9 69.404 8.256 9.308 59 HA ASP 9 HA ASP 9 68.412 8.040 12.095 60 HB2 ASP 9 HB2 ASP 9 67.310 9.772 10.377 61 HB3 ASP 9 HB3 ASP 9 66.729 8.351 9.634 62 H TYR 10 H TYR 10 69.487 6.193 9.835 63 HA TYR 10 HA TYR 10 67.389 4.167 9.857 64 HB2 TYR 10 HB2 TYR 10 69.677 4.732 7.989 65 HB3 TYR 10 HB3 TYR 10 69.088 3.091 8.147 66 HD1 TYR 10 HD1 TYR 10 66.729 2.604 7.530 67 HD2 TYR 10 HD2 TYR 10 68.556 6.327 6.634 68 HE1 TYR 10 HE1 TYR 10 65.017 3.015 5.830 69 HE2 TYR 10 HE2 TYR 10 66.823 6.757 4.921 70 HH TYR 10 HH TYR 10 65.168 5.602 3.601 71 H THR 11 H THR 11 67.806 2.567 11.378 72 HA THR 11 HA THR 11 70.493 2.104 12.283 73 HB THR 11 HB THR 11 69.563 0.154 13.461 74 HG1 THR 11 HG1 THR 11 67.282 -0.297 13.179 75 HG21 THR 11 HG21 THR 11 67.725 1.165 14.789 76 HG22 THR 11 HG22 THR 11 67.674 2.511 13.647 77 HG23 THR 11 HG23 THR 11 69.119 2.219 14.623 78 H GLU 12 H GLU 12 71.297 -0.234 11.911 79 HA GLU 12 HA GLU 12 71.526 -0.671 9.206 80 HB2 GLU 12 HB2 GLU 12 72.361 -2.986 9.968 81 HB3 GLU 12 HB3 GLU 12 73.245 -1.558 10.484 82 HG2 GLU 12 HG2 GLU 12 72.083 -1.649 12.641 83 HG3 GLU 12 HG3 GLU 12 71.273 -3.115 12.178 84 H ALA 13 H ALA 13 69.291 -2.249 11.491 85 HA ALA 13 HA ALA 13 68.046 -3.842 9.468 86 HB1 ALA 13 HB1 ALA 13 66.912 -3.040 12.154 87 HB2 ALA 13 HB2 ALA 13 67.931 -4.450 11.857 88 HB3 ALA 13 HB3 ALA 13 66.336 -4.345 11.119 89 H GLU 14 H GLU 14 67.264 -0.627 10.798 90 HA GLU 14 HA GLU 14 64.803 -0.204 9.491 91 HB2 GLU 14 HB2 GLU 14 67.039 1.621 10.231 92 HB3 GLU 14 HB3 GLU 14 65.642 2.304 9.457 93 HG2 GLU 14 HG2 GLU 14 65.541 0.687 12.002 94 HG3 GLU 14 HG3 GLU 14 65.700 2.438 11.960 95 H PHE 15 H PHE 15 68.066 0.022 8.382 96 HA PHE 15 HA PHE 15 67.370 1.155 5.876 97 HB2 PHE 15 HB2 PHE 15 69.601 1.351 7.091 98 HB3 PHE 15 HB3 PHE 15 69.907 -0.288 6.550 99 HD1 PHE 15 HD1 PHE 15 68.866 3.006 5.193 100 HD2 PHE 15 HD2 PHE 15 70.995 -0.595 4.600 101 HE1 PHE 15 HE1 PHE 15 69.746 3.879 3.065 102 HE2 PHE 15 HE2 PHE 15 71.875 0.262 2.472 103 HZ PHE 15 HZ PHE 15 71.243 2.507 1.717 104 H VAL 16 H VAL 16 68.101 -2.136 7.073 105 HA VAL 16 HA VAL 16 67.962 -3.275 4.525 106 HB VAL 16 HB VAL 16 67.907 -5.433 5.420 107 HG11 VAL 16 HG11 VAL 16 69.408 -3.826 7.370 108 HG12 VAL 16 HG12 VAL 16 69.900 -4.435 5.791 109 HG13 VAL 16 HG13 VAL 16 69.558 -5.572 7.102 110 HG21 VAL 16 HG21 VAL 16 67.331 -6.028 7.698 111 HG22 VAL 16 HG22 VAL 16 66.007 -5.366 6.727 112 HG23 VAL 16 HG23 VAL 16 66.778 -4.348 7.956 113 H GLN 17 H GLN 17 65.440 -2.355 6.742 114 HA GLN 17 HA GLN 17 63.246 -3.643 5.671 115 HB2 GLN 17 HB2 GLN 17 63.506 -2.234 7.769 116 HB3 GLN 17 HB3 GLN 17 63.491 -0.823 6.749 117 HG2 GLN 17 HG2 GLN 17 61.226 -2.739 6.793 118 HG3 GLN 17 HG3 GLN 17 61.409 -1.507 8.042 119 HE21 GLN 17 HE21 GLN 17 60.425 -2.154 4.805 120 HE22 GLN 17 HE22 GLN 17 59.916 -0.545 4.422 121 H LEU 18 H LEU 18 64.738 -0.535 4.800 122 HA LEU 18 HA LEU 18 63.152 0.093 2.558 123 HB2 LEU 18 HB2 LEU 18 64.511 1.739 3.447 124 HB3 LEU 18 HB3 LEU 18 65.942 0.830 3.399 125 HG LEU 18 HG LEU 18 65.878 0.877 0.883 126 HD11 LEU 18 HD11 LEU 18 64.590 2.597 -0.239 127 HD12 LEU 18 HD12 LEU 18 63.756 2.957 1.268 128 HD13 LEU 18 HD13 LEU 18 63.566 1.374 0.513 129 HD21 LEU 18 HD21 LEU 18 66.715 3.151 0.692 130 HD22 LEU 18 HD22 LEU 18 67.371 2.279 2.082 131 HD23 LEU 18 HD23 LEU 18 66.110 3.501 2.317 132 H LEU 19 H LEU 19 66.161 -1.500 2.866 133 HA LEU 19 HA LEU 19 66.842 -2.076 0.212 134 HB2 LEU 19 HB2 LEU 19 67.241 -3.383 2.746 135 HB3 LEU 19 HB3 LEU 19 68.154 -3.921 1.300 136 HG LEU 19 HG LEU 19 68.271 -1.385 2.914 137 HD11 LEU 19 HD11 LEU 19 69.744 -3.075 3.579 138 HD12 LEU 19 HD12 LEU 19 70.649 -1.773 2.770 139 HD13 LEU 19 HD13 LEU 19 70.305 -3.281 1.924 140 HD21 LEU 19 HD21 LEU 19 68.050 -0.587 0.698 141 HD22 LEU 19 HD22 LEU 19 69.308 -1.702 0.124 142 HD23 LEU 19 HD23 LEU 19 69.716 -0.394 1.246 143 H LYS 20 H LYS 20 64.850 -3.888 2.477 144 HA LYS 20 HA LYS 20 64.332 -6.037 0.723 145 HB2 LYS 20 HB2 LYS 20 62.942 -5.121 3.213 146 HB3 LYS 20 HB3 LYS 20 62.458 -6.574 2.341 147 HG2 LYS 20 HG2 LYS 20 64.848 -7.362 2.609 148 HG3 LYS 20 HG3 LYS 20 65.078 -5.998 3.681 149 HD2 LYS 20 HD2 LYS 20 63.348 -6.831 5.175 150 HD3 LYS 20 HD3 LYS 20 63.072 -8.206 4.101 151 HE2 LYS 20 HE2 LYS 20 65.431 -8.881 4.397 152 HE3 LYS 20 HE3 LYS 20 65.652 -7.555 5.527 153 HZ1 LYS 20 HZ1 LYS 20 65.320 -9.620 6.649 154 HZ2 LYS 20 HZ2 LYS 20 63.820 -9.865 5.901 155 HZ3 LYS 20 HZ3 LYS 20 64.029 -8.601 6.997 156 H GLU 21 H GLU 21 62.756 -2.987 1.321 157 HA GLU 21 HA GLU 21 60.483 -3.554 -0.248 158 HB2 GLU 21 HB2 GLU 21 61.785 -0.879 0.300 159 HB3 GLU 21 HB3 GLU 21 60.167 -1.118 -0.348 160 HG2 GLU 21 HG2 GLU 21 61.119 -1.956 2.379 161 HG3 GLU 21 HG3 GLU 21 60.124 -0.550 2.018 162 H ILE 22 H ILE 22 63.627 -2.082 -0.927 163 HA ILE 22 HA ILE 22 63.233 -1.531 -3.630 164 HB ILE 22 HB ILE 22 65.840 -2.484 -2.419 165 HG12 ILE 22 HG12 ILE 22 64.649 0.313 -2.466 166 HG13 ILE 22 HG13 ILE 22 64.886 -0.690 -1.056 167 HG21 ILE 22 HG21 ILE 22 65.793 -2.344 -4.852 168 HG22 ILE 22 HG22 ILE 22 66.814 -1.081 -4.167 169 HG23 ILE 22 HG23 ILE 22 65.200 -0.684 -4.754 170 HD11 ILE 22 HD11 ILE 22 67.060 0.414 -2.792 171 HD12 ILE 22 HD12 ILE 22 67.297 -0.597 -1.370 172 HD13 ILE 22 HD13 ILE 22 66.592 1.016 -1.202 173 H GLU 23 H GLU 23 64.337 -4.523 -2.043 174 HA GLU 23 HA GLU 23 64.859 -6.180 -4.163 175 HB2 GLU 23 HB2 GLU 23 65.449 -6.718 -1.975 176 HB3 GLU 23 HB3 GLU 23 63.859 -6.329 -1.367 177 HG2 GLU 23 HG2 GLU 23 63.986 -8.514 -1.147 178 HG3 GLU 23 HG3 GLU 23 63.060 -8.333 -2.597 179 H LYS 24 H LYS 24 61.906 -5.530 -2.400 180 HA LYS 24 HA LYS 24 60.190 -7.394 -3.603 181 HB2 LYS 24 HB2 LYS 24 59.969 -6.181 -1.416 182 HB3 LYS 24 HB3 LYS 24 59.546 -4.768 -2.378 183 HG2 LYS 24 HG2 LYS 24 57.617 -5.994 -3.282 184 HG3 LYS 24 HG3 LYS 24 58.103 -7.331 -2.198 185 HD2 LYS 24 HD2 LYS 24 57.669 -6.113 -0.269 186 HD3 LYS 24 HD3 LYS 24 57.670 -4.579 -1.134 187 HE2 LYS 24 HE2 LYS 24 55.571 -5.230 -2.230 188 HE3 LYS 24 HE3 LYS 24 55.572 -6.734 -1.306 189 HZ1 LYS 24 HZ1 LYS 24 55.596 -4.043 -0.097 190 HZ2 LYS 24 HZ2 LYS 24 55.381 -5.492 0.725 191 HZ3 LYS 24 HZ3 LYS 24 54.189 -4.914 -0.355 192 H GLU 25 H GLU 25 60.496 -3.854 -4.034 193 HA GLU 25 HA GLU 25 58.677 -3.737 -6.138 194 HB2 GLU 25 HB2 GLU 25 60.699 -1.697 -5.120 195 HB3 GLU 25 HB3 GLU 25 59.703 -1.492 -6.493 196 HG2 GLU 25 HG2 GLU 25 58.794 -0.452 -4.443 197 HG3 GLU 25 HG3 GLU 25 57.710 -1.497 -5.360 198 H ASN 26 H ASN 26 61.952 -4.681 -6.096 199 HA ASN 26 HA ASN 26 62.278 -4.048 -8.899 200 HB2 ASN 26 HB2 ASN 26 64.223 -3.807 -7.381 201 HB3 ASN 26 HB3 ASN 26 64.189 -5.542 -7.087 202 HD21 ASN 26 HD21 ASN 26 64.831 -3.049 -9.447 203 HD22 ASN 26 HD22 ASN 26 65.730 -4.024 -10.533 204 H VAL 27 H VAL 27 61.781 -6.955 -6.913 205 HA VAL 27 HA VAL 27 61.918 -8.658 -9.197 206 HB VAL 27 HB VAL 27 60.930 -10.464 -7.800 207 HG11 VAL 27 HG11 VAL 27 63.314 -10.138 -7.764 208 HG12 VAL 27 HG12 VAL 27 62.748 -10.633 -6.168 209 HG13 VAL 27 HG13 VAL 27 63.156 -8.945 -6.475 210 HG21 VAL 27 HG21 VAL 27 60.805 -8.369 -5.633 211 HG22 VAL 27 HG22 VAL 27 60.497 -10.094 -5.413 212 HG23 VAL 27 HG23 VAL 27 59.423 -9.123 -6.421 213 H ALA 28 H ALA 28 59.301 -6.968 -7.621 214 HA ALA 28 HA ALA 28 57.311 -8.111 -9.369 215 HB1 ALA 28 HB1 ALA 28 57.198 -5.666 -7.589 216 HB2 ALA 28 HB2 ALA 28 56.680 -7.291 -7.142 217 HB3 ALA 28 HB3 ALA 28 55.817 -6.403 -8.398 218 H ALA 29 H ALA 29 59.506 -5.515 -9.308 219 HA ALA 29 HA ALA 29 60.238 -4.005 -10.711 220 HB1 ALA 29 HB1 ALA 29 60.386 -5.857 -12.307 221 HB2 ALA 29 HB2 ALA 29 60.064 -4.297 -13.075 222 HB3 ALA 29 HB3 ALA 29 58.758 -5.467 -12.882 223 H THR 30 H THR 30 58.996 -2.523 -9.543 224 HA THR 30 HA THR 30 56.727 -1.477 -11.028 225 HB THR 30 HB THR 30 56.377 -0.016 -9.025 226 HG1 THR 30 HG1 THR 30 57.885 -1.283 -7.276 227 HG21 THR 30 HG21 THR 30 55.300 -2.210 -9.142 228 HG22 THR 30 HG22 THR 30 55.751 -1.788 -7.476 229 HG23 THR 30 HG23 THR 30 56.743 -2.919 -8.404 230 H ASP 31 H ASP 31 56.842 1.137 -10.726 231 HA ASP 31 HA ASP 31 59.545 1.881 -11.550 232 HB2 ASP 31 HB2 ASP 31 58.233 1.813 -13.554 233 HB3 ASP 31 HB3 ASP 31 56.973 2.745 -12.734 234 H ASP 32 H ASP 32 56.463 3.295 -10.487 235 HA ASP 32 HA ASP 32 57.642 5.726 -9.821 236 HB2 ASP 32 HB2 ASP 32 55.663 6.308 -8.541 237 HB3 ASP 32 HB3 ASP 32 55.181 5.529 -10.041 238 H VAL 33 H VAL 33 56.916 3.068 -7.661 239 HA VAL 33 HA VAL 33 58.200 4.538 -5.548 240 HB VAL 33 HB VAL 33 56.268 3.310 -4.996 241 HG11 VAL 33 HG11 VAL 33 57.755 0.836 -5.778 242 HG12 VAL 33 HG12 VAL 33 56.294 1.493 -6.526 243 HG13 VAL 33 HG13 VAL 33 56.233 0.829 -4.888 244 HG21 VAL 33 HG21 VAL 33 57.048 2.071 -3.008 245 HG22 VAL 33 HG22 VAL 33 57.840 3.632 -3.211 246 HG23 VAL 33 HG23 VAL 33 58.689 2.149 -3.647 247 H LEU 34 H LEU 34 58.923 1.939 -7.586 248 HA LEU 34 HA LEU 34 61.313 0.962 -6.408 249 HB2 LEU 34 HB2 LEU 34 59.913 0.086 -8.512 250 HB3 LEU 34 HB3 LEU 34 60.804 1.326 -9.280 251 HG LEU 34 HG LEU 34 61.623 -1.159 -9.400 252 HD11 LEU 34 HD11 LEU 34 63.352 1.263 -9.338 253 HD12 LEU 34 HD12 LEU 34 62.395 0.630 -10.684 254 HD13 LEU 34 HD13 LEU 34 63.764 -0.302 -10.065 255 HD21 LEU 34 HD21 LEU 34 63.567 -1.494 -7.948 256 HD22 LEU 34 HD22 LEU 34 62.081 -1.398 -7.005 257 HD23 LEU 34 HD23 LEU 34 63.174 -0.015 -7.072 258 H ASP 35 H ASP 35 60.807 3.639 -8.734 259 HA ASP 35 HA ASP 35 63.587 4.209 -8.647 260 HB2 ASP 35 HB2 ASP 35 62.310 4.784 -10.666 261 HB3 ASP 35 HB3 ASP 35 61.328 5.892 -9.720 262 H VAL 36 H VAL 36 60.917 5.161 -6.743 263 HA VAL 36 HA VAL 36 61.992 7.435 -5.429 264 HB VAL 36 HB VAL 36 60.438 5.141 -4.204 265 HG11 VAL 36 HG11 VAL 36 60.873 7.930 -3.246 266 HG12 VAL 36 HG12 VAL 36 61.648 6.458 -2.637 267 HG13 VAL 36 HG13 VAL 36 59.881 6.672 -2.458 268 HG21 VAL 36 HG21 VAL 36 59.546 7.770 -5.172 269 HG22 VAL 36 HG22 VAL 36 58.593 6.462 -4.371 270 HG23 VAL 36 HG23 VAL 36 59.362 6.180 -5.966 271 H LEU 37 H LEU 37 62.176 4.050 -4.882 272 HA LEU 37 HA LEU 37 63.675 4.202 -2.527 273 HB2 LEU 37 HB2 LEU 37 63.537 1.868 -4.369 274 HB3 LEU 37 HB3 LEU 37 63.876 2.028 -2.651 275 HG LEU 37 HG LEU 37 61.157 2.578 -3.778 276 HD11 LEU 37 HD11 LEU 37 62.137 0.125 -2.359 277 HD12 LEU 37 HD12 LEU 37 61.652 0.243 -4.051 278 HD13 LEU 37 HD13 LEU 37 60.460 0.477 -2.774 279 HD21 LEU 37 HD21 LEU 37 62.124 2.277 -0.932 280 HD22 LEU 37 HD22 LEU 37 60.449 2.505 -1.429 281 HD23 LEU 37 HD23 LEU 37 61.630 3.781 -1.711 282 H LEU 38 H LEU 38 64.429 3.537 -5.850 283 HA LEU 38 HA LEU 38 67.122 2.898 -5.527 284 HB2 LEU 38 HB2 LEU 38 65.584 4.134 -7.740 285 HB3 LEU 38 HB3 LEU 38 67.281 3.653 -7.967 286 HG LEU 38 HG LEU 38 64.718 2.149 -7.857 287 HD11 LEU 38 HD11 LEU 38 65.766 2.732 -9.955 288 HD12 LEU 38 HD12 LEU 38 65.739 0.968 -9.705 289 HD13 LEU 38 HD13 LEU 38 67.219 1.887 -9.404 290 HD21 LEU 38 HD21 LEU 38 65.866 0.027 -7.498 291 HD22 LEU 38 HD22 LEU 38 65.974 1.075 -6.083 292 HD23 LEU 38 HD23 LEU 38 67.363 0.902 -7.165 293 H GLU 39 H GLU 39 65.589 5.996 -6.153 294 HA GLU 39 HA GLU 39 68.007 7.469 -6.087 295 HB2 GLU 39 HB2 GLU 39 65.143 8.210 -5.738 296 HB3 GLU 39 HB3 GLU 39 66.457 9.364 -5.693 297 HG2 GLU 39 HG2 GLU 39 65.659 7.601 -8.000 298 HG3 GLU 39 HG3 GLU 39 65.388 9.340 -7.829 299 H HIS 40 H HIS 40 65.550 6.701 -3.715 300 HA HIS 40 HA HIS 40 66.378 8.466 -1.744 301 HB2 HIS 40 HB2 HIS 40 64.209 7.376 -1.771 302 HB3 HIS 40 HB3 HIS 40 64.893 5.829 -1.452 303 HD1 HIS 40 HD1 HIS 40 64.039 9.048 0.255 304 HD2 HIS 40 HD2 HIS 40 65.751 5.391 1.185 305 HE1 HIS 40 HE1 HIS 40 64.207 8.970 2.755 306 H PHE 41 H PHE 41 67.114 5.136 -2.322 307 HA PHE 41 HA PHE 41 68.734 4.633 -0.146 308 HB2 PHE 41 HB2 PHE 41 67.929 2.859 -1.394 309 HB3 PHE 41 HB3 PHE 41 68.454 3.574 -2.906 310 HD1 PHE 41 HD1 PHE 41 69.638 2.020 0.229 311 HD2 PHE 41 HD2 PHE 41 70.515 2.895 -3.826 312 HE1 PHE 41 HE1 PHE 41 71.656 0.618 0.369 313 HE2 PHE 41 HE2 PHE 41 72.536 1.515 -3.676 314 HZ PHE 41 HZ PHE 41 73.107 0.373 -1.593 315 H VAL 42 H VAL 42 69.648 5.707 -3.397 316 HA VAL 42 HA VAL 42 72.350 5.954 -2.645 317 HB VAL 42 HB VAL 42 71.664 5.515 -4.948 318 HG11 VAL 42 HG11 VAL 42 70.735 8.291 -5.083 319 HG12 VAL 42 HG12 VAL 42 69.828 6.755 -5.207 320 HG13 VAL 42 HG13 VAL 42 71.043 7.169 -6.428 321 HG21 VAL 42 HG21 VAL 42 73.325 7.994 -4.718 322 HG22 VAL 42 HG22 VAL 42 73.328 6.880 -6.086 323 HG23 VAL 42 HG23 VAL 42 73.930 6.360 -4.505 324 H LYS 43 H LYS 43 69.769 8.238 -2.541 325 HA LYS 43 HA LYS 43 71.473 10.546 -2.226 326 HB2 LYS 43 HB2 LYS 43 69.551 11.845 -1.616 327 HB3 LYS 43 HB3 LYS 43 69.000 10.706 -2.832 328 HG2 LYS 43 HG2 LYS 43 68.103 9.255 -0.877 329 HG3 LYS 43 HG3 LYS 43 68.578 10.579 0.131 330 HD2 LYS 43 HD2 LYS 43 66.688 11.067 -2.143 331 HD3 LYS 43 HD3 LYS 43 66.128 10.518 -0.565 332 HE2 LYS 43 HE2 LYS 43 67.111 12.467 0.493 333 HE3 LYS 43 HE3 LYS 43 67.760 13.017 -1.055 334 HZ1 LYS 43 HZ1 LYS 43 64.865 12.726 -0.408 335 HZ2 LYS 43 HZ2 LYS 43 65.518 13.343 -1.843 336 HZ3 LYS 43 HZ3 LYS 43 65.736 14.163 -0.392 337 H ILE 44 H ILE 44 70.203 8.279 0.081 338 HA ILE 44 HA ILE 44 71.181 9.897 2.287 339 HB ILE 44 HB ILE 44 70.387 8.004 3.719 340 HG12 ILE 44 HG12 ILE 44 69.509 6.863 1.055 341 HG13 ILE 44 HG13 ILE 44 70.670 6.148 2.156 342 HG21 ILE 44 HG21 ILE 44 68.376 9.071 1.741 343 HG22 ILE 44 HG22 ILE 44 68.938 9.904 3.187 344 HG23 ILE 44 HG23 ILE 44 68.003 8.414 3.333 345 HD11 ILE 44 HD11 ILE 44 67.759 6.572 2.724 346 HD12 ILE 44 HD12 ILE 44 68.909 5.730 3.763 347 HD13 ILE 44 HD13 ILE 44 68.473 5.067 2.179 348 H THR 45 H THR 45 72.226 7.148 0.434 349 HA THR 45 HA THR 45 74.372 6.606 2.279 350 HB THR 45 HB THR 45 75.038 4.857 0.668 351 HG1 THR 45 HG1 THR 45 72.661 5.309 -0.749 352 HG21 THR 45 HG21 THR 45 72.088 4.851 1.287 353 HG22 THR 45 HG22 THR 45 73.349 4.434 2.435 354 HG23 THR 45 HG23 THR 45 73.099 3.436 0.996 355 H GLU 46 H GLU 46 73.897 8.248 -0.771 356 HA GLU 46 HA GLU 46 75.139 9.324 -2.183 357 HB2 GLU 46 HB2 GLU 46 76.506 9.911 0.388 358 HB3 GLU 46 HB3 GLU 46 77.124 10.641 -1.107 359 HG2 GLU 46 HG2 GLU 46 74.339 10.882 0.020 360 HG3 GLU 46 HG3 GLU 46 75.601 12.110 0.173 361 H HIS 47 H HIS 47 75.516 6.666 -1.957 362 HA HIS 47 HA HIS 47 78.297 6.028 -2.218 363 HB2 HIS 47 HB2 HIS 47 76.461 4.461 -1.342 364 HB3 HIS 47 HB3 HIS 47 75.926 4.306 -3.010 365 HD1 HIS 47 HD1 HIS 47 77.326 2.681 -4.529 366 HD2 HIS 47 HD2 HIS 47 78.905 3.294 -0.752 367 HE1 HIS 47 HE1 HIS 47 79.317 1.168 -4.340 368 HA PRO 48 HA PRO 48 78.446 7.420 -6.512 369 HB2 PRO 48 HB2 PRO 48 80.500 5.382 -6.883 370 HB3 PRO 48 HB3 PRO 48 80.600 7.128 -7.095 371 HG2 PRO 48 HG2 PRO 48 81.745 5.760 -5.142 372 HG3 PRO 48 HG3 PRO 48 81.126 7.410 -4.817 373 HD2 PRO 48 HD2 PRO 48 80.011 4.719 -4.136 374 HD3 PRO 48 HD3 PRO 48 79.959 6.210 -3.186 375 H ASP 49 H ASP 49 77.755 4.321 -5.562 376 HA ASP 49 HA ASP 49 77.371 3.556 -8.256 377 HB2 ASP 49 HB2 ASP 49 78.407 1.660 -6.120 378 HB3 ASP 49 HB3 ASP 49 78.079 1.219 -7.775 379 H GLY 50 H GLY 50 75.755 4.684 -6.161 380 HA2 GLY 50 HA2 GLY 50 74.325 3.163 -4.293 381 HA3 GLY 50 HA3 GLY 50 73.707 4.519 -5.204 382 H THR 51 H THR 51 73.253 3.798 -7.453 383 HA THR 51 HA THR 51 71.206 1.906 -6.753 384 HB THR 51 HB THR 51 71.334 3.071 -9.538 385 HG1 THR 51 HG1 THR 51 70.254 4.233 -7.128 386 HG21 THR 51 HG21 THR 51 68.918 2.804 -9.327 387 HG22 THR 51 HG22 THR 51 69.082 2.354 -7.639 388 HG23 THR 51 HG23 THR 51 69.704 1.280 -8.877 389 H ALA 52 H ALA 52 74.144 1.804 -8.510 390 HA ALA 52 HA ALA 52 73.802 -0.658 -9.895 391 HB1 ALA 52 HB1 ALA 52 76.329 0.495 -8.718 392 HB2 ALA 52 HB2 ALA 52 75.688 0.923 -10.300 393 HB3 ALA 52 HB3 ALA 52 76.220 -0.728 -9.982 394 H LEU 53 H LEU 53 74.641 0.098 -6.576 395 HA LEU 53 HA LEU 53 75.277 -2.539 -5.820 396 HB2 LEU 53 HB2 LEU 53 74.039 -0.390 -4.131 397 HB3 LEU 53 HB3 LEU 53 74.661 -1.904 -3.519 398 HG LEU 53 HG LEU 53 76.184 0.415 -4.645 399 HD11 LEU 53 HD11 LEU 53 75.521 0.551 -2.360 400 HD12 LEU 53 HD12 LEU 53 77.266 0.328 -2.494 401 HD13 LEU 53 HD13 LEU 53 76.236 -1.027 -2.026 402 HD21 LEU 53 HD21 LEU 53 78.219 -0.953 -4.330 403 HD22 LEU 53 HD22 LEU 53 77.183 -1.564 -5.616 404 HD23 LEU 53 HD23 LEU 53 77.198 -2.370 -4.047 405 H ILE 54 H ILE 54 72.307 -0.871 -6.111 406 HA ILE 54 HA ILE 54 70.733 -2.890 -4.848 407 HB ILE 54 HB ILE 54 70.081 -0.581 -6.652 408 HG12 ILE 54 HG12 ILE 54 68.849 -1.281 -4.036 409 HG13 ILE 54 HG13 ILE 54 70.367 -0.460 -3.990 410 HG21 ILE 54 HG21 ILE 54 67.679 -1.140 -6.557 411 HG22 ILE 54 HG22 ILE 54 68.086 -2.693 -5.829 412 HG23 ILE 54 HG23 ILE 54 68.612 -2.325 -7.471 413 HD11 ILE 54 HD11 ILE 54 68.663 1.152 -3.770 414 HD12 ILE 54 HD12 ILE 54 67.746 0.475 -5.114 415 HD13 ILE 54 HD13 ILE 54 69.259 1.326 -5.419 416 H TYR 55 H TYR 55 71.636 -2.127 -8.110 417 HA TYR 55 HA TYR 55 70.203 -4.166 -9.335 418 HB2 TYR 55 HB2 TYR 55 72.420 -2.398 -10.163 419 HB3 TYR 55 HB3 TYR 55 71.980 -3.737 -11.198 420 HD1 TYR 55 HD1 TYR 55 69.373 -3.923 -11.673 421 HD2 TYR 55 HD2 TYR 55 71.315 -0.364 -10.420 422 HE1 TYR 55 HE1 TYR 55 67.483 -2.609 -12.506 423 HE2 TYR 55 HE2 TYR 55 69.427 0.968 -11.252 424 HH TYR 55 HH TYR 55 66.463 -0.450 -12.091 425 H GLU 56 H GLU 56 73.603 -4.140 -8.251 426 HA GLU 56 HA GLU 56 73.982 -6.808 -9.122 427 HB2 GLU 56 HB2 GLU 56 75.918 -6.786 -7.403 428 HB3 GLU 56 HB3 GLU 56 76.085 -5.802 -8.827 429 HG2 GLU 56 HG2 GLU 56 75.490 -3.845 -7.566 430 HG3 GLU 56 HG3 GLU 56 75.223 -4.778 -6.111 431 H ALA 57 H ALA 57 73.108 -5.461 -5.967 432 HA ALA 57 HA ALA 57 73.146 -7.911 -4.621 433 HB1 ALA 57 HB1 ALA 57 71.825 -6.841 -2.901 434 HB2 ALA 57 HB2 ALA 57 71.420 -5.521 -3.998 435 HB3 ALA 57 HB3 ALA 57 73.088 -5.748 -3.466 436 H ALA 58 H ALA 58 70.571 -6.307 -6.414 437 HA ALA 58 HA ALA 58 68.499 -8.052 -5.727 438 HB1 ALA 58 HB1 ALA 58 68.827 -6.526 -8.306 439 HB2 ALA 58 HB2 ALA 58 68.129 -5.889 -6.818 440 HB3 ALA 58 HB3 ALA 58 67.321 -7.198 -7.682 441 H ALA 59 H ALA 59 70.784 -8.198 -8.429 442 HA ALA 59 HA ALA 59 69.642 -10.505 -9.628 443 HB1 ALA 59 HB1 ALA 59 71.738 -10.643 -10.906 444 HB2 ALA 59 HB2 ALA 59 72.465 -9.447 -9.833 445 HB3 ALA 59 HB3 ALA 59 71.113 -8.995 -10.871 446 H ARG 60 H ARG 60 72.242 -9.974 -7.384 447 HA ARG 60 HA ARG 60 73.084 -12.646 -7.091 448 HB2 ARG 60 HB2 ARG 60 73.455 -10.198 -5.382 449 HB3 ARG 60 HB3 ARG 60 74.225 -11.748 -5.037 450 HG2 ARG 60 HG2 ARG 60 75.488 -11.656 -7.028 451 HG3 ARG 60 HG3 ARG 60 74.524 -10.323 -7.656 452 HD2 ARG 60 HD2 ARG 60 75.372 -8.848 -6.002 453 HD3 ARG 60 HD3 ARG 60 76.268 -10.103 -5.186 454 HE ARG 60 HE ARG 60 77.172 -10.150 -7.745 455 HH11 ARG 60 HH11 ARG 60 76.951 -7.746 -5.181 456 HH12 ARG 60 HH12 ARG 60 78.188 -6.776 -5.765 457 HH21 ARG 60 HH21 ARG 60 78.980 -8.905 -8.518 458 HH22 ARG 60 HH22 ARG 60 79.444 -7.487 -7.693 459 H ALA 61 H ALA 61 70.633 -10.763 -5.549 460 HA ALA 61 HA ALA 61 70.065 -12.710 -3.530 461 HB1 ALA 61 HB1 ALA 61 68.187 -11.329 -2.997 462 HB2 ALA 61 HB2 ALA 61 68.339 -10.465 -4.526 463 HB3 ALA 61 HB3 ALA 61 69.592 -10.300 -3.296 464 H ALA 62 H ALA 62 68.778 -11.928 -6.715 465 HA ALA 62 HA ALA 62 66.537 -13.617 -6.653 466 HB1 ALA 62 HB1 ALA 62 68.201 -12.802 -9.042 467 HB2 ALA 62 HB2 ALA 62 66.869 -11.876 -8.350 468 HB3 ALA 62 HB3 ALA 62 66.559 -13.450 -9.090 469 H ALA 63 H ALA 63 69.799 -14.203 -7.889 470 HA ALA 63 HA ALA 63 69.327 -17.061 -7.388 471 HB1 ALA 63 HB1 ALA 63 71.173 -17.512 -8.950 472 HB2 ALA 63 HB2 ALA 63 71.277 -15.794 -9.328 473 HB3 ALA 63 HB3 ALA 63 69.827 -16.712 -9.770 474 H ASN 64 H ASN 64 69.859 -16.792 -5.238 475 HA ASN 64 HA ASN 64 72.270 -15.439 -4.574 476 HB2 ASN 64 HB2 ASN 64 70.393 -15.296 -3.041 477 HB3 ASN 64 HB3 ASN 64 70.455 -17.039 -2.772 478 HD21 ASN 64 HD21 ASN 64 72.123 -14.040 -2.302 479 HD22 ASN 64 HD22 ASN 64 73.182 -14.589 -1.054 480 HA PRO 65 HA PRO 65 74.674 -19.166 -4.586 481 HB2 PRO 65 HB2 PRO 65 76.923 -18.128 -5.510 482 HB3 PRO 65 HB3 PRO 65 75.487 -18.196 -6.546 483 HG2 PRO 65 HG2 PRO 65 76.688 -15.859 -5.146 484 HG3 PRO 65 HG3 PRO 65 75.851 -15.929 -6.704 485 HD2 PRO 65 HD2 PRO 65 74.734 -15.227 -4.164 486 HD3 PRO 65 HD3 PRO 65 73.887 -15.414 -5.717 487 H GLY 66 H GLY 66 74.216 -17.284 -2.243 488 HA2 GLY 66 HA2 GLY 66 75.211 -17.079 -0.126 489 HA3 GLY 66 HA3 GLY 66 76.785 -17.444 -0.860 490 H GLY 67 H GLY 67 77.845 -15.924 -2.036 491 HA2 GLY 67 HA2 GLY 67 78.304 -13.899 -3.004 492 HA3 GLY 67 HA3 GLY 67 76.664 -13.407 -2.623 493 H ASP 68 H ASP 68 78.235 -11.504 -2.389 494 HA ASP 68 HA ASP 68 79.065 -11.231 0.423 495 HB2 ASP 68 HB2 ASP 68 80.679 -10.547 -1.432 496 HB3 ASP 68 HB3 ASP 68 79.507 -9.318 -1.877 497 H GLY 69 H GLY 69 77.405 -9.500 -2.147 498 HA2 GLY 69 HA2 GLY 69 75.431 -8.560 -0.184 499 HA3 GLY 69 HA3 GLY 69 75.894 -7.648 -1.622 500 H GLY 70 H GLY 70 74.447 -10.657 -0.534 501 HA2 GLY 70 HA2 GLY 70 73.241 -10.921 -3.206 502 HA3 GLY 70 HA3 GLY 70 73.665 -12.288 -2.180 503 H GLY 71 H GLY 71 72.057 -9.257 -1.360 504 HA2 GLY 71 HA2 GLY 71 69.498 -10.036 -1.312 505 HA3 GLY 71 HA3 GLY 71 70.159 -10.600 0.216 506 HA PRO 72 HA PRO 72 68.939 -6.047 0.223 507 HB2 PRO 72 HB2 PRO 72 67.177 -6.440 2.335 508 HB3 PRO 72 HB3 PRO 72 66.748 -6.276 0.628 509 HG2 PRO 72 HG2 PRO 72 66.994 -8.741 2.276 510 HG3 PRO 72 HG3 PRO 72 65.867 -8.375 0.959 511 HD2 PRO 72 HD2 PRO 72 68.018 -9.969 0.642 512 HD3 PRO 72 HD3 PRO 72 67.424 -8.962 -0.679 513 H GLU 73 H GLU 73 69.366 -8.378 2.805 514 HA GLU 73 HA GLU 73 70.406 -6.420 4.569 515 HB2 GLU 73 HB2 GLU 73 70.555 -9.422 4.738 516 HB3 GLU 73 HB3 GLU 73 70.826 -8.300 6.069 517 HG2 GLU 73 HG2 GLU 73 68.521 -7.572 5.942 518 HG3 GLU 73 HG3 GLU 73 68.233 -8.630 4.573 519 H GLY 74 H GLY 74 71.775 -7.612 1.901 520 HA2 GLY 74 HA2 GLY 74 74.375 -7.293 3.151 521 HA3 GLY 74 HA3 GLY 74 74.175 -8.194 1.620 522 H ILE 75 H ILE 75 72.239 -5.739 1.067 523 HA ILE 75 HA ILE 75 74.124 -4.223 -0.456 524 HB ILE 75 HB ILE 75 71.625 -2.809 0.318 525 HG12 ILE 75 HG12 ILE 75 71.495 -5.530 -1.066 526 HG13 ILE 75 HG13 ILE 75 70.700 -4.955 0.340 527 HG21 ILE 75 HG21 ILE 75 72.885 -3.462 -2.341 528 HG22 ILE 75 HG22 ILE 75 73.082 -1.968 -1.427 529 HG23 ILE 75 HG23 ILE 75 71.507 -2.389 -2.099 530 HD11 ILE 75 HD11 ILE 75 69.252 -3.500 -0.831 531 HD12 ILE 75 HD12 ILE 75 69.173 -5.086 -1.591 532 HD13 ILE 75 HD13 ILE 75 70.094 -3.788 -2.351 533 H VAL 76 H VAL 76 72.427 -3.779 2.494 534 HA VAL 76 HA VAL 76 73.257 -1.274 3.391 535 HB VAL 76 HB VAL 76 71.528 -2.399 4.459 536 HG11 VAL 76 HG11 VAL 76 71.782 -4.426 5.805 537 HG12 VAL 76 HG12 VAL 76 73.161 -4.752 4.714 538 HG13 VAL 76 HG13 VAL 76 71.542 -4.390 4.071 539 HG21 VAL 76 HG21 VAL 76 72.757 -0.992 6.048 540 HG22 VAL 76 HG22 VAL 76 73.789 -2.365 6.450 541 HG23 VAL 76 HG23 VAL 76 72.078 -2.401 6.868 542 H LYS 77 H LYS 77 74.601 -4.327 3.902 543 HA LYS 77 HA LYS 77 76.791 -3.709 5.516 544 HB2 LYS 77 HB2 LYS 77 76.096 -6.009 4.974 545 HB3 LYS 77 HB3 LYS 77 76.712 -5.799 3.348 546 HG2 LYS 77 HG2 LYS 77 78.984 -5.412 4.365 547 HG3 LYS 77 HG3 LYS 77 78.284 -5.911 5.910 548 HD2 LYS 77 HD2 LYS 77 79.227 -7.874 5.022 549 HD3 LYS 77 HD3 LYS 77 77.484 -7.954 4.713 550 HE2 LYS 77 HE2 LYS 77 78.628 -8.675 2.718 551 HE3 LYS 77 HE3 LYS 77 77.885 -7.118 2.405 552 HZ1 LYS 77 HZ1 LYS 77 80.741 -7.596 3.027 553 HZ2 LYS 77 HZ2 LYS 77 80.122 -6.071 2.718 554 HZ3 LYS 77 HZ3 LYS 77 80.109 -7.267 1.512 555 H GLU 78 H GLU 78 76.625 -3.867 1.961 556 HA GLU 78 HA GLU 78 79.272 -3.175 1.379 557 HB2 GLU 78 HB2 GLU 78 77.646 -4.097 -0.259 558 HB3 GLU 78 HB3 GLU 78 76.753 -2.596 -0.255 559 HG2 GLU 78 HG2 GLU 78 78.089 -2.713 -2.211 560 HG3 GLU 78 HG3 GLU 78 78.735 -1.454 -1.162 561 H ILE 79 H ILE 79 76.459 -1.222 2.095 562 HA ILE 79 HA ILE 79 77.651 1.304 1.523 563 HB ILE 79 HB ILE 79 75.257 0.730 3.325 564 HG12 ILE 79 HG12 ILE 79 74.943 -0.011 0.941 565 HG13 ILE 79 HG13 ILE 79 73.872 1.313 1.407 566 HG21 ILE 79 HG21 ILE 79 76.272 2.854 3.821 567 HG22 ILE 79 HG22 ILE 79 74.693 3.037 3.070 568 HG23 ILE 79 HG23 ILE 79 76.156 3.318 2.121 569 HD11 ILE 79 HD11 ILE 79 75.422 2.856 0.257 570 HD12 ILE 79 HD12 ILE 79 74.700 1.644 -0.796 571 HD13 ILE 79 HD13 ILE 79 76.368 1.455 -0.262 572 H LYS 80 H LYS 80 77.212 -0.524 4.526 573 HA LYS 80 HA LYS 80 78.231 1.557 6.143 574 HB2 LYS 80 HB2 LYS 80 78.178 0.054 8.010 575 HB3 LYS 80 HB3 LYS 80 76.842 -0.420 6.989 576 HG2 LYS 80 HG2 LYS 80 78.192 -2.255 6.108 577 HG3 LYS 80 HG3 LYS 80 79.463 -1.825 7.238 578 HD2 LYS 80 HD2 LYS 80 77.818 -2.044 9.098 579 HD3 LYS 80 HD3 LYS 80 76.653 -2.672 7.931 580 HE2 LYS 80 HE2 LYS 80 77.670 -4.532 9.032 581 HE3 LYS 80 HE3 LYS 80 78.296 -4.467 7.386 582 HZ1 LYS 80 HZ1 LYS 80 80.084 -4.883 8.902 583 HZ2 LYS 80 HZ2 LYS 80 79.665 -3.610 9.864 584 HZ3 LYS 80 HZ3 LYS 80 80.311 -3.312 8.336 585 H GLU 81 H GLU 81 79.762 -1.071 4.469 586 HA GLU 81 HA GLU 81 82.298 -0.731 5.641 587 HB2 GLU 81 HB2 GLU 81 81.526 -1.946 2.999 588 HB3 GLU 81 HB3 GLU 81 83.110 -2.106 3.748 589 HG2 GLU 81 HG2 GLU 81 82.135 -3.286 5.619 590 HG3 GLU 81 HG3 GLU 81 80.520 -3.076 4.943 591 H TRP 82 H TRP 82 80.776 0.594 2.772 592 HA TRP 82 HA TRP 82 83.005 1.965 1.681 593 HB2 TRP 82 HB2 TRP 82 80.723 1.524 0.590 594 HB3 TRP 82 HB3 TRP 82 80.182 2.858 1.621 595 HD1 TRP 82 HD1 TRP 82 82.653 2.255 -1.274 596 HE1 TRP 82 HE1 TRP 82 82.931 4.438 -2.555 597 HE3 TRP 82 HE3 TRP 82 79.873 5.316 1.740 598 HZ2 TRP 82 HZ2 TRP 82 82.092 7.112 -2.349 599 HZ3 TRP 82 HZ3 TRP 82 79.662 7.685 1.131 600 HH2 TRP 82 HH2 TRP 82 80.755 8.578 -0.871 601 H ARG 83 H ARG 83 80.377 2.867 3.771 602 HA ARG 83 HA ARG 83 80.812 5.613 3.943 603 HB2 ARG 83 HB2 ARG 83 78.833 4.025 4.743 604 HB3 ARG 83 HB3 ARG 83 79.824 4.043 6.208 605 HG2 ARG 83 HG2 ARG 83 78.211 5.679 6.551 606 HG3 ARG 83 HG3 ARG 83 79.767 6.432 6.169 607 HD2 ARG 83 HD2 ARG 83 79.066 6.970 3.945 608 HD3 ARG 83 HD3 ARG 83 77.553 6.083 4.155 609 HE ARG 83 HE ARG 83 77.596 7.926 6.183 610 HH11 ARG 83 HH11 ARG 83 77.478 8.175 2.586 611 HH12 ARG 83 HH12 ARG 83 76.767 9.707 2.686 612 HH21 ARG 83 HH21 ARG 83 76.625 10.035 6.142 613 HH22 ARG 83 HH22 ARG 83 76.292 10.744 4.635 614 H ALA 84 H ALA 84 81.816 2.918 6.027 615 HA ALA 84 HA ALA 84 83.218 4.483 7.905 616 HB1 ALA 84 HB1 ALA 84 83.543 1.552 7.242 617 HB2 ALA 84 HB2 ALA 84 82.379 2.216 8.377 618 HB3 ALA 84 HB3 ALA 84 84.108 2.352 8.711 619 H ALA 85 H ALA 85 84.233 2.737 4.990 620 HA ALA 85 HA ALA 85 87.005 3.162 5.310 621 HB1 ALA 85 HB1 ALA 85 87.208 2.463 3.007 622 HB2 ALA 85 HB2 ALA 85 85.474 2.676 2.767 623 HB3 ALA 85 HB3 ALA 85 86.066 1.425 3.859 624 H ASN 86 H ASN 86 84.488 5.016 3.752 625 HA ASN 86 HA ASN 86 86.245 6.993 2.640 626 HB2 ASN 86 HB2 ASN 86 83.859 6.705 1.862 627 HB3 ASN 86 HB3 ASN 86 83.326 7.295 3.428 628 HD21 ASN 86 HD21 ASN 86 84.325 8.206 0.273 629 HD22 ASN 86 HD22 ASN 86 84.381 9.895 0.571 630 H GLY 87 H GLY 87 84.283 6.733 5.556 631 HA2 GLY 87 HA2 GLY 87 85.128 7.540 7.660 632 HA3 GLY 87 HA3 GLY 87 85.908 8.854 6.773 633 H LYS 88 H LYS 88 82.544 7.581 6.440 634 HA LYS 88 HA LYS 88 81.593 10.224 7.055 635 HB2 LYS 88 HB2 LYS 88 80.943 8.079 5.112 636 HB3 LYS 88 HB3 LYS 88 79.724 9.217 5.616 637 HG2 LYS 88 HG2 LYS 88 81.028 11.040 4.683 638 HG3 LYS 88 HG3 LYS 88 82.372 9.941 4.346 639 HD2 LYS 88 HD2 LYS 88 80.961 8.708 2.775 640 HD3 LYS 88 HD3 LYS 88 79.615 9.792 3.093 641 HE2 LYS 88 HE2 LYS 88 82.284 10.594 1.960 642 HE3 LYS 88 HE3 LYS 88 80.862 10.325 0.989 643 HZ1 LYS 88 HZ1 LYS 88 79.785 12.157 2.251 644 HZ2 LYS 88 HZ2 LYS 88 81.108 12.657 1.378 645 HZ3 LYS 88 HZ3 LYS 88 81.245 12.467 3.047 646 HA PRO 89 HA PRO 89 79.354 8.008 10.279 647 HB2 PRO 89 HB2 PRO 89 77.139 9.657 10.392 648 HB3 PRO 89 HB3 PRO 89 78.644 9.985 11.246 649 HG2 PRO 89 HG2 PRO 89 77.624 11.123 8.688 650 HG3 PRO 89 HG3 PRO 89 78.565 11.909 9.964 651 HD2 PRO 89 HD2 PRO 89 79.637 11.087 7.611 652 HD3 PRO 89 HD3 PRO 89 80.563 11.129 9.125 653 H GLY 90 H GLY 90 78.241 6.220 9.907 654 HA2 GLY 90 HA2 GLY 90 76.558 6.140 7.540 655 HA3 GLY 90 HA3 GLY 90 77.146 4.746 8.443 656 H PHE 91 H PHE 91 75.707 3.744 9.477 657 HA PHE 91 HA PHE 91 73.024 4.772 9.660 658 HB2 PHE 91 HB2 PHE 91 74.159 2.088 10.453 659 HB3 PHE 91 HB3 PHE 91 72.455 2.490 10.263 660 HD1 PHE 91 HD1 PHE 91 71.696 3.269 7.965 661 HD2 PHE 91 HD2 PHE 91 75.383 1.276 8.655 662 HE1 PHE 91 HE1 PHE 91 71.823 2.672 5.603 663 HE2 PHE 91 HE2 PHE 91 75.497 0.686 6.257 664 HZ PHE 91 HZ PHE 91 73.721 1.386 4.750 665 H LYS 92 H LYS 92 71.804 4.531 11.682 666 HA LYS 92 HA LYS 92 73.408 5.310 13.907 667 HB2 LYS 92 HB2 LYS 92 71.332 5.797 14.932 668 HB3 LYS 92 HB3 LYS 92 71.308 6.459 13.335 669 HG2 LYS 92 HG2 LYS 92 69.869 4.726 12.565 670 HG3 LYS 92 HG3 LYS 92 70.091 3.837 14.075 671 HD2 LYS 92 HD2 LYS 92 68.809 6.559 13.878 672 HD3 LYS 92 HD3 LYS 92 67.918 5.036 13.892 673 HE2 LYS 92 HE2 LYS 92 68.871 4.511 16.108 674 HE3 LYS 92 HE3 LYS 92 69.727 6.048 16.093 675 HZ1 LYS 92 HZ1 LYS 92 67.644 7.209 16.091 676 HZ2 LYS 92 HZ2 LYS 92 67.660 6.134 17.363 677 HZ3 LYS 92 HZ3 LYS 92 66.780 5.774 15.974 678 H GLN 93 H GLN 93 72.701 4.206 15.990 679 HA GLN 93 HA GLN 93 72.885 1.360 15.474 680 HB2 GLN 93 HB2 GLN 93 73.720 3.243 17.506 681 HB3 GLN 93 HB3 GLN 93 73.572 1.558 17.990 682 HG2 GLN 93 HG2 GLN 93 75.916 2.040 17.486 683 HG3 GLN 93 HG3 GLN 93 75.283 1.003 16.219 684 HE21 GLN 93 HE21 GLN 93 75.194 1.786 14.134 685 HE22 GLN 93 HE22 GLN 93 75.865 3.297 13.655 686 H GLY 94 H GLY 94 71.425 0.131 16.105 687 HA2 GLY 94 HA2 GLY 94 69.823 0.110 18.289 688 HA3 GLY 94 HA3 GLY 94 68.905 0.985 17.054 Start of MODEL 15 1 H GLU 2 H GLU 2 60.301 3.086 9.068 2 HA GLU 2 HA GLU 2 58.859 4.857 7.192 3 HB2 GLU 2 HB2 GLU 2 59.933 5.341 9.973 4 HB3 GLU 2 HB3 GLU 2 59.363 6.605 8.894 5 HG2 GLU 2 HG2 GLU 2 57.705 4.327 9.929 6 HG3 GLU 2 HG3 GLU 2 57.686 5.983 10.537 7 H LEU 3 H LEU 3 60.082 6.400 6.162 8 HA LEU 3 HA LEU 3 62.833 5.587 5.726 9 HB2 LEU 3 HB2 LEU 3 61.187 7.701 4.329 10 HB3 LEU 3 HB3 LEU 3 62.727 7.072 3.807 11 HG LEU 3 HG LEU 3 60.088 5.649 3.825 12 HD11 LEU 3 HD11 LEU 3 60.378 7.237 1.950 13 HD12 LEU 3 HD12 LEU 3 60.426 5.588 1.345 14 HD13 LEU 3 HD13 LEU 3 61.915 6.488 1.553 15 HD21 LEU 3 HD21 LEU 3 61.256 3.766 2.805 16 HD22 LEU 3 HD22 LEU 3 61.831 4.090 4.444 17 HD23 LEU 3 HD23 LEU 3 62.797 4.597 3.055 18 H LYS 4 H LYS 4 64.526 6.981 6.024 19 HA LYS 4 HA LYS 4 64.013 9.440 7.552 20 HB2 LYS 4 HB2 LYS 4 66.701 8.133 7.255 21 HB3 LYS 4 HB3 LYS 4 66.119 9.174 8.561 22 HG2 LYS 4 HG2 LYS 4 65.735 6.254 8.021 23 HG3 LYS 4 HG3 LYS 4 66.473 6.984 9.424 24 HD2 LYS 4 HD2 LYS 4 64.134 7.957 9.813 25 HD3 LYS 4 HD3 LYS 4 63.635 6.760 8.642 26 HE2 LYS 4 HE2 LYS 4 65.026 5.091 10.005 27 HE3 LYS 4 HE3 LYS 4 64.901 6.265 11.280 28 HZ1 LYS 4 HZ1 LYS 4 63.139 4.534 11.317 29 HZ2 LYS 4 HZ2 LYS 4 62.492 5.227 9.927 30 HZ3 LYS 4 HZ3 LYS 4 62.581 6.124 11.371 31 H ASN 5 H ASN 5 65.176 11.336 6.754 32 HA ASN 5 HA ASN 5 65.580 11.131 3.881 33 HB2 ASN 5 HB2 ASN 5 64.480 13.141 5.313 34 HB3 ASN 5 HB3 ASN 5 66.155 13.701 5.220 35 HD21 ASN 5 HD21 ASN 5 64.445 11.863 2.768 36 HD22 ASN 5 HD22 ASN 5 64.410 13.079 1.571 37 H SER 6 H SER 6 67.514 10.600 6.433 38 HA SER 6 HA SER 6 69.858 10.801 4.774 39 HB2 SER 6 HB2 SER 6 71.203 11.825 6.629 40 HB3 SER 6 HB3 SER 6 70.003 12.921 5.950 41 HG SER 6 HG SER 6 68.634 11.999 7.756 42 H ILE 7 H ILE 7 71.647 9.491 5.698 43 HA ILE 7 HA ILE 7 70.574 6.972 6.491 44 HB ILE 7 HB ILE 7 72.518 7.331 4.910 45 HG12 ILE 7 HG12 ILE 7 73.859 5.370 5.744 46 HG13 ILE 7 HG13 ILE 7 72.914 5.430 7.227 47 HG21 ILE 7 HG21 ILE 7 73.753 8.981 6.193 48 HG22 ILE 7 HG22 ILE 7 74.758 7.577 5.834 49 HG23 ILE 7 HG23 ILE 7 74.074 7.780 7.444 50 HD11 ILE 7 HD11 ILE 7 71.816 4.959 4.463 51 HD12 ILE 7 HD12 ILE 7 70.879 4.971 5.960 52 HD13 ILE 7 HD13 ILE 7 72.099 3.730 5.689 53 H SER 8 H SER 8 71.512 9.634 8.297 54 HA SER 8 HA SER 8 72.899 8.274 10.394 55 HB2 SER 8 HB2 SER 8 73.348 10.653 9.724 56 HB3 SER 8 HB3 SER 8 71.791 11.095 10.426 57 HG SER 8 HG SER 8 74.082 10.045 11.672 58 H ASP 9 H ASP 9 69.624 8.687 9.646 59 HA ASP 9 HA ASP 9 68.859 8.211 12.459 60 HB2 ASP 9 HB2 ASP 9 67.730 10.042 10.882 61 HB3 ASP 9 HB3 ASP 9 66.898 8.666 10.245 62 H TYR 10 H TYR 10 69.903 6.517 10.034 63 HA TYR 10 HA TYR 10 67.766 4.521 9.931 64 HB2 TYR 10 HB2 TYR 10 69.915 5.267 8.014 65 HB3 TYR 10 HB3 TYR 10 69.556 3.559 8.146 66 HD1 TYR 10 HD1 TYR 10 67.084 2.871 7.805 67 HD2 TYR 10 HD2 TYR 10 68.650 6.630 6.573 68 HE1 TYR 10 HE1 TYR 10 65.201 3.139 6.211 69 HE2 TYR 10 HE2 TYR 10 66.774 6.881 4.991 70 HH TYR 10 HH TYR 10 65.090 5.595 3.857 71 H THR 11 H THR 11 68.030 2.864 11.281 72 HA THR 11 HA THR 11 70.689 2.153 12.129 73 HB THR 11 HB THR 11 69.636 0.397 13.443 74 HG1 THR 11 HG1 THR 11 67.697 -0.392 13.058 75 HG21 THR 11 HG21 THR 11 67.792 1.534 14.651 76 HG22 THR 11 HG22 THR 11 67.831 2.818 13.436 77 HG23 THR 11 HG23 THR 11 69.234 2.518 14.468 78 H GLU 12 H GLU 12 71.372 -0.138 11.582 79 HA GLU 12 HA GLU 12 71.291 -0.588 8.864 80 HB2 GLU 12 HB2 GLU 12 71.979 -2.991 9.609 81 HB3 GLU 12 HB3 GLU 12 73.058 -1.625 9.878 82 HG2 GLU 12 HG2 GLU 12 72.363 -1.459 12.149 83 HG3 GLU 12 HG3 GLU 12 71.170 -2.699 11.988 84 H ALA 13 H ALA 13 69.248 -2.015 11.388 85 HA ALA 13 HA ALA 13 67.873 -3.653 9.555 86 HB1 ALA 13 HB1 ALA 13 66.947 -2.799 12.298 87 HB2 ALA 13 HB2 ALA 13 67.963 -4.195 11.937 88 HB3 ALA 13 HB3 ALA 13 66.301 -4.143 11.356 89 H GLU 14 H GLU 14 67.186 -0.373 10.804 90 HA GLU 14 HA GLU 14 64.612 0.047 9.745 91 HB2 GLU 14 HB2 GLU 14 66.981 1.885 10.001 92 HB3 GLU 14 HB3 GLU 14 65.472 2.512 9.403 93 HG2 GLU 14 HG2 GLU 14 65.999 1.293 12.107 94 HG3 GLU 14 HG3 GLU 14 65.794 3.006 11.745 95 H PHE 15 H PHE 15 67.763 0.204 8.368 96 HA PHE 15 HA PHE 15 66.952 1.142 5.848 97 HB2 PHE 15 HB2 PHE 15 69.223 1.374 6.965 98 HB3 PHE 15 HB3 PHE 15 69.493 -0.295 6.503 99 HD1 PHE 15 HD1 PHE 15 68.118 2.722 4.814 100 HD2 PHE 15 HD2 PHE 15 70.869 -0.505 4.699 101 HE1 PHE 15 HE1 PHE 15 68.923 3.469 2.626 102 HE2 PHE 15 HE2 PHE 15 71.657 0.244 2.517 103 HZ PHE 15 HZ PHE 15 70.679 2.231 1.489 104 H VAL 16 H VAL 16 67.758 -2.103 7.154 105 HA VAL 16 HA VAL 16 67.552 -3.335 4.652 106 HB VAL 16 HB VAL 16 67.630 -5.463 5.598 107 HG11 VAL 16 HG11 VAL 16 69.590 -4.337 5.829 108 HG12 VAL 16 HG12 VAL 16 69.385 -5.487 7.157 109 HG13 VAL 16 HG13 VAL 16 69.161 -3.749 7.435 110 HG21 VAL 16 HG21 VAL 16 66.634 -4.362 8.176 111 HG22 VAL 16 HG22 VAL 16 67.218 -6.034 7.875 112 HG23 VAL 16 HG23 VAL 16 65.801 -5.412 7.013 113 H GLN 17 H GLN 17 65.023 -2.450 6.889 114 HA GLN 17 HA GLN 17 62.959 -3.989 5.772 115 HB2 GLN 17 HB2 GLN 17 62.619 -2.998 7.907 116 HB3 GLN 17 HB3 GLN 17 63.126 -1.417 7.341 117 HG2 GLN 17 HG2 GLN 17 60.774 -1.459 7.718 118 HG3 GLN 17 HG3 GLN 17 61.161 -1.258 6.005 119 HE21 GLN 17 HE21 GLN 17 59.208 -1.973 5.295 120 HE22 GLN 17 HE22 GLN 17 58.692 -3.622 5.382 121 H LEU 18 H LEU 18 64.207 -0.754 5.135 122 HA LEU 18 HA LEU 18 62.521 -0.063 3.009 123 HB2 LEU 18 HB2 LEU 18 63.833 1.566 3.994 124 HB3 LEU 18 HB3 LEU 18 65.318 0.777 3.799 125 HG LEU 18 HG LEU 18 65.087 1.028 1.288 126 HD11 LEU 18 HD11 LEU 18 63.610 2.750 0.434 127 HD12 LEU 18 HD12 LEU 18 62.835 2.843 2.017 128 HD13 LEU 18 HD13 LEU 18 62.750 1.353 1.079 129 HD21 LEU 18 HD21 LEU 18 66.540 2.455 2.591 130 HD22 LEU 18 HD22 LEU 18 65.197 3.568 2.889 131 HD23 LEU 18 HD23 LEU 18 65.807 3.320 1.245 132 H LEU 19 H LEU 19 65.590 -1.561 3.160 133 HA LEU 19 HA LEU 19 66.226 -1.952 0.477 134 HB2 LEU 19 HB2 LEU 19 66.757 -3.374 2.914 135 HB3 LEU 19 HB3 LEU 19 67.586 -3.878 1.409 136 HG LEU 19 HG LEU 19 67.801 -1.364 3.055 137 HD11 LEU 19 HD11 LEU 19 69.788 -3.290 2.000 138 HD12 LEU 19 HD12 LEU 19 69.286 -3.060 3.680 139 HD13 LEU 19 HD13 LEU 19 70.165 -1.784 2.818 140 HD21 LEU 19 HD21 LEU 19 69.222 -0.418 1.331 141 HD22 LEU 19 HD22 LEU 19 67.524 -0.532 0.889 142 HD23 LEU 19 HD23 LEU 19 68.696 -1.696 0.217 143 H LYS 20 H LYS 20 64.430 -4.069 2.640 144 HA LYS 20 HA LYS 20 63.971 -6.134 0.800 145 HB2 LYS 20 HB2 LYS 20 62.423 -5.228 3.213 146 HB3 LYS 20 HB3 LYS 20 61.986 -6.645 2.288 147 HG2 LYS 20 HG2 LYS 20 64.214 -7.599 2.781 148 HG3 LYS 20 HG3 LYS 20 64.547 -6.182 3.756 149 HD2 LYS 20 HD2 LYS 20 62.747 -6.633 5.252 150 HD3 LYS 20 HD3 LYS 20 62.181 -7.971 4.255 151 HE2 LYS 20 HE2 LYS 20 64.889 -7.910 5.573 152 HE3 LYS 20 HE3 LYS 20 63.457 -8.606 6.326 153 HZ1 LYS 20 HZ1 LYS 20 64.572 -9.544 3.710 154 HZ2 LYS 20 HZ2 LYS 20 63.309 -10.222 4.597 155 HZ3 LYS 20 HZ3 LYS 20 64.849 -10.249 5.215 156 H GLU 21 H GLU 21 62.310 -3.140 1.447 157 HA GLU 21 HA GLU 21 60.167 -3.775 -0.297 158 HB2 GLU 21 HB2 GLU 21 60.892 -1.270 1.173 159 HB3 GLU 21 HB3 GLU 21 59.503 -1.370 0.096 160 HG2 GLU 21 HG2 GLU 21 59.958 -3.149 2.480 161 HG3 GLU 21 HG3 GLU 21 58.915 -1.729 2.466 162 H ILE 22 H ILE 22 63.163 -1.998 -0.612 163 HA ILE 22 HA ILE 22 62.607 -0.907 -3.140 164 HB ILE 22 HB ILE 22 65.333 -1.934 -2.267 165 HG12 ILE 22 HG12 ILE 22 63.996 0.727 -1.745 166 HG13 ILE 22 HG13 ILE 22 64.468 -0.459 -0.555 167 HG21 ILE 22 HG21 ILE 22 66.135 -0.144 -3.791 168 HG22 ILE 22 HG22 ILE 22 64.464 0.186 -4.237 169 HG23 ILE 22 HG23 ILE 22 65.186 -1.375 -4.629 170 HD11 ILE 22 HD11 ILE 22 66.374 1.090 -2.288 171 HD12 ILE 22 HD12 ILE 22 66.822 -0.117 -1.088 172 HD13 ILE 22 HD13 ILE 22 66.049 1.387 -0.580 173 H GLU 23 H GLU 23 63.875 -4.039 -2.163 174 HA GLU 23 HA GLU 23 64.242 -5.238 -4.645 175 HB2 GLU 23 HB2 GLU 23 63.264 -6.308 -2.065 176 HB3 GLU 23 HB3 GLU 23 63.536 -7.351 -3.429 177 HG2 GLU 23 HG2 GLU 23 65.951 -6.264 -3.326 178 HG3 GLU 23 HG3 GLU 23 65.429 -5.858 -1.686 179 H LYS 24 H LYS 24 61.411 -4.837 -2.683 180 HA LYS 24 HA LYS 24 59.630 -6.563 -3.943 181 HB2 LYS 24 HB2 LYS 24 59.469 -5.570 -1.737 182 HB3 LYS 24 HB3 LYS 24 59.119 -4.009 -2.446 183 HG2 LYS 24 HG2 LYS 24 57.030 -4.883 -1.735 184 HG3 LYS 24 HG3 LYS 24 57.067 -5.067 -3.489 185 HD2 LYS 24 HD2 LYS 24 56.166 -7.076 -2.455 186 HD3 LYS 24 HD3 LYS 24 57.719 -7.431 -3.202 187 HE2 LYS 24 HE2 LYS 24 57.489 -8.493 -0.986 188 HE3 LYS 24 HE3 LYS 24 58.822 -7.356 -1.022 189 HZ1 LYS 24 HZ1 LYS 24 57.432 -7.245 0.993 190 HZ2 LYS 24 HZ2 LYS 24 56.126 -6.715 0.101 191 HZ3 LYS 24 HZ3 LYS 24 57.527 -5.778 0.216 192 H GLU 25 H GLU 25 60.266 -3.070 -4.471 193 HA GLU 25 HA GLU 25 58.428 -2.935 -6.648 194 HB2 GLU 25 HB2 GLU 25 60.552 -0.974 -5.715 195 HB3 GLU 25 HB3 GLU 25 59.359 -0.683 -6.948 196 HG2 GLU 25 HG2 GLU 25 58.662 -1.321 -4.109 197 HG3 GLU 25 HG3 GLU 25 58.764 0.304 -4.774 198 H ASN 26 H ASN 26 61.860 -3.462 -6.210 199 HA ASN 26 HA ASN 26 62.773 -3.047 -8.823 200 HB2 ASN 26 HB2 ASN 26 64.324 -3.322 -6.940 201 HB3 ASN 26 HB3 ASN 26 63.825 -5.002 -6.766 202 HD21 ASN 26 HD21 ASN 26 65.822 -5.907 -7.164 203 HD22 ASN 26 HD22 ASN 26 66.591 -5.810 -8.712 204 H VAL 27 H VAL 27 61.770 -6.099 -7.280 205 HA VAL 27 HA VAL 27 62.197 -7.642 -9.608 206 HB VAL 27 HB VAL 27 60.955 -9.461 -8.491 207 HG11 VAL 27 HG11 VAL 27 63.288 -9.156 -7.948 208 HG12 VAL 27 HG12 VAL 27 62.398 -9.708 -6.532 209 HG13 VAL 27 HG13 VAL 27 62.865 -8.015 -6.674 210 HG21 VAL 27 HG21 VAL 27 60.044 -9.158 -6.235 211 HG22 VAL 27 HG22 VAL 27 59.208 -8.138 -7.411 212 HG23 VAL 27 HG23 VAL 27 60.407 -7.435 -6.325 213 H ALA 28 H ALA 28 59.517 -5.759 -8.576 214 HA ALA 28 HA ALA 28 57.687 -6.952 -10.473 215 HB1 ALA 28 HB1 ALA 28 56.076 -5.320 -9.624 216 HB2 ALA 28 HB2 ALA 28 57.356 -4.549 -8.684 217 HB3 ALA 28 HB3 ALA 28 56.856 -6.196 -8.308 218 H ALA 29 H ALA 29 59.938 -4.421 -10.321 219 HA ALA 29 HA ALA 29 60.602 -2.755 -11.604 220 HB1 ALA 29 HB1 ALA 29 59.356 -4.300 -13.878 221 HB2 ALA 29 HB2 ALA 29 60.989 -4.535 -13.233 222 HB3 ALA 29 HB3 ALA 29 60.552 -3.009 -14.006 223 H THR 30 H THR 30 58.858 -1.730 -10.289 224 HA THR 30 HA THR 30 56.664 -0.690 -11.839 225 HB THR 30 HB THR 30 56.134 0.438 -9.654 226 HG1 THR 30 HG1 THR 30 57.404 -0.247 -7.849 227 HG21 THR 30 HG21 THR 30 56.702 -2.502 -9.478 228 HG22 THR 30 HG22 THR 30 55.234 -1.789 -10.158 229 HG23 THR 30 HG23 THR 30 55.596 -1.615 -8.430 230 H ASP 31 H ASP 31 56.612 1.968 -10.835 231 HA ASP 31 HA ASP 31 59.230 2.995 -11.576 232 HB2 ASP 31 HB2 ASP 31 57.964 3.132 -13.635 233 HB3 ASP 31 HB3 ASP 31 56.657 3.940 -12.776 234 H ASP 32 H ASP 32 56.101 3.956 -10.269 235 HA ASP 32 HA ASP 32 56.956 6.422 -9.227 236 HB2 ASP 32 HB2 ASP 32 54.779 4.576 -8.295 237 HB3 ASP 32 HB3 ASP 32 55.154 6.061 -7.436 238 H VAL 33 H VAL 33 56.765 3.480 -7.397 239 HA VAL 33 HA VAL 33 58.158 4.899 -5.356 240 HB VAL 33 HB VAL 33 56.807 2.198 -5.404 241 HG11 VAL 33 HG11 VAL 33 57.300 2.132 -3.055 242 HG12 VAL 33 HG12 VAL 33 58.181 3.682 -3.237 243 HG13 VAL 33 HG13 VAL 33 58.784 2.217 -4.039 244 HG21 VAL 33 HG21 VAL 33 56.399 4.779 -4.072 245 HG22 VAL 33 HG22 VAL 33 55.432 3.310 -3.783 246 HG23 VAL 33 HG23 VAL 33 55.415 4.117 -5.393 247 H LEU 34 H LEU 34 58.663 2.555 -7.750 248 HA LEU 34 HA LEU 34 61.056 1.430 -6.886 249 HB2 LEU 34 HB2 LEU 34 59.590 0.802 -8.937 250 HB3 LEU 34 HB3 LEU 34 60.270 2.201 -9.659 251 HG LEU 34 HG LEU 34 61.208 -0.105 -10.303 252 HD11 LEU 34 HD11 LEU 34 61.938 1.914 -11.226 253 HD12 LEU 34 HD12 LEU 34 63.332 0.895 -10.849 254 HD13 LEU 34 HD13 LEU 34 62.926 2.275 -9.809 255 HD21 LEU 34 HD21 LEU 34 63.224 -0.726 -9.062 256 HD22 LEU 34 HD22 LEU 34 61.785 -0.866 -8.052 257 HD23 LEU 34 HD23 LEU 34 62.866 0.514 -7.862 258 H ASP 35 H ASP 35 60.345 4.421 -8.694 259 HA ASP 35 HA ASP 35 63.081 5.154 -8.845 260 HB2 ASP 35 HB2 ASP 35 61.288 6.130 -10.367 261 HB3 ASP 35 HB3 ASP 35 60.739 6.984 -8.913 262 H VAL 36 H VAL 36 60.554 5.886 -6.569 263 HA VAL 36 HA VAL 36 61.826 7.882 -5.087 264 HB VAL 36 HB VAL 36 60.290 5.594 -3.907 265 HG11 VAL 36 HG11 VAL 36 59.850 7.151 -2.070 266 HG12 VAL 36 HG12 VAL 36 60.885 8.327 -2.938 267 HG13 VAL 36 HG13 VAL 36 61.576 6.806 -2.369 268 HG21 VAL 36 HG21 VAL 36 59.017 6.719 -5.567 269 HG22 VAL 36 HG22 VAL 36 59.296 8.274 -4.690 270 HG23 VAL 36 HG23 VAL 36 58.431 6.915 -3.903 271 H LEU 37 H LEU 37 61.824 4.413 -4.759 272 HA LEU 37 HA LEU 37 63.306 4.425 -2.381 273 HB2 LEU 37 HB2 LEU 37 63.026 2.129 -4.248 274 HB3 LEU 37 HB3 LEU 37 63.406 2.236 -2.535 275 HG LEU 37 HG LEU 37 60.719 3.028 -3.558 276 HD11 LEU 37 HD11 LEU 37 59.836 1.046 -2.573 277 HD12 LEU 37 HD12 LEU 37 61.453 0.501 -2.116 278 HD13 LEU 37 HD13 LEU 37 61.004 0.634 -3.828 279 HD21 LEU 37 HD21 LEU 37 61.762 2.643 -0.754 280 HD22 LEU 37 HD22 LEU 37 60.093 3.011 -1.186 281 HD23 LEU 37 HD23 LEU 37 61.365 4.182 -1.521 282 H LEU 38 H LEU 38 64.065 3.910 -5.705 283 HA LEU 38 HA LEU 38 66.698 3.118 -5.282 284 HB2 LEU 38 HB2 LEU 38 65.218 4.296 -7.544 285 HB3 LEU 38 HB3 LEU 38 66.919 3.916 -7.721 286 HG LEU 38 HG LEU 38 64.495 2.150 -7.365 287 HD11 LEU 38 HD11 LEU 38 66.750 2.069 -9.274 288 HD12 LEU 38 HD12 LEU 38 65.156 2.766 -9.597 289 HD13 LEU 38 HD13 LEU 38 65.335 1.018 -9.316 290 HD21 LEU 38 HD21 LEU 38 66.079 1.248 -5.756 291 HD22 LEU 38 HD22 LEU 38 67.338 1.220 -6.990 292 HD23 LEU 38 HD23 LEU 38 65.933 0.173 -7.144 293 H GLU 39 H GLU 39 65.318 6.331 -6.025 294 HA GLU 39 HA GLU 39 67.907 7.470 -5.845 295 HB2 GLU 39 HB2 GLU 39 66.815 9.659 -5.935 296 HB3 GLU 39 HB3 GLU 39 66.375 8.584 -7.235 297 HG2 GLU 39 HG2 GLU 39 64.235 8.373 -6.580 298 HG3 GLU 39 HG3 GLU 39 64.504 8.770 -4.901 299 H HIS 40 H HIS 40 65.311 7.074 -3.596 300 HA HIS 40 HA HIS 40 66.207 8.727 -1.527 301 HB2 HIS 40 HB2 HIS 40 64.003 7.631 -1.619 302 HB3 HIS 40 HB3 HIS 40 64.746 6.085 -1.390 303 HD1 HIS 40 HD1 HIS 40 64.060 9.263 0.539 304 HD2 HIS 40 HD2 HIS 40 65.294 5.360 1.162 305 HE1 HIS 40 HE1 HIS 40 64.070 8.925 3.017 306 H PHE 41 H PHE 41 66.790 5.379 -2.260 307 HA PHE 41 HA PHE 41 68.439 4.695 -0.167 308 HB2 PHE 41 HB2 PHE 41 67.509 3.040 -1.509 309 HB3 PHE 41 HB3 PHE 41 68.105 3.779 -2.983 310 HD1 PHE 41 HD1 PHE 41 69.001 1.866 0.014 311 HD2 PHE 41 HD2 PHE 41 70.242 3.210 -3.793 312 HE1 PHE 41 HE1 PHE 41 70.956 0.362 0.132 313 HE2 PHE 41 HE2 PHE 41 72.183 1.748 -3.687 314 HZ PHE 41 HZ PHE 41 72.557 0.312 -1.732 315 H VAL 42 H VAL 42 69.353 5.831 -3.408 316 HA VAL 42 HA VAL 42 72.062 5.911 -2.668 317 HB VAL 42 HB VAL 42 71.571 5.499 -4.909 318 HG11 VAL 42 HG11 VAL 42 69.618 6.492 -5.261 319 HG12 VAL 42 HG12 VAL 42 70.778 7.012 -6.485 320 HG13 VAL 42 HG13 VAL 42 70.294 8.140 -5.174 321 HG21 VAL 42 HG21 VAL 42 73.011 7.092 -6.133 322 HG22 VAL 42 HG22 VAL 42 73.709 6.520 -4.617 323 HG23 VAL 42 HG23 VAL 42 72.995 8.128 -4.708 324 H LYS 43 H LYS 43 69.664 8.304 -2.525 325 HA LYS 43 HA LYS 43 71.526 10.458 -2.029 326 HB2 LYS 43 HB2 LYS 43 69.728 11.887 -1.480 327 HB3 LYS 43 HB3 LYS 43 69.073 10.800 -2.691 328 HG2 LYS 43 HG2 LYS 43 68.038 9.448 -0.733 329 HG3 LYS 43 HG3 LYS 43 68.620 10.737 0.275 330 HD2 LYS 43 HD2 LYS 43 66.818 11.322 -2.047 331 HD3 LYS 43 HD3 LYS 43 66.198 10.939 -0.444 332 HE2 LYS 43 HE2 LYS 43 67.232 12.860 0.511 333 HE3 LYS 43 HE3 LYS 43 68.169 13.180 -0.953 334 HZ1 LYS 43 HZ1 LYS 43 66.282 14.655 -0.752 335 HZ2 LYS 43 HZ2 LYS 43 65.208 13.360 -0.703 336 HZ3 LYS 43 HZ3 LYS 43 66.100 13.667 -2.097 337 H ILE 44 H ILE 44 70.113 8.133 0.097 338 HA ILE 44 HA ILE 44 71.137 9.588 2.387 339 HB ILE 44 HB ILE 44 70.185 7.715 3.755 340 HG12 ILE 44 HG12 ILE 44 69.283 6.723 1.043 341 HG13 ILE 44 HG13 ILE 44 70.352 5.890 2.154 342 HG21 ILE 44 HG21 ILE 44 67.835 8.303 3.348 343 HG22 ILE 44 HG22 ILE 44 68.284 9.001 1.794 344 HG23 ILE 44 HG23 ILE 44 68.876 9.727 3.286 345 HD11 ILE 44 HD11 ILE 44 68.546 5.505 3.672 346 HD12 ILE 44 HD12 ILE 44 68.008 5.035 2.037 347 HD13 ILE 44 HD13 ILE 44 67.499 6.557 2.735 348 H THR 45 H THR 45 71.938 6.733 0.523 349 HA THR 45 HA THR 45 74.051 5.956 2.323 350 HB THR 45 HB THR 45 74.587 4.280 0.622 351 HG1 THR 45 HG1 THR 45 72.311 4.997 -0.851 352 HG21 THR 45 HG21 THR 45 72.530 3.014 0.772 353 HG22 THR 45 HG22 THR 45 71.629 4.484 1.113 354 HG23 THR 45 HG23 THR 45 72.791 3.880 2.291 355 H GLU 46 H GLU 46 73.672 7.588 -0.724 356 HA GLU 46 HA GLU 46 74.884 8.858 -2.000 357 HB2 GLU 46 HB2 GLU 46 76.488 9.128 0.496 358 HB3 GLU 46 HB3 GLU 46 76.697 10.199 -0.904 359 HG2 GLU 46 HG2 GLU 46 74.330 10.824 -0.666 360 HG3 GLU 46 HG3 GLU 46 74.219 9.759 0.723 361 H HIS 47 H HIS 47 75.292 6.116 -1.927 362 HA HIS 47 HA HIS 47 78.042 5.620 -2.577 363 HB2 HIS 47 HB2 HIS 47 76.394 3.893 -1.644 364 HB3 HIS 47 HB3 HIS 47 75.610 3.911 -3.219 365 HD1 HIS 47 HD1 HIS 47 76.643 2.339 -5.001 366 HD2 HIS 47 HD2 HIS 47 79.036 2.891 -1.666 367 HE1 HIS 47 HE1 HIS 47 78.662 0.863 -5.310 368 HA PRO 48 HA PRO 48 77.589 7.344 -6.736 369 HB2 PRO 48 HB2 PRO 48 79.569 5.367 -7.548 370 HB3 PRO 48 HB3 PRO 48 79.656 7.121 -7.646 371 HG2 PRO 48 HG2 PRO 48 81.058 5.654 -5.979 372 HG3 PRO 48 HG3 PRO 48 80.424 7.230 -5.399 373 HD2 PRO 48 HD2 PRO 48 79.471 4.428 -4.939 374 HD3 PRO 48 HD3 PRO 48 79.557 5.764 -3.780 375 H ASP 49 H ASP 49 77.312 4.067 -6.051 376 HA ASP 49 HA ASP 49 76.372 3.547 -8.680 377 HB2 ASP 49 HB2 ASP 49 77.989 1.661 -6.944 378 HB3 ASP 49 HB3 ASP 49 77.257 1.192 -8.461 379 H GLY 50 H GLY 50 75.009 4.441 -6.466 380 HA2 GLY 50 HA2 GLY 50 73.902 2.733 -4.492 381 HA3 GLY 50 HA3 GLY 50 73.144 4.135 -5.215 382 H THR 51 H THR 51 72.732 3.385 -7.611 383 HA THR 51 HA THR 51 70.532 1.689 -6.894 384 HB THR 51 HB THR 51 70.820 2.439 -9.731 385 HG1 THR 51 HG1 THR 51 69.975 4.370 -7.806 386 HG21 THR 51 HG21 THR 51 68.661 2.653 -7.635 387 HG22 THR 51 HG22 THR 51 68.873 1.316 -8.722 388 HG23 THR 51 HG23 THR 51 68.454 2.922 -9.360 389 H ALA 52 H ALA 52 73.450 1.420 -8.738 390 HA ALA 52 HA ALA 52 72.994 -1.079 -10.000 391 HB1 ALA 52 HB1 ALA 52 74.857 0.429 -10.616 392 HB2 ALA 52 HB2 ALA 52 75.424 -1.187 -10.187 393 HB3 ALA 52 HB3 ALA 52 75.580 0.138 -9.034 394 H LEU 53 H LEU 53 74.042 -0.170 -6.808 395 HA LEU 53 HA LEU 53 74.706 -2.749 -5.982 396 HB2 LEU 53 HB2 LEU 53 73.664 -0.484 -4.345 397 HB3 LEU 53 HB3 LEU 53 74.109 -2.031 -3.659 398 HG LEU 53 HG LEU 53 75.905 -0.021 -4.988 399 HD11 LEU 53 HD11 LEU 53 75.833 -1.230 -2.245 400 HD12 LEU 53 HD12 LEU 53 75.331 0.401 -2.703 401 HD13 LEU 53 HD13 LEU 53 77.024 -0.072 -2.844 402 HD21 LEU 53 HD21 LEU 53 76.547 -2.846 -4.131 403 HD22 LEU 53 HD22 LEU 53 77.736 -1.610 -4.529 404 HD23 LEU 53 HD23 LEU 53 76.635 -2.191 -5.772 405 H ILE 54 H ILE 54 71.521 -1.269 -6.020 406 HA ILE 54 HA ILE 54 70.396 -3.565 -4.633 407 HB ILE 54 HB ILE 54 68.734 -1.804 -6.494 408 HG12 ILE 54 HG12 ILE 54 67.887 -0.959 -4.141 409 HG13 ILE 54 HG13 ILE 54 69.496 -1.447 -3.636 410 HG21 ILE 54 HG21 ILE 54 67.861 -3.664 -4.298 411 HG22 ILE 54 HG22 ILE 54 67.686 -3.927 -6.031 412 HG23 ILE 54 HG23 ILE 54 66.805 -2.618 -5.246 413 HD11 ILE 54 HD11 ILE 54 70.483 0.021 -5.263 414 HD12 ILE 54 HD12 ILE 54 69.384 0.895 -4.194 415 HD13 ILE 54 HD13 ILE 54 68.880 0.483 -5.835 416 H TYR 55 H TYR 55 70.791 -2.633 -7.904 417 HA TYR 55 HA TYR 55 69.433 -4.758 -9.063 418 HB2 TYR 55 HB2 TYR 55 71.440 -2.801 -10.029 419 HB3 TYR 55 HB3 TYR 55 70.942 -4.109 -11.075 420 HD1 TYR 55 HD1 TYR 55 68.355 -4.343 -11.441 421 HD2 TYR 55 HD2 TYR 55 70.201 -0.833 -9.928 422 HE1 TYR 55 HE1 TYR 55 66.388 -3.023 -12.102 423 HE2 TYR 55 HE2 TYR 55 68.240 0.490 -10.578 424 HH TYR 55 HH TYR 55 66.434 0.402 -12.111 425 H GLU 56 H GLU 56 72.943 -4.397 -8.375 426 HA GLU 56 HA GLU 56 73.419 -7.027 -9.302 427 HB2 GLU 56 HB2 GLU 56 75.635 -6.901 -8.197 428 HB3 GLU 56 HB3 GLU 56 75.347 -5.602 -9.348 429 HG2 GLU 56 HG2 GLU 56 75.149 -4.034 -7.686 430 HG3 GLU 56 HG3 GLU 56 74.910 -5.191 -6.397 431 H ALA 57 H ALA 57 72.729 -5.697 -6.100 432 HA ALA 57 HA ALA 57 73.295 -7.980 -4.603 433 HB1 ALA 57 HB1 ALA 57 71.078 -5.992 -4.084 434 HB2 ALA 57 HB2 ALA 57 72.754 -5.805 -3.573 435 HB3 ALA 57 HB3 ALA 57 71.768 -7.109 -2.907 436 H ALA 58 H ALA 58 70.424 -7.088 -6.392 437 HA ALA 58 HA ALA 58 68.761 -9.205 -5.687 438 HB1 ALA 58 HB1 ALA 58 67.573 -8.748 -7.762 439 HB2 ALA 58 HB2 ALA 58 68.945 -7.812 -8.356 440 HB3 ALA 58 HB3 ALA 58 68.022 -7.238 -6.968 441 H ALA 59 H ALA 59 71.113 -8.968 -8.340 442 HA ALA 59 HA ALA 59 70.654 -11.608 -9.307 443 HB1 ALA 59 HB1 ALA 59 73.043 -9.809 -9.725 444 HB2 ALA 59 HB2 ALA 59 71.590 -9.827 -10.722 445 HB3 ALA 59 HB3 ALA 59 72.650 -11.238 -10.684 446 H ARG 60 H ARG 60 73.006 -10.157 -7.158 447 HA ARG 60 HA ARG 60 74.601 -12.406 -6.671 448 HB2 ARG 60 HB2 ARG 60 74.078 -9.955 -4.967 449 HB3 ARG 60 HB3 ARG 60 75.265 -11.194 -4.553 450 HG2 ARG 60 HG2 ARG 60 76.582 -10.679 -6.456 451 HG3 ARG 60 HG3 ARG 60 75.317 -9.665 -7.143 452 HD2 ARG 60 HD2 ARG 60 77.069 -8.274 -6.211 453 HD3 ARG 60 HD3 ARG 60 75.601 -8.086 -5.266 454 HE ARG 60 HE ARG 60 77.053 -10.035 -4.008 455 HH11 ARG 60 HH11 ARG 60 77.696 -6.609 -4.877 456 HH12 ARG 60 HH12 ARG 60 78.633 -6.297 -3.489 457 HH21 ARG 60 HH21 ARG 60 78.417 -9.566 -2.119 458 HH22 ARG 60 HH22 ARG 60 79.078 -8.005 -1.950 459 H ALA 61 H ALA 61 71.566 -11.392 -5.290 460 HA ALA 61 HA ALA 61 71.519 -13.498 -3.325 461 HB1 ALA 61 HB1 ALA 61 69.272 -11.761 -4.330 462 HB2 ALA 61 HB2 ALA 61 70.338 -11.394 -2.973 463 HB3 ALA 61 HB3 ALA 61 69.245 -12.780 -2.886 464 H ALA 62 H ALA 62 69.965 -12.938 -6.466 465 HA ALA 62 HA ALA 62 68.340 -15.197 -6.571 466 HB1 ALA 62 HB1 ALA 62 68.311 -14.877 -8.992 467 HB2 ALA 62 HB2 ALA 62 69.731 -13.838 -8.881 468 HB3 ALA 62 HB3 ALA 62 68.206 -13.321 -8.166 469 H ALA 63 H ALA 63 71.665 -14.793 -7.632 470 HA ALA 63 HA ALA 63 71.971 -17.666 -7.296 471 HB1 ALA 63 HB1 ALA 63 72.009 -17.197 -9.714 472 HB2 ALA 63 HB2 ALA 63 73.608 -17.674 -9.139 473 HB3 ALA 63 HB3 ALA 63 73.255 -15.975 -9.449 474 H ASN 64 H ASN 64 72.656 -17.236 -5.224 475 HA ASN 64 HA ASN 64 74.798 -15.391 -4.846 476 HB2 ASN 64 HB2 ASN 64 73.005 -15.683 -3.137 477 HB3 ASN 64 HB3 ASN 64 73.619 -17.304 -2.823 478 HD21 ASN 64 HD21 ASN 64 74.310 -13.929 -2.626 479 HD22 ASN 64 HD22 ASN 64 75.563 -14.042 -1.429 480 HA PRO 65 HA PRO 65 77.820 -18.479 -5.764 481 HB2 PRO 65 HB2 PRO 65 79.993 -16.911 -5.490 482 HB3 PRO 65 HB3 PRO 65 78.885 -16.749 -6.857 483 HG2 PRO 65 HG2 PRO 65 79.052 -15.102 -4.357 484 HG3 PRO 65 HG3 PRO 65 78.816 -14.568 -6.029 485 HD2 PRO 65 HD2 PRO 65 76.786 -14.831 -4.227 486 HD3 PRO 65 HD3 PRO 65 76.564 -15.007 -5.977 487 H GLY 66 H GLY 66 76.997 -17.512 -2.817 488 HA2 GLY 66 HA2 GLY 66 77.501 -18.519 -0.785 489 HA3 GLY 66 HA3 GLY 66 79.010 -19.133 -1.483 490 H GLY 67 H GLY 67 77.472 -15.984 -0.998 491 HA2 GLY 67 HA2 GLY 67 79.689 -15.096 0.585 492 HA3 GLY 67 HA3 GLY 67 79.637 -14.403 -1.032 493 H ASP 68 H ASP 68 79.473 -12.641 0.835 494 HA ASP 68 HA ASP 68 76.723 -12.197 1.652 495 HB2 ASP 68 HB2 ASP 68 77.547 -10.379 2.997 496 HB3 ASP 68 HB3 ASP 68 78.638 -11.739 3.216 497 H GLY 69 H GLY 69 75.908 -9.900 1.372 498 HA2 GLY 69 HA2 GLY 69 75.563 -8.000 -0.011 499 HA3 GLY 69 HA3 GLY 69 76.707 -8.681 -1.176 500 H GLY 70 H GLY 70 74.586 -10.960 -0.038 501 HA2 GLY 70 HA2 GLY 70 73.021 -10.739 -2.491 502 HA3 GLY 70 HA3 GLY 70 73.284 -12.220 -1.572 503 H GLY 71 H GLY 71 71.160 -9.734 -2.161 504 HA2 GLY 71 HA2 GLY 71 68.973 -9.972 -1.400 505 HA3 GLY 71 HA3 GLY 71 69.604 -10.653 0.100 506 HA PRO 72 HA PRO 72 68.432 -6.140 0.421 507 HB2 PRO 72 HB2 PRO 72 66.831 -6.466 2.625 508 HB3 PRO 72 HB3 PRO 72 66.269 -6.509 0.948 509 HG2 PRO 72 HG2 PRO 72 66.854 -8.766 2.807 510 HG3 PRO 72 HG3 PRO 72 65.569 -8.610 1.597 511 HD2 PRO 72 HD2 PRO 72 67.824 -10.070 1.202 512 HD3 PRO 72 HD3 PRO 72 66.965 -9.302 -0.137 513 H GLU 73 H GLU 73 69.164 -8.467 2.975 514 HA GLU 73 HA GLU 73 70.218 -6.458 4.654 515 HB2 GLU 73 HB2 GLU 73 70.388 -9.465 4.897 516 HB3 GLU 73 HB3 GLU 73 70.756 -8.305 6.167 517 HG2 GLU 73 HG2 GLU 73 68.513 -7.557 6.239 518 HG3 GLU 73 HG3 GLU 73 68.085 -8.513 4.831 519 H GLY 74 H GLY 74 71.421 -7.701 1.947 520 HA2 GLY 74 HA2 GLY 74 74.078 -7.300 3.013 521 HA3 GLY 74 HA3 GLY 74 73.822 -8.250 1.511 522 H ILE 75 H ILE 75 71.822 -5.888 0.931 523 HA ILE 75 HA ILE 75 73.555 -4.297 -0.649 524 HB ILE 75 HB ILE 75 71.118 -2.912 0.354 525 HG12 ILE 75 HG12 ILE 75 70.881 -5.615 -1.055 526 HG13 ILE 75 HG13 ILE 75 70.205 -5.058 0.417 527 HG21 ILE 75 HG21 ILE 75 72.416 -2.029 -1.486 528 HG22 ILE 75 HG22 ILE 75 70.795 -2.450 -2.035 529 HG23 ILE 75 HG23 ILE 75 72.156 -3.506 -2.413 530 HD11 ILE 75 HD11 ILE 75 69.354 -3.874 -2.205 531 HD12 ILE 75 HD12 ILE 75 68.637 -3.619 -0.606 532 HD13 ILE 75 HD13 ILE 75 68.524 -5.190 -1.375 533 H VAL 76 H VAL 76 72.001 -3.822 2.393 534 HA VAL 76 HA VAL 76 72.941 -1.357 3.252 535 HB VAL 76 HB VAL 76 71.197 -2.405 4.375 536 HG11 VAL 76 HG11 VAL 76 71.437 -4.444 5.714 537 HG12 VAL 76 HG12 VAL 76 72.725 -4.833 4.542 538 HG13 VAL 76 HG13 VAL 76 71.085 -4.393 4.004 539 HG21 VAL 76 HG21 VAL 76 72.553 -1.079 5.934 540 HG22 VAL 76 HG22 VAL 76 73.519 -2.508 6.289 541 HG23 VAL 76 HG23 VAL 76 71.820 -2.455 6.757 542 H LYS 77 H LYS 77 74.171 -4.451 3.770 543 HA LYS 77 HA LYS 77 76.405 -3.794 5.347 544 HB2 LYS 77 HB2 LYS 77 75.643 -6.124 5.114 545 HB3 LYS 77 HB3 LYS 77 76.204 -6.135 3.450 546 HG2 LYS 77 HG2 LYS 77 78.491 -5.866 4.169 547 HG3 LYS 77 HG3 LYS 77 77.975 -5.730 5.849 548 HD2 LYS 77 HD2 LYS 77 77.085 -8.010 5.746 549 HD3 LYS 77 HD3 LYS 77 77.620 -8.135 4.070 550 HE2 LYS 77 HE2 LYS 77 79.435 -7.635 6.429 551 HE3 LYS 77 HE3 LYS 77 79.164 -9.203 5.673 552 HZ1 LYS 77 HZ1 LYS 77 81.167 -8.244 4.835 553 HZ2 LYS 77 HZ2 LYS 77 80.432 -6.816 4.408 554 HZ3 LYS 77 HZ3 LYS 77 80.022 -8.261 3.596 555 H GLU 78 H GLU 78 76.216 -4.224 1.826 556 HA GLU 78 HA GLU 78 78.880 -3.639 1.214 557 HB2 GLU 78 HB2 GLU 78 77.113 -4.560 -0.351 558 HB3 GLU 78 HB3 GLU 78 76.443 -2.950 -0.498 559 HG2 GLU 78 HG2 GLU 78 77.778 -3.288 -2.383 560 HG3 GLU 78 HG3 GLU 78 78.687 -2.210 -1.331 561 H ILE 79 H ILE 79 76.105 -1.568 1.755 562 HA ILE 79 HA ILE 79 77.264 0.939 1.070 563 HB ILE 79 HB ILE 79 74.973 0.243 2.900 564 HG12 ILE 79 HG12 ILE 79 74.563 -0.336 0.555 565 HG13 ILE 79 HG13 ILE 79 73.523 0.984 1.072 566 HG21 ILE 79 HG21 ILE 79 75.842 2.379 3.584 567 HG22 ILE 79 HG22 ILE 79 74.277 2.578 2.806 568 HG23 ILE 79 HG23 ILE 79 75.758 2.978 1.927 569 HD11 ILE 79 HD11 ILE 79 74.313 1.416 -1.120 570 HD12 ILE 79 HD12 ILE 79 75.984 1.147 -0.626 571 HD13 ILE 79 HD13 ILE 79 75.104 2.550 -0.022 572 H LYS 80 H LYS 80 76.865 -0.744 4.163 573 HA LYS 80 HA LYS 80 77.784 1.469 5.656 574 HB2 LYS 80 HB2 LYS 80 77.565 0.155 7.614 575 HB3 LYS 80 HB3 LYS 80 76.321 -0.417 6.527 576 HG2 LYS 80 HG2 LYS 80 77.814 -2.332 5.956 577 HG3 LYS 80 HG3 LYS 80 78.893 -1.789 7.243 578 HD2 LYS 80 HD2 LYS 80 76.911 -1.872 8.794 579 HD3 LYS 80 HD3 LYS 80 76.022 -2.670 7.503 580 HE2 LYS 80 HE2 LYS 80 76.840 -4.397 8.914 581 HE3 LYS 80 HE3 LYS 80 77.858 -4.405 7.476 582 HZ1 LYS 80 HZ1 LYS 80 78.534 -3.157 10.075 583 HZ2 LYS 80 HZ2 LYS 80 79.579 -3.186 8.748 584 HZ3 LYS 80 HZ3 LYS 80 79.144 -4.604 9.530 585 H GLU 81 H GLU 81 79.359 -1.308 4.317 586 HA GLU 81 HA GLU 81 81.831 -0.815 5.596 587 HB2 GLU 81 HB2 GLU 81 81.206 -2.440 3.141 588 HB3 GLU 81 HB3 GLU 81 82.704 -2.537 4.072 589 HG2 GLU 81 HG2 GLU 81 81.442 -3.265 6.025 590 HG3 GLU 81 HG3 GLU 81 79.948 -3.158 5.109 591 H TRP 82 H TRP 82 80.399 0.182 2.573 592 HA TRP 82 HA TRP 82 82.737 1.303 1.405 593 HB2 TRP 82 HB2 TRP 82 80.661 0.756 0.141 594 HB3 TRP 82 HB3 TRP 82 79.848 2.065 0.978 595 HD1 TRP 82 HD1 TRP 82 82.443 1.418 -1.743 596 HE1 TRP 82 HE1 TRP 82 82.716 3.548 -3.143 597 HE3 TRP 82 HE3 TRP 82 79.664 4.640 1.105 598 HZ2 TRP 82 HZ2 TRP 82 81.873 6.225 -3.075 599 HZ3 TRP 82 HZ3 TRP 82 79.457 6.976 0.362 600 HH2 TRP 82 HH2 TRP 82 80.546 7.751 -1.677 601 H ARG 83 H ARG 83 80.088 2.633 3.293 602 HA ARG 83 HA ARG 83 81.045 5.305 3.242 603 HB2 ARG 83 HB2 ARG 83 78.613 4.285 3.896 604 HB3 ARG 83 HB3 ARG 83 79.396 4.368 5.482 605 HG2 ARG 83 HG2 ARG 83 79.375 6.591 5.622 606 HG3 ARG 83 HG3 ARG 83 79.496 6.812 3.877 607 HD2 ARG 83 HD2 ARG 83 77.183 6.374 3.566 608 HD3 ARG 83 HD3 ARG 83 77.001 5.779 5.216 609 HE ARG 83 HE ARG 83 77.260 8.007 6.008 610 HH11 ARG 83 HH11 ARG 83 76.651 7.918 2.455 611 HH12 ARG 83 HH12 ARG 83 76.142 9.552 2.484 612 HH21 ARG 83 HH21 ARG 83 76.468 10.200 5.861 613 HH22 ARG 83 HH22 ARG 83 76.027 10.810 4.342 614 H ALA 84 H ALA 84 81.451 2.610 5.434 615 HA ALA 84 HA ALA 84 82.930 3.910 7.445 616 HB1 ALA 84 HB1 ALA 84 82.003 1.666 7.753 617 HB2 ALA 84 HB2 ALA 84 83.751 1.657 8.026 618 HB3 ALA 84 HB3 ALA 84 83.091 1.043 6.515 619 H ALA 85 H ALA 85 83.919 2.362 4.408 620 HA ALA 85 HA ALA 85 86.703 2.606 4.756 621 HB1 ALA 85 HB1 ALA 85 85.136 2.552 2.174 622 HB2 ALA 85 HB2 ALA 85 85.694 1.138 3.066 623 HB3 ALA 85 HB3 ALA 85 86.863 2.241 2.340 624 H ASN 86 H ASN 86 84.297 4.785 3.435 625 HA ASN 86 HA ASN 86 86.066 6.836 2.551 626 HB2 ASN 86 HB2 ASN 86 83.487 6.881 2.049 627 HB3 ASN 86 HB3 ASN 86 83.316 7.259 3.740 628 HD21 ASN 86 HD21 ASN 86 84.203 8.487 0.663 629 HD22 ASN 86 HD22 ASN 86 84.364 10.126 1.139 630 H GLY 87 H GLY 87 84.551 6.030 5.568 631 HA2 GLY 87 HA2 GLY 87 85.068 6.737 7.731 632 HA3 GLY 87 HA3 GLY 87 86.163 7.957 7.051 633 H LYS 88 H LYS 88 82.793 7.125 6.394 634 HA LYS 88 HA LYS 88 82.051 9.935 6.718 635 HB2 LYS 88 HB2 LYS 88 82.281 9.116 4.381 636 HB3 LYS 88 HB3 LYS 88 81.162 7.823 4.734 637 HG2 LYS 88 HG2 LYS 88 79.388 9.553 5.080 638 HG3 LYS 88 HG3 LYS 88 80.626 10.745 4.627 639 HD2 LYS 88 HD2 LYS 88 80.071 8.461 2.803 640 HD3 LYS 88 HD3 LYS 88 79.009 9.843 2.743 641 HE2 LYS 88 HE2 LYS 88 81.997 9.879 2.351 642 HE3 LYS 88 HE3 LYS 88 80.784 9.944 1.084 643 HZ1 LYS 88 HZ1 LYS 88 81.655 12.135 1.597 644 HZ2 LYS 88 HZ2 LYS 88 81.166 12.044 3.182 645 HZ3 LYS 88 HZ3 LYS 88 80.023 12.067 1.936 646 HA PRO 89 HA PRO 89 79.427 8.204 9.899 647 HB2 PRO 89 HB2 PRO 89 77.333 10.011 9.703 648 HB3 PRO 89 HB3 PRO 89 78.803 10.289 10.638 649 HG2 PRO 89 HG2 PRO 89 78.089 11.215 7.886 650 HG3 PRO 89 HG3 PRO 89 78.943 12.086 9.169 651 HD2 PRO 89 HD2 PRO 89 80.241 11.037 7.087 652 HD3 PRO 89 HD3 PRO 89 80.956 11.006 8.712 653 H GLY 90 H GLY 90 78.397 6.378 9.571 654 HA2 GLY 90 HA2 GLY 90 76.582 6.179 7.294 655 HA3 GLY 90 HA3 GLY 90 77.351 4.834 8.116 656 H PHE 91 H PHE 91 76.135 3.706 9.423 657 HA PHE 91 HA PHE 91 73.389 4.525 9.784 658 HB2 PHE 91 HB2 PHE 91 74.772 1.901 10.419 659 HB3 PHE 91 HB3 PHE 91 73.059 2.224 10.564 660 HD1 PHE 91 HD1 PHE 91 75.811 2.205 8.062 661 HD2 PHE 91 HD2 PHE 91 71.652 1.853 8.808 662 HE1 PHE 91 HE1 PHE 91 75.462 1.541 5.731 663 HE2 PHE 91 HE2 PHE 91 71.302 1.194 6.476 664 HZ PHE 91 HZ PHE 91 73.203 1.039 4.933 665 H LYS 92 H LYS 92 72.317 4.431 11.797 666 HA LYS 92 HA LYS 92 73.965 5.120 14.060 667 HB2 LYS 92 HB2 LYS 92 71.913 5.818 15.005 668 HB3 LYS 92 HB3 LYS 92 71.939 6.423 13.382 669 HG2 LYS 92 HG2 LYS 92 70.425 4.672 12.665 670 HG3 LYS 92 HG3 LYS 92 70.511 3.951 14.276 671 HD2 LYS 92 HD2 LYS 92 69.463 6.725 13.726 672 HD3 LYS 92 HD3 LYS 92 68.437 5.299 13.822 673 HE2 LYS 92 HE2 LYS 92 69.089 4.943 16.132 674 HE3 LYS 92 HE3 LYS 92 70.244 6.267 16.042 675 HZ1 LYS 92 HZ1 LYS 92 67.304 6.566 15.739 676 HZ2 LYS 92 HZ2 LYS 92 68.466 7.811 15.775 677 HZ3 LYS 92 HZ3 LYS 92 68.184 6.885 17.139 678 H GLN 93 H GLN 93 72.701 4.184 16.111 679 HA GLN 93 HA GLN 93 72.794 1.300 15.847 680 HB2 GLN 93 HB2 GLN 93 73.107 3.267 18.066 681 HB3 GLN 93 HB3 GLN 93 73.049 1.533 18.340 682 HG2 GLN 93 HG2 GLN 93 75.354 2.114 18.437 683 HG3 GLN 93 HG3 GLN 93 75.139 1.438 16.828 684 HE21 GLN 93 HE21 GLN 93 74.186 4.695 17.824 685 HE22 GLN 93 HE22 GLN 93 75.296 5.512 16.806 686 H GLY 94 H GLY 94 70.979 0.182 16.573 687 HA2 GLY 94 HA2 GLY 94 69.030 0.933 18.260 688 HA3 GLY 94 HA3 GLY 94 68.549 1.648 16.721 Start of MODEL 16 1 H GLU 2 H GLU 2 59.890 1.685 9.103 2 HA GLU 2 HA GLU 2 59.339 3.671 7.871 3 HB2 GLU 2 HB2 GLU 2 59.690 3.680 10.371 4 HB3 GLU 2 HB3 GLU 2 61.333 4.211 10.066 5 HG2 GLU 2 HG2 GLU 2 60.344 6.191 8.877 6 HG3 GLU 2 HG3 GLU 2 58.785 5.692 9.540 7 H LEU 3 H LEU 3 60.004 5.239 6.497 8 HA LEU 3 HA LEU 3 62.725 5.000 5.511 9 HB2 LEU 3 HB2 LEU 3 60.402 6.612 4.505 10 HB3 LEU 3 HB3 LEU 3 61.922 6.402 3.653 11 HG LEU 3 HG LEU 3 59.751 4.390 4.138 12 HD11 LEU 3 HD11 LEU 3 59.769 4.197 1.650 13 HD12 LEU 3 HD12 LEU 3 61.038 5.397 1.562 14 HD13 LEU 3 HD13 LEU 3 59.456 5.851 2.153 15 HD21 LEU 3 HD21 LEU 3 61.241 2.713 3.044 16 HD22 LEU 3 HD22 LEU 3 61.809 3.285 4.620 17 HD23 LEU 3 HD23 LEU 3 62.553 3.905 3.155 18 H LYS 4 H LYS 4 64.177 6.495 5.914 19 HA LYS 4 HA LYS 4 63.497 8.586 7.814 20 HB2 LYS 4 HB2 LYS 4 66.181 7.589 6.933 21 HB3 LYS 4 HB3 LYS 4 65.820 8.565 8.353 22 HG2 LYS 4 HG2 LYS 4 65.167 5.677 7.835 23 HG3 LYS 4 HG3 LYS 4 66.242 6.340 9.062 24 HD2 LYS 4 HD2 LYS 4 64.029 7.615 9.687 25 HD3 LYS 4 HD3 LYS 4 63.330 6.211 8.898 26 HE2 LYS 4 HE2 LYS 4 64.376 4.657 10.390 27 HE3 LYS 4 HE3 LYS 4 65.449 5.881 10.973 28 HZ1 LYS 4 HZ1 LYS 4 62.550 6.190 11.483 29 HZ2 LYS 4 HZ2 LYS 4 63.871 6.967 12.167 30 HZ3 LYS 4 HZ3 LYS 4 63.574 5.352 12.546 31 H ASN 5 H ASN 5 65.219 10.450 7.605 32 HA ASN 5 HA ASN 5 64.977 11.496 4.910 33 HB2 ASN 5 HB2 ASN 5 65.904 12.887 7.443 34 HB3 ASN 5 HB3 ASN 5 65.813 13.623 5.844 35 HD21 ASN 5 HD21 ASN 5 63.813 14.152 4.988 36 HD22 ASN 5 HD22 ASN 5 62.366 14.167 5.922 37 H SER 6 H SER 6 67.356 10.474 7.260 38 HA SER 6 HA SER 6 69.344 10.556 5.146 39 HB2 SER 6 HB2 SER 6 71.010 11.287 6.819 40 HB3 SER 6 HB3 SER 6 69.774 12.507 6.503 41 HG SER 6 HG SER 6 69.189 12.400 8.497 42 H ILE 7 H ILE 7 71.249 9.207 5.764 43 HA ILE 7 HA ILE 7 70.410 6.586 6.428 44 HB ILE 7 HB ILE 7 72.263 7.148 4.817 45 HG12 ILE 7 HG12 ILE 7 73.100 5.309 7.076 46 HG13 ILE 7 HG13 ILE 7 72.045 4.858 5.745 47 HG21 ILE 7 HG21 ILE 7 73.847 7.735 7.309 48 HG22 ILE 7 HG22 ILE 7 73.331 8.913 6.110 49 HG23 ILE 7 HG23 ILE 7 74.489 7.657 5.668 50 HD11 ILE 7 HD11 ILE 7 74.932 5.680 5.503 51 HD12 ILE 7 HD12 ILE 7 73.874 5.214 4.171 52 HD13 ILE 7 HD13 ILE 7 74.308 4.033 5.406 53 H SER 8 H SER 8 71.390 9.221 8.328 54 HA SER 8 HA SER 8 72.777 7.920 10.422 55 HB2 SER 8 HB2 SER 8 71.337 10.570 10.340 56 HB3 SER 8 HB3 SER 8 72.460 10.055 11.601 57 HG SER 8 HG SER 8 74.088 10.301 10.307 58 H ASP 9 H ASP 9 69.422 8.388 9.686 59 HA ASP 9 HA ASP 9 68.657 7.678 12.427 60 HB2 ASP 9 HB2 ASP 9 67.464 9.501 10.942 61 HB3 ASP 9 HB3 ASP 9 66.751 8.119 10.175 62 H TYR 10 H TYR 10 69.260 6.320 9.424 63 HA TYR 10 HA TYR 10 67.504 4.071 9.616 64 HB2 TYR 10 HB2 TYR 10 69.714 4.882 7.772 65 HB3 TYR 10 HB3 TYR 10 69.320 3.178 7.883 66 HD1 TYR 10 HD1 TYR 10 66.953 2.481 7.394 67 HD2 TYR 10 HD2 TYR 10 68.430 6.335 6.389 68 HE1 TYR 10 HE1 TYR 10 65.122 2.747 5.785 69 HE2 TYR 10 HE2 TYR 10 66.594 6.610 4.759 70 HH TYR 10 HH TYR 10 64.990 5.334 3.556 71 H THR 11 H THR 11 67.817 2.485 11.055 72 HA THR 11 HA THR 11 70.395 2.003 12.148 73 HB THR 11 HB THR 11 69.290 0.130 13.289 74 HG1 THR 11 HG1 THR 11 67.188 -0.480 12.728 75 HG21 THR 11 HG21 THR 11 67.379 2.447 13.085 76 HG22 THR 11 HG22 THR 11 68.772 2.363 14.157 77 HG23 THR 11 HG23 THR 11 67.410 1.263 14.388 78 H GLU 12 H GLU 12 71.297 -0.424 11.648 79 HA GLU 12 HA GLU 12 71.495 -0.654 8.876 80 HB2 GLU 12 HB2 GLU 12 72.481 -2.920 9.245 81 HB3 GLU 12 HB3 GLU 12 73.241 -1.642 10.173 82 HG2 GLU 12 HG2 GLU 12 72.199 -2.378 12.174 83 HG3 GLU 12 HG3 GLU 12 71.165 -3.499 11.288 84 H ALA 13 H ALA 13 69.343 -2.286 11.093 85 HA ALA 13 HA ALA 13 68.172 -3.951 9.127 86 HB1 ALA 13 HB1 ALA 13 67.038 -3.097 11.774 87 HB2 ALA 13 HB2 ALA 13 68.136 -4.460 11.489 88 HB3 ALA 13 HB3 ALA 13 66.512 -4.474 10.787 89 H GLU 14 H GLU 14 67.262 -0.705 10.333 90 HA GLU 14 HA GLU 14 64.840 -0.525 8.879 91 HB2 GLU 14 HB2 GLU 14 66.781 1.580 9.781 92 HB3 GLU 14 HB3 GLU 14 65.348 2.002 8.862 93 HG2 GLU 14 HG2 GLU 14 65.430 0.622 11.531 94 HG3 GLU 14 HG3 GLU 14 64.947 2.290 11.219 95 H PHE 15 H PHE 15 68.142 -0.003 7.996 96 HA PHE 15 HA PHE 15 67.568 1.041 5.427 97 HB2 PHE 15 HB2 PHE 15 69.689 1.336 6.812 98 HB3 PHE 15 HB3 PHE 15 70.117 -0.293 6.329 99 HD1 PHE 15 HD1 PHE 15 69.574 3.144 5.158 100 HD2 PHE 15 HD2 PHE 15 70.959 -0.730 4.182 101 HE1 PHE 15 HE1 PHE 15 70.672 4.058 3.150 102 HE2 PHE 15 HE2 PHE 15 72.069 0.168 2.161 103 HZ PHE 15 HZ PHE 15 71.921 2.569 1.657 104 H VAL 16 H VAL 16 68.480 -2.220 6.653 105 HA VAL 16 HA VAL 16 68.474 -3.455 4.135 106 HB VAL 16 HB VAL 16 68.395 -5.596 5.141 107 HG11 VAL 16 HG11 VAL 16 70.447 -4.728 5.571 108 HG12 VAL 16 HG12 VAL 16 69.946 -5.582 7.033 109 HG13 VAL 16 HG13 VAL 16 69.875 -3.823 6.968 110 HG21 VAL 16 HG21 VAL 16 66.454 -5.559 6.437 111 HG22 VAL 16 HG22 VAL 16 67.115 -4.378 7.551 112 HG23 VAL 16 HG23 VAL 16 67.771 -6.029 7.518 113 H GLN 17 H GLN 17 65.820 -2.723 6.335 114 HA GLN 17 HA GLN 17 63.769 -4.199 5.216 115 HB2 GLN 17 HB2 GLN 17 63.881 -3.000 7.392 116 HB3 GLN 17 HB3 GLN 17 63.746 -1.488 6.525 117 HG2 GLN 17 HG2 GLN 17 61.694 -3.606 6.303 118 HG3 GLN 17 HG3 GLN 17 61.722 -2.490 7.673 119 HE21 GLN 17 HE21 GLN 17 61.347 -0.390 7.280 120 HE22 GLN 17 HE22 GLN 17 60.528 0.242 5.865 121 H LEU 18 H LEU 18 64.825 -0.894 4.541 122 HA LEU 18 HA LEU 18 63.011 -0.262 2.497 123 HB2 LEU 18 HB2 LEU 18 64.303 1.419 3.498 124 HB3 LEU 18 HB3 LEU 18 65.801 0.694 3.199 125 HG LEU 18 HG LEU 18 65.473 1.094 0.732 126 HD11 LEU 18 HD11 LEU 18 63.164 2.752 1.676 127 HD12 LEU 18 HD12 LEU 18 63.094 1.308 0.666 128 HD13 LEU 18 HD13 LEU 18 63.867 2.777 0.060 129 HD21 LEU 18 HD21 LEU 18 66.037 3.473 0.858 130 HD22 LEU 18 HD22 LEU 18 66.897 2.520 2.069 131 HD23 LEU 18 HD23 LEU 18 65.506 3.497 2.541 132 H LEU 19 H LEU 19 66.155 -1.590 2.387 133 HA LEU 19 HA LEU 19 66.472 -1.911 -0.390 134 HB2 LEU 19 HB2 LEU 19 67.702 -2.969 2.017 135 HB3 LEU 19 HB3 LEU 19 68.079 -3.810 0.514 136 HG LEU 19 HG LEU 19 69.034 -1.769 -0.414 137 HD11 LEU 19 HD11 LEU 19 67.535 -0.125 0.556 138 HD12 LEU 19 HD12 LEU 19 69.224 0.262 0.953 139 HD13 LEU 19 HD13 LEU 19 68.173 -0.489 2.157 140 HD21 LEU 19 HD21 LEU 19 70.348 -3.166 1.004 141 HD22 LEU 19 HD22 LEU 19 69.892 -2.159 2.391 142 HD23 LEU 19 HD23 LEU 19 70.850 -1.470 1.060 143 H LYS 20 H LYS 20 65.092 -4.101 1.967 144 HA LYS 20 HA LYS 20 64.762 -6.281 0.211 145 HB2 LYS 20 HB2 LYS 20 63.188 -5.520 2.658 146 HB3 LYS 20 HB3 LYS 20 63.057 -7.090 1.872 147 HG2 LYS 20 HG2 LYS 20 65.613 -7.244 2.300 148 HG3 LYS 20 HG3 LYS 20 65.351 -5.895 3.354 149 HD2 LYS 20 HD2 LYS 20 63.846 -8.488 3.661 150 HD3 LYS 20 HD3 LYS 20 65.286 -8.057 4.582 151 HE2 LYS 20 HE2 LYS 20 64.150 -6.138 5.510 152 HE3 LYS 20 HE3 LYS 20 62.709 -6.479 4.546 153 HZ1 LYS 20 HZ1 LYS 20 63.841 -8.122 6.747 154 HZ2 LYS 20 HZ2 LYS 20 62.575 -8.616 5.764 155 HZ3 LYS 20 HZ3 LYS 20 62.393 -7.254 6.756 156 H GLU 21 H GLU 21 62.791 -3.494 0.981 157 HA GLU 21 HA GLU 21 60.510 -4.153 -0.558 158 HB2 GLU 21 HB2 GLU 21 61.692 -1.481 0.200 159 HB3 GLU 21 HB3 GLU 21 60.118 -1.659 -0.533 160 HG2 GLU 21 HG2 GLU 21 60.957 -2.741 2.149 161 HG3 GLU 21 HG3 GLU 21 59.990 -1.296 1.875 162 H ILE 22 H ILE 22 63.455 -2.386 -1.209 163 HA ILE 22 HA ILE 22 62.937 -1.563 -3.793 164 HB ILE 22 HB ILE 22 65.689 -2.323 -2.752 165 HG12 ILE 22 HG12 ILE 22 64.184 0.299 -2.589 166 HG13 ILE 22 HG13 ILE 22 64.589 -0.740 -1.241 167 HG21 ILE 22 HG21 ILE 22 66.456 -0.711 -4.394 168 HG22 ILE 22 HG22 ILE 22 64.796 -0.414 -4.907 169 HG23 ILE 22 HG23 ILE 22 65.533 -1.995 -5.173 170 HD11 ILE 22 HD11 ILE 22 66.082 1.169 -1.334 171 HD12 ILE 22 HD12 ILE 22 66.544 0.747 -2.978 172 HD13 ILE 22 HD13 ILE 22 66.983 -0.317 -1.647 173 H GLU 23 H GLU 23 64.231 -4.660 -2.681 174 HA GLU 23 HA GLU 23 64.988 -5.807 -5.126 175 HB2 GLU 23 HB2 GLU 23 63.733 -7.033 -2.708 176 HB3 GLU 23 HB3 GLU 23 64.311 -8.014 -4.027 177 HG2 GLU 23 HG2 GLU 23 66.565 -7.176 -3.602 178 HG3 GLU 23 HG3 GLU 23 65.930 -6.223 -2.234 179 H LYS 24 H LYS 24 61.882 -5.783 -3.501 180 HA LYS 24 HA LYS 24 60.554 -7.474 -5.348 181 HB2 LYS 24 HB2 LYS 24 59.889 -7.056 -2.976 182 HB3 LYS 24 HB3 LYS 24 59.349 -5.459 -3.516 183 HG2 LYS 24 HG2 LYS 24 57.753 -6.457 -5.026 184 HG3 LYS 24 HG3 LYS 24 58.294 -8.071 -4.553 185 HD2 LYS 24 HD2 LYS 24 57.580 -7.614 -2.256 186 HD3 LYS 24 HD3 LYS 24 57.026 -6.016 -2.768 187 HE2 LYS 24 HE2 LYS 24 55.164 -7.547 -2.640 188 HE3 LYS 24 HE3 LYS 24 55.471 -7.044 -4.301 189 HZ1 LYS 24 HZ1 LYS 24 56.307 -9.622 -3.100 190 HZ2 LYS 24 HZ2 LYS 24 56.609 -9.147 -4.684 191 HZ3 LYS 24 HZ3 LYS 24 55.027 -9.412 -4.179 192 H GLU 25 H GLU 25 60.430 -3.987 -4.764 193 HA GLU 25 HA GLU 25 58.739 -3.456 -6.899 194 HB2 GLU 25 HB2 GLU 25 60.525 -1.684 -5.220 195 HB3 GLU 25 HB3 GLU 25 59.633 -1.106 -6.581 196 HG2 GLU 25 HG2 GLU 25 58.455 -0.756 -4.417 197 HG3 GLU 25 HG3 GLU 25 57.553 -1.587 -5.678 198 H ASN 26 H ASN 26 62.126 -3.956 -6.791 199 HA ASN 26 HA ASN 26 62.842 -2.780 -9.296 200 HB2 ASN 26 HB2 ASN 26 64.493 -3.394 -7.496 201 HB3 ASN 26 HB3 ASN 26 64.171 -5.085 -7.822 202 HD21 ASN 26 HD21 ASN 26 66.691 -3.731 -7.912 203 HD22 ASN 26 HD22 ASN 26 67.291 -3.886 -9.530 204 H VAL 27 H VAL 27 62.236 -6.153 -8.289 205 HA VAL 27 HA VAL 27 62.423 -7.101 -10.963 206 HB VAL 27 HB VAL 27 61.755 -9.306 -10.117 207 HG11 VAL 27 HG11 VAL 27 63.785 -7.914 -8.386 208 HG12 VAL 27 HG12 VAL 27 64.077 -8.661 -9.957 209 HG13 VAL 27 HG13 VAL 27 63.628 -9.661 -8.574 210 HG21 VAL 27 HG21 VAL 27 61.372 -7.919 -7.456 211 HG22 VAL 27 HG22 VAL 27 61.325 -9.662 -7.720 212 HG23 VAL 27 HG23 VAL 27 60.098 -8.626 -8.449 213 H ALA 28 H ALA 28 59.813 -5.881 -9.136 214 HA ALA 28 HA ALA 28 57.837 -6.919 -11.000 215 HB1 ALA 28 HB1 ALA 28 56.206 -5.726 -9.622 216 HB2 ALA 28 HB2 ALA 28 57.521 -5.007 -8.688 217 HB3 ALA 28 HB3 ALA 28 57.252 -6.750 -8.640 218 H ALA 29 H ALA 29 59.853 -4.225 -10.640 219 HA ALA 29 HA ALA 29 60.077 -2.202 -11.546 220 HB1 ALA 29 HB1 ALA 29 58.630 -3.400 -13.917 221 HB2 ALA 29 HB2 ALA 29 60.356 -3.572 -13.593 222 HB3 ALA 29 HB3 ALA 29 59.678 -1.983 -13.943 223 H THR 30 H THR 30 58.514 -1.678 -9.805 224 HA THR 30 HA THR 30 55.830 -1.011 -10.539 225 HB THR 30 HB THR 30 55.764 -0.044 -8.241 226 HG1 THR 30 HG1 THR 30 57.737 -0.507 -7.012 227 HG21 THR 30 HG21 THR 30 57.111 -2.720 -8.428 228 HG22 THR 30 HG22 THR 30 55.380 -2.456 -8.657 229 HG23 THR 30 HG23 THR 30 56.120 -2.162 -7.076 230 H ASP 31 H ASP 31 58.843 0.505 -10.418 231 HA ASP 31 HA ASP 31 59.725 2.356 -11.172 232 HB2 ASP 31 HB2 ASP 31 58.406 2.117 -13.208 233 HB3 ASP 31 HB3 ASP 31 57.090 2.999 -12.428 234 H ASP 32 H ASP 32 56.531 3.572 -10.137 235 HA ASP 32 HA ASP 32 57.659 6.034 -9.400 236 HB2 ASP 32 HB2 ASP 32 55.250 5.897 -9.609 237 HB3 ASP 32 HB3 ASP 32 55.181 4.758 -8.260 238 H VAL 33 H VAL 33 56.897 3.330 -7.313 239 HA VAL 33 HA VAL 33 58.142 4.753 -5.112 240 HB VAL 33 HB VAL 33 56.236 3.386 -4.610 241 HG11 VAL 33 HG11 VAL 33 57.951 1.026 -5.304 242 HG12 VAL 33 HG12 VAL 33 56.483 1.535 -6.128 243 HG13 VAL 33 HG13 VAL 33 56.400 0.901 -4.481 244 HG21 VAL 33 HG21 VAL 33 58.709 2.431 -3.192 245 HG22 VAL 33 HG22 VAL 33 57.063 2.224 -2.588 246 HG23 VAL 33 HG23 VAL 33 57.733 3.843 -2.790 247 H LEU 34 H LEU 34 58.908 2.280 -7.270 248 HA LEU 34 HA LEU 34 61.343 1.285 -6.162 249 HB2 LEU 34 HB2 LEU 34 59.964 0.383 -8.187 250 HB3 LEU 34 HB3 LEU 34 60.625 1.755 -8.997 251 HG LEU 34 HG LEU 34 61.690 -0.630 -9.306 252 HD11 LEU 34 HD11 LEU 34 62.250 1.285 -10.538 253 HD12 LEU 34 HD12 LEU 34 63.718 0.445 -10.026 254 HD13 LEU 34 HD13 LEU 34 63.203 1.932 -9.204 255 HD21 LEU 34 HD21 LEU 34 63.273 0.527 -7.012 256 HD22 LEU 34 HD22 LEU 34 63.732 -0.871 -7.982 257 HD23 LEU 34 HD23 LEU 34 62.299 -0.942 -6.955 258 H ASP 35 H ASP 35 60.693 3.994 -8.340 259 HA ASP 35 HA ASP 35 63.389 4.804 -8.491 260 HB2 ASP 35 HB2 ASP 35 61.520 5.521 -10.068 261 HB3 ASP 35 HB3 ASP 35 61.003 6.554 -8.739 262 H VAL 36 H VAL 36 60.755 5.727 -6.398 263 HA VAL 36 HA VAL 36 61.928 7.761 -4.897 264 HB VAL 36 HB VAL 36 60.369 5.401 -3.806 265 HG11 VAL 36 HG11 VAL 36 61.574 6.569 -2.186 266 HG12 VAL 36 HG12 VAL 36 59.807 6.890 -2.014 267 HG13 VAL 36 HG13 VAL 36 60.905 8.106 -2.756 268 HG21 VAL 36 HG21 VAL 36 59.192 6.534 -5.452 269 HG22 VAL 36 HG22 VAL 36 59.462 8.083 -4.538 270 HG23 VAL 36 HG23 VAL 36 58.570 6.703 -3.792 271 H LEU 37 H LEU 37 62.034 4.316 -4.539 272 HA LEU 37 HA LEU 37 63.528 4.334 -2.173 273 HB2 LEU 37 HB2 LEU 37 63.372 2.074 -4.114 274 HB3 LEU 37 HB3 LEU 37 63.719 2.147 -2.391 275 HG LEU 37 HG LEU 37 61.011 2.677 -3.566 276 HD11 LEU 37 HD11 LEU 37 60.307 0.615 -2.488 277 HD12 LEU 37 HD12 LEU 37 61.973 0.297 -2.015 278 HD13 LEU 37 HD13 LEU 37 61.533 0.343 -3.724 279 HD21 LEU 37 HD21 LEU 37 60.218 2.725 -1.257 280 HD22 LEU 37 HD22 LEU 37 61.408 3.992 -1.546 281 HD23 LEU 37 HD23 LEU 37 61.869 2.526 -0.676 282 H LEU 38 H LEU 38 64.288 3.891 -5.532 283 HA LEU 38 HA LEU 38 66.968 3.180 -5.308 284 HB2 LEU 38 HB2 LEU 38 65.372 4.612 -7.323 285 HB3 LEU 38 HB3 LEU 38 67.078 4.271 -7.651 286 HG LEU 38 HG LEU 38 64.592 2.630 -7.644 287 HD11 LEU 38 HD11 LEU 38 65.538 1.689 -9.643 288 HD12 LEU 38 HD12 LEU 38 67.030 2.560 -9.317 289 HD13 LEU 38 HD13 LEU 38 65.553 3.466 -9.687 290 HD21 LEU 38 HD21 LEU 38 65.878 1.399 -6.022 291 HD22 LEU 38 HD22 LEU 38 67.285 1.413 -7.080 292 HD23 LEU 38 HD23 LEU 38 65.840 0.514 -7.546 293 H GLU 39 H GLU 39 65.487 6.396 -5.794 294 HA GLU 39 HA GLU 39 68.029 7.648 -5.601 295 HB2 GLU 39 HB2 GLU 39 66.755 9.813 -5.525 296 HB3 GLU 39 HB3 GLU 39 66.517 8.815 -6.941 297 HG2 GLU 39 HG2 GLU 39 64.367 8.299 -6.400 298 HG3 GLU 39 HG3 GLU 39 64.525 8.674 -4.702 299 H HIS 40 H HIS 40 65.458 7.058 -3.363 300 HA HIS 40 HA HIS 40 66.289 8.677 -1.239 301 HB2 HIS 40 HB2 HIS 40 64.133 7.465 -1.410 302 HB3 HIS 40 HB3 HIS 40 64.919 5.953 -1.150 303 HD1 HIS 40 HD1 HIS 40 62.936 8.223 0.668 304 HD2 HIS 40 HD2 HIS 40 66.465 6.204 1.515 305 HE1 HIS 40 HE1 HIS 40 63.139 8.183 3.153 306 H PHE 41 H PHE 41 67.052 5.393 -2.095 307 HA PHE 41 HA PHE 41 68.763 4.740 -0.026 308 HB2 PHE 41 HB2 PHE 41 67.860 3.067 -1.374 309 HB3 PHE 41 HB3 PHE 41 68.388 3.847 -2.849 310 HD1 PHE 41 HD1 PHE 41 69.530 2.050 0.144 311 HD2 PHE 41 HD2 PHE 41 70.439 3.241 -3.813 312 HE1 PHE 41 HE1 PHE 41 71.495 0.554 0.147 313 HE2 PHE 41 HE2 PHE 41 72.404 1.778 -3.801 314 HZ PHE 41 HZ PHE 41 72.927 0.429 -1.856 315 H VAL 42 H VAL 42 69.565 5.863 -3.307 316 HA VAL 42 HA VAL 42 72.294 6.020 -2.618 317 HB VAL 42 HB VAL 42 71.643 5.519 -4.864 318 HG11 VAL 42 HG11 VAL 42 70.614 8.277 -5.150 319 HG12 VAL 42 HG12 VAL 42 69.778 6.694 -5.230 320 HG13 VAL 42 HG13 VAL 42 70.970 7.114 -6.451 321 HG21 VAL 42 HG21 VAL 42 73.321 8.004 -4.692 322 HG22 VAL 42 HG22 VAL 42 73.237 6.958 -6.105 323 HG23 VAL 42 HG23 VAL 42 73.884 6.336 -4.585 324 H LYS 43 H LYS 43 69.850 8.389 -2.495 325 HA LYS 43 HA LYS 43 71.746 10.527 -2.109 326 HB2 LYS 43 HB2 LYS 43 69.987 11.999 -1.642 327 HB3 LYS 43 HB3 LYS 43 69.182 10.778 -2.606 328 HG2 LYS 43 HG2 LYS 43 68.200 9.778 -0.483 329 HG3 LYS 43 HG3 LYS 43 69.125 10.962 0.391 330 HD2 LYS 43 HD2 LYS 43 67.987 12.824 -0.580 331 HD3 LYS 43 HD3 LYS 43 67.088 11.774 -1.663 332 HE2 LYS 43 HE2 LYS 43 66.862 11.729 1.357 333 HE3 LYS 43 HE3 LYS 43 65.782 12.607 0.291 334 HZ1 LYS 43 HZ1 LYS 43 66.163 9.663 0.320 335 HZ2 LYS 43 HZ2 LYS 43 65.157 10.515 -0.751 336 HZ3 LYS 43 HZ3 LYS 43 64.821 10.523 0.879 337 H ILE 44 H ILE 44 70.484 8.174 0.082 338 HA ILE 44 HA ILE 44 71.507 9.714 2.303 339 HB ILE 44 HB ILE 44 70.675 7.894 3.779 340 HG12 ILE 44 HG12 ILE 44 69.636 6.732 1.191 341 HG13 ILE 44 HG13 ILE 44 70.891 6.022 2.185 342 HG21 ILE 44 HG21 ILE 44 68.642 8.970 1.829 343 HG22 ILE 44 HG22 ILE 44 69.286 9.827 3.223 344 HG23 ILE 44 HG23 ILE 44 68.303 8.379 3.456 345 HD11 ILE 44 HD11 ILE 44 69.266 5.685 3.964 346 HD12 ILE 44 HD12 ILE 44 68.749 4.909 2.461 347 HD13 ILE 44 HD13 ILE 44 68.028 6.437 2.966 348 H THR 45 H THR 45 72.375 6.754 0.574 349 HA THR 45 HA THR 45 74.676 6.479 2.289 350 HB THR 45 HB THR 45 73.751 4.377 1.553 351 HG1 THR 45 HG1 THR 45 76.312 5.135 0.955 352 HG21 THR 45 HG21 THR 45 74.353 5.266 -1.282 353 HG22 THR 45 HG22 THR 45 72.748 5.097 -0.580 354 HG23 THR 45 HG23 THR 45 73.759 3.675 -0.807 355 H GLU 46 H GLU 46 73.981 7.799 -0.861 356 HA GLU 46 HA GLU 46 75.092 8.969 -2.345 357 HB2 GLU 46 HB2 GLU 46 76.935 9.351 -0.044 358 HB3 GLU 46 HB3 GLU 46 77.087 10.267 -1.554 359 HG2 GLU 46 HG2 GLU 46 74.858 11.173 -1.128 360 HG3 GLU 46 HG3 GLU 46 74.770 10.219 0.350 361 H HIS 47 H HIS 47 75.719 6.129 -1.947 362 HA HIS 47 HA HIS 47 78.450 5.687 -2.588 363 HB2 HIS 47 HB2 HIS 47 76.719 4.012 -1.627 364 HB3 HIS 47 HB3 HIS 47 76.161 3.831 -3.282 365 HD1 HIS 47 HD1 HIS 47 78.082 2.738 -5.018 366 HD2 HIS 47 HD2 HIS 47 78.845 2.551 -0.939 367 HE1 HIS 47 HE1 HIS 47 79.881 1.065 -4.742 368 HA PRO 48 HA PRO 48 78.093 7.032 -6.911 369 HB2 PRO 48 HB2 PRO 48 80.348 5.254 -7.389 370 HB3 PRO 48 HB3 PRO 48 80.223 7.001 -7.635 371 HG2 PRO 48 HG2 PRO 48 81.627 5.729 -5.782 372 HG3 PRO 48 HG3 PRO 48 80.938 7.347 -5.410 373 HD2 PRO 48 HD2 PRO 48 80.116 4.593 -4.586 374 HD3 PRO 48 HD3 PRO 48 79.979 6.127 -3.700 375 H ASP 49 H ASP 49 77.360 4.108 -5.861 376 HA ASP 49 HA ASP 49 77.097 3.218 -8.472 377 HB2 ASP 49 HB2 ASP 49 78.199 1.459 -6.275 378 HB3 ASP 49 HB3 ASP 49 77.532 0.755 -7.709 379 H GLY 50 H GLY 50 75.417 4.407 -6.448 380 HA2 GLY 50 HA2 GLY 50 74.034 2.944 -4.548 381 HA3 GLY 50 HA3 GLY 50 73.383 4.284 -5.460 382 H THR 51 H THR 51 72.979 3.471 -7.791 383 HA THR 51 HA THR 51 71.000 1.575 -7.134 384 HB THR 51 HB THR 51 70.558 2.048 -9.826 385 HG1 THR 51 HG1 THR 51 70.553 4.580 -9.133 386 HG21 THR 51 HG21 THR 51 69.461 3.238 -7.275 387 HG22 THR 51 HG22 THR 51 68.911 1.797 -8.102 388 HG23 THR 51 HG23 THR 51 68.680 3.379 -8.844 389 H ALA 52 H ALA 52 73.978 1.452 -8.779 390 HA ALA 52 HA ALA 52 73.554 -0.984 -10.177 391 HB1 ALA 52 HB1 ALA 52 75.485 0.513 -10.613 392 HB2 ALA 52 HB2 ALA 52 75.975 -1.138 -10.258 393 HB3 ALA 52 HB3 ALA 52 76.120 0.112 -9.019 394 H LEU 53 H LEU 53 74.459 -0.212 -6.874 395 HA LEU 53 HA LEU 53 75.014 -2.858 -6.071 396 HB2 LEU 53 HB2 LEU 53 74.039 -0.539 -4.445 397 HB3 LEU 53 HB3 LEU 53 74.616 -2.053 -3.780 398 HG LEU 53 HG LEU 53 76.212 -0.000 -5.296 399 HD11 LEU 53 HD11 LEU 53 75.750 0.557 -3.012 400 HD12 LEU 53 HD12 LEU 53 77.454 0.149 -3.216 401 HD13 LEU 53 HD13 LEU 53 76.346 -1.013 -2.481 402 HD21 LEU 53 HD21 LEU 53 77.079 -2.712 -4.287 403 HD22 LEU 53 HD22 LEU 53 78.161 -1.453 -4.875 404 HD23 LEU 53 HD23 LEU 53 77.002 -2.196 -5.972 405 H ILE 54 H ILE 54 72.077 -1.051 -6.277 406 HA ILE 54 HA ILE 54 70.464 -2.892 -4.819 407 HB ILE 54 HB ILE 54 69.920 -0.614 -6.686 408 HG12 ILE 54 HG12 ILE 54 68.853 -1.135 -3.937 409 HG13 ILE 54 HG13 ILE 54 70.390 -0.340 -4.163 410 HG21 ILE 54 HG21 ILE 54 67.781 -2.489 -5.699 411 HG22 ILE 54 HG22 ILE 54 68.275 -2.248 -7.375 412 HG23 ILE 54 HG23 ILE 54 67.498 -0.934 -6.487 413 HD11 ILE 54 HD11 ILE 54 68.625 1.256 -3.776 414 HD12 ILE 54 HD12 ILE 54 67.706 0.611 -5.143 415 HD13 ILE 54 HD13 ILE 54 69.239 1.429 -5.416 416 H TYR 55 H TYR 55 71.128 -2.307 -8.186 417 HA TYR 55 HA TYR 55 69.470 -4.278 -9.137 418 HB2 TYR 55 HB2 TYR 55 71.615 -2.628 -10.268 419 HB3 TYR 55 HB3 TYR 55 71.104 -4.016 -11.203 420 HD1 TYR 55 HD1 TYR 55 68.667 -4.164 -11.902 421 HD2 TYR 55 HD2 TYR 55 70.266 -0.674 -10.086 422 HE1 TYR 55 HE1 TYR 55 66.718 -2.875 -12.675 423 HE2 TYR 55 HE2 TYR 55 68.333 0.620 -10.846 424 HH TYR 55 HH TYR 55 65.506 -0.772 -12.024 425 H GLU 56 H GLU 56 72.994 -4.385 -8.499 426 HA GLU 56 HA GLU 56 73.216 -7.082 -9.274 427 HB2 GLU 56 HB2 GLU 56 75.303 -7.130 -7.799 428 HB3 GLU 56 HB3 GLU 56 75.337 -6.037 -9.165 429 HG2 GLU 56 HG2 GLU 56 74.932 -4.172 -7.764 430 HG3 GLU 56 HG3 GLU 56 74.676 -5.151 -6.344 431 H ALA 57 H ALA 57 72.436 -5.595 -6.179 432 HA ALA 57 HA ALA 57 72.525 -7.891 -4.601 433 HB1 ALA 57 HB1 ALA 57 72.241 -5.668 -3.689 434 HB2 ALA 57 HB2 ALA 57 71.004 -6.778 -3.099 435 HB3 ALA 57 HB3 ALA 57 70.610 -5.595 -4.350 436 H ALA 58 H ALA 58 69.791 -6.498 -6.367 437 HA ALA 58 HA ALA 58 67.869 -8.355 -5.598 438 HB1 ALA 58 HB1 ALA 58 66.585 -7.624 -7.537 439 HB2 ALA 58 HB2 ALA 58 68.033 -6.906 -8.241 440 HB3 ALA 58 HB3 ALA 58 67.357 -6.245 -6.755 441 H ALA 59 H ALA 59 70.026 -8.418 -8.393 442 HA ALA 59 HA ALA 59 69.026 -10.865 -9.422 443 HB1 ALA 59 HB1 ALA 59 71.651 -9.486 -9.955 444 HB2 ALA 59 HB2 ALA 59 70.144 -9.203 -10.825 445 HB3 ALA 59 HB3 ALA 59 70.942 -10.772 -10.930 446 H ARG 60 H ARG 60 71.862 -10.030 -7.456 447 HA ARG 60 HA ARG 60 72.894 -12.648 -7.428 448 HB2 ARG 60 HB2 ARG 60 73.465 -10.313 -5.610 449 HB3 ARG 60 HB3 ARG 60 74.325 -11.845 -5.525 450 HG2 ARG 60 HG2 ARG 60 75.174 -11.560 -7.752 451 HG3 ARG 60 HG3 ARG 60 74.199 -10.108 -7.981 452 HD2 ARG 60 HD2 ARG 60 75.453 -9.035 -6.147 453 HD3 ARG 60 HD3 ARG 60 76.475 -10.466 -6.032 454 HE ARG 60 HE ARG 60 76.505 -9.626 -8.672 455 HH11 ARG 60 HH11 ARG 60 77.636 -8.413 -5.557 456 HH12 ARG 60 HH12 ARG 60 78.855 -7.434 -6.236 457 HH21 ARG 60 HH21 ARG 60 78.178 -8.317 -9.587 458 HH22 ARG 60 HH22 ARG 60 79.168 -7.381 -8.571 459 H ALA 61 H ALA 61 70.720 -10.923 -5.270 460 HA ALA 61 HA ALA 61 70.742 -12.871 -3.209 461 HB1 ALA 61 HB1 ALA 61 68.657 -10.788 -3.799 462 HB2 ALA 61 HB2 ALA 61 70.149 -10.527 -2.904 463 HB3 ALA 61 HB3 ALA 61 68.926 -11.630 -2.262 464 H ALA 62 H ALA 62 69.005 -12.520 -6.172 465 HA ALA 62 HA ALA 62 66.819 -14.169 -5.546 466 HB1 ALA 62 HB1 ALA 62 66.835 -12.611 -7.420 467 HB2 ALA 62 HB2 ALA 62 66.436 -14.246 -7.958 468 HB3 ALA 62 HB3 ALA 62 68.053 -13.586 -8.238 469 H ALA 63 H ALA 63 70.061 -14.837 -6.364 470 HA ALA 63 HA ALA 63 69.484 -17.722 -6.508 471 HB1 ALA 63 HB1 ALA 63 72.025 -16.232 -7.190 472 HB2 ALA 63 HB2 ALA 63 70.856 -16.859 -8.351 473 HB3 ALA 63 HB3 ALA 63 71.787 -17.971 -7.349 474 H ASN 64 H ASN 64 71.345 -15.267 -4.882 475 HA ASN 64 HA ASN 64 72.336 -15.021 -2.960 476 HB2 ASN 64 HB2 ASN 64 70.238 -15.567 -1.897 477 HB3 ASN 64 HB3 ASN 64 70.560 -17.290 -2.049 478 HD21 ASN 64 HD21 ASN 64 71.470 -14.338 -0.358 479 HD22 ASN 64 HD22 ASN 64 72.244 -15.132 0.950 480 HA PRO 65 HA PRO 65 75.632 -18.070 -3.457 481 HB2 PRO 65 HB2 PRO 65 77.460 -15.849 -3.667 482 HB3 PRO 65 HB3 PRO 65 77.006 -16.992 -4.929 483 HG2 PRO 65 HG2 PRO 65 76.334 -14.323 -4.958 484 HG3 PRO 65 HG3 PRO 65 75.426 -15.584 -5.804 485 HD2 PRO 65 HD2 PRO 65 74.854 -14.279 -3.172 486 HD3 PRO 65 HD3 PRO 65 73.729 -14.725 -4.482 487 H GLY 66 H GLY 66 75.065 -15.361 -1.420 488 HA2 GLY 66 HA2 GLY 66 76.058 -16.564 0.883 489 HA3 GLY 66 HA3 GLY 66 77.219 -15.374 0.285 490 H GLY 67 H GLY 67 76.079 -14.894 2.672 491 HA2 GLY 67 HA2 GLY 67 73.683 -13.398 2.553 492 HA3 GLY 67 HA3 GLY 67 74.859 -13.382 3.864 493 H ASP 68 H ASP 68 77.082 -12.546 2.523 494 HA ASP 68 HA ASP 68 76.551 -9.747 2.232 495 HB2 ASP 68 HB2 ASP 68 78.988 -9.512 1.783 496 HB3 ASP 68 HB3 ASP 68 78.661 -10.384 3.272 497 H GLY 69 H GLY 69 76.610 -8.523 0.406 498 HA2 GLY 69 HA2 GLY 69 76.401 -8.006 -1.797 499 HA3 GLY 69 HA3 GLY 69 77.194 -9.531 -2.193 500 H GLY 70 H GLY 70 75.527 -11.394 -1.425 501 HA2 GLY 70 HA2 GLY 70 73.396 -11.081 -3.360 502 HA3 GLY 70 HA3 GLY 70 73.905 -12.577 -2.590 503 H GLY 71 H GLY 71 72.577 -9.456 -1.610 504 HA2 GLY 71 HA2 GLY 71 70.087 -10.201 -0.924 505 HA3 GLY 71 HA3 GLY 71 70.996 -10.596 0.510 506 HA PRO 72 HA PRO 72 69.709 -6.049 0.265 507 HB2 PRO 72 HB2 PRO 72 68.124 -6.401 2.548 508 HB3 PRO 72 HB3 PRO 72 67.577 -6.184 0.883 509 HG2 PRO 72 HG2 PRO 72 67.820 -8.684 2.472 510 HG3 PRO 72 HG3 PRO 72 66.678 -8.276 1.183 511 HD2 PRO 72 HD2 PRO 72 68.747 -9.933 0.821 512 HD3 PRO 72 HD3 PRO 72 68.110 -8.907 -0.474 513 H GLU 73 H GLU 73 70.199 -8.347 2.879 514 HA GLU 73 HA GLU 73 71.546 -6.474 4.646 515 HB2 GLU 73 HB2 GLU 73 71.364 -9.489 4.800 516 HB3 GLU 73 HB3 GLU 73 71.813 -8.393 6.094 517 HG2 GLU 73 HG2 GLU 73 69.545 -7.468 6.084 518 HG3 GLU 73 HG3 GLU 73 69.123 -8.558 4.781 519 H GLY 74 H GLY 74 72.509 -7.861 1.872 520 HA2 GLY 74 HA2 GLY 74 75.170 -7.911 2.967 521 HA3 GLY 74 HA3 GLY 74 74.775 -8.827 1.460 522 H ILE 75 H ILE 75 73.325 -6.444 0.440 523 HA ILE 75 HA ILE 75 75.519 -4.917 -0.507 524 HB ILE 75 HB ILE 75 73.584 -3.149 -0.900 525 HG12 ILE 75 HG12 ILE 75 72.063 -5.752 -0.933 526 HG13 ILE 75 HG13 ILE 75 72.019 -4.639 0.420 527 HG21 ILE 75 HG21 ILE 75 73.272 -4.109 -3.084 528 HG22 ILE 75 HG22 ILE 75 74.031 -5.617 -2.536 529 HG23 ILE 75 HG23 ILE 75 74.957 -4.109 -2.576 530 HD11 ILE 75 HD11 ILE 75 70.111 -4.417 -0.975 531 HD12 ILE 75 HD12 ILE 75 71.137 -3.998 -2.377 532 HD13 ILE 75 HD13 ILE 75 71.094 -2.965 -0.920 533 H VAL 76 H VAL 76 73.485 -4.639 2.328 534 HA VAL 76 HA VAL 76 74.050 -2.063 2.915 535 HB VAL 76 HB VAL 76 73.602 -2.678 5.105 536 HG11 VAL 76 HG11 VAL 76 71.560 -3.943 3.353 537 HG12 VAL 76 HG12 VAL 76 71.863 -2.231 3.463 538 HG13 VAL 76 HG13 VAL 76 71.267 -3.094 4.889 539 HG21 VAL 76 HG21 VAL 76 74.497 -4.800 5.439 540 HG22 VAL 76 HG22 VAL 76 73.400 -5.497 4.246 541 HG23 VAL 76 HG23 VAL 76 72.769 -4.885 5.781 542 H LYS 77 H LYS 77 75.787 -4.939 3.406 543 HA LYS 77 HA LYS 77 77.890 -4.004 5.018 544 HB2 LYS 77 HB2 LYS 77 77.546 -6.387 4.540 545 HB3 LYS 77 HB3 LYS 77 77.962 -6.123 2.860 546 HG2 LYS 77 HG2 LYS 77 80.239 -5.489 3.536 547 HG3 LYS 77 HG3 LYS 77 79.813 -5.832 5.216 548 HD2 LYS 77 HD2 LYS 77 79.325 -8.148 4.626 549 HD3 LYS 77 HD3 LYS 77 79.711 -7.808 2.943 550 HE2 LYS 77 HE2 LYS 77 81.631 -7.582 5.258 551 HE3 LYS 77 HE3 LYS 77 81.559 -8.920 4.113 552 HZ1 LYS 77 HZ1 LYS 77 82.190 -6.088 3.406 553 HZ2 LYS 77 HZ2 LYS 77 82.141 -7.386 2.339 554 HZ3 LYS 77 HZ3 LYS 77 83.295 -7.346 3.554 555 H GLU 78 H GLU 78 77.575 -4.152 1.473 556 HA GLU 78 HA GLU 78 80.029 -2.980 0.781 557 HB2 GLU 78 HB2 GLU 78 78.474 -4.115 -0.829 558 HB3 GLU 78 HB3 GLU 78 77.386 -2.750 -0.784 559 HG2 GLU 78 HG2 GLU 78 78.665 -2.558 -2.735 560 HG3 GLU 78 HG3 GLU 78 79.270 -1.339 -1.614 561 H ILE 79 H ILE 79 76.898 -1.579 1.437 562 HA ILE 79 HA ILE 79 77.510 1.107 0.959 563 HB ILE 79 HB ILE 79 75.402 -0.200 2.660 564 HG12 ILE 79 HG12 ILE 79 75.156 -0.589 0.279 565 HG13 ILE 79 HG13 ILE 79 73.882 0.489 0.843 566 HG21 ILE 79 HG21 ILE 79 75.608 2.737 2.038 567 HG22 ILE 79 HG22 ILE 79 75.754 1.978 3.624 568 HG23 ILE 79 HG23 ILE 79 74.212 1.940 2.769 569 HD11 ILE 79 HD11 ILE 79 76.352 1.245 -0.698 570 HD12 ILE 79 HD12 ILE 79 75.219 2.391 -0.004 571 HD13 ILE 79 HD13 ILE 79 74.680 1.283 -1.263 572 H LYS 80 H LYS 80 77.553 -0.782 3.957 573 HA LYS 80 HA LYS 80 78.036 1.453 5.596 574 HB2 LYS 80 HB2 LYS 80 78.210 -0.044 7.442 575 HB3 LYS 80 HB3 LYS 80 77.044 -0.742 6.335 576 HG2 LYS 80 HG2 LYS 80 78.789 -2.261 5.508 577 HG3 LYS 80 HG3 LYS 80 79.876 -1.631 6.740 578 HD2 LYS 80 HD2 LYS 80 78.102 -2.227 8.434 579 HD3 LYS 80 HD3 LYS 80 77.287 -3.112 7.147 580 HE2 LYS 80 HE2 LYS 80 78.617 -4.675 8.391 581 HE3 LYS 80 HE3 LYS 80 79.384 -4.427 6.823 582 HZ1 LYS 80 HZ1 LYS 80 80.186 -3.154 9.377 583 HZ2 LYS 80 HZ2 LYS 80 80.952 -2.895 7.895 584 HZ3 LYS 80 HZ3 LYS 80 80.990 -4.414 8.613 585 H GLU 81 H GLU 81 80.172 -0.831 4.013 586 HA GLU 81 HA GLU 81 82.465 0.005 5.423 587 HB2 GLU 81 HB2 GLU 81 82.211 -1.496 2.828 588 HB3 GLU 81 HB3 GLU 81 83.729 -1.235 3.680 589 HG2 GLU 81 HG2 GLU 81 82.835 -2.433 5.615 590 HG3 GLU 81 HG3 GLU 81 81.336 -2.707 4.739 591 H TRP 82 H TRP 82 81.039 0.908 2.370 592 HA TRP 82 HA TRP 82 83.088 2.580 1.389 593 HB2 TRP 82 HB2 TRP 82 80.949 1.771 0.200 594 HB3 TRP 82 HB3 TRP 82 80.182 3.072 1.140 595 HD1 TRP 82 HD1 TRP 82 82.771 2.626 -1.672 596 HE1 TRP 82 HE1 TRP 82 82.878 4.789 -3.018 597 HE3 TRP 82 HE3 TRP 82 79.686 5.520 1.203 598 HZ2 TRP 82 HZ2 TRP 82 81.792 7.351 -2.930 599 HZ3 TRP 82 HZ3 TRP 82 79.271 7.834 0.501 600 HH2 TRP 82 HH2 TRP 82 80.308 8.749 -1.515 601 H ARG 83 H ARG 83 80.200 3.159 3.281 602 HA ARG 83 HA ARG 83 80.309 5.949 3.475 603 HB2 ARG 83 HB2 ARG 83 78.466 4.134 4.198 604 HB3 ARG 83 HB3 ARG 83 79.418 4.297 5.689 605 HG2 ARG 83 HG2 ARG 83 77.628 5.730 5.995 606 HG3 ARG 83 HG3 ARG 83 79.109 6.622 5.624 607 HD2 ARG 83 HD2 ARG 83 78.369 7.131 3.416 608 HD3 ARG 83 HD3 ARG 83 76.948 6.085 3.592 609 HE ARG 83 HE ARG 83 76.681 7.738 5.655 610 HH11 ARG 83 HH11 ARG 83 76.960 8.424 2.156 611 HH12 ARG 83 HH12 ARG 83 76.375 10.022 2.322 612 HH21 ARG 83 HH21 ARG 83 75.821 9.928 5.779 613 HH22 ARG 83 HH22 ARG 83 75.715 10.854 4.365 614 H ALA 84 H ALA 84 81.467 3.361 5.624 615 HA ALA 84 HA ALA 84 82.505 5.054 7.627 616 HB1 ALA 84 HB1 ALA 84 81.903 2.718 8.052 617 HB2 ALA 84 HB2 ALA 84 83.579 3.046 8.504 618 HB3 ALA 84 HB3 ALA 84 83.220 2.192 7.005 619 H ALA 85 H ALA 85 83.949 3.527 4.781 620 HA ALA 85 HA ALA 85 86.606 4.291 5.393 621 HB1 ALA 85 HB1 ALA 85 85.393 3.651 2.708 622 HB2 ALA 85 HB2 ALA 85 86.078 2.475 3.830 623 HB3 ALA 85 HB3 ALA 85 87.115 3.696 3.092 624 H ASN 86 H ASN 86 84.015 5.792 3.560 625 HA ASN 86 HA ASN 86 85.556 7.955 2.523 626 HB2 ASN 86 HB2 ASN 86 83.180 7.184 1.796 627 HB3 ASN 86 HB3 ASN 86 82.609 8.133 3.162 628 HD21 ASN 86 HD21 ASN 86 82.968 10.496 3.092 629 HD22 ASN 86 HD22 ASN 86 83.214 11.243 1.573 630 H GLY 87 H GLY 87 83.765 7.394 5.444 631 HA2 GLY 87 HA2 GLY 87 84.299 8.439 7.501 632 HA3 GLY 87 HA3 GLY 87 84.935 9.814 6.594 633 H LYS 88 H LYS 88 81.802 8.093 6.160 634 HA LYS 88 HA LYS 88 80.453 10.555 6.767 635 HB2 LYS 88 HB2 LYS 88 80.231 8.388 4.743 636 HB3 LYS 88 HB3 LYS 88 78.805 9.254 5.243 637 HG2 LYS 88 HG2 LYS 88 79.787 11.336 4.391 638 HG3 LYS 88 HG3 LYS 88 81.292 10.478 4.042 639 HD2 LYS 88 HD2 LYS 88 80.214 9.131 2.370 640 HD3 LYS 88 HD3 LYS 88 78.636 9.788 2.792 641 HE2 LYS 88 HE2 LYS 88 80.912 11.439 1.702 642 HE3 LYS 88 HE3 LYS 88 79.671 10.703 0.698 643 HZ1 LYS 88 HZ1 LYS 88 77.991 12.042 1.857 644 HZ2 LYS 88 HZ2 LYS 88 79.162 13.048 1.211 645 HZ3 LYS 88 HZ3 LYS 88 79.164 12.707 2.852 646 HA PRO 89 HA PRO 89 78.587 8.000 9.959 647 HB2 PRO 89 HB2 PRO 89 75.997 8.984 9.856 648 HB3 PRO 89 HB3 PRO 89 77.314 9.748 10.753 649 HG2 PRO 89 HG2 PRO 89 76.220 10.417 8.053 650 HG3 PRO 89 HG3 PRO 89 76.775 11.502 9.338 651 HD2 PRO 89 HD2 PRO 89 78.286 10.977 7.181 652 HD3 PRO 89 HD3 PRO 89 79.007 11.217 8.785 653 H GLY 90 H GLY 90 77.871 5.980 9.852 654 HA2 GLY 90 HA2 GLY 90 76.464 5.150 7.427 655 HA3 GLY 90 HA3 GLY 90 77.389 4.098 8.494 656 H PHE 91 H PHE 91 75.932 2.650 9.078 657 HA PHE 91 HA PHE 91 73.171 3.344 9.466 658 HB2 PHE 91 HB2 PHE 91 74.540 0.742 10.102 659 HB3 PHE 91 HB3 PHE 91 72.814 1.019 9.929 660 HD1 PHE 91 HD1 PHE 91 72.847 2.669 7.432 661 HD2 PHE 91 HD2 PHE 91 74.952 -0.854 8.523 662 HE1 PHE 91 HE1 PHE 91 73.035 2.048 5.075 663 HE2 PHE 91 HE2 PHE 91 75.138 -1.476 6.165 664 HZ PHE 91 HZ PHE 91 74.180 -0.029 4.440 665 H LYS 92 H LYS 92 72.048 3.247 11.322 666 HA LYS 92 HA LYS 92 73.381 3.797 13.729 667 HB2 LYS 92 HB2 LYS 92 70.731 3.896 12.791 668 HB3 LYS 92 HB3 LYS 92 70.791 2.806 14.190 669 HG2 LYS 92 HG2 LYS 92 71.943 4.414 15.416 670 HG3 LYS 92 HG3 LYS 92 71.882 5.495 14.004 671 HD2 LYS 92 HD2 LYS 92 70.110 6.226 15.481 672 HD3 LYS 92 HD3 LYS 92 69.335 5.304 14.189 673 HE2 LYS 92 HE2 LYS 92 68.346 4.542 16.229 674 HE3 LYS 92 HE3 LYS 92 69.496 3.299 15.730 675 HZ1 LYS 92 HZ1 LYS 92 71.114 4.335 17.301 676 HZ2 LYS 92 HZ2 LYS 92 69.793 3.584 17.964 677 HZ3 LYS 92 HZ3 LYS 92 69.831 5.271 17.898 678 H GLN 93 H GLN 93 73.232 2.588 15.570 679 HA GLN 93 HA GLN 93 73.788 -0.216 15.145 680 HB2 GLN 93 HB2 GLN 93 74.451 -0.233 17.402 681 HB3 GLN 93 HB3 GLN 93 75.193 1.158 16.577 682 HG2 GLN 93 HG2 GLN 93 73.171 2.444 17.584 683 HG3 GLN 93 HG3 GLN 93 73.039 1.064 18.665 684 HE21 GLN 93 HE21 GLN 93 75.992 2.489 17.383 685 HE22 GLN 93 HE22 GLN 93 76.605 2.996 18.905 686 H GLY 94 H GLY 94 71.248 1.382 15.500 687 HA2 GLY 94 HA2 GLY 94 69.025 0.619 15.741 688 HA3 GLY 94 HA3 GLY 94 69.650 -0.842 16.508 Start of MODEL 17 1 H GLU 2 H GLU 2 59.157 2.264 6.273 2 HA GLU 2 HA GLU 2 58.521 4.429 6.857 3 HB2 GLU 2 HB2 GLU 2 60.146 3.915 9.366 4 HB3 GLU 2 HB3 GLU 2 59.542 5.480 8.857 5 HG2 GLU 2 HG2 GLU 2 57.811 3.109 9.503 6 HG3 GLU 2 HG3 GLU 2 58.156 4.450 10.595 7 H LEU 3 H LEU 3 60.072 6.280 6.669 8 HA LEU 3 HA LEU 3 62.645 5.365 5.575 9 HB2 LEU 3 HB2 LEU 3 60.866 7.607 4.617 10 HB3 LEU 3 HB3 LEU 3 62.439 7.214 3.967 11 HG LEU 3 HG LEU 3 59.961 5.522 3.789 12 HD11 LEU 3 HD11 LEU 3 60.147 5.945 1.383 13 HD12 LEU 3 HD12 LEU 3 61.549 6.973 1.667 14 HD13 LEU 3 HD13 LEU 3 59.968 7.456 2.275 15 HD21 LEU 3 HD21 LEU 3 61.320 4.036 2.416 16 HD22 LEU 3 HD22 LEU 3 61.920 4.162 4.076 17 HD23 LEU 3 HD23 LEU 3 62.740 5.023 2.778 18 H LYS 4 H LYS 4 64.332 6.741 5.991 19 HA LYS 4 HA LYS 4 63.839 8.868 7.954 20 HB2 LYS 4 HB2 LYS 4 66.514 7.679 7.242 21 HB3 LYS 4 HB3 LYS 4 66.073 8.599 8.678 22 HG2 LYS 4 HG2 LYS 4 65.561 5.726 7.974 23 HG3 LYS 4 HG3 LYS 4 66.449 6.355 9.344 24 HD2 LYS 4 HD2 LYS 4 64.082 7.407 9.863 25 HD3 LYS 4 HD3 LYS 4 63.578 6.069 8.857 26 HE2 LYS 4 HE2 LYS 4 64.932 4.483 10.236 27 HE3 LYS 4 HE3 LYS 4 65.299 5.799 11.314 28 HZ1 LYS 4 HZ1 LYS 4 62.969 6.019 11.887 29 HZ2 LYS 4 HZ2 LYS 4 63.512 4.478 12.215 30 HZ3 LYS 4 HZ3 LYS 4 62.554 4.734 10.876 31 H ASN 5 H ASN 5 65.227 10.845 7.552 32 HA ASN 5 HA ASN 5 65.243 11.386 4.693 33 HB2 ASN 5 HB2 ASN 5 65.673 13.174 7.074 34 HB3 ASN 5 HB3 ASN 5 66.065 13.714 5.448 35 HD21 ASN 5 HD21 ASN 5 63.372 11.577 6.001 36 HD22 ASN 5 HD22 ASN 5 62.137 12.735 5.705 37 H SER 6 H SER 6 67.475 10.372 6.982 38 HA SER 6 HA SER 6 69.613 10.730 5.056 39 HB2 SER 6 HB2 SER 6 71.074 11.188 7.053 40 HB3 SER 6 HB3 SER 6 70.085 12.534 6.475 41 HG SER 6 HG SER 6 69.293 12.590 8.401 42 H ILE 7 H ILE 7 71.453 9.388 5.558 43 HA ILE 7 HA ILE 7 70.808 6.670 5.988 44 HB ILE 7 HB ILE 7 72.692 7.563 4.615 45 HG12 ILE 7 HG12 ILE 7 74.426 5.854 5.348 46 HG13 ILE 7 HG13 ILE 7 73.368 5.509 6.714 47 HG21 ILE 7 HG21 ILE 7 74.037 8.117 7.242 48 HG22 ILE 7 HG22 ILE 7 73.532 9.296 6.034 49 HG23 ILE 7 HG23 ILE 7 74.826 8.155 5.665 50 HD11 ILE 7 HD11 ILE 7 73.120 3.948 4.874 51 HD12 ILE 7 HD12 ILE 7 72.631 5.275 3.822 52 HD13 ILE 7 HD13 ILE 7 71.623 4.821 5.200 53 H SER 8 H SER 8 71.540 9.234 8.121 54 HA SER 8 HA SER 8 72.995 7.795 10.041 55 HB2 SER 8 HB2 SER 8 72.801 10.107 11.173 56 HB3 SER 8 HB3 SER 8 73.627 9.967 9.606 57 HG SER 8 HG SER 8 71.156 11.114 10.176 58 H ASP 9 H ASP 9 69.657 8.125 9.480 59 HA ASP 9 HA ASP 9 69.138 7.479 12.310 60 HB2 ASP 9 HB2 ASP 9 67.720 9.351 11.161 61 HB3 ASP 9 HB3 ASP 9 67.041 8.046 10.245 62 H TYR 10 H TYR 10 69.718 6.067 9.430 63 HA TYR 10 HA TYR 10 67.844 3.887 9.680 64 HB2 TYR 10 HB2 TYR 10 69.998 4.552 7.678 65 HB3 TYR 10 HB3 TYR 10 69.377 2.918 7.791 66 HD1 TYR 10 HD1 TYR 10 66.903 2.561 7.448 67 HD2 TYR 10 HD2 TYR 10 68.849 6.196 6.418 68 HE1 TYR 10 HE1 TYR 10 65.023 3.137 5.973 69 HE2 TYR 10 HE2 TYR 10 66.961 6.782 4.929 70 HH TYR 10 HH TYR 10 65.082 5.763 3.788 71 H THR 11 H THR 11 68.257 2.406 11.179 72 HA THR 11 HA THR 11 70.910 1.944 12.058 73 HB THR 11 HB THR 11 69.965 0.255 13.530 74 HG1 THR 11 HG1 THR 11 68.337 -0.949 12.975 75 HG21 THR 11 HG21 THR 11 67.859 2.339 13.024 76 HG22 THR 11 HG22 THR 11 69.227 2.451 14.143 77 HG23 THR 11 HG23 THR 11 67.940 1.295 14.435 78 H GLU 12 H GLU 12 71.715 -0.551 11.633 79 HA GLU 12 HA GLU 12 71.661 -0.888 8.857 80 HB2 GLU 12 HB2 GLU 12 72.776 -3.131 9.273 81 HB3 GLU 12 HB3 GLU 12 73.594 -1.714 9.897 82 HG2 GLU 12 HG2 GLU 12 72.741 -2.212 12.130 83 HG3 GLU 12 HG3 GLU 12 71.931 -3.642 11.485 84 H ALA 13 H ALA 13 69.632 -2.327 11.292 85 HA ALA 13 HA ALA 13 68.298 -4.120 9.509 86 HB1 ALA 13 HB1 ALA 13 67.294 -2.966 12.114 87 HB2 ALA 13 HB2 ALA 13 68.222 -4.461 11.944 88 HB3 ALA 13 HB3 ALA 13 66.608 -4.342 11.255 89 H GLU 14 H GLU 14 67.561 -0.818 10.632 90 HA GLU 14 HA GLU 14 65.077 -0.446 9.379 91 HB2 GLU 14 HB2 GLU 14 67.327 1.490 9.868 92 HB3 GLU 14 HB3 GLU 14 65.796 2.018 9.221 93 HG2 GLU 14 HG2 GLU 14 66.228 0.698 11.887 94 HG3 GLU 14 HG3 GLU 14 66.024 2.427 11.614 95 H PHE 15 H PHE 15 68.329 -0.063 8.205 96 HA PHE 15 HA PHE 15 67.696 1.059 5.715 97 HB2 PHE 15 HB2 PHE 15 70.015 0.890 6.930 98 HB3 PHE 15 HB3 PHE 15 70.049 -0.682 6.197 99 HD1 PHE 15 HD1 PHE 15 69.271 2.785 5.134 100 HD2 PHE 15 HD2 PHE 15 71.108 -0.928 4.240 101 HE1 PHE 15 HE1 PHE 15 70.121 3.711 3.026 102 HE2 PHE 15 HE2 PHE 15 71.960 -0.006 2.141 103 HZ PHE 15 HZ PHE 15 71.463 2.320 1.543 104 H VAL 16 H VAL 16 68.620 -2.260 6.606 105 HA VAL 16 HA VAL 16 68.200 -3.124 4.031 106 HB VAL 16 HB VAL 16 69.704 -4.284 5.482 107 HG11 VAL 16 HG11 VAL 16 68.662 -4.141 7.427 108 HG12 VAL 16 HG12 VAL 16 68.999 -5.854 7.017 109 HG13 VAL 16 HG13 VAL 16 67.324 -5.201 6.883 110 HG21 VAL 16 HG21 VAL 16 68.946 -5.476 3.552 111 HG22 VAL 16 HG22 VAL 16 67.541 -6.060 4.445 112 HG23 VAL 16 HG23 VAL 16 69.159 -6.587 4.905 113 H GLN 17 H GLN 17 65.934 -2.855 6.644 114 HA GLN 17 HA GLN 17 63.912 -4.405 5.632 115 HB2 GLN 17 HB2 GLN 17 63.882 -3.333 7.823 116 HB3 GLN 17 HB3 GLN 17 63.877 -1.747 7.064 117 HG2 GLN 17 HG2 GLN 17 61.774 -2.373 5.992 118 HG3 GLN 17 HG3 GLN 17 61.758 -3.813 7.032 119 HE21 GLN 17 HE21 GLN 17 61.387 -0.385 6.889 120 HE22 GLN 17 HE22 GLN 17 60.841 -0.154 8.502 121 H LEU 18 H LEU 18 64.791 -1.023 5.056 122 HA LEU 18 HA LEU 18 62.848 -0.407 3.145 123 HB2 LEU 18 HB2 LEU 18 64.144 1.201 4.389 124 HB3 LEU 18 HB3 LEU 18 65.611 0.761 3.690 125 HG LEU 18 HG LEU 18 64.566 2.936 2.844 126 HD11 LEU 18 HD11 LEU 18 66.498 1.961 1.779 127 HD12 LEU 18 HD12 LEU 18 65.389 2.605 0.566 128 HD13 LEU 18 HD13 LEU 18 65.463 0.868 0.864 129 HD21 LEU 18 HD21 LEU 18 62.308 2.018 2.480 130 HD22 LEU 18 HD22 LEU 18 62.953 1.016 1.171 131 HD23 LEU 18 HD23 LEU 18 62.999 2.780 1.053 132 H LEU 19 H LEU 19 66.026 -1.621 2.969 133 HA LEU 19 HA LEU 19 66.538 -1.802 0.259 134 HB2 LEU 19 HB2 LEU 19 67.196 -3.385 2.523 135 HB3 LEU 19 HB3 LEU 19 67.935 -3.807 0.974 136 HG LEU 19 HG LEU 19 68.314 -1.433 2.774 137 HD11 LEU 19 HD11 LEU 19 70.631 -1.870 2.400 138 HD12 LEU 19 HD12 LEU 19 70.207 -3.129 1.243 139 HD13 LEU 19 HD13 LEU 19 69.779 -3.326 2.932 140 HD21 LEU 19 HD21 LEU 19 67.810 -0.352 0.672 141 HD22 LEU 19 HD22 LEU 19 68.928 -1.406 -0.188 142 HD23 LEU 19 HD23 LEU 19 69.536 -0.250 0.992 143 H LYS 20 H LYS 20 64.997 -4.177 2.365 144 HA LYS 20 HA LYS 20 64.500 -6.186 0.476 145 HB2 LYS 20 HB2 LYS 20 63.036 -5.399 2.973 146 HB3 LYS 20 HB3 LYS 20 62.588 -6.764 1.975 147 HG2 LYS 20 HG2 LYS 20 64.795 -7.773 2.414 148 HG3 LYS 20 HG3 LYS 20 65.196 -6.390 3.435 149 HD2 LYS 20 HD2 LYS 20 63.373 -6.899 4.937 150 HD3 LYS 20 HD3 LYS 20 62.841 -8.214 3.893 151 HE2 LYS 20 HE2 LYS 20 64.070 -9.032 5.854 152 HE3 LYS 20 HE3 LYS 20 64.891 -9.430 4.350 153 HZ1 LYS 20 HZ1 LYS 20 66.229 -8.538 6.280 154 HZ2 LYS 20 HZ2 LYS 20 65.674 -7.002 5.860 155 HZ3 LYS 20 HZ3 LYS 20 66.563 -7.974 4.765 156 H GLU 21 H GLU 21 62.697 -3.357 1.419 157 HA GLU 21 HA GLU 21 60.410 -3.950 -0.099 158 HB2 GLU 21 HB2 GLU 21 61.374 -1.320 1.022 159 HB3 GLU 21 HB3 GLU 21 59.791 -1.624 0.309 160 HG2 GLU 21 HG2 GLU 21 60.852 -3.083 2.705 161 HG3 GLU 21 HG3 GLU 21 59.810 -1.666 2.791 162 H ILE 22 H ILE 22 63.397 -2.252 -0.840 163 HA ILE 22 HA ILE 22 62.543 -1.181 -3.344 164 HB ILE 22 HB ILE 22 65.368 -2.128 -2.749 165 HG12 ILE 22 HG12 ILE 22 64.147 0.586 -2.110 166 HG13 ILE 22 HG13 ILE 22 64.660 -0.617 -0.943 167 HG21 ILE 22 HG21 ILE 22 64.255 -0.042 -4.619 168 HG22 ILE 22 HG22 ILE 22 64.951 -1.598 -5.074 169 HG23 ILE 22 HG23 ILE 22 65.970 -0.342 -4.363 170 HD11 ILE 22 HD11 ILE 22 66.967 -0.369 -1.667 171 HD12 ILE 22 HD12 ILE 22 66.289 1.180 -1.165 172 HD13 ILE 22 HD13 ILE 22 66.469 0.810 -2.879 173 H GLU 23 H GLU 23 64.175 -4.121 -2.389 174 HA GLU 23 HA GLU 23 64.412 -5.439 -4.819 175 HB2 GLU 23 HB2 GLU 23 64.184 -6.213 -1.990 176 HB3 GLU 23 HB3 GLU 23 64.059 -7.480 -3.197 177 HG2 GLU 23 HG2 GLU 23 66.313 -5.496 -3.025 178 HG3 GLU 23 HG3 GLU 23 66.305 -7.097 -2.248 179 H LYS 24 H LYS 24 61.756 -5.164 -2.655 180 HA LYS 24 HA LYS 24 60.083 -7.106 -3.758 181 HB2 LYS 24 HB2 LYS 24 59.775 -6.222 -1.561 182 HB3 LYS 24 HB3 LYS 24 59.472 -4.618 -2.191 183 HG2 LYS 24 HG2 LYS 24 57.363 -5.651 -1.520 184 HG3 LYS 24 HG3 LYS 24 57.400 -5.410 -3.262 185 HD2 LYS 24 HD2 LYS 24 56.458 -7.589 -2.736 186 HD3 LYS 24 HD3 LYS 24 58.002 -7.791 -3.558 187 HE2 LYS 24 HE2 LYS 24 59.095 -8.156 -1.404 188 HE3 LYS 24 HE3 LYS 24 57.548 -7.969 -0.581 189 HZ1 LYS 24 HZ1 LYS 24 56.740 -9.922 -1.754 190 HZ2 LYS 24 HZ2 LYS 24 58.162 -10.318 -0.920 191 HZ3 LYS 24 HZ3 LYS 24 58.188 -10.067 -2.577 192 H GLU 25 H GLU 25 60.523 -3.608 -4.610 193 HA GLU 25 HA GLU 25 58.354 -3.964 -6.446 194 HB2 GLU 25 HB2 GLU 25 58.608 -1.448 -6.832 195 HB3 GLU 25 HB3 GLU 25 58.268 -1.876 -5.146 196 HG2 GLU 25 HG2 GLU 25 59.829 -0.185 -5.104 197 HG3 GLU 25 HG3 GLU 25 60.827 -1.635 -4.941 198 H ASN 26 H ASN 26 61.791 -3.729 -6.343 199 HA ASN 26 HA ASN 26 62.589 -3.239 -8.908 200 HB2 ASN 26 HB2 ASN 26 64.176 -3.568 -7.079 201 HB3 ASN 26 HB3 ASN 26 63.700 -5.246 -6.936 202 HD21 ASN 26 HD21 ASN 26 65.923 -5.827 -7.140 203 HD22 ASN 26 HD22 ASN 26 66.676 -5.833 -8.687 204 H VAL 27 H VAL 27 61.584 -6.367 -7.621 205 HA VAL 27 HA VAL 27 62.030 -7.723 -10.080 206 HB VAL 27 HB VAL 27 60.808 -9.649 -9.071 207 HG11 VAL 27 HG11 VAL 27 62.896 -8.369 -7.313 208 HG12 VAL 27 HG12 VAL 27 63.203 -9.384 -8.721 209 HG13 VAL 27 HG13 VAL 27 62.440 -10.072 -7.287 210 HG21 VAL 27 HG21 VAL 27 59.185 -8.402 -7.718 211 HG22 VAL 27 HG22 VAL 27 60.501 -7.800 -6.705 212 HG23 VAL 27 HG23 VAL 27 60.118 -9.520 -6.718 213 H ALA 28 H ALA 28 59.454 -5.759 -9.084 214 HA ALA 28 HA ALA 28 57.698 -6.945 -11.120 215 HB1 ALA 28 HB1 ALA 28 57.032 -4.994 -8.916 216 HB2 ALA 28 HB2 ALA 28 56.705 -6.729 -8.898 217 HB3 ALA 28 HB3 ALA 28 55.886 -5.689 -10.061 218 H ALA 29 H ALA 29 59.672 -4.302 -10.373 219 HA ALA 29 HA ALA 29 60.268 -2.410 -11.299 220 HB1 ALA 29 HB1 ALA 29 60.675 -3.806 -13.296 221 HB2 ALA 29 HB2 ALA 29 60.214 -2.158 -13.715 222 HB3 ALA 29 HB3 ALA 29 59.033 -3.464 -13.847 223 H THR 30 H THR 30 59.029 -1.119 -10.035 224 HA THR 30 HA THR 30 56.380 -0.439 -11.051 225 HB THR 30 HB THR 30 55.978 0.605 -8.888 226 HG1 THR 30 HG1 THR 30 58.710 -0.002 -8.159 227 HG21 THR 30 HG21 THR 30 55.761 -1.810 -8.975 228 HG22 THR 30 HG22 THR 30 56.357 -1.285 -7.383 229 HG23 THR 30 HG23 THR 30 57.475 -1.956 -8.581 230 H ASP 31 H ASP 31 56.233 2.215 -10.122 231 HA ASP 31 HA ASP 31 58.508 3.463 -11.391 232 HB2 ASP 31 HB2 ASP 31 57.268 4.953 -12.748 233 HB3 ASP 31 HB3 ASP 31 56.781 3.317 -13.161 234 H ASP 32 H ASP 32 55.673 4.011 -9.373 235 HA ASP 32 HA ASP 32 56.613 6.581 -8.599 236 HB2 ASP 32 HB2 ASP 32 54.230 5.956 -8.286 237 HB3 ASP 32 HB3 ASP 32 54.732 4.754 -7.098 238 H VAL 33 H VAL 33 56.537 3.517 -6.935 239 HA VAL 33 HA VAL 33 58.076 4.692 -4.814 240 HB VAL 33 HB VAL 33 56.265 3.050 -4.402 241 HG11 VAL 33 HG11 VAL 33 56.739 0.654 -4.523 242 HG12 VAL 33 HG12 VAL 33 58.209 1.051 -5.428 243 HG13 VAL 33 HG13 VAL 33 56.627 1.455 -6.098 244 HG21 VAL 33 HG21 VAL 33 58.931 2.329 -3.218 245 HG22 VAL 33 HG22 VAL 33 57.368 1.857 -2.553 246 HG23 VAL 33 HG23 VAL 33 57.816 3.562 -2.630 247 H LEU 34 H LEU 34 58.640 2.712 -7.514 248 HA LEU 34 HA LEU 34 61.257 1.752 -7.173 249 HB2 LEU 34 HB2 LEU 34 59.692 1.245 -9.040 250 HB3 LEU 34 HB3 LEU 34 59.762 2.850 -9.549 251 HG LEU 34 HG LEU 34 60.929 1.217 -11.016 252 HD11 LEU 34 HD11 LEU 34 62.670 3.370 -9.942 253 HD12 LEU 34 HD12 LEU 34 61.463 3.478 -11.233 254 HD13 LEU 34 HD13 LEU 34 62.918 2.488 -11.461 255 HD21 LEU 34 HD21 LEU 34 63.102 0.316 -10.397 256 HD22 LEU 34 HD22 LEU 34 61.854 -0.224 -9.256 257 HD23 LEU 34 HD23 LEU 34 62.951 1.054 -8.804 258 H ASP 35 H ASP 35 60.173 4.874 -8.527 259 HA ASP 35 HA ASP 35 62.923 5.743 -8.627 260 HB2 ASP 35 HB2 ASP 35 61.270 6.522 -10.326 261 HB3 ASP 35 HB3 ASP 35 60.433 7.405 -9.057 262 H VAL 36 H VAL 36 60.462 5.927 -6.304 263 HA VAL 36 HA VAL 36 61.588 8.100 -4.828 264 HB VAL 36 HB VAL 36 60.141 5.686 -3.755 265 HG11 VAL 36 HG11 VAL 36 59.609 7.081 -1.878 266 HG12 VAL 36 HG12 VAL 36 60.620 8.377 -2.602 267 HG13 VAL 36 HG13 VAL 36 61.357 6.834 -2.112 268 HG21 VAL 36 HG21 VAL 36 59.110 8.347 -4.506 269 HG22 VAL 36 HG22 VAL 36 58.256 7.002 -3.659 270 HG23 VAL 36 HG23 VAL 36 58.876 6.769 -5.320 271 H LEU 37 H LEU 37 61.824 4.629 -4.648 272 HA LEU 37 HA LEU 37 63.447 4.690 -2.365 273 HB2 LEU 37 HB2 LEU 37 63.160 2.414 -4.276 274 HB3 LEU 37 HB3 LEU 37 63.684 2.484 -2.607 275 HG LEU 37 HG LEU 37 60.859 3.064 -3.405 276 HD11 LEU 37 HD11 LEU 37 62.030 0.614 -2.112 277 HD12 LEU 37 HD12 LEU 37 61.365 0.723 -3.742 278 HD13 LEU 37 HD13 LEU 37 60.312 0.929 -2.341 279 HD21 LEU 37 HD21 LEU 37 60.429 2.963 -0.988 280 HD22 LEU 37 HD22 LEU 37 61.562 4.252 -1.397 281 HD23 LEU 37 HD23 LEU 37 62.155 2.736 -0.710 282 H LEU 38 H LEU 38 64.029 4.223 -5.742 283 HA LEU 38 HA LEU 38 66.724 3.615 -5.445 284 HB2 LEU 38 HB2 LEU 38 65.100 4.653 -7.709 285 HB3 LEU 38 HB3 LEU 38 66.798 4.241 -7.929 286 HG LEU 38 HG LEU 38 64.412 2.512 -7.352 287 HD11 LEU 38 HD11 LEU 38 66.544 2.417 -9.414 288 HD12 LEU 38 HD12 LEU 38 64.894 3.013 -9.645 289 HD13 LEU 38 HD13 LEU 38 65.189 1.297 -9.296 290 HD21 LEU 38 HD21 LEU 38 66.093 1.718 -5.793 291 HD22 LEU 38 HD22 LEU 38 67.298 1.669 -7.076 292 HD23 LEU 38 HD23 LEU 38 65.931 0.573 -7.120 293 H GLU 39 H GLU 39 65.180 6.745 -5.948 294 HA GLU 39 HA GLU 39 67.691 8.086 -5.955 295 HB2 GLU 39 HB2 GLU 39 64.924 8.994 -5.315 296 HB3 GLU 39 HB3 GLU 39 66.326 10.041 -5.413 297 HG2 GLU 39 HG2 GLU 39 65.090 8.420 -7.632 298 HG3 GLU 39 HG3 GLU 39 64.958 10.160 -7.384 299 H HIS 40 H HIS 40 65.288 7.317 -3.524 300 HA HIS 40 HA HIS 40 66.237 8.907 -1.454 301 HB2 HIS 40 HB2 HIS 40 64.020 7.845 -1.540 302 HB3 HIS 40 HB3 HIS 40 64.720 6.284 -1.301 303 HD1 HIS 40 HD1 HIS 40 63.503 9.228 0.539 304 HD2 HIS 40 HD2 HIS 40 65.816 5.868 1.310 305 HE1 HIS 40 HE1 HIS 40 63.630 9.015 3.045 306 H PHE 41 H PHE 41 66.844 5.580 -2.270 307 HA PHE 41 HA PHE 41 68.515 4.960 -0.144 308 HB2 PHE 41 HB2 PHE 41 67.558 3.195 -1.271 309 HB3 PHE 41 HB3 PHE 41 67.972 3.850 -2.845 310 HD1 PHE 41 HD1 PHE 41 69.333 2.203 0.171 311 HD2 PHE 41 HD2 PHE 41 69.948 3.211 -3.892 312 HE1 PHE 41 HE1 PHE 41 71.320 0.738 0.100 313 HE2 PHE 41 HE2 PHE 41 71.893 1.784 -3.961 314 HZ PHE 41 HZ PHE 41 72.605 0.540 -1.991 315 H VAL 42 H VAL 42 69.298 6.058 -3.439 316 HA VAL 42 HA VAL 42 72.056 6.028 -2.863 317 HB VAL 42 HB VAL 42 71.199 5.764 -5.130 318 HG11 VAL 42 HG11 VAL 42 70.661 7.552 -6.519 319 HG12 VAL 42 HG12 VAL 42 70.475 8.607 -5.080 320 HG13 VAL 42 HG13 VAL 42 69.485 7.128 -5.287 321 HG21 VAL 42 HG21 VAL 42 73.156 8.032 -4.876 322 HG22 VAL 42 HG22 VAL 42 72.908 7.058 -6.326 323 HG23 VAL 42 HG23 VAL 42 73.545 6.315 -4.861 324 H LYS 43 H LYS 43 69.705 8.467 -2.456 325 HA LYS 43 HA LYS 43 71.645 10.555 -2.009 326 HB2 LYS 43 HB2 LYS 43 69.896 12.011 -1.464 327 HB3 LYS 43 HB3 LYS 43 69.137 10.886 -2.574 328 HG2 LYS 43 HG2 LYS 43 68.204 9.661 -0.504 329 HG3 LYS 43 HG3 LYS 43 68.894 10.973 0.414 330 HD2 LYS 43 HD2 LYS 43 67.601 12.612 -0.795 331 HD3 LYS 43 HD3 LYS 43 66.850 11.336 -1.751 332 HE2 LYS 43 HE2 LYS 43 65.905 10.377 0.313 333 HE3 LYS 43 HE3 LYS 43 66.642 11.684 1.241 334 HZ1 LYS 43 HZ1 LYS 43 65.312 13.268 -0.031 335 HZ2 LYS 43 HZ2 LYS 43 64.307 12.142 0.735 336 HZ3 LYS 43 HZ3 LYS 43 64.624 12.009 -0.897 337 H ILE 44 H ILE 44 70.104 8.307 0.147 338 HA ILE 44 HA ILE 44 71.278 9.591 2.453 339 HB ILE 44 HB ILE 44 70.462 7.580 3.704 340 HG12 ILE 44 HG12 ILE 44 69.343 6.791 1.014 341 HG13 ILE 44 HG13 ILE 44 70.630 5.935 1.825 342 HG21 ILE 44 HG21 ILE 44 68.422 8.931 1.934 343 HG22 ILE 44 HG22 ILE 44 69.059 9.566 3.447 344 HG23 ILE 44 HG23 ILE 44 68.075 8.103 3.451 345 HD11 ILE 44 HD11 ILE 44 67.774 6.211 2.717 346 HD12 ILE 44 HD12 ILE 44 69.030 5.391 3.637 347 HD13 ILE 44 HD13 ILE 44 68.535 4.764 2.061 348 H THR 45 H THR 45 72.157 7.000 0.271 349 HA THR 45 HA THR 45 74.324 6.159 1.969 350 HB THR 45 HB THR 45 74.921 4.676 0.070 351 HG1 THR 45 HG1 THR 45 72.486 5.325 -1.131 352 HG21 THR 45 HG21 THR 45 73.373 3.955 1.822 353 HG22 THR 45 HG22 THR 45 72.941 3.269 0.252 354 HG23 THR 45 HG23 THR 45 72.025 4.626 0.901 355 H GLU 46 H GLU 46 73.872 8.163 -0.883 356 HA GLU 46 HA GLU 46 75.152 9.615 -1.989 357 HB2 GLU 46 HB2 GLU 46 76.602 9.379 0.586 358 HB3 GLU 46 HB3 GLU 46 77.156 10.535 -0.649 359 HG2 GLU 46 HG2 GLU 46 74.363 10.463 0.389 360 HG3 GLU 46 HG3 GLU 46 75.626 11.316 1.279 361 H HIS 47 H HIS 47 75.474 6.828 -2.227 362 HA HIS 47 HA HIS 47 78.257 6.199 -2.678 363 HB2 HIS 47 HB2 HIS 47 76.377 4.638 -1.816 364 HB3 HIS 47 HB3 HIS 47 75.834 4.581 -3.482 365 HD1 HIS 47 HD1 HIS 47 77.946 3.553 -5.220 366 HD2 HIS 47 HD2 HIS 47 78.092 2.772 -1.148 367 HE1 HIS 47 HE1 HIS 47 79.310 1.523 -4.981 368 HA PRO 48 HA PRO 48 77.926 7.495 -7.058 369 HB2 PRO 48 HB2 PRO 48 80.009 5.555 -7.581 370 HB3 PRO 48 HB3 PRO 48 80.051 7.308 -7.792 371 HG2 PRO 48 HG2 PRO 48 81.396 5.930 -5.972 372 HG3 PRO 48 HG3 PRO 48 80.773 7.558 -5.535 373 HD2 PRO 48 HD2 PRO 48 79.741 4.811 -4.912 374 HD3 PRO 48 HD3 PRO 48 79.797 6.219 -3.842 375 H ASP 49 H ASP 49 76.800 4.800 -5.996 376 HA ASP 49 HA ASP 49 76.693 3.719 -8.600 377 HB2 ASP 49 HB2 ASP 49 77.227 2.156 -6.114 378 HB3 ASP 49 HB3 ASP 49 76.327 1.333 -7.358 379 H GLY 50 H GLY 50 75.356 3.181 -5.394 380 HA2 GLY 50 HA2 GLY 50 73.334 3.159 -4.432 381 HA3 GLY 50 HA3 GLY 50 72.909 4.389 -5.631 382 H THR 51 H THR 51 72.414 3.652 -7.431 383 HA THR 51 HA THR 51 70.241 1.889 -7.046 384 HB THR 51 HB THR 51 70.827 2.788 -9.811 385 HG1 THR 51 HG1 THR 51 69.786 4.878 -8.621 386 HG21 THR 51 HG21 THR 51 68.422 3.278 -9.665 387 HG22 THR 51 HG22 THR 51 68.480 2.973 -7.934 388 HG23 THR 51 HG23 THR 51 68.743 1.649 -9.048 389 H ALA 52 H ALA 52 73.232 1.902 -8.872 390 HA ALA 52 HA ALA 52 73.061 -0.607 -10.186 391 HB1 ALA 52 HB1 ALA 52 75.465 -0.436 -10.417 392 HB2 ALA 52 HB2 ALA 52 75.526 0.826 -9.187 393 HB3 ALA 52 HB3 ALA 52 74.741 1.138 -10.731 394 H LEU 53 H LEU 53 73.867 0.259 -6.916 395 HA LEU 53 HA LEU 53 74.879 -2.276 -6.171 396 HB2 LEU 53 HB2 LEU 53 73.508 -0.236 -4.456 397 HB3 LEU 53 HB3 LEU 53 74.260 -1.693 -3.851 398 HG LEU 53 HG LEU 53 75.594 0.710 -5.064 399 HD11 LEU 53 HD11 LEU 53 75.799 -0.632 -2.415 400 HD12 LEU 53 HD12 LEU 53 74.970 0.879 -2.789 401 HD13 LEU 53 HD13 LEU 53 76.721 0.772 -2.952 402 HD21 LEU 53 HD21 LEU 53 77.720 -0.492 -4.770 403 HD22 LEU 53 HD22 LEU 53 76.710 -1.258 -5.988 404 HD23 LEU 53 HD23 LEU 53 76.828 -1.962 -4.373 405 H ILE 54 H ILE 54 71.558 -1.011 -6.209 406 HA ILE 54 HA ILE 54 70.521 -3.391 -4.906 407 HB ILE 54 HB ILE 54 68.866 -1.639 -6.773 408 HG12 ILE 54 HG12 ILE 54 67.893 -0.914 -4.411 409 HG13 ILE 54 HG13 ILE 54 69.529 -1.301 -3.897 410 HG21 ILE 54 HG21 ILE 54 66.914 -2.555 -5.607 411 HG22 ILE 54 HG22 ILE 54 67.981 -3.590 -4.657 412 HG23 ILE 54 HG23 ILE 54 67.868 -3.809 -6.403 413 HD11 ILE 54 HD11 ILE 54 70.419 0.248 -5.510 414 HD12 ILE 54 HD12 ILE 54 69.276 1.037 -4.422 415 HD13 ILE 54 HD13 ILE 54 68.788 0.614 -6.066 416 H TYR 55 H TYR 55 70.942 -2.312 -8.132 417 HA TYR 55 HA TYR 55 69.707 -4.443 -9.328 418 HB2 TYR 55 HB2 TYR 55 71.656 -2.424 -10.316 419 HB3 TYR 55 HB3 TYR 55 71.073 -3.698 -11.366 420 HD1 TYR 55 HD1 TYR 55 68.261 -3.968 -10.693 421 HD2 TYR 55 HD2 TYR 55 70.599 -0.417 -10.925 422 HE1 TYR 55 HE1 TYR 55 66.225 -2.665 -11.086 423 HE2 TYR 55 HE2 TYR 55 68.555 0.895 -11.318 424 HH TYR 55 HH TYR 55 65.479 -0.348 -10.754 425 H GLU 56 H GLU 56 73.154 -4.045 -8.481 426 HA GLU 56 HA GLU 56 73.745 -6.650 -9.464 427 HB2 GLU 56 HB2 GLU 56 75.803 -6.526 -7.985 428 HB3 GLU 56 HB3 GLU 56 75.711 -5.351 -9.296 429 HG2 GLU 56 HG2 GLU 56 75.231 -3.632 -7.833 430 HG3 GLU 56 HG3 GLU 56 74.885 -4.670 -6.471 431 H ALA 57 H ALA 57 72.723 -5.404 -6.361 432 HA ALA 57 HA ALA 57 73.160 -7.654 -4.799 433 HB1 ALA 57 HB1 ALA 57 72.521 -5.478 -3.874 434 HB2 ALA 57 HB2 ALA 57 71.473 -6.772 -3.285 435 HB3 ALA 57 HB3 ALA 57 70.901 -5.675 -4.544 436 H ALA 58 H ALA 58 70.437 -6.839 -6.861 437 HA ALA 58 HA ALA 58 68.793 -9.012 -6.223 438 HB1 ALA 58 HB1 ALA 58 68.019 -7.073 -7.504 439 HB2 ALA 58 HB2 ALA 58 67.667 -8.578 -8.350 440 HB3 ALA 58 HB3 ALA 58 69.021 -7.571 -8.867 441 H ALA 59 H ALA 59 71.430 -8.754 -8.540 442 HA ALA 59 HA ALA 59 71.112 -11.393 -9.624 443 HB1 ALA 59 HB1 ALA 59 73.305 -11.018 -10.656 444 HB2 ALA 59 HB2 ALA 59 73.543 -9.592 -9.646 445 HB3 ALA 59 HB3 ALA 59 72.272 -9.603 -10.869 446 H ARG 60 H ARG 60 73.167 -9.906 -7.246 447 HA ARG 60 HA ARG 60 74.615 -12.139 -6.370 448 HB2 ARG 60 HB2 ARG 60 73.883 -9.576 -4.909 449 HB3 ARG 60 HB3 ARG 60 75.042 -10.772 -4.299 450 HG2 ARG 60 HG2 ARG 60 76.530 -10.337 -6.102 451 HG3 ARG 60 HG3 ARG 60 75.321 -9.374 -6.946 452 HD2 ARG 60 HD2 ARG 60 76.972 -7.917 -5.931 453 HD3 ARG 60 HD3 ARG 60 75.421 -7.702 -5.133 454 HE ARG 60 HE ARG 60 76.716 -9.556 -3.622 455 HH11 ARG 60 HH11 ARG 60 77.557 -6.224 -4.694 456 HH12 ARG 60 HH12 ARG 60 78.509 -5.915 -3.331 457 HH21 ARG 60 HH21 ARG 60 77.974 -9.036 -1.724 458 HH22 ARG 60 HH22 ARG 60 78.743 -7.512 -1.603 459 H ALA 61 H ALA 61 71.436 -11.049 -5.634 460 HA ALA 61 HA ALA 61 70.828 -12.706 -3.443 461 HB1 ALA 61 HB1 ALA 61 69.026 -11.702 -5.632 462 HB2 ALA 61 HB2 ALA 61 69.425 -10.833 -4.153 463 HB3 ALA 61 HB3 ALA 61 68.503 -12.339 -4.075 464 H ALA 62 H ALA 62 70.408 -13.160 -6.949 465 HA ALA 62 HA ALA 62 69.236 -15.732 -6.733 466 HB1 ALA 62 HB1 ALA 62 69.614 -15.891 -9.148 467 HB2 ALA 62 HB2 ALA 62 70.667 -14.477 -9.080 468 HB3 ALA 62 HB3 ALA 62 68.947 -14.314 -8.725 469 H ALA 63 H ALA 63 72.497 -14.648 -7.576 470 HA ALA 63 HA ALA 63 73.439 -17.344 -6.958 471 HB1 ALA 63 HB1 ALA 63 74.874 -15.092 -8.379 472 HB2 ALA 63 HB2 ALA 63 74.170 -16.520 -9.150 473 HB3 ALA 63 HB3 ALA 63 75.542 -16.687 -8.046 474 H ASN 64 H ASN 64 72.956 -16.784 -4.756 475 HA ASN 64 HA ASN 64 74.624 -14.804 -3.539 476 HB2 ASN 64 HB2 ASN 64 73.541 -15.371 -1.402 477 HB3 ASN 64 HB3 ASN 64 72.442 -14.947 -2.703 478 HD21 ASN 64 HD21 ASN 64 70.977 -16.498 -3.437 479 HD22 ASN 64 HD22 ASN 64 70.753 -18.014 -2.634 480 HA PRO 65 HA PRO 65 77.560 -17.809 -2.768 481 HB2 PRO 65 HB2 PRO 65 79.333 -15.836 -1.551 482 HB3 PRO 65 HB3 PRO 65 79.503 -16.647 -3.110 483 HG2 PRO 65 HG2 PRO 65 78.850 -13.963 -2.804 484 HG3 PRO 65 HG3 PRO 65 78.485 -14.924 -4.242 485 HD2 PRO 65 HD2 PRO 65 76.714 -14.133 -1.987 486 HD3 PRO 65 HD3 PRO 65 76.384 -14.313 -3.732 487 H GLY 66 H GLY 66 77.724 -15.275 -0.202 488 HA2 GLY 66 HA2 GLY 66 76.813 -17.240 1.775 489 HA3 GLY 66 HA3 GLY 66 78.271 -16.301 2.068 490 H GLY 67 H GLY 67 77.724 -15.119 3.631 491 HA2 GLY 67 HA2 GLY 67 75.230 -13.670 3.659 492 HA3 GLY 67 HA3 GLY 67 76.506 -13.758 4.889 493 H ASP 68 H ASP 68 76.250 -12.831 1.592 494 HA ASP 68 HA ASP 68 77.322 -10.149 2.038 495 HB2 ASP 68 HB2 ASP 68 79.123 -10.393 0.433 496 HB3 ASP 68 HB3 ASP 68 79.294 -11.661 1.643 497 H GLY 69 H GLY 69 75.962 -12.607 -0.039 498 HA2 GLY 69 HA2 GLY 69 74.877 -10.561 -1.810 499 HA3 GLY 69 HA3 GLY 69 74.850 -12.306 -2.093 500 H GLY 70 H GLY 70 72.772 -12.889 -2.143 501 HA2 GLY 70 HA2 GLY 70 70.859 -13.621 -0.959 502 HA3 GLY 70 HA3 GLY 70 71.300 -12.524 0.343 503 H GLY 71 H GLY 71 71.661 -10.305 -1.482 504 HA2 GLY 71 HA2 GLY 71 70.299 -9.192 -3.095 505 HA3 GLY 71 HA3 GLY 71 68.883 -9.799 -2.227 506 HA PRO 72 HA PRO 72 68.784 -5.966 -0.160 507 HB2 PRO 72 HB2 PRO 72 67.441 -6.752 2.088 508 HB3 PRO 72 HB3 PRO 72 66.662 -6.400 0.547 509 HG2 PRO 72 HG2 PRO 72 67.353 -9.016 1.786 510 HG3 PRO 72 HG3 PRO 72 65.961 -8.602 0.781 511 HD2 PRO 72 HD2 PRO 72 68.129 -9.982 -0.113 512 HD3 PRO 72 HD3 PRO 72 67.162 -8.987 -1.195 513 H GLU 73 H GLU 73 69.936 -8.775 1.463 514 HA GLU 73 HA GLU 73 70.926 -7.324 3.734 515 HB2 GLU 73 HB2 GLU 73 71.776 -10.105 2.947 516 HB3 GLU 73 HB3 GLU 73 71.652 -9.426 4.560 517 HG2 GLU 73 HG2 GLU 73 69.341 -10.118 2.758 518 HG3 GLU 73 HG3 GLU 73 69.895 -11.088 4.112 519 H GLY 74 H GLY 74 72.046 -7.789 0.614 520 HA2 GLY 74 HA2 GLY 74 74.681 -7.401 1.660 521 HA3 GLY 74 HA3 GLY 74 74.431 -7.995 -0.023 522 H ILE 75 H ILE 75 72.333 -5.774 -0.131 523 HA ILE 75 HA ILE 75 73.972 -3.716 -1.154 524 HB ILE 75 HB ILE 75 71.542 -2.542 -0.159 525 HG12 ILE 75 HG12 ILE 75 71.102 -5.183 -1.633 526 HG13 ILE 75 HG13 ILE 75 70.717 -4.820 0.014 527 HG21 ILE 75 HG21 ILE 75 72.743 -1.767 -2.093 528 HG22 ILE 75 HG22 ILE 75 71.089 -2.192 -2.536 529 HG23 ILE 75 HG23 ILE 75 72.416 -3.281 -2.937 530 HD11 ILE 75 HD11 ILE 75 69.046 -3.351 -0.490 531 HD12 ILE 75 HD12 ILE 75 68.763 -4.717 -1.569 532 HD13 ILE 75 HD13 ILE 75 69.484 -3.219 -2.187 533 H VAL 76 H VAL 76 72.373 -4.155 1.916 534 HA VAL 76 HA VAL 76 73.143 -1.778 3.156 535 HB VAL 76 HB VAL 76 71.385 -3.088 3.912 536 HG11 VAL 76 HG11 VAL 76 71.473 -4.966 3.376 537 HG12 VAL 76 HG12 VAL 76 71.473 -5.072 5.133 538 HG13 VAL 76 HG13 VAL 76 72.989 -5.394 4.213 539 HG21 VAL 76 HG21 VAL 76 73.446 -3.040 6.088 540 HG22 VAL 76 HG22 VAL 76 71.704 -3.175 6.344 541 HG23 VAL 76 HG23 VAL 76 72.387 -1.705 5.652 542 H LYS 77 H LYS 77 74.490 -4.887 3.153 543 HA LYS 77 HA LYS 77 76.678 -4.412 4.855 544 HB2 LYS 77 HB2 LYS 77 75.978 -6.699 4.120 545 HB3 LYS 77 HB3 LYS 77 76.706 -6.374 2.556 546 HG2 LYS 77 HG2 LYS 77 78.889 -6.123 3.600 547 HG3 LYS 77 HG3 LYS 77 78.168 -6.418 5.181 548 HD2 LYS 77 HD2 LYS 77 77.456 -8.646 4.401 549 HD3 LYS 77 HD3 LYS 77 78.278 -8.344 2.867 550 HE2 LYS 77 HE2 LYS 77 80.393 -8.062 4.065 551 HE3 LYS 77 HE3 LYS 77 79.568 -8.372 5.588 552 HZ1 LYS 77 HZ1 LYS 77 78.958 -10.595 4.658 553 HZ2 LYS 77 HZ2 LYS 77 80.606 -10.361 4.916 554 HZ3 LYS 77 HZ3 LYS 77 79.999 -10.273 3.354 555 H GLU 78 H GLU 78 76.492 -4.184 1.319 556 HA GLU 78 HA GLU 78 79.100 -3.355 0.751 557 HB2 GLU 78 HB2 GLU 78 76.463 -2.730 -0.488 558 HB3 GLU 78 HB3 GLU 78 77.925 -2.212 -1.265 559 HG2 GLU 78 HG2 GLU 78 76.992 -5.023 -0.680 560 HG3 GLU 78 HG3 GLU 78 77.137 -4.259 -2.259 561 H ILE 79 H ILE 79 76.255 -1.521 1.449 562 HA ILE 79 HA ILE 79 77.382 1.054 1.395 563 HB ILE 79 HB ILE 79 74.976 0.154 3.021 564 HG12 ILE 79 HG12 ILE 79 74.698 -0.194 0.569 565 HG13 ILE 79 HG13 ILE 79 73.647 1.094 1.166 566 HG21 ILE 79 HG21 ILE 79 75.870 2.237 3.904 567 HG22 ILE 79 HG22 ILE 79 74.320 2.495 3.110 568 HG23 ILE 79 HG23 ILE 79 75.815 2.959 2.294 569 HD11 ILE 79 HD11 ILE 79 75.302 2.690 0.328 570 HD12 ILE 79 HD12 ILE 79 74.554 1.659 -0.896 571 HD13 ILE 79 HD13 ILE 79 76.204 1.321 -0.351 572 H LYS 80 H LYS 80 77.025 -1.148 4.172 573 HA LYS 80 HA LYS 80 77.984 0.754 6.008 574 HB2 LYS 80 HB2 LYS 80 78.158 -0.983 7.654 575 HB3 LYS 80 HB3 LYS 80 76.744 -1.350 6.700 576 HG2 LYS 80 HG2 LYS 80 78.294 -2.947 5.423 577 HG3 LYS 80 HG3 LYS 80 79.371 -2.745 6.798 578 HD2 LYS 80 HD2 LYS 80 76.518 -3.720 6.901 579 HD3 LYS 80 HD3 LYS 80 77.961 -4.703 7.126 580 HE2 LYS 80 HE2 LYS 80 78.494 -3.420 9.155 581 HE3 LYS 80 HE3 LYS 80 77.048 -2.437 8.900 582 HZ1 LYS 80 HZ1 LYS 80 75.763 -4.555 9.073 583 HZ2 LYS 80 HZ2 LYS 80 76.486 -4.051 10.480 584 HZ3 LYS 80 HZ3 LYS 80 77.174 -5.323 9.599 585 H GLU 81 H GLU 81 79.638 -1.611 4.025 586 HA GLU 81 HA GLU 81 82.161 -1.096 5.175 587 HB2 GLU 81 HB2 GLU 81 81.461 -2.386 2.540 588 HB3 GLU 81 HB3 GLU 81 83.095 -2.276 3.165 589 HG2 GLU 81 HG2 GLU 81 82.252 -3.544 5.202 590 HG3 GLU 81 HG3 GLU 81 80.782 -3.844 4.278 591 H TRP 82 H TRP 82 80.539 0.150 2.284 592 HA TRP 82 HA TRP 82 82.678 1.645 1.204 593 HB2 TRP 82 HB2 TRP 82 80.393 1.127 0.135 594 HB3 TRP 82 HB3 TRP 82 79.828 2.462 1.161 595 HD1 TRP 82 HD1 TRP 82 82.204 1.866 -1.806 596 HE1 TRP 82 HE1 TRP 82 82.440 4.047 -3.104 597 HE3 TRP 82 HE3 TRP 82 79.575 4.954 1.309 598 HZ2 TRP 82 HZ2 TRP 82 81.642 6.718 -2.874 599 HZ3 TRP 82 HZ3 TRP 82 79.364 7.322 0.692 600 HH2 TRP 82 HH2 TRP 82 80.382 8.193 -1.352 601 H ARG 83 H ARG 83 80.055 2.521 3.355 602 HA ARG 83 HA ARG 83 80.489 5.288 3.477 603 HB2 ARG 83 HB2 ARG 83 78.538 3.681 4.400 604 HB3 ARG 83 HB3 ARG 83 79.610 3.788 5.811 605 HG2 ARG 83 HG2 ARG 83 78.030 5.409 6.213 606 HG3 ARG 83 HG3 ARG 83 79.516 6.168 5.625 607 HD2 ARG 83 HD2 ARG 83 78.547 6.525 3.435 608 HD3 ARG 83 HD3 ARG 83 77.080 5.677 3.929 609 HE ARG 83 HE ARG 83 77.189 7.516 5.796 610 HH11 ARG 83 HH11 ARG 83 77.291 7.942 2.247 611 HH12 ARG 83 HH12 ARG 83 76.970 9.606 2.380 612 HH21 ARG 83 HH21 ARG 83 76.674 9.750 5.853 613 HH22 ARG 83 HH22 ARG 83 76.591 10.632 4.404 614 H ALA 84 H ALA 84 81.534 2.608 5.512 615 HA ALA 84 HA ALA 84 82.987 4.126 7.392 616 HB1 ALA 84 HB1 ALA 84 83.817 1.985 8.185 617 HB2 ALA 84 HB2 ALA 84 83.252 1.197 6.711 618 HB3 ALA 84 HB3 ALA 84 82.089 1.868 7.846 619 H ALA 85 H ALA 85 83.876 2.464 4.403 620 HA ALA 85 HA ALA 85 86.671 2.717 4.648 621 HB1 ALA 85 HB1 ALA 85 85.612 1.157 3.077 622 HB2 ALA 85 HB2 ALA 85 86.753 2.222 2.257 623 HB3 ALA 85 HB3 ALA 85 85.021 2.520 2.129 624 H ASN 86 H ASN 86 84.234 4.789 3.233 625 HA ASN 86 HA ASN 86 86.092 6.763 2.303 626 HB2 ASN 86 HB2 ASN 86 83.773 6.585 1.412 627 HB3 ASN 86 HB3 ASN 86 83.155 7.106 2.977 628 HD21 ASN 86 HD21 ASN 86 84.417 8.100 -0.011 629 HD22 ASN 86 HD22 ASN 86 84.451 9.799 0.301 630 H GLY 87 H GLY 87 84.125 6.322 5.180 631 HA2 GLY 87 HA2 GLY 87 84.899 7.036 7.338 632 HA3 GLY 87 HA3 GLY 87 85.698 8.396 6.555 633 H LYS 88 H LYS 88 82.381 7.294 5.809 634 HA LYS 88 HA LYS 88 81.420 9.901 6.533 635 HB2 LYS 88 HB2 LYS 88 80.698 7.697 4.663 636 HB3 LYS 88 HB3 LYS 88 79.527 8.902 5.120 637 HG2 LYS 88 HG2 LYS 88 80.883 10.631 4.089 638 HG3 LYS 88 HG3 LYS 88 82.190 9.475 3.813 639 HD2 LYS 88 HD2 LYS 88 80.729 8.195 2.316 640 HD3 LYS 88 HD3 LYS 88 79.432 9.350 2.560 641 HE2 LYS 88 HE2 LYS 88 82.128 9.981 1.363 642 HE3 LYS 88 HE3 LYS 88 80.680 9.671 0.425 643 HZ1 LYS 88 HZ1 LYS 88 79.685 11.669 1.471 644 HZ2 LYS 88 HZ2 LYS 88 81.080 12.010 0.615 645 HZ3 LYS 88 HZ3 LYS 88 81.146 11.950 2.288 646 HA PRO 89 HA PRO 89 79.220 7.825 9.866 647 HB2 PRO 89 HB2 PRO 89 76.964 9.398 9.935 648 HB3 PRO 89 HB3 PRO 89 78.501 9.890 10.654 649 HG2 PRO 89 HG2 PRO 89 77.345 10.607 7.990 650 HG3 PRO 89 HG3 PRO 89 78.149 11.660 9.166 651 HD2 PRO 89 HD2 PRO 89 79.427 10.748 7.001 652 HD3 PRO 89 HD3 PRO 89 80.268 10.908 8.558 653 H GLY 90 H GLY 90 78.069 6.026 9.714 654 HA2 GLY 90 HA2 GLY 90 76.360 5.747 7.358 655 HA3 GLY 90 HA3 GLY 90 77.284 4.437 8.082 656 H PHE 91 H PHE 91 76.196 3.107 9.273 657 HA PHE 91 HA PHE 91 73.416 3.675 9.624 658 HB2 PHE 91 HB2 PHE 91 74.963 1.160 10.170 659 HB3 PHE 91 HB3 PHE 91 73.216 1.328 10.307 660 HD1 PHE 91 HD1 PHE 91 72.451 2.835 8.014 661 HD2 PHE 91 HD2 PHE 91 75.423 -0.181 8.366 662 HE1 PHE 91 HE1 PHE 91 72.211 2.318 5.654 663 HE2 PHE 91 HE2 PHE 91 75.159 -0.681 5.951 664 HZ PHE 91 HZ PHE 91 73.570 0.571 4.628 665 H LYS 92 H LYS 92 72.252 3.590 11.387 666 HA LYS 92 HA LYS 92 73.476 4.245 13.836 667 HB2 LYS 92 HB2 LYS 92 71.235 5.036 12.557 668 HB3 LYS 92 HB3 LYS 92 70.693 3.578 13.437 669 HG2 LYS 92 HG2 LYS 92 71.321 4.288 15.338 670 HG3 LYS 92 HG3 LYS 92 72.199 5.697 14.635 671 HD2 LYS 92 HD2 LYS 92 70.114 6.545 15.692 672 HD3 LYS 92 HD3 LYS 92 69.953 6.613 13.939 673 HE2 LYS 92 HE2 LYS 92 68.636 4.603 13.951 674 HE3 LYS 92 HE3 LYS 92 68.934 4.383 15.675 675 HZ1 LYS 92 HZ1 LYS 92 67.393 6.639 14.456 676 HZ2 LYS 92 HZ2 LYS 92 67.692 6.436 16.097 677 HZ3 LYS 92 HZ3 LYS 92 66.745 5.320 15.276 678 H GLN 93 H GLN 93 72.489 2.924 15.754 679 HA GLN 93 HA GLN 93 71.722 0.262 15.014 680 HB2 GLN 93 HB2 GLN 93 73.155 -0.576 16.714 681 HB3 GLN 93 HB3 GLN 93 73.951 -0.145 15.180 682 HG2 GLN 93 HG2 GLN 93 73.990 1.792 17.447 683 HG3 GLN 93 HG3 GLN 93 75.085 0.411 17.566 684 HE21 GLN 93 HE21 GLN 93 74.487 3.456 16.048 685 HE22 GLN 93 HE22 GLN 93 75.932 3.506 15.101 686 H GLY 94 H GLY 94 70.402 2.471 16.196 687 HA2 GLY 94 HA2 GLY 94 69.397 1.170 18.583 688 HA3 GLY 94 HA3 GLY 94 70.166 2.746 18.779 Start of MODEL 18 1 H GLU 2 H GLU 2 61.818 2.057 8.871 2 HA GLU 2 HA GLU 2 59.592 3.035 7.210 3 HB2 GLU 2 HB2 GLU 2 60.777 4.067 9.794 4 HB3 GLU 2 HB3 GLU 2 59.426 4.769 8.913 5 HG2 GLU 2 HG2 GLU 2 58.105 2.759 9.347 6 HG3 GLU 2 HG3 GLU 2 59.461 2.071 10.236 7 H LEU 3 H LEU 3 60.002 5.231 6.425 8 HA LEU 3 HA LEU 3 62.743 5.351 5.490 9 HB2 LEU 3 HB2 LEU 3 60.331 6.901 4.595 10 HB3 LEU 3 HB3 LEU 3 61.919 6.992 3.859 11 HG LEU 3 HG LEU 3 59.995 4.691 3.829 12 HD11 LEU 3 HD11 LEU 3 59.602 6.391 2.109 13 HD12 LEU 3 HD12 LEU 3 60.205 4.909 1.377 14 HD13 LEU 3 HD13 LEU 3 61.281 6.275 1.595 15 HD21 LEU 3 HD21 LEU 3 62.874 4.730 2.983 16 HD22 LEU 3 HD22 LEU 3 61.729 3.421 2.631 17 HD23 LEU 3 HD23 LEU 3 62.172 3.795 4.300 18 H LYS 4 H LYS 4 64.118 6.776 5.990 19 HA LYS 4 HA LYS 4 63.423 8.929 7.842 20 HB2 LYS 4 HB2 LYS 4 66.138 7.937 6.996 21 HB3 LYS 4 HB3 LYS 4 65.766 8.961 8.383 22 HG2 LYS 4 HG2 LYS 4 65.349 6.023 7.972 23 HG3 LYS 4 HG3 LYS 4 66.254 6.827 9.245 24 HD2 LYS 4 HD2 LYS 4 63.891 7.846 9.758 25 HD3 LYS 4 HD3 LYS 4 63.373 6.423 8.878 26 HE2 LYS 4 HE2 LYS 4 64.705 4.964 10.353 27 HE3 LYS 4 HE3 LYS 4 65.215 6.361 11.235 28 HZ1 LYS 4 HZ1 LYS 4 63.044 6.822 11.974 29 HZ2 LYS 4 HZ2 LYS 4 63.421 5.242 12.392 30 HZ3 LYS 4 HZ3 LYS 4 62.370 5.549 11.101 31 H ASN 5 H ASN 5 65.594 10.588 7.225 32 HA ASN 5 HA ASN 5 64.992 11.299 4.451 33 HB2 ASN 5 HB2 ASN 5 65.547 13.150 6.773 34 HB3 ASN 5 HB3 ASN 5 65.524 13.662 5.089 35 HD21 ASN 5 HD21 ASN 5 63.564 13.772 3.996 36 HD22 ASN 5 HD22 ASN 5 62.059 13.699 4.819 37 H SER 6 H SER 6 67.434 10.849 6.847 38 HA SER 6 HA SER 6 69.431 10.896 4.740 39 HB2 SER 6 HB2 SER 6 71.014 11.866 6.482 40 HB3 SER 6 HB3 SER 6 69.776 12.982 5.885 41 HG SER 6 HG SER 6 69.320 13.218 7.877 42 H ILE 7 H ILE 7 71.429 9.687 5.531 43 HA ILE 7 HA ILE 7 70.694 7.085 6.416 44 HB ILE 7 HB ILE 7 72.635 7.607 4.868 45 HG12 ILE 7 HG12 ILE 7 74.213 5.918 5.825 46 HG13 ILE 7 HG13 ILE 7 73.262 5.945 7.309 47 HG21 ILE 7 HG21 ILE 7 73.617 9.492 6.012 48 HG22 ILE 7 HG22 ILE 7 74.799 8.189 5.825 49 HG23 ILE 7 HG23 ILE 7 74.031 8.461 7.386 50 HD11 ILE 7 HD11 ILE 7 72.293 5.146 4.590 51 HD12 ILE 7 HD12 ILE 7 71.348 5.084 6.092 52 HD13 ILE 7 HD13 ILE 7 72.783 4.069 5.886 53 H SER 8 H SER 8 71.181 9.884 8.120 54 HA SER 8 HA SER 8 72.712 9.058 10.344 55 HB2 SER 8 HB2 SER 8 70.779 11.351 10.098 56 HB3 SER 8 HB3 SER 8 72.173 11.231 11.183 57 HG SER 8 HG SER 8 72.149 12.371 8.947 58 H ASP 9 H ASP 9 69.328 8.869 9.506 59 HA ASP 9 HA ASP 9 68.726 8.251 12.315 60 HB2 ASP 9 HB2 ASP 9 67.382 10.009 10.861 61 HB3 ASP 9 HB3 ASP 9 66.662 8.586 10.197 62 H TYR 10 H TYR 10 69.795 6.653 9.865 63 HA TYR 10 HA TYR 10 67.767 4.534 9.762 64 HB2 TYR 10 HB2 TYR 10 69.984 5.309 7.917 65 HB3 TYR 10 HB3 TYR 10 69.568 3.608 8.015 66 HD1 TYR 10 HD1 TYR 10 67.221 2.913 7.440 67 HD2 TYR 10 HD2 TYR 10 68.671 6.823 6.616 68 HE1 TYR 10 HE1 TYR 10 65.399 3.235 5.816 69 HE2 TYR 10 HE2 TYR 10 66.837 7.154 4.992 70 HH TYR 10 HH TYR 10 65.219 5.914 3.690 71 H THR 11 H THR 11 68.044 2.803 11.021 72 HA THR 11 HA THR 11 70.686 2.145 12.033 73 HB THR 11 HB THR 11 69.444 0.298 13.174 74 HG1 THR 11 HG1 THR 11 67.073 0.521 13.040 75 HG21 THR 11 HG21 THR 11 68.102 1.676 14.693 76 HG22 THR 11 HG22 THR 11 68.176 3.014 13.545 77 HG23 THR 11 HG23 THR 11 69.650 2.434 14.330 78 H GLU 12 H GLU 12 71.233 -0.326 11.696 79 HA GLU 12 HA GLU 12 71.335 -0.749 8.969 80 HB2 GLU 12 HB2 GLU 12 71.867 -3.237 9.634 81 HB3 GLU 12 HB3 GLU 12 73.013 -1.957 9.957 82 HG2 GLU 12 HG2 GLU 12 72.806 -3.587 11.783 83 HG3 GLU 12 HG3 GLU 12 72.407 -1.940 12.284 84 H ALA 13 H ALA 13 69.064 -2.074 11.259 85 HA ALA 13 HA ALA 13 67.781 -3.647 9.312 86 HB1 ALA 13 HB1 ALA 13 66.724 -2.760 11.982 87 HB2 ALA 13 HB2 ALA 13 67.672 -4.212 11.655 88 HB3 ALA 13 HB3 ALA 13 66.045 -4.051 10.984 89 H GLU 14 H GLU 14 67.076 -0.360 10.543 90 HA GLU 14 HA GLU 14 64.667 -0.102 9.099 91 HB2 GLU 14 HB2 GLU 14 66.622 1.926 10.124 92 HB3 GLU 14 HB3 GLU 14 65.244 2.436 9.167 93 HG2 GLU 14 HG2 GLU 14 65.167 0.929 11.773 94 HG3 GLU 14 HG3 GLU 14 64.769 2.630 11.517 95 H PHE 15 H PHE 15 67.973 0.305 8.248 96 HA PHE 15 HA PHE 15 67.483 1.408 5.694 97 HB2 PHE 15 HB2 PHE 15 69.613 1.597 6.974 98 HB3 PHE 15 HB3 PHE 15 69.895 -0.110 6.677 99 HD1 PHE 15 HD1 PHE 15 69.319 3.102 4.925 100 HD2 PHE 15 HD2 PHE 15 71.056 -0.758 4.820 101 HE1 PHE 15 HE1 PHE 15 70.493 3.690 2.848 102 HE2 PHE 15 HE2 PHE 15 72.227 -0.183 2.741 103 HZ PHE 15 HZ PHE 15 71.942 2.051 1.763 104 H VAL 16 H VAL 16 68.085 -1.914 6.890 105 HA VAL 16 HA VAL 16 67.934 -3.073 4.337 106 HB VAL 16 HB VAL 16 67.755 -5.202 5.238 107 HG11 VAL 16 HG11 VAL 16 69.827 -4.540 5.653 108 HG12 VAL 16 HG12 VAL 16 69.313 -5.401 7.106 109 HG13 VAL 16 HG13 VAL 16 69.383 -3.635 7.096 110 HG21 VAL 16 HG21 VAL 16 66.633 -4.146 7.810 111 HG22 VAL 16 HG22 VAL 16 67.147 -5.821 7.492 112 HG23 VAL 16 HG23 VAL 16 65.833 -5.120 6.564 113 H GLN 17 H GLN 17 65.411 -2.019 6.529 114 HA GLN 17 HA GLN 17 63.276 -3.356 5.424 115 HB2 GLN 17 HB2 GLN 17 63.385 -2.080 7.596 116 HB3 GLN 17 HB3 GLN 17 63.347 -0.603 6.660 117 HG2 GLN 17 HG2 GLN 17 61.247 -2.647 6.369 118 HG3 GLN 17 HG3 GLN 17 61.231 -1.505 7.724 119 HE21 GLN 17 HE21 GLN 17 59.363 -1.827 5.411 120 HE22 GLN 17 HE22 GLN 17 59.348 -0.298 4.605 121 H LEU 18 H LEU 18 64.716 -0.209 4.652 122 HA LEU 18 HA LEU 18 62.993 0.521 2.526 123 HB2 LEU 18 HB2 LEU 18 64.488 2.126 3.484 124 HB3 LEU 18 HB3 LEU 18 65.874 1.182 3.152 125 HG LEU 18 HG LEU 18 65.567 1.530 0.710 126 HD11 LEU 18 HD11 LEU 18 63.463 3.495 1.504 127 HD12 LEU 18 HD12 LEU 18 63.205 1.964 0.670 128 HD13 LEU 18 HD13 LEU 18 64.124 3.253 -0.113 129 HD21 LEU 18 HD21 LEU 18 67.125 2.885 1.958 130 HD22 LEU 18 HD22 LEU 18 65.834 4.011 2.380 131 HD23 LEU 18 HD23 LEU 18 66.346 3.844 0.699 132 H LEU 19 H LEU 19 66.056 -1.076 2.581 133 HA LEU 19 HA LEU 19 66.235 -1.615 -0.180 134 HB2 LEU 19 HB2 LEU 19 67.529 -2.622 2.224 135 HB3 LEU 19 HB3 LEU 19 67.730 -3.630 0.785 136 HG LEU 19 HG LEU 19 69.655 -2.198 1.027 137 HD11 LEU 19 HD11 LEU 19 68.847 -2.493 -1.261 138 HD12 LEU 19 HD12 LEU 19 69.667 -0.957 -1.025 139 HD13 LEU 19 HD13 LEU 19 67.916 -1.007 -1.128 140 HD21 LEU 19 HD21 LEU 19 67.752 0.124 1.117 141 HD22 LEU 19 HD22 LEU 19 69.515 0.201 1.071 142 HD23 LEU 19 HD23 LEU 19 68.703 -0.496 2.477 143 H LYS 20 H LYS 20 64.721 -3.493 2.351 144 HA LYS 20 HA LYS 20 64.095 -5.651 0.662 145 HB2 LYS 20 HB2 LYS 20 62.821 -4.703 3.206 146 HB3 LYS 20 HB3 LYS 20 62.284 -6.154 2.362 147 HG2 LYS 20 HG2 LYS 20 64.621 -7.073 2.646 148 HG3 LYS 20 HG3 LYS 20 64.983 -5.646 3.580 149 HD2 LYS 20 HD2 LYS 20 63.253 -6.124 5.198 150 HD3 LYS 20 HD3 LYS 20 62.768 -7.557 4.300 151 HE2 LYS 20 HE2 LYS 20 65.548 -7.225 5.421 152 HE3 LYS 20 HE3 LYS 20 64.238 -7.888 6.383 153 HZ1 LYS 20 HZ1 LYS 20 64.022 -9.684 4.843 154 HZ2 LYS 20 HZ2 LYS 20 65.609 -9.578 5.385 155 HZ3 LYS 20 HZ3 LYS 20 65.223 -9.082 3.819 156 H GLU 21 H GLU 21 62.390 -2.615 1.426 157 HA GLU 21 HA GLU 21 60.136 -3.288 -0.143 158 HB2 GLU 21 HB2 GLU 21 61.174 -0.608 0.775 159 HB3 GLU 21 HB3 GLU 21 59.733 -0.725 -0.204 160 HG2 GLU 21 HG2 GLU 21 58.894 -2.339 1.632 161 HG3 GLU 21 HG3 GLU 21 60.198 -1.661 2.602 162 H ILE 22 H ILE 22 63.157 -1.794 -0.821 163 HA ILE 22 HA ILE 22 62.732 -1.110 -3.504 164 HB ILE 22 HB ILE 22 65.292 -1.966 -2.115 165 HG12 ILE 22 HG12 ILE 22 64.140 0.754 -2.736 166 HG13 ILE 22 HG13 ILE 22 64.210 0.010 -1.159 167 HG21 ILE 22 HG21 ILE 22 64.926 -0.553 -4.752 168 HG22 ILE 22 HG22 ILE 22 65.430 -2.230 -4.541 169 HG23 ILE 22 HG23 ILE 22 66.459 -0.922 -3.954 170 HD11 ILE 22 HD11 ILE 22 65.886 1.775 -1.597 171 HD12 ILE 22 HD12 ILE 22 66.663 0.684 -2.758 172 HD13 ILE 22 HD13 ILE 22 66.531 0.247 -1.046 173 H GLU 23 H GLU 23 63.983 -4.094 -2.014 174 HA GLU 23 HA GLU 23 64.470 -5.703 -4.170 175 HB2 GLU 23 HB2 GLU 23 65.185 -6.303 -2.049 176 HB3 GLU 23 HB3 GLU 23 63.648 -5.894 -1.325 177 HG2 GLU 23 HG2 GLU 23 63.690 -8.074 -1.106 178 HG3 GLU 23 HG3 GLU 23 62.759 -7.895 -2.554 179 H LYS 24 H LYS 24 61.592 -5.149 -2.275 180 HA LYS 24 HA LYS 24 59.895 -7.053 -3.364 181 HB2 LYS 24 HB2 LYS 24 59.682 -5.717 -1.221 182 HB3 LYS 24 HB3 LYS 24 59.046 -4.417 -2.220 183 HG2 LYS 24 HG2 LYS 24 57.269 -5.980 -2.999 184 HG3 LYS 24 HG3 LYS 24 57.952 -7.139 -1.836 185 HD2 LYS 24 HD2 LYS 24 56.936 -4.410 -1.055 186 HD3 LYS 24 HD3 LYS 24 55.939 -5.859 -1.005 187 HE2 LYS 24 HE2 LYS 24 58.521 -5.465 0.510 188 HE3 LYS 24 HE3 LYS 24 56.912 -5.272 1.186 189 HZ1 LYS 24 HZ1 LYS 24 56.484 -7.626 0.678 190 HZ2 LYS 24 HZ2 LYS 24 57.746 -7.391 1.748 191 HZ3 LYS 24 HZ3 LYS 24 58.090 -7.825 0.168 192 H GLU 25 H GLU 25 60.082 -3.503 -4.106 193 HA GLU 25 HA GLU 25 58.258 -3.907 -6.226 194 HB2 GLU 25 HB2 GLU 25 59.776 -1.383 -5.496 195 HB3 GLU 25 HB3 GLU 25 58.511 -1.594 -6.651 196 HG2 GLU 25 HG2 GLU 25 58.143 -1.544 -3.637 197 HG3 GLU 25 HG3 GLU 25 57.559 -0.675 -4.943 198 H ASN 26 H ASN 26 61.631 -4.158 -5.961 199 HA ASN 26 HA ASN 26 62.348 -3.291 -8.573 200 HB2 ASN 26 HB2 ASN 26 64.016 -3.562 -6.760 201 HB3 ASN 26 HB3 ASN 26 63.764 -5.300 -6.803 202 HD21 ASN 26 HD21 ASN 26 65.866 -5.750 -7.306 203 HD22 ASN 26 HD22 ASN 26 66.577 -5.391 -8.835 204 H VAL 27 H VAL 27 61.649 -6.472 -7.205 205 HA VAL 27 HA VAL 27 61.987 -7.795 -9.707 206 HB VAL 27 HB VAL 27 61.032 -9.795 -8.663 207 HG11 VAL 27 HG11 VAL 27 62.671 -10.076 -6.849 208 HG12 VAL 27 HG12 VAL 27 62.977 -8.340 -6.878 209 HG13 VAL 27 HG13 VAL 27 63.372 -9.328 -8.284 210 HG21 VAL 27 HG21 VAL 27 60.284 -9.775 -6.319 211 HG22 VAL 27 HG22 VAL 27 59.265 -8.753 -7.333 212 HG23 VAL 27 HG23 VAL 27 60.472 -8.020 -6.279 213 H ALA 28 H ALA 28 59.434 -6.066 -8.322 214 HA ALA 28 HA ALA 28 57.403 -7.180 -10.085 215 HB1 ALA 28 HB1 ALA 28 56.801 -6.533 -7.803 216 HB2 ALA 28 HB2 ALA 28 55.914 -5.568 -8.987 217 HB3 ALA 28 HB3 ALA 28 57.296 -4.876 -8.139 218 H ALA 29 H ALA 29 59.740 -4.758 -10.024 219 HA ALA 29 HA ALA 29 60.262 -2.932 -11.122 220 HB1 ALA 29 HB1 ALA 29 60.124 -2.983 -13.533 221 HB2 ALA 29 HB2 ALA 29 58.924 -4.275 -13.469 222 HB3 ALA 29 HB3 ALA 29 60.577 -4.576 -12.922 223 H THR 30 H THR 30 58.781 -1.799 -9.735 224 HA THR 30 HA THR 30 56.459 -0.761 -11.130 225 HB THR 30 HB THR 30 55.995 0.405 -8.905 226 HG1 THR 30 HG1 THR 30 57.321 -0.570 -7.191 227 HG21 THR 30 HG21 THR 30 55.062 -1.818 -9.376 228 HG22 THR 30 HG22 THR 30 55.482 -1.627 -7.665 229 HG23 THR 30 HG23 THR 30 56.543 -2.540 -8.743 230 H ASP 31 H ASP 31 56.437 1.814 -10.193 231 HA ASP 31 HA ASP 31 58.985 2.892 -11.109 232 HB2 ASP 31 HB2 ASP 31 57.566 2.937 -13.054 233 HB3 ASP 31 HB3 ASP 31 56.289 3.705 -12.110 234 H ASP 32 H ASP 32 55.831 3.829 -9.796 235 HA ASP 32 HA ASP 32 56.786 6.285 -8.927 236 HB2 ASP 32 HB2 ASP 32 54.798 6.523 -7.503 237 HB3 ASP 32 HB3 ASP 32 54.397 6.030 -9.139 238 H VAL 33 H VAL 33 56.557 3.360 -6.989 239 HA VAL 33 HA VAL 33 57.861 4.879 -4.878 240 HB VAL 33 HB VAL 33 56.132 3.056 -4.339 241 HG11 VAL 33 HG11 VAL 33 56.732 0.867 -4.192 242 HG12 VAL 33 HG12 VAL 33 58.259 1.209 -5.033 243 HG13 VAL 33 HG13 VAL 33 56.715 1.441 -5.864 244 HG21 VAL 33 HG21 VAL 33 57.311 2.234 -2.373 245 HG22 VAL 33 HG22 VAL 33 57.512 3.972 -2.586 246 HG23 VAL 33 HG23 VAL 33 58.819 2.874 -3.024 247 H LEU 34 H LEU 34 58.594 2.568 -7.287 248 HA LEU 34 HA LEU 34 61.080 1.569 -6.410 249 HB2 LEU 34 HB2 LEU 34 59.478 0.796 -8.314 250 HB3 LEU 34 HB3 LEU 34 60.164 2.111 -9.180 251 HG LEU 34 HG LEU 34 61.028 -0.256 -9.659 252 HD11 LEU 34 HD11 LEU 34 63.183 0.613 -10.290 253 HD12 LEU 34 HD12 LEU 34 62.856 2.073 -9.338 254 HD13 LEU 34 HD13 LEU 34 61.838 1.665 -10.725 255 HD21 LEU 34 HD21 LEU 34 62.737 0.454 -7.274 256 HD22 LEU 34 HD22 LEU 34 63.014 -0.889 -8.383 257 HD23 LEU 34 HD23 LEU 34 61.579 -0.873 -7.361 258 H ASP 35 H ASP 35 60.259 4.418 -8.390 259 HA ASP 35 HA ASP 35 63.036 5.041 -8.705 260 HB2 ASP 35 HB2 ASP 35 60.837 5.855 -10.059 261 HB3 ASP 35 HB3 ASP 35 61.049 7.224 -8.976 262 H VAL 36 H VAL 36 60.611 5.853 -6.411 263 HA VAL 36 HA VAL 36 61.915 7.984 -5.075 264 HB VAL 36 HB VAL 36 60.221 5.752 -3.885 265 HG11 VAL 36 HG11 VAL 36 61.011 8.415 -2.795 266 HG12 VAL 36 HG12 VAL 36 61.678 6.846 -2.330 267 HG13 VAL 36 HG13 VAL 36 59.958 7.216 -1.989 268 HG21 VAL 36 HG21 VAL 36 59.592 8.520 -4.647 269 HG22 VAL 36 HG22 VAL 36 58.603 7.321 -3.733 270 HG23 VAL 36 HG23 VAL 36 59.081 6.979 -5.432 271 H LEU 37 H LEU 37 61.887 4.561 -4.664 272 HA LEU 37 HA LEU 37 63.432 4.585 -2.337 273 HB2 LEU 37 HB2 LEU 37 63.074 2.279 -4.170 274 HB3 LEU 37 HB3 LEU 37 63.483 2.425 -2.453 275 HG LEU 37 HG LEU 37 60.784 3.141 -3.505 276 HD11 LEU 37 HD11 LEU 37 61.659 0.632 -2.099 277 HD12 LEU 37 HD12 LEU 37 61.100 0.765 -3.766 278 HD13 LEU 37 HD13 LEU 37 59.988 1.083 -2.433 279 HD21 LEU 37 HD21 LEU 37 61.402 4.328 -1.467 280 HD22 LEU 37 HD22 LEU 37 61.818 2.801 -0.689 281 HD23 LEU 37 HD23 LEU 37 60.146 3.138 -1.132 282 H LEU 38 H LEU 38 64.115 3.885 -5.672 283 HA LEU 38 HA LEU 38 66.761 3.085 -5.331 284 HB2 LEU 38 HB2 LEU 38 65.271 4.329 -7.576 285 HB3 LEU 38 HB3 LEU 38 66.934 3.780 -7.808 286 HG LEU 38 HG LEU 38 64.341 2.329 -7.546 287 HD11 LEU 38 HD11 LEU 38 65.168 1.100 -9.425 288 HD12 LEU 38 HD12 LEU 38 66.735 1.868 -9.220 289 HD13 LEU 38 HD13 LEU 38 65.343 2.847 -9.715 290 HD21 LEU 38 HD21 LEU 38 65.470 0.203 -7.169 291 HD22 LEU 38 HD22 LEU 38 65.678 1.295 -5.800 292 HD23 LEU 38 HD23 LEU 38 66.998 1.053 -6.949 293 H GLU 39 H GLU 39 65.372 6.271 -5.962 294 HA GLU 39 HA GLU 39 67.840 7.655 -5.928 295 HB2 GLU 39 HB2 GLU 39 64.981 8.406 -5.623 296 HB3 GLU 39 HB3 GLU 39 66.266 9.579 -5.394 297 HG2 GLU 39 HG2 GLU 39 65.806 7.960 -7.900 298 HG3 GLU 39 HG3 GLU 39 65.269 9.617 -7.598 299 H HIS 40 H HIS 40 65.456 6.875 -3.507 300 HA HIS 40 HA HIS 40 66.347 8.607 -1.534 301 HB2 HIS 40 HB2 HIS 40 64.143 7.466 -1.620 302 HB3 HIS 40 HB3 HIS 40 64.857 5.974 -1.162 303 HD1 HIS 40 HD1 HIS 40 63.248 8.872 0.282 304 HD2 HIS 40 HD2 HIS 40 66.156 6.178 1.519 305 HE1 HIS 40 HE1 HIS 40 63.334 9.032 2.784 306 H PHE 41 H PHE 41 66.983 5.254 -2.190 307 HA PHE 41 HA PHE 41 68.679 4.642 -0.092 308 HB2 PHE 41 HB2 PHE 41 67.776 2.935 -1.367 309 HB3 PHE 41 HB3 PHE 41 68.307 3.658 -2.876 310 HD1 PHE 41 HD1 PHE 41 69.559 2.118 0.246 311 HD2 PHE 41 HD2 PHE 41 70.258 2.871 -3.857 312 HE1 PHE 41 HE1 PHE 41 71.543 0.653 0.315 313 HE2 PHE 41 HE2 PHE 41 72.239 1.440 -3.778 314 HZ PHE 41 HZ PHE 41 72.879 0.322 -1.715 315 H VAL 42 H VAL 42 69.480 5.766 -3.366 316 HA VAL 42 HA VAL 42 72.228 5.933 -2.746 317 HB VAL 42 HB VAL 42 71.446 5.554 -5.015 318 HG11 VAL 42 HG11 VAL 42 70.682 7.207 -6.419 319 HG12 VAL 42 HG12 VAL 42 70.518 8.339 -5.043 320 HG13 VAL 42 HG13 VAL 42 69.577 6.821 -5.101 321 HG21 VAL 42 HG21 VAL 42 73.008 7.000 -6.216 322 HG22 VAL 42 HG22 VAL 42 73.720 6.395 -4.714 323 HG23 VAL 42 HG23 VAL 42 73.114 8.047 -4.803 324 H LYS 43 H LYS 43 69.702 8.278 -2.492 325 HA LYS 43 HA LYS 43 71.479 10.498 -2.161 326 HB2 LYS 43 HB2 LYS 43 69.654 11.837 -1.425 327 HB3 LYS 43 HB3 LYS 43 68.985 10.738 -2.615 328 HG2 LYS 43 HG2 LYS 43 68.036 9.329 -0.754 329 HG3 LYS 43 HG3 LYS 43 68.802 10.412 0.360 330 HD2 LYS 43 HD2 LYS 43 66.810 11.468 -1.608 331 HD3 LYS 43 HD3 LYS 43 66.329 10.806 -0.044 332 HE2 LYS 43 HE2 LYS 43 67.679 12.427 1.120 333 HE3 LYS 43 HE3 LYS 43 68.340 13.041 -0.398 334 HZ1 LYS 43 HZ1 LYS 43 66.120 13.774 -0.978 335 HZ2 LYS 43 HZ2 LYS 43 66.660 14.457 0.465 336 HZ3 LYS 43 HZ3 LYS 43 65.523 13.203 0.506 337 H ILE 44 H ILE 44 70.175 8.210 0.127 338 HA ILE 44 HA ILE 44 71.171 9.730 2.331 339 HB ILE 44 HB ILE 44 70.488 7.790 3.759 340 HG12 ILE 44 HG12 ILE 44 69.537 6.648 1.125 341 HG13 ILE 44 HG13 ILE 44 70.849 5.997 2.086 342 HG21 ILE 44 HG21 ILE 44 68.939 9.628 3.275 343 HG22 ILE 44 HG22 ILE 44 68.082 8.095 3.422 344 HG23 ILE 44 HG23 ILE 44 68.388 8.781 1.830 345 HD11 ILE 44 HD11 ILE 44 68.790 4.719 2.319 346 HD12 ILE 44 HD12 ILE 44 67.963 6.163 2.909 347 HD13 ILE 44 HD13 ILE 44 69.270 5.447 3.851 348 H THR 45 H THR 45 72.304 7.071 0.431 349 HA THR 45 HA THR 45 74.511 6.572 2.215 350 HB THR 45 HB THR 45 75.235 4.963 0.435 351 HG1 THR 45 HG1 THR 45 72.708 5.298 -0.778 352 HG21 THR 45 HG21 THR 45 72.387 4.720 1.396 353 HG22 THR 45 HG22 THR 45 73.828 4.240 2.293 354 HG23 THR 45 HG23 THR 45 73.384 3.392 0.811 355 H GLU 46 H GLU 46 73.885 8.156 -0.870 356 HA GLU 46 HA GLU 46 75.018 9.338 -2.277 357 HB2 GLU 46 HB2 GLU 46 76.557 9.947 0.214 358 HB3 GLU 46 HB3 GLU 46 77.017 10.677 -1.331 359 HG2 GLU 46 HG2 GLU 46 74.309 10.843 -0.056 360 HG3 GLU 46 HG3 GLU 46 75.536 12.127 0.015 361 H HIS 47 H HIS 47 75.432 6.671 -2.048 362 HA HIS 47 HA HIS 47 78.186 6.068 -2.484 363 HB2 HIS 47 HB2 HIS 47 76.283 4.521 -1.580 364 HB3 HIS 47 HB3 HIS 47 75.878 4.303 -3.275 365 HD1 HIS 47 HD1 HIS 47 78.195 3.302 -4.770 366 HD2 HIS 47 HD2 HIS 47 78.044 2.842 -0.653 367 HE1 HIS 47 HE1 HIS 47 79.749 1.470 -4.243 368 HA PRO 48 HA PRO 48 77.872 7.308 -6.860 369 HB2 PRO 48 HB2 PRO 48 80.175 5.609 -7.249 370 HB3 PRO 48 HB3 PRO 48 80.034 7.355 -7.463 371 HG2 PRO 48 HG2 PRO 48 81.426 6.136 -5.538 372 HG3 PRO 48 HG3 PRO 48 80.590 7.675 -5.149 373 HD2 PRO 48 HD2 PRO 48 79.849 4.827 -4.634 374 HD3 PRO 48 HD3 PRO 48 79.710 6.198 -3.527 375 H ASP 49 H ASP 49 77.078 4.464 -5.755 376 HA ASP 49 HA ASP 49 77.138 3.357 -8.300 377 HB2 ASP 49 HB2 ASP 49 77.982 1.773 -5.858 378 HB3 ASP 49 HB3 ASP 49 77.757 1.077 -7.432 379 H GLY 50 H GLY 50 75.337 4.595 -6.248 380 HA2 GLY 50 HA2 GLY 50 73.911 3.100 -4.378 381 HA3 GLY 50 HA3 GLY 50 73.277 4.428 -5.319 382 H THR 51 H THR 51 72.625 3.741 -7.480 383 HA THR 51 HA THR 51 70.679 1.789 -6.793 384 HB THR 51 HB THR 51 70.810 2.823 -9.595 385 HG1 THR 51 HG1 THR 51 69.485 4.547 -7.979 386 HG21 THR 51 HG21 THR 51 68.392 2.879 -9.223 387 HG22 THR 51 HG22 THR 51 68.614 2.482 -7.531 388 HG23 THR 51 HG23 THR 51 69.026 1.301 -8.757 389 H ALA 52 H ALA 52 73.711 1.669 -8.322 390 HA ALA 52 HA ALA 52 73.264 -0.685 -9.928 391 HB1 ALA 52 HB1 ALA 52 75.074 0.917 -10.417 392 HB2 ALA 52 HB2 ALA 52 75.667 -0.723 -10.150 393 HB3 ALA 52 HB3 ALA 52 75.830 0.494 -8.882 394 H LEU 53 H LEU 53 74.273 0.003 -6.671 395 HA LEU 53 HA LEU 53 75.014 -2.621 -5.974 396 HB2 LEU 53 HB2 LEU 53 73.896 -0.393 -4.320 397 HB3 LEU 53 HB3 LEU 53 74.461 -1.889 -3.621 398 HG LEU 53 HG LEU 53 76.093 0.170 -5.104 399 HD11 LEU 53 HD11 LEU 53 77.254 0.364 -2.984 400 HD12 LEU 53 HD12 LEU 53 76.128 -0.792 -2.270 401 HD13 LEU 53 HD13 LEU 53 75.546 0.768 -2.858 402 HD21 LEU 53 HD21 LEU 53 78.043 -1.240 -4.573 403 HD22 LEU 53 HD22 LEU 53 76.945 -2.010 -5.708 404 HD23 LEU 53 HD23 LEU 53 76.954 -2.512 -4.014 405 H ILE 54 H ILE 54 71.971 -1.018 -6.086 406 HA ILE 54 HA ILE 54 70.448 -3.118 -4.850 407 HB ILE 54 HB ILE 54 69.696 -0.802 -6.629 408 HG12 ILE 54 HG12 ILE 54 68.729 -1.393 -3.867 409 HG13 ILE 54 HG13 ILE 54 70.240 -0.552 -4.069 410 HG21 ILE 54 HG21 ILE 54 67.318 -1.343 -6.307 411 HG22 ILE 54 HG22 ILE 54 67.775 -2.861 -5.535 412 HG23 ILE 54 HG23 ILE 54 68.156 -2.589 -7.234 413 HD11 ILE 54 HD11 ILE 54 69.028 1.179 -5.352 414 HD12 ILE 54 HD12 ILE 54 68.473 1.006 -3.693 415 HD13 ILE 54 HD13 ILE 54 67.526 0.325 -5.023 416 H TYR 55 H TYR 55 71.134 -2.183 -8.133 417 HA TYR 55 HA TYR 55 69.710 -4.234 -9.348 418 HB2 TYR 55 HB2 TYR 55 71.720 -2.269 -10.215 419 HB3 TYR 55 HB3 TYR 55 71.375 -3.596 -11.300 420 HD1 TYR 55 HD1 TYR 55 68.745 -4.020 -11.627 421 HD2 TYR 55 HD2 TYR 55 70.440 -0.334 -10.376 422 HE1 TYR 55 HE1 TYR 55 66.695 -2.846 -12.315 423 HE2 TYR 55 HE2 TYR 55 68.407 0.844 -11.046 424 HH TYR 55 HH TYR 55 66.522 0.522 -12.559 425 H GLU 56 H GLU 56 73.203 -4.045 -8.612 426 HA GLU 56 HA GLU 56 73.646 -6.612 -9.641 427 HB2 GLU 56 HB2 GLU 56 75.801 -6.613 -8.390 428 HB3 GLU 56 HB3 GLU 56 75.578 -5.214 -9.425 429 HG2 GLU 56 HG2 GLU 56 75.264 -3.806 -7.670 430 HG3 GLU 56 HG3 GLU 56 74.916 -5.055 -6.501 431 H ALA 57 H ALA 57 72.679 -5.528 -6.421 432 HA ALA 57 HA ALA 57 73.053 -7.943 -5.051 433 HB1 ALA 57 HB1 ALA 57 72.421 -5.835 -3.955 434 HB2 ALA 57 HB2 ALA 57 71.378 -7.176 -3.484 435 HB3 ALA 57 HB3 ALA 57 70.804 -5.977 -4.645 436 H ALA 58 H ALA 58 70.329 -6.860 -6.999 437 HA ALA 58 HA ALA 58 68.673 -9.092 -6.581 438 HB1 ALA 58 HB1 ALA 58 67.499 -8.393 -8.600 439 HB2 ALA 58 HB2 ALA 58 68.851 -7.345 -9.033 440 HB3 ALA 58 HB3 ALA 58 67.891 -6.994 -7.599 441 H ALA 59 H ALA 59 71.163 -8.469 -8.996 442 HA ALA 59 HA ALA 59 70.750 -10.913 -10.410 443 HB1 ALA 59 HB1 ALA 59 72.796 -10.339 -11.615 444 HB2 ALA 59 HB2 ALA 59 73.144 -9.072 -10.439 445 HB3 ALA 59 HB3 ALA 59 71.734 -8.937 -11.490 446 H ARG 60 H ARG 60 73.081 -9.819 -8.003 447 HA ARG 60 HA ARG 60 74.633 -12.150 -7.882 448 HB2 ARG 60 HB2 ARG 60 74.160 -9.993 -5.808 449 HB3 ARG 60 HB3 ARG 60 75.301 -11.308 -5.578 450 HG2 ARG 60 HG2 ARG 60 76.664 -10.547 -7.382 451 HG3 ARG 60 HG3 ARG 60 75.444 -9.376 -7.885 452 HD2 ARG 60 HD2 ARG 60 77.257 -8.255 -6.719 453 HD3 ARG 60 HD3 ARG 60 75.778 -8.152 -5.776 454 HE ARG 60 HE ARG 60 77.320 -10.369 -4.951 455 HH11 ARG 60 HH11 ARG 60 77.499 -6.817 -4.848 456 HH12 ARG 60 HH12 ARG 60 78.266 -6.752 -3.327 457 HH21 ARG 60 HH21 ARG 60 78.380 -10.282 -2.829 458 HH22 ARG 60 HH22 ARG 60 78.743 -8.782 -2.139 459 H ALA 61 H ALA 61 71.730 -11.188 -6.120 460 HA ALA 61 HA ALA 61 71.670 -13.358 -4.343 461 HB1 ALA 61 HB1 ALA 61 69.344 -12.800 -3.968 462 HB2 ALA 61 HB2 ALA 61 69.333 -11.800 -5.423 463 HB3 ALA 61 HB3 ALA 61 70.325 -11.336 -4.042 464 H ALA 62 H ALA 62 70.723 -13.171 -7.686 465 HA ALA 62 HA ALA 62 68.989 -15.370 -7.747 466 HB1 ALA 62 HB1 ALA 62 69.172 -13.762 -9.591 467 HB2 ALA 62 HB2 ALA 62 69.388 -15.416 -10.160 468 HB3 ALA 62 HB3 ALA 62 70.788 -14.362 -9.954 469 H ALA 63 H ALA 63 72.483 -15.189 -8.007 470 HA ALA 63 HA ALA 63 72.615 -18.118 -8.119 471 HB1 ALA 63 HB1 ALA 63 74.050 -16.864 -9.686 472 HB2 ALA 63 HB2 ALA 63 75.000 -17.838 -8.565 473 HB3 ALA 63 HB3 ALA 63 74.849 -16.098 -8.312 474 H ASN 64 H ASN 64 73.327 -15.397 -6.122 475 HA ASN 64 HA ASN 64 73.836 -15.016 -4.030 476 HB2 ASN 64 HB2 ASN 64 71.831 -16.503 -3.675 477 HB3 ASN 64 HB3 ASN 64 72.950 -17.838 -3.446 478 HD21 ASN 64 HD21 ASN 64 70.997 -16.766 -1.585 479 HD22 ASN 64 HD22 ASN 64 71.877 -16.245 -0.198 480 HA PRO 65 HA PRO 65 77.992 -16.893 -4.370 481 HB2 PRO 65 HB2 PRO 65 78.787 -14.260 -3.314 482 HB3 PRO 65 HB3 PRO 65 79.328 -15.072 -4.784 483 HG2 PRO 65 HG2 PRO 65 77.721 -12.928 -4.884 484 HG3 PRO 65 HG3 PRO 65 77.568 -14.264 -6.042 485 HD2 PRO 65 HD2 PRO 65 75.914 -13.665 -3.610 486 HD3 PRO 65 HD3 PRO 65 75.400 -14.190 -5.231 487 H GLY 66 H GLY 66 77.757 -18.290 -2.678 488 HA2 GLY 66 HA2 GLY 66 78.138 -19.126 -0.588 489 HA3 GLY 66 HA3 GLY 66 78.854 -17.570 -0.158 490 H GLY 67 H GLY 67 77.657 -16.050 0.756 491 HA2 GLY 67 HA2 GLY 67 74.802 -16.251 0.981 492 HA3 GLY 67 HA3 GLY 67 75.674 -16.476 2.500 493 H ASP 68 H ASP 68 77.061 -14.449 0.062 494 HA ASP 68 HA ASP 68 76.294 -12.118 1.662 495 HB2 ASP 68 HB2 ASP 68 79.020 -12.710 0.515 496 HB3 ASP 68 HB3 ASP 68 78.534 -11.102 1.024 497 H GLY 69 H GLY 69 75.560 -10.457 0.647 498 HA2 GLY 69 HA2 GLY 69 75.060 -9.003 -1.092 499 HA3 GLY 69 HA3 GLY 69 76.088 -9.965 -2.149 500 H GLY 70 H GLY 70 74.005 -11.921 -0.509 501 HA2 GLY 70 HA2 GLY 70 72.300 -12.118 -2.871 502 HA3 GLY 70 HA3 GLY 70 72.624 -13.440 -1.751 503 H GLY 71 H GLY 71 71.365 -10.127 -1.648 504 HA2 GLY 71 HA2 GLY 71 68.883 -10.368 -1.184 505 HA3 GLY 71 HA3 GLY 71 69.452 -10.965 0.368 506 HA PRO 72 HA PRO 72 68.953 -6.234 0.057 507 HB2 PRO 72 HB2 PRO 72 67.157 -6.122 2.156 508 HB3 PRO 72 HB3 PRO 72 66.769 -6.141 0.424 509 HG2 PRO 72 HG2 PRO 72 66.778 -8.409 2.365 510 HG3 PRO 72 HG3 PRO 72 65.602 -8.024 1.097 511 HD2 PRO 72 HD2 PRO 72 67.450 -9.917 0.740 512 HD3 PRO 72 HD3 PRO 72 66.992 -8.862 -0.602 513 H GLU 73 H GLU 73 69.260 -8.417 2.787 514 HA GLU 73 HA GLU 73 70.565 -6.417 4.376 515 HB2 GLU 73 HB2 GLU 73 70.117 -9.354 4.880 516 HB3 GLU 73 HB3 GLU 73 70.684 -8.178 6.060 517 HG2 GLU 73 HG2 GLU 73 68.596 -6.945 5.845 518 HG3 GLU 73 HG3 GLU 73 68.033 -8.104 4.658 519 H GLY 74 H GLY 74 71.651 -8.141 1.855 520 HA2 GLY 74 HA2 GLY 74 74.230 -8.047 3.142 521 HA3 GLY 74 HA3 GLY 74 73.982 -8.999 1.621 522 H ILE 75 H ILE 75 72.464 -6.533 0.723 523 HA ILE 75 HA ILE 75 74.573 -5.068 -0.536 524 HB ILE 75 HB ILE 75 72.282 -3.395 -0.111 525 HG12 ILE 75 HG12 ILE 75 71.583 -6.124 -1.297 526 HG13 ILE 75 HG13 ILE 75 71.182 -5.510 0.284 527 HG21 ILE 75 HG21 ILE 75 73.447 -4.696 -2.554 528 HG22 ILE 75 HG22 ILE 75 73.812 -3.095 -1.913 529 HG23 ILE 75 HG23 ILE 75 72.211 -3.437 -2.575 530 HD11 ILE 75 HD11 ILE 75 69.868 -3.923 -0.392 531 HD12 ILE 75 HD12 ILE 75 69.381 -5.254 -1.474 532 HD13 ILE 75 HD13 ILE 75 70.406 -3.917 -2.058 533 H VAL 76 H VAL 76 72.696 -4.690 2.390 534 HA VAL 76 HA VAL 76 73.396 -2.133 2.989 535 HB VAL 76 HB VAL 76 72.677 -2.732 5.134 536 HG11 VAL 76 HG11 VAL 76 70.818 -3.862 3.048 537 HG12 VAL 76 HG12 VAL 76 71.106 -2.155 3.287 538 HG13 VAL 76 HG13 VAL 76 70.319 -3.078 4.556 539 HG21 VAL 76 HG21 VAL 76 73.470 -4.918 5.405 540 HG22 VAL 76 HG22 VAL 76 72.384 -5.511 4.153 541 HG23 VAL 76 HG23 VAL 76 71.735 -4.910 5.687 542 H LYS 77 H LYS 77 74.862 -5.180 3.703 543 HA LYS 77 HA LYS 77 76.889 -4.330 5.439 544 HB2 LYS 77 HB2 LYS 77 76.257 -6.684 5.048 545 HB3 LYS 77 HB3 LYS 77 76.920 -6.585 3.426 546 HG2 LYS 77 HG2 LYS 77 79.145 -6.128 4.426 547 HG3 LYS 77 HG3 LYS 77 78.430 -6.381 6.016 548 HD2 LYS 77 HD2 LYS 77 78.394 -8.369 3.792 549 HD3 LYS 77 HD3 LYS 77 79.585 -8.407 5.107 550 HE2 LYS 77 HE2 LYS 77 77.616 -8.611 6.683 551 HE3 LYS 77 HE3 LYS 77 76.586 -8.790 5.264 552 HZ1 LYS 77 HZ1 LYS 77 77.149 -10.924 6.147 553 HZ2 LYS 77 HZ2 LYS 77 78.787 -10.582 6.093 554 HZ3 LYS 77 HZ3 LYS 77 77.940 -10.789 4.657 555 H GLU 78 H GLU 78 76.727 -4.647 1.921 556 HA GLU 78 HA GLU 78 79.302 -3.830 1.144 557 HB2 GLU 78 HB2 GLU 78 76.575 -3.488 -0.067 558 HB3 GLU 78 HB3 GLU 78 77.962 -3.038 -0.998 559 HG2 GLU 78 HG2 GLU 78 77.395 -5.800 0.104 560 HG3 GLU 78 HG3 GLU 78 76.988 -5.269 -1.526 561 H ILE 79 H ILE 79 76.380 -2.061 1.633 562 HA ILE 79 HA ILE 79 77.305 0.552 1.246 563 HB ILE 79 HB ILE 79 74.933 -0.525 2.785 564 HG12 ILE 79 HG12 ILE 79 74.824 -0.711 0.345 565 HG13 ILE 79 HG13 ILE 79 73.635 0.413 0.974 566 HG21 ILE 79 HG21 ILE 79 75.544 1.526 3.894 567 HG22 ILE 79 HG22 ILE 79 74.055 1.732 2.970 568 HG23 ILE 79 HG23 ILE 79 75.574 2.373 2.348 569 HD11 ILE 79 HD11 ILE 79 74.595 1.343 -1.016 570 HD12 ILE 79 HD12 ILE 79 76.218 1.133 -0.387 571 HD13 ILE 79 HD13 ILE 79 75.131 2.298 0.367 572 H LYS 80 H LYS 80 77.110 -1.283 4.299 573 HA LYS 80 HA LYS 80 77.847 0.979 5.814 574 HB2 LYS 80 HB2 LYS 80 77.880 -0.368 7.766 575 HB3 LYS 80 HB3 LYS 80 76.628 -1.019 6.731 576 HG2 LYS 80 HG2 LYS 80 78.131 -2.829 6.073 577 HG3 LYS 80 HG3 LYS 80 79.363 -2.199 7.162 578 HD2 LYS 80 HD2 LYS 80 77.661 -2.393 9.029 579 HD3 LYS 80 HD3 LYS 80 76.636 -3.277 7.900 580 HE2 LYS 80 HE2 LYS 80 77.807 -4.887 9.214 581 HE3 LYS 80 HE3 LYS 80 78.525 -4.901 7.604 582 HZ1 LYS 80 HZ1 LYS 80 80.316 -3.445 8.505 583 HZ2 LYS 80 HZ2 LYS 80 80.257 -4.947 9.242 584 HZ3 LYS 80 HZ3 LYS 80 79.655 -3.615 10.045 585 H GLU 81 H GLU 81 79.718 -1.544 4.328 586 HA GLU 81 HA GLU 81 82.125 -0.934 5.665 587 HB2 GLU 81 HB2 GLU 81 81.756 -2.278 2.988 588 HB3 GLU 81 HB3 GLU 81 83.210 -2.317 3.975 589 HG2 GLU 81 HG2 GLU 81 81.914 -3.436 5.753 590 HG3 GLU 81 HG3 GLU 81 80.534 -3.491 4.667 591 H TRP 82 H TRP 82 80.564 0.325 2.847 592 HA TRP 82 HA TRP 82 82.834 1.597 1.753 593 HB2 TRP 82 HB2 TRP 82 80.862 1.013 0.432 594 HB3 TRP 82 HB3 TRP 82 79.918 2.197 1.326 595 HD1 TRP 82 HD1 TRP 82 82.790 2.002 -1.226 596 HE1 TRP 82 HE1 TRP 82 82.854 4.202 -2.527 597 HE3 TRP 82 HE3 TRP 82 79.295 4.598 1.434 598 HZ2 TRP 82 HZ2 TRP 82 81.578 6.712 -2.458 599 HZ3 TRP 82 HZ3 TRP 82 78.772 6.889 0.765 600 HH2 TRP 82 HH2 TRP 82 79.895 7.936 -1.146 601 H ARG 83 H ARG 83 80.142 2.893 3.769 602 HA ARG 83 HA ARG 83 81.262 5.527 3.723 603 HB2 ARG 83 HB2 ARG 83 79.419 4.510 5.928 604 HB3 ARG 83 HB3 ARG 83 79.946 6.155 5.714 605 HG2 ARG 83 HG2 ARG 83 77.860 6.219 4.901 606 HG3 ARG 83 HG3 ARG 83 78.749 5.889 3.407 607 HD2 ARG 83 HD2 ARG 83 76.724 4.483 3.764 608 HD3 ARG 83 HD3 ARG 83 78.215 3.582 3.516 609 HE ARG 83 HE ARG 83 78.318 3.316 5.989 610 HH11 ARG 83 HH11 ARG 83 75.198 4.029 4.591 611 HH12 ARG 83 HH12 ARG 83 74.328 3.233 5.825 612 HH21 ARG 83 HH21 ARG 83 77.196 2.278 7.655 613 HH22 ARG 83 HH22 ARG 83 75.510 2.188 7.631 614 H ALA 84 H ALA 84 81.704 2.808 5.836 615 HA ALA 84 HA ALA 84 83.021 4.131 7.914 616 HB1 ALA 84 HB1 ALA 84 83.779 1.932 8.616 617 HB2 ALA 84 HB2 ALA 84 83.359 1.265 7.040 618 HB3 ALA 84 HB3 ALA 84 82.091 1.864 8.108 619 H ALA 85 H ALA 85 84.244 2.710 4.934 620 HA ALA 85 HA ALA 85 86.990 3.130 5.609 621 HB1 ALA 85 HB1 ALA 85 87.443 2.523 3.290 622 HB2 ALA 85 HB2 ALA 85 85.719 2.606 2.928 623 HB3 ALA 85 HB3 ALA 85 86.328 1.380 4.037 624 H ASN 86 H ASN 86 84.620 4.788 3.585 625 HA ASN 86 HA ASN 86 86.449 6.737 2.622 626 HB2 ASN 86 HB2 ASN 86 84.217 6.075 1.500 627 HB3 ASN 86 HB3 ASN 86 83.440 7.018 2.744 628 HD21 ASN 86 HD21 ASN 86 83.723 7.246 -0.261 629 HD22 ASN 86 HD22 ASN 86 84.204 8.885 -0.495 630 H GLY 87 H GLY 87 84.336 6.594 5.409 631 HA2 GLY 87 HA2 GLY 87 84.798 7.820 7.385 632 HA3 GLY 87 HA3 GLY 87 85.582 9.053 6.401 633 H LYS 88 H LYS 88 82.489 7.592 5.612 634 HA LYS 88 HA LYS 88 81.261 10.177 5.767 635 HB2 LYS 88 HB2 LYS 88 80.976 7.699 4.153 636 HB3 LYS 88 HB3 LYS 88 79.647 8.817 4.286 637 HG2 LYS 88 HG2 LYS 88 81.095 10.594 3.340 638 HG3 LYS 88 HG3 LYS 88 82.418 9.428 3.230 639 HD2 LYS 88 HD2 LYS 88 81.159 8.101 1.675 640 HD3 LYS 88 HD3 LYS 88 79.761 9.148 1.822 641 HE2 LYS 88 HE2 LYS 88 82.469 9.896 0.719 642 HE3 LYS 88 HE3 LYS 88 81.020 9.597 -0.229 643 HZ1 LYS 88 HZ1 LYS 88 79.999 11.558 0.838 644 HZ2 LYS 88 HZ2 LYS 88 81.407 11.943 0.019 645 HZ3 LYS 88 HZ3 LYS 88 81.428 11.858 1.679 646 HA PRO 89 HA PRO 89 78.535 8.848 8.996 647 HB2 PRO 89 HB2 PRO 89 76.165 9.533 7.365 648 HB3 PRO 89 HB3 PRO 89 76.678 10.188 8.924 649 HG2 PRO 89 HG2 PRO 89 76.911 11.642 6.708 650 HG3 PRO 89 HG3 PRO 89 78.174 11.680 7.953 651 HD2 PRO 89 HD2 PRO 89 78.116 10.200 5.354 652 HD3 PRO 89 HD3 PRO 89 79.440 11.127 6.094 653 H GLY 90 H GLY 90 77.861 6.954 9.655 654 HA2 GLY 90 HA2 GLY 90 76.929 5.050 7.643 655 HA3 GLY 90 HA3 GLY 90 77.626 4.629 9.205 656 H PHE 91 H PHE 91 75.892 3.335 9.809 657 HA PHE 91 HA PHE 91 73.199 4.464 9.801 658 HB2 PHE 91 HB2 PHE 91 74.119 1.850 11.022 659 HB3 PHE 91 HB3 PHE 91 72.471 2.333 10.700 660 HD1 PHE 91 HD1 PHE 91 72.376 3.123 7.990 661 HD2 PHE 91 HD2 PHE 91 74.749 0.081 9.768 662 HE1 PHE 91 HE1 PHE 91 72.475 1.932 5.845 663 HE2 PHE 91 HE2 PHE 91 74.857 -1.105 7.629 664 HZ PHE 91 HZ PHE 91 73.722 -0.176 5.653 665 H LYS 92 H LYS 92 72.030 4.928 11.768 666 HA LYS 92 HA LYS 92 73.665 5.661 13.958 667 HB2 LYS 92 HB2 LYS 92 71.653 6.428 14.933 668 HB3 LYS 92 HB3 LYS 92 71.655 6.919 13.276 669 HG2 LYS 92 HG2 LYS 92 70.010 5.286 12.697 670 HG3 LYS 92 HG3 LYS 92 70.195 4.484 14.259 671 HD2 LYS 92 HD2 LYS 92 69.213 7.319 13.968 672 HD3 LYS 92 HD3 LYS 92 68.126 5.927 14.022 673 HE2 LYS 92 HE2 LYS 92 68.992 5.369 16.248 674 HE3 LYS 92 HE3 LYS 92 70.091 6.738 16.179 675 HZ1 LYS 92 HZ1 LYS 92 68.169 8.216 16.080 676 HZ2 LYS 92 HZ2 LYS 92 68.134 7.250 17.454 677 HZ3 LYS 92 HZ3 LYS 92 67.125 6.886 16.155 678 H GLN 93 H GLN 93 73.062 4.891 16.117 679 HA GLN 93 HA GLN 93 72.859 2.017 16.125 680 HB2 GLN 93 HB2 GLN 93 73.510 4.166 18.011 681 HB3 GLN 93 HB3 GLN 93 73.309 2.528 18.606 682 HG2 GLN 93 HG2 GLN 93 75.703 3.070 18.354 683 HG3 GLN 93 HG3 GLN 93 75.249 1.812 17.218 684 HE21 GLN 93 HE21 GLN 93 75.389 2.235 15.060 685 HE22 GLN 93 HE22 GLN 93 76.088 3.664 14.391 686 H GLY 94 H GLY 94 71.063 1.049 16.870 687 HA2 GLY 94 HA2 GLY 94 69.133 2.494 18.450 688 HA3 GLY 94 HA3 GLY 94 68.582 2.044 16.841 Start of MODEL 19 1 H GLU 2 H GLU 2 61.055 1.506 7.267 2 HA GLU 2 HA GLU 2 59.396 3.236 7.526 3 HB2 GLU 2 HB2 GLU 2 60.973 3.792 10.059 4 HB3 GLU 2 HB3 GLU 2 59.668 4.790 9.432 5 HG2 GLU 2 HG2 GLU 2 58.062 3.090 9.873 6 HG3 GLU 2 HG3 GLU 2 59.321 1.922 10.264 7 H LEU 3 H LEU 3 59.939 5.238 6.603 8 HA LEU 3 HA LEU 3 62.690 5.229 5.668 9 HB2 LEU 3 HB2 LEU 3 60.367 6.903 4.732 10 HB3 LEU 3 HB3 LEU 3 61.951 6.840 3.991 11 HG LEU 3 HG LEU 3 59.842 4.713 4.041 12 HD11 LEU 3 HD11 LEU 3 61.279 6.142 1.804 13 HD12 LEU 3 HD12 LEU 3 59.615 6.434 2.291 14 HD13 LEU 3 HD13 LEU 3 60.081 4.878 1.578 15 HD21 LEU 3 HD21 LEU 3 61.958 3.642 4.482 16 HD22 LEU 3 HD22 LEU 3 62.691 4.482 3.117 17 HD23 LEU 3 HD23 LEU 3 61.411 3.283 2.844 18 H LYS 4 H LYS 4 64.104 6.628 6.280 19 HA LYS 4 HA LYS 4 63.337 8.785 8.101 20 HB2 LYS 4 HB2 LYS 4 66.130 7.952 7.297 21 HB3 LYS 4 HB3 LYS 4 65.654 8.833 8.747 22 HG2 LYS 4 HG2 LYS 4 65.469 5.929 8.076 23 HG3 LYS 4 HG3 LYS 4 66.279 6.671 9.437 24 HD2 LYS 4 HD2 LYS 4 63.883 7.395 10.103 25 HD3 LYS 4 HD3 LYS 4 63.401 6.169 8.958 26 HE2 LYS 4 HE2 LYS 4 64.990 4.580 10.133 27 HE3 LYS 4 HE3 LYS 4 65.094 5.791 11.375 28 HZ1 LYS 4 HZ1 LYS 4 63.498 4.377 12.163 29 HZ2 LYS 4 HZ2 LYS 4 62.803 4.097 10.710 30 HZ3 LYS 4 HZ3 LYS 4 62.534 5.600 11.502 31 H ASN 5 H ASN 5 65.425 10.582 7.500 32 HA ASN 5 HA ASN 5 64.984 11.050 4.642 33 HB2 ASN 5 HB2 ASN 5 65.401 13.148 6.781 34 HB3 ASN 5 HB3 ASN 5 65.534 13.466 5.053 35 HD21 ASN 5 HD21 ASN 5 63.349 11.707 4.297 36 HD22 ASN 5 HD22 ASN 5 61.892 12.453 4.785 37 H SER 6 H SER 6 67.361 10.610 7.070 38 HA SER 6 HA SER 6 69.325 10.729 4.937 39 HB2 SER 6 HB2 SER 6 70.981 11.733 6.477 40 HB3 SER 6 HB3 SER 6 69.611 12.813 6.199 41 HG SER 6 HG SER 6 68.770 12.012 8.217 42 H ILE 7 H ILE 7 71.395 9.563 5.643 43 HA ILE 7 HA ILE 7 70.726 6.893 6.274 44 HB ILE 7 HB ILE 7 72.686 7.744 4.844 45 HG12 ILE 7 HG12 ILE 7 74.257 5.859 5.561 46 HG13 ILE 7 HG13 ILE 7 73.180 5.607 6.936 47 HG21 ILE 7 HG21 ILE 7 73.619 9.375 6.370 48 HG22 ILE 7 HG22 ILE 7 74.832 8.167 5.966 49 HG23 ILE 7 HG23 ILE 7 74.018 8.107 7.524 50 HD11 ILE 7 HD11 ILE 7 72.772 4.050 5.144 51 HD12 ILE 7 HD12 ILE 7 72.483 5.384 4.034 52 HD13 ILE 7 HD13 ILE 7 71.365 5.096 5.377 53 H SER 8 H SER 8 71.192 9.536 8.301 54 HA SER 8 HA SER 8 72.785 8.283 10.305 55 HB2 SER 8 HB2 SER 8 72.937 10.717 9.752 56 HB3 SER 8 HB3 SER 8 71.332 10.931 10.437 57 HG SER 8 HG SER 8 73.564 9.874 11.805 58 H ASP 9 H ASP 9 69.388 8.496 9.665 59 HA ASP 9 HA ASP 9 68.952 7.688 12.445 60 HB2 ASP 9 HB2 ASP 9 67.447 9.562 11.358 61 HB3 ASP 9 HB3 ASP 9 66.741 8.237 10.515 62 H TYR 10 H TYR 10 69.809 6.244 9.851 63 HA TYR 10 HA TYR 10 67.762 4.188 9.839 64 HB2 TYR 10 HB2 TYR 10 69.980 4.861 7.952 65 HB3 TYR 10 HB3 TYR 10 69.452 3.190 8.046 66 HD1 TYR 10 HD1 TYR 10 67.081 2.632 7.518 67 HD2 TYR 10 HD2 TYR 10 68.692 6.488 6.747 68 HE1 TYR 10 HE1 TYR 10 65.221 3.080 5.973 69 HE2 TYR 10 HE2 TYR 10 66.821 6.953 5.197 70 HH TYR 10 HH TYR 10 65.133 5.799 3.911 71 H THR 11 H THR 11 67.962 2.506 11.135 72 HA THR 11 HA THR 11 70.543 1.775 12.191 73 HB THR 11 HB THR 11 69.285 -0.075 13.272 74 HG1 THR 11 HG1 THR 11 66.874 0.065 12.872 75 HG21 THR 11 HG21 THR 11 67.632 1.167 14.599 76 HG22 THR 11 HG22 THR 11 67.736 2.505 13.451 77 HG23 THR 11 HG23 THR 11 69.142 2.056 14.419 78 H GLU 12 H GLU 12 71.203 -0.643 11.628 79 HA GLU 12 HA GLU 12 71.141 -0.813 8.859 80 HB2 GLU 12 HB2 GLU 12 71.942 -3.270 9.227 81 HB3 GLU 12 HB3 GLU 12 72.993 -1.927 9.624 82 HG2 GLU 12 HG2 GLU 12 73.069 -3.731 11.243 83 HG3 GLU 12 HG3 GLU 12 72.520 -2.225 11.993 84 H ALA 13 H ALA 13 69.124 -2.439 11.195 85 HA ALA 13 HA ALA 13 67.780 -3.968 9.317 86 HB1 ALA 13 HB1 ALA 13 67.711 -4.482 11.698 87 HB2 ALA 13 HB2 ALA 13 66.079 -4.367 11.039 88 HB3 ALA 13 HB3 ALA 13 66.742 -3.039 11.994 89 H GLU 14 H GLU 14 67.049 -0.674 10.569 90 HA GLU 14 HA GLU 14 64.575 -0.286 9.277 91 HB2 GLU 14 HB2 GLU 14 66.747 1.583 10.123 92 HB3 GLU 14 HB3 GLU 14 65.458 2.226 9.131 93 HG2 GLU 14 HG2 GLU 14 65.166 0.878 11.805 94 HG3 GLU 14 HG3 GLU 14 65.040 2.609 11.486 95 H PHE 15 H PHE 15 67.836 0.009 8.183 96 HA PHE 15 HA PHE 15 67.104 1.082 5.674 97 HB2 PHE 15 HB2 PHE 15 69.307 1.396 6.882 98 HB3 PHE 15 HB3 PHE 15 69.702 -0.240 6.381 99 HD1 PHE 15 HD1 PHE 15 68.397 2.903 4.858 100 HD2 PHE 15 HD2 PHE 15 70.981 -0.438 4.521 101 HE1 PHE 15 HE1 PHE 15 69.288 3.793 2.734 102 HE2 PHE 15 HE2 PHE 15 71.853 0.441 2.409 103 HZ PHE 15 HZ PHE 15 71.000 2.559 1.530 104 H VAL 16 H VAL 16 67.983 -2.174 6.882 105 HA VAL 16 HA VAL 16 67.887 -3.348 4.342 106 HB VAL 16 HB VAL 16 67.855 -5.491 5.253 107 HG11 VAL 16 HG11 VAL 16 69.855 -4.534 5.515 108 HG12 VAL 16 HG12 VAL 16 69.570 -5.557 6.935 109 HG13 VAL 16 HG13 VAL 16 69.442 -3.793 7.058 110 HG21 VAL 16 HG21 VAL 16 67.447 -5.995 7.633 111 HG22 VAL 16 HG22 VAL 16 66.076 -5.542 6.614 112 HG23 VAL 16 HG23 VAL 16 66.734 -4.352 7.749 113 H GLN 17 H GLN 17 65.297 -2.631 6.616 114 HA GLN 17 HA GLN 17 63.314 -4.097 5.382 115 HB2 GLN 17 HB2 GLN 17 63.119 -3.131 7.599 116 HB3 GLN 17 HB3 GLN 17 63.322 -1.518 6.952 117 HG2 GLN 17 HG2 GLN 17 61.051 -2.007 7.580 118 HG3 GLN 17 HG3 GLN 17 61.254 -1.642 5.856 119 HE21 GLN 17 HE21 GLN 17 60.819 -3.194 4.371 120 HE22 GLN 17 HE22 GLN 17 60.070 -4.701 4.705 121 H LEU 18 H LEU 18 64.539 -0.831 4.854 122 HA LEU 18 HA LEU 18 62.841 -0.106 2.725 123 HB2 LEU 18 HB2 LEU 18 64.122 1.508 3.772 124 HB3 LEU 18 HB3 LEU 18 65.628 0.778 3.527 125 HG LEU 18 HG LEU 18 65.291 1.111 1.003 126 HD11 LEU 18 HD11 LEU 18 63.119 2.924 1.895 127 HD12 LEU 18 HD12 LEU 18 62.954 1.445 0.943 128 HD13 LEU 18 HD13 LEU 18 63.815 2.839 0.279 129 HD21 LEU 18 HD21 LEU 18 65.517 3.551 2.737 130 HD22 LEU 18 HD22 LEU 18 65.993 3.416 1.036 131 HD23 LEU 18 HD23 LEU 18 66.827 2.458 2.262 132 H LEU 19 H LEU 19 65.939 -1.559 2.835 133 HA LEU 19 HA LEU 19 66.611 -1.898 0.139 134 HB2 LEU 19 HB2 LEU 19 67.112 -3.356 2.568 135 HB3 LEU 19 HB3 LEU 19 67.985 -3.806 1.072 136 HG LEU 19 HG LEU 19 68.100 -1.326 2.773 137 HD11 LEU 19 HD11 LEU 19 70.480 -1.691 2.594 138 HD12 LEU 19 HD12 LEU 19 70.135 -3.220 1.763 139 HD13 LEU 19 HD13 LEU 19 69.599 -2.969 3.424 140 HD21 LEU 19 HD21 LEU 19 69.562 -0.328 1.105 141 HD22 LEU 19 HD22 LEU 19 67.871 -0.444 0.639 142 HD23 LEU 19 HD23 LEU 19 69.060 -1.581 -0.047 143 H LYS 20 H LYS 20 64.829 -4.083 2.259 144 HA LYS 20 HA LYS 20 64.406 -6.165 0.390 145 HB2 LYS 20 HB2 LYS 20 62.768 -5.310 2.783 146 HB3 LYS 20 HB3 LYS 20 62.516 -6.798 1.894 147 HG2 LYS 20 HG2 LYS 20 64.744 -7.572 2.551 148 HG3 LYS 20 HG3 LYS 20 65.020 -6.053 3.373 149 HD2 LYS 20 HD2 LYS 20 63.175 -6.446 4.908 150 HD3 LYS 20 HD3 LYS 20 62.796 -7.958 4.095 151 HE2 LYS 20 HE2 LYS 20 65.446 -7.406 5.439 152 HE3 LYS 20 HE3 LYS 20 64.088 -8.153 6.267 153 HZ1 LYS 20 HZ1 LYS 20 64.208 -10.025 4.810 154 HZ2 LYS 20 HZ2 LYS 20 65.752 -9.742 5.391 155 HZ3 LYS 20 HZ3 LYS 20 65.350 -9.296 3.819 156 H GLU 21 H GLU 21 62.560 -3.307 1.274 157 HA GLU 21 HA GLU 21 60.346 -3.764 -0.388 158 HB2 GLU 21 HB2 GLU 21 61.432 -1.198 0.775 159 HB3 GLU 21 HB3 GLU 21 59.878 -1.344 -0.034 160 HG2 GLU 21 HG2 GLU 21 59.081 -2.855 1.672 161 HG3 GLU 21 HG3 GLU 21 60.666 -2.856 2.444 162 H ILE 22 H ILE 22 63.393 -2.028 -0.881 163 HA ILE 22 HA ILE 22 62.802 -0.931 -3.376 164 HB ILE 22 HB ILE 22 65.536 -1.949 -2.528 165 HG12 ILE 22 HG12 ILE 22 64.263 0.760 -2.144 166 HG13 ILE 22 HG13 ILE 22 64.606 -0.392 -0.866 167 HG21 ILE 22 HG21 ILE 22 65.299 -1.439 -4.913 168 HG22 ILE 22 HG22 ILE 22 66.347 -0.278 -4.089 169 HG23 ILE 22 HG23 ILE 22 64.694 0.171 -4.507 170 HD11 ILE 22 HD11 ILE 22 66.271 1.378 -0.900 171 HD12 ILE 22 HD12 ILE 22 66.650 1.005 -2.580 172 HD13 ILE 22 HD13 ILE 22 67.008 -0.171 -1.320 173 H GLU 23 H GLU 23 64.201 -4.087 -2.558 174 HA GLU 23 HA GLU 23 64.634 -5.093 -5.133 175 HB2 GLU 23 HB2 GLU 23 63.685 -6.453 -2.674 176 HB3 GLU 23 HB3 GLU 23 64.146 -7.341 -4.095 177 HG2 GLU 23 HG2 GLU 23 66.459 -6.204 -3.720 178 HG3 GLU 23 HG3 GLU 23 65.775 -5.773 -2.146 179 H LYS 24 H LYS 24 61.850 -5.091 -3.072 180 HA LYS 24 HA LYS 24 60.254 -6.880 -4.444 181 HB2 LYS 24 HB2 LYS 24 59.867 -6.403 -2.198 182 HB3 LYS 24 HB3 LYS 24 59.652 -4.690 -2.492 183 HG2 LYS 24 HG2 LYS 24 57.504 -5.711 -2.033 184 HG3 LYS 24 HG3 LYS 24 57.571 -5.169 -3.706 185 HD2 LYS 24 HD2 LYS 24 58.117 -7.509 -4.374 186 HD3 LYS 24 HD3 LYS 24 57.867 -7.998 -2.693 187 HE2 LYS 24 HE2 LYS 24 55.851 -8.411 -3.949 188 HE3 LYS 24 HE3 LYS 24 55.574 -7.091 -2.813 189 HZ1 LYS 24 HZ1 LYS 24 56.053 -6.856 -5.731 190 HZ2 LYS 24 HZ2 LYS 24 55.982 -5.521 -4.727 191 HZ3 LYS 24 HZ3 LYS 24 54.628 -6.506 -4.924 192 H GLU 25 H GLU 25 60.101 -3.225 -4.646 193 HA GLU 25 HA GLU 25 58.305 -3.656 -6.797 194 HB2 GLU 25 HB2 GLU 25 59.330 -1.027 -5.674 195 HB3 GLU 25 HB3 GLU 25 58.127 -1.278 -6.910 196 HG2 GLU 25 HG2 GLU 25 57.867 -2.003 -3.997 197 HG3 GLU 25 HG3 GLU 25 57.028 -0.838 -4.937 198 H ASN 26 H ASN 26 61.572 -3.678 -6.559 199 HA ASN 26 HA ASN 26 62.161 -2.541 -9.141 200 HB2 ASN 26 HB2 ASN 26 63.931 -2.647 -7.427 201 HB3 ASN 26 HB3 ASN 26 63.811 -4.404 -7.405 202 HD21 ASN 26 HD21 ASN 26 65.872 -4.812 -8.054 203 HD22 ASN 26 HD22 ASN 26 66.452 -4.476 -9.638 204 H VAL 27 H VAL 27 61.779 -5.783 -7.777 205 HA VAL 27 HA VAL 27 62.179 -7.107 -10.251 206 HB VAL 27 HB VAL 27 61.333 -9.159 -9.152 207 HG11 VAL 27 HG11 VAL 27 63.031 -9.309 -7.381 208 HG12 VAL 27 HG12 VAL 27 63.264 -7.562 -7.488 209 HG13 VAL 27 HG13 VAL 27 63.646 -8.591 -8.868 210 HG21 VAL 27 HG21 VAL 27 60.778 -7.363 -6.786 211 HG22 VAL 27 HG22 VAL 27 60.701 -9.123 -6.768 212 HG23 VAL 27 HG23 VAL 27 59.570 -8.198 -7.759 213 H ALA 28 H ALA 28 59.344 -5.866 -8.648 214 HA ALA 28 HA ALA 28 57.513 -6.948 -10.590 215 HB1 ALA 28 HB1 ALA 28 55.839 -5.559 -9.444 216 HB2 ALA 28 HB2 ALA 28 57.124 -4.774 -8.526 217 HB3 ALA 28 HB3 ALA 28 56.794 -6.488 -8.287 218 H ALA 29 H ALA 29 59.569 -4.297 -10.306 219 HA ALA 29 HA ALA 29 60.085 -2.503 -11.433 220 HB1 ALA 29 HB1 ALA 29 58.715 -3.772 -13.793 221 HB2 ALA 29 HB2 ALA 29 60.380 -4.091 -13.280 222 HB3 ALA 29 HB3 ALA 29 59.915 -2.476 -13.824 223 H THR 30 H THR 30 58.805 -1.249 -10.108 224 HA THR 30 HA THR 30 56.478 -0.125 -11.467 225 HB THR 30 HB THR 30 55.951 0.896 -9.250 226 HG1 THR 30 HG1 THR 30 57.196 0.125 -7.475 227 HG21 THR 30 HG21 THR 30 56.540 -2.040 -9.098 228 HG22 THR 30 HG22 THR 30 55.064 -1.319 -9.757 229 HG23 THR 30 HG23 THR 30 55.450 -1.154 -8.033 230 H ASP 31 H ASP 31 56.535 2.371 -10.461 231 HA ASP 31 HA ASP 31 59.237 3.356 -10.802 232 HB2 ASP 31 HB2 ASP 31 58.726 4.986 -12.440 233 HB3 ASP 31 HB3 ASP 31 58.103 3.464 -13.050 234 H ASP 32 H ASP 32 56.076 3.731 -9.476 235 HA ASP 32 HA ASP 32 56.512 6.387 -8.580 236 HB2 ASP 32 HB2 ASP 32 54.561 4.347 -7.461 237 HB3 ASP 32 HB3 ASP 32 54.600 6.045 -7.026 238 H VAL 33 H VAL 33 56.636 3.373 -6.738 239 HA VAL 33 HA VAL 33 57.906 4.928 -4.645 240 HB VAL 33 HB VAL 33 56.346 2.729 -4.337 241 HG11 VAL 33 HG11 VAL 33 58.992 1.477 -4.473 242 HG12 VAL 33 HG12 VAL 33 57.593 1.192 -5.508 243 HG13 VAL 33 HG13 VAL 33 57.531 0.774 -3.788 244 HG21 VAL 33 HG21 VAL 33 57.255 2.417 -2.102 245 HG22 VAL 33 HG22 VAL 33 57.117 4.132 -2.501 246 HG23 VAL 33 HG23 VAL 33 58.690 3.335 -2.561 247 H LEU 34 H LEU 34 58.680 2.825 -7.191 248 HA LEU 34 HA LEU 34 61.247 1.926 -6.479 249 HB2 LEU 34 HB2 LEU 34 59.615 1.151 -8.304 250 HB3 LEU 34 HB3 LEU 34 60.174 2.509 -9.197 251 HG LEU 34 HG LEU 34 61.149 0.225 -9.760 252 HD11 LEU 34 HD11 LEU 34 61.822 2.228 -10.763 253 HD12 LEU 34 HD12 LEU 34 63.225 1.206 -10.436 254 HD13 LEU 34 HD13 LEU 34 62.886 2.612 -9.408 255 HD21 LEU 34 HD21 LEU 34 62.900 0.939 -7.411 256 HD22 LEU 34 HD22 LEU 34 63.199 -0.355 -8.570 257 HD23 LEU 34 HD23 LEU 34 61.800 -0.436 -7.500 258 H ASP 35 H ASP 35 60.226 4.857 -8.343 259 HA ASP 35 HA ASP 35 62.930 5.590 -8.609 260 HB2 ASP 35 HB2 ASP 35 60.335 6.877 -9.196 261 HB3 ASP 35 HB3 ASP 35 61.720 7.927 -8.992 262 H VAL 36 H VAL 36 60.594 6.172 -6.173 263 HA VAL 36 HA VAL 36 61.983 8.247 -4.812 264 HB VAL 36 HB VAL 36 60.540 5.980 -3.487 265 HG11 VAL 36 HG11 VAL 36 61.021 8.827 -2.732 266 HG12 VAL 36 HG12 VAL 36 61.867 7.406 -2.122 267 HG13 VAL 36 HG13 VAL 36 60.139 7.640 -1.734 268 HG21 VAL 36 HG21 VAL 36 58.619 7.273 -3.486 269 HG22 VAL 36 HG22 VAL 36 59.155 6.833 -5.126 270 HG23 VAL 36 HG23 VAL 36 59.381 8.513 -4.519 271 H LEU 37 H LEU 37 61.949 4.770 -4.555 272 HA LEU 37 HA LEU 37 63.570 4.693 -2.266 273 HB2 LEU 37 HB2 LEU 37 63.276 2.423 -4.184 274 HB3 LEU 37 HB3 LEU 37 63.675 2.493 -2.482 275 HG LEU 37 HG LEU 37 60.931 3.143 -3.508 276 HD11 LEU 37 HD11 LEU 37 61.909 0.684 -2.092 277 HD12 LEU 37 HD12 LEU 37 61.376 0.795 -3.770 278 HD13 LEU 37 HD13 LEU 37 60.226 1.064 -2.459 279 HD21 LEU 37 HD21 LEU 37 60.293 3.119 -1.139 280 HD22 LEU 37 HD22 LEU 37 61.496 4.362 -1.468 281 HD23 LEU 37 HD23 LEU 37 61.975 2.851 -0.690 282 H LEU 38 H LEU 38 64.175 4.217 -5.631 283 HA LEU 38 HA LEU 38 66.838 3.450 -5.410 284 HB2 LEU 38 HB2 LEU 38 65.233 4.771 -7.510 285 HB3 LEU 38 HB3 LEU 38 66.894 4.320 -7.867 286 HG LEU 38 HG LEU 38 64.402 2.717 -7.520 287 HD11 LEU 38 HD11 LEU 38 65.200 1.610 -9.501 288 HD12 LEU 38 HD12 LEU 38 66.689 2.544 -9.382 289 HD13 LEU 38 HD13 LEU 38 65.161 3.374 -9.710 290 HD21 LEU 38 HD21 LEU 38 65.888 1.649 -5.919 291 HD22 LEU 38 HD22 LEU 38 67.157 1.543 -7.140 292 HD23 LEU 38 HD23 LEU 38 65.665 0.628 -7.336 293 H GLU 39 H GLU 39 65.435 6.668 -5.821 294 HA GLU 39 HA GLU 39 67.969 7.956 -5.775 295 HB2 GLU 39 HB2 GLU 39 65.182 8.890 -5.349 296 HB3 GLU 39 HB3 GLU 39 66.572 9.931 -5.113 297 HG2 GLU 39 HG2 GLU 39 65.662 8.595 -7.654 298 HG3 GLU 39 HG3 GLU 39 65.651 10.313 -7.234 299 H HIS 40 H HIS 40 65.520 7.297 -3.368 300 HA HIS 40 HA HIS 40 66.514 8.885 -1.335 301 HB2 HIS 40 HB2 HIS 40 64.293 7.854 -1.356 302 HB3 HIS 40 HB3 HIS 40 64.961 6.277 -1.136 303 HD1 HIS 40 HD1 HIS 40 63.770 9.179 0.766 304 HD2 HIS 40 HD2 HIS 40 66.220 5.903 1.460 305 HE1 HIS 40 HE1 HIS 40 63.998 8.986 3.253 306 H PHE 41 H PHE 41 67.062 5.558 -2.136 307 HA PHE 41 HA PHE 41 68.789 4.853 -0.094 308 HB2 PHE 41 HB2 PHE 41 67.759 3.194 -1.352 309 HB3 PHE 41 HB3 PHE 41 68.250 3.915 -2.871 310 HD1 PHE 41 HD1 PHE 41 69.476 2.163 0.131 311 HD2 PHE 41 HD2 PHE 41 70.193 3.153 -3.919 312 HE1 PHE 41 HE1 PHE 41 71.403 0.621 0.101 313 HE2 PHE 41 HE2 PHE 41 72.103 1.645 -3.952 314 HZ PHE 41 HZ PHE 41 72.720 0.369 -1.958 315 H VAL 42 H VAL 42 69.551 5.925 -3.415 316 HA VAL 42 HA VAL 42 72.330 5.953 -2.883 317 HB VAL 42 HB VAL 42 71.488 5.580 -5.137 318 HG11 VAL 42 HG11 VAL 42 70.806 7.282 -6.549 319 HG12 VAL 42 HG12 VAL 42 70.588 8.367 -5.133 320 HG13 VAL 42 HG13 VAL 42 69.677 6.829 -5.276 321 HG21 VAL 42 HG21 VAL 42 73.035 6.994 -6.402 322 HG22 VAL 42 HG22 VAL 42 73.776 6.338 -4.942 323 HG23 VAL 42 HG23 VAL 42 73.234 8.011 -4.980 324 H LYS 43 H LYS 43 69.976 8.412 -2.585 325 HA LYS 43 HA LYS 43 71.908 10.536 -2.327 326 HB2 LYS 43 HB2 LYS 43 70.137 11.983 -1.846 327 HB3 LYS 43 HB3 LYS 43 69.317 10.730 -2.760 328 HG2 LYS 43 HG2 LYS 43 68.657 9.690 -0.483 329 HG3 LYS 43 HG3 LYS 43 69.330 11.138 0.214 330 HD2 LYS 43 HD2 LYS 43 67.773 12.503 -1.159 331 HD3 LYS 43 HD3 LYS 43 66.989 11.007 -1.662 332 HE2 LYS 43 HE2 LYS 43 65.726 11.878 0.191 333 HE3 LYS 43 HE3 LYS 43 66.625 10.484 0.779 334 HZ1 LYS 43 HZ1 LYS 43 68.313 12.094 1.660 335 HZ2 LYS 43 HZ2 LYS 43 66.812 12.236 2.365 336 HZ3 LYS 43 HZ3 LYS 43 67.282 13.345 1.209 337 H ILE 44 H ILE 44 70.562 8.330 0.033 338 HA ILE 44 HA ILE 44 71.792 9.918 2.126 339 HB ILE 44 HB ILE 44 70.839 8.265 3.722 340 HG12 ILE 44 HG12 ILE 44 69.641 7.057 1.221 341 HG13 ILE 44 HG13 ILE 44 70.839 6.287 2.247 342 HG21 ILE 44 HG21 ILE 44 68.529 8.968 3.417 343 HG22 ILE 44 HG22 ILE 44 68.861 9.360 1.735 344 HG23 ILE 44 HG23 ILE 44 69.624 10.298 3.014 345 HD11 ILE 44 HD11 ILE 44 68.509 5.493 2.558 346 HD12 ILE 44 HD12 ILE 44 68.099 7.095 3.158 347 HD13 ILE 44 HD13 ILE 44 69.268 6.101 4.028 348 H THR 45 H THR 45 72.402 7.016 0.388 349 HA THR 45 HA THR 45 74.545 6.248 2.152 350 HB THR 45 HB THR 45 74.963 4.495 0.515 351 HG1 THR 45 HG1 THR 45 72.661 5.194 -0.929 352 HG21 THR 45 HG21 THR 45 72.025 4.814 1.108 353 HG22 THR 45 HG22 THR 45 73.224 4.209 2.241 354 HG23 THR 45 HG23 THR 45 72.860 3.296 0.769 355 H GLU 46 H GLU 46 74.026 7.748 -0.924 356 HA GLU 46 HA GLU 46 75.118 9.019 -2.269 357 HB2 GLU 46 HB2 GLU 46 76.995 9.227 -0.000 358 HB3 GLU 46 HB3 GLU 46 77.188 10.203 -1.476 359 HG2 GLU 46 HG2 GLU 46 74.877 11.042 -0.978 360 HG3 GLU 46 HG3 GLU 46 74.979 10.174 0.543 361 H HIS 47 H HIS 47 75.590 6.171 -2.035 362 HA HIS 47 HA HIS 47 78.231 5.688 -2.955 363 HB2 HIS 47 HB2 HIS 47 76.716 3.953 -1.885 364 HB3 HIS 47 HB3 HIS 47 75.777 3.943 -3.375 365 HD1 HIS 47 HD1 HIS 47 76.698 2.456 -5.292 366 HD2 HIS 47 HD2 HIS 47 79.318 2.924 -2.121 367 HE1 HIS 47 HE1 HIS 47 78.694 1.006 -5.789 368 HA PRO 48 HA PRO 48 77.567 7.487 -7.023 369 HB2 PRO 48 HB2 PRO 48 79.542 5.503 -7.907 370 HB3 PRO 48 HB3 PRO 48 79.610 7.265 -8.053 371 HG2 PRO 48 HG2 PRO 48 81.072 5.831 -6.439 372 HG3 PRO 48 HG3 PRO 48 80.444 7.400 -5.821 373 HD2 PRO 48 HD2 PRO 48 79.572 4.576 -5.362 374 HD3 PRO 48 HD3 PRO 48 79.672 5.889 -4.185 375 H ASP 49 H ASP 49 77.375 4.187 -6.417 376 HA ASP 49 HA ASP 49 76.285 3.736 -8.986 377 HB2 ASP 49 HB2 ASP 49 78.059 1.859 -7.400 378 HB3 ASP 49 HB3 ASP 49 77.215 1.371 -8.858 379 H GLY 50 H GLY 50 75.065 4.604 -6.666 380 HA2 GLY 50 HA2 GLY 50 73.985 2.958 -4.656 381 HA3 GLY 50 HA3 GLY 50 73.203 4.299 -5.433 382 H THR 51 H THR 51 72.674 3.597 -7.713 383 HA THR 51 HA THR 51 70.516 1.846 -7.021 384 HB THR 51 HB THR 51 70.851 2.544 -9.887 385 HG1 THR 51 HG1 THR 51 69.844 4.661 -9.088 386 HG21 THR 51 HG21 THR 51 68.584 2.797 -7.905 387 HG22 THR 51 HG22 THR 51 68.923 1.369 -8.834 388 HG23 THR 51 HG23 THR 51 68.500 2.883 -9.666 389 H ALA 52 H ALA 52 73.438 1.590 -8.897 390 HA ALA 52 HA ALA 52 72.959 -0.956 -10.056 391 HB1 ALA 52 HB1 ALA 52 75.594 0.313 -9.354 392 HB2 ALA 52 HB2 ALA 52 74.710 0.614 -10.850 393 HB3 ALA 52 HB3 ALA 52 75.333 -1.001 -10.500 394 H LEU 53 H LEU 53 74.088 0.032 -6.921 395 HA LEU 53 HA LEU 53 74.925 -2.505 -6.080 396 HB2 LEU 53 HB2 LEU 53 73.739 -0.304 -4.447 397 HB3 LEU 53 HB3 LEU 53 74.284 -1.813 -3.752 398 HG LEU 53 HG LEU 53 75.933 0.314 -5.074 399 HD11 LEU 53 HD11 LEU 53 77.024 0.343 -2.927 400 HD12 LEU 53 HD12 LEU 53 75.901 -0.892 -2.340 401 HD13 LEU 53 HD13 LEU 53 75.303 0.701 -2.818 402 HD21 LEU 53 HD21 LEU 53 76.748 -2.455 -4.207 403 HD22 LEU 53 HD22 LEU 53 77.859 -1.143 -4.589 404 HD23 LEU 53 HD23 LEU 53 76.817 -1.801 -5.848 405 H ILE 54 H ILE 54 71.745 -1.130 -6.068 406 HA ILE 54 HA ILE 54 70.547 -3.354 -4.659 407 HB ILE 54 HB ILE 54 69.196 -1.405 -6.573 408 HG12 ILE 54 HG12 ILE 54 68.622 -1.338 -3.708 409 HG13 ILE 54 HG13 ILE 54 70.240 -0.800 -4.075 410 HG21 ILE 54 HG21 ILE 54 67.938 -3.335 -4.638 411 HG22 ILE 54 HG22 ILE 54 67.942 -3.481 -6.393 412 HG23 ILE 54 HG23 ILE 54 67.092 -2.141 -5.626 413 HD11 ILE 54 HD11 ILE 54 68.610 1.021 -3.980 414 HD12 ILE 54 HD12 ILE 54 67.711 0.276 -5.324 415 HD13 ILE 54 HD13 ILE 54 69.341 0.872 -5.569 416 H TYR 55 H TYR 55 71.013 -2.473 -7.956 417 HA TYR 55 HA TYR 55 69.697 -4.632 -9.103 418 HB2 TYR 55 HB2 TYR 55 71.647 -2.629 -10.080 419 HB3 TYR 55 HB3 TYR 55 71.225 -3.972 -11.121 420 HD1 TYR 55 HD1 TYR 55 68.687 -4.359 -11.482 421 HD2 TYR 55 HD2 TYR 55 70.289 -0.725 -10.007 422 HE1 TYR 55 HE1 TYR 55 66.610 -3.210 -12.082 423 HE2 TYR 55 HE2 TYR 55 68.221 0.446 -10.594 424 HH TYR 55 HH TYR 55 65.388 -1.253 -11.432 425 H GLU 56 H GLU 56 73.173 -4.234 -8.348 426 HA GLU 56 HA GLU 56 73.740 -6.838 -9.288 427 HB2 GLU 56 HB2 GLU 56 75.878 -6.683 -8.003 428 HB3 GLU 56 HB3 GLU 56 75.633 -5.380 -9.155 429 HG2 GLU 56 HG2 GLU 56 75.347 -3.832 -7.557 430 HG3 GLU 56 HG3 GLU 56 74.840 -4.942 -6.305 431 H ALA 57 H ALA 57 72.846 -5.566 -6.117 432 HA ALA 57 HA ALA 57 73.333 -7.877 -4.633 433 HB1 ALA 57 HB1 ALA 57 71.802 -6.989 -2.975 434 HB2 ALA 57 HB2 ALA 57 71.142 -5.863 -4.160 435 HB3 ALA 57 HB3 ALA 57 72.812 -5.695 -3.621 436 H ALA 58 H ALA 58 70.503 -6.916 -6.478 437 HA ALA 58 HA ALA 58 68.846 -9.065 -5.801 438 HB1 ALA 58 HB1 ALA 58 67.607 -8.534 -7.846 439 HB2 ALA 58 HB2 ALA 58 68.951 -7.534 -8.404 440 HB3 ALA 58 HB3 ALA 58 68.039 -7.064 -6.970 441 H ALA 59 H ALA 59 71.110 -8.688 -8.510 442 HA ALA 59 HA ALA 59 70.704 -11.274 -9.589 443 HB1 ALA 59 HB1 ALA 59 73.122 -9.478 -9.856 444 HB2 ALA 59 HB2 ALA 59 71.689 -9.428 -10.884 445 HB3 ALA 59 HB3 ALA 59 72.731 -10.850 -10.895 446 H ARG 60 H ARG 60 73.014 -9.972 -7.307 447 HA ARG 60 HA ARG 60 74.594 -12.265 -6.948 448 HB2 ARG 60 HB2 ARG 60 74.049 -9.912 -5.151 449 HB3 ARG 60 HB3 ARG 60 75.152 -11.198 -4.693 450 HG2 ARG 60 HG2 ARG 60 76.621 -10.674 -6.503 451 HG3 ARG 60 HG3 ARG 60 75.441 -9.574 -7.210 452 HD2 ARG 60 HD2 ARG 60 77.220 -8.360 -6.053 453 HD3 ARG 60 HD3 ARG 60 75.653 -8.078 -5.306 454 HE ARG 60 HE ARG 60 76.974 -10.210 -4.049 455 HH11 ARG 60 HH11 ARG 60 77.271 -6.661 -4.363 456 HH12 ARG 60 HH12 ARG 60 77.924 -6.425 -2.811 457 HH21 ARG 60 HH21 ARG 60 77.861 -9.861 -1.846 458 HH22 ARG 60 HH22 ARG 60 78.185 -8.267 -1.348 459 H ALA 61 H ALA 61 71.558 -11.280 -5.484 460 HA ALA 61 HA ALA 61 71.558 -13.434 -3.582 461 HB1 ALA 61 HB1 ALA 61 69.300 -11.654 -4.491 462 HB2 ALA 61 HB2 ALA 61 70.375 -11.369 -3.118 463 HB3 ALA 61 HB3 ALA 61 69.274 -12.743 -3.101 464 H ALA 62 H ALA 62 70.394 -12.896 -6.801 465 HA ALA 62 HA ALA 62 68.670 -15.131 -6.990 466 HB1 ALA 62 HB1 ALA 62 70.175 -13.654 -9.149 467 HB2 ALA 62 HB2 ALA 62 68.568 -13.247 -8.551 468 HB3 ALA 62 HB3 ALA 62 68.833 -14.760 -9.422 469 H ALA 63 H ALA 63 72.052 -14.609 -7.739 470 HA ALA 63 HA ALA 63 72.562 -17.339 -8.444 471 HB1 ALA 63 HB1 ALA 63 73.985 -15.519 -9.264 472 HB2 ALA 63 HB2 ALA 63 74.940 -16.658 -8.313 473 HB3 ALA 63 HB3 ALA 63 74.446 -15.118 -7.611 474 H ASN 64 H ASN 64 73.476 -15.287 -5.737 475 HA ASN 64 HA ASN 64 73.940 -15.531 -3.630 476 HB2 ASN 64 HB2 ASN 64 71.551 -16.172 -3.551 477 HB3 ASN 64 HB3 ASN 64 72.041 -17.860 -3.663 478 HD21 ASN 64 HD21 ASN 64 73.619 -15.266 -1.769 479 HD22 ASN 64 HD22 ASN 64 73.302 -16.017 -0.254 480 HA PRO 65 HA PRO 65 77.212 -18.683 -4.061 481 HB2 PRO 65 HB2 PRO 65 78.622 -16.592 -2.503 482 HB3 PRO 65 HB3 PRO 65 79.138 -17.416 -3.976 483 HG2 PRO 65 HG2 PRO 65 78.369 -14.859 -4.039 484 HG3 PRO 65 HG3 PRO 65 77.967 -15.977 -5.353 485 HD2 PRO 65 HD2 PRO 65 76.228 -14.985 -3.131 486 HD3 PRO 65 HD3 PRO 65 75.846 -15.230 -4.849 487 H GLY 66 H GLY 66 76.281 -16.602 -1.404 488 HA2 GLY 66 HA2 GLY 66 75.271 -17.857 0.529 489 HA3 GLY 66 HA3 GLY 66 76.769 -18.792 0.492 490 H GLY 67 H GLY 67 76.222 -17.642 2.776 491 HA2 GLY 67 HA2 GLY 67 77.500 -16.514 4.332 492 HA3 GLY 67 HA3 GLY 67 78.505 -15.984 2.978 493 H ASP 68 H ASP 68 78.190 -14.036 2.081 494 HA ASP 68 HA ASP 68 75.949 -12.382 3.052 495 HB2 ASP 68 HB2 ASP 68 78.844 -11.557 2.686 496 HB3 ASP 68 HB3 ASP 68 77.527 -10.443 3.004 497 H GLY 69 H GLY 69 76.775 -14.018 0.652 498 HA2 GLY 69 HA2 GLY 69 77.266 -12.152 -1.446 499 HA3 GLY 69 HA3 GLY 69 76.944 -13.873 -1.631 500 H GLY 70 H GLY 70 75.485 -10.773 -0.996 501 HA2 GLY 70 HA2 GLY 70 73.897 -9.951 -2.628 502 HA3 GLY 70 HA3 GLY 70 73.280 -11.592 -2.757 503 H GLY 71 H GLY 71 71.355 -10.119 -2.433 504 HA2 GLY 71 HA2 GLY 71 69.467 -10.291 -1.109 505 HA3 GLY 71 HA3 GLY 71 70.453 -10.629 0.297 506 HA PRO 72 HA PRO 72 68.950 -6.117 -0.001 507 HB2 PRO 72 HB2 PRO 72 67.210 -6.288 2.107 508 HB3 PRO 72 HB3 PRO 72 66.764 -6.497 0.402 509 HG2 PRO 72 HG2 PRO 72 67.371 -8.598 2.439 510 HG3 PRO 72 HG3 PRO 72 66.020 -8.501 1.291 511 HD2 PRO 72 HD2 PRO 72 68.115 -10.031 0.747 512 HD3 PRO 72 HD3 PRO 72 67.344 -9.050 -0.519 513 H GLU 73 H GLU 73 69.509 -8.352 2.668 514 HA GLU 73 HA GLU 73 70.482 -6.289 4.304 515 HB2 GLU 73 HB2 GLU 73 70.584 -9.287 4.693 516 HB3 GLU 73 HB3 GLU 73 70.954 -8.083 5.923 517 HG2 GLU 73 HG2 GLU 73 68.743 -7.211 5.864 518 HG3 GLU 73 HG3 GLU 73 68.308 -8.230 4.507 519 H GLY 74 H GLY 74 71.810 -7.626 1.709 520 HA2 GLY 74 HA2 GLY 74 74.412 -7.067 2.824 521 HA3 GLY 74 HA3 GLY 74 74.240 -8.127 1.381 522 H ILE 75 H ILE 75 72.147 -5.646 0.968 523 HA ILE 75 HA ILE 75 73.929 -4.146 -0.729 524 HB ILE 75 HB ILE 75 71.427 -2.805 0.193 525 HG12 ILE 75 HG12 ILE 75 71.353 -5.426 -1.376 526 HG13 ILE 75 HG13 ILE 75 70.620 -5.004 0.123 527 HG21 ILE 75 HG21 ILE 75 72.839 -1.866 -1.518 528 HG22 ILE 75 HG22 ILE 75 71.264 -2.296 -2.207 529 HG23 ILE 75 HG23 ILE 75 72.673 -3.332 -2.483 530 HD11 ILE 75 HD11 ILE 75 68.984 -5.053 -1.731 531 HD12 ILE 75 HD12 ILE 75 69.789 -3.634 -2.416 532 HD13 ILE 75 HD13 ILE 75 69.037 -3.552 -0.820 533 H VAL 76 H VAL 76 72.280 -3.662 2.257 534 HA VAL 76 HA VAL 76 73.250 -1.206 3.145 535 HB VAL 76 HB VAL 76 71.464 -2.243 4.206 536 HG11 VAL 76 HG11 VAL 76 73.018 -4.650 4.503 537 HG12 VAL 76 HG12 VAL 76 71.388 -4.283 3.842 538 HG13 VAL 76 HG13 VAL 76 71.679 -4.254 5.581 539 HG21 VAL 76 HG21 VAL 76 72.759 -0.910 5.792 540 HG22 VAL 76 HG22 VAL 76 73.728 -2.329 6.190 541 HG23 VAL 76 HG23 VAL 76 72.016 -2.284 6.611 542 H LYS 77 H LYS 77 74.385 -4.325 3.541 543 HA LYS 77 HA LYS 77 76.638 -3.937 5.160 544 HB2 LYS 77 HB2 LYS 77 75.789 -6.165 4.581 545 HB3 LYS 77 HB3 LYS 77 76.332 -5.941 2.926 546 HG2 LYS 77 HG2 LYS 77 78.658 -5.693 3.871 547 HG3 LYS 77 HG3 LYS 77 77.996 -6.289 5.394 548 HD2 LYS 77 HD2 LYS 77 77.177 -8.289 4.222 549 HD3 LYS 77 HD3 LYS 77 77.922 -7.702 2.735 550 HE2 LYS 77 HE2 LYS 77 79.443 -9.234 3.641 551 HE3 LYS 77 HE3 LYS 77 80.096 -7.641 4.022 552 HZ1 LYS 77 HZ1 LYS 77 79.085 -7.889 6.268 553 HZ2 LYS 77 HZ2 LYS 77 80.253 -9.045 5.926 554 HZ3 LYS 77 HZ3 LYS 77 78.616 -9.450 5.832 555 H GLU 78 H GLU 78 76.378 -3.975 1.622 556 HA GLU 78 HA GLU 78 79.053 -3.394 0.973 557 HB2 GLU 78 HB2 GLU 78 77.055 -4.171 -0.514 558 HB3 GLU 78 HB3 GLU 78 76.680 -2.463 -0.645 559 HG2 GLU 78 HG2 GLU 78 77.928 -3.072 -2.558 560 HG3 GLU 78 HG3 GLU 78 78.995 -2.117 -1.525 561 H ILE 79 H ILE 79 76.262 -1.396 1.647 562 HA ILE 79 HA ILE 79 77.427 1.131 1.115 563 HB ILE 79 HB ILE 79 75.073 0.413 2.891 564 HG12 ILE 79 HG12 ILE 79 74.701 -0.123 0.506 565 HG13 ILE 79 HG13 ILE 79 73.689 1.219 1.030 566 HG21 ILE 79 HG21 ILE 79 74.434 2.730 2.841 567 HG22 ILE 79 HG22 ILE 79 75.925 3.134 1.989 568 HG23 ILE 79 HG23 ILE 79 75.994 2.494 3.630 569 HD11 ILE 79 HD11 ILE 79 75.354 2.747 0.010 570 HD12 ILE 79 HD12 ILE 79 74.519 1.688 -1.115 571 HD13 ILE 79 HD13 ILE 79 76.181 1.328 -0.638 572 H LYS 80 H LYS 80 77.048 -0.709 4.123 573 HA LYS 80 HA LYS 80 77.946 1.410 5.727 574 HB2 LYS 80 HB2 LYS 80 77.913 -0.088 7.581 575 HB3 LYS 80 HB3 LYS 80 76.632 -0.626 6.515 576 HG2 LYS 80 HG2 LYS 80 78.154 -2.382 5.669 577 HG3 LYS 80 HG3 LYS 80 79.312 -1.894 6.907 578 HD2 LYS 80 HD2 LYS 80 77.491 -2.259 8.604 579 HD3 LYS 80 HD3 LYS 80 76.534 -2.980 7.311 580 HE2 LYS 80 HE2 LYS 80 77.619 -4.749 8.492 581 HE3 LYS 80 HE3 LYS 80 78.398 -4.582 6.923 582 HZ1 LYS 80 HZ1 LYS 80 80.024 -4.845 8.669 583 HZ2 LYS 80 HZ2 LYS 80 79.418 -3.503 9.487 584 HZ3 LYS 80 HZ3 LYS 80 80.186 -3.298 8.009 585 H GLU 81 H GLU 81 79.622 -1.182 4.117 586 HA GLU 81 HA GLU 81 82.096 -0.596 5.323 587 HB2 GLU 81 HB2 GLU 81 81.483 -2.144 2.797 588 HB3 GLU 81 HB3 GLU 81 83.060 -2.089 3.576 589 HG2 GLU 81 HG2 GLU 81 82.117 -3.124 5.581 590 HG3 GLU 81 HG3 GLU 81 80.532 -3.171 4.820 591 H TRP 82 H TRP 82 80.526 0.454 2.360 592 HA TRP 82 HA TRP 82 82.738 1.840 1.206 593 HB2 TRP 82 HB2 TRP 82 80.497 1.181 0.086 594 HB3 TRP 82 HB3 TRP 82 79.896 2.603 0.971 595 HD1 TRP 82 HD1 TRP 82 82.416 1.775 -1.845 596 HE1 TRP 82 HE1 TRP 82 82.659 3.838 -3.337 597 HE3 TRP 82 HE3 TRP 82 79.588 5.073 0.874 598 HZ2 TRP 82 HZ2 TRP 82 81.756 6.514 -3.393 599 HZ3 TRP 82 HZ3 TRP 82 79.342 7.365 0.040 600 HH2 TRP 82 HH2 TRP 82 80.411 8.082 -2.043 601 H ARG 83 H ARG 83 79.967 2.802 3.127 602 HA ARG 83 HA ARG 83 80.280 5.586 3.141 603 HB2 ARG 83 HB2 ARG 83 78.331 3.986 4.097 604 HB3 ARG 83 HB3 ARG 83 79.423 4.109 5.496 605 HG2 ARG 83 HG2 ARG 83 77.861 5.694 5.975 606 HG3 ARG 83 HG3 ARG 83 79.310 6.465 5.308 607 HD2 ARG 83 HD2 ARG 83 78.179 6.866 3.181 608 HD3 ARG 83 HD3 ARG 83 76.755 6.008 3.766 609 HE ARG 83 HE ARG 83 77.023 7.800 5.668 610 HH11 ARG 83 HH11 ARG 83 76.842 8.335 2.142 611 HH12 ARG 83 HH12 ARG 83 76.456 9.990 2.310 612 HH21 ARG 83 HH21 ARG 83 76.488 10.040 5.829 613 HH22 ARG 83 HH22 ARG 83 76.208 10.951 4.429 614 H ALA 84 H ALA 84 81.343 3.047 5.382 615 HA ALA 84 HA ALA 84 82.593 4.714 7.259 616 HB1 ALA 84 HB1 ALA 84 83.126 1.812 6.637 617 HB2 ALA 84 HB2 ALA 84 81.874 2.415 7.721 618 HB3 ALA 84 HB3 ALA 84 83.574 2.657 8.117 619 H ALA 85 H ALA 85 83.839 2.899 4.482 620 HA ALA 85 HA ALA 85 86.539 3.585 4.840 621 HB1 ALA 85 HB1 ALA 85 86.856 2.790 2.567 622 HB2 ALA 85 HB2 ALA 85 85.115 2.844 2.292 623 HB3 ALA 85 HB3 ALA 85 85.786 1.700 3.450 624 H ASN 86 H ASN 86 83.957 5.048 2.959 625 HA ASN 86 HA ASN 86 85.498 7.030 1.671 626 HB2 ASN 86 HB2 ASN 86 83.012 6.361 1.207 627 HB3 ASN 86 HB3 ASN 86 82.641 7.467 2.519 628 HD21 ASN 86 HD21 ASN 86 83.147 9.765 2.226 629 HD22 ASN 86 HD22 ASN 86 83.315 10.356 0.630 630 H GLY 87 H GLY 87 84.037 6.815 4.809 631 HA2 GLY 87 HA2 GLY 87 84.949 8.025 6.657 632 HA3 GLY 87 HA3 GLY 87 85.383 9.313 5.536 633 H LYS 88 H LYS 88 82.183 7.687 5.537 634 HA LYS 88 HA LYS 88 81.068 10.232 6.222 635 HB2 LYS 88 HB2 LYS 88 80.433 7.962 4.430 636 HB3 LYS 88 HB3 LYS 88 79.173 9.030 4.992 637 HG2 LYS 88 HG2 LYS 88 80.300 10.907 3.878 638 HG3 LYS 88 HG3 LYS 88 81.636 9.831 3.445 639 HD2 LYS 88 HD2 LYS 88 80.204 8.521 2.044 640 HD3 LYS 88 HD3 LYS 88 78.787 9.425 2.553 641 HE2 LYS 88 HE2 LYS 88 81.139 10.575 1.064 642 HE3 LYS 88 HE3 LYS 88 79.629 10.064 0.314 643 HZ1 LYS 88 HZ1 LYS 88 79.920 12.265 2.316 644 HZ2 LYS 88 HZ2 LYS 88 78.463 11.778 1.599 645 HZ3 LYS 88 HZ3 LYS 88 79.678 12.443 0.662 646 HA PRO 89 HA PRO 89 79.349 7.991 9.739 647 HB2 PRO 89 HB2 PRO 89 76.975 9.717 9.460 648 HB3 PRO 89 HB3 PRO 89 78.090 9.588 10.820 649 HG2 PRO 89 HG2 PRO 89 78.019 11.753 9.209 650 HG3 PRO 89 HG3 PRO 89 79.502 11.181 9.989 651 HD2 PRO 89 HD2 PRO 89 78.624 10.893 7.154 652 HD3 PRO 89 HD3 PRO 89 80.249 11.132 7.828 653 H GLY 90 H GLY 90 77.971 6.302 9.915 654 HA2 GLY 90 HA2 GLY 90 76.390 5.818 7.508 655 HA3 GLY 90 HA3 GLY 90 77.167 4.564 8.465 656 H PHE 91 H PHE 91 75.847 3.463 9.555 657 HA PHE 91 HA PHE 91 73.149 4.352 9.923 658 HB2 PHE 91 HB2 PHE 91 74.433 1.683 10.567 659 HB3 PHE 91 HB3 PHE 91 72.713 2.048 10.538 660 HD1 PHE 91 HD1 PHE 91 71.549 2.442 8.480 661 HD2 PHE 91 HD2 PHE 91 75.675 1.455 8.487 662 HE1 PHE 91 HE1 PHE 91 71.451 1.987 6.079 663 HE2 PHE 91 HE2 PHE 91 75.577 1.007 6.075 664 HZ PHE 91 HZ PHE 91 73.466 1.272 4.873 665 H LYS 92 H LYS 92 72.054 4.278 11.880 666 HA LYS 92 HA LYS 92 73.579 5.197 14.141 667 HB2 LYS 92 HB2 LYS 92 71.512 5.881 14.937 668 HB3 LYS 92 HB3 LYS 92 71.369 6.096 13.230 669 HG2 LYS 92 HG2 LYS 92 70.121 4.041 12.999 670 HG3 LYS 92 HG3 LYS 92 70.312 3.722 14.723 671 HD2 LYS 92 HD2 LYS 92 68.821 6.055 13.499 672 HD3 LYS 92 HD3 LYS 92 68.096 4.615 14.197 673 HE2 LYS 92 HE2 LYS 92 69.006 5.166 16.349 674 HE3 LYS 92 HE3 LYS 92 69.796 6.603 15.695 675 HZ1 LYS 92 HZ1 LYS 92 66.866 6.127 15.939 676 HZ2 LYS 92 HZ2 LYS 92 67.511 7.426 15.084 677 HZ3 LYS 92 HZ3 LYS 92 67.789 7.284 16.735 678 H GLN 93 H GLN 93 72.536 4.325 16.245 679 HA GLN 93 HA GLN 93 73.091 1.522 16.260 680 HB2 GLN 93 HB2 GLN 93 72.834 3.687 18.244 681 HB3 GLN 93 HB3 GLN 93 72.793 2.016 18.773 682 HG2 GLN 93 HG2 GLN 93 75.046 2.798 19.080 683 HG3 GLN 93 HG3 GLN 93 75.062 1.713 17.704 684 HE21 GLN 93 HE21 GLN 93 74.010 5.114 17.655 685 HE22 GLN 93 HE22 GLN 93 75.286 5.653 16.638 686 H GLY 94 H GLY 94 71.655 0.049 16.822 687 HA2 GLY 94 HA2 GLY 94 69.320 0.079 18.151 688 HA3 GLY 94 HA3 GLY 94 68.861 0.599 16.525 Start of MODEL 20 1 H GLU 2 H GLU 2 60.427 2.305 7.583 2 HA GLU 2 HA GLU 2 59.161 4.354 7.585 3 HB2 GLU 2 HB2 GLU 2 59.064 4.721 9.991 4 HB3 GLU 2 HB3 GLU 2 60.809 4.846 10.086 5 HG2 GLU 2 HG2 GLU 2 59.791 7.029 10.299 6 HG3 GLU 2 HG3 GLU 2 60.709 6.940 8.799 7 H LEU 3 H LEU 3 59.950 6.067 6.467 8 HA LEU 3 HA LEU 3 62.625 5.650 5.392 9 HB2 LEU 3 HB2 LEU 3 60.463 7.596 4.570 10 HB3 LEU 3 HB3 LEU 3 61.966 7.306 3.729 11 HG LEU 3 HG LEU 3 59.665 5.402 4.009 12 HD11 LEU 3 HD11 LEU 3 59.511 5.697 1.546 13 HD12 LEU 3 HD12 LEU 3 60.827 6.861 1.614 14 HD13 LEU 3 HD13 LEU 3 59.298 7.224 2.401 15 HD21 LEU 3 HD21 LEU 3 62.317 5.068 2.638 16 HD22 LEU 3 HD22 LEU 3 60.962 3.930 2.566 17 HD23 LEU 3 HD23 LEU 3 61.779 4.251 4.103 18 H LYS 4 H LYS 4 64.173 6.899 6.048 19 HA LYS 4 HA LYS 4 63.540 9.227 7.685 20 HB2 LYS 4 HB2 LYS 4 66.288 8.079 7.140 21 HB3 LYS 4 HB3 LYS 4 65.787 9.095 8.502 22 HG2 LYS 4 HG2 LYS 4 65.449 6.177 7.973 23 HG3 LYS 4 HG3 LYS 4 66.206 6.947 9.345 24 HD2 LYS 4 HD2 LYS 4 63.799 7.816 9.807 25 HD3 LYS 4 HD3 LYS 4 63.346 6.527 8.704 26 HE2 LYS 4 HE2 LYS 4 64.823 4.973 10.084 27 HE3 LYS 4 HE3 LYS 4 64.868 6.250 11.267 28 HZ1 LYS 4 HZ1 LYS 4 62.312 6.095 11.258 29 HZ2 LYS 4 HZ2 LYS 4 63.209 4.951 12.039 30 HZ3 LYS 4 HZ3 LYS 4 62.562 4.545 10.554 31 H ASN 5 H ASN 5 65.589 10.973 7.067 32 HA ASN 5 HA ASN 5 65.295 11.156 4.143 33 HB2 ASN 5 HB2 ASN 5 65.589 13.452 6.091 34 HB3 ASN 5 HB3 ASN 5 65.614 13.623 4.336 35 HD21 ASN 5 HD21 ASN 5 63.716 13.203 3.185 36 HD22 ASN 5 HD22 ASN 5 62.163 13.218 3.944 37 H SER 6 H SER 6 67.439 10.584 6.511 38 HA SER 6 HA SER 6 69.594 10.755 4.624 39 HB2 SER 6 HB2 SER 6 71.076 11.658 6.507 40 HB3 SER 6 HB3 SER 6 69.980 12.825 5.757 41 HG SER 6 HG SER 6 70.124 11.972 8.331 42 H ILE 7 H ILE 7 71.488 9.482 5.514 43 HA ILE 7 HA ILE 7 70.506 6.930 6.248 44 HB ILE 7 HB ILE 7 72.495 7.320 4.757 45 HG12 ILE 7 HG12 ILE 7 73.099 5.601 7.184 46 HG13 ILE 7 HG13 ILE 7 72.143 5.098 5.797 47 HG21 ILE 7 HG21 ILE 7 73.917 8.014 7.326 48 HG22 ILE 7 HG22 ILE 7 73.551 9.128 6.015 49 HG23 ILE 7 HG23 ILE 7 74.685 7.803 5.753 50 HD11 ILE 7 HD11 ILE 7 74.391 4.188 5.692 51 HD12 ILE 7 HD12 ILE 7 75.070 5.813 5.771 52 HD13 ILE 7 HD13 ILE 7 74.122 5.324 4.368 53 H SER 8 H SER 8 71.069 9.592 8.117 54 HA SER 8 HA SER 8 72.640 8.513 10.215 55 HB2 SER 8 HB2 SER 8 72.215 10.776 11.199 56 HB3 SER 8 HB3 SER 8 72.920 10.778 9.572 57 HG SER 8 HG SER 8 70.642 11.855 10.419 58 H ASP 9 H ASP 9 69.202 8.837 9.600 59 HA ASP 9 HA ASP 9 68.726 8.175 12.416 60 HB2 ASP 9 HB2 ASP 9 67.287 9.952 11.179 61 HB3 ASP 9 HB3 ASP 9 66.579 8.593 10.375 62 H TYR 10 H TYR 10 69.157 6.758 9.482 63 HA TYR 10 HA TYR 10 67.338 4.580 9.725 64 HB2 TYR 10 HB2 TYR 10 69.545 5.282 7.859 65 HB3 TYR 10 HB3 TYR 10 69.160 3.580 8.042 66 HD1 TYR 10 HD1 TYR 10 66.736 2.883 7.655 67 HD2 TYR 10 HD2 TYR 10 68.294 6.626 6.394 68 HE1 TYR 10 HE1 TYR 10 64.886 3.091 6.040 69 HE2 TYR 10 HE2 TYR 10 66.440 6.849 4.787 70 HH TYR 10 HH TYR 10 64.808 5.557 3.665 71 H THR 11 H THR 11 67.543 3.069 11.205 72 HA THR 11 HA THR 11 70.137 2.390 12.231 73 HB THR 11 HB THR 11 68.924 0.584 13.391 74 HG1 THR 11 HG1 THR 11 66.579 0.561 13.129 75 HG21 THR 11 HG21 THR 11 68.909 2.728 14.483 76 HG22 THR 11 HG22 THR 11 67.348 1.949 14.734 77 HG23 THR 11 HG23 THR 11 67.508 3.240 13.542 78 H GLU 12 H GLU 12 70.875 0.204 11.904 79 HA GLU 12 HA GLU 12 71.146 -0.242 9.209 80 HB2 GLU 12 HB2 GLU 12 72.358 -2.278 9.787 81 HB3 GLU 12 HB3 GLU 12 72.829 -0.927 10.792 82 HG2 GLU 12 HG2 GLU 12 71.354 -3.442 11.582 83 HG3 GLU 12 HG3 GLU 12 72.834 -2.684 12.183 84 H ALA 13 H ALA 13 69.024 -1.905 11.500 85 HA ALA 13 HA ALA 13 67.887 -3.602 9.525 86 HB1 ALA 13 HB1 ALA 13 67.789 -4.117 11.934 87 HB2 ALA 13 HB2 ALA 13 66.205 -4.179 11.166 88 HB3 ALA 13 HB3 ALA 13 66.650 -2.787 12.155 89 H GLU 14 H GLU 14 66.875 -0.343 10.697 90 HA GLU 14 HA GLU 14 64.377 -0.205 9.396 91 HB2 GLU 14 HB2 GLU 14 66.368 1.802 10.295 92 HB3 GLU 14 HB3 GLU 14 65.199 2.402 9.149 93 HG2 GLU 14 HG2 GLU 14 64.565 1.082 11.795 94 HG3 GLU 14 HG3 GLU 14 64.606 2.820 11.511 95 H PHE 15 H PHE 15 67.617 0.288 8.228 96 HA PHE 15 HA PHE 15 66.618 1.139 5.705 97 HB2 PHE 15 HB2 PHE 15 68.810 1.912 6.723 98 HB3 PHE 15 HB3 PHE 15 69.465 0.349 6.241 99 HD1 PHE 15 HD1 PHE 15 67.089 2.613 4.459 100 HD2 PHE 15 HD2 PHE 15 70.937 0.809 4.512 101 HE1 PHE 15 HE1 PHE 15 67.553 3.550 2.252 102 HE2 PHE 15 HE2 PHE 15 71.402 1.756 2.301 103 HZ PHE 15 HZ PHE 15 69.710 3.140 1.182 104 H VAL 16 H VAL 16 68.138 -1.860 6.968 105 HA VAL 16 HA VAL 16 68.247 -3.117 4.508 106 HB VAL 16 HB VAL 16 68.447 -5.234 5.518 107 HG11 VAL 16 HG11 VAL 16 69.739 -3.305 7.330 108 HG12 VAL 16 HG12 VAL 16 70.297 -3.928 5.778 109 HG13 VAL 16 HG13 VAL 16 70.136 -5.023 7.155 110 HG21 VAL 16 HG21 VAL 16 68.058 -5.627 7.943 111 HG22 VAL 16 HG22 VAL 16 66.694 -5.480 6.830 112 HG23 VAL 16 HG23 VAL 16 67.085 -4.113 7.886 113 H GLN 17 H GLN 17 65.533 -2.700 6.718 114 HA GLN 17 HA GLN 17 63.702 -4.519 5.678 115 HB2 GLN 17 HB2 GLN 17 63.569 -3.340 7.835 116 HB3 GLN 17 HB3 GLN 17 63.338 -1.827 6.974 117 HG2 GLN 17 HG2 GLN 17 61.334 -2.787 5.965 118 HG3 GLN 17 HG3 GLN 17 61.546 -4.192 7.026 119 HE21 GLN 17 HE21 GLN 17 60.760 -0.835 6.873 120 HE22 GLN 17 HE22 GLN 17 60.138 -0.684 8.467 121 H LEU 18 H LEU 18 64.358 -1.129 5.030 122 HA LEU 18 HA LEU 18 62.345 -0.727 3.149 123 HB2 LEU 18 HB2 LEU 18 63.525 0.992 4.374 124 HB3 LEU 18 HB3 LEU 18 64.995 0.739 3.588 125 HG LEU 18 HG LEU 18 63.677 2.769 2.797 126 HD11 LEU 18 HD11 LEU 18 65.559 1.933 1.531 127 HD12 LEU 18 HD12 LEU 18 64.286 2.518 0.463 128 HD13 LEU 18 HD13 LEU 18 64.507 0.783 0.708 129 HD21 LEU 18 HD21 LEU 18 62.044 0.658 1.392 130 HD22 LEU 18 HD22 LEU 18 61.919 2.408 1.166 131 HD23 LEU 18 HD23 LEU 18 61.488 1.688 2.709 132 H LEU 19 H LEU 19 65.640 -1.618 2.961 133 HA LEU 19 HA LEU 19 66.070 -1.774 0.204 134 HB2 LEU 19 HB2 LEU 19 67.107 -3.227 2.511 135 HB3 LEU 19 HB3 LEU 19 67.901 -3.370 0.916 136 HG LEU 19 HG LEU 19 67.704 -1.106 2.874 137 HD11 LEU 19 HD11 LEU 19 69.519 -2.652 3.082 138 HD12 LEU 19 HD12 LEU 19 70.035 -1.011 2.686 139 HD13 LEU 19 HD13 LEU 19 70.040 -2.258 1.443 140 HD21 LEU 19 HD21 LEU 19 67.102 -0.146 0.793 141 HD22 LEU 19 HD22 LEU 19 68.548 -0.854 0.026 142 HD23 LEU 19 HD23 LEU 19 68.706 0.358 1.324 143 H LYS 20 H LYS 20 64.798 -4.168 2.497 144 HA LYS 20 HA LYS 20 64.636 -6.319 0.689 145 HB2 LYS 20 HB2 LYS 20 62.925 -5.741 3.112 146 HB3 LYS 20 HB3 LYS 20 62.885 -7.248 2.230 147 HG2 LYS 20 HG2 LYS 20 65.420 -7.365 2.812 148 HG3 LYS 20 HG3 LYS 20 65.016 -6.131 3.986 149 HD2 LYS 20 HD2 LYS 20 63.336 -7.502 5.031 150 HD3 LYS 20 HD3 LYS 20 63.543 -8.757 3.820 151 HE2 LYS 20 HE2 LYS 20 64.672 -9.476 5.789 152 HE3 LYS 20 HE3 LYS 20 65.908 -9.017 4.621 153 HZ1 LYS 20 HZ1 LYS 20 64.964 -7.480 6.955 154 HZ2 LYS 20 HZ2 LYS 20 66.003 -6.835 5.815 155 HZ3 LYS 20 HZ3 LYS 20 66.492 -8.158 6.770 156 H GLU 21 H GLU 21 62.518 -3.664 1.463 157 HA GLU 21 HA GLU 21 60.328 -4.552 -0.038 158 HB2 GLU 21 HB2 GLU 21 61.074 -1.752 0.799 159 HB3 GLU 21 HB3 GLU 21 59.527 -2.192 0.105 160 HG2 GLU 21 HG2 GLU 21 60.663 -3.145 2.722 161 HG3 GLU 21 HG3 GLU 21 59.344 -1.998 2.489 162 H ILE 22 H ILE 22 63.187 -2.754 -0.833 163 HA ILE 22 HA ILE 22 62.378 -1.836 -3.374 164 HB ILE 22 HB ILE 22 65.233 -2.553 -2.633 165 HG12 ILE 22 HG12 ILE 22 63.773 0.058 -2.196 166 HG13 ILE 22 HG13 ILE 22 64.250 -1.054 -0.916 167 HG21 ILE 22 HG21 ILE 22 65.762 -0.784 -4.264 168 HG22 ILE 22 HG22 ILE 22 64.043 -0.583 -4.596 169 HG23 ILE 22 HG23 ILE 22 64.849 -2.102 -4.997 170 HD11 ILE 22 HD11 ILE 22 66.604 -0.654 -1.523 171 HD12 ILE 22 HD12 ILE 22 65.761 0.820 -1.043 172 HD13 ILE 22 HD13 ILE 22 66.063 0.491 -2.747 173 H GLU 23 H GLU 23 63.963 -4.824 -2.294 174 HA GLU 23 HA GLU 23 64.486 -6.038 -4.782 175 HB2 GLU 23 HB2 GLU 23 63.473 -7.270 -2.253 176 HB3 GLU 23 HB3 GLU 23 64.020 -8.222 -3.604 177 HG2 GLU 23 HG2 GLU 23 66.285 -7.187 -3.231 178 HG3 GLU 23 HG3 GLU 23 65.614 -6.449 -1.765 179 H LYS 24 H LYS 24 61.710 -6.012 -2.724 180 HA LYS 24 HA LYS 24 60.063 -7.839 -4.009 181 HB2 LYS 24 HB2 LYS 24 59.839 -7.143 -1.728 182 HB3 LYS 24 HB3 LYS 24 59.425 -5.512 -2.221 183 HG2 LYS 24 HG2 LYS 24 57.420 -6.648 -1.546 184 HG3 LYS 24 HG3 LYS 24 57.378 -6.408 -3.291 185 HD2 LYS 24 HD2 LYS 24 58.046 -8.712 -3.656 186 HD3 LYS 24 HD3 LYS 24 58.209 -8.964 -1.916 187 HE2 LYS 24 HE2 LYS 24 55.662 -8.277 -3.375 188 HE3 LYS 24 HE3 LYS 24 56.101 -9.871 -2.754 189 HZ1 LYS 24 HZ1 LYS 24 54.631 -8.783 -1.235 190 HZ2 LYS 24 HZ2 LYS 24 55.603 -7.420 -1.148 191 HZ3 LYS 24 HZ3 LYS 24 56.142 -8.869 -0.501 192 H GLU 25 H GLU 25 60.190 -4.263 -4.344 193 HA GLU 25 HA GLU 25 58.154 -4.541 -6.338 194 HB2 GLU 25 HB2 GLU 25 58.354 -1.966 -6.504 195 HB3 GLU 25 HB3 GLU 25 57.680 -2.632 -4.992 196 HG2 GLU 25 HG2 GLU 25 59.080 -0.933 -4.361 197 HG3 GLU 25 HG3 GLU 25 60.157 -2.328 -4.250 198 H ASN 26 H ASN 26 61.588 -4.042 -6.279 199 HA ASN 26 HA ASN 26 61.883 -3.304 -8.969 200 HB2 ASN 26 HB2 ASN 26 63.729 -3.042 -7.392 201 HB3 ASN 26 HB3 ASN 26 63.813 -4.779 -7.155 202 HD21 ASN 26 HD21 ASN 26 64.922 -6.022 -8.628 203 HD22 ASN 26 HD22 ASN 26 65.832 -5.354 -9.928 204 H VAL 27 H VAL 27 61.535 -6.483 -7.479 205 HA VAL 27 HA VAL 27 62.042 -7.826 -9.972 206 HB VAL 27 HB VAL 27 61.340 -9.916 -8.911 207 HG11 VAL 27 HG11 VAL 27 63.118 -8.282 -7.122 208 HG12 VAL 27 HG12 VAL 27 63.611 -9.210 -8.537 209 HG13 VAL 27 HG13 VAL 27 62.993 -10.041 -7.111 210 HG21 VAL 27 HG21 VAL 27 60.612 -10.001 -6.558 211 HG22 VAL 27 HG22 VAL 27 59.467 -9.107 -7.562 212 HG23 VAL 27 HG23 VAL 27 60.585 -8.237 -6.511 213 H ALA 28 H ALA 28 59.400 -6.194 -8.742 214 HA ALA 28 HA ALA 28 57.524 -7.571 -10.529 215 HB1 ALA 28 HB1 ALA 28 57.070 -5.327 -8.542 216 HB2 ALA 28 HB2 ALA 28 56.712 -7.034 -8.275 217 HB3 ALA 28 HB3 ALA 28 55.813 -6.124 -9.491 218 H ALA 29 H ALA 29 59.468 -4.838 -10.159 219 HA ALA 29 HA ALA 29 60.186 -3.217 -11.413 220 HB1 ALA 29 HB1 ALA 29 58.676 -4.408 -13.741 221 HB2 ALA 29 HB2 ALA 29 60.323 -4.839 -13.263 222 HB3 ALA 29 HB3 ALA 29 59.963 -3.204 -13.817 223 H THR 30 H THR 30 59.120 -1.771 -10.136 224 HA THR 30 HA THR 30 56.777 -0.543 -11.405 225 HB THR 30 HB THR 30 56.289 0.514 -9.302 226 HG1 THR 30 HG1 THR 30 58.731 -0.257 -8.006 227 HG21 THR 30 HG21 THR 30 55.813 -1.877 -9.123 228 HG22 THR 30 HG22 THR 30 56.359 -1.242 -7.566 229 HG23 THR 30 HG23 THR 30 57.467 -2.161 -8.584 230 H ASP 31 H ASP 31 57.073 1.986 -11.368 231 HA ASP 31 HA ASP 31 59.898 2.587 -11.111 232 HB2 ASP 31 HB2 ASP 31 60.136 3.825 -13.072 233 HB3 ASP 31 HB3 ASP 31 59.370 2.333 -13.557 234 H ASP 32 H ASP 32 57.223 3.024 -9.837 235 HA ASP 32 HA ASP 32 57.394 5.916 -9.470 236 HB2 ASP 32 HB2 ASP 32 55.538 3.950 -8.106 237 HB3 ASP 32 HB3 ASP 32 55.437 5.697 -8.012 238 H VAL 33 H VAL 33 57.041 3.167 -7.288 239 HA VAL 33 HA VAL 33 58.403 4.609 -5.252 240 HB VAL 33 HB VAL 33 56.542 3.075 -4.792 241 HG11 VAL 33 HG11 VAL 33 56.977 1.249 -6.241 242 HG12 VAL 33 HG12 VAL 33 56.948 0.650 -4.575 243 HG13 VAL 33 HG13 VAL 33 58.488 0.900 -5.405 244 HG21 VAL 33 HG21 VAL 33 57.465 2.076 -2.727 245 HG22 VAL 33 HG22 VAL 33 57.936 3.759 -2.966 246 HG23 VAL 33 HG23 VAL 33 59.084 2.465 -3.310 247 H LEU 34 H LEU 34 59.203 2.132 -7.524 248 HA LEU 34 HA LEU 34 61.751 1.329 -6.653 249 HB2 LEU 34 HB2 LEU 34 60.457 0.353 -8.477 250 HB3 LEU 34 HB3 LEU 34 60.585 1.730 -9.425 251 HG LEU 34 HG LEU 34 61.971 -0.213 -10.139 252 HD11 LEU 34 HD11 LEU 34 62.512 1.928 -10.983 253 HD12 LEU 34 HD12 LEU 34 63.995 1.011 -10.686 254 HD13 LEU 34 HD13 LEU 34 63.498 2.291 -9.567 255 HD21 LEU 34 HD21 LEU 34 62.640 -1.021 -7.964 256 HD22 LEU 34 HD22 LEU 34 63.603 0.431 -7.695 257 HD23 LEU 34 HD23 LEU 34 64.057 -0.708 -8.967 258 H ASP 35 H ASP 35 60.802 4.079 -8.626 259 HA ASP 35 HA ASP 35 63.513 5.027 -8.740 260 HB2 ASP 35 HB2 ASP 35 62.003 5.737 -10.522 261 HB3 ASP 35 HB3 ASP 35 60.946 6.497 -9.338 262 H VAL 36 H VAL 36 60.968 5.535 -6.495 263 HA VAL 36 HA VAL 36 62.167 7.702 -5.089 264 HB VAL 36 HB VAL 36 60.657 5.372 -3.913 265 HG11 VAL 36 HG11 VAL 36 61.108 8.136 -2.904 266 HG12 VAL 36 HG12 VAL 36 61.897 6.644 -2.365 267 HG13 VAL 36 HG13 VAL 36 60.142 6.863 -2.108 268 HG21 VAL 36 HG21 VAL 36 59.415 6.396 -5.591 269 HG22 VAL 36 HG22 VAL 36 59.651 7.996 -4.790 270 HG23 VAL 36 HG23 VAL 36 58.778 6.663 -3.957 271 H LEU 37 H LEU 37 62.259 4.238 -4.757 272 HA LEU 37 HA LEU 37 63.822 4.298 -2.438 273 HB2 LEU 37 HB2 LEU 37 63.436 1.999 -4.282 274 HB3 LEU 37 HB3 LEU 37 63.914 2.050 -2.603 275 HG LEU 37 HG LEU 37 61.169 2.867 -3.519 276 HD11 LEU 37 HD11 LEU 37 61.918 0.415 -1.945 277 HD12 LEU 37 HD12 LEU 37 61.518 0.439 -3.662 278 HD13 LEU 37 HD13 LEU 37 60.311 0.909 -2.469 279 HD21 LEU 37 HD21 LEU 37 60.656 2.932 -1.100 280 HD22 LEU 37 HD22 LEU 37 61.851 4.129 -1.592 281 HD23 LEU 37 HD23 LEU 37 62.371 2.657 -0.771 282 H LEU 38 H LEU 38 64.509 3.693 -5.772 283 HA LEU 38 HA LEU 38 67.189 3.013 -5.403 284 HB2 LEU 38 HB2 LEU 38 65.683 4.198 -7.650 285 HB3 LEU 38 HB3 LEU 38 67.398 3.794 -7.830 286 HG LEU 38 HG LEU 38 64.925 2.174 -7.842 287 HD11 LEU 38 HD11 LEU 38 66.174 2.668 -9.835 288 HD12 LEU 38 HD12 LEU 38 66.143 0.925 -9.500 289 HD13 LEU 38 HD13 LEU 38 67.581 1.881 -9.116 290 HD21 LEU 38 HD21 LEU 38 65.980 1.227 -5.881 291 HD22 LEU 38 HD22 LEU 38 67.498 1.038 -6.764 292 HD23 LEU 38 HD23 LEU 38 66.076 0.109 -7.239 293 H GLU 39 H GLU 39 65.683 6.143 -5.990 294 HA GLU 39 HA GLU 39 68.167 7.504 -5.961 295 HB2 GLU 39 HB2 GLU 39 65.385 8.458 -5.426 296 HB3 GLU 39 HB3 GLU 39 66.809 9.470 -5.579 297 HG2 GLU 39 HG2 GLU 39 65.559 7.736 -7.691 298 HG3 GLU 39 HG3 GLU 39 65.505 9.493 -7.590 299 H HIS 40 H HIS 40 65.695 6.832 -3.597 300 HA HIS 40 HA HIS 40 66.548 8.463 -1.559 301 HB2 HIS 40 HB2 HIS 40 64.396 7.318 -1.715 302 HB3 HIS 40 HB3 HIS 40 65.120 5.794 -1.363 303 HD1 HIS 40 HD1 HIS 40 63.756 8.790 0.242 304 HD2 HIS 40 HD2 HIS 40 66.091 5.539 1.327 305 HE1 HIS 40 HE1 HIS 40 63.737 8.715 2.758 306 H PHE 41 H PHE 41 67.279 5.129 -2.242 307 HA PHE 41 HA PHE 41 68.963 4.590 -0.092 308 HB2 PHE 41 HB2 PHE 41 68.088 2.811 -1.333 309 HB3 PHE 41 HB3 PHE 41 68.603 3.512 -2.855 310 HD1 PHE 41 HD1 PHE 41 69.578 1.589 0.075 311 HD2 PHE 41 HD2 PHE 41 70.888 3.109 -3.641 312 HE1 PHE 41 HE1 PHE 41 71.541 0.116 0.187 313 HE2 PHE 41 HE2 PHE 41 72.861 1.652 -3.523 314 HZ PHE 41 HZ PHE 41 73.192 0.162 -1.648 315 H VAL 42 H VAL 42 69.747 5.557 -3.406 316 HA VAL 42 HA VAL 42 72.481 5.724 -2.782 317 HB VAL 42 HB VAL 42 71.652 5.189 -5.026 318 HG11 VAL 42 HG11 VAL 42 70.940 8.031 -5.325 319 HG12 VAL 42 HG12 VAL 42 69.913 6.562 -5.332 320 HG13 VAL 42 HG13 VAL 42 71.121 6.800 -6.600 321 HG21 VAL 42 HG21 VAL 42 73.530 7.519 -4.986 322 HG22 VAL 42 HG22 VAL 42 73.376 6.347 -6.296 323 HG23 VAL 42 HG23 VAL 42 73.975 5.845 -4.710 324 H LYS 43 H LYS 43 70.003 8.084 -2.676 325 HA LYS 43 HA LYS 43 71.784 10.325 -2.523 326 HB2 LYS 43 HB2 LYS 43 69.920 11.698 -1.941 327 HB3 LYS 43 HB3 LYS 43 69.293 10.507 -3.066 328 HG2 LYS 43 HG2 LYS 43 68.447 9.206 -1.052 329 HG3 LYS 43 HG3 LYS 43 68.962 10.559 -0.081 330 HD2 LYS 43 HD2 LYS 43 66.951 10.832 -2.315 331 HD3 LYS 43 HD3 LYS 43 66.503 10.486 -0.655 332 HE2 LYS 43 HE2 LYS 43 66.197 12.819 -0.960 333 HE3 LYS 43 HE3 LYS 43 67.661 12.648 -0.009 334 HZ1 LYS 43 HZ1 LYS 43 67.590 13.120 -2.946 335 HZ2 LYS 43 HZ2 LYS 43 68.970 13.151 -1.972 336 HZ3 LYS 43 HZ3 LYS 43 67.776 14.313 -1.791 337 H ILE 44 H ILE 44 70.421 8.255 -0.010 338 HA ILE 44 HA ILE 44 71.560 9.982 2.016 339 HB ILE 44 HB ILE 44 70.751 8.358 3.656 340 HG12 ILE 44 HG12 ILE 44 69.702 6.780 1.312 341 HG13 ILE 44 HG13 ILE 44 71.138 6.325 2.211 342 HG21 ILE 44 HG21 ILE 44 68.368 8.634 3.243 343 HG22 ILE 44 HG22 ILE 44 68.687 8.937 1.541 344 HG23 ILE 44 HG23 ILE 44 69.236 10.094 2.746 345 HD11 ILE 44 HD11 ILE 44 69.209 5.068 2.926 346 HD12 ILE 44 HD12 ILE 44 68.351 6.565 3.300 347 HD13 ILE 44 HD13 ILE 44 69.782 6.107 4.227 348 H THR 45 H THR 45 72.477 7.099 0.338 349 HA THR 45 HA THR 45 74.679 6.595 2.124 350 HB THR 45 HB THR 45 75.242 4.771 0.554 351 HG1 THR 45 HG1 THR 45 72.830 5.219 -0.796 352 HG21 THR 45 HG21 THR 45 72.313 4.862 1.302 353 HG22 THR 45 HG22 THR 45 73.624 4.406 2.388 354 HG23 THR 45 HG23 THR 45 73.256 3.408 0.981 355 H GLU 46 H GLU 46 74.130 8.060 -1.030 356 HA GLU 46 HA GLU 46 75.331 9.164 -2.488 357 HB2 GLU 46 HB2 GLU 46 76.826 9.703 0.021 358 HB3 GLU 46 HB3 GLU 46 77.438 10.380 -1.502 359 HG2 GLU 46 HG2 GLU 46 74.656 10.766 -0.435 360 HG3 GLU 46 HG3 GLU 46 75.983 11.887 -0.102 361 H HIS 47 H HIS 47 75.701 6.424 -2.124 362 HA HIS 47 HA HIS 47 78.431 5.730 -2.585 363 HB2 HIS 47 HB2 HIS 47 76.647 4.242 -1.520 364 HB3 HIS 47 HB3 HIS 47 75.962 4.047 -3.126 365 HD1 HIS 47 HD1 HIS 47 76.959 2.108 -4.507 366 HD2 HIS 47 HD2 HIS 47 79.301 3.217 -1.265 367 HE1 HIS 47 HE1 HIS 47 78.917 0.562 -4.494 368 HA PRO 48 HA PRO 48 78.422 6.788 -6.977 369 HB2 PRO 48 HB2 PRO 48 80.326 4.612 -7.330 370 HB3 PRO 48 HB3 PRO 48 80.534 6.337 -7.640 371 HG2 PRO 48 HG2 PRO 48 81.685 4.981 -5.675 372 HG3 PRO 48 HG3 PRO 48 81.179 6.678 -5.384 373 HD2 PRO 48 HD2 PRO 48 79.928 4.081 -4.589 374 HD3 PRO 48 HD3 PRO 48 80.042 5.581 -3.658 375 H ASP 49 H ASP 49 77.859 3.635 -5.850 376 HA ASP 49 HA ASP 49 76.986 2.955 -8.418 377 HB2 ASP 49 HB2 ASP 49 78.668 1.258 -6.608 378 HB3 ASP 49 HB3 ASP 49 77.636 0.486 -7.792 379 H GLY 50 H GLY 50 75.559 4.103 -6.522 380 HA2 GLY 50 HA2 GLY 50 74.251 2.773 -4.434 381 HA3 GLY 50 HA3 GLY 50 73.581 4.027 -5.439 382 H THR 51 H THR 51 73.375 2.968 -7.758 383 HA THR 51 HA THR 51 71.258 1.282 -6.943 384 HB THR 51 HB THR 51 70.641 1.501 -9.576 385 HG1 THR 51 HG1 THR 51 71.073 4.066 -9.400 386 HG21 THR 51 HG21 THR 51 69.174 1.852 -7.661 387 HG22 THR 51 HG22 THR 51 69.064 3.228 -8.740 388 HG23 THR 51 HG23 THR 51 70.005 3.338 -7.253 389 H ALA 52 H ALA 52 74.203 0.840 -8.567 390 HA ALA 52 HA ALA 52 73.750 -1.838 -9.583 391 HB1 ALA 52 HB1 ALA 52 76.244 -0.696 -8.358 392 HB2 ALA 52 HB2 ALA 52 75.802 -0.435 -10.048 393 HB3 ALA 52 HB3 ALA 52 76.130 -2.067 -9.458 394 H LEU 53 H LEU 53 74.584 -0.614 -6.395 395 HA LEU 53 HA LEU 53 74.813 -3.175 -5.307 396 HB2 LEU 53 HB2 LEU 53 73.912 -0.661 -3.944 397 HB3 LEU 53 HB3 LEU 53 74.252 -2.157 -3.109 398 HG LEU 53 HG LEU 53 76.184 -0.364 -4.547 399 HD11 LEU 53 HD11 LEU 53 75.597 0.274 -2.318 400 HD12 LEU 53 HD12 LEU 53 77.263 -0.308 -2.374 401 HD13 LEU 53 HD13 LEU 53 75.987 -1.336 -1.715 402 HD21 LEU 53 HD21 LEU 53 76.694 -3.138 -3.450 403 HD22 LEU 53 HD22 LEU 53 77.931 -1.990 -3.959 404 HD23 LEU 53 HD23 LEU 53 76.804 -2.635 -5.144 405 H ILE 54 H ILE 54 71.905 -1.200 -5.672 406 HA ILE 54 HA ILE 54 70.243 -3.042 -4.226 407 HB ILE 54 HB ILE 54 69.627 -0.733 -6.049 408 HG12 ILE 54 HG12 ILE 54 68.658 -1.288 -3.275 409 HG13 ILE 54 HG13 ILE 54 70.167 -0.453 -3.513 410 HG21 ILE 54 HG21 ILE 54 67.964 -2.424 -6.638 411 HG22 ILE 54 HG22 ILE 54 67.228 -1.086 -5.761 412 HG23 ILE 54 HG23 ILE 54 67.541 -2.612 -4.934 413 HD11 ILE 54 HD11 ILE 54 67.436 0.412 -4.422 414 HD12 ILE 54 HD12 ILE 54 68.930 1.284 -4.767 415 HD13 ILE 54 HD13 ILE 54 68.383 1.093 -3.102 416 H TYR 55 H TYR 55 70.831 -2.427 -7.624 417 HA TYR 55 HA TYR 55 69.048 -4.259 -8.645 418 HB2 TYR 55 HB2 TYR 55 71.393 -2.799 -9.623 419 HB3 TYR 55 HB3 TYR 55 70.907 -4.174 -10.579 420 HD1 TYR 55 HD1 TYR 55 68.496 -4.208 -11.441 421 HD2 TYR 55 HD2 TYR 55 70.268 -0.751 -9.738 422 HE1 TYR 55 HE1 TYR 55 66.769 -2.815 -12.485 423 HE2 TYR 55 HE2 TYR 55 68.553 0.652 -10.778 424 HH TYR 55 HH TYR 55 65.761 -0.681 -12.203 425 H GLU 56 H GLU 56 72.536 -4.576 -7.983 426 HA GLU 56 HA GLU 56 72.733 -7.232 -8.726 427 HB2 GLU 56 HB2 GLU 56 74.353 -5.615 -6.787 428 HB3 GLU 56 HB3 GLU 56 74.752 -7.173 -7.320 429 HG2 GLU 56 HG2 GLU 56 74.364 -5.058 -9.370 430 HG3 GLU 56 HG3 GLU 56 75.915 -5.327 -8.576 431 H ALA 57 H ALA 57 71.947 -5.681 -5.613 432 HA ALA 57 HA ALA 57 72.140 -7.952 -3.997 433 HB1 ALA 57 HB1 ALA 57 71.808 -5.691 -3.128 434 HB2 ALA 57 HB2 ALA 57 70.661 -6.843 -2.441 435 HB3 ALA 57 HB3 ALA 57 70.142 -5.720 -3.701 436 H ALA 58 H ALA 58 69.360 -6.691 -5.746 437 HA ALA 58 HA ALA 58 67.547 -8.651 -4.916 438 HB1 ALA 58 HB1 ALA 58 66.843 -6.563 -5.977 439 HB2 ALA 58 HB2 ALA 58 66.172 -7.958 -6.826 440 HB3 ALA 58 HB3 ALA 58 67.553 -7.090 -7.500 441 H ALA 59 H ALA 59 69.630 -8.523 -7.784 442 HA ALA 59 HA ALA 59 68.710 -11.011 -8.829 443 HB1 ALA 59 HB1 ALA 59 71.208 -9.466 -9.516 444 HB2 ALA 59 HB2 ALA 59 69.619 -9.233 -10.251 445 HB3 ALA 59 HB3 ALA 59 70.473 -10.758 -10.469 446 H ARG 60 H ARG 60 71.571 -10.029 -7.014 447 HA ARG 60 HA ARG 60 72.940 -12.494 -7.084 448 HB2 ARG 60 HB2 ARG 60 73.172 -10.039 -5.355 449 HB3 ARG 60 HB3 ARG 60 74.159 -11.466 -5.004 450 HG2 ARG 60 HG2 ARG 60 75.125 -11.183 -7.250 451 HG3 ARG 60 HG3 ARG 60 74.096 -9.761 -7.478 452 HD2 ARG 60 HD2 ARG 60 75.099 -8.808 -5.394 453 HD3 ARG 60 HD3 ARG 60 76.231 -10.156 -5.387 454 HE ARG 60 HE ARG 60 76.300 -8.871 -7.878 455 HH11 ARG 60 HH11 ARG 60 77.415 -8.409 -4.540 456 HH12 ARG 60 HH12 ARG 60 78.586 -7.243 -4.967 457 HH21 ARG 60 HH21 ARG 60 77.884 -7.304 -8.426 458 HH22 ARG 60 HH22 ARG 60 78.896 -6.641 -7.229 459 H ALA 61 H ALA 61 70.510 -11.198 -4.912 460 HA ALA 61 HA ALA 61 70.832 -13.431 -3.157 461 HB1 ALA 61 HB1 ALA 61 68.663 -11.335 -3.193 462 HB2 ALA 61 HB2 ALA 61 70.193 -11.269 -2.310 463 HB3 ALA 61 HB3 ALA 61 68.999 -12.495 -1.890 464 H ALA 62 H ALA 62 68.608 -12.578 -5.781 465 HA ALA 62 HA ALA 62 66.856 -14.792 -5.308 466 HB1 ALA 62 HB1 ALA 62 67.232 -13.156 -7.816 467 HB2 ALA 62 HB2 ALA 62 66.103 -12.786 -6.512 468 HB3 ALA 62 HB3 ALA 62 65.886 -14.242 -7.485 469 H ALA 63 H ALA 63 69.372 -14.201 -7.739 470 HA ALA 63 HA ALA 63 69.592 -17.102 -8.000 471 HB1 ALA 63 HB1 ALA 63 69.178 -16.059 -10.188 472 HB2 ALA 63 HB2 ALA 63 70.852 -16.642 -10.072 473 HB3 ALA 63 HB3 ALA 63 70.507 -14.924 -9.897 474 H ASN 64 H ASN 64 70.609 -17.097 -6.089 475 HA ASN 64 HA ASN 64 72.937 -15.497 -5.672 476 HB2 ASN 64 HB2 ASN 64 71.429 -15.989 -3.817 477 HB3 ASN 64 HB3 ASN 64 71.782 -17.705 -3.974 478 HD21 ASN 64 HD21 ASN 64 73.058 -14.609 -3.121 479 HD22 ASN 64 HD22 ASN 64 74.382 -15.180 -2.168 480 HA PRO 65 HA PRO 65 75.466 -18.775 -7.227 481 HB2 PRO 65 HB2 PRO 65 77.452 -17.272 -8.182 482 HB3 PRO 65 HB3 PRO 65 75.871 -17.315 -8.978 483 HG2 PRO 65 HG2 PRO 65 77.061 -15.197 -7.251 484 HG3 PRO 65 HG3 PRO 65 75.971 -15.037 -8.638 485 HD2 PRO 65 HD2 PRO 65 75.243 -15.019 -5.893 486 HD3 PRO 65 HD3 PRO 65 74.153 -15.092 -7.293 487 H GLY 66 H GLY 66 75.524 -17.123 -4.524 488 HA2 GLY 66 HA2 GLY 66 76.808 -17.463 -2.580 489 HA3 GLY 66 HA3 GLY 66 78.188 -17.888 -3.597 490 H GLY 67 H GLY 67 77.811 -15.706 -1.468 491 HA2 GLY 67 HA2 GLY 67 79.414 -13.812 -2.756 492 HA3 GLY 67 HA3 GLY 67 77.755 -13.271 -2.852 493 H ASP 68 H ASP 68 79.050 -11.580 -1.731 494 HA ASP 68 HA ASP 68 79.015 -11.977 1.192 495 HB2 ASP 68 HB2 ASP 68 81.179 -11.311 0.084 496 HB3 ASP 68 HB3 ASP 68 80.394 -9.817 -0.400 497 H GLY 69 H GLY 69 77.973 -10.012 -1.511 498 HA2 GLY 69 HA2 GLY 69 75.989 -8.707 0.228 499 HA3 GLY 69 HA3 GLY 69 76.786 -7.845 -1.104 500 H GLY 70 H GLY 70 75.208 -10.900 -0.504 501 HA2 GLY 70 HA2 GLY 70 73.710 -10.505 -2.988 502 HA3 GLY 70 HA3 GLY 70 74.103 -12.081 -2.287 503 H GLY 71 H GLY 71 72.529 -9.029 -1.422 504 HA2 GLY 71 HA2 GLY 71 70.052 -9.807 -0.943 505 HA3 GLY 71 HA3 GLY 71 70.870 -10.360 0.509 506 HA PRO 72 HA PRO 72 69.530 -5.810 0.555 507 HB2 PRO 72 HB2 PRO 72 67.617 -6.084 2.500 508 HB3 PRO 72 HB3 PRO 72 67.306 -6.182 0.762 509 HG2 PRO 72 HG2 PRO 72 67.674 -8.404 2.728 510 HG3 PRO 72 HG3 PRO 72 66.503 -8.251 1.405 511 HD2 PRO 72 HD2 PRO 72 68.721 -9.745 1.183 512 HD3 PRO 72 HD3 PRO 72 68.043 -8.873 -0.203 513 H GLU 73 H GLU 73 70.288 -8.178 3.020 514 HA GLU 73 HA GLU 73 71.212 -6.109 4.891 515 HB2 GLU 73 HB2 GLU 73 71.152 -9.109 5.286 516 HB3 GLU 73 HB3 GLU 73 71.222 -7.849 6.515 517 HG2 GLU 73 HG2 GLU 73 68.982 -7.111 5.913 518 HG3 GLU 73 HG3 GLU 73 68.896 -8.364 4.681 519 H GLY 74 H GLY 74 72.413 -7.615 2.273 520 HA2 GLY 74 HA2 GLY 74 75.067 -7.539 3.459 521 HA3 GLY 74 HA3 GLY 74 74.722 -8.362 1.906 522 H ILE 75 H ILE 75 73.128 -6.028 1.016 523 HA ILE 75 HA ILE 75 75.168 -4.384 -0.055 524 HB ILE 75 HB ILE 75 73.243 -2.722 -0.464 525 HG12 ILE 75 HG12 ILE 75 71.657 -5.184 0.251 526 HG13 ILE 75 HG13 ILE 75 71.782 -3.743 1.247 527 HG21 ILE 75 HG21 ILE 75 72.519 -3.980 -2.359 528 HG22 ILE 75 HG22 ILE 75 73.271 -5.446 -1.683 529 HG23 ILE 75 HG23 ILE 75 74.270 -4.052 -2.139 530 HD11 ILE 75 HD11 ILE 75 70.735 -2.459 -0.454 531 HD12 ILE 75 HD12 ILE 75 69.750 -3.816 0.098 532 HD13 ILE 75 HD13 ILE 75 70.560 -3.902 -1.489 533 H VAL 76 H VAL 76 73.198 -4.064 2.820 534 HA VAL 76 HA VAL 76 73.905 -1.472 3.429 535 HB VAL 76 HB VAL 76 73.423 -2.495 5.802 536 HG11 VAL 76 HG11 VAL 76 72.025 -0.908 4.629 537 HG12 VAL 76 HG12 VAL 76 71.078 -2.135 5.459 538 HG13 VAL 76 HG13 VAL 76 71.338 -2.240 3.711 539 HG21 VAL 76 HG21 VAL 76 72.143 -4.379 5.847 540 HG22 VAL 76 HG22 VAL 76 73.610 -4.747 4.939 541 HG23 VAL 76 HG23 VAL 76 72.086 -4.458 4.089 542 H LYS 77 H LYS 77 75.422 -4.558 3.903 543 HA LYS 77 HA LYS 77 77.449 -3.691 5.647 544 HB2 LYS 77 HB2 LYS 77 76.969 -6.056 5.383 545 HB3 LYS 77 HB3 LYS 77 77.330 -5.977 3.669 546 HG2 LYS 77 HG2 LYS 77 79.675 -5.525 4.195 547 HG3 LYS 77 HG3 LYS 77 79.301 -5.633 5.916 548 HD2 LYS 77 HD2 LYS 77 78.600 -7.940 5.651 549 HD3 LYS 77 HD3 LYS 77 78.866 -7.840 3.910 550 HE2 LYS 77 HE2 LYS 77 80.993 -7.472 6.005 551 HE3 LYS 77 HE3 LYS 77 80.705 -8.967 5.116 552 HZ1 LYS 77 HZ1 LYS 77 81.186 -7.778 3.066 553 HZ2 LYS 77 HZ2 LYS 77 82.491 -7.735 4.124 554 HZ3 LYS 77 HZ3 LYS 77 81.556 -6.354 3.925 555 H GLU 78 H GLU 78 77.215 -4.055 2.152 556 HA GLU 78 HA GLU 78 79.710 -3.107 1.339 557 HB2 GLU 78 HB2 GLU 78 76.972 -3.025 0.161 558 HB3 GLU 78 HB3 GLU 78 78.281 -2.352 -0.760 559 HG2 GLU 78 HG2 GLU 78 78.060 -5.194 0.242 560 HG3 GLU 78 HG3 GLU 78 77.715 -4.653 -1.400 561 H ILE 79 H ILE 79 76.723 -1.392 1.890 562 HA ILE 79 HA ILE 79 77.655 1.188 1.362 563 HB ILE 79 HB ILE 79 75.368 0.241 3.073 564 HG12 ILE 79 HG12 ILE 79 75.105 -0.167 0.682 565 HG13 ILE 79 HG13 ILE 79 73.962 1.051 1.228 566 HG21 ILE 79 HG21 ILE 79 76.031 2.376 3.976 567 HG22 ILE 79 HG22 ILE 79 74.497 2.524 3.122 568 HG23 ILE 79 HG23 ILE 79 75.986 3.100 2.366 569 HD11 ILE 79 HD11 ILE 79 74.853 1.697 -0.891 570 HD12 ILE 79 HD12 ILE 79 76.502 1.510 -0.316 571 HD13 ILE 79 HD13 ILE 79 75.482 2.793 0.338 572 H LYS 80 H LYS 80 77.431 -0.580 4.436 573 HA LYS 80 HA LYS 80 78.143 1.686 5.951 574 HB2 LYS 80 HB2 LYS 80 77.961 0.318 7.885 575 HB3 LYS 80 HB3 LYS 80 76.794 -0.310 6.744 576 HG2 LYS 80 HG2 LYS 80 78.429 -2.084 6.169 577 HG3 LYS 80 HG3 LYS 80 79.405 -1.523 7.525 578 HD2 LYS 80 HD2 LYS 80 77.430 -1.793 9.016 579 HD3 LYS 80 HD3 LYS 80 76.553 -2.508 7.667 580 HE2 LYS 80 HE2 LYS 80 77.387 -4.281 9.016 581 HE3 LYS 80 HE3 LYS 80 78.344 -4.246 7.538 582 HZ1 LYS 80 HZ1 LYS 80 79.149 -3.128 10.163 583 HZ2 LYS 80 HZ2 LYS 80 80.082 -3.037 8.766 584 HZ3 LYS 80 HZ3 LYS 80 79.744 -4.532 9.457 585 H GLU 81 H GLU 81 80.008 -0.960 4.600 586 HA GLU 81 HA GLU 81 82.338 -0.250 6.031 587 HB2 GLU 81 HB2 GLU 81 82.089 -1.871 3.490 588 HB3 GLU 81 HB3 GLU 81 83.533 -1.777 4.496 589 HG2 GLU 81 HG2 GLU 81 82.240 -2.745 6.368 590 HG3 GLU 81 HG3 GLU 81 80.865 -2.917 5.295 591 H TRP 82 H TRP 82 81.005 0.609 2.942 592 HA TRP 82 HA TRP 82 83.198 2.030 1.824 593 HB2 TRP 82 HB2 TRP 82 80.974 1.295 0.729 594 HB3 TRP 82 HB3 TRP 82 80.341 2.736 1.552 595 HD1 TRP 82 HD1 TRP 82 82.842 1.810 -1.222 596 HE1 TRP 82 HE1 TRP 82 83.063 3.814 -2.796 597 HE3 TRP 82 HE3 TRP 82 80.028 5.194 1.382 598 HZ2 TRP 82 HZ2 TRP 82 82.166 6.475 -2.940 599 HZ3 TRP 82 HZ3 TRP 82 79.759 7.450 0.467 600 HH2 TRP 82 HH2 TRP 82 80.813 8.094 -1.650 601 H ARG 83 H ARG 83 80.378 2.961 3.668 602 HA ARG 83 HA ARG 83 80.672 5.738 3.687 603 HB2 ARG 83 HB2 ARG 83 78.703 4.099 4.473 604 HB3 ARG 83 HB3 ARG 83 79.626 4.241 5.977 605 HG2 ARG 83 HG2 ARG 83 77.926 5.795 6.187 606 HG3 ARG 83 HG3 ARG 83 79.469 6.585 5.837 607 HD2 ARG 83 HD2 ARG 83 78.816 7.073 3.586 608 HD3 ARG 83 HD3 ARG 83 77.329 6.125 3.764 609 HE ARG 83 HE ARG 83 77.158 7.880 5.777 610 HH11 ARG 83 HH11 ARG 83 77.420 8.391 2.234 611 HH12 ARG 83 HH12 ARG 83 76.807 9.977 2.351 612 HH21 ARG 83 HH21 ARG 83 76.281 10.069 5.796 613 HH22 ARG 83 HH22 ARG 83 76.172 10.924 4.327 614 H ALA 84 H ALA 84 81.650 3.216 6.016 615 HA ALA 84 HA ALA 84 82.870 4.966 7.864 616 HB1 ALA 84 HB1 ALA 84 83.336 2.014 7.457 617 HB2 ALA 84 HB2 ALA 84 82.063 2.723 8.451 618 HB3 ALA 84 HB3 ALA 84 83.755 2.956 8.890 619 H ALA 85 H ALA 85 84.089 3.100 5.142 620 HA ALA 85 HA ALA 85 86.822 3.496 5.503 621 HB1 ALA 85 HB1 ALA 85 85.858 1.896 3.911 622 HB2 ALA 85 HB2 ALA 85 87.056 2.946 3.164 623 HB3 ALA 85 HB3 ALA 85 85.338 3.243 2.894 624 H ASN 86 H ASN 86 84.472 5.406 3.687 625 HA ASN 86 HA ASN 86 86.329 7.424 2.876 626 HB2 ASN 86 HB2 ASN 86 84.087 7.102 1.802 627 HB3 ASN 86 HB3 ASN 86 83.334 7.708 3.273 628 HD21 ASN 86 HD21 ASN 86 84.668 8.561 0.287 629 HD22 ASN 86 HD22 ASN 86 84.730 10.257 0.527 630 H GLY 87 H GLY 87 84.189 6.985 5.604 631 HA2 GLY 87 HA2 GLY 87 84.718 7.817 7.767 632 HA3 GLY 87 HA3 GLY 87 85.529 9.190 7.009 633 H LYS 88 H LYS 88 82.318 7.806 6.187 634 HA LYS 88 HA LYS 88 81.147 10.377 6.690 635 HB2 LYS 88 HB2 LYS 88 80.669 8.040 4.895 636 HB3 LYS 88 HB3 LYS 88 79.490 9.302 5.135 637 HG2 LYS 88 HG2 LYS 88 81.093 10.922 4.180 638 HG3 LYS 88 HG3 LYS 88 82.270 9.622 4.006 639 HD2 LYS 88 HD2 LYS 88 80.834 8.470 2.438 640 HD3 LYS 88 HD3 LYS 88 79.564 9.665 2.659 641 HE2 LYS 88 HE2 LYS 88 82.306 10.192 1.539 642 HE3 LYS 88 HE3 LYS 88 80.852 10.043 0.571 643 HZ1 LYS 88 HZ1 LYS 88 81.342 12.338 0.911 644 HZ2 LYS 88 HZ2 LYS 88 81.510 12.164 2.548 645 HZ3 LYS 88 HZ3 LYS 88 79.978 12.005 1.839 646 HA PRO 89 HA PRO 89 78.934 8.304 9.986 647 HB2 PRO 89 HB2 PRO 89 76.460 9.511 9.734 648 HB3 PRO 89 HB3 PRO 89 77.839 10.248 10.555 649 HG2 PRO 89 HG2 PRO 89 76.843 10.685 7.769 650 HG3 PRO 89 HG3 PRO 89 77.446 11.871 8.939 651 HD2 PRO 89 HD2 PRO 89 78.967 10.996 6.912 652 HD3 PRO 89 HD3 PRO 89 79.670 11.346 8.506 653 H GLY 90 H GLY 90 77.961 6.424 10.137 654 HA2 GLY 90 HA2 GLY 90 76.690 5.378 7.716 655 HA3 GLY 90 HA3 GLY 90 77.451 4.414 8.978 656 H PHE 91 H PHE 91 75.791 3.146 9.497 657 HA PHE 91 HA PHE 91 73.124 4.170 9.740 658 HB2 PHE 91 HB2 PHE 91 74.240 1.436 10.351 659 HB3 PHE 91 HB3 PHE 91 72.532 1.860 10.368 660 HD1 PHE 91 HD1 PHE 91 71.633 2.931 8.192 661 HD2 PHE 91 HD2 PHE 91 75.163 0.583 8.421 662 HE1 PHE 91 HE1 PHE 91 71.493 2.494 5.793 663 HE2 PHE 91 HE2 PHE 91 75.023 0.143 5.996 664 HZ PHE 91 HZ PHE 91 73.193 1.096 4.691 665 H LYS 92 H LYS 92 71.919 4.286 11.516 666 HA LYS 92 HA LYS 92 73.382 4.835 13.930 667 HB2 LYS 92 HB2 LYS 92 71.899 6.500 14.015 668 HB3 LYS 92 HB3 LYS 92 71.018 5.801 12.685 669 HG2 LYS 92 HG2 LYS 92 69.658 4.544 14.094 670 HG3 LYS 92 HG3 LYS 92 70.587 4.942 15.535 671 HD2 LYS 92 HD2 LYS 92 69.918 7.321 15.201 672 HD3 LYS 92 HD3 LYS 92 68.981 6.810 13.789 673 HE2 LYS 92 HE2 LYS 92 67.682 5.334 15.200 674 HE3 LYS 92 HE3 LYS 92 68.618 5.880 16.588 675 HZ1 LYS 92 HZ1 LYS 92 66.407 7.032 16.287 676 HZ2 LYS 92 HZ2 LYS 92 67.019 7.783 14.908 677 HZ3 LYS 92 HZ3 LYS 92 67.727 8.045 16.413 678 H GLN 93 H GLN 93 72.525 4.223 15.928 679 HA GLN 93 HA GLN 93 72.162 1.386 16.209 680 HB2 GLN 93 HB2 GLN 93 72.369 3.725 17.931 681 HB3 GLN 93 HB3 GLN 93 72.418 2.072 18.564 682 HG2 GLN 93 HG2 GLN 93 74.506 1.693 17.410 683 HG3 GLN 93 HG3 GLN 93 74.307 3.255 16.587 684 HE21 GLN 93 HE21 GLN 93 73.438 4.750 18.770 685 HE22 GLN 93 HE22 GLN 93 74.753 4.975 19.827 686 H GLY 94 H GLY 94 70.162 0.609 16.577 687 HA2 GLY 94 HA2 GLY 94 68.391 1.430 18.486 688 HA3 GLY 94 HA3 GLY 94 67.841 2.180 16.986 Start of MODEL 21 1 H GLU 2 H GLU 2 61.530 2.128 7.167 2 HA GLU 2 HA GLU 2 59.401 3.990 6.355 3 HB2 GLU 2 HB2 GLU 2 59.511 3.335 8.787 4 HB3 GLU 2 HB3 GLU 2 61.167 3.911 8.803 5 HG2 GLU 2 HG2 GLU 2 60.276 6.138 8.081 6 HG3 GLU 2 HG3 GLU 2 58.662 5.499 8.405 7 H LEU 3 H LEU 3 60.217 6.014 5.710 8 HA LEU 3 HA LEU 3 63.025 5.915 4.956 9 HB2 LEU 3 HB2 LEU 3 60.812 7.714 4.038 10 HB3 LEU 3 HB3 LEU 3 62.457 7.744 3.435 11 HG LEU 3 HG LEU 3 60.457 5.531 3.110 12 HD11 LEU 3 HD11 LEU 3 61.817 7.327 1.097 13 HD12 LEU 3 HD12 LEU 3 60.150 7.475 1.639 14 HD13 LEU 3 HD13 LEU 3 60.654 6.049 0.726 15 HD21 LEU 3 HD21 LEU 3 62.208 4.413 1.801 16 HD22 LEU 3 HD22 LEU 3 62.625 4.620 3.514 17 HD23 LEU 3 HD23 LEU 3 63.344 5.672 2.311 18 H LYS 4 H LYS 4 64.417 7.329 5.683 19 HA LYS 4 HA LYS 4 63.546 9.379 7.562 20 HB2 LYS 4 HB2 LYS 4 66.344 8.449 6.881 21 HB3 LYS 4 HB3 LYS 4 65.876 9.415 8.283 22 HG2 LYS 4 HG2 LYS 4 65.541 6.513 7.685 23 HG3 LYS 4 HG3 LYS 4 66.360 7.244 9.044 24 HD2 LYS 4 HD2 LYS 4 63.948 8.157 9.519 25 HD3 LYS 4 HD3 LYS 4 63.545 6.818 8.455 26 HE2 LYS 4 HE2 LYS 4 64.837 5.235 9.798 27 HE3 LYS 4 HE3 LYS 4 65.259 6.512 10.887 28 HZ1 LYS 4 HZ1 LYS 4 62.388 6.136 10.596 29 HZ2 LYS 4 HZ2 LYS 4 63.319 6.395 11.996 30 HZ3 LYS 4 HZ3 LYS 4 63.231 4.873 11.276 31 H ASN 5 H ASN 5 65.767 11.078 7.131 32 HA ASN 5 HA ASN 5 65.424 11.863 4.315 33 HB2 ASN 5 HB2 ASN 5 66.039 13.651 6.683 34 HB3 ASN 5 HB3 ASN 5 65.984 14.184 5.011 35 HD21 ASN 5 HD21 ASN 5 63.639 12.415 4.463 36 HD22 ASN 5 HD22 ASN 5 62.291 13.197 5.167 37 H SER 6 H SER 6 67.637 11.201 6.892 38 HA SER 6 HA SER 6 69.756 11.224 4.920 39 HB2 SER 6 HB2 SER 6 71.298 11.983 6.675 40 HB3 SER 6 HB3 SER 6 70.083 13.199 6.269 41 HG SER 6 HG SER 6 69.506 13.179 8.257 42 H ILE 7 H ILE 7 71.610 9.910 5.729 43 HA ILE 7 HA ILE 7 70.698 7.289 6.327 44 HB ILE 7 HB ILE 7 72.642 7.920 4.860 45 HG12 ILE 7 HG12 ILE 7 74.126 6.029 5.596 46 HG13 ILE 7 HG13 ILE 7 73.111 5.888 7.030 47 HG21 ILE 7 HG21 ILE 7 74.851 8.261 5.881 48 HG22 ILE 7 HG22 ILE 7 74.080 8.361 7.464 49 HG23 ILE 7 HG23 ILE 7 73.724 9.572 6.233 50 HD11 ILE 7 HD11 ILE 7 72.532 4.302 5.272 51 HD12 ILE 7 HD12 ILE 7 72.131 5.643 4.199 52 HD13 ILE 7 HD13 ILE 7 71.194 5.373 5.670 53 H SER 8 H SER 8 71.459 9.917 8.299 54 HA SER 8 HA SER 8 72.840 8.536 10.367 55 HB2 SER 8 HB2 SER 8 71.752 11.341 10.212 56 HB3 SER 8 HB3 SER 8 72.820 10.728 11.484 57 HG SER 8 HG SER 8 74.319 10.241 9.864 58 H ASP 9 H ASP 9 69.607 8.762 9.576 59 HA ASP 9 HA ASP 9 68.840 8.332 12.402 60 HB2 ASP 9 HB2 ASP 9 67.630 10.120 10.800 61 HB3 ASP 9 HB3 ASP 9 66.865 8.701 10.202 62 H TYR 10 H TYR 10 69.896 6.658 9.978 63 HA TYR 10 HA TYR 10 67.733 4.714 9.791 64 HB2 TYR 10 HB2 TYR 10 70.015 5.393 8.021 65 HB3 TYR 10 HB3 TYR 10 69.582 3.697 8.117 66 HD1 TYR 10 HD1 TYR 10 67.254 3.007 7.485 67 HD2 TYR 10 HD2 TYR 10 68.741 6.912 6.713 68 HE1 TYR 10 HE1 TYR 10 65.465 3.350 5.814 69 HE2 TYR 10 HE2 TYR 10 66.951 7.250 5.042 70 HH TYR 10 HH TYR 10 65.407 6.016 3.688 71 H THR 11 H THR 11 67.828 3.177 11.313 72 HA THR 11 HA THR 11 70.365 2.203 12.221 73 HB THR 11 HB THR 11 69.067 0.367 13.236 74 HG1 THR 11 HG1 THR 11 66.655 0.551 12.913 75 HG21 THR 11 HG21 THR 11 67.489 1.612 14.677 76 HG22 THR 11 HG22 THR 11 67.655 3.011 13.611 77 HG23 THR 11 HG23 THR 11 69.046 2.421 14.521 78 H GLU 12 H GLU 12 71.088 0.037 11.492 79 HA GLU 12 HA GLU 12 70.852 -0.090 8.735 80 HB2 GLU 12 HB2 GLU 12 72.045 -2.290 8.927 81 HB3 GLU 12 HB3 GLU 12 72.851 -0.895 9.620 82 HG2 GLU 12 HG2 GLU 12 71.984 -1.576 11.832 83 HG3 GLU 12 HG3 GLU 12 71.373 -3.056 11.099 84 H ALA 13 H ALA 13 68.922 -1.688 11.171 85 HA ALA 13 HA ALA 13 67.596 -3.448 9.320 86 HB1 ALA 13 HB1 ALA 13 67.578 -3.864 11.760 87 HB2 ALA 13 HB2 ALA 13 65.948 -3.787 11.087 88 HB3 ALA 13 HB3 ALA 13 66.597 -2.415 11.984 89 H GLU 14 H GLU 14 66.845 -0.119 10.480 90 HA GLU 14 HA GLU 14 64.384 0.250 9.148 91 HB2 GLU 14 HB2 GLU 14 66.683 2.147 9.651 92 HB3 GLU 14 HB3 GLU 14 65.234 2.733 8.885 93 HG2 GLU 14 HG2 GLU 14 65.431 1.525 11.643 94 HG3 GLU 14 HG3 GLU 14 65.383 3.245 11.281 95 H PHE 15 H PHE 15 67.671 0.418 8.149 96 HA PHE 15 HA PHE 15 67.200 1.316 5.525 97 HB2 PHE 15 HB2 PHE 15 69.382 1.419 6.947 98 HB3 PHE 15 HB3 PHE 15 69.589 -0.223 6.410 99 HD1 PHE 15 HD1 PHE 15 68.826 3.104 4.968 100 HD2 PHE 15 HD2 PHE 15 70.773 -0.621 4.572 101 HE1 PHE 15 HE1 PHE 15 69.864 3.872 2.876 102 HE2 PHE 15 HE2 PHE 15 71.815 0.139 2.476 103 HZ PHE 15 HZ PHE 15 71.350 2.389 1.645 104 H VAL 16 H VAL 16 67.954 -1.930 6.908 105 HA VAL 16 HA VAL 16 67.885 -3.173 4.409 106 HB VAL 16 HB VAL 16 67.941 -5.277 5.360 107 HG11 VAL 16 HG11 VAL 16 69.883 -4.179 5.688 108 HG12 VAL 16 HG12 VAL 16 69.610 -5.318 7.017 109 HG13 VAL 16 HG13 VAL 16 69.388 -3.577 7.267 110 HG21 VAL 16 HG21 VAL 16 67.463 -5.792 7.715 111 HG22 VAL 16 HG22 VAL 16 66.129 -5.413 6.628 112 HG23 VAL 16 HG23 VAL 16 66.656 -4.190 7.804 113 H GLN 17 H GLN 17 65.279 -2.378 6.598 114 HA GLN 17 HA GLN 17 63.316 -3.972 5.448 115 HB2 GLN 17 HB2 GLN 17 63.225 -2.449 7.530 116 HB3 GLN 17 HB3 GLN 17 62.851 -1.161 6.386 117 HG2 GLN 17 HG2 GLN 17 61.088 -2.744 5.502 118 HG3 GLN 17 HG3 GLN 17 61.345 -3.607 7.028 119 HE21 GLN 17 HE21 GLN 17 60.120 -0.772 5.519 120 HE22 GLN 17 HE22 GLN 17 59.281 -0.155 6.908 121 H LEU 18 H LEU 18 64.390 -0.673 4.799 122 HA LEU 18 HA LEU 18 62.787 -0.077 2.598 123 HB2 LEU 18 HB2 LEU 18 64.018 1.538 3.901 124 HB3 LEU 18 HB3 LEU 18 65.528 0.945 3.448 125 HG LEU 18 HG LEU 18 64.774 3.125 2.339 126 HD11 LEU 18 HD11 LEU 18 65.914 2.611 0.259 127 HD12 LEU 18 HD12 LEU 18 65.810 0.890 0.639 128 HD13 LEU 18 HD13 LEU 18 66.764 1.963 1.664 129 HD21 LEU 18 HD21 LEU 18 63.286 1.181 0.586 130 HD22 LEU 18 HD22 LEU 18 63.504 2.907 0.281 131 HD23 LEU 18 HD23 LEU 18 62.542 2.363 1.661 132 H LEU 19 H LEU 19 65.931 -1.410 2.831 133 HA LEU 19 HA LEU 19 66.624 -1.861 0.158 134 HB2 LEU 19 HB2 LEU 19 67.095 -3.245 2.646 135 HB3 LEU 19 HB3 LEU 19 67.960 -3.748 1.167 136 HG LEU 19 HG LEU 19 68.120 -1.227 2.793 137 HD11 LEU 19 HD11 LEU 19 70.514 -1.682 2.526 138 HD12 LEU 19 HD12 LEU 19 70.042 -3.254 1.848 139 HD13 LEU 19 HD13 LEU 19 69.602 -2.834 3.500 140 HD21 LEU 19 HD21 LEU 19 69.081 -1.600 -0.013 141 HD22 LEU 19 HD22 LEU 19 69.582 -0.306 1.089 142 HD23 LEU 19 HD23 LEU 19 67.893 -0.420 0.583 143 H LYS 20 H LYS 20 64.823 -3.955 2.386 144 HA LYS 20 HA LYS 20 64.378 -6.039 0.524 145 HB2 LYS 20 HB2 LYS 20 62.850 -5.303 3.012 146 HB3 LYS 20 HB3 LYS 20 62.568 -6.750 2.049 147 HG2 LYS 20 HG2 LYS 20 64.931 -7.426 2.512 148 HG3 LYS 20 HG3 LYS 20 65.055 -6.020 3.531 149 HD2 LYS 20 HD2 LYS 20 63.330 -6.728 5.020 150 HD3 LYS 20 HD3 LYS 20 62.943 -8.110 4.001 151 HE2 LYS 20 HE2 LYS 20 65.613 -7.707 5.331 152 HE3 LYS 20 HE3 LYS 20 64.297 -8.623 6.055 153 HZ1 LYS 20 HZ1 LYS 20 64.376 -10.177 4.271 154 HZ2 LYS 20 HZ2 LYS 20 65.942 -10.013 4.879 155 HZ3 LYS 20 HZ3 LYS 20 65.521 -9.300 3.417 156 H GLU 21 H GLU 21 62.635 -3.144 1.387 157 HA GLU 21 HA GLU 21 60.408 -3.701 -0.203 158 HB2 GLU 21 HB2 GLU 21 61.506 -1.063 0.757 159 HB3 GLU 21 HB3 GLU 21 59.953 -1.255 -0.051 160 HG2 GLU 21 HG2 GLU 21 59.209 -2.743 1.746 161 HG3 GLU 21 HG3 GLU 21 60.756 -2.522 2.557 162 H ILE 22 H ILE 22 63.458 -2.108 -0.884 163 HA ILE 22 HA ILE 22 62.872 -1.315 -3.519 164 HB ILE 22 HB ILE 22 65.581 -2.292 -2.555 165 HG12 ILE 22 HG12 ILE 22 64.379 0.496 -2.415 166 HG13 ILE 22 HG13 ILE 22 64.808 -0.538 -1.073 167 HG21 ILE 22 HG21 ILE 22 65.391 -2.097 -4.967 168 HG22 ILE 22 HG22 ILE 22 66.439 -0.829 -4.331 169 HG23 ILE 22 HG23 ILE 22 64.784 -0.450 -4.805 170 HD11 ILE 22 HD11 ILE 22 66.456 1.208 -1.417 171 HD12 ILE 22 HD12 ILE 22 66.759 0.607 -3.047 172 HD13 ILE 22 HD13 ILE 22 67.152 -0.395 -1.651 173 H GLU 23 H GLU 23 64.167 -4.334 -2.196 174 HA GLU 23 HA GLU 23 64.570 -5.855 -4.454 175 HB2 GLU 23 HB2 GLU 23 65.363 -6.590 -2.407 176 HB3 GLU 23 HB3 GLU 23 63.871 -6.190 -1.586 177 HG2 GLU 23 HG2 GLU 23 63.740 -8.332 -1.496 178 HG3 GLU 23 HG3 GLU 23 62.938 -8.137 -3.030 179 H LYS 24 H LYS 24 61.760 -5.409 -2.407 180 HA LYS 24 HA LYS 24 60.027 -7.255 -3.598 181 HB2 LYS 24 HB2 LYS 24 59.954 -6.188 -1.279 182 HB3 LYS 24 HB3 LYS 24 59.313 -4.774 -2.107 183 HG2 LYS 24 HG2 LYS 24 57.310 -5.871 -2.680 184 HG3 LYS 24 HG3 LYS 24 58.029 -7.445 -2.284 185 HD2 LYS 24 HD2 LYS 24 56.429 -6.665 -0.535 186 HD3 LYS 24 HD3 LYS 24 58.056 -6.933 0.064 187 HE2 LYS 24 HE2 LYS 24 57.185 -4.896 1.046 188 HE3 LYS 24 HE3 LYS 24 58.464 -4.486 -0.079 189 HZ1 LYS 24 HZ1 LYS 24 56.523 -3.040 -0.221 190 HZ2 LYS 24 HZ2 LYS 24 55.572 -4.322 -0.773 191 HZ3 LYS 24 HZ3 LYS 24 56.893 -3.776 -1.669 192 H GLU 25 H GLU 25 60.169 -3.693 -3.840 193 HA GLU 25 HA GLU 25 58.179 -3.544 -5.785 194 HB2 GLU 25 HB2 GLU 25 60.187 -1.573 -4.702 195 HB3 GLU 25 HB3 GLU 25 59.189 -1.203 -6.067 196 HG2 GLU 25 HG2 GLU 25 58.264 -0.368 -3.949 197 HG3 GLU 25 HG3 GLU 25 57.188 -1.425 -4.863 198 H ASN 26 H ASN 26 61.584 -4.055 -5.998 199 HA ASN 26 HA ASN 26 61.874 -3.400 -8.745 200 HB2 ASN 26 HB2 ASN 26 63.842 -3.504 -7.329 201 HB3 ASN 26 HB3 ASN 26 63.523 -5.185 -6.944 202 HD21 ASN 26 HD21 ASN 26 64.699 -2.967 -9.364 203 HD22 ASN 26 HD22 ASN 26 65.458 -4.164 -10.344 204 H VAL 27 H VAL 27 61.414 -6.502 -7.049 205 HA VAL 27 HA VAL 27 61.267 -7.866 -9.564 206 HB VAL 27 HB VAL 27 60.778 -9.919 -8.316 207 HG11 VAL 27 HG11 VAL 27 62.891 -10.062 -7.102 208 HG12 VAL 27 HG12 VAL 27 63.021 -8.305 -7.130 209 HG13 VAL 27 HG13 VAL 27 63.083 -9.214 -8.637 210 HG21 VAL 27 HG21 VAL 27 60.742 -9.924 -5.860 211 HG22 VAL 27 HG22 VAL 27 59.403 -8.976 -6.513 212 HG23 VAL 27 HG23 VAL 27 60.825 -8.163 -5.857 213 H ALA 28 H ALA 28 59.024 -6.178 -7.767 214 HA ALA 28 HA ALA 28 56.750 -7.538 -8.988 215 HB1 ALA 28 HB1 ALA 28 56.537 -6.753 -6.680 216 HB2 ALA 28 HB2 ALA 28 55.392 -5.919 -7.736 217 HB3 ALA 28 HB3 ALA 28 56.864 -5.104 -7.208 218 H ALA 29 H ALA 29 58.903 -5.001 -9.563 219 HA ALA 29 HA ALA 29 59.098 -3.296 -10.908 220 HB1 ALA 29 HB1 ALA 29 58.414 -3.528 -13.219 221 HB2 ALA 29 HB2 ALA 29 57.267 -4.794 -12.788 222 HB3 ALA 29 HB3 ALA 29 59.004 -5.080 -12.622 223 H THR 30 H THR 30 58.063 -1.998 -9.404 224 HA THR 30 HA THR 30 55.295 -1.249 -9.950 225 HB THR 30 HB THR 30 55.500 0.039 -7.847 226 HG1 THR 30 HG1 THR 30 57.616 -0.702 -6.753 227 HG21 THR 30 HG21 THR 30 54.901 -2.363 -7.789 228 HG22 THR 30 HG22 THR 30 55.812 -1.850 -6.357 229 HG23 THR 30 HG23 THR 30 56.628 -2.728 -7.654 230 H ASP 31 H ASP 31 58.530 -0.202 -10.353 231 HA ASP 31 HA ASP 31 59.584 1.426 -11.229 232 HB2 ASP 31 HB2 ASP 31 57.017 2.177 -12.578 233 HB3 ASP 31 HB3 ASP 31 58.651 2.756 -12.927 234 H ASP 32 H ASP 32 56.512 2.958 -10.375 235 HA ASP 32 HA ASP 32 57.792 5.455 -10.030 236 HB2 ASP 32 HB2 ASP 32 55.756 6.304 -9.099 237 HB3 ASP 32 HB3 ASP 32 55.365 5.301 -10.498 238 H VAL 33 H VAL 33 56.767 3.083 -7.648 239 HA VAL 33 HA VAL 33 57.903 4.782 -5.582 240 HB VAL 33 HB VAL 33 55.909 3.660 -4.996 241 HG11 VAL 33 HG11 VAL 33 56.005 1.646 -6.281 242 HG12 VAL 33 HG12 VAL 33 55.800 1.204 -4.582 243 HG13 VAL 33 HG13 VAL 33 57.385 1.073 -5.350 244 HG21 VAL 33 HG21 VAL 33 57.339 4.162 -3.145 245 HG22 VAL 33 HG22 VAL 33 58.212 2.644 -3.352 246 HG23 VAL 33 HG23 VAL 33 56.531 2.628 -2.818 247 H LEU 34 H LEU 34 58.664 2.031 -7.311 248 HA LEU 34 HA LEU 34 60.975 1.103 -5.978 249 HB2 LEU 34 HB2 LEU 34 59.693 0.054 -7.981 250 HB3 LEU 34 HB3 LEU 34 60.452 1.288 -8.902 251 HG LEU 34 HG LEU 34 61.434 -1.128 -8.893 252 HD11 LEU 34 HD11 LEU 34 63.556 -0.209 -9.554 253 HD12 LEU 34 HD12 LEU 34 63.032 1.374 -8.925 254 HD13 LEU 34 HD13 LEU 34 62.155 0.605 -10.256 255 HD21 LEU 34 HD21 LEU 34 63.378 -1.314 -7.418 256 HD22 LEU 34 HD22 LEU 34 61.878 -1.248 -6.492 257 HD23 LEU 34 HD23 LEU 34 62.908 0.180 -6.610 258 H ASP 35 H ASP 35 60.514 3.644 -8.373 259 HA ASP 35 HA ASP 35 63.241 4.356 -8.481 260 HB2 ASP 35 HB2 ASP 35 61.669 5.036 -10.252 261 HB3 ASP 35 HB3 ASP 35 60.856 6.088 -9.110 262 H VAL 36 H VAL 36 60.638 5.376 -6.481 263 HA VAL 36 HA VAL 36 61.769 7.584 -5.180 264 HB VAL 36 HB VAL 36 60.114 5.366 -3.956 265 HG11 VAL 36 HG11 VAL 36 59.512 7.017 -2.327 266 HG12 VAL 36 HG12 VAL 36 60.576 8.181 -3.185 267 HG13 VAL 36 HG13 VAL 36 61.279 6.744 -2.406 268 HG21 VAL 36 HG21 VAL 36 59.177 6.327 -5.818 269 HG22 VAL 36 HG22 VAL 36 59.353 7.962 -5.063 270 HG23 VAL 36 HG23 VAL 36 58.313 6.689 -4.307 271 H LEU 37 H LEU 37 61.854 4.204 -4.549 272 HA LEU 37 HA LEU 37 63.340 4.362 -2.187 273 HB2 LEU 37 HB2 LEU 37 63.188 1.987 -3.980 274 HB3 LEU 37 HB3 LEU 37 63.435 2.166 -2.248 275 HG LEU 37 HG LEU 37 60.820 2.732 -3.578 276 HD11 LEU 37 HD11 LEU 37 61.307 0.379 -3.701 277 HD12 LEU 37 HD12 LEU 37 60.018 0.693 -2.538 278 HD13 LEU 37 HD13 LEU 37 61.649 0.336 -1.971 279 HD21 LEU 37 HD21 LEU 37 61.179 4.031 -1.535 280 HD22 LEU 37 HD22 LEU 37 61.549 2.550 -0.650 281 HD23 LEU 37 HD23 LEU 37 59.930 2.811 -1.300 282 H LEU 38 H LEU 38 64.115 3.620 -5.505 283 HA LEU 38 HA LEU 38 66.821 2.975 -5.239 284 HB2 LEU 38 HB2 LEU 38 65.168 4.188 -7.349 285 HB3 LEU 38 HB3 LEU 38 66.876 3.916 -7.671 286 HG LEU 38 HG LEU 38 64.543 2.066 -7.403 287 HD11 LEU 38 HD11 LEU 38 66.798 2.352 -9.327 288 HD12 LEU 38 HD12 LEU 38 65.131 2.898 -9.566 289 HD13 LEU 38 HD13 LEU 38 65.500 1.166 -9.471 290 HD21 LEU 38 HD21 LEU 38 67.424 1.197 -7.163 291 HD22 LEU 38 HD22 LEU 38 66.030 0.138 -7.365 292 HD23 LEU 38 HD23 LEU 38 66.199 1.092 -5.894 293 H GLU 39 H GLU 39 65.314 6.062 -5.931 294 HA GLU 39 HA GLU 39 67.724 7.539 -5.994 295 HB2 GLU 39 HB2 GLU 39 64.848 8.204 -5.613 296 HB3 GLU 39 HB3 GLU 39 66.105 9.417 -5.520 297 HG2 GLU 39 HG2 GLU 39 65.539 7.654 -7.902 298 HG3 GLU 39 HG3 GLU 39 64.957 9.309 -7.677 299 H HIS 40 H HIS 40 65.370 6.813 -3.514 300 HA HIS 40 HA HIS 40 66.351 8.647 -1.666 301 HB2 HIS 40 HB2 HIS 40 64.144 7.717 -1.579 302 HB3 HIS 40 HB3 HIS 40 64.678 6.136 -1.207 303 HD1 HIS 40 HD1 HIS 40 63.988 9.431 0.365 304 HD2 HIS 40 HD2 HIS 40 65.816 5.862 1.424 305 HE1 HIS 40 HE1 HIS 40 64.288 9.514 2.847 306 H PHE 41 H PHE 41 66.886 5.257 -2.145 307 HA PHE 41 HA PHE 41 68.603 4.697 -0.082 308 HB2 PHE 41 HB2 PHE 41 67.713 2.970 -1.318 309 HB3 PHE 41 HB3 PHE 41 68.184 3.701 -2.843 310 HD1 PHE 41 HD1 PHE 41 69.488 2.086 0.226 311 HD2 PHE 41 HD2 PHE 41 70.196 2.960 -3.859 312 HE1 PHE 41 HE1 PHE 41 71.488 0.647 0.267 313 HE2 PHE 41 HE2 PHE 41 72.193 1.535 -3.808 314 HZ PHE 41 HZ PHE 41 72.836 0.375 -1.755 315 H VAL 42 H VAL 42 69.433 5.770 -3.378 316 HA VAL 42 HA VAL 42 72.161 5.986 -2.692 317 HB VAL 42 HB VAL 42 71.456 5.551 -4.990 318 HG11 VAL 42 HG11 VAL 42 69.581 6.734 -5.187 319 HG12 VAL 42 HG12 VAL 42 70.739 7.081 -6.466 320 HG13 VAL 42 HG13 VAL 42 70.458 8.292 -5.172 321 HG21 VAL 42 HG21 VAL 42 73.099 8.055 -4.750 322 HG22 VAL 42 HG22 VAL 42 73.066 6.996 -6.156 323 HG23 VAL 42 HG23 VAL 42 73.716 6.413 -4.622 324 H LYS 43 H LYS 43 69.637 8.287 -2.521 325 HA LYS 43 HA LYS 43 71.416 10.551 -2.207 326 HB2 LYS 43 HB2 LYS 43 69.531 11.904 -1.649 327 HB3 LYS 43 HB3 LYS 43 68.938 10.754 -2.838 328 HG2 LYS 43 HG2 LYS 43 68.066 9.366 -0.857 329 HG3 LYS 43 HG3 LYS 43 68.524 10.721 0.126 330 HD2 LYS 43 HD2 LYS 43 66.612 11.015 -2.169 331 HD3 LYS 43 HD3 LYS 43 66.100 10.667 -0.519 332 HE2 LYS 43 HE2 LYS 43 67.204 12.733 0.227 333 HE3 LYS 43 HE3 LYS 43 67.657 13.079 -1.440 334 HZ1 LYS 43 HZ1 LYS 43 64.875 12.826 -0.434 335 HZ2 LYS 43 HZ2 LYS 43 65.315 13.199 -2.018 336 HZ3 LYS 43 HZ3 LYS 43 65.650 14.279 -0.776 337 H ILE 44 H ILE 44 70.062 8.323 0.097 338 HA ILE 44 HA ILE 44 71.017 9.924 2.311 339 HB ILE 44 HB ILE 44 70.275 7.989 3.729 340 HG12 ILE 44 HG12 ILE 44 69.345 6.907 1.060 341 HG13 ILE 44 HG13 ILE 44 70.575 6.193 2.079 342 HG21 ILE 44 HG21 ILE 44 68.241 9.126 1.815 343 HG22 ILE 44 HG22 ILE 44 68.804 9.880 3.305 344 HG23 ILE 44 HG23 ILE 44 67.874 8.382 3.368 345 HD11 ILE 44 HD11 ILE 44 68.901 5.677 3.745 346 HD12 ILE 44 HD12 ILE 44 68.414 5.031 2.166 347 HD13 ILE 44 HD13 ILE 44 67.682 6.500 2.786 348 H THR 45 H THR 45 72.105 7.132 0.521 349 HA THR 45 HA THR 45 74.243 6.602 2.391 350 HB THR 45 HB THR 45 74.922 4.881 0.746 351 HG1 THR 45 HG1 THR 45 72.578 5.291 -0.719 352 HG21 THR 45 HG21 THR 45 72.991 3.466 0.998 353 HG22 THR 45 HG22 THR 45 71.965 4.865 1.290 354 HG23 THR 45 HG23 THR 45 73.197 4.419 2.472 355 H GLU 46 H GLU 46 73.742 8.030 -0.754 356 HA GLU 46 HA GLU 46 74.859 9.242 -2.157 357 HB2 GLU 46 HB2 GLU 46 76.535 9.811 0.248 358 HB3 GLU 46 HB3 GLU 46 76.637 10.756 -1.256 359 HG2 GLU 46 HG2 GLU 46 74.246 11.291 -0.932 360 HG3 GLU 46 HG3 GLU 46 74.296 10.407 0.579 361 H HIS 47 H HIS 47 75.407 6.535 -1.713 362 HA HIS 47 HA HIS 47 78.143 5.961 -2.140 363 HB2 HIS 47 HB2 HIS 47 76.324 4.356 -1.290 364 HB3 HIS 47 HB3 HIS 47 75.772 4.249 -2.956 365 HD1 HIS 47 HD1 HIS 47 77.042 2.531 -4.457 366 HD2 HIS 47 HD2 HIS 47 78.894 3.299 -0.825 367 HE1 HIS 47 HE1 HIS 47 79.017 1.005 -4.332 368 HA PRO 48 HA PRO 48 78.094 7.371 -6.441 369 HB2 PRO 48 HB2 PRO 48 80.353 5.666 -6.932 370 HB3 PRO 48 HB3 PRO 48 80.253 7.419 -6.938 371 HG2 PRO 48 HG2 PRO 48 81.552 5.909 -5.125 372 HG3 PRO 48 HG3 PRO 48 80.835 7.479 -4.642 373 HD2 PRO 48 HD2 PRO 48 79.887 4.674 -4.246 374 HD3 PRO 48 HD3 PRO 48 79.775 6.034 -3.133 375 H ASP 49 H ASP 49 77.300 4.434 -5.556 376 HA ASP 49 HA ASP 49 77.189 3.641 -8.196 377 HB2 ASP 49 HB2 ASP 49 79.167 2.749 -7.507 378 HB3 ASP 49 HB3 ASP 49 78.531 1.931 -6.065 379 H GLY 50 H GLY 50 75.452 4.653 -6.286 380 HA2 GLY 50 HA2 GLY 50 74.048 3.147 -4.364 381 HA3 GLY 50 HA3 GLY 50 73.403 4.471 -5.310 382 H THR 51 H THR 51 72.986 3.718 -7.601 383 HA THR 51 HA THR 51 71.354 1.576 -6.879 384 HB THR 51 HB THR 51 70.255 1.897 -9.223 385 HG1 THR 51 HG1 THR 51 71.364 3.586 -10.004 386 HG21 THR 51 HG21 THR 51 68.596 3.214 -8.008 387 HG22 THR 51 HG22 THR 51 69.795 3.546 -6.742 388 HG23 THR 51 HG23 THR 51 69.260 1.899 -7.046 389 H ALA 52 H ALA 52 74.290 1.686 -8.461 390 HA ALA 52 HA ALA 52 73.670 -0.641 -9.986 391 HB1 ALA 52 HB1 ALA 52 76.043 -0.827 -10.314 392 HB2 ALA 52 HB2 ALA 52 76.343 0.380 -9.064 393 HB3 ALA 52 HB3 ALA 52 75.555 0.847 -10.574 394 H LEU 53 H LEU 53 74.619 0.042 -6.698 395 HA LEU 53 HA LEU 53 75.111 -2.603 -5.928 396 HB2 LEU 53 HB2 LEU 53 73.897 -0.362 -4.326 397 HB3 LEU 53 HB3 LEU 53 74.256 -1.939 -3.675 398 HG LEU 53 HG LEU 53 76.240 0.074 -4.707 399 HD11 LEU 53 HD11 LEU 53 75.714 -1.094 -1.996 400 HD12 LEU 53 HD12 LEU 53 75.315 0.539 -2.537 401 HD13 LEU 53 HD13 LEU 53 77.001 0.041 -2.408 402 HD21 LEU 53 HD21 LEU 53 76.688 -2.724 -3.669 403 HD22 LEU 53 HD22 LEU 53 77.943 -1.529 -3.992 404 HD23 LEU 53 HD23 LEU 53 76.976 -2.164 -5.319 405 H ILE 54 H ILE 54 72.112 -0.848 -6.261 406 HA ILE 54 HA ILE 54 70.554 -2.945 -5.124 407 HB ILE 54 HB ILE 54 69.672 -0.711 -6.978 408 HG12 ILE 54 HG12 ILE 54 70.300 0.211 -4.826 409 HG13 ILE 54 HG13 ILE 54 68.539 0.122 -4.839 410 HG21 ILE 54 HG21 ILE 54 67.936 -2.691 -5.522 411 HG22 ILE 54 HG22 ILE 54 68.158 -2.569 -7.267 412 HG23 ILE 54 HG23 ILE 54 67.358 -1.265 -6.385 413 HD11 ILE 54 HD11 ILE 54 68.604 -1.909 -3.595 414 HD12 ILE 54 HD12 ILE 54 69.355 -0.540 -2.762 415 HD13 ILE 54 HD13 ILE 54 70.370 -1.786 -3.508 416 H TYR 55 H TYR 55 71.329 -1.928 -8.363 417 HA TYR 55 HA TYR 55 69.784 -3.773 -9.712 418 HB2 TYR 55 HB2 TYR 55 71.964 -1.927 -10.413 419 HB3 TYR 55 HB3 TYR 55 71.504 -3.124 -11.600 420 HD1 TYR 55 HD1 TYR 55 69.653 -0.938 -9.196 421 HD2 TYR 55 HD2 TYR 55 70.088 -2.166 -13.237 422 HE1 TYR 55 HE1 TYR 55 67.811 0.502 -9.793 423 HE2 TYR 55 HE2 TYR 55 68.216 -0.703 -13.880 424 HH TYR 55 HH TYR 55 67.063 1.714 -11.895 425 H GLU 56 H GLU 56 73.249 -3.872 -8.847 426 HA GLU 56 HA GLU 56 73.621 -6.385 -10.061 427 HB2 GLU 56 HB2 GLU 56 75.706 -6.589 -8.748 428 HB3 GLU 56 HB3 GLU 56 75.609 -5.066 -9.625 429 HG2 GLU 56 HG2 GLU 56 75.242 -3.863 -7.697 430 HG3 GLU 56 HG3 GLU 56 74.864 -5.266 -6.724 431 H ALA 57 H ALA 57 72.542 -5.394 -6.889 432 HA ALA 57 HA ALA 57 72.821 -7.809 -5.530 433 HB1 ALA 57 HB1 ALA 57 71.079 -7.035 -4.039 434 HB2 ALA 57 HB2 ALA 57 70.601 -5.807 -5.215 435 HB3 ALA 57 HB3 ALA 57 72.188 -5.725 -4.447 436 H ALA 58 H ALA 58 70.183 -6.652 -7.554 437 HA ALA 58 HA ALA 58 68.456 -8.816 -7.203 438 HB1 ALA 58 HB1 ALA 58 67.778 -6.729 -8.294 439 HB2 ALA 58 HB2 ALA 58 67.420 -8.123 -9.315 440 HB3 ALA 58 HB3 ALA 58 68.824 -7.108 -9.663 441 H ALA 59 H ALA 59 71.039 -8.329 -9.553 442 HA ALA 59 HA ALA 59 70.702 -10.816 -10.913 443 HB1 ALA 59 HB1 ALA 59 73.168 -9.076 -10.750 444 HB2 ALA 59 HB2 ALA 59 71.855 -8.869 -11.906 445 HB3 ALA 59 HB3 ALA 59 72.850 -10.324 -11.957 446 H ARG 60 H ARG 60 72.805 -9.740 -8.328 447 HA ARG 60 HA ARG 60 74.310 -12.096 -7.965 448 HB2 ARG 60 HB2 ARG 60 73.607 -9.853 -6.082 449 HB3 ARG 60 HB3 ARG 60 74.693 -11.163 -5.635 450 HG2 ARG 60 HG2 ARG 60 76.278 -10.472 -7.278 451 HG3 ARG 60 HG3 ARG 60 75.134 -9.318 -7.970 452 HD2 ARG 60 HD2 ARG 60 76.764 -8.159 -6.572 453 HD3 ARG 60 HD3 ARG 60 75.156 -8.046 -5.878 454 HE ARG 60 HE ARG 60 76.394 -10.230 -4.715 455 HH11 ARG 60 HH11 ARG 60 77.070 -6.733 -4.887 456 HH12 ARG 60 HH12 ARG 60 77.691 -6.670 -3.295 457 HH21 ARG 60 HH21 ARG 60 77.380 -10.087 -2.542 458 HH22 ARG 60 HH22 ARG 60 77.898 -8.566 -1.989 459 H ALA 61 H ALA 61 71.227 -11.034 -6.636 460 HA ALA 61 HA ALA 61 70.966 -13.164 -4.769 461 HB1 ALA 61 HB1 ALA 61 68.686 -12.369 -4.495 462 HB2 ALA 61 HB2 ALA 61 68.875 -11.321 -5.905 463 HB3 ALA 61 HB3 ALA 61 69.837 -11.032 -4.454 464 H ALA 62 H ALA 62 70.085 -12.701 -8.106 465 HA ALA 62 HA ALA 62 68.194 -14.715 -8.437 466 HB1 ALA 62 HB1 ALA 62 68.869 -14.719 -10.788 467 HB2 ALA 62 HB2 ALA 62 70.323 -13.811 -10.375 468 HB3 ALA 62 HB3 ALA 62 68.733 -13.074 -10.168 469 H ALA 63 H ALA 63 71.691 -14.850 -8.798 470 HA ALA 63 HA ALA 63 71.716 -17.713 -9.019 471 HB1 ALA 63 HB1 ALA 63 73.438 -16.323 -10.103 472 HB2 ALA 63 HB2 ALA 63 74.146 -17.486 -8.983 473 HB3 ALA 63 HB3 ALA 63 73.995 -15.792 -8.514 474 H ASN 64 H ASN 64 72.778 -15.360 -6.605 475 HA ASN 64 HA ASN 64 73.060 -15.339 -4.435 476 HB2 ASN 64 HB2 ASN 64 70.715 -15.862 -4.284 477 HB3 ASN 64 HB3 ASN 64 71.045 -17.596 -4.392 478 HD21 ASN 64 HD21 ASN 64 71.016 -14.778 -2.347 479 HD22 ASN 64 HD22 ASN 64 71.370 -15.605 -0.888 480 HA PRO 65 HA PRO 65 76.244 -18.507 -3.981 481 HB2 PRO 65 HB2 PRO 65 77.890 -16.308 -3.026 482 HB3 PRO 65 HB3 PRO 65 78.135 -17.317 -4.453 483 HG2 PRO 65 HG2 PRO 65 77.489 -14.679 -4.588 484 HG3 PRO 65 HG3 PRO 65 77.042 -15.854 -5.833 485 HD2 PRO 65 HD2 PRO 65 75.367 -14.724 -3.615 486 HD3 PRO 65 HD3 PRO 65 74.940 -15.040 -5.314 487 H GLY 66 H GLY 66 77.686 -18.745 -1.899 488 HA2 GLY 66 HA2 GLY 66 75.914 -18.526 0.400 489 HA3 GLY 66 HA3 GLY 66 77.471 -19.347 0.344 490 H GLY 67 H GLY 67 77.049 -18.000 2.522 491 HA2 GLY 67 HA2 GLY 67 78.196 -16.481 3.833 492 HA3 GLY 67 HA3 GLY 67 79.101 -16.086 2.361 493 H ASP 68 H ASP 68 78.992 -13.910 2.222 494 HA ASP 68 HA ASP 68 76.424 -12.611 2.644 495 HB2 ASP 68 HB2 ASP 68 79.102 -11.391 1.896 496 HB3 ASP 68 HB3 ASP 68 77.630 -10.474 2.153 497 H GLY 69 H GLY 69 75.318 -13.531 0.997 498 HA2 GLY 69 HA2 GLY 69 76.238 -13.180 -1.733 499 HA3 GLY 69 HA3 GLY 69 74.750 -13.973 -1.228 500 H GLY 70 H GLY 70 74.457 -12.417 -3.299 501 HA2 GLY 70 HA2 GLY 70 73.910 -9.687 -2.828 502 HA3 GLY 70 HA3 GLY 70 73.234 -10.691 -4.115 503 H GLY 71 H GLY 71 72.114 -8.652 -1.960 504 HA2 GLY 71 HA2 GLY 71 69.592 -9.421 -1.987 505 HA3 GLY 71 HA3 GLY 71 70.241 -10.234 -0.567 506 HA PRO 72 HA PRO 72 68.931 -5.734 0.151 507 HB2 PRO 72 HB2 PRO 72 67.236 -6.407 2.236 508 HB3 PRO 72 HB3 PRO 72 66.757 -6.120 0.560 509 HG2 PRO 72 HG2 PRO 72 67.234 -8.697 1.973 510 HG3 PRO 72 HG3 PRO 72 65.995 -8.293 0.776 511 HD2 PRO 72 HD2 PRO 72 68.199 -9.712 0.152 512 HD3 PRO 72 HD3 PRO 72 67.502 -8.598 -1.026 513 H GLU 73 H GLU 73 69.395 -8.253 2.626 514 HA GLU 73 HA GLU 73 70.390 -6.358 4.493 515 HB2 GLU 73 HB2 GLU 73 70.287 -9.373 4.586 516 HB3 GLU 73 HB3 GLU 73 70.649 -8.320 5.953 517 HG2 GLU 73 HG2 GLU 73 68.483 -7.311 5.832 518 HG3 GLU 73 HG3 GLU 73 68.118 -8.171 4.357 519 H GLY 74 H GLY 74 71.802 -7.595 1.860 520 HA2 GLY 74 HA2 GLY 74 74.373 -7.333 3.185 521 HA3 GLY 74 HA3 GLY 74 74.225 -8.320 1.697 522 H ILE 75 H ILE 75 72.491 -5.923 0.718 523 HA ILE 75 HA ILE 75 74.638 -4.428 -0.411 524 HB ILE 75 HB ILE 75 72.822 -2.861 -1.259 525 HG12 ILE 75 HG12 ILE 75 71.104 -4.824 0.267 526 HG13 ILE 75 HG13 ILE 75 71.161 -3.069 0.348 527 HG21 ILE 75 HG21 ILE 75 72.586 -5.786 -1.867 528 HG22 ILE 75 HG22 ILE 75 73.678 -4.618 -2.630 529 HG23 ILE 75 HG23 ILE 75 71.931 -4.474 -2.842 530 HD11 ILE 75 HD11 ILE 75 70.082 -4.652 -1.971 531 HD12 ILE 75 HD12 ILE 75 70.039 -2.892 -1.787 532 HD13 ILE 75 HD13 ILE 75 69.118 -3.924 -0.696 533 H VAL 76 H VAL 76 72.562 -3.958 2.281 534 HA VAL 76 HA VAL 76 73.254 -1.341 3.069 535 HB VAL 76 HB VAL 76 71.476 -2.352 4.104 536 HG11 VAL 76 HG11 VAL 76 71.380 -4.349 3.821 537 HG12 VAL 76 HG12 VAL 76 71.716 -4.359 5.577 538 HG13 VAL 76 HG13 VAL 76 73.003 -4.737 4.409 539 HG21 VAL 76 HG21 VAL 76 73.613 -2.380 6.219 540 HG22 VAL 76 HG22 VAL 76 71.876 -2.348 6.535 541 HG23 VAL 76 HG23 VAL 76 72.654 -0.981 5.739 542 H LYS 77 H LYS 77 74.550 -4.322 3.725 543 HA LYS 77 HA LYS 77 76.673 -3.666 5.436 544 HB2 LYS 77 HB2 LYS 77 76.079 -5.977 5.118 545 HB3 LYS 77 HB3 LYS 77 76.484 -5.897 3.414 546 HG2 LYS 77 HG2 LYS 77 78.857 -5.530 4.052 547 HG3 LYS 77 HG3 LYS 77 78.387 -5.771 5.733 548 HD2 LYS 77 HD2 LYS 77 77.662 -8.010 5.286 549 HD3 LYS 77 HD3 LYS 77 77.882 -7.786 3.553 550 HE2 LYS 77 HE2 LYS 77 80.080 -7.683 5.607 551 HE3 LYS 77 HE3 LYS 77 79.702 -9.082 4.601 552 HZ1 LYS 77 HZ1 LYS 77 80.638 -6.418 3.612 553 HZ2 LYS 77 HZ2 LYS 77 80.180 -7.691 2.640 554 HZ3 LYS 77 HZ3 LYS 77 81.516 -7.851 3.632 555 H GLU 78 H GLU 78 76.561 -3.771 1.897 556 HA GLU 78 HA GLU 78 79.264 -3.103 1.437 557 HB2 GLU 78 HB2 GLU 78 77.492 -4.030 -0.208 558 HB3 GLU 78 HB3 GLU 78 77.004 -2.372 -0.476 559 HG2 GLU 78 HG2 GLU 78 78.543 -3.080 -2.172 560 HG3 GLU 78 HG3 GLU 78 79.295 -1.834 -1.170 561 H ILE 79 H ILE 79 76.413 -1.234 2.027 562 HA ILE 79 HA ILE 79 77.486 1.334 1.449 563 HB ILE 79 HB ILE 79 75.167 0.548 3.218 564 HG12 ILE 79 HG12 ILE 79 74.877 -0.111 0.848 565 HG13 ILE 79 HG13 ILE 79 73.713 1.121 1.318 566 HG21 ILE 79 HG21 ILE 79 75.865 3.274 2.155 567 HG22 ILE 79 HG22 ILE 79 75.984 2.736 3.828 568 HG23 ILE 79 HG23 ILE 79 74.404 2.849 3.053 569 HD11 ILE 79 HD11 ILE 79 75.122 2.798 0.176 570 HD12 ILE 79 HD12 ILE 79 74.531 1.512 -0.878 571 HD13 ILE 79 HD13 ILE 79 76.200 1.488 -0.332 572 H LYS 80 H LYS 80 77.093 -0.510 4.482 573 HA LYS 80 HA LYS 80 77.998 1.586 6.137 574 HB2 LYS 80 HB2 LYS 80 78.205 0.004 7.977 575 HB3 LYS 80 HB3 LYS 80 76.784 -0.442 7.059 576 HG2 LYS 80 HG2 LYS 80 77.929 -2.272 6.053 577 HG3 LYS 80 HG3 LYS 80 79.438 -1.780 6.802 578 HD2 LYS 80 HD2 LYS 80 78.469 -3.620 8.059 579 HD3 LYS 80 HD3 LYS 80 78.462 -2.138 9.017 580 HE2 LYS 80 HE2 LYS 80 76.099 -1.830 8.590 581 HE3 LYS 80 HE3 LYS 80 76.079 -3.229 7.517 582 HZ1 LYS 80 HZ1 LYS 80 76.599 -4.649 9.374 583 HZ2 LYS 80 HZ2 LYS 80 75.248 -3.748 9.781 584 HZ3 LYS 80 HZ3 LYS 80 76.750 -3.335 10.411 585 H GLU 81 H GLU 81 79.677 -0.924 4.428 586 HA GLU 81 HA GLU 81 82.182 -0.521 5.628 587 HB2 GLU 81 HB2 GLU 81 81.445 -1.654 2.946 588 HB3 GLU 81 HB3 GLU 81 83.063 -1.702 3.622 589 HG2 GLU 81 HG2 GLU 81 82.264 -3.052 5.472 590 HG3 GLU 81 HG3 GLU 81 80.624 -2.977 4.822 591 H TRP 82 H TRP 82 80.682 0.796 2.737 592 HA TRP 82 HA TRP 82 82.980 2.114 1.753 593 HB2 TRP 82 HB2 TRP 82 81.004 1.575 0.376 594 HB3 TRP 82 HB3 TRP 82 80.065 2.734 1.298 595 HD1 TRP 82 HD1 TRP 82 82.732 2.518 -1.418 596 HE1 TRP 82 HE1 TRP 82 82.879 4.776 -2.625 597 HE3 TRP 82 HE3 TRP 82 79.734 5.317 1.660 598 HZ2 TRP 82 HZ2 TRP 82 81.868 7.356 -2.354 599 HZ3 TRP 82 HZ3 TRP 82 79.395 7.700 1.113 600 HH2 TRP 82 HH2 TRP 82 80.441 8.698 -0.852 601 H ARG 83 H ARG 83 80.218 3.249 3.655 602 HA ARG 83 HA ARG 83 81.195 5.922 3.604 603 HB2 ARG 83 HB2 ARG 83 78.690 4.967 4.064 604 HB3 ARG 83 HB3 ARG 83 79.353 5.089 5.691 605 HG2 ARG 83 HG2 ARG 83 79.348 7.302 5.807 606 HG3 ARG 83 HG3 ARG 83 79.694 7.514 4.095 607 HD2 ARG 83 HD2 ARG 83 77.416 7.236 3.497 608 HD3 ARG 83 HD3 ARG 83 77.002 6.572 5.077 609 HE ARG 83 HE ARG 83 77.365 8.727 6.021 610 HH11 ARG 83 HH11 ARG 83 76.803 8.833 2.438 611 HH12 ARG 83 HH12 ARG 83 76.302 10.459 2.495 612 HH21 ARG 83 HH21 ARG 83 76.579 10.934 5.967 613 HH22 ARG 83 HH22 ARG 83 76.158 11.637 4.494 614 H ALA 84 H ALA 84 81.351 3.295 5.941 615 HA ALA 84 HA ALA 84 82.529 4.844 8.001 616 HB1 ALA 84 HB1 ALA 84 83.043 2.736 9.104 617 HB2 ALA 84 HB2 ALA 84 82.700 1.860 7.615 618 HB3 ALA 84 HB3 ALA 84 81.402 2.705 8.455 619 H ALA 85 H ALA 85 83.967 2.786 5.458 620 HA ALA 85 HA ALA 85 86.617 3.156 6.401 621 HB1 ALA 85 HB1 ALA 85 85.687 2.414 3.628 622 HB2 ALA 85 HB2 ALA 85 86.009 1.279 4.940 623 HB3 ALA 85 HB3 ALA 85 87.324 2.229 4.253 624 H ASN 86 H ASN 86 84.543 4.927 4.256 625 HA ASN 86 HA ASN 86 86.503 6.674 3.158 626 HB2 ASN 86 HB2 ASN 86 83.964 6.280 2.451 627 HB3 ASN 86 HB3 ASN 86 83.665 7.501 3.664 628 HD21 ASN 86 HD21 ASN 86 83.132 7.656 0.870 629 HD22 ASN 86 HD22 ASN 86 84.049 8.979 0.250 630 H GLY 87 H GLY 87 84.686 6.583 6.126 631 HA2 GLY 87 HA2 GLY 87 85.404 7.654 8.118 632 HA3 GLY 87 HA3 GLY 87 86.207 8.872 7.136 633 H LYS 88 H LYS 88 82.847 7.797 6.494 634 HA LYS 88 HA LYS 88 82.002 10.444 7.178 635 HB2 LYS 88 HB2 LYS 88 81.483 8.462 5.012 636 HB3 LYS 88 HB3 LYS 88 80.365 9.764 5.348 637 HG2 LYS 88 HG2 LYS 88 81.930 11.405 4.693 638 HG3 LYS 88 HG3 LYS 88 83.293 10.293 4.844 639 HD2 LYS 88 HD2 LYS 88 82.863 10.746 2.514 640 HD3 LYS 88 HD3 LYS 88 82.429 9.089 2.861 641 HE2 LYS 88 HE2 LYS 88 80.844 10.178 1.398 642 HE3 LYS 88 HE3 LYS 88 80.113 9.634 2.897 643 HZ1 LYS 88 HZ1 LYS 88 80.221 12.003 3.680 644 HZ2 LYS 88 HZ2 LYS 88 79.373 11.913 2.235 645 HZ3 LYS 88 HZ3 LYS 88 80.946 12.438 2.232 646 HA PRO 89 HA PRO 89 79.367 8.405 10.211 647 HB2 PRO 89 HB2 PRO 89 77.086 9.983 9.769 648 HB3 PRO 89 HB3 PRO 89 78.385 10.355 10.907 649 HG2 PRO 89 HG2 PRO 89 77.943 11.348 8.126 650 HG3 PRO 89 HG3 PRO 89 78.571 12.215 9.540 651 HD2 PRO 89 HD2 PRO 89 80.221 11.404 7.621 652 HD3 PRO 89 HD3 PRO 89 80.686 11.278 9.328 653 H GLY 90 H GLY 90 78.467 6.468 9.847 654 HA2 GLY 90 HA2 GLY 90 77.025 6.036 7.345 655 HA3 GLY 90 HA3 GLY 90 77.687 4.787 8.383 656 H PHE 91 H PHE 91 76.167 3.605 9.272 657 HA PHE 91 HA PHE 91 73.452 4.630 9.521 658 HB2 PHE 91 HB2 PHE 91 74.541 1.900 10.250 659 HB3 PHE 91 HB3 PHE 91 72.858 2.379 10.213 660 HD1 PHE 91 HD1 PHE 91 71.945 3.200 7.969 661 HD2 PHE 91 HD2 PHE 91 75.506 0.942 8.417 662 HE1 PHE 91 HE1 PHE 91 71.789 2.484 5.642 663 HE2 PHE 91 HE2 PHE 91 75.340 0.235 6.058 664 HZ PHE 91 HZ PHE 91 73.488 1.016 4.686 665 H LYS 92 H LYS 92 72.272 4.470 11.536 666 HA LYS 92 HA LYS 92 73.979 4.892 13.770 667 HB2 LYS 92 HB2 LYS 92 72.073 5.712 14.833 668 HB3 LYS 92 HB3 LYS 92 71.981 6.285 13.216 669 HG2 LYS 92 HG2 LYS 92 70.297 4.676 12.652 670 HG3 LYS 92 HG3 LYS 92 70.498 3.881 14.214 671 HD2 LYS 92 HD2 LYS 92 69.494 6.714 13.796 672 HD3 LYS 92 HD3 LYS 92 68.479 5.320 14.162 673 HE2 LYS 92 HE2 LYS 92 69.726 5.032 16.291 674 HE3 LYS 92 HE3 LYS 92 70.632 6.497 15.933 675 HZ1 LYS 92 HZ1 LYS 92 68.835 6.963 17.427 676 HZ2 LYS 92 HZ2 LYS 92 67.708 6.319 16.373 677 HZ3 LYS 92 HZ3 LYS 92 68.532 7.732 15.963 678 H GLN 93 H GLN 93 72.986 3.683 15.821 679 HA GLN 93 HA GLN 93 72.731 0.918 14.998 680 HB2 GLN 93 HB2 GLN 93 74.274 2.391 16.901 681 HB3 GLN 93 HB3 GLN 93 73.949 0.691 17.292 682 HG2 GLN 93 HG2 GLN 93 75.420 1.864 14.908 683 HG3 GLN 93 HG3 GLN 93 76.136 0.903 16.203 684 HE21 GLN 93 HE21 GLN 93 74.163 0.822 13.330 685 HE22 GLN 93 HE22 GLN 93 74.237 -0.882 13.084 686 H GLY 94 H GLY 94 71.242 -0.155 15.872 687 HA2 GLY 94 HA2 GLY 94 70.050 0.495 18.393 688 HA3 GLY 94 HA3 GLY 94 68.959 0.637 17.007 Start of MODEL 22 1 H GLU 2 H GLU 2 60.424 1.982 8.569 2 HA GLU 2 HA GLU 2 59.736 3.567 6.910 3 HB2 GLU 2 HB2 GLU 2 60.563 4.783 9.555 4 HB3 GLU 2 HB3 GLU 2 59.420 5.516 8.433 5 HG2 GLU 2 HG2 GLU 2 59.093 2.915 9.905 6 HG3 GLU 2 HG3 GLU 2 58.198 4.414 10.173 7 H LEU 3 H LEU 3 60.126 5.822 6.081 8 HA LEU 3 HA LEU 3 62.915 5.882 5.296 9 HB2 LEU 3 HB2 LEU 3 60.616 7.485 4.191 10 HB3 LEU 3 HB3 LEU 3 62.218 7.348 3.502 11 HG LEU 3 HG LEU 3 60.077 5.246 3.616 12 HD11 LEU 3 HD11 LEU 3 60.367 5.213 1.183 13 HD12 LEU 3 HD12 LEU 3 61.563 6.491 1.312 14 HD13 LEU 3 HD13 LEU 3 59.887 6.807 1.767 15 HD21 LEU 3 HD21 LEU 3 61.658 3.690 2.622 16 HD22 LEU 3 HD22 LEU 3 62.186 4.214 4.226 17 HD23 LEU 3 HD23 LEU 3 62.949 4.890 2.789 18 H LYS 4 H LYS 4 64.267 7.308 5.965 19 HA LYS 4 HA LYS 4 63.414 9.566 7.650 20 HB2 LYS 4 HB2 LYS 4 66.234 8.637 7.074 21 HB3 LYS 4 HB3 LYS 4 65.678 9.621 8.430 22 HG2 LYS 4 HG2 LYS 4 65.458 6.679 7.938 23 HG3 LYS 4 HG3 LYS 4 66.210 7.470 9.303 24 HD2 LYS 4 HD2 LYS 4 63.791 8.344 9.700 25 HD3 LYS 4 HD3 LYS 4 63.392 7.014 8.635 26 HE2 LYS 4 HE2 LYS 4 64.810 5.527 10.116 27 HE3 LYS 4 HE3 LYS 4 64.804 6.837 11.269 28 HZ1 LYS 4 HZ1 LYS 4 63.036 5.561 11.981 29 HZ2 LYS 4 HZ2 LYS 4 62.602 5.098 10.472 30 HZ3 LYS 4 HZ3 LYS 4 62.206 6.666 10.998 31 H ASN 5 H ASN 5 65.634 11.260 7.125 32 HA ASN 5 HA ASN 5 65.339 11.702 4.232 33 HB2 ASN 5 HB2 ASN 5 66.131 13.810 6.268 34 HB3 ASN 5 HB3 ASN 5 66.025 13.999 4.520 35 HD21 ASN 5 HD21 ASN 5 63.506 12.508 4.306 36 HD22 ASN 5 HD22 ASN 5 62.299 13.559 4.940 37 H SER 6 H SER 6 67.562 11.286 6.851 38 HA SER 6 HA SER 6 69.687 11.181 4.860 39 HB2 SER 6 HB2 SER 6 71.245 11.945 6.634 40 HB3 SER 6 HB3 SER 6 70.124 13.190 6.078 41 HG SER 6 HG SER 6 68.874 12.825 7.918 42 H ILE 7 H ILE 7 71.607 9.918 5.684 43 HA ILE 7 HA ILE 7 70.762 7.252 6.238 44 HB ILE 7 HB ILE 7 72.735 8.031 4.835 45 HG12 ILE 7 HG12 ILE 7 74.289 6.118 5.648 46 HG13 ILE 7 HG13 ILE 7 73.027 5.832 6.847 47 HG21 ILE 7 HG21 ILE 7 74.902 8.356 5.916 48 HG22 ILE 7 HG22 ILE 7 74.107 8.318 7.489 49 HG23 ILE 7 HG23 ILE 7 73.736 9.610 6.348 50 HD11 ILE 7 HD11 ILE 7 72.627 5.885 3.889 51 HD12 ILE 7 HD12 ILE 7 71.428 5.408 5.108 52 HD13 ILE 7 HD13 ILE 7 72.890 4.444 4.847 53 H SER 8 H SER 8 71.566 9.918 8.177 54 HA SER 8 HA SER 8 72.878 8.643 10.314 55 HB2 SER 8 HB2 SER 8 71.565 11.340 10.235 56 HB3 SER 8 HB3 SER 8 72.954 10.815 11.222 57 HG SER 8 HG SER 8 74.220 11.094 9.611 58 H ASP 9 H ASP 9 69.547 9.040 9.478 59 HA ASP 9 HA ASP 9 68.788 8.559 12.278 60 HB2 ASP 9 HB2 ASP 9 67.562 10.416 10.879 61 HB3 ASP 9 HB3 ASP 9 66.883 9.093 10.021 62 H TYR 10 H TYR 10 69.795 6.822 9.934 63 HA TYR 10 HA TYR 10 67.610 4.891 9.829 64 HB2 TYR 10 HB2 TYR 10 69.893 5.474 8.014 65 HB3 TYR 10 HB3 TYR 10 69.403 3.795 8.159 66 HD1 TYR 10 HD1 TYR 10 67.128 3.130 7.509 67 HD2 TYR 10 HD2 TYR 10 68.580 7.050 6.765 68 HE1 TYR 10 HE1 TYR 10 65.323 3.469 5.878 69 HE2 TYR 10 HE2 TYR 10 66.763 7.406 5.132 70 HH TYR 10 HH TYR 10 65.189 6.153 3.778 71 H THR 11 H THR 11 67.737 3.211 11.142 72 HA THR 11 HA THR 11 70.294 2.466 12.255 73 HB THR 11 HB THR 11 68.986 0.731 13.413 74 HG1 THR 11 HG1 THR 11 66.780 0.568 13.071 75 HG21 THR 11 HG21 THR 11 67.634 3.416 13.511 76 HG22 THR 11 HG22 THR 11 69.040 2.912 14.457 77 HG23 THR 11 HG23 THR 11 67.473 2.149 14.725 78 H GLU 12 H GLU 12 70.710 -0.041 11.968 79 HA GLU 12 HA GLU 12 70.767 -0.497 9.223 80 HB2 GLU 12 HB2 GLU 12 71.382 -2.888 9.866 81 HB3 GLU 12 HB3 GLU 12 72.457 -1.611 10.405 82 HG2 GLU 12 HG2 GLU 12 71.659 -1.720 12.570 83 HG3 GLU 12 HG3 GLU 12 70.329 -2.789 12.203 84 H ALA 13 H ALA 13 68.491 -1.589 11.680 85 HA ALA 13 HA ALA 13 67.040 -3.252 9.873 86 HB1 ALA 13 HB1 ALA 13 66.938 -3.571 12.315 87 HB2 ALA 13 HB2 ALA 13 65.335 -3.399 11.595 88 HB3 ALA 13 HB3 ALA 13 66.063 -2.047 12.464 89 H GLU 14 H GLU 14 66.625 0.155 10.850 90 HA GLU 14 HA GLU 14 64.225 0.619 9.430 91 HB2 GLU 14 HB2 GLU 14 66.516 2.401 10.184 92 HB3 GLU 14 HB3 GLU 14 65.248 3.040 9.164 93 HG2 GLU 14 HG2 GLU 14 64.911 1.903 11.933 94 HG3 GLU 14 HG3 GLU 14 64.896 3.613 11.494 95 H PHE 15 H PHE 15 67.570 0.624 8.478 96 HA PHE 15 HA PHE 15 67.081 1.550 5.858 97 HB2 PHE 15 HB2 PHE 15 69.279 1.655 7.183 98 HB3 PHE 15 HB3 PHE 15 69.457 -0.035 6.773 99 HD1 PHE 15 HD1 PHE 15 68.663 3.162 5.041 100 HD2 PHE 15 HD2 PHE 15 70.744 -0.517 5.005 101 HE1 PHE 15 HE1 PHE 15 69.729 3.785 2.914 102 HE2 PHE 15 HE2 PHE 15 71.807 0.095 2.873 103 HZ PHE 15 HZ PHE 15 71.290 2.248 1.840 104 H VAL 16 H VAL 16 67.626 -1.688 7.278 105 HA VAL 16 HA VAL 16 67.516 -3.018 4.829 106 HB VAL 16 HB VAL 16 67.266 -5.090 5.915 107 HG11 VAL 16 HG11 VAL 16 68.987 -3.375 7.587 108 HG12 VAL 16 HG12 VAL 16 69.383 -4.262 6.114 109 HG13 VAL 16 HG13 VAL 16 68.989 -5.141 7.597 110 HG21 VAL 16 HG21 VAL 16 65.489 -4.874 7.279 111 HG22 VAL 16 HG22 VAL 16 66.218 -3.577 8.211 112 HG23 VAL 16 HG23 VAL 16 66.832 -5.262 8.378 113 H GLN 17 H GLN 17 64.932 -1.865 6.856 114 HA GLN 17 HA GLN 17 62.840 -3.314 5.758 115 HB2 GLN 17 HB2 GLN 17 62.800 -2.023 7.817 116 HB3 GLN 17 HB3 GLN 17 63.024 -0.537 6.920 117 HG2 GLN 17 HG2 GLN 17 60.750 -2.265 6.296 118 HG3 GLN 17 HG3 GLN 17 60.712 -1.311 7.789 119 HE21 GLN 17 HE21 GLN 17 59.043 -1.093 5.408 120 HE22 GLN 17 HE22 GLN 17 59.236 0.521 4.819 121 H LEU 18 H LEU 18 64.262 -0.202 4.902 122 HA LEU 18 HA LEU 18 62.722 0.342 2.627 123 HB2 LEU 18 HB2 LEU 18 64.086 2.007 3.563 124 HB3 LEU 18 HB3 LEU 18 65.533 1.131 3.433 125 HG LEU 18 HG LEU 18 65.304 1.207 0.901 126 HD11 LEU 18 HD11 LEU 18 63.241 3.277 1.483 127 HD12 LEU 18 HD12 LEU 18 62.980 1.706 0.720 128 HD13 LEU 18 HD13 LEU 18 63.963 2.929 -0.085 129 HD21 LEU 18 HD21 LEU 18 66.149 3.462 0.707 130 HD22 LEU 18 HD22 LEU 18 66.883 2.579 2.048 131 HD23 LEU 18 HD23 LEU 18 65.641 3.804 2.367 132 H LEU 19 H LEU 19 65.696 -1.251 3.082 133 HA LEU 19 HA LEU 19 66.443 -1.923 0.494 134 HB2 LEU 19 HB2 LEU 19 66.769 -3.151 3.075 135 HB3 LEU 19 HB3 LEU 19 67.688 -3.760 1.666 136 HG LEU 19 HG LEU 19 67.840 -1.155 3.162 137 HD11 LEU 19 HD11 LEU 19 69.775 -3.256 2.434 138 HD12 LEU 19 HD12 LEU 19 69.277 -2.718 4.046 139 HD13 LEU 19 HD13 LEU 19 70.247 -1.666 3.001 140 HD21 LEU 19 HD21 LEU 19 69.393 -0.335 1.479 141 HD22 LEU 19 HD22 LEU 19 67.730 -0.458 0.917 142 HD23 LEU 19 HD23 LEU 19 68.928 -1.676 0.421 143 H LYS 20 H LYS 20 64.382 -3.686 2.737 144 HA LYS 20 HA LYS 20 63.949 -5.878 0.987 145 HB2 LYS 20 HB2 LYS 20 62.437 -4.889 3.371 146 HB3 LYS 20 HB3 LYS 20 62.068 -6.432 2.607 147 HG2 LYS 20 HG2 LYS 20 64.633 -6.868 3.011 148 HG3 LYS 20 HG3 LYS 20 64.454 -5.577 4.168 149 HD2 LYS 20 HD2 LYS 20 62.703 -6.782 5.355 150 HD3 LYS 20 HD3 LYS 20 62.830 -8.115 4.200 151 HE2 LYS 20 HE2 LYS 20 65.254 -8.314 4.842 152 HE3 LYS 20 HE3 LYS 20 64.943 -7.147 6.115 153 HZ1 LYS 20 HZ1 LYS 20 64.874 -9.426 6.914 154 HZ2 LYS 20 HZ2 LYS 20 63.591 -9.775 5.861 155 HZ3 LYS 20 HZ3 LYS 20 63.369 -8.692 7.113 156 H GLU 21 H GLU 21 62.251 -2.893 1.692 157 HA GLU 21 HA GLU 21 60.035 -3.368 0.106 158 HB2 GLU 21 HB2 GLU 21 61.349 -0.803 0.944 159 HB3 GLU 21 HB3 GLU 21 59.911 -0.819 -0.066 160 HG2 GLU 21 HG2 GLU 21 60.165 -1.961 2.704 161 HG3 GLU 21 HG3 GLU 21 59.311 -0.483 2.245 162 H ILE 22 H ILE 22 63.149 -1.882 -0.717 163 HA ILE 22 HA ILE 22 62.547 -1.194 -3.331 164 HB ILE 22 HB ILE 22 65.258 -2.205 -2.419 165 HG12 ILE 22 HG12 ILE 22 64.139 0.616 -2.322 166 HG13 ILE 22 HG13 ILE 22 64.424 -0.412 -0.930 167 HG21 ILE 22 HG21 ILE 22 64.976 -1.981 -4.835 168 HG22 ILE 22 HG22 ILE 22 66.069 -0.729 -4.223 169 HG23 ILE 22 HG23 ILE 22 64.403 -0.331 -4.621 170 HD11 ILE 22 HD11 ILE 22 66.181 1.237 -1.184 171 HD12 ILE 22 HD12 ILE 22 66.536 0.634 -2.801 172 HD13 ILE 22 HD13 ILE 22 66.820 -0.392 -1.396 173 H GLU 23 H GLU 23 63.785 -4.331 -2.105 174 HA GLU 23 HA GLU 23 64.295 -5.551 -4.585 175 HB2 GLU 23 HB2 GLU 23 63.206 -6.818 -2.102 176 HB3 GLU 23 HB3 GLU 23 63.809 -7.715 -3.467 177 HG2 GLU 23 HG2 GLU 23 66.021 -6.488 -3.009 178 HG3 GLU 23 HG3 GLU 23 65.282 -6.056 -1.463 179 H LYS 24 H LYS 24 61.452 -5.494 -2.621 180 HA LYS 24 HA LYS 24 59.874 -7.284 -4.042 181 HB2 LYS 24 HB2 LYS 24 59.453 -6.814 -1.799 182 HB3 LYS 24 HB3 LYS 24 59.263 -5.098 -2.105 183 HG2 LYS 24 HG2 LYS 24 57.168 -5.466 -3.219 184 HG3 LYS 24 HG3 LYS 24 57.403 -7.213 -3.167 185 HD2 LYS 24 HD2 LYS 24 55.828 -6.479 -1.464 186 HD3 LYS 24 HD3 LYS 24 57.274 -7.186 -0.744 187 HE2 LYS 24 HE2 LYS 24 56.728 -5.271 0.549 188 HE3 LYS 24 HE3 LYS 24 58.122 -4.826 -0.427 189 HZ1 LYS 24 HZ1 LYS 24 55.303 -4.089 -0.948 190 HZ2 LYS 24 HZ2 LYS 24 56.579 -3.682 -1.964 191 HZ3 LYS 24 HZ3 LYS 24 56.529 -3.083 -0.379 192 H GLU 25 H GLU 25 60.103 -3.761 -4.288 193 HA GLU 25 HA GLU 25 58.042 -3.894 -6.277 194 HB2 GLU 25 HB2 GLU 25 58.216 -1.353 -6.243 195 HB3 GLU 25 HB3 GLU 25 57.644 -2.109 -4.733 196 HG2 GLU 25 HG2 GLU 25 59.073 -0.409 -4.106 197 HG3 GLU 25 HG3 GLU 25 60.148 -1.810 -4.095 198 H ASN 26 H ASN 26 61.495 -3.314 -6.149 199 HA ASN 26 HA ASN 26 61.885 -2.268 -8.708 200 HB2 ASN 26 HB2 ASN 26 63.661 -2.300 -7.040 201 HB3 ASN 26 HB3 ASN 26 63.712 -4.054 -7.099 202 HD21 ASN 26 HD21 ASN 26 65.797 -4.169 -7.701 203 HD22 ASN 26 HD22 ASN 26 66.387 -3.699 -9.262 204 H VAL 27 H VAL 27 61.813 -5.662 -7.695 205 HA VAL 27 HA VAL 27 62.297 -6.483 -10.413 206 HB VAL 27 HB VAL 27 62.078 -8.784 -9.648 207 HG11 VAL 27 HG11 VAL 27 63.932 -8.844 -8.036 208 HG12 VAL 27 HG12 VAL 27 63.733 -7.112 -7.770 209 HG13 VAL 27 HG13 VAL 27 64.225 -7.710 -9.355 210 HG21 VAL 27 HG21 VAL 27 61.315 -7.616 -6.970 211 HG22 VAL 27 HG22 VAL 27 61.644 -9.321 -7.283 212 HG23 VAL 27 HG23 VAL 27 60.264 -8.531 -8.052 213 H ALA 28 H ALA 28 59.697 -5.229 -9.019 214 HA ALA 28 HA ALA 28 57.842 -6.775 -10.682 215 HB1 ALA 28 HB1 ALA 28 57.381 -6.890 -8.254 216 HB2 ALA 28 HB2 ALA 28 56.077 -6.130 -9.151 217 HB3 ALA 28 HB3 ALA 28 57.203 -5.139 -8.219 218 H ALA 29 H ALA 29 59.595 -4.065 -10.600 219 HA ALA 29 HA ALA 29 59.591 -1.981 -11.387 220 HB1 ALA 29 HB1 ALA 29 59.797 -3.323 -13.420 221 HB2 ALA 29 HB2 ALA 29 58.988 -1.790 -13.746 222 HB3 ALA 29 HB3 ALA 29 58.052 -3.279 -13.633 223 H THR 30 H THR 30 58.439 -0.799 -9.864 224 HA THR 30 HA THR 30 55.578 -0.414 -10.327 225 HB THR 30 HB THR 30 55.608 0.725 -8.167 226 HG1 THR 30 HG1 THR 30 58.289 0.113 -7.511 227 HG21 THR 30 HG21 THR 30 55.396 -1.731 -8.258 228 HG22 THR 30 HG22 THR 30 56.225 -1.190 -6.793 229 HG23 THR 30 HG23 THR 30 57.155 -1.850 -8.148 230 H ASP 31 H ASP 31 58.578 1.125 -10.722 231 HA ASP 31 HA ASP 31 59.349 3.081 -11.374 232 HB2 ASP 31 HB2 ASP 31 58.022 2.935 -13.378 233 HB3 ASP 31 HB3 ASP 31 56.601 3.524 -12.514 234 H ASP 32 H ASP 32 56.206 3.825 -10.018 235 HA ASP 32 HA ASP 32 56.966 6.401 -9.196 236 HB2 ASP 32 HB2 ASP 32 54.614 5.830 -9.204 237 HB3 ASP 32 HB3 ASP 32 54.907 4.615 -7.951 238 H VAL 33 H VAL 33 56.784 3.506 -7.227 239 HA VAL 33 HA VAL 33 58.046 5.035 -5.104 240 HB VAL 33 HB VAL 33 56.164 3.480 -4.574 241 HG11 VAL 33 HG11 VAL 33 58.141 1.313 -5.090 242 HG12 VAL 33 HG12 VAL 33 56.648 1.627 -5.980 243 HG13 VAL 33 HG13 VAL 33 56.581 1.092 -4.295 244 HG21 VAL 33 HG21 VAL 33 57.601 4.252 -2.790 245 HG22 VAL 33 HG22 VAL 33 58.717 2.915 -3.084 246 HG23 VAL 33 HG23 VAL 33 57.091 2.592 -2.487 247 H LEU 34 H LEU 34 58.742 2.748 -7.424 248 HA LEU 34 HA LEU 34 61.245 1.727 -6.724 249 HB2 LEU 34 HB2 LEU 34 59.807 0.976 -8.507 250 HB3 LEU 34 HB3 LEU 34 59.927 2.443 -9.348 251 HG LEU 34 HG LEU 34 61.148 0.472 -10.307 252 HD11 LEU 34 HD11 LEU 34 61.694 2.658 -11.041 253 HD12 LEU 34 HD12 LEU 34 63.164 1.675 -10.932 254 HD13 LEU 34 HD13 LEU 34 62.802 2.884 -9.685 255 HD21 LEU 34 HD21 LEU 34 63.055 0.950 -8.044 256 HD22 LEU 34 HD22 LEU 34 63.238 -0.237 -9.342 257 HD23 LEU 34 HD23 LEU 34 61.936 -0.393 -8.157 258 H ASP 35 H ASP 35 60.438 4.651 -8.549 259 HA ASP 35 HA ASP 35 63.181 5.518 -8.636 260 HB2 ASP 35 HB2 ASP 35 61.471 6.356 -10.240 261 HB3 ASP 35 HB3 ASP 35 60.686 7.188 -8.916 262 H VAL 36 H VAL 36 60.647 5.954 -6.368 263 HA VAL 36 HA VAL 36 61.883 8.071 -4.932 264 HB VAL 36 HB VAL 36 60.273 5.842 -3.721 265 HG11 VAL 36 HG11 VAL 36 59.682 7.500 -2.111 266 HG12 VAL 36 HG12 VAL 36 60.730 8.655 -3.005 267 HG13 VAL 36 HG13 VAL 36 61.447 7.219 -2.229 268 HG21 VAL 36 HG21 VAL 36 59.327 8.390 -4.860 269 HG22 VAL 36 HG22 VAL 36 58.408 7.144 -3.931 270 HG23 VAL 36 HG23 VAL 36 59.126 6.738 -5.519 271 H LEU 37 H LEU 37 61.850 4.587 -4.567 272 HA LEU 37 HA LEU 37 63.393 4.673 -2.233 273 HB2 LEU 37 HB2 LEU 37 63.107 2.296 -4.003 274 HB3 LEU 37 HB3 LEU 37 63.488 2.466 -2.305 275 HG LEU 37 HG LEU 37 60.768 3.024 -3.430 276 HD11 LEU 37 HD11 LEU 37 61.208 0.664 -3.356 277 HD12 LEU 37 HD12 LEU 37 60.045 1.107 -2.108 278 HD13 LEU 37 HD13 LEU 37 61.724 0.782 -1.675 279 HD21 LEU 37 HD21 LEU 37 61.266 4.517 -1.574 280 HD22 LEU 37 HD22 LEU 37 61.752 3.144 -0.577 281 HD23 LEU 37 HD23 LEU 37 60.074 3.312 -1.088 282 H LEU 38 H LEU 38 64.087 3.961 -5.555 283 HA LEU 38 HA LEU 38 66.746 3.246 -5.133 284 HB2 LEU 38 HB2 LEU 38 65.239 4.273 -7.463 285 HB3 LEU 38 HB3 LEU 38 66.920 3.799 -7.653 286 HG LEU 38 HG LEU 38 64.461 2.172 -7.086 287 HD11 LEU 38 HD11 LEU 38 65.030 2.583 -9.390 288 HD12 LEU 38 HD12 LEU 38 65.230 0.871 -8.972 289 HD13 LEU 38 HD13 LEU 38 66.643 1.920 -9.093 290 HD21 LEU 38 HD21 LEU 38 67.300 1.205 -6.729 291 HD22 LEU 38 HD22 LEU 38 65.870 0.185 -6.780 292 HD23 LEU 38 HD23 LEU 38 66.067 1.346 -5.473 293 H GLU 39 H GLU 39 65.341 6.386 -5.882 294 HA GLU 39 HA GLU 39 67.877 7.670 -5.894 295 HB2 GLU 39 HB2 GLU 39 65.090 8.655 -5.481 296 HB3 GLU 39 HB3 GLU 39 66.502 9.689 -5.450 297 HG2 GLU 39 HG2 GLU 39 65.523 8.032 -7.765 298 HG3 GLU 39 HG3 GLU 39 65.317 9.772 -7.540 299 H HIS 40 H HIS 40 65.406 7.125 -3.465 300 HA HIS 40 HA HIS 40 66.409 8.855 -1.523 301 HB2 HIS 40 HB2 HIS 40 64.159 7.907 -1.547 302 HB3 HIS 40 HB3 HIS 40 64.737 6.330 -1.181 303 HD1 HIS 40 HD1 HIS 40 63.503 9.340 0.435 304 HD2 HIS 40 HD2 HIS 40 66.034 6.214 1.473 305 HE1 HIS 40 HE1 HIS 40 63.666 9.361 2.937 306 H PHE 41 H PHE 41 66.848 5.452 -2.071 307 HA PHE 41 HA PHE 41 68.511 4.823 0.044 308 HB2 PHE 41 HB2 PHE 41 67.519 3.095 -1.170 309 HB3 PHE 41 HB3 PHE 41 68.046 3.764 -2.701 310 HD1 PHE 41 HD1 PHE 41 69.173 2.047 0.376 311 HD2 PHE 41 HD2 PHE 41 70.080 3.035 -3.647 312 HE1 PHE 41 HE1 PHE 41 71.114 0.528 0.438 313 HE2 PHE 41 HE2 PHE 41 72.011 1.543 -3.577 314 HZ PHE 41 HZ PHE 41 72.536 0.286 -1.551 315 H VAL 42 H VAL 42 69.371 5.737 -3.290 316 HA VAL 42 HA VAL 42 72.074 5.809 -2.582 317 HB VAL 42 HB VAL 42 71.336 5.282 -4.837 318 HG11 VAL 42 HG11 VAL 42 70.667 8.089 -5.236 319 HG12 VAL 42 HG12 VAL 42 69.647 6.612 -5.253 320 HG13 VAL 42 HG13 VAL 42 70.917 6.821 -6.462 321 HG21 VAL 42 HG21 VAL 42 73.125 6.437 -6.069 322 HG22 VAL 42 HG22 VAL 42 73.661 5.829 -4.501 323 HG23 VAL 42 HG23 VAL 42 73.303 7.539 -4.707 324 H LYS 43 H LYS 43 69.708 8.260 -2.513 325 HA LYS 43 HA LYS 43 71.589 10.417 -2.330 326 HB2 LYS 43 HB2 LYS 43 69.830 11.901 -1.891 327 HB3 LYS 43 HB3 LYS 43 69.031 10.623 -2.784 328 HG2 LYS 43 HG2 LYS 43 68.252 9.696 -0.534 329 HG3 LYS 43 HG3 LYS 43 68.943 11.141 0.177 330 HD2 LYS 43 HD2 LYS 43 67.516 12.547 -1.270 331 HD3 LYS 43 HD3 LYS 43 66.752 11.085 -1.887 332 HE2 LYS 43 HE2 LYS 43 65.342 12.028 -0.164 333 HE3 LYS 43 HE3 LYS 43 66.057 10.547 0.469 334 HZ1 LYS 43 HZ1 LYS 43 66.977 13.298 0.997 335 HZ2 LYS 43 HZ2 LYS 43 67.622 11.926 1.737 336 HZ3 LYS 43 HZ3 LYS 43 66.029 12.388 2.005 337 H ILE 44 H ILE 44 70.286 8.308 0.089 338 HA ILE 44 HA ILE 44 71.487 9.864 2.237 339 HB ILE 44 HB ILE 44 70.659 8.024 3.724 340 HG12 ILE 44 HG12 ILE 44 69.454 6.972 1.159 341 HG13 ILE 44 HG13 ILE 44 70.721 6.177 2.064 342 HG21 ILE 44 HG21 ILE 44 68.602 9.214 1.864 343 HG22 ILE 44 HG22 ILE 44 69.318 10.019 3.254 344 HG23 ILE 44 HG23 ILE 44 68.294 8.600 3.490 345 HD11 ILE 44 HD11 ILE 44 67.939 6.724 3.050 346 HD12 ILE 44 HD12 ILE 44 69.175 5.790 3.898 347 HD13 ILE 44 HD13 ILE 44 68.489 5.200 2.378 348 H THR 45 H THR 45 72.220 6.945 0.410 349 HA THR 45 HA THR 45 74.449 6.286 2.121 350 HB THR 45 HB THR 45 74.881 4.497 0.459 351 HG1 THR 45 HG1 THR 45 72.450 5.061 -0.799 352 HG21 THR 45 HG21 THR 45 72.879 3.215 0.904 353 HG22 THR 45 HG22 THR 45 71.990 4.688 1.283 354 HG23 THR 45 HG23 THR 45 73.302 4.157 2.338 355 H GLU 46 H GLU 46 73.877 7.814 -0.978 356 HA GLU 46 HA GLU 46 75.050 8.757 -2.505 357 HB2 GLU 46 HB2 GLU 46 76.695 9.440 -0.114 358 HB3 GLU 46 HB3 GLU 46 77.116 10.074 -1.714 359 HG2 GLU 46 HG2 GLU 46 74.846 11.027 -1.850 360 HG3 GLU 46 HG3 GLU 46 74.529 10.437 -0.224 361 H HIS 47 H HIS 47 75.364 6.090 -2.129 362 HA HIS 47 HA HIS 47 78.078 5.329 -2.557 363 HB2 HIS 47 HB2 HIS 47 76.214 3.882 -1.532 364 HB3 HIS 47 HB3 HIS 47 75.607 3.688 -3.173 365 HD1 HIS 47 HD1 HIS 47 76.815 1.895 -4.635 366 HD2 HIS 47 HD2 HIS 47 78.700 2.714 -1.040 367 HE1 HIS 47 HE1 HIS 47 78.768 0.331 -4.487 368 HA PRO 48 HA PRO 48 78.032 6.497 -6.931 369 HB2 PRO 48 HB2 PRO 48 80.089 4.469 -7.275 370 HB3 PRO 48 HB3 PRO 48 80.176 6.210 -7.559 371 HG2 PRO 48 HG2 PRO 48 81.373 4.862 -5.616 372 HG3 PRO 48 HG3 PRO 48 80.802 6.535 -5.293 373 HD2 PRO 48 HD2 PRO 48 79.670 3.869 -4.535 374 HD3 PRO 48 HD3 PRO 48 79.688 5.376 -3.604 375 H ASP 49 H ASP 49 77.158 3.587 -5.799 376 HA ASP 49 HA ASP 49 76.749 2.678 -8.403 377 HB2 ASP 49 HB2 ASP 49 77.835 0.916 -6.193 378 HB3 ASP 49 HB3 ASP 49 77.273 0.282 -7.713 379 H GLY 50 H GLY 50 75.170 3.946 -6.329 380 HA2 GLY 50 HA2 GLY 50 73.752 2.499 -4.362 381 HA3 GLY 50 HA3 GLY 50 73.132 3.863 -5.287 382 H THR 51 H THR 51 72.647 2.992 -7.531 383 HA THR 51 HA THR 51 70.450 1.303 -6.777 384 HB THR 51 HB THR 51 70.757 1.931 -9.651 385 HG1 THR 51 HG1 THR 51 69.867 4.160 -8.499 386 HG21 THR 51 HG21 THR 51 68.434 2.575 -9.308 387 HG22 THR 51 HG22 THR 51 68.626 2.436 -7.571 388 HG23 THR 51 HG23 THR 51 68.726 1.004 -8.565 389 H ALA 52 H ALA 52 73.448 0.976 -8.421 390 HA ALA 52 HA ALA 52 73.043 -1.476 -9.770 391 HB1 ALA 52 HB1 ALA 52 75.554 -0.306 -8.606 392 HB2 ALA 52 HB2 ALA 52 74.936 0.012 -10.230 393 HB3 ALA 52 HB3 ALA 52 75.460 -1.614 -9.781 394 H LEU 53 H LEU 53 74.071 -0.699 -6.503 395 HA LEU 53 HA LEU 53 74.696 -3.293 -5.673 396 HB2 LEU 53 HB2 LEU 53 73.492 -1.081 -4.054 397 HB3 LEU 53 HB3 LEU 53 74.092 -2.584 -3.394 398 HG LEU 53 HG LEU 53 75.648 -0.353 -4.649 399 HD11 LEU 53 HD11 LEU 53 75.076 -0.132 -2.330 400 HD12 LEU 53 HD12 LEU 53 76.808 -0.401 -2.522 401 HD13 LEU 53 HD13 LEU 53 75.764 -1.716 -1.979 402 HD21 LEU 53 HD21 LEU 53 76.626 -3.126 -3.961 403 HD22 LEU 53 HD22 LEU 53 77.649 -1.746 -4.348 404 HD23 LEU 53 HD23 LEU 53 76.570 -2.405 -5.574 405 H ILE 54 H ILE 54 71.542 -1.700 -5.743 406 HA ILE 54 HA ILE 54 70.361 -3.909 -4.359 407 HB ILE 54 HB ILE 54 68.722 -2.151 -6.233 408 HG12 ILE 54 HG12 ILE 54 67.974 -1.235 -3.839 409 HG13 ILE 54 HG13 ILE 54 69.609 -1.721 -3.424 410 HG21 ILE 54 HG21 ILE 54 66.806 -2.866 -4.903 411 HG22 ILE 54 HG22 ILE 54 67.859 -3.924 -3.966 412 HG23 ILE 54 HG23 ILE 54 67.620 -4.220 -5.689 413 HD11 ILE 54 HD11 ILE 54 69.502 0.606 -4.037 414 HD12 ILE 54 HD12 ILE 54 68.858 0.164 -5.619 415 HD13 ILE 54 HD13 ILE 54 70.496 -0.311 -5.167 416 H TYR 55 H TYR 55 70.644 -3.006 -7.682 417 HA TYR 55 HA TYR 55 69.210 -5.085 -8.882 418 HB2 TYR 55 HB2 TYR 55 71.238 -3.121 -9.761 419 HB3 TYR 55 HB3 TYR 55 70.852 -4.432 -10.841 420 HD1 TYR 55 HD1 TYR 55 68.350 -4.703 -11.466 421 HD2 TYR 55 HD2 TYR 55 69.912 -1.207 -9.635 422 HE1 TYR 55 HE1 TYR 55 66.377 -3.440 -12.200 423 HE2 TYR 55 HE2 TYR 55 67.956 0.065 -10.356 424 HH TYR 55 HH TYR 55 65.178 -1.441 -11.376 425 H GLU 56 H GLU 56 72.701 -4.788 -8.284 426 HA GLU 56 HA GLU 56 73.144 -7.326 -9.413 427 HB2 GLU 56 HB2 GLU 56 75.458 -7.171 -8.564 428 HB3 GLU 56 HB3 GLU 56 74.955 -5.750 -9.472 429 HG2 GLU 56 HG2 GLU 56 74.785 -4.460 -7.570 430 HG3 GLU 56 HG3 GLU 56 74.970 -5.823 -6.483 431 H ALA 57 H ALA 57 72.576 -6.247 -6.127 432 HA ALA 57 HA ALA 57 73.325 -8.566 -4.785 433 HB1 ALA 57 HB1 ALA 57 71.036 -6.740 -4.153 434 HB2 ALA 57 HB2 ALA 57 72.715 -6.507 -3.667 435 HB3 ALA 57 HB3 ALA 57 71.797 -7.875 -3.039 436 H ALA 58 H ALA 58 70.293 -7.741 -6.358 437 HA ALA 58 HA ALA 58 68.808 -9.990 -5.627 438 HB1 ALA 58 HB1 ALA 58 67.393 -9.480 -7.563 439 HB2 ALA 58 HB2 ALA 58 68.646 -8.416 -8.202 440 HB3 ALA 58 HB3 ALA 58 67.827 -8.009 -6.694 441 H ALA 59 H ALA 59 70.976 -9.458 -8.324 442 HA ALA 59 HA ALA 59 70.635 -12.050 -9.490 443 HB1 ALA 59 HB1 ALA 59 72.882 -10.070 -9.877 444 HB2 ALA 59 HB2 ALA 59 71.366 -10.078 -10.775 445 HB3 ALA 59 HB3 ALA 59 72.490 -11.424 -10.941 446 H ARG 60 H ARG 60 73.053 -10.583 -7.407 447 HA ARG 60 HA ARG 60 74.892 -12.692 -7.174 448 HB2 ARG 60 HB2 ARG 60 74.236 -10.374 -5.343 449 HB3 ARG 60 HB3 ARG 60 75.511 -11.528 -4.969 450 HG2 ARG 60 HG2 ARG 60 76.812 -10.824 -6.805 451 HG3 ARG 60 HG3 ARG 60 75.450 -9.998 -7.555 452 HD2 ARG 60 HD2 ARG 60 77.058 -8.412 -6.562 453 HD3 ARG 60 HD3 ARG 60 75.470 -8.294 -5.830 454 HE ARG 60 HE ARG 60 76.996 -10.012 -4.257 455 HH11 ARG 60 HH11 ARG 60 77.240 -6.583 -5.252 456 HH12 ARG 60 HH12 ARG 60 77.850 -6.051 -3.752 457 HH21 ARG 60 HH21 ARG 60 77.936 -9.170 -2.146 458 HH22 ARG 60 HH22 ARG 60 78.276 -7.494 -2.075 459 H ALA 61 H ALA 61 71.913 -12.063 -5.498 460 HA ALA 61 HA ALA 61 72.264 -14.181 -3.597 461 HB1 ALA 61 HB1 ALA 61 69.779 -12.670 -4.376 462 HB2 ALA 61 HB2 ALA 61 70.905 -12.231 -3.088 463 HB3 ALA 61 HB3 ALA 61 69.965 -13.716 -2.963 464 H ALA 62 H ALA 62 70.409 -13.734 -6.577 465 HA ALA 62 HA ALA 62 69.054 -16.192 -6.538 466 HB1 ALA 62 HB1 ALA 62 68.376 -14.283 -7.916 467 HB2 ALA 62 HB2 ALA 62 68.571 -15.751 -8.876 468 HB3 ALA 62 HB3 ALA 62 69.815 -14.503 -8.912 469 H ALA 63 H ALA 63 72.009 -15.222 -8.214 470 HA ALA 63 HA ALA 63 72.694 -18.055 -8.361 471 HB1 ALA 63 HB1 ALA 63 72.452 -17.093 -10.612 472 HB2 ALA 63 HB2 ALA 63 74.137 -17.498 -10.278 473 HB3 ALA 63 HB3 ALA 63 73.601 -15.823 -10.191 474 H ASN 64 H ASN 64 73.314 -17.731 -6.206 475 HA ASN 64 HA ASN 64 75.322 -15.857 -5.537 476 HB2 ASN 64 HB2 ASN 64 73.643 -16.820 -3.929 477 HB3 ASN 64 HB3 ASN 64 74.576 -18.316 -3.960 478 HD21 ASN 64 HD21 ASN 64 74.519 -15.015 -2.986 479 HD22 ASN 64 HD22 ASN 64 75.854 -15.079 -1.896 480 HA PRO 65 HA PRO 65 78.615 -18.534 -6.996 481 HB2 PRO 65 HB2 PRO 65 80.443 -16.652 -7.296 482 HB3 PRO 65 HB3 PRO 65 78.993 -16.633 -8.311 483 HG2 PRO 65 HG2 PRO 65 79.645 -14.973 -5.908 484 HG3 PRO 65 HG3 PRO 65 78.863 -14.485 -7.419 485 HD2 PRO 65 HD2 PRO 65 77.549 -15.137 -5.043 486 HD3 PRO 65 HD3 PRO 65 76.811 -15.072 -6.658 487 H GLY 66 H GLY 66 78.012 -18.106 -4.049 488 HA2 GLY 66 HA2 GLY 66 79.106 -18.685 -2.096 489 HA3 GLY 66 HA3 GLY 66 80.622 -18.752 -3.008 490 H GLY 67 H GLY 67 78.236 -16.227 -2.632 491 HA2 GLY 67 HA2 GLY 67 80.339 -14.539 -1.519 492 HA3 GLY 67 HA3 GLY 67 79.397 -13.970 -2.899 493 H ASP 68 H ASP 68 79.291 -12.393 -0.821 494 HA ASP 68 HA ASP 68 76.714 -12.992 0.404 495 HB2 ASP 68 HB2 ASP 68 78.490 -13.376 2.048 496 HB3 ASP 68 HB3 ASP 68 79.147 -11.780 1.722 497 H GLY 69 H GLY 69 75.561 -11.042 1.026 498 HA2 GLY 69 HA2 GLY 69 75.342 -8.630 0.909 499 HA3 GLY 69 HA3 GLY 69 76.424 -8.658 -0.488 500 H GLY 70 H GLY 70 74.546 -11.234 -0.893 501 HA2 GLY 70 HA2 GLY 70 72.895 -9.838 -2.802 502 HA3 GLY 70 HA3 GLY 70 73.052 -11.583 -2.610 503 H GLY 71 H GLY 71 71.586 -8.692 -1.256 504 HA2 GLY 71 HA2 GLY 71 69.127 -9.590 -0.907 505 HA3 GLY 71 HA3 GLY 71 69.954 -10.209 0.517 506 HA PRO 72 HA PRO 72 68.597 -5.721 0.876 507 HB2 PRO 72 HB2 PRO 72 66.838 -6.120 2.951 508 HB3 PRO 72 HB3 PRO 72 66.384 -6.094 1.242 509 HG2 PRO 72 HG2 PRO 72 66.832 -8.419 3.039 510 HG3 PRO 72 HG3 PRO 72 65.626 -8.202 1.762 511 HD2 PRO 72 HD2 PRO 72 67.889 -9.672 1.450 512 HD3 PRO 72 HD3 PRO 72 67.118 -8.834 0.096 513 H GLU 73 H GLU 73 68.784 -8.054 3.553 514 HA GLU 73 HA GLU 73 70.049 -6.198 5.239 515 HB2 GLU 73 HB2 GLU 73 69.647 -9.174 5.545 516 HB3 GLU 73 HB3 GLU 73 70.244 -8.102 6.813 517 HG2 GLU 73 HG2 GLU 73 68.193 -6.786 6.658 518 HG3 GLU 73 HG3 GLU 73 67.589 -7.882 5.432 519 H GLY 74 H GLY 74 71.289 -7.607 2.619 520 HA2 GLY 74 HA2 GLY 74 73.890 -7.479 3.865 521 HA3 GLY 74 HA3 GLY 74 73.630 -8.499 2.410 522 H ILE 75 H ILE 75 72.079 -6.100 1.239 523 HA ILE 75 HA ILE 75 74.315 -4.737 0.194 524 HB ILE 75 HB ILE 75 72.627 -3.019 -0.677 525 HG12 ILE 75 HG12 ILE 75 70.721 -5.019 0.556 526 HG13 ILE 75 HG13 ILE 75 70.874 -3.296 0.885 527 HG21 ILE 75 HG21 ILE 75 72.339 -5.901 -1.414 528 HG22 ILE 75 HG22 ILE 75 73.531 -4.758 -2.035 529 HG23 ILE 75 HG23 ILE 75 71.820 -4.536 -2.401 530 HD11 ILE 75 HD11 ILE 75 69.927 -4.474 -1.712 531 HD12 ILE 75 HD12 ILE 75 69.977 -2.755 -1.278 532 HD13 ILE 75 HD13 ILE 75 68.888 -3.861 -0.423 533 H VAL 76 H VAL 76 72.221 -4.022 2.824 534 HA VAL 76 HA VAL 76 73.134 -1.459 3.521 535 HB VAL 76 HB VAL 76 71.299 -2.290 4.603 536 HG11 VAL 76 HG11 VAL 76 71.107 -4.319 4.365 537 HG12 VAL 76 HG12 VAL 76 71.285 -4.221 6.129 538 HG13 VAL 76 HG13 VAL 76 72.644 -4.776 5.116 539 HG21 VAL 76 HG21 VAL 76 72.575 -0.933 6.170 540 HG22 VAL 76 HG22 VAL 76 73.439 -2.368 6.716 541 HG23 VAL 76 HG23 VAL 76 71.713 -2.204 7.037 542 H LYS 77 H LYS 77 74.199 -4.509 4.344 543 HA LYS 77 HA LYS 77 76.444 -3.898 5.889 544 HB2 LYS 77 HB2 LYS 77 75.772 -6.179 5.862 545 HB3 LYS 77 HB3 LYS 77 75.896 -6.270 4.115 546 HG2 LYS 77 HG2 LYS 77 78.335 -6.087 4.287 547 HG3 LYS 77 HG3 LYS 77 78.195 -6.038 6.041 548 HD2 LYS 77 HD2 LYS 77 77.322 -8.251 6.116 549 HD3 LYS 77 HD3 LYS 77 77.133 -8.295 4.363 550 HE2 LYS 77 HE2 LYS 77 79.109 -9.576 5.133 551 HE3 LYS 77 HE3 LYS 77 79.528 -8.252 4.055 552 HZ1 LYS 77 HZ1 LYS 77 79.739 -8.140 7.018 553 HZ2 LYS 77 HZ2 LYS 77 80.285 -6.974 5.868 554 HZ3 LYS 77 HZ3 LYS 77 80.996 -8.475 5.940 555 H GLU 78 H GLU 78 76.231 -4.350 2.351 556 HA GLU 78 HA GLU 78 78.962 -3.761 1.955 557 HB2 GLU 78 HB2 GLU 78 77.452 -5.043 0.319 558 HB3 GLU 78 HB3 GLU 78 76.824 -3.512 -0.251 559 HG2 GLU 78 HG2 GLU 78 78.829 -2.895 -1.212 560 HG3 GLU 78 HG3 GLU 78 79.763 -4.013 -0.218 561 H ILE 79 H ILE 79 76.137 -1.762 2.192 562 HA ILE 79 HA ILE 79 77.344 0.689 1.388 563 HB ILE 79 HB ILE 79 75.000 0.219 3.274 564 HG12 ILE 79 HG12 ILE 79 74.571 -0.508 0.953 565 HG13 ILE 79 HG13 ILE 79 73.572 0.864 1.411 566 HG21 ILE 79 HG21 ILE 79 75.890 2.830 2.096 567 HG22 ILE 79 HG22 ILE 79 75.997 2.344 3.786 568 HG23 ILE 79 HG23 ILE 79 74.418 2.552 3.032 569 HD11 ILE 79 HD11 ILE 79 75.100 2.341 0.174 570 HD12 ILE 79 HD12 ILE 79 74.354 1.104 -0.834 571 HD13 ILE 79 HD13 ILE 79 76.029 0.922 -0.329 572 H LYS 80 H LYS 80 76.998 -0.835 4.582 573 HA LYS 80 HA LYS 80 78.087 1.366 5.963 574 HB2 LYS 80 HB2 LYS 80 78.113 0.035 7.948 575 HB3 LYS 80 HB3 LYS 80 76.745 -0.524 7.017 576 HG2 LYS 80 HG2 LYS 80 78.048 -2.453 6.266 577 HG3 LYS 80 HG3 LYS 80 79.393 -1.905 7.268 578 HD2 LYS 80 HD2 LYS 80 77.899 -2.004 9.246 579 HD3 LYS 80 HD3 LYS 80 76.637 -2.674 8.215 580 HE2 LYS 80 HE2 LYS 80 77.708 -4.477 9.361 581 HE3 LYS 80 HE3 LYS 80 78.164 -4.547 7.662 582 HZ1 LYS 80 HZ1 LYS 80 80.059 -4.940 9.093 583 HZ2 LYS 80 HZ2 LYS 80 79.831 -3.490 9.882 584 HZ3 LYS 80 HZ3 LYS 80 80.307 -3.493 8.273 585 H GLU 81 H GLU 81 79.569 -1.409 4.486 586 HA GLU 81 HA GLU 81 82.099 -0.904 5.594 587 HB2 GLU 81 HB2 GLU 81 81.284 -2.594 3.239 588 HB3 GLU 81 HB3 GLU 81 82.924 -2.545 3.884 589 HG2 GLU 81 HG2 GLU 81 82.113 -3.313 6.043 590 HG3 GLU 81 HG3 GLU 81 80.466 -3.344 5.428 591 H TRP 82 H TRP 82 80.515 0.207 2.721 592 HA TRP 82 HA TRP 82 82.779 1.437 1.479 593 HB2 TRP 82 HB2 TRP 82 80.499 0.948 0.412 594 HB3 TRP 82 HB3 TRP 82 79.948 2.319 1.399 595 HD1 TRP 82 HD1 TRP 82 82.427 1.654 -1.497 596 HE1 TRP 82 HE1 TRP 82 82.606 3.801 -2.881 597 HE3 TRP 82 HE3 TRP 82 79.563 4.742 1.405 598 HZ2 TRP 82 HZ2 TRP 82 81.659 6.423 -2.799 599 HZ3 TRP 82 HZ3 TRP 82 79.253 7.064 0.693 600 HH2 TRP 82 HH2 TRP 82 80.285 7.910 -1.365 601 H ARG 83 H ARG 83 80.194 2.437 3.612 602 HA ARG 83 HA ARG 83 80.678 5.179 3.738 603 HB2 ARG 83 HB2 ARG 83 78.733 3.579 4.739 604 HB3 ARG 83 HB3 ARG 83 79.783 3.761 6.153 605 HG2 ARG 83 HG2 ARG 83 78.238 5.430 6.450 606 HG3 ARG 83 HG3 ARG 83 79.712 6.144 5.770 607 HD2 ARG 83 HD2 ARG 83 78.684 6.305 3.560 608 HD3 ARG 83 HD3 ARG 83 77.242 5.508 4.173 609 HE ARG 83 HE ARG 83 77.397 7.511 5.862 610 HH11 ARG 83 HH11 ARG 83 77.531 7.670 2.268 611 HH12 ARG 83 HH12 ARG 83 77.059 9.297 2.293 612 HH21 ARG 83 HH21 ARG 83 76.692 9.677 5.734 613 HH22 ARG 83 HH22 ARG 83 76.529 10.421 4.231 614 H ALA 84 H ALA 84 81.789 2.481 5.729 615 HA ALA 84 HA ALA 84 83.344 3.950 7.555 616 HB1 ALA 84 HB1 ALA 84 84.352 1.787 8.109 617 HB2 ALA 84 HB2 ALA 84 83.598 1.073 6.682 618 HB3 ALA 84 HB3 ALA 84 82.598 1.676 8.002 619 H ALA 85 H ALA 85 84.143 2.311 4.510 620 HA ALA 85 HA ALA 85 86.921 2.686 4.596 621 HB1 ALA 85 HB1 ALA 85 86.899 2.220 2.205 622 HB2 ALA 85 HB2 ALA 85 85.153 2.469 2.165 623 HB3 ALA 85 HB3 ALA 85 85.828 1.115 3.067 624 H ASN 86 H ASN 86 84.356 4.671 3.213 625 HA ASN 86 HA ASN 86 86.137 6.641 2.148 626 HB2 ASN 86 HB2 ASN 86 83.646 6.227 1.468 627 HB3 ASN 86 HB3 ASN 86 83.267 7.187 2.887 628 HD21 ASN 86 HD21 ASN 86 83.886 9.449 2.913 629 HD22 ASN 86 HD22 ASN 86 84.228 10.248 1.439 630 H GLY 87 H GLY 87 84.454 6.160 5.162 631 HA2 GLY 87 HA2 GLY 87 85.101 7.072 7.219 632 HA3 GLY 87 HA3 GLY 87 85.981 8.335 6.359 633 H LYS 88 H LYS 88 82.566 7.202 6.101 634 HA LYS 88 HA LYS 88 81.734 9.919 6.565 635 HB2 LYS 88 HB2 LYS 88 80.993 7.731 4.723 636 HB3 LYS 88 HB3 LYS 88 79.783 8.881 5.225 637 HG2 LYS 88 HG2 LYS 88 81.176 10.691 4.285 638 HG3 LYS 88 HG3 LYS 88 82.396 9.495 3.846 639 HD2 LYS 88 HD2 LYS 88 80.876 8.431 2.322 640 HD3 LYS 88 HD3 LYS 88 79.559 9.486 2.810 641 HE2 LYS 88 HE2 LYS 88 82.114 10.340 1.440 642 HE3 LYS 88 HE3 LYS 88 80.551 10.172 0.657 643 HZ1 LYS 88 HZ1 LYS 88 81.242 12.122 2.806 644 HZ2 LYS 88 HZ2 LYS 88 79.724 11.967 2.139 645 HZ3 LYS 88 HZ3 LYS 88 81.012 12.486 1.191 646 HA PRO 89 HA PRO 89 79.337 8.115 9.932 647 HB2 PRO 89 HB2 PRO 89 77.137 9.784 9.687 648 HB3 PRO 89 HB3 PRO 89 78.516 10.187 10.682 649 HG2 PRO 89 HG2 PRO 89 77.761 11.127 7.974 650 HG3 PRO 89 HG3 PRO 89 78.696 11.962 9.224 651 HD2 PRO 89 HD2 PRO 89 79.803 10.904 6.979 652 HD3 PRO 89 HD3 PRO 89 80.681 11.043 8.512 653 H GLY 90 H GLY 90 78.026 6.419 9.885 654 HA2 GLY 90 HA2 GLY 90 76.372 6.131 7.482 655 HA3 GLY 90 HA3 GLY 90 77.015 4.780 8.397 656 H PHE 91 H PHE 91 75.553 3.759 9.431 657 HA PHE 91 HA PHE 91 72.943 4.900 9.822 658 HB2 PHE 91 HB2 PHE 91 73.922 2.163 10.651 659 HB3 PHE 91 HB3 PHE 91 72.270 2.692 10.403 660 HD1 PHE 91 HD1 PHE 91 71.798 3.651 7.960 661 HD2 PHE 91 HD2 PHE 91 74.913 0.943 9.002 662 HE1 PHE 91 HE1 PHE 91 71.919 2.889 5.653 663 HE2 PHE 91 HE2 PHE 91 75.034 0.202 6.654 664 HZ PHE 91 HZ PHE 91 73.543 1.177 4.992 665 H LYS 92 H LYS 92 71.878 4.876 11.844 666 HA LYS 92 HA LYS 92 73.595 5.313 14.113 667 HB2 LYS 92 HB2 LYS 92 71.803 6.486 14.968 668 HB3 LYS 92 HB3 LYS 92 71.712 6.810 13.286 669 HG2 LYS 92 HG2 LYS 92 69.946 5.286 12.972 670 HG3 LYS 92 HG3 LYS 92 70.141 4.675 14.620 671 HD2 LYS 92 HD2 LYS 92 69.562 6.927 15.472 672 HD3 LYS 92 HD3 LYS 92 69.214 7.433 13.813 673 HE2 LYS 92 HE2 LYS 92 67.661 5.592 13.626 674 HE3 LYS 92 HE3 LYS 92 67.987 5.196 15.314 675 HZ1 LYS 92 HZ1 LYS 92 67.087 7.428 15.916 676 HZ2 LYS 92 HZ2 LYS 92 65.955 6.443 15.173 677 HZ3 LYS 92 HZ3 LYS 92 66.682 7.680 14.285 678 H GLN 93 H GLN 93 72.461 4.394 16.139 679 HA GLN 93 HA GLN 93 72.028 1.541 15.658 680 HB2 GLN 93 HB2 GLN 93 72.988 3.290 17.752 681 HB3 GLN 93 HB3 GLN 93 72.482 1.670 18.234 682 HG2 GLN 93 HG2 GLN 93 74.928 1.757 18.003 683 HG3 GLN 93 HG3 GLN 93 74.275 0.770 16.706 684 HE21 GLN 93 HE21 GLN 93 75.640 3.864 17.508 685 HE22 GLN 93 HE22 GLN 93 76.130 4.292 15.905 686 H GLY 94 H GLY 94 70.204 0.620 16.403 687 HA2 GLY 94 HA2 GLY 94 68.543 1.241 18.432 688 HA3 GLY 94 HA3 GLY 94 67.998 2.317 17.146 Start of MODEL 23 1 H GLU 2 H GLU 2 61.585 1.524 7.351 2 HA GLU 2 HA GLU 2 59.810 3.164 7.335 3 HB2 GLU 2 HB2 GLU 2 61.268 4.188 9.771 4 HB3 GLU 2 HB3 GLU 2 60.009 5.054 8.913 5 HG2 GLU 2 HG2 GLU 2 58.419 3.274 9.505 6 HG3 GLU 2 HG3 GLU 2 59.699 2.464 10.413 7 H LEU 3 H LEU 3 60.238 5.231 6.317 8 HA LEU 3 HA LEU 3 62.950 5.273 5.278 9 HB2 LEU 3 HB2 LEU 3 60.536 6.839 4.365 10 HB3 LEU 3 HB3 LEU 3 62.071 6.721 3.530 11 HG LEU 3 HG LEU 3 59.962 4.610 3.853 12 HD11 LEU 3 HD11 LEU 3 59.661 6.132 1.978 13 HD12 LEU 3 HD12 LEU 3 60.072 4.512 1.417 14 HD13 LEU 3 HD13 LEU 3 61.295 5.772 1.419 15 HD21 LEU 3 HD21 LEU 3 62.802 4.281 2.970 16 HD22 LEU 3 HD22 LEU 3 61.541 3.064 2.701 17 HD23 LEU 3 HD23 LEU 3 62.023 3.511 4.348 18 H LYS 4 H LYS 4 64.367 6.726 5.749 19 HA LYS 4 HA LYS 4 63.650 8.827 7.644 20 HB2 LYS 4 HB2 LYS 4 66.362 7.711 6.962 21 HB3 LYS 4 HB3 LYS 4 65.971 8.785 8.307 22 HG2 LYS 4 HG2 LYS 4 65.355 5.877 7.906 23 HG3 LYS 4 HG3 LYS 4 66.250 6.633 9.219 24 HD2 LYS 4 HD2 LYS 4 63.950 7.886 9.500 25 HD3 LYS 4 HD3 LYS 4 63.405 6.452 8.670 26 HE2 LYS 4 HE2 LYS 4 64.306 4.964 10.306 27 HE3 LYS 4 HE3 LYS 4 65.101 6.285 11.105 28 HZ1 LYS 4 HZ1 LYS 4 62.155 6.200 10.902 29 HZ2 LYS 4 HZ2 LYS 4 63.129 7.254 11.783 30 HZ3 LYS 4 HZ3 LYS 4 63.030 5.642 12.237 31 H ASN 5 H ASN 5 65.388 10.686 7.488 32 HA ASN 5 HA ASN 5 65.233 11.709 4.749 33 HB2 ASN 5 HB2 ASN 5 66.012 13.161 7.303 34 HB3 ASN 5 HB3 ASN 5 65.900 13.898 5.717 35 HD21 ASN 5 HD21 ASN 5 64.335 15.351 6.257 36 HD22 ASN 5 HD22 ASN 5 62.717 14.910 6.668 37 H SER 6 H SER 6 67.452 10.521 7.058 38 HA SER 6 HA SER 6 69.586 10.772 5.123 39 HB2 SER 6 HB2 SER 6 71.163 11.406 6.959 40 HB3 SER 6 HB3 SER 6 70.025 12.686 6.512 41 HG SER 6 HG SER 6 68.728 11.577 8.313 42 H ILE 7 H ILE 7 71.428 9.395 5.738 43 HA ILE 7 HA ILE 7 70.550 6.745 6.166 44 HB ILE 7 HB ILE 7 72.428 7.480 4.677 45 HG12 ILE 7 HG12 ILE 7 73.202 5.290 6.670 46 HG13 ILE 7 HG13 ILE 7 72.214 5.108 5.233 47 HG21 ILE 7 HG21 ILE 7 73.977 7.789 7.239 48 HG22 ILE 7 HG22 ILE 7 73.526 9.069 6.120 49 HG23 ILE 7 HG23 ILE 7 74.670 7.822 5.617 50 HD11 ILE 7 HD11 ILE 7 75.100 5.931 5.272 51 HD12 ILE 7 HD12 ILE 7 74.101 5.664 3.842 52 HD13 ILE 7 HD13 ILE 7 74.478 4.320 4.918 53 H SER 8 H SER 8 71.510 9.162 8.356 54 HA SER 8 HA SER 8 72.618 7.332 10.273 55 HB2 SER 8 HB2 SER 8 72.357 10.312 10.230 56 HB3 SER 8 HB3 SER 8 73.035 9.432 11.618 57 HG SER 8 HG SER 8 74.277 8.410 9.666 58 H ASP 9 H ASP 9 69.483 8.214 9.587 59 HA ASP 9 HA ASP 9 68.713 7.726 12.399 60 HB2 ASP 9 HB2 ASP 9 67.539 9.656 11.042 61 HB3 ASP 9 HB3 ASP 9 66.812 8.366 10.146 62 H TYR 10 H TYR 10 69.677 6.105 9.990 63 HA TYR 10 HA TYR 10 67.543 4.127 9.822 64 HB2 TYR 10 HB2 TYR 10 69.810 4.862 8.017 65 HB3 TYR 10 HB3 TYR 10 69.357 3.171 8.091 66 HD1 TYR 10 HD1 TYR 10 66.971 2.576 7.541 67 HD2 TYR 10 HD2 TYR 10 68.641 6.371 6.656 68 HE1 TYR 10 HE1 TYR 10 65.229 2.927 5.853 69 HE2 TYR 10 HE2 TYR 10 66.883 6.741 4.959 70 HH TYR 10 HH TYR 10 65.263 5.524 3.628 71 H THR 11 H THR 11 67.818 2.465 11.225 72 HA THR 11 HA THR 11 70.428 1.814 12.211 73 HB THR 11 HB THR 11 69.274 -0.101 13.280 74 HG1 THR 11 HG1 THR 11 66.967 -0.275 12.907 75 HG21 THR 11 HG21 THR 11 67.544 1.083 14.589 76 HG22 THR 11 HG22 THR 11 67.649 2.442 13.466 77 HG23 THR 11 HG23 THR 11 69.039 1.996 14.460 78 H GLU 12 H GLU 12 71.226 -0.501 11.668 79 HA GLU 12 HA GLU 12 71.323 -0.791 8.929 80 HB2 GLU 12 HB2 GLU 12 72.165 -3.144 9.413 81 HB3 GLU 12 HB3 GLU 12 73.076 -1.803 10.081 82 HG2 GLU 12 HG2 GLU 12 72.161 -2.176 12.246 83 HG3 GLU 12 HG3 GLU 12 71.056 -3.397 11.651 84 H ALA 13 H ALA 13 69.109 -2.389 11.191 85 HA ALA 13 HA ALA 13 67.882 -3.933 9.131 86 HB1 ALA 13 HB1 ALA 13 67.749 -4.612 11.486 87 HB2 ALA 13 HB2 ALA 13 66.149 -4.469 10.753 88 HB3 ALA 13 HB3 ALA 13 66.750 -3.200 11.827 89 H GLU 14 H GLU 14 67.086 -0.739 10.532 90 HA GLU 14 HA GLU 14 64.681 -0.312 9.112 91 HB2 GLU 14 HB2 GLU 14 66.800 1.543 10.111 92 HB3 GLU 14 HB3 GLU 14 65.458 2.172 9.171 93 HG2 GLU 14 HG2 GLU 14 65.267 0.640 11.755 94 HG3 GLU 14 HG3 GLU 14 65.033 2.377 11.547 95 H PHE 15 H PHE 15 68.009 0.028 8.208 96 HA PHE 15 HA PHE 15 67.390 1.175 5.706 97 HB2 PHE 15 HB2 PHE 15 69.588 1.345 7.007 98 HB3 PHE 15 HB3 PHE 15 69.933 -0.257 6.385 99 HD1 PHE 15 HD1 PHE 15 68.958 3.133 5.238 100 HD2 PHE 15 HD2 PHE 15 70.976 -0.476 4.375 101 HE1 PHE 15 HE1 PHE 15 69.856 4.132 3.179 102 HE2 PHE 15 HE2 PHE 15 71.875 0.506 2.314 103 HZ PHE 15 HZ PHE 15 71.310 2.815 1.724 104 H VAL 16 H VAL 16 68.164 -2.135 6.829 105 HA VAL 16 HA VAL 16 68.043 -3.201 4.245 106 HB VAL 16 HB VAL 16 68.026 -5.362 5.037 107 HG11 VAL 16 HG11 VAL 16 69.478 -3.861 7.105 108 HG12 VAL 16 HG12 VAL 16 70.012 -4.403 5.514 109 HG13 VAL 16 HG13 VAL 16 69.646 -5.592 6.767 110 HG21 VAL 16 HG21 VAL 16 66.800 -4.467 7.598 111 HG22 VAL 16 HG22 VAL 16 67.439 -6.110 7.267 112 HG23 VAL 16 HG23 VAL 16 66.115 -5.451 6.294 113 H GLN 17 H GLN 17 65.487 -2.390 6.499 114 HA GLN 17 HA GLN 17 63.401 -3.726 5.302 115 HB2 GLN 17 HB2 GLN 17 63.389 -2.599 7.519 116 HB3 GLN 17 HB3 GLN 17 63.497 -1.048 6.714 117 HG2 GLN 17 HG2 GLN 17 61.300 -2.872 6.058 118 HG3 GLN 17 HG3 GLN 17 61.267 -2.003 7.601 119 HE21 GLN 17 HE21 GLN 17 59.527 -1.790 5.231 120 HE22 GLN 17 HE22 GLN 17 59.572 -0.139 4.721 121 H LEU 18 H LEU 18 64.764 -0.516 4.704 122 HA LEU 18 HA LEU 18 63.150 0.217 2.517 123 HB2 LEU 18 HB2 LEU 18 64.574 1.807 3.559 124 HB3 LEU 18 HB3 LEU 18 65.987 0.883 3.270 125 HG LEU 18 HG LEU 18 65.651 1.210 0.788 126 HD11 LEU 18 HD11 LEU 18 63.329 1.812 0.790 127 HD12 LEU 18 HD12 LEU 18 64.339 3.008 -0.019 128 HD13 LEU 18 HD13 LEU 18 63.721 3.333 1.598 129 HD21 LEU 18 HD21 LEU 18 66.586 3.449 0.764 130 HD22 LEU 18 HD22 LEU 18 67.329 2.408 1.979 131 HD23 LEU 18 HD23 LEU 18 66.156 3.644 2.469 132 H LEU 19 H LEU 19 66.196 -1.347 2.712 133 HA LEU 19 HA LEU 19 66.834 -1.784 0.021 134 HB2 LEU 19 HB2 LEU 19 67.320 -3.215 2.479 135 HB3 LEU 19 HB3 LEU 19 68.201 -3.640 0.983 136 HG LEU 19 HG LEU 19 68.301 -1.190 2.720 137 HD11 LEU 19 HD11 LEU 19 69.804 -2.862 3.308 138 HD12 LEU 19 HD12 LEU 19 70.692 -1.541 2.509 139 HD13 LEU 19 HD13 LEU 19 70.332 -3.029 1.640 140 HD21 LEU 19 HD21 LEU 19 69.718 -0.112 1.077 141 HD22 LEU 19 HD22 LEU 19 68.041 -0.286 0.573 142 HD23 LEU 19 HD23 LEU 19 69.286 -1.361 -0.103 143 H LYS 20 H LYS 20 64.943 -3.766 2.247 144 HA LYS 20 HA LYS 20 64.458 -5.838 0.390 145 HB2 LYS 20 HB2 LYS 20 62.996 -5.062 2.874 146 HB3 LYS 20 HB3 LYS 20 62.629 -6.465 1.843 147 HG2 LYS 20 HG2 LYS 20 64.943 -7.316 2.295 148 HG3 LYS 20 HG3 LYS 20 65.182 -5.957 3.371 149 HD2 LYS 20 HD2 LYS 20 63.335 -6.685 4.805 150 HD3 LYS 20 HD3 LYS 20 63.067 -8.078 3.759 151 HE2 LYS 20 HE2 LYS 20 65.648 -7.536 5.240 152 HE3 LYS 20 HE3 LYS 20 64.351 -8.561 5.846 153 HZ1 LYS 20 HZ1 LYS 20 66.220 -9.767 4.730 154 HZ2 LYS 20 HZ2 LYS 20 65.701 -9.115 3.244 155 HZ3 LYS 20 HZ3 LYS 20 64.696 -10.097 4.118 156 H GLU 21 H GLU 21 62.790 -2.898 1.273 157 HA GLU 21 HA GLU 21 60.594 -3.554 -0.357 158 HB2 GLU 21 HB2 GLU 21 61.414 -0.883 0.764 159 HB3 GLU 21 HB3 GLU 21 59.920 -1.194 -0.114 160 HG2 GLU 21 HG2 GLU 21 60.752 -2.358 2.522 161 HG3 GLU 21 HG3 GLU 21 59.415 -1.253 2.209 162 H ILE 22 H ILE 22 63.588 -1.869 -0.907 163 HA ILE 22 HA ILE 22 63.060 -1.074 -3.550 164 HB ILE 22 HB ILE 22 65.704 -2.095 -2.449 165 HG12 ILE 22 HG12 ILE 22 64.600 0.707 -2.572 166 HG13 ILE 22 HG13 ILE 22 64.768 -0.247 -1.113 167 HG21 ILE 22 HG21 ILE 22 66.678 -0.744 -4.232 168 HG22 ILE 22 HG22 ILE 22 65.064 -0.312 -4.796 169 HG23 ILE 22 HG23 ILE 22 65.611 -1.987 -4.885 170 HD11 ILE 22 HD11 ILE 22 67.212 -0.262 -1.446 171 HD12 ILE 22 HD12 ILE 22 66.538 1.355 -1.249 172 HD13 ILE 22 HD13 ILE 22 66.989 0.779 -2.854 173 H GLU 23 H GLU 23 64.253 -4.061 -2.161 174 HA GLU 23 HA GLU 23 64.489 -5.623 -4.445 175 HB2 GLU 23 HB2 GLU 23 65.352 -6.757 -2.671 176 HB3 GLU 23 HB3 GLU 23 64.226 -6.022 -1.548 177 HG2 GLU 23 HG2 GLU 23 62.527 -7.617 -2.138 178 HG3 GLU 23 HG3 GLU 23 63.543 -8.317 -3.376 179 H LYS 24 H LYS 24 61.739 -5.012 -2.377 180 HA LYS 24 HA LYS 24 59.809 -6.722 -3.423 181 HB2 LYS 24 HB2 LYS 24 59.734 -5.294 -1.338 182 HB3 LYS 24 HB3 LYS 24 59.401 -3.925 -2.368 183 HG2 LYS 24 HG2 LYS 24 57.318 -4.570 -1.506 184 HG3 LYS 24 HG3 LYS 24 57.364 -5.175 -3.162 185 HD2 LYS 24 HD2 LYS 24 56.427 -6.841 -1.649 186 HD3 LYS 24 HD3 LYS 24 57.945 -7.405 -2.341 187 HE2 LYS 24 HE2 LYS 24 57.771 -7.911 0.061 188 HE3 LYS 24 HE3 LYS 24 59.127 -6.846 -0.283 189 HZ1 LYS 24 HZ1 LYS 24 56.482 -5.971 0.787 190 HZ2 LYS 24 HZ2 LYS 24 57.836 -4.967 0.561 191 HZ3 LYS 24 HZ3 LYS 24 57.881 -6.185 1.679 192 H GLU 25 H GLU 25 60.526 -3.318 -4.222 193 HA GLU 25 HA GLU 25 58.609 -3.242 -6.311 194 HB2 GLU 25 HB2 GLU 25 60.762 -1.280 -5.526 195 HB3 GLU 25 HB3 GLU 25 59.485 -1.002 -6.686 196 HG2 GLU 25 HG2 GLU 25 59.038 -1.629 -3.784 197 HG3 GLU 25 HG3 GLU 25 59.000 -0.016 -4.495 198 H ASN 26 H ASN 26 62.022 -3.959 -6.145 199 HA ASN 26 HA ASN 26 62.422 -3.523 -8.959 200 HB2 ASN 26 HB2 ASN 26 64.309 -3.204 -7.419 201 HB3 ASN 26 HB3 ASN 26 64.242 -4.904 -6.970 202 HD21 ASN 26 HD21 ASN 26 65.111 -2.624 -9.484 203 HD22 ASN 26 HD22 ASN 26 66.023 -3.731 -10.419 204 H VAL 27 H VAL 27 61.939 -6.393 -6.918 205 HA VAL 27 HA VAL 27 62.355 -8.162 -9.106 206 HB VAL 27 HB VAL 27 61.477 -9.975 -7.722 207 HG11 VAL 27 HG11 VAL 27 63.078 -9.861 -5.869 208 HG12 VAL 27 HG12 VAL 27 63.323 -8.147 -6.208 209 HG13 VAL 27 HG13 VAL 27 63.779 -9.355 -7.407 210 HG21 VAL 27 HG21 VAL 27 60.786 -7.840 -5.695 211 HG22 VAL 27 HG22 VAL 27 60.692 -9.577 -5.418 212 HG23 VAL 27 HG23 VAL 27 59.631 -8.815 -6.607 213 H ALA 28 H ALA 28 59.663 -6.345 -8.106 214 HA ALA 28 HA ALA 28 57.902 -7.842 -9.904 215 HB1 ALA 28 HB1 ALA 28 57.300 -5.506 -8.087 216 HB2 ALA 28 HB2 ALA 28 56.992 -7.203 -7.715 217 HB3 ALA 28 HB3 ALA 28 56.114 -6.412 -9.026 218 H ALA 29 H ALA 29 59.957 -5.196 -9.817 219 HA ALA 29 HA ALA 29 60.428 -3.416 -11.017 220 HB1 ALA 29 HB1 ALA 29 59.176 -4.889 -13.330 221 HB2 ALA 29 HB2 ALA 29 60.830 -5.123 -12.750 222 HB3 ALA 29 HB3 ALA 29 60.337 -3.559 -13.411 223 H THR 30 H THR 30 58.973 -2.218 -9.761 224 HA THR 30 HA THR 30 56.517 -1.420 -11.109 225 HB THR 30 HB THR 30 55.994 -0.274 -8.998 226 HG1 THR 30 HG1 THR 30 57.499 -0.530 -7.248 227 HG21 THR 30 HG21 THR 30 55.488 -2.652 -9.114 228 HG22 THR 30 HG22 THR 30 56.002 -2.192 -7.473 229 HG23 THR 30 HG23 THR 30 57.132 -3.001 -8.565 230 H ASP 31 H ASP 31 56.390 1.242 -10.346 231 HA ASP 31 HA ASP 31 58.914 2.313 -11.256 232 HB2 ASP 31 HB2 ASP 31 57.948 3.804 -12.900 233 HB3 ASP 31 HB3 ASP 31 57.584 2.137 -13.298 234 H ASP 32 H ASP 32 55.836 3.087 -9.752 235 HA ASP 32 HA ASP 32 56.628 5.754 -9.082 236 HB2 ASP 32 HB2 ASP 32 54.250 5.135 -9.169 237 HB3 ASP 32 HB3 ASP 32 54.494 4.050 -7.802 238 H VAL 33 H VAL 33 56.629 2.887 -7.053 239 HA VAL 33 HA VAL 33 57.958 4.528 -5.137 240 HB VAL 33 HB VAL 33 56.901 1.699 -5.016 241 HG11 VAL 33 HG11 VAL 33 58.274 3.325 -2.944 242 HG12 VAL 33 HG12 VAL 33 58.999 1.991 -3.854 243 HG13 VAL 33 HG13 VAL 33 57.637 1.663 -2.734 244 HG21 VAL 33 HG21 VAL 33 55.362 3.513 -4.891 245 HG22 VAL 33 HG22 VAL 33 56.417 4.242 -3.666 246 HG23 VAL 33 HG23 VAL 33 55.561 2.721 -3.295 247 H LEU 34 H LEU 34 58.658 2.205 -7.499 248 HA LEU 34 HA LEU 34 61.167 1.324 -6.648 249 HB2 LEU 34 HB2 LEU 34 59.693 0.486 -8.590 250 HB3 LEU 34 HB3 LEU 34 60.250 1.893 -9.428 251 HG LEU 34 HG LEU 34 61.318 -0.363 -9.981 252 HD11 LEU 34 HD11 LEU 34 62.908 2.112 -9.583 253 HD12 LEU 34 HD12 LEU 34 61.898 1.663 -10.968 254 HD13 LEU 34 HD13 LEU 34 63.353 0.730 -10.600 255 HD21 LEU 34 HD21 LEU 34 61.955 -1.002 -7.707 256 HD22 LEU 34 HD22 LEU 34 62.975 0.434 -7.588 257 HD23 LEU 34 HD23 LEU 34 63.371 -0.837 -8.746 258 H ASP 35 H ASP 35 60.229 4.168 -8.662 259 HA ASP 35 HA ASP 35 62.892 5.025 -8.676 260 HB2 ASP 35 HB2 ASP 35 60.354 6.108 -9.691 261 HB3 ASP 35 HB3 ASP 35 61.646 7.251 -9.388 262 H VAL 36 H VAL 36 60.445 5.381 -6.347 263 HA VAL 36 HA VAL 36 61.543 7.728 -5.142 264 HB VAL 36 HB VAL 36 60.291 5.419 -3.673 265 HG11 VAL 36 HG11 VAL 36 59.803 7.120 -1.969 266 HG12 VAL 36 HG12 VAL 36 60.667 8.297 -2.997 267 HG13 VAL 36 HG13 VAL 36 61.536 6.919 -2.322 268 HG21 VAL 36 HG21 VAL 36 58.864 6.269 -5.381 269 HG22 VAL 36 HG22 VAL 36 58.981 7.899 -4.632 270 HG23 VAL 36 HG23 VAL 36 58.277 6.519 -3.731 271 H LEU 37 H LEU 37 61.846 4.318 -4.727 272 HA LEU 37 HA LEU 37 63.496 4.462 -2.468 273 HB2 LEU 37 HB2 LEU 37 63.268 2.125 -4.280 274 HB3 LEU 37 HB3 LEU 37 63.707 2.299 -2.592 275 HG LEU 37 HG LEU 37 60.938 2.895 -3.530 276 HD11 LEU 37 HD11 LEU 37 61.350 0.543 -3.807 277 HD12 LEU 37 HD12 LEU 37 60.233 0.861 -2.487 278 HD13 LEU 37 HD13 LEU 37 61.911 0.422 -2.132 279 HD21 LEU 37 HD21 LEU 37 61.573 4.105 -1.525 280 HD22 LEU 37 HD22 LEU 37 62.093 2.604 -0.761 281 HD23 LEU 37 HD23 LEU 37 60.390 2.856 -1.142 282 H LEU 38 H LEU 38 64.095 3.873 -5.828 283 HA LEU 38 HA LEU 38 66.802 3.260 -5.582 284 HB2 LEU 38 HB2 LEU 38 65.184 4.484 -7.737 285 HB3 LEU 38 HB3 LEU 38 66.890 4.065 -8.026 286 HG LEU 38 HG LEU 38 64.384 2.464 -7.845 287 HD11 LEU 38 HD11 LEU 38 65.358 3.101 -9.969 288 HD12 LEU 38 HD12 LEU 38 65.341 1.338 -9.728 289 HD13 LEU 38 HD13 LEU 38 66.834 2.246 -9.485 290 HD21 LEU 38 HD21 LEU 38 67.089 1.285 -7.254 291 HD22 LEU 38 HD22 LEU 38 65.600 0.381 -7.528 292 HD23 LEU 38 HD23 LEU 38 65.749 1.423 -6.112 293 H GLU 39 H GLU 39 65.188 6.364 -5.993 294 HA GLU 39 HA GLU 39 67.597 7.866 -5.995 295 HB2 GLU 39 HB2 GLU 39 64.728 8.538 -5.518 296 HB3 GLU 39 HB3 GLU 39 66.017 9.724 -5.502 297 HG2 GLU 39 HG2 GLU 39 65.210 7.985 -7.826 298 HG3 GLU 39 HG3 GLU 39 64.851 9.702 -7.584 299 H HIS 40 H HIS 40 65.183 7.074 -3.607 300 HA HIS 40 HA HIS 40 66.015 8.699 -1.550 301 HB2 HIS 40 HB2 HIS 40 63.869 7.489 -1.692 302 HB3 HIS 40 HB3 HIS 40 64.678 5.991 -1.389 303 HD1 HIS 40 HD1 HIS 40 63.136 8.831 0.387 304 HD2 HIS 40 HD2 HIS 40 65.787 5.752 1.254 305 HE1 HIS 40 HE1 HIS 40 63.227 8.654 2.884 306 H PHE 41 H PHE 41 66.826 5.404 -2.305 307 HA PHE 41 HA PHE 41 68.502 4.884 -0.156 308 HB2 PHE 41 HB2 PHE 41 67.717 3.086 -1.377 309 HB3 PHE 41 HB3 PHE 41 68.161 3.812 -2.912 310 HD1 PHE 41 HD1 PHE 41 69.563 2.362 0.195 311 HD2 PHE 41 HD2 PHE 41 70.155 3.170 -3.926 312 HE1 PHE 41 HE1 PHE 41 71.649 1.051 0.238 313 HE2 PHE 41 HE2 PHE 41 72.231 1.883 -3.874 314 HZ PHE 41 HZ PHE 41 72.982 0.820 -1.816 315 H VAL 42 H VAL 42 69.274 6.040 -3.413 316 HA VAL 42 HA VAL 42 72.006 6.239 -2.772 317 HB VAL 42 HB VAL 42 71.274 5.852 -5.048 318 HG11 VAL 42 HG11 VAL 42 69.405 7.104 -5.195 319 HG12 VAL 42 HG12 VAL 42 70.563 7.441 -6.485 320 HG13 VAL 42 HG13 VAL 42 70.338 8.629 -5.160 321 HG21 VAL 42 HG21 VAL 42 72.832 7.353 -6.209 322 HG22 VAL 42 HG22 VAL 42 73.523 6.662 -4.733 323 HG23 VAL 42 HG23 VAL 42 72.941 8.319 -4.744 324 H LYS 43 H LYS 43 69.473 8.526 -2.510 325 HA LYS 43 HA LYS 43 71.193 10.816 -2.199 326 HB2 LYS 43 HB2 LYS 43 69.303 12.080 -1.524 327 HB3 LYS 43 HB3 LYS 43 68.677 10.913 -2.678 328 HG2 LYS 43 HG2 LYS 43 67.936 9.486 -0.685 329 HG3 LYS 43 HG3 LYS 43 68.473 10.805 0.318 330 HD2 LYS 43 HD2 LYS 43 66.351 11.102 -1.788 331 HD3 LYS 43 HD3 LYS 43 66.037 10.808 -0.082 332 HE2 LYS 43 HE2 LYS 43 67.183 12.885 0.490 333 HE3 LYS 43 HE3 LYS 43 67.508 13.187 -1.217 334 HZ1 LYS 43 HZ1 LYS 43 65.582 14.419 -0.429 335 HZ2 LYS 43 HZ2 LYS 43 64.794 12.975 -0.021 336 HZ3 LYS 43 HZ3 LYS 43 65.160 13.319 -1.623 337 H ILE 44 H ILE 44 70.020 8.482 0.096 338 HA ILE 44 HA ILE 44 71.071 10.022 2.321 339 HB ILE 44 HB ILE 44 70.323 8.084 3.715 340 HG12 ILE 44 HG12 ILE 44 69.374 7.034 1.038 341 HG13 ILE 44 HG13 ILE 44 70.542 6.273 2.095 342 HG21 ILE 44 HG21 ILE 44 68.236 9.229 1.858 343 HG22 ILE 44 HG22 ILE 44 68.859 10.008 3.306 344 HG23 ILE 44 HG23 ILE 44 67.925 8.517 3.441 345 HD11 ILE 44 HD11 ILE 44 68.783 5.882 3.735 346 HD12 ILE 44 HD12 ILE 44 68.388 5.167 2.162 347 HD13 ILE 44 HD13 ILE 44 67.631 6.674 2.666 348 H THR 45 H THR 45 72.040 7.323 0.350 349 HA THR 45 HA THR 45 74.284 6.720 2.054 350 HB THR 45 HB THR 45 74.888 5.111 0.268 351 HG1 THR 45 HG1 THR 45 72.417 5.513 -0.953 352 HG21 THR 45 HG21 THR 45 72.000 4.999 1.124 353 HG22 THR 45 HG22 THR 45 73.369 4.487 2.104 354 HG23 THR 45 HG23 THR 45 72.986 3.630 0.607 355 H GLU 46 H GLU 46 73.592 8.513 -0.856 356 HA GLU 46 HA GLU 46 74.722 9.809 -2.228 357 HB2 GLU 46 HB2 GLU 46 76.262 10.092 0.296 358 HB3 GLU 46 HB3 GLU 46 76.746 11.018 -1.143 359 HG2 GLU 46 HG2 GLU 46 74.006 11.041 0.088 360 HG3 GLU 46 HG3 GLU 46 75.266 12.191 0.532 361 H HIS 47 H HIS 47 75.142 7.098 -2.240 362 HA HIS 47 HA HIS 47 77.912 6.560 -2.701 363 HB2 HIS 47 HB2 HIS 47 76.200 4.920 -1.735 364 HB3 HIS 47 HB3 HIS 47 75.552 4.778 -3.367 365 HD1 HIS 47 HD1 HIS 47 76.761 3.105 -4.902 366 HD2 HIS 47 HD2 HIS 47 78.851 4.025 -1.458 367 HE1 HIS 47 HE1 HIS 47 78.869 1.719 -4.942 368 HA PRO 48 HA PRO 48 77.719 7.971 -6.993 369 HB2 PRO 48 HB2 PRO 48 79.894 6.056 -7.411 370 HB3 PRO 48 HB3 PRO 48 79.876 7.806 -7.694 371 HG2 PRO 48 HG2 PRO 48 81.187 6.564 -5.800 372 HG3 PRO 48 HG3 PRO 48 80.439 8.149 -5.402 373 HD2 PRO 48 HD2 PRO 48 79.585 5.343 -4.789 374 HD3 PRO 48 HD3 PRO 48 79.495 6.767 -3.744 375 H ASP 49 H ASP 49 77.343 4.811 -6.022 376 HA ASP 49 HA ASP 49 76.782 4.049 -8.679 377 HB2 ASP 49 HB2 ASP 49 78.150 2.269 -6.636 378 HB3 ASP 49 HB3 ASP 49 77.668 1.736 -8.231 379 H GLY 50 H GLY 50 75.222 5.051 -6.530 380 HA2 GLY 50 HA2 GLY 50 73.995 3.483 -4.546 381 HA3 GLY 50 HA3 GLY 50 73.267 4.779 -5.450 382 H THR 51 H THR 51 72.853 3.977 -7.721 383 HA THR 51 HA THR 51 70.819 2.088 -6.960 384 HB THR 51 HB THR 51 70.929 3.167 -9.767 385 HG1 THR 51 HG1 THR 51 69.974 4.501 -7.398 386 HG21 THR 51 HG21 THR 51 68.701 2.658 -7.771 387 HG22 THR 51 HG22 THR 51 69.218 1.513 -8.983 388 HG23 THR 51 HG23 THR 51 68.529 3.079 -9.469 389 H ALA 52 H ALA 52 73.753 2.040 -8.706 390 HA ALA 52 HA ALA 52 73.435 -0.465 -10.057 391 HB1 ALA 52 HB1 ALA 52 75.184 1.172 -10.687 392 HB2 ALA 52 HB2 ALA 52 75.854 -0.411 -10.299 393 HB3 ALA 52 HB3 ALA 52 75.960 0.905 -9.128 394 H LEU 53 H LEU 53 74.294 0.451 -6.817 395 HA LEU 53 HA LEU 53 75.121 -2.142 -6.084 396 HB2 LEU 53 HB2 LEU 53 73.907 -0.029 -4.329 397 HB3 LEU 53 HB3 LEU 53 74.567 -1.533 -3.735 398 HG LEU 53 HG LEU 53 76.017 0.797 -4.934 399 HD11 LEU 53 HD11 LEU 53 77.215 0.706 -2.830 400 HD12 LEU 53 HD12 LEU 53 76.221 -0.662 -2.325 401 HD13 LEU 53 HD13 LEU 53 75.481 0.915 -2.601 402 HD21 LEU 53 HD21 LEU 53 76.994 -1.164 -5.954 403 HD22 LEU 53 HD22 LEU 53 77.077 -1.976 -4.400 404 HD23 LEU 53 HD23 LEU 53 78.085 -0.556 -4.708 405 H ILE 54 H ILE 54 72.063 -0.636 -6.236 406 HA ILE 54 HA ILE 54 70.577 -2.752 -5.018 407 HB ILE 54 HB ILE 54 69.828 -0.500 -6.878 408 HG12 ILE 54 HG12 ILE 54 68.739 -1.044 -4.162 409 HG13 ILE 54 HG13 ILE 54 70.276 -0.253 -4.257 410 HG21 ILE 54 HG21 ILE 54 67.924 -2.589 -5.811 411 HG22 ILE 54 HG22 ILE 54 68.348 -2.331 -7.503 412 HG23 ILE 54 HG23 ILE 54 67.454 -1.092 -6.615 413 HD11 ILE 54 HD11 ILE 54 68.563 1.379 -4.015 414 HD12 ILE 54 HD12 ILE 54 67.636 0.682 -5.345 415 HD13 ILE 54 HD13 ILE 54 69.165 1.495 -5.666 416 H TYR 55 H TYR 55 71.451 -1.916 -8.267 417 HA TYR 55 HA TYR 55 70.194 -4.013 -9.580 418 HB2 TYR 55 HB2 TYR 55 72.311 -2.086 -10.248 419 HB3 TYR 55 HB3 TYR 55 72.117 -3.458 -11.311 420 HD1 TYR 55 HD1 TYR 55 69.601 -3.895 -12.037 421 HD2 TYR 55 HD2 TYR 55 71.062 -0.157 -10.649 422 HE1 TYR 55 HE1 TYR 55 67.731 -2.771 -13.131 423 HE2 TYR 55 HE2 TYR 55 69.185 0.989 -11.743 424 HH TYR 55 HH TYR 55 66.502 -0.735 -12.944 425 H GLU 56 H GLU 56 73.553 -3.830 -8.342 426 HA GLU 56 HA GLU 56 74.046 -6.473 -9.233 427 HB2 GLU 56 HB2 GLU 56 75.958 -6.497 -7.584 428 HB3 GLU 56 HB3 GLU 56 76.053 -5.272 -8.847 429 HG2 GLU 56 HG2 GLU 56 75.707 -3.587 -7.407 430 HG3 GLU 56 HG3 GLU 56 74.895 -4.532 -6.183 431 H ALA 57 H ALA 57 72.858 -5.167 -6.189 432 HA ALA 57 HA ALA 57 72.978 -7.491 -4.661 433 HB1 ALA 57 HB1 ALA 57 72.470 -5.281 -3.741 434 HB2 ALA 57 HB2 ALA 57 71.286 -6.495 -3.246 435 HB3 ALA 57 HB3 ALA 57 70.886 -5.337 -4.514 436 H ALA 58 H ALA 58 70.456 -6.395 -6.862 437 HA ALA 58 HA ALA 58 68.594 -8.415 -6.328 438 HB1 ALA 58 HB1 ALA 58 68.058 -6.402 -7.635 439 HB2 ALA 58 HB2 ALA 58 67.606 -7.871 -8.492 440 HB3 ALA 58 HB3 ALA 58 69.067 -6.998 -8.955 441 H ALA 59 H ALA 59 71.272 -8.301 -8.612 442 HA ALA 59 HA ALA 59 70.797 -10.886 -9.724 443 HB1 ALA 59 HB1 ALA 59 73.314 -9.213 -9.774 444 HB2 ALA 59 HB2 ALA 59 72.012 -9.140 -10.959 445 HB3 ALA 59 HB3 ALA 59 72.979 -10.607 -10.802 446 H ARG 60 H ARG 60 72.843 -9.606 -7.193 447 HA ARG 60 HA ARG 60 74.330 -11.884 -6.577 448 HB2 ARG 60 HB2 ARG 60 73.475 -9.510 -4.932 449 HB3 ARG 60 HB3 ARG 60 74.436 -10.806 -4.231 450 HG2 ARG 60 HG2 ARG 60 76.276 -10.285 -5.632 451 HG3 ARG 60 HG3 ARG 60 75.282 -9.234 -6.643 452 HD2 ARG 60 HD2 ARG 60 76.747 -7.952 -5.124 453 HD3 ARG 60 HD3 ARG 60 75.050 -7.639 -4.830 454 HE ARG 60 HE ARG 60 75.782 -9.614 -3.044 455 HH11 ARG 60 HH11 ARG 60 76.889 -6.298 -3.742 456 HH12 ARG 60 HH12 ARG 60 77.265 -5.922 -2.129 457 HH21 ARG 60 HH21 ARG 60 76.302 -9.078 -0.744 458 HH22 ARG 60 HH22 ARG 60 76.914 -7.535 -0.401 459 H ALA 61 H ALA 61 71.172 -10.818 -5.411 460 HA ALA 61 HA ALA 61 70.803 -13.077 -3.670 461 HB1 ALA 61 HB1 ALA 61 69.651 -10.952 -3.306 462 HB2 ALA 61 HB2 ALA 61 68.515 -12.294 -3.456 463 HB3 ALA 61 HB3 ALA 61 68.753 -11.182 -4.805 464 H ALA 62 H ALA 62 70.036 -12.362 -6.995 465 HA ALA 62 HA ALA 62 68.269 -14.516 -7.427 466 HB1 ALA 62 HB1 ALA 62 68.674 -14.139 -9.811 467 HB2 ALA 62 HB2 ALA 62 70.070 -13.134 -9.422 468 HB3 ALA 62 HB3 ALA 62 68.451 -12.603 -8.972 469 H ALA 63 H ALA 63 71.747 -14.187 -7.693 470 HA ALA 63 HA ALA 63 72.118 -16.918 -8.495 471 HB1 ALA 63 HB1 ALA 63 74.504 -16.459 -8.198 472 HB2 ALA 63 HB2 ALA 63 74.122 -14.922 -7.426 473 HB3 ALA 63 HB3 ALA 63 73.740 -15.171 -9.129 474 H ASN 64 H ASN 64 72.599 -15.023 -5.569 475 HA ASN 64 HA ASN 64 72.731 -15.430 -3.428 476 HB2 ASN 64 HB2 ASN 64 70.508 -16.423 -3.657 477 HB3 ASN 64 HB3 ASN 64 71.217 -17.980 -4.047 478 HD21 ASN 64 HD21 ASN 64 72.170 -15.635 -1.528 479 HD22 ASN 64 HD22 ASN 64 71.906 -16.713 -0.212 480 HA PRO 65 HA PRO 65 76.492 -17.908 -3.842 481 HB2 PRO 65 HB2 PRO 65 78.061 -16.245 -2.419 482 HB3 PRO 65 HB3 PRO 65 77.645 -15.918 -4.106 483 HG2 PRO 65 HG2 PRO 65 76.462 -14.775 -1.608 484 HG3 PRO 65 HG3 PRO 65 76.897 -13.946 -3.112 485 HD2 PRO 65 HD2 PRO 65 74.365 -14.681 -2.488 486 HD3 PRO 65 HD3 PRO 65 74.947 -14.571 -4.159 487 H GLY 66 H GLY 66 78.065 -18.634 -2.061 488 HA2 GLY 66 HA2 GLY 66 76.539 -19.700 0.161 489 HA3 GLY 66 HA3 GLY 66 78.237 -20.031 -0.214 490 H GLY 67 H GLY 67 76.077 -17.576 0.927 491 HA2 GLY 67 HA2 GLY 67 76.704 -16.806 3.222 492 HA3 GLY 67 HA3 GLY 67 78.300 -16.587 2.469 493 H ASP 68 H ASP 68 77.143 -14.423 3.598 494 HA ASP 68 HA ASP 68 76.833 -12.206 3.225 495 HB2 ASP 68 HB2 ASP 68 78.327 -12.359 1.264 496 HB3 ASP 68 HB3 ASP 68 76.965 -12.853 0.264 497 H GLY 69 H GLY 69 75.000 -14.053 0.904 498 HA2 GLY 69 HA2 GLY 69 72.621 -14.316 1.130 499 HA3 GLY 69 HA3 GLY 69 72.538 -12.680 1.775 500 H GLY 70 H GLY 70 74.158 -11.333 0.028 501 HA2 GLY 70 HA2 GLY 70 74.470 -10.767 -2.157 502 HA3 GLY 70 HA3 GLY 70 73.221 -11.903 -2.636 503 H GLY 71 H GLY 71 71.112 -10.989 -1.026 504 HA2 GLY 71 HA2 GLY 71 70.341 -8.850 -2.775 505 HA3 GLY 71 HA3 GLY 71 69.299 -9.733 -1.687 506 HA PRO 72 HA PRO 72 68.936 -5.568 -0.199 507 HB2 PRO 72 HB2 PRO 72 67.339 -6.215 1.959 508 HB3 PRO 72 HB3 PRO 72 66.797 -5.864 0.313 509 HG2 PRO 72 HG2 PRO 72 67.235 -8.491 1.647 510 HG3 PRO 72 HG3 PRO 72 65.958 -8.006 0.521 511 HD2 PRO 72 HD2 PRO 72 68.026 -9.502 -0.230 512 HD3 PRO 72 HD3 PRO 72 67.326 -8.316 -1.344 513 H GLU 73 H GLU 73 69.509 -8.116 2.166 514 HA GLU 73 HA GLU 73 70.591 -6.249 3.956 515 HB2 GLU 73 HB2 GLU 73 70.611 -9.263 4.073 516 HB3 GLU 73 HB3 GLU 73 71.041 -8.179 5.392 517 HG2 GLU 73 HG2 GLU 73 68.838 -7.215 5.395 518 HG3 GLU 73 HG3 GLU 73 68.374 -8.191 4.018 519 H GLY 74 H GLY 74 71.892 -7.300 1.216 520 HA2 GLY 74 HA2 GLY 74 74.507 -6.911 2.393 521 HA3 GLY 74 HA3 GLY 74 74.322 -7.860 0.876 522 H ILE 75 H ILE 75 72.265 -5.304 0.737 523 HA ILE 75 HA ILE 75 74.063 -3.732 -0.887 524 HB ILE 75 HB ILE 75 71.558 -2.430 0.072 525 HG12 ILE 75 HG12 ILE 75 71.456 -4.978 -1.626 526 HG13 ILE 75 HG13 ILE 75 70.739 -4.653 -0.099 527 HG21 ILE 75 HG21 ILE 75 72.793 -2.883 -2.622 528 HG22 ILE 75 HG22 ILE 75 73.017 -1.467 -1.598 529 HG23 ILE 75 HG23 ILE 75 71.423 -1.811 -2.298 530 HD11 ILE 75 HD11 ILE 75 69.910 -3.105 -2.530 531 HD12 ILE 75 HD12 ILE 75 69.128 -3.172 -0.938 532 HD13 ILE 75 HD13 ILE 75 69.122 -4.580 -1.976 533 H VAL 76 H VAL 76 72.438 -3.477 2.144 534 HA VAL 76 HA VAL 76 73.350 -1.050 3.169 535 HB VAL 76 HB VAL 76 71.587 -2.211 4.170 536 HG11 VAL 76 HG11 VAL 76 71.585 -4.214 3.674 537 HG12 VAL 76 HG12 VAL 76 71.861 -4.322 5.433 538 HG13 VAL 76 HG13 VAL 76 73.193 -4.591 4.301 539 HG21 VAL 76 HG21 VAL 76 73.862 -2.300 6.143 540 HG22 VAL 76 HG22 VAL 76 72.152 -2.358 6.575 541 HG23 VAL 76 HG23 VAL 76 72.823 -0.911 5.824 542 H LYS 77 H LYS 77 74.544 -4.156 3.401 543 HA LYS 77 HA LYS 77 76.804 -3.851 5.000 544 HB2 LYS 77 HB2 LYS 77 75.864 -6.017 4.318 545 HB3 LYS 77 HB3 LYS 77 76.382 -5.719 2.674 546 HG2 LYS 77 HG2 LYS 77 78.711 -5.865 3.373 547 HG3 LYS 77 HG3 LYS 77 78.193 -6.140 5.043 548 HD2 LYS 77 HD2 LYS 77 76.950 -8.101 4.346 549 HD3 LYS 77 HD3 LYS 77 77.471 -7.856 2.682 550 HE2 LYS 77 HE2 LYS 77 79.785 -8.201 3.358 551 HE3 LYS 77 HE3 LYS 77 79.270 -8.431 5.034 552 HZ1 LYS 77 HZ1 LYS 77 78.404 -10.073 2.740 553 HZ2 LYS 77 HZ2 LYS 77 78.024 -10.374 4.359 554 HZ3 LYS 77 HZ3 LYS 77 79.605 -10.559 3.815 555 H GLU 78 H GLU 78 76.493 -3.719 1.477 556 HA GLU 78 HA GLU 78 79.136 -3.100 0.831 557 HB2 GLU 78 HB2 GLU 78 77.230 -3.848 -0.668 558 HB3 GLU 78 HB3 GLU 78 76.663 -2.187 -0.630 559 HG2 GLU 78 HG2 GLU 78 77.911 -2.633 -2.639 560 HG3 GLU 78 HG3 GLU 78 78.762 -1.459 -1.630 561 H ILE 79 H ILE 79 76.363 -1.079 1.634 562 HA ILE 79 HA ILE 79 77.586 1.433 1.181 563 HB ILE 79 HB ILE 79 75.228 0.815 3.022 564 HG12 ILE 79 HG12 ILE 79 74.829 0.237 0.631 565 HG13 ILE 79 HG13 ILE 79 73.827 1.576 1.182 566 HG21 ILE 79 HG21 ILE 79 74.706 3.157 2.922 567 HG22 ILE 79 HG22 ILE 79 76.149 3.462 1.956 568 HG23 ILE 79 HG23 ILE 79 76.307 2.895 3.621 569 HD11 ILE 79 HD11 ILE 79 74.633 2.014 -1.021 570 HD12 ILE 79 HD12 ILE 79 76.296 1.723 -0.524 571 HD13 ILE 79 HD13 ILE 79 75.421 3.127 0.099 572 H LYS 80 H LYS 80 77.243 -0.521 4.128 573 HA LYS 80 HA LYS 80 78.326 1.445 5.817 574 HB2 LYS 80 HB2 LYS 80 78.448 -0.214 7.564 575 HB3 LYS 80 HB3 LYS 80 77.054 -0.645 6.598 576 HG2 LYS 80 HG2 LYS 80 78.313 -2.381 5.502 577 HG3 LYS 80 HG3 LYS 80 79.736 -1.961 6.444 578 HD2 LYS 80 HD2 LYS 80 78.463 -2.442 8.512 579 HD3 LYS 80 HD3 LYS 80 77.100 -2.954 7.515 580 HE2 LYS 80 HE2 LYS 80 78.332 -4.909 8.212 581 HE3 LYS 80 HE3 LYS 80 78.554 -4.671 6.482 582 HZ1 LYS 80 HZ1 LYS 80 80.739 -3.632 6.988 583 HZ2 LYS 80 HZ2 LYS 80 80.657 -5.221 7.514 584 HZ3 LYS 80 HZ3 LYS 80 80.496 -3.960 8.614 585 H GLU 81 H GLU 81 79.795 -1.031 3.871 586 HA GLU 81 HA GLU 81 82.398 -0.739 4.931 587 HB2 GLU 81 HB2 GLU 81 81.504 -1.890 2.285 588 HB3 GLU 81 HB3 GLU 81 83.107 -2.094 2.988 589 HG2 GLU 81 HG2 GLU 81 82.127 -3.250 4.897 590 HG3 GLU 81 HG3 GLU 81 80.523 -3.034 4.210 591 H TRP 82 H TRP 82 80.691 0.754 2.274 592 HA TRP 82 HA TRP 82 82.902 2.169 1.124 593 HB2 TRP 82 HB2 TRP 82 80.576 1.756 0.103 594 HB3 TRP 82 HB3 TRP 82 80.059 3.023 1.225 595 HD1 TRP 82 HD1 TRP 82 82.373 2.614 -1.846 596 HE1 TRP 82 HE1 TRP 82 82.440 4.853 -3.098 597 HE3 TRP 82 HE3 TRP 82 79.729 5.462 1.480 598 HZ2 TRP 82 HZ2 TRP 82 81.495 7.476 -2.739 599 HZ3 TRP 82 HZ3 TRP 82 79.365 7.831 0.979 600 HH2 TRP 82 HH2 TRP 82 80.222 8.844 -1.057 601 H ARG 83 H ARG 83 80.359 2.925 3.365 602 HA ARG 83 HA ARG 83 80.867 5.640 3.757 603 HB2 ARG 83 HB2 ARG 83 78.894 3.950 4.497 604 HB3 ARG 83 HB3 ARG 83 79.910 3.997 5.950 605 HG2 ARG 83 HG2 ARG 83 78.221 5.584 6.282 606 HG3 ARG 83 HG3 ARG 83 79.778 6.361 5.959 607 HD2 ARG 83 HD2 ARG 83 79.125 6.934 3.724 608 HD3 ARG 83 HD3 ARG 83 77.613 6.031 3.896 609 HE ARG 83 HE ARG 83 77.647 7.836 5.965 610 HH11 ARG 83 HH11 ARG 83 77.463 8.112 2.393 611 HH12 ARG 83 HH12 ARG 83 76.748 9.642 2.504 612 HH21 ARG 83 HH21 ARG 83 76.642 9.883 5.992 613 HH22 ARG 83 HH22 ARG 83 76.281 10.668 4.524 614 H ALA 84 H ALA 84 81.872 2.754 5.592 615 HA ALA 84 HA ALA 84 83.323 4.114 7.595 616 HB1 ALA 84 HB1 ALA 84 82.462 1.861 7.895 617 HB2 ALA 84 HB2 ALA 84 84.210 1.906 8.154 618 HB3 ALA 84 HB3 ALA 84 83.553 1.266 6.649 619 H ALA 85 H ALA 85 84.328 2.549 4.556 620 HA ALA 85 HA ALA 85 87.089 2.953 4.948 621 HB1 ALA 85 HB1 ALA 85 87.332 2.436 2.575 622 HB2 ALA 85 HB2 ALA 85 85.590 2.630 2.350 623 HB3 ALA 85 HB3 ALA 85 86.209 1.316 3.346 624 H ASN 86 H ASN 86 84.578 4.936 3.612 625 HA ASN 86 HA ASN 86 86.356 6.967 2.618 626 HB2 ASN 86 HB2 ASN 86 83.854 6.500 1.931 627 HB3 ASN 86 HB3 ASN 86 83.476 7.387 3.386 628 HD21 ASN 86 HD21 ASN 86 82.938 7.942 0.597 629 HD22 ASN 86 HD22 ASN 86 83.565 9.517 0.280 630 H GLY 87 H GLY 87 84.519 6.346 5.552 631 HA2 GLY 87 HA2 GLY 87 85.242 7.020 7.692 632 HA3 GLY 87 HA3 GLY 87 86.119 8.352 6.949 633 H LYS 88 H LYS 88 82.735 7.455 6.239 634 HA LYS 88 HA LYS 88 81.968 10.061 7.174 635 HB2 LYS 88 HB2 LYS 88 81.435 8.367 4.801 636 HB3 LYS 88 HB3 LYS 88 80.173 9.443 5.358 637 HG2 LYS 88 HG2 LYS 88 81.507 11.364 4.923 638 HG3 LYS 88 HG3 LYS 88 82.987 10.416 4.887 639 HD2 LYS 88 HD2 LYS 88 82.430 11.187 2.660 640 HD3 LYS 88 HD3 LYS 88 82.283 9.447 2.739 641 HE2 LYS 88 HE2 LYS 88 80.539 10.507 1.425 642 HE3 LYS 88 HE3 LYS 88 79.877 9.602 2.766 643 HZ1 LYS 88 HZ1 LYS 88 80.278 12.573 2.663 644 HZ2 LYS 88 HZ2 LYS 88 79.555 11.776 3.932 645 HZ3 LYS 88 HZ3 LYS 88 78.824 11.819 2.424 646 HA PRO 89 HA PRO 89 79.315 7.837 10.020 647 HB2 PRO 89 HB2 PRO 89 77.226 9.601 10.101 648 HB3 PRO 89 HB3 PRO 89 78.718 9.818 11.023 649 HG2 PRO 89 HG2 PRO 89 77.918 10.994 8.388 650 HG3 PRO 89 HG3 PRO 89 78.690 11.790 9.774 651 HD2 PRO 89 HD2 PRO 89 80.148 11.066 7.663 652 HD3 PRO 89 HD3 PRO 89 80.777 10.832 9.305 653 H GLY 90 H GLY 90 78.020 6.215 9.630 654 HA2 GLY 90 HA2 GLY 90 76.352 6.339 7.233 655 HA3 GLY 90 HA3 GLY 90 76.991 4.866 7.952 656 H PHE 91 H PHE 91 75.762 3.768 9.248 657 HA PHE 91 HA PHE 91 73.031 4.655 9.583 658 HB2 PHE 91 HB2 PHE 91 74.230 1.970 10.303 659 HB3 PHE 91 HB3 PHE 91 72.545 2.378 10.056 660 HD1 PHE 91 HD1 PHE 91 71.834 3.147 7.752 661 HD2 PHE 91 HD2 PHE 91 75.524 1.191 8.528 662 HE1 PHE 91 HE1 PHE 91 72.028 2.560 5.393 663 HE2 PHE 91 HE2 PHE 91 75.710 0.616 6.140 664 HZ PHE 91 HZ PHE 91 73.958 1.299 4.586 665 H LYS 92 H LYS 92 71.958 4.131 11.665 666 HA LYS 92 HA LYS 92 73.673 4.784 13.874 667 HB2 LYS 92 HB2 LYS 92 71.671 5.326 14.980 668 HB3 LYS 92 HB3 LYS 92 71.631 6.123 13.441 669 HG2 LYS 92 HG2 LYS 92 70.085 4.436 12.608 670 HG3 LYS 92 HG3 LYS 92 70.233 3.560 14.137 671 HD2 LYS 92 HD2 LYS 92 69.159 6.370 13.863 672 HD3 LYS 92 HD3 LYS 92 68.148 4.928 13.934 673 HE2 LYS 92 HE2 LYS 92 69.096 4.426 16.165 674 HE3 LYS 92 HE3 LYS 92 70.040 5.909 16.076 675 HZ1 LYS 92 HZ1 LYS 92 67.079 5.762 16.030 676 HZ2 LYS 92 HZ2 LYS 92 67.986 7.178 15.985 677 HZ3 LYS 92 HZ3 LYS 92 68.000 6.217 17.357 678 H GLN 93 H GLN 93 72.915 3.585 15.855 679 HA GLN 93 HA GLN 93 72.759 0.791 15.214 680 HB2 GLN 93 HB2 GLN 93 73.631 2.456 17.459 681 HB3 GLN 93 HB3 GLN 93 73.283 0.755 17.762 682 HG2 GLN 93 HG2 GLN 93 75.651 0.916 17.426 683 HG3 GLN 93 HG3 GLN 93 74.991 0.232 15.952 684 HE21 GLN 93 HE21 GLN 93 74.951 3.663 16.848 685 HE22 GLN 93 HE22 GLN 93 75.990 4.178 15.574 686 H GLY 94 H GLY 94 71.198 -0.414 15.915 687 HA2 GLY 94 HA2 GLY 94 69.438 -0.239 17.896 688 HA3 GLY 94 HA3 GLY 94 68.714 0.750 16.618 Start of MODEL 24 1 H GLU 2 H GLU 2 61.289 2.942 8.992 2 HA GLU 2 HA GLU 2 59.167 4.379 7.511 3 HB2 GLU 2 HB2 GLU 2 61.083 5.338 9.632 4 HB3 GLU 2 HB3 GLU 2 59.827 6.273 8.846 5 HG2 GLU 2 HG2 GLU 2 58.135 4.909 9.948 6 HG3 GLU 2 HG3 GLU 2 59.434 3.971 10.705 7 H LEU 3 H LEU 3 60.089 6.205 6.344 8 HA LEU 3 HA LEU 3 62.747 5.610 5.315 9 HB2 LEU 3 HB2 LEU 3 60.659 7.606 4.426 10 HB3 LEU 3 HB3 LEU 3 62.172 7.282 3.609 11 HG LEU 3 HG LEU 3 59.901 5.366 3.953 12 HD11 LEU 3 HD11 LEU 3 60.956 6.810 1.497 13 HD12 LEU 3 HD12 LEU 3 59.427 7.144 2.302 14 HD13 LEU 3 HD13 LEU 3 59.674 5.604 1.482 15 HD21 LEU 3 HD21 LEU 3 62.519 5.064 2.518 16 HD22 LEU 3 HD22 LEU 3 61.178 3.908 2.472 17 HD23 LEU 3 HD23 LEU 3 62.012 4.245 3.994 18 H LYS 4 H LYS 4 64.392 6.792 5.976 19 HA LYS 4 HA LYS 4 63.828 9.175 7.577 20 HB2 LYS 4 HB2 LYS 4 66.526 7.926 7.288 21 HB3 LYS 4 HB3 LYS 4 65.881 8.910 8.597 22 HG2 LYS 4 HG2 LYS 4 65.466 5.995 7.990 23 HG3 LYS 4 HG3 LYS 4 66.244 6.683 9.392 24 HD2 LYS 4 HD2 LYS 4 63.834 7.721 9.720 25 HD3 LYS 4 HD3 LYS 4 63.402 6.342 8.722 26 HE2 LYS 4 HE2 LYS 4 64.857 4.908 10.252 27 HE3 LYS 4 HE3 LYS 4 64.894 6.264 11.332 28 HZ1 LYS 4 HZ1 LYS 4 62.342 6.076 11.438 29 HZ2 LYS 4 HZ2 LYS 4 63.301 4.943 12.164 30 HZ3 LYS 4 HZ3 LYS 4 62.585 4.531 10.709 31 H ASN 5 H ASN 5 64.797 11.125 6.925 32 HA ASN 5 HA ASN 5 65.365 11.182 4.123 33 HB2 ASN 5 HB2 ASN 5 65.468 13.490 6.082 34 HB3 ASN 5 HB3 ASN 5 65.575 13.604 4.320 35 HD21 ASN 5 HD21 ASN 5 63.738 13.315 3.087 36 HD22 ASN 5 HD22 ASN 5 62.151 13.282 3.778 37 H SER 6 H SER 6 67.341 10.794 6.859 38 HA SER 6 HA SER 6 69.604 11.029 5.059 39 HB2 SER 6 HB2 SER 6 71.023 11.881 6.855 40 HB3 SER 6 HB3 SER 6 69.718 13.004 6.479 41 HG SER 6 HG SER 6 68.587 12.137 8.295 42 H ILE 7 H ILE 7 71.516 9.819 5.826 43 HA ILE 7 HA ILE 7 70.820 7.101 6.286 44 HB ILE 7 HB ILE 7 72.762 8.055 4.938 45 HG12 ILE 7 HG12 ILE 7 74.389 6.178 5.625 46 HG13 ILE 7 HG13 ILE 7 73.198 5.794 6.871 47 HG21 ILE 7 HG21 ILE 7 73.669 9.620 6.519 48 HG22 ILE 7 HG22 ILE 7 74.896 8.435 6.078 49 HG23 ILE 7 HG23 ILE 7 74.070 8.312 7.631 50 HD11 ILE 7 HD11 ILE 7 72.628 5.932 3.945 51 HD12 ILE 7 HD12 ILE 7 71.557 5.299 5.214 52 HD13 ILE 7 HD13 ILE 7 73.076 4.478 4.809 53 H SER 8 H SER 8 71.401 9.733 8.332 54 HA SER 8 HA SER 8 72.782 8.435 10.442 55 HB2 SER 8 HB2 SER 8 71.398 11.117 10.385 56 HB3 SER 8 HB3 SER 8 72.653 10.581 11.520 57 HG SER 8 HG SER 8 74.022 10.337 9.765 58 H ASP 9 H ASP 9 69.472 8.725 9.589 59 HA ASP 9 HA ASP 9 68.715 8.130 12.367 60 HB2 ASP 9 HB2 ASP 9 67.455 9.923 10.815 61 HB3 ASP 9 HB3 ASP 9 66.793 8.470 10.163 62 H TYR 10 H TYR 10 69.838 6.484 9.987 63 HA TYR 10 HA TYR 10 67.691 4.533 9.794 64 HB2 TYR 10 HB2 TYR 10 69.877 5.254 7.938 65 HB3 TYR 10 HB3 TYR 10 69.544 3.534 8.077 66 HD1 TYR 10 HD1 TYR 10 67.027 2.865 7.869 67 HD2 TYR 10 HD2 TYR 10 68.640 6.516 6.398 68 HE1 TYR 10 HE1 TYR 10 65.109 3.088 6.310 69 HE2 TYR 10 HE2 TYR 10 66.723 6.721 4.844 70 HH TYR 10 HH TYR 10 64.988 5.470 3.861 71 H THR 11 H THR 11 67.738 3.031 11.185 72 HA THR 11 HA THR 11 70.204 2.211 12.361 73 HB THR 11 HB THR 11 68.836 0.608 13.584 74 HG1 THR 11 HG1 THR 11 66.608 0.446 13.143 75 HG21 THR 11 HG21 THR 11 67.152 2.102 14.612 76 HG22 THR 11 HG22 THR 11 67.503 3.302 13.358 77 HG23 THR 11 HG23 THR 11 68.757 2.800 14.497 78 H GLU 12 H GLU 12 70.807 -0.095 12.118 79 HA GLU 12 HA GLU 12 71.105 -0.718 9.447 80 HB2 GLU 12 HB2 GLU 12 71.840 -2.996 10.321 81 HB3 GLU 12 HB3 GLU 12 72.721 -1.587 10.891 82 HG2 GLU 12 HG2 GLU 12 71.406 -1.625 12.960 83 HG3 GLU 12 HG3 GLU 12 70.574 -3.067 12.380 84 H ALA 13 H ALA 13 68.736 -2.020 11.749 85 HA ALA 13 HA ALA 13 67.571 -3.782 9.828 86 HB1 ALA 13 HB1 ALA 13 66.324 -2.707 12.366 87 HB2 ALA 13 HB2 ALA 13 67.360 -4.130 12.270 88 HB3 ALA 13 HB3 ALA 13 65.797 -4.122 11.450 89 H GLU 14 H GLU 14 66.742 -0.422 10.838 90 HA GLU 14 HA GLU 14 64.397 -0.191 9.295 91 HB2 GLU 14 HB2 GLU 14 66.428 1.804 10.222 92 HB3 GLU 14 HB3 GLU 14 65.234 2.328 9.057 93 HG2 GLU 14 HG2 GLU 14 64.585 1.119 11.743 94 HG3 GLU 14 HG3 GLU 14 64.700 2.845 11.420 95 H PHE 15 H PHE 15 67.756 0.103 8.458 96 HA PHE 15 HA PHE 15 67.252 0.987 5.819 97 HB2 PHE 15 HB2 PHE 15 69.406 1.276 7.247 98 HB3 PHE 15 HB3 PHE 15 69.793 -0.342 6.687 99 HD1 PHE 15 HD1 PHE 15 68.868 3.023 5.434 100 HD2 PHE 15 HD2 PHE 15 70.871 -0.633 4.650 101 HE1 PHE 15 HE1 PHE 15 69.803 3.970 3.370 102 HE2 PHE 15 HE2 PHE 15 71.800 0.313 2.592 103 HZ PHE 15 HZ PHE 15 71.263 2.617 1.955 104 H VAL 16 H VAL 16 68.026 -2.217 7.269 105 HA VAL 16 HA VAL 16 68.082 -3.547 4.788 106 HB VAL 16 HB VAL 16 67.979 -5.643 5.868 107 HG11 VAL 16 HG11 VAL 16 69.950 -4.649 6.174 108 HG12 VAL 16 HG12 VAL 16 69.583 -5.610 7.615 109 HG13 VAL 16 HG13 VAL 16 69.451 -3.841 7.657 110 HG21 VAL 16 HG21 VAL 16 66.068 -5.577 7.151 111 HG22 VAL 16 HG22 VAL 16 66.696 -4.335 8.223 112 HG23 VAL 16 HG23 VAL 16 67.388 -5.984 8.248 113 H GLN 17 H GLN 17 65.438 -2.766 6.918 114 HA GLN 17 HA GLN 17 63.317 -4.144 5.774 115 HB2 GLN 17 HB2 GLN 17 63.376 -2.942 7.897 116 HB3 GLN 17 HB3 GLN 17 63.597 -1.448 7.014 117 HG2 GLN 17 HG2 GLN 17 61.418 -1.899 5.937 118 HG3 GLN 17 HG3 GLN 17 61.206 -3.200 7.126 119 HE21 GLN 17 HE21 GLN 17 62.833 -0.156 7.672 120 HE22 GLN 17 HE22 GLN 17 61.769 0.419 8.884 121 H LEU 18 H LEU 18 64.585 -0.880 5.222 122 HA LEU 18 HA LEU 18 62.834 -0.160 3.223 123 HB2 LEU 18 HB2 LEU 18 64.131 1.437 4.467 124 HB3 LEU 18 HB3 LEU 18 65.624 0.822 3.910 125 HG LEU 18 HG LEU 18 64.781 3.072 2.966 126 HD11 LEU 18 HD11 LEU 18 65.839 0.955 1.141 127 HD12 LEU 18 HD12 LEU 18 66.782 1.996 2.209 128 HD13 LEU 18 HD13 LEU 18 65.894 2.695 0.853 129 HD21 LEU 18 HD21 LEU 18 62.563 2.309 2.289 130 HD22 LEU 18 HD22 LEU 18 63.303 1.175 1.153 131 HD23 LEU 18 HD23 LEU 18 63.497 2.916 0.922 132 H LEU 19 H LEU 19 65.979 -1.526 3.204 133 HA LEU 19 HA LEU 19 66.496 -1.840 0.505 134 HB2 LEU 19 HB2 LEU 19 67.509 -2.905 2.945 135 HB3 LEU 19 HB3 LEU 19 67.751 -3.961 1.559 136 HG LEU 19 HG LEU 19 69.055 -2.358 0.416 137 HD11 LEU 19 HD11 LEU 19 67.670 -0.374 0.755 138 HD12 LEU 19 HD12 LEU 19 69.350 -0.073 1.169 139 HD13 LEU 19 HD13 LEU 19 68.157 -0.335 2.452 140 HD21 LEU 19 HD21 LEU 19 70.048 -3.410 2.339 141 HD22 LEU 19 HD22 LEU 19 69.641 -1.948 3.271 142 HD23 LEU 19 HD23 LEU 19 70.753 -1.852 1.883 143 H LYS 20 H LYS 20 64.697 -3.981 2.615 144 HA LYS 20 HA LYS 20 64.304 -6.078 0.755 145 HB2 LYS 20 HB2 LYS 20 62.541 -5.204 3.043 146 HB3 LYS 20 HB3 LYS 20 62.371 -6.723 2.199 147 HG2 LYS 20 HG2 LYS 20 64.780 -7.170 2.913 148 HG3 LYS 20 HG3 LYS 20 64.566 -5.801 3.976 149 HD2 LYS 20 HD2 LYS 20 62.660 -6.811 5.051 150 HD3 LYS 20 HD3 LYS 20 62.769 -8.217 3.996 151 HE2 LYS 20 HE2 LYS 20 65.052 -8.636 4.890 152 HE3 LYS 20 HE3 LYS 20 64.810 -7.304 6.017 153 HZ1 LYS 20 HZ1 LYS 20 64.316 -9.379 7.092 154 HZ2 LYS 20 HZ2 LYS 20 63.270 -9.822 5.881 155 HZ3 LYS 20 HZ3 LYS 20 62.865 -8.536 6.901 156 H GLU 21 H GLU 21 62.543 -3.171 1.522 157 HA GLU 21 HA GLU 21 60.362 -3.590 -0.186 158 HB2 GLU 21 HB2 GLU 21 61.569 -1.028 0.841 159 HB3 GLU 21 HB3 GLU 21 60.031 -1.126 -0.002 160 HG2 GLU 21 HG2 GLU 21 60.699 -2.466 2.604 161 HG3 GLU 21 HG3 GLU 21 59.737 -1.001 2.414 162 H ILE 22 H ILE 22 63.513 -2.142 -0.649 163 HA ILE 22 HA ILE 22 63.020 -1.082 -3.177 164 HB ILE 22 HB ILE 22 65.740 -2.070 -2.182 165 HG12 ILE 22 HG12 ILE 22 64.359 0.624 -1.957 166 HG13 ILE 22 HG13 ILE 22 64.853 -0.433 -0.655 167 HG21 ILE 22 HG21 ILE 22 65.589 -1.732 -4.613 168 HG22 ILE 22 HG22 ILE 22 66.574 -0.457 -3.865 169 HG23 ILE 22 HG23 ILE 22 64.919 -0.129 -4.343 170 HD11 ILE 22 HD11 ILE 22 66.722 0.959 -2.552 171 HD12 ILE 22 HD12 ILE 22 67.200 -0.115 -1.244 172 HD13 ILE 22 HD13 ILE 22 66.402 1.421 -0.882 173 H GLU 23 H GLU 23 64.235 -4.272 -2.258 174 HA GLU 23 HA GLU 23 64.682 -5.365 -4.807 175 HB2 GLU 23 HB2 GLU 23 63.564 -6.644 -2.368 176 HB3 GLU 23 HB3 GLU 23 64.088 -7.552 -3.756 177 HG2 GLU 23 HG2 GLU 23 66.380 -6.506 -3.320 178 HG3 GLU 23 HG3 GLU 23 65.686 -5.967 -1.786 179 H LYS 24 H LYS 24 61.861 -5.253 -2.818 180 HA LYS 24 HA LYS 24 60.123 -6.893 -4.240 181 HB2 LYS 24 HB2 LYS 24 59.875 -6.303 -1.968 182 HB3 LYS 24 HB3 LYS 24 59.703 -4.604 -2.350 183 HG2 LYS 24 HG2 LYS 24 57.578 -5.134 -3.527 184 HG3 LYS 24 HG3 LYS 24 57.740 -6.806 -2.977 185 HD2 LYS 24 HD2 LYS 24 57.609 -4.395 -1.160 186 HD3 LYS 24 HD3 LYS 24 56.241 -5.440 -1.531 187 HE2 LYS 24 HE2 LYS 24 57.393 -7.336 -0.530 188 HE3 LYS 24 HE3 LYS 24 58.811 -6.332 -0.229 189 HZ1 LYS 24 HZ1 LYS 24 56.144 -5.785 0.945 190 HZ2 LYS 24 HZ2 LYS 24 57.628 -5.058 1.350 191 HZ3 LYS 24 HZ3 LYS 24 57.349 -6.680 1.704 192 H GLU 25 H GLU 25 60.413 -3.340 -4.220 193 HA GLU 25 HA GLU 25 58.457 -2.947 -6.216 194 HB2 GLU 25 HB2 GLU 25 60.622 -1.140 -5.134 195 HB3 GLU 25 HB3 GLU 25 59.316 -0.639 -6.193 196 HG2 GLU 25 HG2 GLU 25 58.936 -1.826 -3.454 197 HG3 GLU 25 HG3 GLU 25 58.903 -0.106 -3.828 198 H ASN 26 H ASN 26 61.869 -3.524 -6.235 199 HA ASN 26 HA ASN 26 62.434 -2.645 -8.882 200 HB2 ASN 26 HB2 ASN 26 64.249 -2.873 -7.284 201 HB3 ASN 26 HB3 ASN 26 63.917 -4.588 -7.097 202 HD21 ASN 26 HD21 ASN 26 65.962 -5.209 -7.713 203 HD22 ASN 26 HD22 ASN 26 66.506 -5.107 -9.347 204 H VAL 27 H VAL 27 61.948 -5.888 -7.525 205 HA VAL 27 HA VAL 27 62.200 -7.160 -10.044 206 HB VAL 27 HB VAL 27 61.443 -9.218 -8.949 207 HG11 VAL 27 HG11 VAL 27 63.770 -8.601 -8.747 208 HG12 VAL 27 HG12 VAL 27 63.224 -9.388 -7.266 209 HG13 VAL 27 HG13 VAL 27 63.414 -7.637 -7.313 210 HG21 VAL 27 HG21 VAL 27 60.939 -7.479 -6.524 211 HG22 VAL 27 HG22 VAL 27 60.883 -9.241 -6.542 212 HG23 VAL 27 HG23 VAL 27 59.712 -8.312 -7.479 213 H ALA 28 H ALA 28 59.576 -5.647 -8.523 214 HA ALA 28 HA ALA 28 57.620 -6.928 -10.270 215 HB1 ALA 28 HB1 ALA 28 56.995 -6.573 -7.947 216 HB2 ALA 28 HB2 ALA 28 55.961 -5.625 -9.015 217 HB3 ALA 28 HB3 ALA 28 57.265 -4.842 -8.123 218 H ALA 29 H ALA 29 59.697 -4.297 -10.241 219 HA ALA 29 HA ALA 29 59.908 -2.347 -11.249 220 HB1 ALA 29 HB1 ALA 29 58.366 -3.699 -13.466 221 HB2 ALA 29 HB2 ALA 29 60.106 -3.832 -13.204 222 HB3 ALA 29 HB3 ALA 29 59.393 -2.279 -13.650 223 H THR 30 H THR 30 58.496 -1.488 -9.563 224 HA THR 30 HA THR 30 55.786 -0.856 -10.359 225 HB THR 30 HB THR 30 55.558 0.017 -8.083 226 HG1 THR 30 HG1 THR 30 57.343 -0.095 -6.708 227 HG21 THR 30 HG21 THR 30 56.051 -2.053 -6.874 228 HG22 THR 30 HG22 THR 30 57.099 -2.550 -8.205 229 HG23 THR 30 HG23 THR 30 55.357 -2.404 -8.468 230 H ASP 31 H ASP 31 58.834 0.532 -10.480 231 HA ASP 31 HA ASP 31 59.714 2.355 -10.996 232 HB2 ASP 31 HB2 ASP 31 57.281 2.577 -12.649 233 HB3 ASP 31 HB3 ASP 31 58.431 3.916 -12.486 234 H ASP 32 H ASP 32 56.571 3.521 -9.867 235 HA ASP 32 HA ASP 32 57.805 6.049 -9.245 236 HB2 ASP 32 HB2 ASP 32 55.349 5.972 -9.461 237 HB3 ASP 32 HB3 ASP 32 55.283 4.925 -8.039 238 H VAL 33 H VAL 33 56.958 3.423 -7.127 239 HA VAL 33 HA VAL 33 58.298 4.811 -5.047 240 HB VAL 33 HB VAL 33 56.883 2.150 -5.167 241 HG11 VAL 33 HG11 VAL 33 57.419 1.890 -2.824 242 HG12 VAL 33 HG12 VAL 33 58.355 3.421 -2.922 243 HG13 VAL 33 HG13 VAL 33 58.883 2.000 -3.841 244 HG21 VAL 33 HG21 VAL 33 56.652 4.657 -3.657 245 HG22 VAL 33 HG22 VAL 33 55.576 3.251 -3.473 246 HG23 VAL 33 HG23 VAL 33 55.613 4.181 -5.011 247 H LEU 34 H LEU 34 58.934 2.325 -7.264 248 HA LEU 34 HA LEU 34 61.328 1.300 -6.233 249 HB2 LEU 34 HB2 LEU 34 59.953 0.426 -8.205 250 HB3 LEU 34 HB3 LEU 34 60.513 1.832 -9.048 251 HG LEU 34 HG LEU 34 61.616 -0.522 -9.449 252 HD11 LEU 34 HD11 LEU 34 63.564 0.622 -10.290 253 HD12 LEU 34 HD12 LEU 34 63.081 2.073 -9.392 254 HD13 LEU 34 HD13 LEU 34 62.049 1.439 -10.680 255 HD21 LEU 34 HD21 LEU 34 63.752 -0.706 -8.252 256 HD22 LEU 34 HD22 LEU 34 62.377 -0.858 -7.157 257 HD23 LEU 34 HD23 LEU 34 63.285 0.650 -7.225 258 H ASP 35 H ASP 35 60.711 4.041 -8.385 259 HA ASP 35 HA ASP 35 63.423 4.850 -8.500 260 HB2 ASP 35 HB2 ASP 35 61.557 5.574 -10.111 261 HB3 ASP 35 HB3 ASP 35 61.048 6.602 -8.772 262 H VAL 36 H VAL 36 60.777 5.769 -6.404 263 HA VAL 36 HA VAL 36 61.976 7.853 -5.011 264 HB VAL 36 HB VAL 36 60.419 5.630 -3.732 265 HG11 VAL 36 HG11 VAL 36 59.871 7.333 -2.074 266 HG12 VAL 36 HG12 VAL 36 60.953 8.439 -2.989 267 HG13 VAL 36 HG13 VAL 36 61.616 6.977 -2.238 268 HG21 VAL 36 HG21 VAL 36 59.476 8.210 -4.828 269 HG22 VAL 36 HG22 VAL 36 58.558 6.962 -3.904 270 HG23 VAL 36 HG23 VAL 36 59.251 6.571 -5.508 271 H LEU 37 H LEU 37 62.006 4.416 -4.435 272 HA LEU 37 HA LEU 37 63.454 4.564 -2.037 273 HB2 LEU 37 HB2 LEU 37 63.283 2.181 -3.818 274 HB3 LEU 37 HB3 LEU 37 63.601 2.361 -2.096 275 HG LEU 37 HG LEU 37 60.929 3.018 -3.251 276 HD11 LEU 37 HD11 LEU 37 61.716 0.553 -1.719 277 HD12 LEU 37 HD12 LEU 37 61.279 0.651 -3.435 278 HD13 LEU 37 HD13 LEU 37 60.084 1.042 -2.203 279 HD21 LEU 37 HD21 LEU 37 61.868 2.778 -0.397 280 HD22 LEU 37 HD22 LEU 37 60.208 3.074 -0.911 281 HD23 LEU 37 HD23 LEU 37 61.457 4.274 -1.237 282 H LEU 38 H LEU 38 64.277 3.909 -5.324 283 HA LEU 38 HA LEU 38 66.935 3.183 -4.910 284 HB2 LEU 38 HB2 LEU 38 65.406 4.335 -7.151 285 HB3 LEU 38 HB3 LEU 38 67.119 3.973 -7.344 286 HG LEU 38 HG LEU 38 64.726 2.188 -6.907 287 HD11 LEU 38 HD11 LEU 38 66.813 2.228 -9.011 288 HD12 LEU 38 HD12 LEU 38 65.171 2.862 -9.158 289 HD13 LEU 38 HD13 LEU 38 65.445 1.119 -8.946 290 HD21 LEU 38 HD21 LEU 38 66.415 1.270 -5.439 291 HD22 LEU 38 HD22 LEU 38 67.613 1.319 -6.726 292 HD23 LEU 38 HD23 LEU 38 66.231 0.232 -6.850 293 H GLU 39 H GLU 39 65.505 6.347 -5.738 294 HA GLU 39 HA GLU 39 68.072 7.563 -5.576 295 HB2 GLU 39 HB2 GLU 39 66.858 9.740 -5.693 296 HB3 GLU 39 HB3 GLU 39 66.616 8.659 -7.039 297 HG2 GLU 39 HG2 GLU 39 64.449 8.136 -6.390 298 HG3 GLU 39 HG3 GLU 39 64.586 8.874 -4.814 299 H HIS 40 H HIS 40 65.457 7.156 -3.373 300 HA HIS 40 HA HIS 40 66.261 8.827 -1.311 301 HB2 HIS 40 HB2 HIS 40 64.121 7.661 -1.421 302 HB3 HIS 40 HB3 HIS 40 64.878 6.122 -1.224 303 HD1 HIS 40 HD1 HIS 40 63.796 9.115 0.672 304 HD2 HIS 40 HD2 HIS 40 65.665 5.496 1.389 305 HE1 HIS 40 HE1 HIS 40 63.769 8.796 3.174 306 H PHE 41 H PHE 41 67.020 5.530 -2.046 307 HA PHE 41 HA PHE 41 68.731 4.943 0.047 308 HB2 PHE 41 HB2 PHE 41 67.775 3.240 -1.248 309 HB3 PHE 41 HB3 PHE 41 68.346 3.953 -2.739 310 HD1 PHE 41 HD1 PHE 41 69.350 2.138 0.312 311 HD2 PHE 41 HD2 PHE 41 70.406 3.322 -3.619 312 HE1 PHE 41 HE1 PHE 41 71.275 0.595 0.363 313 HE2 PHE 41 HE2 PHE 41 72.316 1.805 -3.558 314 HZ PHE 41 HZ PHE 41 72.757 0.445 -1.623 315 H VAL 42 H VAL 42 69.529 6.039 -3.253 316 HA VAL 42 HA VAL 42 72.246 6.256 -2.537 317 HB VAL 42 HB VAL 42 71.850 5.761 -4.746 318 HG11 VAL 42 HG11 VAL 42 69.794 6.523 -5.129 319 HG12 VAL 42 HG12 VAL 42 70.881 7.084 -6.390 320 HG13 VAL 42 HG13 VAL 42 70.291 8.238 -5.147 321 HG21 VAL 42 HG21 VAL 42 73.116 7.433 -6.046 322 HG22 VAL 42 HG22 VAL 42 73.859 7.039 -4.496 323 HG23 VAL 42 HG23 VAL 42 72.962 8.545 -4.687 324 H LYS 43 H LYS 43 69.784 8.569 -2.453 325 HA LYS 43 HA LYS 43 71.543 10.826 -2.070 326 HB2 LYS 43 HB2 LYS 43 69.668 12.160 -1.407 327 HB3 LYS 43 HB3 LYS 43 69.012 11.013 -2.556 328 HG2 LYS 43 HG2 LYS 43 68.233 9.605 -0.537 329 HG3 LYS 43 HG3 LYS 43 68.773 10.942 0.437 330 HD2 LYS 43 HD2 LYS 43 66.783 11.350 -1.756 331 HD3 LYS 43 HD3 LYS 43 66.300 10.866 -0.133 332 HE2 LYS 43 HE2 LYS 43 67.862 13.382 -0.808 333 HE3 LYS 43 HE3 LYS 43 66.124 13.311 -0.530 334 HZ1 LYS 43 HZ1 LYS 43 67.294 14.049 1.405 335 HZ2 LYS 43 HZ2 LYS 43 68.201 12.649 1.498 336 HZ3 LYS 43 HZ3 LYS 43 66.510 12.606 1.710 337 H ILE 44 H ILE 44 70.327 8.514 0.196 338 HA ILE 44 HA ILE 44 71.424 10.032 2.411 339 HB ILE 44 HB ILE 44 70.616 8.146 3.835 340 HG12 ILE 44 HG12 ILE 44 69.618 7.060 1.198 341 HG13 ILE 44 HG13 ILE 44 70.833 6.310 2.210 342 HG21 ILE 44 HG21 ILE 44 68.239 8.606 3.527 343 HG22 ILE 44 HG22 ILE 44 68.562 9.230 1.914 344 HG23 ILE 44 HG23 ILE 44 69.186 10.083 3.321 345 HD11 ILE 44 HD11 ILE 44 69.147 5.914 3.918 346 HD12 ILE 44 HD12 ILE 44 68.649 5.226 2.359 347 HD13 ILE 44 HD13 ILE 44 67.954 6.737 2.920 348 H THR 45 H THR 45 72.267 7.210 0.507 349 HA THR 45 HA THR 45 74.480 6.537 2.233 350 HB THR 45 HB THR 45 74.967 4.785 0.558 351 HG1 THR 45 HG1 THR 45 72.610 5.438 -0.809 352 HG21 THR 45 HG21 THR 45 73.268 4.406 2.334 353 HG22 THR 45 HG22 THR 45 72.960 3.482 0.863 354 HG23 THR 45 HG23 THR 45 72.022 4.935 1.199 355 H GLU 46 H GLU 46 73.901 8.224 -0.773 356 HA GLU 46 HA GLU 46 75.053 9.366 -2.194 357 HB2 GLU 46 HB2 GLU 46 76.662 9.634 0.241 358 HB3 GLU 46 HB3 GLU 46 77.346 10.340 -1.251 359 HG2 GLU 46 HG2 GLU 46 74.712 10.933 0.095 360 HG3 GLU 46 HG3 GLU 46 76.151 11.957 0.150 361 H HIS 47 H HIS 47 75.431 6.486 -1.851 362 HA HIS 47 HA HIS 47 78.067 5.864 -2.715 363 HB2 HIS 47 HB2 HIS 47 76.530 4.242 -1.521 364 HB3 HIS 47 HB3 HIS 47 75.565 4.157 -2.991 365 HD1 HIS 47 HD1 HIS 47 76.314 2.386 -4.686 366 HD2 HIS 47 HD2 HIS 47 79.196 3.269 -1.858 367 HE1 HIS 47 HE1 HIS 47 78.286 0.907 -5.188 368 HA PRO 48 HA PRO 48 77.427 7.315 -6.913 369 HB2 PRO 48 HB2 PRO 48 79.518 5.422 -7.680 370 HB3 PRO 48 HB3 PRO 48 79.502 7.186 -7.826 371 HG2 PRO 48 HG2 PRO 48 80.996 5.817 -6.153 372 HG3 PRO 48 HG3 PRO 48 80.297 7.374 -5.593 373 HD2 PRO 48 HD2 PRO 48 79.443 4.538 -5.120 374 HD3 PRO 48 HD3 PRO 48 79.531 5.841 -3.931 375 H ASP 49 H ASP 49 77.247 4.086 -6.052 376 HA ASP 49 HA ASP 49 76.278 3.491 -8.609 377 HB2 ASP 49 HB2 ASP 49 78.155 1.841 -6.954 378 HB3 ASP 49 HB3 ASP 49 77.208 1.071 -8.204 379 H GLY 50 H GLY 50 74.962 4.378 -6.374 380 HA2 GLY 50 HA2 GLY 50 73.894 2.687 -4.384 381 HA3 GLY 50 HA3 GLY 50 73.070 4.035 -5.142 382 H THR 51 H THR 51 72.662 3.255 -7.514 383 HA THR 51 HA THR 51 70.566 1.440 -6.867 384 HB THR 51 HB THR 51 70.742 2.084 -9.687 385 HG1 THR 51 HG1 THR 51 70.334 4.439 -9.045 386 HG21 THR 51 HG21 THR 51 68.746 1.418 -8.468 387 HG22 THR 51 HG22 THR 51 68.534 3.044 -9.120 388 HG23 THR 51 HG23 THR 51 68.880 2.804 -7.422 389 H ALA 52 H ALA 52 73.568 1.352 -8.594 390 HA ALA 52 HA ALA 52 73.239 -1.126 -9.926 391 HB1 ALA 52 HB1 ALA 52 75.766 0.051 -8.836 392 HB2 ALA 52 HB2 ALA 52 75.072 0.482 -10.404 393 HB3 ALA 52 HB3 ALA 52 75.631 -1.167 -10.102 394 H LEU 53 H LEU 53 74.263 -0.330 -6.668 395 HA LEU 53 HA LEU 53 74.977 -2.909 -5.911 396 HB2 LEU 53 HB2 LEU 53 73.699 -0.783 -4.230 397 HB3 LEU 53 HB3 LEU 53 74.275 -2.308 -3.598 398 HG LEU 53 HG LEU 53 75.904 -0.082 -4.790 399 HD11 LEU 53 HD11 LEU 53 76.958 -0.095 -2.608 400 HD12 LEU 53 HD12 LEU 53 75.869 -1.383 -2.088 401 HD13 LEU 53 HD13 LEU 53 75.224 0.206 -2.509 402 HD21 LEU 53 HD21 LEU 53 77.877 -1.500 -4.363 403 HD22 LEU 53 HD22 LEU 53 76.847 -2.163 -5.622 404 HD23 LEU 53 HD23 LEU 53 76.811 -2.859 -3.997 405 H ILE 54 H ILE 54 71.737 -1.465 -5.868 406 HA ILE 54 HA ILE 54 70.680 -3.869 -4.715 407 HB ILE 54 HB ILE 54 68.944 -1.874 -6.237 408 HG12 ILE 54 HG12 ILE 54 68.217 -1.459 -3.716 409 HG13 ILE 54 HG13 ILE 54 69.842 -2.028 -3.403 410 HG21 ILE 54 HG21 ILE 54 67.917 -4.069 -6.086 411 HG22 ILE 54 HG22 ILE 54 67.057 -2.897 -5.098 412 HG23 ILE 54 HG23 ILE 54 68.136 -4.065 -4.337 413 HD11 ILE 54 HD11 ILE 54 69.767 0.369 -3.514 414 HD12 ILE 54 HD12 ILE 54 69.122 0.289 -5.153 415 HD13 ILE 54 HD13 ILE 54 70.754 -0.294 -4.812 416 H TYR 55 H TYR 55 70.935 -2.618 -7.918 417 HA TYR 55 HA TYR 55 69.498 -4.606 -9.241 418 HB2 TYR 55 HB2 TYR 55 71.366 -2.475 -10.020 419 HB3 TYR 55 HB3 TYR 55 71.033 -3.713 -11.208 420 HD1 TYR 55 HD1 TYR 55 68.573 -4.103 -11.829 421 HD2 TYR 55 HD2 TYR 55 69.841 -0.728 -9.590 422 HE1 TYR 55 HE1 TYR 55 66.463 -2.964 -12.366 423 HE2 TYR 55 HE2 TYR 55 67.751 0.426 -10.118 424 HH TYR 55 HH TYR 55 65.070 -1.205 -11.501 425 H GLU 56 H GLU 56 73.006 -4.364 -8.665 426 HA GLU 56 HA GLU 56 73.444 -6.839 -9.922 427 HB2 GLU 56 HB2 GLU 56 75.686 -6.842 -8.839 428 HB3 GLU 56 HB3 GLU 56 75.335 -5.352 -9.714 429 HG2 GLU 56 HG2 GLU 56 75.012 -4.165 -7.751 430 HG3 GLU 56 HG3 GLU 56 75.078 -5.592 -6.737 431 H ALA 57 H ALA 57 72.669 -5.922 -6.649 432 HA ALA 57 HA ALA 57 73.117 -8.346 -5.367 433 HB1 ALA 57 HB1 ALA 57 72.528 -6.285 -4.189 434 HB2 ALA 57 HB2 ALA 57 71.501 -7.637 -3.712 435 HB3 ALA 57 HB3 ALA 57 70.884 -6.405 -4.815 436 H ALA 58 H ALA 58 70.320 -7.281 -7.238 437 HA ALA 58 HA ALA 58 68.661 -9.471 -6.767 438 HB1 ALA 58 HB1 ALA 58 67.521 -8.881 -8.842 439 HB2 ALA 58 HB2 ALA 58 68.896 -7.886 -9.324 440 HB3 ALA 58 HB3 ALA 58 67.923 -7.428 -7.926 441 H ALA 59 H ALA 59 71.130 -9.042 -9.262 442 HA ALA 59 HA ALA 59 70.790 -11.614 -10.443 443 HB1 ALA 59 HB1 ALA 59 72.927 -11.158 -11.572 444 HB2 ALA 59 HB2 ALA 59 73.199 -9.784 -10.500 445 HB3 ALA 59 HB3 ALA 59 71.858 -9.755 -11.645 446 H ARG 60 H ARG 60 72.900 -10.308 -8.035 447 HA ARG 60 HA ARG 60 74.494 -12.564 -7.524 448 HB2 ARG 60 HB2 ARG 60 73.834 -10.079 -5.997 449 HB3 ARG 60 HB3 ARG 60 74.872 -11.314 -5.289 450 HG2 ARG 60 HG2 ARG 60 76.535 -10.966 -6.932 451 HG3 ARG 60 HG3 ARG 60 75.426 -10.079 -7.972 452 HD2 ARG 60 HD2 ARG 60 77.140 -8.699 -6.672 453 HD3 ARG 60 HD3 ARG 60 75.459 -8.179 -6.588 454 HE ARG 60 HE ARG 60 76.110 -9.942 -4.493 455 HH11 ARG 60 HH11 ARG 60 76.913 -6.571 -5.448 456 HH12 ARG 60 HH12 ARG 60 76.745 -6.006 -3.842 457 HH21 ARG 60 HH21 ARG 60 75.782 -8.968 -2.314 458 HH22 ARG 60 HH22 ARG 60 76.044 -7.273 -2.170 459 H ALA 61 H ALA 61 71.359 -11.623 -6.289 460 HA ALA 61 HA ALA 61 71.200 -13.618 -4.251 461 HB1 ALA 61 HB1 ALA 61 68.999 -12.143 -5.703 462 HB2 ALA 61 HB2 ALA 61 69.786 -11.613 -4.219 463 HB3 ALA 61 HB3 ALA 61 68.806 -13.081 -4.224 464 H ALA 62 H ALA 62 70.137 -13.338 -7.580 465 HA ALA 62 HA ALA 62 68.790 -15.800 -7.729 466 HB1 ALA 62 HB1 ALA 62 70.088 -14.254 -9.977 467 HB2 ALA 62 HB2 ALA 62 68.478 -13.946 -9.329 468 HB3 ALA 62 HB3 ALA 62 68.824 -15.478 -10.127 469 H ALA 63 H ALA 63 72.097 -14.859 -8.549 470 HA ALA 63 HA ALA 63 72.808 -17.703 -8.552 471 HB1 ALA 63 HB1 ALA 63 74.307 -15.388 -9.783 472 HB2 ALA 63 HB2 ALA 63 73.375 -16.606 -10.670 473 HB3 ALA 63 HB3 ALA 63 74.833 -17.068 -9.776 474 H ASN 64 H ASN 64 72.656 -17.495 -6.259 475 HA ASN 64 HA ASN 64 74.384 -15.808 -4.761 476 HB2 ASN 64 HB2 ASN 64 72.347 -16.457 -3.729 477 HB3 ASN 64 HB3 ASN 64 72.646 -18.162 -4.037 478 HD21 ASN 64 HD21 ASN 64 73.352 -15.457 -1.945 479 HD22 ASN 64 HD22 ASN 64 74.111 -16.406 -0.712 480 HA PRO 65 HA PRO 65 77.830 -18.628 -5.072 481 HB2 PRO 65 HB2 PRO 65 79.747 -16.909 -4.261 482 HB3 PRO 65 HB3 PRO 65 79.038 -16.838 -5.877 483 HG2 PRO 65 HG2 PRO 65 78.534 -15.110 -3.502 484 HG3 PRO 65 HG3 PRO 65 78.544 -14.681 -5.218 485 HD2 PRO 65 HD2 PRO 65 76.269 -15.162 -3.660 486 HD3 PRO 65 HD3 PRO 65 76.328 -15.139 -5.433 487 H GLY 66 H GLY 66 76.572 -17.024 -2.350 488 HA2 GLY 66 HA2 GLY 66 76.525 -18.420 -0.267 489 HA3 GLY 66 HA3 GLY 66 78.278 -18.507 -0.464 490 H GLY 67 H GLY 67 77.563 -17.580 1.833 491 HA2 GLY 67 HA2 GLY 67 78.167 -15.817 3.168 492 HA3 GLY 67 HA3 GLY 67 78.598 -14.962 1.680 493 H ASP 68 H ASP 68 77.581 -13.039 1.945 494 HA ASP 68 HA ASP 68 74.804 -12.908 2.766 495 HB2 ASP 68 HB2 ASP 68 76.540 -10.721 1.541 496 HB3 ASP 68 HB3 ASP 68 74.937 -10.487 2.208 497 H GLY 69 H GLY 69 76.663 -12.294 -0.158 498 HA2 GLY 69 HA2 GLY 69 76.167 -12.704 -2.342 499 HA3 GLY 69 HA3 GLY 69 74.685 -13.504 -1.827 500 H GLY 70 H GLY 70 73.140 -12.543 -2.964 501 HA2 GLY 70 HA2 GLY 70 73.081 -9.617 -2.973 502 HA3 GLY 70 HA3 GLY 70 72.197 -10.665 -4.085 503 H GLY 71 H GLY 71 71.595 -8.621 -1.683 504 HA2 GLY 71 HA2 GLY 71 69.091 -9.401 -1.248 505 HA3 GLY 71 HA3 GLY 71 69.984 -10.222 0.024 506 HA PRO 72 HA PRO 72 68.759 -5.755 0.844 507 HB2 PRO 72 HB2 PRO 72 67.237 -6.376 3.067 508 HB3 PRO 72 HB3 PRO 72 66.625 -6.064 1.441 509 HG2 PRO 72 HG2 PRO 72 67.051 -8.652 2.839 510 HG3 PRO 72 HG3 PRO 72 65.821 -8.216 1.644 511 HD2 PRO 72 HD2 PRO 72 68.002 -9.726 1.071 512 HD3 PRO 72 HD3 PRO 72 67.199 -8.709 -0.130 513 H GLU 73 H GLU 73 69.404 -8.326 3.181 514 HA GLU 73 HA GLU 73 70.619 -6.529 5.027 515 HB2 GLU 73 HB2 GLU 73 70.749 -9.538 4.942 516 HB3 GLU 73 HB3 GLU 73 71.129 -8.520 6.321 517 HG2 GLU 73 HG2 GLU 73 68.846 -7.797 6.468 518 HG3 GLU 73 HG3 GLU 73 68.427 -8.696 5.024 519 H GLY 74 H GLY 74 71.748 -7.525 2.168 520 HA2 GLY 74 HA2 GLY 74 74.417 -7.406 3.267 521 HA3 GLY 74 HA3 GLY 74 74.132 -8.297 1.728 522 H ILE 75 H ILE 75 72.516 -6.100 0.679 523 HA ILE 75 HA ILE 75 74.520 -4.415 -0.303 524 HB ILE 75 HB ILE 75 72.519 -2.879 -0.969 525 HG12 ILE 75 HG12 ILE 75 71.070 -5.349 0.017 526 HG13 ILE 75 HG13 ILE 75 70.943 -3.718 0.653 527 HG21 ILE 75 HG21 ILE 75 72.761 -5.701 -1.968 528 HG22 ILE 75 HG22 ILE 75 73.687 -4.296 -2.513 529 HG23 ILE 75 HG23 ILE 75 71.946 -4.378 -2.804 530 HD11 ILE 75 HD11 ILE 75 70.023 -4.643 -2.060 531 HD12 ILE 75 HD12 ILE 75 69.885 -2.998 -1.415 532 HD13 ILE 75 HD13 ILE 75 69.012 -4.331 -0.643 533 H VAL 76 H VAL 76 72.534 -4.101 2.513 534 HA VAL 76 HA VAL 76 73.114 -1.418 3.192 535 HB VAL 76 HB VAL 76 71.366 -2.495 4.257 536 HG11 VAL 76 HG11 VAL 76 73.009 -4.777 4.680 537 HG12 VAL 76 HG12 VAL 76 71.331 -4.483 4.087 538 HG13 VAL 76 HG13 VAL 76 71.709 -4.373 5.809 539 HG21 VAL 76 HG21 VAL 76 71.740 -2.347 6.674 540 HG22 VAL 76 HG22 VAL 76 72.522 -0.995 5.846 541 HG23 VAL 76 HG23 VAL 76 73.476 -2.367 6.394 542 H LYS 77 H LYS 77 74.520 -4.352 4.001 543 HA LYS 77 HA LYS 77 76.618 -3.473 5.661 544 HB2 LYS 77 HB2 LYS 77 75.765 -5.762 5.499 545 HB3 LYS 77 HB3 LYS 77 76.485 -5.926 3.912 546 HG2 LYS 77 HG2 LYS 77 78.708 -5.731 4.893 547 HG3 LYS 77 HG3 LYS 77 77.988 -5.527 6.492 548 HD2 LYS 77 HD2 LYS 77 77.545 -7.903 4.718 549 HD3 LYS 77 HD3 LYS 77 78.735 -7.880 6.034 550 HE2 LYS 77 HE2 LYS 77 76.862 -7.455 7.613 551 HE3 LYS 77 HE3 LYS 77 75.740 -7.536 6.262 552 HZ1 LYS 77 HZ1 LYS 77 77.458 -9.776 7.173 553 HZ2 LYS 77 HZ2 LYS 77 76.311 -9.854 5.928 554 HZ3 LYS 77 HZ3 LYS 77 75.825 -9.584 7.511 555 H GLU 78 H GLU 78 76.439 -4.015 2.189 556 HA GLU 78 HA GLU 78 79.056 -3.363 1.449 557 HB2 GLU 78 HB2 GLU 78 76.401 -3.211 0.157 558 HB3 GLU 78 HB3 GLU 78 77.759 -2.684 -0.791 559 HG2 GLU 78 HG2 GLU 78 78.799 -4.925 -0.303 560 HG3 GLU 78 HG3 GLU 78 77.307 -5.360 0.512 561 H ILE 79 H ILE 79 76.251 -1.374 1.782 562 HA ILE 79 HA ILE 79 77.379 1.126 1.194 563 HB ILE 79 HB ILE 79 75.090 0.543 3.100 564 HG12 ILE 79 HG12 ILE 79 74.645 -0.154 0.782 565 HG13 ILE 79 HG13 ILE 79 73.639 1.215 1.238 566 HG21 ILE 79 HG21 ILE 79 75.900 3.198 1.974 567 HG22 ILE 79 HG22 ILE 79 76.044 2.677 3.650 568 HG23 ILE 79 HG23 ILE 79 74.449 2.857 2.920 569 HD11 ILE 79 HD11 ILE 79 75.179 2.695 0.013 570 HD12 ILE 79 HD12 ILE 79 74.427 1.462 -0.999 571 HD13 ILE 79 HD13 ILE 79 76.098 1.271 -0.501 572 H LYS 80 H LYS 80 77.143 -0.498 4.371 573 HA LYS 80 HA LYS 80 78.222 1.709 5.759 574 HB2 LYS 80 HB2 LYS 80 78.497 0.295 7.706 575 HB3 LYS 80 HB3 LYS 80 76.976 -0.109 6.933 576 HG2 LYS 80 HG2 LYS 80 78.039 -2.071 5.924 577 HG3 LYS 80 HG3 LYS 80 79.519 -1.674 6.777 578 HD2 LYS 80 HD2 LYS 80 76.875 -2.240 8.126 579 HD3 LYS 80 HD3 LYS 80 78.185 -3.405 7.937 580 HE2 LYS 80 HE2 LYS 80 79.663 -1.920 9.217 581 HE3 LYS 80 HE3 LYS 80 78.332 -0.788 9.433 582 HZ1 LYS 80 HZ1 LYS 80 78.394 -3.577 10.417 583 HZ2 LYS 80 HZ2 LYS 80 77.145 -2.473 10.683 584 HZ3 LYS 80 HZ3 LYS 80 78.665 -2.208 11.346 585 H GLU 81 H GLU 81 79.752 -1.022 4.211 586 HA GLU 81 HA GLU 81 82.346 -0.555 5.157 587 HB2 GLU 81 HB2 GLU 81 81.441 -1.794 2.566 588 HB3 GLU 81 HB3 GLU 81 83.089 -1.850 3.172 589 HG2 GLU 81 HG2 GLU 81 82.286 -3.089 5.140 590 HG3 GLU 81 HG3 GLU 81 80.659 -3.060 4.464 591 H TRP 82 H TRP 82 80.611 0.666 2.368 592 HA TRP 82 HA TRP 82 82.760 2.070 1.145 593 HB2 TRP 82 HB2 TRP 82 80.467 1.473 0.147 594 HB3 TRP 82 HB3 TRP 82 79.911 2.850 1.125 595 HD1 TRP 82 HD1 TRP 82 82.320 2.164 -1.810 596 HE1 TRP 82 HE1 TRP 82 82.431 4.282 -3.252 597 HE3 TRP 82 HE3 TRP 82 79.516 5.262 1.121 598 HZ2 TRP 82 HZ2 TRP 82 81.444 6.915 -3.172 599 HZ3 TRP 82 HZ3 TRP 82 79.158 7.567 0.393 600 HH2 TRP 82 HH2 TRP 82 80.109 8.397 -1.713 601 H ARG 83 H ARG 83 80.163 2.948 3.313 602 HA ARG 83 HA ARG 83 80.581 5.704 3.473 603 HB2 ARG 83 HB2 ARG 83 78.669 4.047 4.462 604 HB3 ARG 83 HB3 ARG 83 79.748 4.225 5.857 605 HG2 ARG 83 HG2 ARG 83 78.159 5.827 6.231 606 HG3 ARG 83 HG3 ARG 83 79.618 6.584 5.580 607 HD2 ARG 83 HD2 ARG 83 78.587 6.931 3.424 608 HD3 ARG 83 HD3 ARG 83 77.169 6.006 3.923 609 HE ARG 83 HE ARG 83 77.234 7.830 5.811 610 HH11 ARG 83 HH11 ARG 83 77.253 8.337 2.252 611 HH12 ARG 83 HH12 ARG 83 76.707 9.943 2.424 612 HH21 ARG 83 HH21 ARG 83 76.448 10.019 5.896 613 HH22 ARG 83 HH22 ARG 83 76.208 10.868 4.459 614 H ALA 84 H ALA 84 81.742 2.999 5.486 615 HA ALA 84 HA ALA 84 83.296 4.534 7.268 616 HB1 ALA 84 HB1 ALA 84 82.523 2.258 7.780 617 HB2 ALA 84 HB2 ALA 84 84.280 2.385 7.923 618 HB3 ALA 84 HB3 ALA 84 83.560 1.625 6.505 619 H ALA 85 H ALA 85 84.056 2.915 4.223 620 HA ALA 85 HA ALA 85 86.837 3.308 4.223 621 HB1 ALA 85 HB1 ALA 85 84.982 3.193 1.843 622 HB2 ALA 85 HB2 ALA 85 85.678 1.795 2.661 623 HB3 ALA 85 HB3 ALA 85 86.726 2.931 1.814 624 H ASN 86 H ASN 86 84.242 5.287 2.934 625 HA ASN 86 HA ASN 86 85.913 7.374 1.949 626 HB2 ASN 86 HB2 ASN 86 83.513 6.963 1.277 627 HB3 ASN 86 HB3 ASN 86 83.032 7.588 2.850 628 HD21 ASN 86 HD21 ASN 86 83.876 8.371 -0.324 629 HD22 ASN 86 HD22 ASN 86 83.915 10.079 -0.142 630 H GLY 87 H GLY 87 84.176 6.807 4.954 631 HA2 GLY 87 HA2 GLY 87 85.032 7.568 7.055 632 HA3 GLY 87 HA3 GLY 87 85.712 8.968 6.223 633 H LYS 88 H LYS 88 82.440 7.754 5.585 634 HA LYS 88 HA LYS 88 81.419 10.298 6.408 635 HB2 LYS 88 HB2 LYS 88 80.674 8.108 4.540 636 HB3 LYS 88 HB3 LYS 88 79.500 9.289 5.057 637 HG2 LYS 88 HG2 LYS 88 80.871 11.059 4.046 638 HG3 LYS 88 HG3 LYS 88 82.091 9.861 3.608 639 HD2 LYS 88 HD2 LYS 88 80.434 8.714 2.203 640 HD3 LYS 88 HD3 LYS 88 79.238 9.937 2.606 641 HE2 LYS 88 HE2 LYS 88 81.858 10.444 1.199 642 HE3 LYS 88 HE3 LYS 88 80.320 10.302 0.373 643 HZ1 LYS 88 HZ1 LYS 88 81.165 12.418 2.296 644 HZ2 LYS 88 HZ2 LYS 88 79.596 12.290 1.713 645 HZ3 LYS 88 HZ3 LYS 88 80.860 12.607 0.656 646 HA PRO 89 HA PRO 89 79.298 8.397 9.864 647 HB2 PRO 89 HB2 PRO 89 76.841 9.659 9.513 648 HB3 PRO 89 HB3 PRO 89 78.175 10.356 10.428 649 HG2 PRO 89 HG2 PRO 89 77.296 10.837 7.621 650 HG3 PRO 89 HG3 PRO 89 77.959 11.987 8.794 651 HD2 PRO 89 HD2 PRO 89 79.437 11.053 6.781 652 HD3 PRO 89 HD3 PRO 89 80.148 11.315 8.386 653 H GLY 90 H GLY 90 78.383 6.491 10.035 654 HA2 GLY 90 HA2 GLY 90 76.925 5.416 7.746 655 HA3 GLY 90 HA3 GLY 90 77.637 4.492 9.061 656 H PHE 91 H PHE 91 75.838 3.328 9.492 657 HA PHE 91 HA PHE 91 73.242 4.544 9.796 658 HB2 PHE 91 HB2 PHE 91 74.099 1.729 10.488 659 HB3 PHE 91 HB3 PHE 91 72.462 2.312 10.247 660 HD1 PHE 91 HD1 PHE 91 72.159 3.511 7.824 661 HD2 PHE 91 HD2 PHE 91 74.989 0.490 8.820 662 HE1 PHE 91 HE1 PHE 91 72.292 2.842 5.480 663 HE2 PHE 91 HE2 PHE 91 75.120 -0.153 6.449 664 HZ PHE 91 HZ PHE 91 73.779 1.030 4.789 665 H LYS 92 H LYS 92 72.000 4.297 11.794 666 HA LYS 92 HA LYS 92 73.684 4.730 14.088 667 HB2 LYS 92 HB2 LYS 92 71.735 5.679 15.035 668 HB3 LYS 92 HB3 LYS 92 71.969 6.375 13.460 669 HG2 LYS 92 HG2 LYS 92 70.197 5.049 12.567 670 HG3 LYS 92 HG3 LYS 92 70.126 4.107 14.050 671 HD2 LYS 92 HD2 LYS 92 69.503 7.062 13.869 672 HD3 LYS 92 HD3 LYS 92 68.276 5.797 13.842 673 HE2 LYS 92 HE2 LYS 92 69.095 5.079 16.096 674 HE3 LYS 92 HE3 LYS 92 70.182 6.465 16.091 675 HZ1 LYS 92 HZ1 LYS 92 68.195 7.013 17.297 676 HZ2 LYS 92 HZ2 LYS 92 67.230 6.529 16.021 677 HZ3 LYS 92 HZ3 LYS 92 68.193 7.900 15.866 678 H GLN 93 H GLN 93 72.569 3.916 16.124 679 HA GLN 93 HA GLN 93 71.606 1.207 15.790 680 HB2 GLN 93 HB2 GLN 93 73.085 2.727 17.807 681 HB3 GLN 93 HB3 GLN 93 72.323 1.197 18.250 682 HG2 GLN 93 HG2 GLN 93 74.487 1.677 16.198 683 HG3 GLN 93 HG3 GLN 93 74.680 0.872 17.760 684 HE21 GLN 93 HE21 GLN 93 73.492 0.575 14.511 685 HE22 GLN 93 HE22 GLN 93 73.229 -1.119 14.513 686 H GLY 94 H GLY 94 69.715 0.715 16.793 687 HA2 GLY 94 HA2 GLY 94 68.357 1.531 18.767 688 HA3 GLY 94 HA3 GLY 94 68.122 2.953 17.736 Start of MODEL 25 1 H GLU 2 H GLU 2 61.577 2.421 8.936 2 HA GLU 2 HA GLU 2 59.240 3.440 7.486 3 HB2 GLU 2 HB2 GLU 2 60.782 4.460 9.873 4 HB3 GLU 2 HB3 GLU 2 59.625 5.424 8.966 5 HG2 GLU 2 HG2 GLU 2 59.023 2.890 10.450 6 HG3 GLU 2 HG3 GLU 2 58.620 4.530 10.962 7 H LEU 3 H LEU 3 60.105 6.031 7.236 8 HA LEU 3 HA LEU 3 62.514 5.761 5.583 9 HB2 LEU 3 HB2 LEU 3 60.079 7.517 5.210 10 HB3 LEU 3 HB3 LEU 3 61.547 7.673 4.274 11 HG LEU 3 HG LEU 3 59.726 5.268 4.289 12 HD11 LEU 3 HD11 LEU 3 58.741 7.192 3.132 13 HD12 LEU 3 HD12 LEU 3 59.224 5.945 1.982 14 HD13 LEU 3 HD13 LEU 3 60.214 7.381 2.182 15 HD21 LEU 3 HD21 LEU 3 62.205 5.898 2.720 16 HD22 LEU 3 HD22 LEU 3 61.139 4.512 2.456 17 HD23 LEU 3 HD23 LEU 3 62.033 4.670 3.972 18 H LYS 4 H LYS 4 64.103 7.194 5.966 19 HA LYS 4 HA LYS 4 63.607 9.360 7.903 20 HB2 LYS 4 HB2 LYS 4 66.326 8.279 7.119 21 HB3 LYS 4 HB3 LYS 4 65.914 9.244 8.533 22 HG2 LYS 4 HG2 LYS 4 65.589 6.327 7.993 23 HG3 LYS 4 HG3 LYS 4 66.379 7.093 9.351 24 HD2 LYS 4 HD2 LYS 4 63.974 7.965 9.820 25 HD3 LYS 4 HD3 LYS 4 63.536 6.662 8.756 26 HE2 LYS 4 HE2 LYS 4 64.999 5.123 10.176 27 HE3 LYS 4 HE3 LYS 4 65.010 6.408 11.360 28 HZ1 LYS 4 HZ1 LYS 4 62.715 4.809 10.452 29 HZ2 LYS 4 HZ2 LYS 4 62.478 6.279 11.255 30 HZ3 LYS 4 HZ3 LYS 4 63.269 5.014 12.022 31 H ASN 5 H ASN 5 65.712 11.053 7.297 32 HA ASN 5 HA ASN 5 65.313 11.568 4.420 33 HB2 ASN 5 HB2 ASN 5 66.106 13.900 4.845 34 HB3 ASN 5 HB3 ASN 5 64.592 13.513 5.659 35 HD21 ASN 5 HD21 ASN 5 64.505 13.655 7.825 36 HD22 ASN 5 HD22 ASN 5 65.820 14.185 8.808 37 H SER 6 H SER 6 67.624 11.020 6.872 38 HA SER 6 HA SER 6 69.648 10.806 4.804 39 HB2 SER 6 HB2 SER 6 71.259 11.608 6.672 40 HB3 SER 6 HB3 SER 6 70.301 12.807 5.805 41 HG SER 6 HG SER 6 68.883 12.887 7.480 42 H ILE 7 H ILE 7 71.507 9.438 5.542 43 HA ILE 7 HA ILE 7 70.481 6.905 6.342 44 HB ILE 7 HB ILE 7 72.364 7.307 4.687 45 HG12 ILE 7 HG12 ILE 7 73.016 5.389 6.948 46 HG13 ILE 7 HG13 ILE 7 71.912 5.055 5.621 47 HG21 ILE 7 HG21 ILE 7 74.003 7.752 7.180 48 HG22 ILE 7 HG22 ILE 7 73.637 8.953 5.949 49 HG23 ILE 7 HG23 ILE 7 74.652 7.566 5.551 50 HD11 ILE 7 HD11 ILE 7 74.867 5.576 5.364 51 HD12 ILE 7 HD12 ILE 7 73.758 5.227 4.040 52 HD13 ILE 7 HD13 ILE 7 74.074 4.002 5.268 53 H SER 8 H SER 8 71.500 9.538 8.099 54 HA SER 8 HA SER 8 72.975 8.292 10.166 55 HB2 SER 8 HB2 SER 8 71.633 10.984 10.124 56 HB3 SER 8 HB3 SER 8 73.013 10.472 11.112 57 HG SER 8 HG SER 8 73.761 9.885 8.782 58 H ASP 9 H ASP 9 69.582 8.790 9.544 59 HA ASP 9 HA ASP 9 69.020 8.107 12.337 60 HB2 ASP 9 HB2 ASP 9 67.682 10.010 11.105 61 HB3 ASP 9 HB3 ASP 9 66.941 8.694 10.270 62 H TYR 10 H TYR 10 69.870 6.550 9.789 63 HA TYR 10 HA TYR 10 67.718 4.606 9.740 64 HB2 TYR 10 HB2 TYR 10 69.868 5.287 7.798 65 HB3 TYR 10 HB3 TYR 10 69.420 3.594 7.914 66 HD1 TYR 10 HD1 TYR 10 66.968 3.008 7.611 67 HD2 TYR 10 HD2 TYR 10 68.565 6.776 6.458 68 HE1 TYR 10 HE1 TYR 10 65.039 3.362 6.134 69 HE2 TYR 10 HE2 TYR 10 66.643 7.136 4.964 70 HH TYR 10 HH TYR 10 64.870 5.926 3.860 71 H THR 11 H THR 11 67.858 3.092 11.153 72 HA THR 11 HA THR 11 70.377 2.228 12.176 73 HB THR 11 HB THR 11 69.036 0.506 13.298 74 HG1 THR 11 HG1 THR 11 66.837 0.315 12.831 75 HG21 THR 11 HG21 THR 11 68.937 2.719 14.296 76 HG22 THR 11 HG22 THR 11 67.402 1.875 14.493 77 HG23 THR 11 HG23 THR 11 67.567 3.131 13.265 78 H GLU 12 H GLU 12 71.108 -0.048 11.618 79 HA GLU 12 HA GLU 12 70.970 -0.307 8.848 80 HB2 GLU 12 HB2 GLU 12 72.027 -2.580 9.168 81 HB3 GLU 12 HB3 GLU 12 72.917 -1.177 9.734 82 HG2 GLU 12 HG2 GLU 12 72.412 -1.654 11.969 83 HG3 GLU 12 HG3 GLU 12 71.266 -2.912 11.563 84 H ALA 13 H ALA 13 69.054 -1.826 11.324 85 HA ALA 13 HA ALA 13 67.801 -3.586 9.488 86 HB1 ALA 13 HB1 ALA 13 66.208 -4.078 11.227 87 HB2 ALA 13 HB2 ALA 13 66.711 -2.650 12.140 88 HB3 ALA 13 HB3 ALA 13 67.832 -3.998 11.908 89 H GLU 14 H GLU 14 66.926 -0.290 10.619 90 HA GLU 14 HA GLU 14 64.494 -0.015 9.234 91 HB2 GLU 14 HB2 GLU 14 66.624 1.875 10.115 92 HB3 GLU 14 HB3 GLU 14 65.484 2.482 8.934 93 HG2 GLU 14 HG2 GLU 14 64.739 1.289 11.588 94 HG3 GLU 14 HG3 GLU 14 64.903 3.018 11.259 95 H PHE 15 H PHE 15 67.775 0.338 8.273 96 HA PHE 15 HA PHE 15 67.280 1.234 5.669 97 HB2 PHE 15 HB2 PHE 15 69.360 1.513 7.056 98 HB3 PHE 15 HB3 PHE 15 69.715 -0.175 6.728 99 HD1 PHE 15 HD1 PHE 15 69.084 3.070 5.082 100 HD2 PHE 15 HD2 PHE 15 70.862 -0.751 4.875 101 HE1 PHE 15 HE1 PHE 15 70.251 3.740 3.028 102 HE2 PHE 15 HE2 PHE 15 72.048 -0.098 2.808 103 HZ PHE 15 HZ PHE 15 71.733 2.154 1.900 104 H VAL 16 H VAL 16 68.005 -2.021 7.043 105 HA VAL 16 HA VAL 16 67.981 -3.313 4.558 106 HB VAL 16 HB VAL 16 67.892 -5.419 5.566 107 HG11 VAL 16 HG11 VAL 16 69.438 -3.677 7.347 108 HG12 VAL 16 HG12 VAL 16 69.956 -4.697 5.987 109 HG13 VAL 16 HG13 VAL 16 69.413 -5.427 7.488 110 HG21 VAL 16 HG21 VAL 16 66.654 -4.264 8.043 111 HG22 VAL 16 HG22 VAL 16 67.292 -5.917 7.891 112 HG23 VAL 16 HG23 VAL 16 65.965 -5.391 6.862 113 H GLN 17 H GLN 17 65.294 -2.557 6.730 114 HA GLN 17 HA GLN 17 63.472 -4.162 5.271 115 HB2 GLN 17 HB2 GLN 17 61.677 -3.252 6.653 116 HB3 GLN 17 HB3 GLN 17 63.155 -3.600 7.527 117 HG2 GLN 17 HG2 GLN 17 62.260 -1.682 8.552 118 HG3 GLN 17 HG3 GLN 17 63.641 -1.167 7.605 119 HE21 GLN 17 HE21 GLN 17 63.342 0.478 6.218 120 HE22 GLN 17 HE22 GLN 17 61.832 1.168 5.749 121 H LEU 18 H LEU 18 64.392 -1.001 5.097 122 HA LEU 18 HA LEU 18 62.514 -0.165 3.105 123 HB2 LEU 18 HB2 LEU 18 63.780 1.408 4.507 124 HB3 LEU 18 HB3 LEU 18 65.264 1.035 3.747 125 HG LEU 18 HG LEU 18 64.135 3.213 3.054 126 HD11 LEU 18 HD11 LEU 18 65.982 2.300 1.778 127 HD12 LEU 18 HD12 LEU 18 64.769 3.021 0.712 128 HD13 LEU 18 HD13 LEU 18 64.857 1.268 0.895 129 HD21 LEU 18 HD21 LEU 18 61.871 2.326 2.840 130 HD22 LEU 18 HD22 LEU 18 62.399 1.315 1.490 131 HD23 LEU 18 HD23 LEU 18 62.429 3.072 1.344 132 H LEU 19 H LEU 19 65.759 -1.295 2.972 133 HA LEU 19 HA LEU 19 66.046 -1.401 0.220 134 HB2 LEU 19 HB2 LEU 19 67.392 -2.544 2.494 135 HB3 LEU 19 HB3 LEU 19 67.642 -3.437 1.002 136 HG LEU 19 HG LEU 19 68.541 -1.449 -0.073 137 HD11 LEU 19 HD11 LEU 19 67.195 0.260 0.962 138 HD12 LEU 19 HD12 LEU 19 68.921 0.584 1.201 139 HD13 LEU 19 HD13 LEU 19 67.948 -0.067 2.527 140 HD21 LEU 19 HD21 LEU 19 70.498 -1.162 1.215 141 HD22 LEU 19 HD22 LEU 19 69.950 -2.856 1.275 142 HD23 LEU 19 HD23 LEU 19 69.652 -1.770 2.642 143 H LYS 20 H LYS 20 64.686 -3.791 2.385 144 HA LYS 20 HA LYS 20 64.361 -5.843 0.523 145 HB2 LYS 20 HB2 LYS 20 62.646 -5.173 2.923 146 HB3 LYS 20 HB3 LYS 20 62.535 -6.674 2.015 147 HG2 LYS 20 HG2 LYS 20 64.981 -7.033 2.585 148 HG3 LYS 20 HG3 LYS 20 64.828 -5.638 3.588 149 HD2 LYS 20 HD2 LYS 20 63.198 -6.572 5.020 150 HD3 LYS 20 HD3 LYS 20 62.975 -7.967 3.966 151 HE2 LYS 20 HE2 LYS 20 65.603 -7.338 5.284 152 HE3 LYS 20 HE3 LYS 20 64.372 -8.314 6.072 153 HZ1 LYS 20 HZ1 LYS 20 66.122 -9.585 4.858 154 HZ2 LYS 20 HZ2 LYS 20 65.446 -9.071 3.370 155 HZ3 LYS 20 HZ3 LYS 20 64.548 -9.950 4.471 156 H GLU 21 H GLU 21 62.430 -3.038 1.299 157 HA GLU 21 HA GLU 21 60.243 -3.666 -0.362 158 HB2 GLU 21 HB2 GLU 21 61.219 -1.048 0.756 159 HB3 GLU 21 HB3 GLU 21 59.726 -1.190 -0.149 160 HG2 GLU 21 HG2 GLU 21 60.401 -2.506 2.468 161 HG3 GLU 21 HG3 GLU 21 59.244 -1.202 2.199 162 H ILE 22 H ILE 22 63.304 -2.075 -0.873 163 HA ILE 22 HA ILE 22 62.678 -1.008 -3.424 164 HB ILE 22 HB ILE 22 65.485 -1.849 -2.685 165 HG12 ILE 22 HG12 ILE 22 64.002 0.633 -1.804 166 HG13 ILE 22 HG13 ILE 22 64.626 -0.612 -0.778 167 HG21 ILE 22 HG21 ILE 22 65.105 -1.059 -4.954 168 HG22 ILE 22 HG22 ILE 22 65.980 0.193 -4.046 169 HG23 ILE 22 HG23 ILE 22 64.261 0.353 -4.337 170 HD11 ILE 22 HD11 ILE 22 66.332 1.176 -2.499 171 HD12 ILE 22 HD12 ILE 22 66.923 -0.076 -1.409 172 HD13 ILE 22 HD13 ILE 22 66.098 1.344 -0.762 173 H GLU 23 H GLU 23 64.096 -4.028 -2.334 174 HA GLU 23 HA GLU 23 64.738 -5.201 -4.785 175 HB2 GLU 23 HB2 GLU 23 63.600 -6.414 -2.307 176 HB3 GLU 23 HB3 GLU 23 64.189 -7.377 -3.632 177 HG2 GLU 23 HG2 GLU 23 66.440 -6.293 -3.234 178 HG3 GLU 23 HG3 GLU 23 65.733 -5.558 -1.794 179 H LYS 24 H LYS 24 61.794 -5.198 -2.945 180 HA LYS 24 HA LYS 24 60.289 -6.906 -4.542 181 HB2 LYS 24 HB2 LYS 24 59.798 -6.352 -2.255 182 HB3 LYS 24 HB3 LYS 24 59.403 -4.698 -2.703 183 HG2 LYS 24 HG2 LYS 24 57.534 -5.463 -4.020 184 HG3 LYS 24 HG3 LYS 24 57.951 -7.143 -3.671 185 HD2 LYS 24 HD2 LYS 24 57.571 -6.665 -1.265 186 HD3 LYS 24 HD3 LYS 24 57.033 -5.045 -1.713 187 HE2 LYS 24 HE2 LYS 24 55.132 -6.570 -1.401 188 HE3 LYS 24 HE3 LYS 24 55.246 -5.976 -3.054 189 HZ1 LYS 24 HZ1 LYS 24 56.171 -8.049 -3.765 190 HZ2 LYS 24 HZ2 LYS 24 54.791 -8.411 -2.869 191 HZ3 LYS 24 HZ3 LYS 24 56.316 -8.604 -2.188 192 H GLU 25 H GLU 25 60.543 -3.336 -4.628 193 HA GLU 25 HA GLU 25 58.699 -3.141 -6.775 194 HB2 GLU 25 HB2 GLU 25 60.605 -1.117 -5.573 195 HB3 GLU 25 HB3 GLU 25 59.445 -0.781 -6.835 196 HG2 GLU 25 HG2 GLU 25 58.740 -1.779 -4.092 197 HG3 GLU 25 HG3 GLU 25 58.602 -0.113 -4.654 198 H ASN 26 H ASN 26 62.133 -3.512 -6.493 199 HA ASN 26 HA ASN 26 62.757 -2.693 -9.164 200 HB2 ASN 26 HB2 ASN 26 64.429 -2.584 -7.346 201 HB3 ASN 26 HB3 ASN 26 64.402 -4.336 -7.221 202 HD21 ASN 26 HD21 ASN 26 65.503 -5.577 -8.779 203 HD22 ASN 26 HD22 ASN 26 66.552 -4.865 -9.920 204 H VAL 27 H VAL 27 62.394 -5.834 -7.574 205 HA VAL 27 HA VAL 27 63.000 -7.358 -9.875 206 HB VAL 27 HB VAL 27 61.514 -8.131 -7.331 207 HG11 VAL 27 HG11 VAL 27 62.603 -9.944 -9.487 208 HG12 VAL 27 HG12 VAL 27 60.899 -9.671 -9.123 209 HG13 VAL 27 HG13 VAL 27 61.935 -10.468 -7.941 210 HG21 VAL 27 HG21 VAL 27 64.355 -8.603 -8.220 211 HG22 VAL 27 HG22 VAL 27 63.636 -9.226 -6.737 212 HG23 VAL 27 HG23 VAL 27 63.826 -7.486 -6.962 213 H ALA 28 H ALA 28 59.979 -6.087 -8.600 214 HA ALA 28 HA ALA 28 58.415 -7.372 -10.678 215 HB1 ALA 28 HB1 ALA 28 57.436 -7.022 -8.461 216 HB2 ALA 28 HB2 ALA 28 56.520 -6.149 -9.693 217 HB3 ALA 28 HB3 ALA 28 57.637 -5.281 -8.647 218 H ALA 29 H ALA 29 60.347 -4.703 -10.445 219 HA ALA 29 HA ALA 29 60.751 -2.836 -11.519 220 HB1 ALA 29 HB1 ALA 29 59.561 -4.215 -13.913 221 HB2 ALA 29 HB2 ALA 29 61.216 -4.430 -13.318 222 HB3 ALA 29 HB3 ALA 29 60.686 -2.855 -13.916 223 H THR 30 H THR 30 59.207 -1.748 -10.201 224 HA THR 30 HA THR 30 56.866 -0.840 -11.671 225 HB THR 30 HB THR 30 56.214 0.164 -9.474 226 HG1 THR 30 HG1 THR 30 57.469 -0.563 -7.666 227 HG21 THR 30 HG21 THR 30 55.473 -2.087 -10.074 228 HG22 THR 30 HG22 THR 30 55.790 -1.967 -8.334 229 HG23 THR 30 HG23 THR 30 56.967 -2.741 -9.399 230 H ASP 31 H ASP 31 56.638 1.744 -10.533 231 HA ASP 31 HA ASP 31 59.098 3.022 -11.456 232 HB2 ASP 31 HB2 ASP 31 57.596 3.124 -13.339 233 HB3 ASP 31 HB3 ASP 31 56.326 3.739 -12.281 234 H ASP 32 H ASP 32 56.018 3.900 -9.964 235 HA ASP 32 HA ASP 32 57.040 6.309 -8.935 236 HB2 ASP 32 HB2 ASP 32 54.620 4.751 -8.124 237 HB3 ASP 32 HB3 ASP 32 55.092 6.254 -7.337 238 H VAL 33 H VAL 33 56.772 3.273 -7.202 239 HA VAL 33 HA VAL 33 58.046 4.696 -5.070 240 HB VAL 33 HB VAL 33 56.794 1.949 -5.198 241 HG11 VAL 33 HG11 VAL 33 58.829 1.921 -3.946 242 HG12 VAL 33 HG12 VAL 33 57.393 1.723 -2.887 243 HG13 VAL 33 HG13 VAL 33 58.264 3.293 -2.994 244 HG21 VAL 33 HG21 VAL 33 55.387 3.856 -4.998 245 HG22 VAL 33 HG22 VAL 33 56.424 4.425 -3.676 246 HG23 VAL 33 HG23 VAL 33 55.461 2.935 -3.465 247 H LEU 34 H LEU 34 58.702 2.455 -7.521 248 HA LEU 34 HA LEU 34 61.126 1.409 -6.632 249 HB2 LEU 34 HB2 LEU 34 59.712 0.731 -8.700 250 HB3 LEU 34 HB3 LEU 34 60.307 2.180 -9.400 251 HG LEU 34 HG LEU 34 61.380 -0.089 -10.026 252 HD11 LEU 34 HD11 LEU 34 62.931 2.425 -9.610 253 HD12 LEU 34 HD12 LEU 34 61.892 2.008 -10.978 254 HD13 LEU 34 HD13 LEU 34 63.367 1.084 -10.683 255 HD21 LEU 34 HD21 LEU 34 62.073 -0.735 -7.779 256 HD22 LEU 34 HD22 LEU 34 63.022 0.744 -7.637 257 HD23 LEU 34 HD23 LEU 34 63.478 -0.484 -8.817 258 H ASP 35 H ASP 35 60.365 4.346 -8.458 259 HA ASP 35 HA ASP 35 63.064 5.204 -8.483 260 HB2 ASP 35 HB2 ASP 35 61.563 5.976 -10.225 261 HB3 ASP 35 HB3 ASP 35 60.534 6.749 -9.026 262 H VAL 36 H VAL 36 60.474 5.686 -6.211 263 HA VAL 36 HA VAL 36 61.675 7.811 -4.790 264 HB VAL 36 HB VAL 36 60.256 5.460 -3.540 265 HG11 VAL 36 HG11 VAL 36 61.578 6.700 -2.034 266 HG12 VAL 36 HG12 VAL 36 59.853 7.021 -1.687 267 HG13 VAL 36 HG13 VAL 36 60.853 8.211 -2.570 268 HG21 VAL 36 HG21 VAL 36 58.359 6.792 -3.427 269 HG22 VAL 36 HG22 VAL 36 58.894 6.549 -5.119 270 HG23 VAL 36 HG23 VAL 36 59.181 8.115 -4.289 271 H LEU 37 H LEU 37 61.839 4.392 -4.574 272 HA LEU 37 HA LEU 37 63.421 4.360 -2.273 273 HB2 LEU 37 HB2 LEU 37 63.110 2.163 -4.239 274 HB3 LEU 37 HB3 LEU 37 63.589 2.199 -2.551 275 HG LEU 37 HG LEU 37 60.813 2.974 -3.380 276 HD11 LEU 37 HD11 LEU 37 60.044 0.895 -2.475 277 HD12 LEU 37 HD12 LEU 37 61.701 0.378 -2.160 278 HD13 LEU 37 HD13 LEU 37 61.140 0.614 -3.826 279 HD21 LEU 37 HD21 LEU 37 62.039 2.435 -0.684 280 HD22 LEU 37 HD22 LEU 37 60.335 2.773 -0.981 281 HD23 LEU 37 HD23 LEU 37 61.547 4.008 -1.315 282 H LEU 38 H LEU 38 64.124 3.871 -5.650 283 HA LEU 38 HA LEU 38 66.809 3.198 -5.300 284 HB2 LEU 38 HB2 LEU 38 65.311 4.459 -7.538 285 HB3 LEU 38 HB3 LEU 38 66.990 3.955 -7.730 286 HG LEU 38 HG LEU 38 64.468 2.357 -7.431 287 HD11 LEU 38 HD11 LEU 38 65.155 3.072 -9.639 288 HD12 LEU 38 HD12 LEU 38 65.248 1.308 -9.449 289 HD13 LEU 38 HD13 LEU 38 66.714 2.285 -9.367 290 HD21 LEU 38 HD21 LEU 38 67.262 1.235 -7.205 291 HD22 LEU 38 HD22 LEU 38 65.767 0.309 -7.294 292 HD23 LEU 38 HD23 LEU 38 66.084 1.330 -5.895 293 H GLU 39 H GLU 39 65.248 6.325 -5.820 294 HA GLU 39 HA GLU 39 67.686 7.760 -5.807 295 HB2 GLU 39 HB2 GLU 39 64.826 8.448 -5.478 296 HB3 GLU 39 HB3 GLU 39 66.098 9.630 -5.241 297 HG2 GLU 39 HG2 GLU 39 65.602 8.058 -7.766 298 HG3 GLU 39 HG3 GLU 39 65.097 9.720 -7.427 299 H HIS 40 H HIS 40 65.236 7.056 -3.397 300 HA HIS 40 HA HIS 40 66.137 8.737 -1.401 301 HB2 HIS 40 HB2 HIS 40 63.942 7.551 -1.480 302 HB3 HIS 40 HB3 HIS 40 64.738 6.065 -1.060 303 HD1 HIS 40 HD1 HIS 40 63.110 8.940 0.421 304 HD2 HIS 40 HD2 HIS 40 65.939 6.145 1.602 305 HE1 HIS 40 HE1 HIS 40 63.188 9.038 2.944 306 H PHE 41 H PHE 41 66.809 5.393 -2.087 307 HA PHE 41 HA PHE 41 68.508 4.838 0.032 308 HB2 PHE 41 HB2 PHE 41 67.602 3.055 -1.121 309 HB3 PHE 41 HB3 PHE 41 68.042 3.718 -2.683 310 HD1 PHE 41 HD1 PHE 41 69.440 2.248 0.397 311 HD2 PHE 41 HD2 PHE 41 69.957 3.011 -3.726 312 HE1 PHE 41 HE1 PHE 41 71.435 0.777 0.376 313 HE2 PHE 41 HE2 PHE 41 71.929 1.587 -3.749 314 HZ PHE 41 HZ PHE 41 72.673 0.460 -1.747 315 H VAL 42 H VAL 42 69.277 5.842 -3.298 316 HA VAL 42 HA VAL 42 72.018 5.917 -2.675 317 HB VAL 42 HB VAL 42 71.227 5.520 -4.944 318 HG11 VAL 42 HG11 VAL 42 70.475 8.362 -5.068 319 HG12 VAL 42 HG12 VAL 42 69.458 6.886 -5.108 320 HG13 VAL 42 HG13 VAL 42 70.625 7.189 -6.405 321 HG21 VAL 42 HG21 VAL 42 72.889 6.848 -6.147 322 HG22 VAL 42 HG22 VAL 42 73.533 6.192 -4.637 323 HG23 VAL 42 HG23 VAL 42 73.055 7.882 -4.733 324 H LYS 43 H LYS 43 69.581 8.329 -2.475 325 HA LYS 43 HA LYS 43 71.430 10.512 -2.171 326 HB2 LYS 43 HB2 LYS 43 69.606 11.924 -1.731 327 HB3 LYS 43 HB3 LYS 43 68.897 10.678 -2.739 328 HG2 LYS 43 HG2 LYS 43 68.016 9.571 -0.607 329 HG3 LYS 43 HG3 LYS 43 68.699 10.928 0.245 330 HD2 LYS 43 HD2 LYS 43 67.305 12.495 -0.990 331 HD3 LYS 43 HD3 LYS 43 66.562 11.150 -1.858 332 HE2 LYS 43 HE2 LYS 43 65.705 10.249 0.240 333 HE3 LYS 43 HE3 LYS 43 66.504 11.539 1.135 334 HZ1 LYS 43 HZ1 LYS 43 64.291 11.894 -0.827 335 HZ2 LYS 43 HZ2 LYS 43 65.109 13.134 -0.052 336 HZ3 LYS 43 HZ3 LYS 43 64.197 12.055 0.843 337 H ILE 44 H ILE 44 70.140 8.193 0.050 338 HA ILE 44 HA ILE 44 71.125 9.732 2.281 339 HB ILE 44 HB ILE 44 70.348 7.857 3.733 340 HG12 ILE 44 HG12 ILE 44 69.372 6.677 1.126 341 HG13 ILE 44 HG13 ILE 44 70.655 6.015 2.118 342 HG21 ILE 44 HG21 ILE 44 67.949 8.214 3.374 343 HG22 ILE 44 HG22 ILE 44 68.295 8.882 1.781 344 HG23 ILE 44 HG23 ILE 44 68.858 9.720 3.223 345 HD11 ILE 44 HD11 ILE 44 68.566 4.788 2.375 346 HD12 ILE 44 HD12 ILE 44 67.765 6.269 2.901 347 HD13 ILE 44 HD13 ILE 44 69.040 5.561 3.887 348 H THR 45 H THR 45 72.103 6.971 0.400 349 HA THR 45 HA THR 45 74.292 6.352 2.172 350 HB THR 45 HB THR 45 74.911 4.709 0.405 351 HG1 THR 45 HG1 THR 45 72.447 5.246 -0.843 352 HG21 THR 45 HG21 THR 45 73.402 4.073 2.215 353 HG22 THR 45 HG22 THR 45 72.953 3.281 0.701 354 HG23 THR 45 HG23 THR 45 72.027 4.663 1.278 355 H GLU 46 H GLU 46 73.707 8.114 -0.786 356 HA GLU 46 HA GLU 46 74.891 9.294 -2.179 357 HB2 GLU 46 HB2 GLU 46 76.433 9.640 0.343 358 HB3 GLU 46 HB3 GLU 46 76.916 10.503 -1.129 359 HG2 GLU 46 HG2 GLU 46 74.206 10.634 0.184 360 HG3 GLU 46 HG3 GLU 46 75.484 11.830 0.424 361 H HIS 47 H HIS 47 75.222 6.591 -2.085 362 HA HIS 47 HA HIS 47 77.970 5.907 -2.486 363 HB2 HIS 47 HB2 HIS 47 76.230 4.370 -1.460 364 HB3 HIS 47 HB3 HIS 47 75.488 4.252 -3.052 365 HD1 HIS 47 HD1 HIS 47 76.377 2.345 -4.499 366 HD2 HIS 47 HD2 HIS 47 78.928 3.391 -1.407 367 HE1 HIS 47 HE1 HIS 47 78.369 0.800 -4.644 368 HA PRO 48 HA PRO 48 77.871 7.115 -6.834 369 HB2 PRO 48 HB2 PRO 48 79.918 5.101 -7.270 370 HB3 PRO 48 HB3 PRO 48 80.006 6.852 -7.472 371 HG2 PRO 48 HG2 PRO 48 81.230 5.430 -5.598 372 HG3 PRO 48 HG3 PRO 48 80.641 7.077 -5.194 373 HD2 PRO 48 HD2 PRO 48 79.503 4.367 -4.617 374 HD3 PRO 48 HD3 PRO 48 79.559 5.772 -3.549 375 H ASP 49 H ASP 49 77.111 4.069 -5.761 376 HA ASP 49 HA ASP 49 76.601 3.315 -8.413 377 HB2 ASP 49 HB2 ASP 49 77.791 1.427 -6.369 378 HB3 ASP 49 HB3 ASP 49 77.246 0.928 -7.949 379 H GLY 50 H GLY 50 75.044 4.436 -6.351 380 HA2 GLY 50 HA2 GLY 50 73.672 2.905 -4.382 381 HA3 GLY 50 HA3 GLY 50 73.039 4.269 -5.280 382 H THR 51 H THR 51 72.611 3.519 -7.539 383 HA THR 51 HA THR 51 70.464 1.773 -6.896 384 HB THR 51 HB THR 51 70.861 2.584 -9.724 385 HG1 THR 51 HG1 THR 51 69.652 4.543 -8.312 386 HG21 THR 51 HG21 THR 51 68.585 2.630 -7.748 387 HG22 THR 51 HG22 THR 51 68.896 1.345 -8.887 388 HG23 THR 51 HG23 THR 51 68.470 2.967 -9.466 389 H ALA 52 H ALA 52 73.459 1.508 -8.620 390 HA ALA 52 HA ALA 52 73.034 -1.011 -9.878 391 HB1 ALA 52 HB1 ALA 52 75.443 -1.105 -10.072 392 HB2 ALA 52 HB2 ALA 52 75.615 0.175 -8.872 393 HB3 ALA 52 HB3 ALA 52 74.903 0.534 -10.446 394 H LEU 53 H LEU 53 73.824 -0.112 -6.627 395 HA LEU 53 HA LEU 53 74.490 -2.711 -5.783 396 HB2 LEU 53 HB2 LEU 53 73.379 -0.435 -4.200 397 HB3 LEU 53 HB3 LEU 53 73.814 -1.976 -3.495 398 HG LEU 53 HG LEU 53 75.633 0.056 -4.758 399 HD11 LEU 53 HD11 LEU 53 76.681 -0.014 -2.572 400 HD12 LEU 53 HD12 LEU 53 75.467 -1.177 -2.031 401 HD13 LEU 53 HD13 LEU 53 74.988 0.459 -2.491 402 HD21 LEU 53 HD21 LEU 53 76.298 -2.758 -3.881 403 HD22 LEU 53 HD22 LEU 53 77.473 -1.506 -4.267 404 HD23 LEU 53 HD23 LEU 53 76.408 -2.121 -5.526 405 H ILE 54 H ILE 54 71.354 -1.134 -5.962 406 HA ILE 54 HA ILE 54 70.095 -3.371 -4.637 407 HB ILE 54 HB ILE 54 68.573 -1.592 -6.592 408 HG12 ILE 54 HG12 ILE 54 67.681 -0.678 -4.278 409 HG13 ILE 54 HG13 ILE 54 69.252 -1.223 -3.715 410 HG21 ILE 54 HG21 ILE 54 66.573 -2.333 -5.418 411 HG22 ILE 54 HG22 ILE 54 67.556 -3.365 -4.382 412 HG23 ILE 54 HG23 ILE 54 67.457 -3.691 -6.112 413 HD11 ILE 54 HD11 ILE 54 69.266 1.105 -4.301 414 HD12 ILE 54 HD12 ILE 54 68.786 0.705 -5.953 415 HD13 ILE 54 HD13 ILE 54 70.350 0.174 -5.326 416 H TYR 55 H TYR 55 70.624 -2.460 -7.927 417 HA TYR 55 HA TYR 55 69.371 -4.568 -9.214 418 HB2 TYR 55 HB2 TYR 55 71.553 -2.693 -9.928 419 HB3 TYR 55 HB3 TYR 55 71.236 -4.034 -11.001 420 HD1 TYR 55 HD1 TYR 55 68.809 -4.247 -11.905 421 HD2 TYR 55 HD2 TYR 55 70.264 -0.733 -10.010 422 HE1 TYR 55 HE1 TYR 55 66.983 -2.948 -12.924 423 HE2 TYR 55 HE2 TYR 55 68.444 0.573 -11.014 424 HH TYR 55 HH TYR 55 65.774 -0.887 -12.510 425 H GLU 56 H GLU 56 72.786 -4.340 -8.133 426 HA GLU 56 HA GLU 56 73.239 -7.001 -8.926 427 HB2 GLU 56 HB2 GLU 56 75.282 -6.984 -7.473 428 HB3 GLU 56 HB3 GLU 56 75.231 -5.720 -8.685 429 HG2 GLU 56 HG2 GLU 56 75.011 -4.086 -7.181 430 HG3 GLU 56 HG3 GLU 56 74.286 -5.060 -5.925 431 H ALA 57 H ALA 57 72.036 -5.635 -5.930 432 HA ALA 57 HA ALA 57 72.332 -7.856 -4.259 433 HB1 ALA 57 HB1 ALA 57 70.050 -5.892 -4.258 434 HB2 ALA 57 HB2 ALA 57 71.606 -5.654 -3.468 435 HB3 ALA 57 HB3 ALA 57 70.529 -6.941 -2.922 436 H ALA 58 H ALA 58 69.665 -7.034 -6.420 437 HA ALA 58 HA ALA 58 68.026 -9.215 -5.780 438 HB1 ALA 58 HB1 ALA 58 67.220 -7.254 -7.011 439 HB2 ALA 58 HB2 ALA 58 66.876 -8.742 -7.893 440 HB3 ALA 58 HB3 ALA 58 68.218 -7.711 -8.390 441 H ALA 59 H ALA 59 70.499 -8.802 -8.245 442 HA ALA 59 HA ALA 59 70.209 -11.397 -9.355 443 HB1 ALA 59 HB1 ALA 59 71.155 -9.550 -10.621 444 HB2 ALA 59 HB2 ALA 59 72.301 -10.891 -10.521 445 HB3 ALA 59 HB3 ALA 59 72.511 -9.467 -9.501 446 H ARG 60 H ARG 60 72.201 -10.031 -6.837 447 HA ARG 60 HA ARG 60 73.943 -12.196 -6.373 448 HB2 ARG 60 HB2 ARG 60 72.992 -9.946 -4.629 449 HB3 ARG 60 HB3 ARG 60 74.084 -11.181 -4.026 450 HG2 ARG 60 HG2 ARG 60 75.784 -10.549 -5.518 451 HG3 ARG 60 HG3 ARG 60 74.684 -9.555 -6.475 452 HD2 ARG 60 HD2 ARG 60 76.165 -8.212 -5.020 453 HD3 ARG 60 HD3 ARG 60 74.459 -7.976 -4.667 454 HE ARG 60 HE ARG 60 75.270 -9.939 -2.965 455 HH11 ARG 60 HH11 ARG 60 76.391 -6.615 -3.583 456 HH12 ARG 60 HH12 ARG 60 76.893 -6.356 -1.978 457 HH21 ARG 60 HH21 ARG 60 75.889 -9.514 -0.758 458 HH22 ARG 60 HH22 ARG 60 76.632 -8.021 -0.356 459 H ALA 61 H ALA 61 70.707 -11.551 -5.274 460 HA ALA 61 HA ALA 61 70.767 -13.854 -3.553 461 HB1 ALA 61 HB1 ALA 61 68.402 -13.410 -3.164 462 HB2 ALA 61 HB2 ALA 61 68.409 -12.168 -4.433 463 HB3 ALA 61 HB3 ALA 61 69.383 -11.969 -2.966 464 H ALA 62 H ALA 62 69.350 -13.130 -6.719 465 HA ALA 62 HA ALA 62 68.201 -15.687 -7.097 466 HB1 ALA 62 HB1 ALA 62 67.556 -13.709 -8.425 467 HB2 ALA 62 HB2 ALA 62 68.014 -15.068 -9.455 468 HB3 ALA 62 HB3 ALA 62 69.137 -13.733 -9.204 469 H ALA 63 H ALA 63 71.306 -14.388 -8.115 470 HA ALA 63 HA ALA 63 72.229 -17.128 -8.422 471 HB1 ALA 63 HB1 ALA 63 73.890 -16.268 -10.037 472 HB2 ALA 63 HB2 ALA 63 73.210 -14.650 -9.871 473 HB3 ALA 63 HB3 ALA 63 72.246 -15.940 -10.589 474 H ASN 64 H ASN 64 72.579 -17.106 -6.217 475 HA ASN 64 HA ASN 64 74.113 -15.120 -4.911 476 HB2 ASN 64 HB2 ASN 64 72.426 -16.550 -3.788 477 HB3 ASN 64 HB3 ASN 64 73.502 -17.928 -3.964 478 HD21 ASN 64 HD21 ASN 64 74.235 -14.571 -3.125 479 HD22 ASN 64 HD22 ASN 64 74.924 -14.957 -1.579 480 HA PRO 65 HA PRO 65 78.053 -16.906 -6.257 481 HB2 PRO 65 HB2 PRO 65 79.293 -14.623 -4.915 482 HB3 PRO 65 HB3 PRO 65 79.292 -15.018 -6.633 483 HG2 PRO 65 HG2 PRO 65 77.922 -12.897 -5.611 484 HG3 PRO 65 HG3 PRO 65 77.410 -13.779 -7.056 485 HD2 PRO 65 HD2 PRO 65 76.377 -13.965 -4.259 486 HD3 PRO 65 HD3 PRO 65 75.501 -14.009 -5.808 487 H GLY 66 H GLY 66 77.763 -15.242 -3.120 488 HA2 GLY 66 HA2 GLY 66 78.517 -17.647 -1.691 489 HA3 GLY 66 HA3 GLY 66 79.611 -16.271 -1.540 490 H GLY 67 H GLY 67 78.629 -17.126 0.614 491 HA2 GLY 67 HA2 GLY 67 76.048 -16.052 1.236 492 HA3 GLY 67 HA3 GLY 67 77.217 -16.890 2.271 493 H ASP 68 H ASP 68 77.431 -13.953 0.378 494 HA ASP 68 HA ASP 68 78.596 -12.532 2.662 495 HB2 ASP 68 HB2 ASP 68 78.304 -11.685 -0.230 496 HB3 ASP 68 HB3 ASP 68 79.069 -10.720 1.022 497 H GLY 69 H GLY 69 75.672 -13.060 1.316 498 HA2 GLY 69 HA2 GLY 69 73.716 -12.101 2.359 499 HA3 GLY 69 HA3 GLY 69 74.544 -10.537 2.347 500 H GLY 70 H GLY 70 73.143 -13.056 0.447 501 HA2 GLY 70 HA2 GLY 70 73.102 -11.433 -1.926 502 HA3 GLY 70 HA3 GLY 70 72.392 -13.038 -1.735 503 H GLY 71 H GLY 71 71.938 -9.633 -1.177 504 HA2 GLY 71 HA2 GLY 71 69.473 -9.292 -1.915 505 HA3 GLY 71 HA3 GLY 71 69.230 -10.085 -0.357 506 HA PRO 72 HA PRO 72 69.312 -5.673 0.498 507 HB2 PRO 72 HB2 PRO 72 67.854 -5.914 2.822 508 HB3 PRO 72 HB3 PRO 72 67.179 -5.634 1.224 509 HG2 PRO 72 HG2 PRO 72 67.087 -8.051 2.849 510 HG3 PRO 72 HG3 PRO 72 66.222 -7.632 1.360 511 HD2 PRO 72 HD2 PRO 72 68.428 -9.402 1.661 512 HD3 PRO 72 HD3 PRO 72 67.538 -8.992 0.189 513 H GLU 73 H GLU 73 69.626 -8.087 3.017 514 HA GLU 73 HA GLU 73 71.069 -6.402 4.793 515 HB2 GLU 73 HB2 GLU 73 70.548 -9.383 4.819 516 HB3 GLU 73 HB3 GLU 73 71.127 -8.420 6.182 517 HG2 GLU 73 HG2 GLU 73 69.113 -7.178 6.263 518 HG3 GLU 73 HG3 GLU 73 68.556 -7.862 4.754 519 H GLY 74 H GLY 74 72.024 -7.812 2.023 520 HA2 GLY 74 HA2 GLY 74 74.689 -7.782 3.117 521 HA3 GLY 74 HA3 GLY 74 74.355 -8.683 1.581 522 H ILE 75 H ILE 75 72.808 -6.287 0.617 523 HA ILE 75 HA ILE 75 74.975 -4.693 -0.263 524 HB ILE 75 HB ILE 75 73.052 -2.950 -0.712 525 HG12 ILE 75 HG12 ILE 75 71.484 -5.515 -0.639 526 HG13 ILE 75 HG13 ILE 75 71.479 -4.366 0.684 527 HG21 ILE 75 HG21 ILE 75 73.416 -5.495 -2.256 528 HG22 ILE 75 HG22 ILE 75 74.358 -4.001 -2.381 529 HG23 ILE 75 HG23 ILE 75 72.660 -4.010 -2.856 530 HD11 ILE 75 HD11 ILE 75 69.542 -4.145 -0.683 531 HD12 ILE 75 HD12 ILE 75 70.539 -3.816 -2.127 532 HD13 ILE 75 HD13 ILE 75 70.559 -2.718 -0.713 533 H VAL 76 H VAL 76 72.901 -4.515 2.570 534 HA VAL 76 HA VAL 76 73.482 -1.960 3.264 535 HB VAL 76 HB VAL 76 73.001 -2.615 5.395 536 HG11 VAL 76 HG11 VAL 76 71.226 -2.230 3.763 537 HG12 VAL 76 HG12 VAL 76 70.704 -3.098 5.190 538 HG13 VAL 76 HG13 VAL 76 70.984 -3.976 3.672 539 HG21 VAL 76 HG21 VAL 76 72.908 -5.458 4.563 540 HG22 VAL 76 HG22 VAL 76 72.222 -4.860 6.082 541 HG23 VAL 76 HG23 VAL 76 73.951 -4.705 5.770 542 H LYS 77 H LYS 77 75.164 -4.899 3.741 543 HA LYS 77 HA LYS 77 77.258 -3.994 5.382 544 HB2 LYS 77 HB2 LYS 77 76.721 -6.340 5.029 545 HB3 LYS 77 HB3 LYS 77 77.178 -6.213 3.341 546 HG2 LYS 77 HG2 LYS 77 79.501 -5.691 4.082 547 HG3 LYS 77 HG3 LYS 77 78.988 -6.033 5.740 548 HD2 LYS 77 HD2 LYS 77 78.754 -7.930 3.429 549 HD3 LYS 77 HD3 LYS 77 80.058 -7.979 4.630 550 HE2 LYS 77 HE2 LYS 77 78.387 -8.420 6.386 551 HE3 LYS 77 HE3 LYS 77 77.106 -8.299 5.183 552 HZ1 LYS 77 HZ1 LYS 77 79.232 -10.361 5.208 553 HZ2 LYS 77 HZ2 LYS 77 77.957 -10.230 4.084 554 HZ3 LYS 77 HZ3 LYS 77 77.627 -10.578 5.678 555 H GLU 78 H GLU 78 76.893 -4.326 1.865 556 HA GLU 78 HA GLU 78 79.413 -3.436 1.053 557 HB2 GLU 78 HB2 GLU 78 77.580 -4.481 -0.400 558 HB3 GLU 78 HB3 GLU 78 76.821 -2.909 -0.494 559 HG2 GLU 78 HG2 GLU 78 78.087 -3.196 -2.446 560 HG3 GLU 78 HG3 GLU 78 78.953 -2.030 -1.444 561 H ILE 79 H ILE 79 76.485 -1.684 1.862 562 HA ILE 79 HA ILE 79 77.361 0.887 1.195 563 HB ILE 79 HB ILE 79 75.233 -0.041 3.129 564 HG12 ILE 79 HG12 ILE 79 74.802 -0.466 0.769 565 HG13 ILE 79 HG13 ILE 79 73.661 0.703 1.426 566 HG21 ILE 79 HG21 ILE 79 75.775 2.811 2.318 567 HG22 ILE 79 HG22 ILE 79 75.989 2.116 3.926 568 HG23 ILE 79 HG23 ILE 79 74.373 2.244 3.230 569 HD11 ILE 79 HD11 ILE 79 76.032 1.282 -0.347 570 HD12 ILE 79 HD12 ILE 79 75.019 2.510 0.409 571 HD13 ILE 79 HD13 ILE 79 74.322 1.394 -0.762 572 H LYS 80 H LYS 80 77.391 -0.902 4.304 573 HA LYS 80 HA LYS 80 78.369 1.321 5.768 574 HB2 LYS 80 HB2 LYS 80 78.629 -0.150 7.697 575 HB3 LYS 80 HB3 LYS 80 77.180 -0.619 6.821 576 HG2 LYS 80 HG2 LYS 80 78.257 -2.502 5.886 577 HG3 LYS 80 HG3 LYS 80 79.791 -2.032 6.587 578 HD2 LYS 80 HD2 LYS 80 78.689 -3.822 7.892 579 HD3 LYS 80 HD3 LYS 80 78.955 -2.358 8.834 580 HE2 LYS 80 HE2 LYS 80 76.599 -1.739 8.540 581 HE3 LYS 80 HE3 LYS 80 76.334 -3.176 7.552 582 HZ1 LYS 80 HZ1 LYS 80 77.258 -3.261 10.365 583 HZ2 LYS 80 HZ2 LYS 80 76.733 -4.563 9.445 584 HZ3 LYS 80 HZ3 LYS 80 75.641 -3.398 9.962 585 H GLU 81 H GLU 81 79.943 -1.340 4.160 586 HA GLU 81 HA GLU 81 82.496 -0.757 5.200 587 HB2 GLU 81 HB2 GLU 81 81.820 -2.279 2.687 588 HB3 GLU 81 HB3 GLU 81 83.365 -2.319 3.538 589 HG2 GLU 81 HG2 GLU 81 82.154 -3.184 5.525 590 HG3 GLU 81 HG3 GLU 81 80.713 -3.317 4.527 591 H TRP 82 H TRP 82 80.747 0.375 2.421 592 HA TRP 82 HA TRP 82 82.945 1.695 1.153 593 HB2 TRP 82 HB2 TRP 82 80.660 1.180 0.101 594 HB3 TRP 82 HB3 TRP 82 80.094 2.512 1.134 595 HD1 TRP 82 HD1 TRP 82 82.495 1.965 -1.840 596 HE1 TRP 82 HE1 TRP 82 82.697 4.188 -3.098 597 HE3 TRP 82 HE3 TRP 82 79.762 4.924 1.304 598 HZ2 TRP 82 HZ2 TRP 82 81.800 6.827 -2.826 599 HZ3 TRP 82 HZ3 TRP 82 79.490 7.295 0.747 600 HH2 TRP 82 HH2 TRP 82 80.488 8.238 -1.249 601 H ARG 83 H ARG 83 80.345 2.636 3.287 602 HA ARG 83 HA ARG 83 80.777 5.394 3.380 603 HB2 ARG 83 HB2 ARG 83 78.797 3.800 4.232 604 HB3 ARG 83 HB3 ARG 83 79.795 3.891 5.689 605 HG2 ARG 83 HG2 ARG 83 78.151 5.513 5.998 606 HG3 ARG 83 HG3 ARG 83 79.697 6.263 5.568 607 HD2 ARG 83 HD2 ARG 83 78.944 6.771 3.352 608 HD3 ARG 83 HD3 ARG 83 77.443 5.868 3.600 609 HE ARG 83 HE ARG 83 77.375 7.618 5.613 610 HH11 ARG 83 HH11 ARG 83 77.528 8.182 2.089 611 HH12 ARG 83 HH12 ARG 83 77.120 9.818 2.233 612 HH21 ARG 83 HH21 ARG 83 76.733 9.806 5.747 613 HH22 ARG 83 HH22 ARG 83 76.625 10.772 4.351 614 H ALA 84 H ALA 84 81.800 2.753 5.543 615 HA ALA 84 HA ALA 84 83.236 4.342 7.370 616 HB1 ALA 84 HB1 ALA 84 84.142 2.240 8.210 617 HB2 ALA 84 HB2 ALA 84 83.562 1.401 6.771 618 HB3 ALA 84 HB3 ALA 84 82.411 2.094 7.909 619 H ALA 85 H ALA 85 84.219 2.632 4.442 620 HA ALA 85 HA ALA 85 86.995 3.040 4.771 621 HB1 ALA 85 HB1 ALA 85 87.195 2.472 2.401 622 HB2 ALA 85 HB2 ALA 85 85.446 2.644 2.212 623 HB3 ALA 85 HB3 ALA 85 86.100 1.365 3.228 624 H ASN 86 H ASN 86 84.475 4.945 3.253 625 HA ASN 86 HA ASN 86 86.248 6.944 2.215 626 HB2 ASN 86 HB2 ASN 86 83.855 6.659 1.401 627 HB3 ASN 86 HB3 ASN 86 83.327 7.315 2.946 628 HD21 ASN 86 HD21 ASN 86 84.498 8.025 -0.168 629 HD22 ASN 86 HD22 ASN 86 84.577 9.737 0.008 630 H GLY 87 H GLY 87 84.257 6.627 5.091 631 HA2 GLY 87 HA2 GLY 87 85.051 7.441 7.208 632 HA3 GLY 87 HA3 GLY 87 85.808 8.782 6.351 633 H LYS 88 H LYS 88 82.490 7.465 5.810 634 HA LYS 88 HA LYS 88 81.497 10.068 6.452 635 HB2 LYS 88 HB2 LYS 88 80.886 7.934 4.456 636 HB3 LYS 88 HB3 LYS 88 79.681 9.106 4.916 637 HG2 LYS 88 HG2 LYS 88 81.164 10.913 4.107 638 HG3 LYS 88 HG3 LYS 88 82.398 9.715 3.735 639 HD2 LYS 88 HD2 LYS 88 80.991 8.741 2.013 640 HD3 LYS 88 HD3 LYS 88 79.667 9.831 2.396 641 HE2 LYS 88 HE2 LYS 88 81.249 11.747 1.845 642 HE3 LYS 88 HE3 LYS 88 82.376 10.524 1.283 643 HZ1 LYS 88 HZ1 LYS 88 80.834 9.921 -0.494 644 HZ2 LYS 88 HZ2 LYS 88 81.124 11.563 -0.490 645 HZ3 LYS 88 HZ3 LYS 88 79.681 11.011 0.117 646 HA PRO 89 HA PRO 89 79.230 7.894 9.697 647 HB2 PRO 89 HB2 PRO 89 77.012 9.541 9.771 648 HB3 PRO 89 HB3 PRO 89 78.521 9.914 10.600 649 HG2 PRO 89 HG2 PRO 89 77.481 10.929 7.992 650 HG3 PRO 89 HG3 PRO 89 78.393 11.788 9.245 651 HD2 PRO 89 HD2 PRO 89 79.531 10.931 6.954 652 HD3 PRO 89 HD3 PRO 89 80.423 10.994 8.484 653 H GLY 90 H GLY 90 77.883 6.158 9.549 654 HA2 GLY 90 HA2 GLY 90 76.175 6.093 7.174 655 HA3 GLY 90 HA3 GLY 90 77.008 4.688 7.810 656 H PHE 91 H PHE 91 75.890 3.406 9.057 657 HA PHE 91 HA PHE 91 73.119 4.036 9.584 658 HB2 PHE 91 HB2 PHE 91 74.642 1.577 10.427 659 HB3 PHE 91 HB3 PHE 91 72.899 1.766 10.346 660 HD1 PHE 91 HD1 PHE 91 72.535 3.001 7.725 661 HD2 PHE 91 HD2 PHE 91 75.175 -0.082 8.970 662 HE1 PHE 91 HE1 PHE 91 72.581 2.120 5.446 663 HE2 PHE 91 HE2 PHE 91 75.218 -0.971 6.680 664 HZ PHE 91 HZ PHE 91 73.923 0.131 4.922 665 H LYS 92 H LYS 92 72.136 4.261 11.557 666 HA LYS 92 HA LYS 92 73.879 4.683 13.811 667 HB2 LYS 92 HB2 LYS 92 72.188 5.969 14.657 668 HB3 LYS 92 HB3 LYS 92 72.069 6.270 12.972 669 HG2 LYS 92 HG2 LYS 92 70.154 4.972 12.729 670 HG3 LYS 92 HG3 LYS 92 70.398 4.204 14.308 671 HD2 LYS 92 HD2 LYS 92 70.101 6.428 15.362 672 HD3 LYS 92 HD3 LYS 92 69.666 7.081 13.787 673 HE2 LYS 92 HE2 LYS 92 67.904 5.425 13.617 674 HE3 LYS 92 HE3 LYS 92 68.371 4.826 15.210 675 HZ1 LYS 92 HZ1 LYS 92 67.283 7.548 14.625 676 HZ2 LYS 92 HZ2 LYS 92 67.768 6.992 16.154 677 HZ3 LYS 92 HZ3 LYS 92 66.452 6.278 15.363 678 H GLN 93 H GLN 93 72.852 3.921 15.849 679 HA GLN 93 HA GLN 93 72.164 1.128 15.568 680 HB2 GLN 93 HB2 GLN 93 73.109 2.966 17.639 681 HB3 GLN 93 HB3 GLN 93 72.418 1.428 18.156 682 HG2 GLN 93 HG2 GLN 93 74.813 1.190 18.169 683 HG3 GLN 93 HG3 GLN 93 74.250 0.334 16.743 684 HE21 GLN 93 HE21 GLN 93 74.823 1.104 14.729 685 HE22 GLN 93 HE22 GLN 93 75.983 2.362 14.511 686 H GLY 94 H GLY 94 70.264 0.348 16.472 687 HA2 GLY 94 HA2 GLY 94 68.503 1.305 18.211 688 HA3 GLY 94 HA3 GLY 94 68.110 2.248 16.769 Start of MODEL 26 1 H GLU 2 H GLU 2 61.201 2.311 8.894 2 HA GLU 2 HA GLU 2 59.223 3.215 6.885 3 HB2 GLU 2 HB2 GLU 2 60.218 4.556 9.408 4 HB3 GLU 2 HB3 GLU 2 59.138 5.287 8.227 5 HG2 GLU 2 HG2 GLU 2 58.567 2.975 10.061 6 HG3 GLU 2 HG3 GLU 2 57.836 4.582 10.084 7 H LEU 3 H LEU 3 59.957 5.250 5.900 8 HA LEU 3 HA LEU 3 62.764 4.961 5.278 9 HB2 LEU 3 HB2 LEU 3 60.694 6.790 4.124 10 HB3 LEU 3 HB3 LEU 3 62.301 6.528 3.486 11 HG LEU 3 HG LEU 3 59.982 4.626 3.466 12 HD11 LEU 3 HD11 LEU 3 61.683 5.805 1.269 13 HD12 LEU 3 HD12 LEU 3 60.047 6.304 1.667 14 HD13 LEU 3 HD13 LEU 3 60.347 4.685 1.026 15 HD21 LEU 3 HD21 LEU 3 61.934 3.376 4.101 16 HD22 LEU 3 HD22 LEU 3 62.859 4.107 2.800 17 HD23 LEU 3 HD23 LEU 3 61.517 3.003 2.423 18 H LYS 4 H LYS 4 64.199 6.342 5.919 19 HA LYS 4 HA LYS 4 63.414 8.454 7.754 20 HB2 LYS 4 HB2 LYS 4 66.176 7.533 6.994 21 HB3 LYS 4 HB3 LYS 4 65.728 8.497 8.397 22 HG2 LYS 4 HG2 LYS 4 65.389 5.587 7.835 23 HG3 LYS 4 HG3 LYS 4 66.199 6.324 9.195 24 HD2 LYS 4 HD2 LYS 4 63.828 7.248 9.694 25 HD3 LYS 4 HD3 LYS 4 63.341 5.947 8.623 26 HE2 LYS 4 HE2 LYS 4 64.904 4.457 10.021 27 HE3 LYS 4 HE3 LYS 4 64.865 5.739 11.186 28 HZ1 LYS 4 HZ1 LYS 4 63.215 4.272 11.887 29 HZ2 LYS 4 HZ2 LYS 4 62.625 4.024 10.368 30 HZ3 LYS 4 HZ3 LYS 4 62.330 5.514 11.143 31 H ASN 5 H ASN 5 65.419 10.256 7.440 32 HA ASN 5 HA ASN 5 65.273 10.922 4.597 33 HB2 ASN 5 HB2 ASN 5 65.329 12.853 6.920 34 HB3 ASN 5 HB3 ASN 5 65.449 13.337 5.231 35 HD21 ASN 5 HD21 ASN 5 63.628 12.966 3.861 36 HD22 ASN 5 HD22 ASN 5 62.041 12.810 4.509 37 H SER 6 H SER 6 67.286 9.762 6.819 38 HA SER 6 HA SER 6 69.513 10.384 5.154 39 HB2 SER 6 HB2 SER 6 70.938 11.030 7.030 40 HB3 SER 6 HB3 SER 6 69.693 12.226 6.680 41 HG SER 6 HG SER 6 68.931 11.974 8.585 42 H ILE 7 H ILE 7 71.361 9.026 5.664 43 HA ILE 7 HA ILE 7 70.580 6.331 6.092 44 HB ILE 7 HB ILE 7 72.454 7.074 4.598 45 HG12 ILE 7 HG12 ILE 7 73.267 5.032 6.716 46 HG13 ILE 7 HG13 ILE 7 72.337 4.721 5.259 47 HG21 ILE 7 HG21 ILE 7 73.959 7.551 7.164 48 HG22 ILE 7 HG22 ILE 7 73.452 8.775 6.004 49 HG23 ILE 7 HG23 ILE 7 74.660 7.577 5.545 50 HD11 ILE 7 HD11 ILE 7 74.264 5.310 3.906 51 HD12 ILE 7 HD12 ILE 7 74.643 4.019 5.045 52 HD13 ILE 7 HD13 ILE 7 75.187 5.664 5.364 53 H SER 8 H SER 8 71.676 8.818 8.193 54 HA SER 8 HA SER 8 72.751 7.037 10.163 55 HB2 SER 8 HB2 SER 8 72.410 10.033 10.170 56 HB3 SER 8 HB3 SER 8 73.374 9.093 11.323 57 HG SER 8 HG SER 8 74.395 8.244 9.330 58 H ASP 9 H ASP 9 69.682 7.880 9.370 59 HA ASP 9 HA ASP 9 68.744 7.772 12.178 60 HB2 ASP 9 HB2 ASP 9 67.729 9.417 10.202 61 HB3 ASP 9 HB3 ASP 9 66.932 7.955 9.856 62 H TYR 10 H TYR 10 69.732 5.856 9.880 63 HA TYR 10 HA TYR 10 67.485 3.985 9.779 64 HB2 TYR 10 HB2 TYR 10 69.770 4.537 7.944 65 HB3 TYR 10 HB3 TYR 10 69.249 2.872 8.093 66 HD1 TYR 10 HD1 TYR 10 66.889 2.304 7.499 67 HD2 TYR 10 HD2 TYR 10 68.586 6.083 6.590 68 HE1 TYR 10 HE1 TYR 10 65.122 2.682 5.831 69 HE2 TYR 10 HE2 TYR 10 66.821 6.474 4.911 70 HH TYR 10 HH TYR 10 65.176 5.284 3.611 71 H THR 11 H THR 11 67.600 2.315 11.087 72 HA THR 11 HA THR 11 70.144 1.416 12.169 73 HB THR 11 HB THR 11 68.753 -0.409 13.097 74 HG1 THR 11 HG1 THR 11 66.319 0.104 12.728 75 HG21 THR 11 HG21 THR 11 68.878 1.668 14.383 76 HG22 THR 11 HG22 THR 11 67.296 0.911 14.573 77 HG23 THR 11 HG23 THR 11 67.486 2.303 13.506 78 H GLU 12 H GLU 12 70.881 -0.660 11.667 79 HA GLU 12 HA GLU 12 71.187 -0.943 8.946 80 HB2 GLU 12 HB2 GLU 12 72.358 -3.005 9.396 81 HB3 GLU 12 HB3 GLU 12 72.796 -1.795 10.580 82 HG2 GLU 12 HG2 GLU 12 71.116 -4.282 11.005 83 HG3 GLU 12 HG3 GLU 12 72.687 -3.783 11.646 84 H ALA 13 H ALA 13 68.980 -2.584 11.122 85 HA ALA 13 HA ALA 13 67.859 -4.226 9.128 86 HB1 ALA 13 HB1 ALA 13 66.157 -4.791 10.738 87 HB2 ALA 13 HB2 ALA 13 66.624 -3.416 11.753 88 HB3 ALA 13 HB3 ALA 13 67.751 -4.757 11.489 89 H GLU 14 H GLU 14 66.855 -0.974 10.325 90 HA GLU 14 HA GLU 14 64.482 -0.746 8.801 91 HB2 GLU 14 HB2 GLU 14 66.460 1.245 9.853 92 HB3 GLU 14 HB3 GLU 14 65.276 1.814 8.698 93 HG2 GLU 14 HG2 GLU 14 64.602 0.432 11.286 94 HG3 GLU 14 HG3 GLU 14 64.681 2.181 11.076 95 H PHE 15 H PHE 15 67.823 -0.288 8.013 96 HA PHE 15 HA PHE 15 67.300 0.763 5.434 97 HB2 PHE 15 HB2 PHE 15 69.317 1.220 6.890 98 HB3 PHE 15 HB3 PHE 15 69.892 -0.377 6.446 99 HD1 PHE 15 HD1 PHE 15 68.506 2.626 4.717 100 HD2 PHE 15 HD2 PHE 15 71.433 -0.414 4.841 101 HE1 PHE 15 HE1 PHE 15 69.574 3.578 2.706 102 HE2 PHE 15 HE2 PHE 15 72.501 0.517 2.824 103 HZ PHE 15 HZ PHE 15 71.559 2.517 1.773 104 H VAL 16 H VAL 16 68.279 -2.454 6.676 105 HA VAL 16 HA VAL 16 68.423 -3.648 4.126 106 HB VAL 16 HB VAL 16 68.364 -5.812 5.122 107 HG11 VAL 16 HG11 VAL 16 70.388 -4.827 5.461 108 HG12 VAL 16 HG12 VAL 16 69.996 -5.693 6.961 109 HG13 VAL 16 HG13 VAL 16 69.824 -3.945 6.868 110 HG21 VAL 16 HG21 VAL 16 67.074 -4.545 7.492 111 HG22 VAL 16 HG22 VAL 16 67.861 -6.125 7.591 112 HG23 VAL 16 HG23 VAL 16 66.492 -5.883 6.501 113 H GLN 17 H GLN 17 65.692 -2.971 6.226 114 HA GLN 17 HA GLN 17 63.772 -4.493 4.940 115 HB2 GLN 17 HB2 GLN 17 63.454 -3.486 7.112 116 HB3 GLN 17 HB3 GLN 17 63.602 -1.879 6.411 117 HG2 GLN 17 HG2 GLN 17 61.689 -2.352 5.019 118 HG3 GLN 17 HG3 GLN 17 61.507 -3.900 5.852 119 HE21 GLN 17 HE21 GLN 17 61.190 -0.516 6.057 120 HE22 GLN 17 HE22 GLN 17 60.280 -0.488 7.534 121 H LEU 18 H LEU 18 64.817 -1.129 4.552 122 HA LEU 18 HA LEU 18 63.111 -0.368 2.520 123 HB2 LEU 18 HB2 LEU 18 64.360 1.259 3.543 124 HB3 LEU 18 HB3 LEU 18 65.880 0.527 3.347 125 HG LEU 18 HG LEU 18 65.737 0.985 0.860 126 HD11 LEU 18 HD11 LEU 18 64.167 2.656 0.070 127 HD12 LEU 18 HD12 LEU 18 63.340 2.596 1.628 128 HD13 LEU 18 HD13 LEU 18 63.375 1.171 0.593 129 HD21 LEU 18 HD21 LEU 18 65.607 3.359 2.700 130 HD22 LEU 18 HD22 LEU 18 66.253 3.368 1.059 131 HD23 LEU 18 HD23 LEU 18 67.042 2.409 2.314 132 H LEU 19 H LEU 19 66.283 -1.716 2.413 133 HA LEU 19 HA LEU 19 66.577 -1.998 -0.371 134 HB2 LEU 19 HB2 LEU 19 67.870 -3.042 1.981 135 HB3 LEU 19 HB3 LEU 19 68.117 -4.046 0.551 136 HG LEU 19 HG LEU 19 69.966 -2.560 0.783 137 HD11 LEU 19 HD11 LEU 19 69.893 -1.269 -1.293 138 HD12 LEU 19 HD12 LEU 19 68.156 -1.539 -1.405 139 HD13 LEU 19 HD13 LEU 19 69.266 -2.902 -1.485 140 HD21 LEU 19 HD21 LEU 19 69.762 -0.154 0.808 141 HD22 LEU 19 HD22 LEU 19 68.990 -0.881 2.223 142 HD23 LEU 19 HD23 LEU 19 68.004 -0.281 0.876 143 H LYS 20 H LYS 20 65.116 -4.266 1.918 144 HA LYS 20 HA LYS 20 64.738 -6.387 0.150 145 HB2 LYS 20 HB2 LYS 20 62.862 -5.470 2.347 146 HB3 LYS 20 HB3 LYS 20 62.743 -6.995 1.479 147 HG2 LYS 20 HG2 LYS 20 64.990 -7.559 2.349 148 HG3 LYS 20 HG3 LYS 20 64.937 -6.101 3.317 149 HD2 LYS 20 HD2 LYS 20 62.965 -6.867 4.502 150 HD3 LYS 20 HD3 LYS 20 62.883 -8.311 3.494 151 HE2 LYS 20 HE2 LYS 20 65.032 -9.057 4.388 152 HE3 LYS 20 HE3 LYS 20 65.138 -7.603 5.374 153 HZ1 LYS 20 HZ1 LYS 20 63.167 -8.316 6.582 154 HZ2 LYS 20 HZ2 LYS 20 64.332 -9.521 6.650 155 HZ3 LYS 20 HZ3 LYS 20 63.024 -9.687 5.620 156 H GLU 21 H GLU 21 62.771 -3.596 0.961 157 HA GLU 21 HA GLU 21 60.682 -4.110 -0.808 158 HB2 GLU 21 HB2 GLU 21 61.577 -1.580 0.549 159 HB3 GLU 21 HB3 GLU 21 60.126 -1.669 -0.437 160 HG2 GLU 21 HG2 GLU 21 59.227 -3.401 1.051 161 HG3 GLU 21 HG3 GLU 21 60.678 -3.290 2.042 162 H ILE 22 H ILE 22 63.655 -2.343 -1.197 163 HA ILE 22 HA ILE 22 63.014 -1.197 -3.675 164 HB ILE 22 HB ILE 22 65.812 -1.960 -2.781 165 HG12 ILE 22 HG12 ILE 22 64.174 0.525 -2.331 166 HG13 ILE 22 HG13 ILE 22 64.766 -0.570 -1.112 167 HG21 ILE 22 HG21 ILE 22 66.472 -0.160 -4.286 168 HG22 ILE 22 HG22 ILE 22 64.787 0.074 -4.759 169 HG23 ILE 22 HG23 ILE 22 65.618 -1.434 -5.158 170 HD11 ILE 22 HD11 ILE 22 66.525 1.149 -2.849 171 HD12 ILE 22 HD12 ILE 22 67.065 0.097 -1.538 172 HD13 ILE 22 HD13 ILE 22 66.068 1.504 -1.188 173 H GLU 23 H GLU 23 64.564 -4.319 -2.941 174 HA GLU 23 HA GLU 23 65.085 -4.968 -5.658 175 HB2 GLU 23 HB2 GLU 23 65.865 -7.071 -4.829 176 HB3 GLU 23 HB3 GLU 23 65.842 -5.985 -3.432 177 HG2 GLU 23 HG2 GLU 23 64.188 -6.974 -2.366 178 HG3 GLU 23 HG3 GLU 23 63.464 -7.682 -3.797 179 H LYS 24 H LYS 24 62.446 -5.294 -3.585 180 HA LYS 24 HA LYS 24 60.945 -7.179 -5.032 181 HB2 LYS 24 HB2 LYS 24 61.028 -6.690 -2.657 182 HB3 LYS 24 HB3 LYS 24 60.204 -5.180 -2.995 183 HG2 LYS 24 HG2 LYS 24 58.190 -6.241 -3.691 184 HG3 LYS 24 HG3 LYS 24 58.966 -7.824 -3.760 185 HD2 LYS 24 HD2 LYS 24 57.519 -7.640 -1.792 186 HD3 LYS 24 HD3 LYS 24 59.206 -7.829 -1.333 187 HE2 LYS 24 HE2 LYS 24 58.147 -6.165 0.073 188 HE3 LYS 24 HE3 LYS 24 59.358 -5.418 -0.955 189 HZ1 LYS 24 HZ1 LYS 24 57.618 -4.588 -2.395 190 HZ2 LYS 24 HZ2 LYS 24 57.307 -4.118 -0.829 191 HZ3 LYS 24 HZ3 LYS 24 56.443 -5.405 -1.502 192 H GLU 25 H GLU 25 60.548 -3.641 -4.496 193 HA GLU 25 HA GLU 25 58.547 -3.363 -6.402 194 HB2 GLU 25 HB2 GLU 25 60.394 -1.364 -5.054 195 HB3 GLU 25 HB3 GLU 25 59.290 -0.919 -6.290 196 HG2 GLU 25 HG2 GLU 25 58.388 -0.533 -4.023 197 HG3 GLU 25 HG3 GLU 25 57.378 -1.504 -5.084 198 H ASN 26 H ASN 26 61.893 -3.754 -6.733 199 HA ASN 26 HA ASN 26 62.094 -2.587 -9.357 200 HB2 ASN 26 HB2 ASN 26 64.092 -2.691 -7.899 201 HB3 ASN 26 HB3 ASN 26 63.994 -4.444 -7.907 202 HD21 ASN 26 HD21 ASN 26 64.759 -1.620 -9.801 203 HD22 ASN 26 HD22 ASN 26 65.562 -2.484 -11.067 204 H VAL 27 H VAL 27 62.074 -5.909 -8.074 205 HA VAL 27 HA VAL 27 62.046 -7.012 -10.698 206 HB VAL 27 HB VAL 27 61.764 -9.206 -9.680 207 HG11 VAL 27 HG11 VAL 27 63.989 -8.314 -9.737 208 HG12 VAL 27 HG12 VAL 27 63.765 -9.230 -8.241 209 HG13 VAL 27 HG13 VAL 27 63.726 -7.472 -8.212 210 HG21 VAL 27 HG21 VAL 27 61.568 -9.497 -7.242 211 HG22 VAL 27 HG22 VAL 27 60.163 -8.654 -7.905 212 HG23 VAL 27 HG23 VAL 27 61.417 -7.748 -7.057 213 H ALA 28 H ALA 28 59.537 -6.082 -8.483 214 HA ALA 28 HA ALA 28 57.465 -7.327 -10.067 215 HB1 ALA 28 HB1 ALA 28 57.278 -5.233 -7.890 216 HB2 ALA 28 HB2 ALA 28 57.136 -6.975 -7.654 217 HB3 ALA 28 HB3 ALA 28 55.918 -6.109 -8.591 218 H ALA 29 H ALA 29 59.278 -4.495 -10.021 219 HA ALA 29 HA ALA 29 59.436 -2.637 -11.189 220 HB1 ALA 29 HB1 ALA 29 57.777 -4.045 -13.276 221 HB2 ALA 29 HB2 ALA 29 59.528 -4.179 -13.101 222 HB3 ALA 29 HB3 ALA 29 58.796 -2.629 -13.528 223 H THR 30 H THR 30 58.291 -1.565 -9.594 224 HA THR 30 HA THR 30 55.499 -0.944 -10.133 225 HB THR 30 HB THR 30 55.590 0.244 -7.971 226 HG1 THR 30 HG1 THR 30 57.745 -0.332 -6.877 227 HG21 THR 30 HG21 THR 30 55.222 -2.219 -8.047 228 HG22 THR 30 HG22 THR 30 56.018 -1.672 -6.564 229 HG23 THR 30 HG23 THR 30 56.974 -2.410 -7.860 230 H ASP 31 H ASP 31 58.655 0.373 -10.405 231 HA ASP 31 HA ASP 31 59.591 2.098 -11.242 232 HB2 ASP 31 HB2 ASP 31 56.986 2.636 -12.615 233 HB3 ASP 31 HB3 ASP 31 58.548 3.428 -12.895 234 H ASP 32 H ASP 32 56.440 3.224 -10.133 235 HA ASP 32 HA ASP 32 57.470 5.848 -9.805 236 HB2 ASP 32 HB2 ASP 32 55.409 6.473 -8.770 237 HB3 ASP 32 HB3 ASP 32 55.043 5.444 -10.152 238 H VAL 33 H VAL 33 56.844 3.297 -7.456 239 HA VAL 33 HA VAL 33 58.051 5.009 -5.432 240 HB VAL 33 HB VAL 33 56.212 3.720 -4.695 241 HG11 VAL 33 HG11 VAL 33 56.343 1.757 -6.080 242 HG12 VAL 33 HG12 VAL 33 56.314 1.258 -4.383 243 HG13 VAL 33 HG13 VAL 33 57.836 1.264 -5.279 244 HG21 VAL 33 HG21 VAL 33 57.803 4.271 -2.989 245 HG22 VAL 33 HG22 VAL 33 58.745 2.825 -3.348 246 HG23 VAL 33 HG23 VAL 33 57.139 2.672 -2.639 247 H LEU 34 H LEU 34 58.811 2.382 -7.346 248 HA LEU 34 HA LEU 34 61.274 1.524 -6.217 249 HB2 LEU 34 HB2 LEU 34 59.902 0.490 -8.178 250 HB3 LEU 34 HB3 LEU 34 60.579 1.807 -9.066 251 HG LEU 34 HG LEU 34 61.663 -0.577 -9.198 252 HD11 LEU 34 HD11 LEU 34 63.692 0.461 -9.942 253 HD12 LEU 34 HD12 LEU 34 63.139 1.996 -9.229 254 HD13 LEU 34 HD13 LEU 34 62.223 1.239 -10.539 255 HD21 LEU 34 HD21 LEU 34 63.158 0.738 -6.931 256 HD22 LEU 34 HD22 LEU 34 63.695 -0.678 -7.823 257 HD23 LEU 34 HD23 LEU 34 62.234 -0.764 -6.836 258 H ASP 35 H ASP 35 60.519 4.130 -8.465 259 HA ASP 35 HA ASP 35 63.171 4.994 -8.837 260 HB2 ASP 35 HB2 ASP 35 61.101 5.751 -10.159 261 HB3 ASP 35 HB3 ASP 35 60.786 6.750 -8.741 262 H VAL 36 H VAL 36 60.763 5.816 -6.510 263 HA VAL 36 HA VAL 36 62.036 7.889 -5.119 264 HB VAL 36 HB VAL 36 60.426 5.638 -3.911 265 HG11 VAL 36 HG11 VAL 36 60.920 8.432 -3.105 266 HG12 VAL 36 HG12 VAL 36 61.667 6.967 -2.429 267 HG13 VAL 36 HG13 VAL 36 59.900 7.251 -2.228 268 HG21 VAL 36 HG21 VAL 36 59.530 8.241 -4.951 269 HG22 VAL 36 HG22 VAL 36 58.611 6.967 -4.061 270 HG23 VAL 36 HG23 VAL 36 59.310 6.613 -5.674 271 H LEU 37 H LEU 37 62.005 4.442 -4.708 272 HA LEU 37 HA LEU 37 63.517 4.363 -2.374 273 HB2 LEU 37 HB2 LEU 37 63.396 2.169 -4.388 274 HB3 LEU 37 HB3 LEU 37 63.699 2.236 -2.658 275 HG LEU 37 HG LEU 37 60.988 2.873 -3.754 276 HD11 LEU 37 HD11 LEU 37 60.271 0.700 -2.943 277 HD12 LEU 37 HD12 LEU 37 61.926 0.304 -2.503 278 HD13 LEU 37 HD13 LEU 37 61.496 0.534 -4.200 279 HD21 LEU 37 HD21 LEU 37 61.974 2.331 -0.950 280 HD22 LEU 37 HD22 LEU 37 60.298 2.618 -1.414 281 HD23 LEU 37 HD23 LEU 37 61.492 3.900 -1.601 282 H LEU 38 H LEU 38 64.300 3.951 -5.743 283 HA LEU 38 HA LEU 38 66.964 3.203 -5.482 284 HB2 LEU 38 HB2 LEU 38 65.435 4.655 -7.549 285 HB3 LEU 38 HB3 LEU 38 67.138 4.260 -7.818 286 HG LEU 38 HG LEU 38 64.616 2.662 -7.786 287 HD11 LEU 38 HD11 LEU 38 67.009 2.786 -9.488 288 HD12 LEU 38 HD12 LEU 38 65.402 3.447 -9.853 289 HD13 LEU 38 HD13 LEU 38 65.667 1.685 -9.787 290 HD21 LEU 38 HD21 LEU 38 65.834 0.555 -7.737 291 HD22 LEU 38 HD22 LEU 38 65.981 1.430 -6.217 292 HD23 LEU 38 HD23 LEU 38 67.325 1.417 -7.367 293 H GLU 39 H GLU 39 65.550 6.434 -6.007 294 HA GLU 39 HA GLU 39 68.085 7.678 -5.813 295 HB2 GLU 39 HB2 GLU 39 66.829 9.816 -5.711 296 HB3 GLU 39 HB3 GLU 39 66.447 8.820 -7.096 297 HG2 GLU 39 HG2 GLU 39 64.338 8.492 -6.497 298 HG3 GLU 39 HG3 GLU 39 64.621 8.476 -4.779 299 H HIS 40 H HIS 40 65.520 7.080 -3.541 300 HA HIS 40 HA HIS 40 66.347 8.680 -1.397 301 HB2 HIS 40 HB2 HIS 40 64.187 7.525 -1.558 302 HB3 HIS 40 HB3 HIS 40 64.931 5.983 -1.388 303 HD1 HIS 40 HD1 HIS 40 63.251 8.480 0.584 304 HD2 HIS 40 HD2 HIS 40 66.350 5.795 1.241 305 HE1 HIS 40 HE1 HIS 40 63.472 8.239 3.063 306 H PHE 41 H PHE 41 67.108 5.394 -2.252 307 HA PHE 41 HA PHE 41 68.751 4.799 -0.096 308 HB2 PHE 41 HB2 PHE 41 67.869 3.051 -1.332 309 HB3 PHE 41 HB3 PHE 41 68.369 3.754 -2.857 310 HD1 PHE 41 HD1 PHE 41 69.639 2.205 0.252 311 HD2 PHE 41 HD2 PHE 41 70.346 3.032 -3.843 312 HE1 PHE 41 HE1 PHE 41 71.655 0.779 0.316 313 HE2 PHE 41 HE2 PHE 41 72.360 1.634 -3.770 314 HZ PHE 41 HZ PHE 41 73.011 0.502 -1.722 315 H VAL 42 H VAL 42 69.614 5.841 -3.373 316 HA VAL 42 HA VAL 42 72.360 5.980 -2.703 317 HB VAL 42 HB VAL 42 71.656 5.501 -4.954 318 HG11 VAL 42 HG11 VAL 42 69.789 6.728 -5.196 319 HG12 VAL 42 HG12 VAL 42 70.947 7.055 -6.488 320 HG13 VAL 42 HG13 VAL 42 70.684 8.274 -5.199 321 HG21 VAL 42 HG21 VAL 42 73.898 6.325 -4.706 322 HG22 VAL 42 HG22 VAL 42 73.320 7.986 -4.818 323 HG23 VAL 42 HG23 VAL 42 73.211 6.920 -6.217 324 H LYS 43 H LYS 43 69.908 8.334 -2.546 325 HA LYS 43 HA LYS 43 71.724 10.547 -2.228 326 HB2 LYS 43 HB2 LYS 43 69.880 11.921 -1.691 327 HB3 LYS 43 HB3 LYS 43 69.180 10.698 -2.736 328 HG2 LYS 43 HG2 LYS 43 68.385 9.488 -0.588 329 HG3 LYS 43 HG3 LYS 43 69.003 10.878 0.257 330 HD2 LYS 43 HD2 LYS 43 67.513 12.365 -0.971 331 HD3 LYS 43 HD3 LYS 43 66.836 10.974 -1.818 332 HE2 LYS 43 HE2 LYS 43 66.080 10.033 0.318 333 HE3 LYS 43 HE3 LYS 43 66.773 11.409 1.170 334 HZ1 LYS 43 HZ1 LYS 43 65.227 12.855 -0.042 335 HZ2 LYS 43 HZ2 LYS 43 64.434 11.730 0.896 336 HZ3 LYS 43 HZ3 LYS 43 64.530 11.503 -0.777 337 H ILE 44 H ILE 44 70.291 8.386 0.133 338 HA ILE 44 HA ILE 44 71.405 9.914 2.321 339 HB ILE 44 HB ILE 44 70.570 8.068 3.764 340 HG12 ILE 44 HG12 ILE 44 69.616 6.905 1.135 341 HG13 ILE 44 HG13 ILE 44 70.820 6.193 2.193 342 HG21 ILE 44 HG21 ILE 44 68.196 8.524 3.400 343 HG22 ILE 44 HG22 ILE 44 68.554 9.114 1.780 344 HG23 ILE 44 HG23 ILE 44 69.152 9.996 3.182 345 HD11 ILE 44 HD11 ILE 44 68.586 5.149 2.303 346 HD12 ILE 44 HD12 ILE 44 67.960 6.663 2.950 347 HD13 ILE 44 HD13 ILE 44 69.169 5.750 3.854 348 H THR 45 H THR 45 72.334 7.146 0.442 349 HA THR 45 HA THR 45 74.510 6.494 2.214 350 HB THR 45 HB THR 45 75.123 4.851 0.459 351 HG1 THR 45 HG1 THR 45 72.709 5.353 -0.851 352 HG21 THR 45 HG21 THR 45 73.535 4.241 2.230 353 HG22 THR 45 HG22 THR 45 73.154 3.437 0.707 354 HG23 THR 45 HG23 THR 45 72.206 4.829 1.226 355 H GLU 46 H GLU 46 73.982 8.216 -0.796 356 HA GLU 46 HA GLU 46 75.194 9.492 -2.123 357 HB2 GLU 46 HB2 GLU 46 76.741 9.632 0.398 358 HB3 GLU 46 HB3 GLU 46 77.309 10.565 -1.012 359 HG2 GLU 46 HG2 GLU 46 74.548 10.710 0.117 360 HG3 GLU 46 HG3 GLU 46 75.854 11.712 0.777 361 H HIS 47 H HIS 47 75.538 6.659 -1.895 362 HA HIS 47 HA HIS 47 78.260 6.022 -2.484 363 HB2 HIS 47 HB2 HIS 47 76.628 4.480 -1.324 364 HB3 HIS 47 HB3 HIS 47 75.788 4.304 -2.862 365 HD1 HIS 47 HD1 HIS 47 76.651 2.409 -4.345 366 HD2 HIS 47 HD2 HIS 47 79.331 3.550 -1.403 367 HE1 HIS 47 HE1 HIS 47 78.657 0.891 -4.549 368 HA PRO 48 HA PRO 48 77.806 7.260 -6.770 369 HB2 PRO 48 HB2 PRO 48 80.004 5.411 -7.347 370 HB3 PRO 48 HB3 PRO 48 79.943 7.162 -7.563 371 HG2 PRO 48 HG2 PRO 48 81.398 5.957 -5.730 372 HG3 PRO 48 HG3 PRO 48 80.565 7.480 -5.288 373 HD2 PRO 48 HD2 PRO 48 79.810 4.625 -4.778 374 HD3 PRO 48 HD3 PRO 48 79.787 5.940 -3.615 375 H ASP 49 H ASP 49 77.681 4.031 -5.774 376 HA ASP 49 HA ASP 49 77.047 3.260 -8.431 377 HB2 ASP 49 HB2 ASP 49 78.227 1.409 -6.329 378 HB3 ASP 49 HB3 ASP 49 77.905 0.985 -7.993 379 H GLY 50 H GLY 50 75.503 4.372 -6.324 380 HA2 GLY 50 HA2 GLY 50 74.102 2.910 -4.403 381 HA3 GLY 50 HA3 GLY 50 73.470 4.211 -5.365 382 H THR 51 H THR 51 73.176 3.366 -7.652 383 HA THR 51 HA THR 51 71.031 1.571 -6.990 384 HB THR 51 HB THR 51 71.216 2.510 -9.812 385 HG1 THR 51 HG1 THR 51 70.123 4.518 -8.628 386 HG21 THR 51 HG21 THR 51 68.982 2.492 -7.748 387 HG22 THR 51 HG22 THR 51 69.398 1.120 -8.727 388 HG23 THR 51 HG23 THR 51 68.846 2.610 -9.506 389 H ALA 52 H ALA 52 74.020 1.443 -8.610 390 HA ALA 52 HA ALA 52 73.725 -1.029 -10.009 391 HB1 ALA 52 HB1 ALA 52 76.203 0.103 -8.717 392 HB2 ALA 52 HB2 ALA 52 75.642 0.529 -10.333 393 HB3 ALA 52 HB3 ALA 52 76.147 -1.125 -9.982 394 H LEU 53 H LEU 53 74.484 -0.271 -6.667 395 HA LEU 53 HA LEU 53 74.930 -2.931 -5.871 396 HB2 LEU 53 HB2 LEU 53 73.859 -0.613 -4.294 397 HB3 LEU 53 HB3 LEU 53 74.227 -2.167 -3.588 398 HG LEU 53 HG LEU 53 76.163 -0.204 -4.798 399 HD11 LEU 53 HD11 LEU 53 75.809 -1.305 -2.021 400 HD12 LEU 53 HD12 LEU 53 75.389 0.319 -2.571 401 HD13 LEU 53 HD13 LEU 53 77.075 -0.191 -2.538 402 HD21 LEU 53 HD21 LEU 53 77.917 -1.795 -4.160 403 HD22 LEU 53 HD22 LEU 53 76.865 -2.455 -5.406 404 HD23 LEU 53 HD23 LEU 53 76.685 -2.983 -3.730 405 H ILE 54 H ILE 54 72.038 -1.061 -6.209 406 HA ILE 54 HA ILE 54 70.284 -2.958 -4.987 407 HB ILE 54 HB ILE 54 69.834 -0.644 -6.862 408 HG12 ILE 54 HG12 ILE 54 68.731 -1.060 -4.116 409 HG13 ILE 54 HG13 ILE 54 70.332 -0.390 -4.300 410 HG21 ILE 54 HG21 ILE 54 67.405 -0.942 -6.613 411 HG22 ILE 54 HG22 ILE 54 67.685 -2.470 -5.777 412 HG23 ILE 54 HG23 ILE 54 68.149 -2.295 -7.467 413 HD11 ILE 54 HD11 ILE 54 69.368 1.461 -5.583 414 HD12 ILE 54 HD12 ILE 54 68.631 1.324 -3.984 415 HD13 ILE 54 HD13 ILE 54 67.777 0.737 -5.415 416 H TYR 55 H TYR 55 71.159 -2.230 -8.276 417 HA TYR 55 HA TYR 55 69.577 -4.155 -9.489 418 HB2 TYR 55 HB2 TYR 55 71.824 -2.449 -10.269 419 HB3 TYR 55 HB3 TYR 55 71.493 -3.816 -11.311 420 HD1 TYR 55 HD1 TYR 55 69.223 -3.982 -12.373 421 HD2 TYR 55 HD2 TYR 55 70.414 -0.527 -10.214 422 HE1 TYR 55 HE1 TYR 55 67.390 -2.721 -13.404 423 HE2 TYR 55 HE2 TYR 55 68.602 0.754 -11.230 424 HH TYR 55 HH TYR 55 66.092 -0.819 -13.072 425 H GLU 56 H GLU 56 72.987 -4.356 -8.445 426 HA GLU 56 HA GLU 56 73.105 -7.027 -9.389 427 HB2 GLU 56 HB2 GLU 56 75.259 -7.244 -8.136 428 HB3 GLU 56 HB3 GLU 56 75.210 -5.881 -9.236 429 HG2 GLU 56 HG2 GLU 56 75.169 -4.349 -7.579 430 HG3 GLU 56 HG3 GLU 56 74.608 -5.434 -6.335 431 H ALA 57 H ALA 57 72.327 -5.602 -6.267 432 HA ALA 57 HA ALA 57 72.311 -7.969 -4.773 433 HB1 ALA 57 HB1 ALA 57 70.905 -6.816 -3.181 434 HB2 ALA 57 HB2 ALA 57 70.526 -5.578 -4.377 435 HB3 ALA 57 HB3 ALA 57 72.171 -5.737 -3.764 436 H ALA 58 H ALA 58 69.774 -6.467 -6.715 437 HA ALA 58 HA ALA 58 67.673 -8.140 -6.018 438 HB1 ALA 58 HB1 ALA 58 67.407 -6.107 -7.376 439 HB2 ALA 58 HB2 ALA 58 66.644 -7.503 -8.138 440 HB3 ALA 58 HB3 ALA 58 68.200 -6.916 -8.728 441 H ALA 59 H ALA 59 70.080 -8.549 -8.564 442 HA ALA 59 HA ALA 59 69.082 -11.086 -9.370 443 HB1 ALA 59 HB1 ALA 59 70.362 -9.659 -10.891 444 HB2 ALA 59 HB2 ALA 59 71.108 -11.248 -10.728 445 HB3 ALA 59 HB3 ALA 59 71.790 -9.860 -9.879 446 H ARG 60 H ARG 60 71.762 -10.055 -7.295 447 HA ARG 60 HA ARG 60 72.808 -12.650 -6.862 448 HB2 ARG 60 HB2 ARG 60 73.197 -10.125 -5.270 449 HB3 ARG 60 HB3 ARG 60 74.071 -11.624 -4.989 450 HG2 ARG 60 HG2 ARG 60 75.062 -11.504 -7.188 451 HG3 ARG 60 HG3 ARG 60 74.118 -10.055 -7.549 452 HD2 ARG 60 HD2 ARG 60 76.404 -9.482 -6.912 453 HD3 ARG 60 HD3 ARG 60 75.237 -8.863 -5.747 454 HE ARG 60 HE ARG 60 76.156 -11.402 -4.954 455 HH11 ARG 60 HH11 ARG 60 77.227 -7.990 -5.084 456 HH12 ARG 60 HH12 ARG 60 78.306 -8.169 -3.796 457 HH21 ARG 60 HH21 ARG 60 77.633 -11.605 -3.179 458 HH22 ARG 60 HH22 ARG 60 78.579 -10.273 -2.697 459 H ALA 61 H ALA 61 70.360 -10.837 -5.146 460 HA ALA 61 HA ALA 61 70.339 -12.720 -2.983 461 HB1 ALA 61 HB1 ALA 61 68.289 -10.619 -3.675 462 HB2 ALA 61 HB2 ALA 61 69.739 -10.393 -2.687 463 HB3 ALA 61 HB3 ALA 61 68.466 -11.479 -2.130 464 H ALA 62 H ALA 62 68.877 -12.501 -6.049 465 HA ALA 62 HA ALA 62 66.673 -14.247 -5.571 466 HB1 ALA 62 HB1 ALA 62 68.075 -13.549 -8.143 467 HB2 ALA 62 HB2 ALA 62 66.704 -12.684 -7.447 468 HB3 ALA 62 HB3 ALA 62 66.510 -14.347 -8.008 469 H ALA 63 H ALA 63 69.967 -14.611 -6.616 470 HA ALA 63 HA ALA 63 69.835 -17.423 -5.927 471 HB1 ALA 63 HB1 ALA 63 71.254 -18.019 -7.858 472 HB2 ALA 63 HB2 ALA 63 71.143 -16.363 -8.450 473 HB3 ALA 63 HB3 ALA 63 69.701 -17.378 -8.387 474 H ASN 64 H ASN 64 70.786 -16.817 -4.050 475 HA ASN 64 HA ASN 64 73.208 -15.248 -4.072 476 HB2 ASN 64 HB2 ASN 64 71.555 -14.725 -2.372 477 HB3 ASN 64 HB3 ASN 64 71.595 -16.382 -1.790 478 HD21 ASN 64 HD21 ASN 64 72.127 -15.714 0.259 479 HD22 ASN 64 HD22 ASN 64 73.699 -15.159 0.694 480 HA PRO 65 HA PRO 65 75.512 -19.065 -4.195 481 HB2 PRO 65 HB2 PRO 65 77.862 -17.987 -4.861 482 HB3 PRO 65 HB3 PRO 65 76.520 -18.065 -6.011 483 HG2 PRO 65 HG2 PRO 65 77.437 -15.752 -4.344 484 HG3 PRO 65 HG3 PRO 65 76.977 -15.773 -6.053 485 HD2 PRO 65 HD2 PRO 65 75.312 -14.985 -4.048 486 HD3 PRO 65 HD3 PRO 65 74.744 -15.678 -5.577 487 H GLY 66 H GLY 66 75.647 -16.641 -1.884 488 HA2 GLY 66 HA2 GLY 66 76.937 -18.263 0.012 489 HA3 GLY 66 HA3 GLY 66 78.072 -17.054 -0.584 490 H GLY 67 H GLY 67 77.499 -14.800 -0.354 491 HA2 GLY 67 HA2 GLY 67 75.297 -13.770 0.841 492 HA3 GLY 67 HA3 GLY 67 76.278 -14.357 2.177 493 H ASP 68 H ASP 68 76.131 -12.037 2.658 494 HA ASP 68 HA ASP 68 77.112 -10.042 3.013 495 HB2 ASP 68 HB2 ASP 68 79.487 -11.369 1.686 496 HB3 ASP 68 HB3 ASP 68 79.557 -9.770 2.407 497 H GLY 69 H GLY 69 75.594 -10.520 0.636 498 HA2 GLY 69 HA2 GLY 69 75.747 -8.086 -0.670 499 HA3 GLY 69 HA3 GLY 69 76.752 -9.191 -1.607 500 H GLY 70 H GLY 70 75.075 -11.499 -0.913 501 HA2 GLY 70 HA2 GLY 70 73.106 -11.141 -2.988 502 HA3 GLY 70 HA3 GLY 70 73.550 -12.654 -2.200 503 H GLY 71 H GLY 71 72.199 -9.536 -1.297 504 HA2 GLY 71 HA2 GLY 71 69.711 -10.184 -0.657 505 HA3 GLY 71 HA3 GLY 71 70.622 -10.729 0.742 506 HA PRO 72 HA PRO 72 69.649 -6.180 0.680 507 HB2 PRO 72 HB2 PRO 72 68.091 -6.083 2.868 508 HB3 PRO 72 HB3 PRO 72 67.528 -6.223 1.209 509 HG2 PRO 72 HG2 PRO 72 67.749 -8.394 3.260 510 HG3 PRO 72 HG3 PRO 72 66.584 -8.200 1.955 511 HD2 PRO 72 HD2 PRO 72 68.686 -9.907 1.837 512 HD3 PRO 72 HD3 PRO 72 67.891 -9.213 0.415 513 H GLU 73 H GLU 73 70.560 -8.431 3.083 514 HA GLU 73 HA GLU 73 71.704 -6.423 4.863 515 HB2 GLU 73 HB2 GLU 73 71.841 -9.444 5.022 516 HB3 GLU 73 HB3 GLU 73 72.239 -8.299 6.292 517 HG2 GLU 73 HG2 GLU 73 69.926 -7.570 6.399 518 HG3 GLU 73 HG3 GLU 73 69.509 -8.674 5.100 519 H GLY 74 H GLY 74 72.617 -7.639 1.998 520 HA2 GLY 74 HA2 GLY 74 75.305 -7.416 2.956 521 HA3 GLY 74 HA3 GLY 74 74.963 -8.324 1.435 522 H ILE 75 H ILE 75 73.199 -5.866 0.624 523 HA ILE 75 HA ILE 75 75.358 -4.314 -0.328 524 HB ILE 75 HB ILE 75 73.647 -2.594 -0.945 525 HG12 ILE 75 HG12 ILE 75 71.932 -3.579 0.800 526 HG13 ILE 75 HG13 ILE 75 71.338 -2.905 -0.694 527 HG21 ILE 75 HG21 ILE 75 73.348 -5.339 -2.058 528 HG22 ILE 75 HG22 ILE 75 74.491 -4.084 -2.565 529 HG23 ILE 75 HG23 ILE 75 72.750 -3.854 -2.799 530 HD11 ILE 75 HD11 ILE 75 70.159 -4.757 -0.308 531 HD12 ILE 75 HD12 ILE 75 71.552 -5.699 0.201 532 HD13 ILE 75 HD13 ILE 75 71.326 -5.304 -1.521 533 H VAL 76 H VAL 76 73.346 -4.179 2.511 534 HA VAL 76 HA VAL 76 73.907 -1.615 3.238 535 HB VAL 76 HB VAL 76 73.348 -2.445 5.436 536 HG11 VAL 76 HG11 VAL 76 71.623 -1.839 3.662 537 HG12 VAL 76 HG12 VAL 76 71.030 -2.841 4.981 538 HG13 VAL 76 HG13 VAL 76 71.422 -3.572 3.424 539 HG21 VAL 76 HG21 VAL 76 74.247 -4.600 5.441 540 HG22 VAL 76 HG22 VAL 76 73.120 -5.103 4.177 541 HG23 VAL 76 HG23 VAL 76 72.521 -4.675 5.790 542 H LYS 77 H LYS 77 75.542 -4.609 3.739 543 HA LYS 77 HA LYS 77 77.696 -3.790 5.324 544 HB2 LYS 77 HB2 LYS 77 77.352 -6.134 4.942 545 HB3 LYS 77 HB3 LYS 77 77.436 -5.920 3.204 546 HG2 LYS 77 HG2 LYS 77 79.841 -5.315 3.461 547 HG3 LYS 77 HG3 LYS 77 79.709 -5.739 5.170 548 HD2 LYS 77 HD2 LYS 77 79.113 -7.997 4.619 549 HD3 LYS 77 HD3 LYS 77 79.026 -7.600 2.907 550 HE2 LYS 77 HE2 LYS 77 81.524 -7.468 4.596 551 HE3 LYS 77 HE3 LYS 77 81.112 -8.788 3.508 552 HZ1 LYS 77 HZ1 LYS 77 81.135 -7.091 1.665 553 HZ2 LYS 77 HZ2 LYS 77 82.613 -7.348 2.413 554 HZ3 LYS 77 HZ3 LYS 77 81.746 -5.972 2.791 555 H GLU 78 H GLU 78 77.328 -3.939 1.807 556 HA GLU 78 HA GLU 78 79.880 -2.991 1.142 557 HB2 GLU 78 HB2 GLU 78 78.109 -4.139 -0.348 558 HB3 GLU 78 HB3 GLU 78 77.424 -2.555 -0.640 559 HG2 GLU 78 HG2 GLU 78 78.905 -3.144 -2.409 560 HG3 GLU 78 HG3 GLU 78 79.606 -1.812 -1.485 561 H ILE 79 H ILE 79 76.860 -1.347 1.784 562 HA ILE 79 HA ILE 79 77.697 1.291 1.194 563 HB ILE 79 HB ILE 79 75.453 0.267 2.973 564 HG12 ILE 79 HG12 ILE 79 75.150 -0.181 0.582 565 HG13 ILE 79 HG13 ILE 79 73.986 1.005 1.160 566 HG21 ILE 79 HG21 ILE 79 75.973 3.116 2.205 567 HG22 ILE 79 HG22 ILE 79 76.117 2.411 3.815 568 HG23 ILE 79 HG23 ILE 79 74.540 2.495 3.030 569 HD11 ILE 79 HD11 ILE 79 74.790 1.654 -0.991 570 HD12 ILE 79 HD12 ILE 79 76.461 1.533 -0.459 571 HD13 ILE 79 HD13 ILE 79 75.410 2.787 0.210 572 H LYS 80 H LYS 80 77.617 -0.550 4.249 573 HA LYS 80 HA LYS 80 78.333 1.677 5.824 574 HB2 LYS 80 HB2 LYS 80 78.492 0.201 7.699 575 HB3 LYS 80 HB3 LYS 80 77.252 -0.471 6.656 576 HG2 LYS 80 HG2 LYS 80 78.858 -2.115 5.815 577 HG3 LYS 80 HG3 LYS 80 80.069 -1.455 6.908 578 HD2 LYS 80 HD2 LYS 80 78.600 -1.984 8.822 579 HD3 LYS 80 HD3 LYS 80 77.452 -2.718 7.708 580 HE2 LYS 80 HE2 LYS 80 78.811 -4.444 8.716 581 HE3 LYS 80 HE3 LYS 80 79.194 -4.317 7.001 582 HZ1 LYS 80 HZ1 LYS 80 80.817 -3.249 9.263 583 HZ2 LYS 80 HZ2 LYS 80 81.186 -2.952 7.673 584 HZ3 LYS 80 HZ3 LYS 80 81.217 -4.528 8.254 585 H GLU 81 H GLU 81 80.217 -0.777 4.226 586 HA GLU 81 HA GLU 81 82.660 -0.043 5.442 587 HB2 GLU 81 HB2 GLU 81 82.157 -1.552 2.881 588 HB3 GLU 81 HB3 GLU 81 83.715 -1.409 3.688 589 HG2 GLU 81 HG2 GLU 81 82.764 -2.516 5.667 590 HG3 GLU 81 HG3 GLU 81 81.242 -2.712 4.804 591 H TRP 82 H TRP 82 81.052 0.930 2.470 592 HA TRP 82 HA TRP 82 83.196 2.414 1.334 593 HB2 TRP 82 HB2 TRP 82 80.978 1.736 0.212 594 HB3 TRP 82 HB3 TRP 82 80.315 3.083 1.173 595 HD1 TRP 82 HD1 TRP 82 82.899 2.533 -1.649 596 HE1 TRP 82 HE1 TRP 82 83.026 4.700 -3.032 597 HE3 TRP 82 HE3 TRP 82 79.807 5.505 1.149 598 HZ2 TRP 82 HZ2 TRP 82 81.962 7.259 -2.995 599 HZ3 TRP 82 HZ3 TRP 82 79.424 7.815 0.409 600 HH2 TRP 82 HH2 TRP 82 80.485 8.688 -1.616 601 H ARG 83 H ARG 83 80.437 3.200 3.296 602 HA ARG 83 HA ARG 83 80.671 5.978 3.437 603 HB2 ARG 83 HB2 ARG 83 78.769 4.276 4.174 604 HB3 ARG 83 HB3 ARG 83 79.757 4.295 5.643 605 HG2 ARG 83 HG2 ARG 83 78.049 5.796 6.090 606 HG3 ARG 83 HG3 ARG 83 79.543 6.662 5.703 607 HD2 ARG 83 HD2 ARG 83 78.728 7.299 3.545 608 HD3 ARG 83 HD3 ARG 83 77.292 6.280 3.730 609 HE ARG 83 HE ARG 83 77.245 7.953 5.890 610 HH11 ARG 83 HH11 ARG 83 76.994 8.497 2.364 611 HH12 ARG 83 HH12 ARG 83 76.245 10.010 2.581 612 HH21 ARG 83 HH21 ARG 83 76.155 10.012 6.078 613 HH22 ARG 83 HH22 ARG 83 75.768 10.866 4.670 614 H ALA 84 H ALA 84 81.787 3.368 5.621 615 HA ALA 84 HA ALA 84 82.967 5.070 7.532 616 HB1 ALA 84 HB1 ALA 84 82.232 2.775 8.028 617 HB2 ALA 84 HB2 ALA 84 83.910 3.054 8.487 618 HB3 ALA 84 HB3 ALA 84 83.538 2.154 7.017 619 H ALA 85 H ALA 85 84.338 3.229 4.817 620 HA ALA 85 HA ALA 85 87.019 3.903 5.353 621 HB1 ALA 85 HB1 ALA 85 86.407 2.026 3.905 622 HB2 ALA 85 HB2 ALA 85 87.484 3.149 3.068 623 HB3 ALA 85 HB3 ALA 85 85.757 3.154 2.717 624 H ASN 86 H ASN 86 84.491 5.507 3.544 625 HA ASN 86 HA ASN 86 86.196 7.509 2.409 626 HB2 ASN 86 HB2 ASN 86 83.672 6.883 1.771 627 HB3 ASN 86 HB3 ASN 86 83.307 8.048 3.027 628 HD21 ASN 86 HD21 ASN 86 83.866 10.306 2.689 629 HD22 ASN 86 HD22 ASN 86 84.203 10.844 1.094 630 H GLY 87 H GLY 87 84.163 7.242 5.259 631 HA2 GLY 87 HA2 GLY 87 84.986 8.172 7.338 632 HA3 GLY 87 HA3 GLY 87 85.552 9.564 6.415 633 H LYS 88 H LYS 88 82.349 7.951 6.037 634 HA LYS 88 HA LYS 88 81.160 10.435 6.810 635 HB2 LYS 88 HB2 LYS 88 80.631 8.282 4.820 636 HB3 LYS 88 HB3 LYS 88 79.412 9.428 5.304 637 HG2 LYS 88 HG2 LYS 88 80.745 11.247 4.368 638 HG3 LYS 88 HG3 LYS 88 82.070 10.124 4.044 639 HD2 LYS 88 HD2 LYS 88 80.716 8.913 2.467 640 HD3 LYS 88 HD3 LYS 88 79.315 9.910 2.821 641 HE2 LYS 88 HE2 LYS 88 81.914 10.863 1.613 642 HE3 LYS 88 HE3 LYS 88 80.431 10.548 0.716 643 HZ1 LYS 88 HZ1 LYS 88 79.364 12.337 2.007 644 HZ2 LYS 88 HZ2 LYS 88 80.659 12.874 1.112 645 HZ3 LYS 88 HZ3 LYS 88 80.828 12.684 2.771 646 HA PRO 89 HA PRO 89 79.303 7.833 10.001 647 HB2 PRO 89 HB2 PRO 89 76.948 9.285 10.268 648 HB3 PRO 89 HB3 PRO 89 78.456 9.649 11.112 649 HG2 PRO 89 HG2 PRO 89 77.310 10.889 8.657 650 HG3 PRO 89 HG3 PRO 89 78.212 11.645 9.982 651 HD2 PRO 89 HD2 PRO 89 79.315 11.113 7.588 652 HD3 PRO 89 HD3 PRO 89 80.250 11.039 9.096 653 H GLY 90 H GLY 90 77.988 6.112 9.939 654 HA2 GLY 90 HA2 GLY 90 76.541 5.721 7.421 655 HA3 GLY 90 HA3 GLY 90 77.214 4.435 8.414 656 H PHE 91 H PHE 91 75.799 3.322 9.489 657 HA PHE 91 HA PHE 91 73.029 4.198 9.578 658 HB2 PHE 91 HB2 PHE 91 74.155 1.582 10.597 659 HB3 PHE 91 HB3 PHE 91 72.497 1.952 10.175 660 HD1 PHE 91 HD1 PHE 91 72.618 3.079 7.557 661 HD2 PHE 91 HD2 PHE 91 74.962 -0.046 9.233 662 HE1 PHE 91 HE1 PHE 91 72.999 2.156 5.318 663 HE2 PHE 91 HE2 PHE 91 75.336 -0.974 7.000 664 HZ PHE 91 HZ PHE 91 74.364 0.132 5.035 665 H LYS 92 H LYS 92 71.810 3.816 11.652 666 HA LYS 92 HA LYS 92 73.512 4.388 13.876 667 HB2 LYS 92 HB2 LYS 92 71.587 5.134 14.947 668 HB3 LYS 92 HB3 LYS 92 71.707 5.975 13.434 669 HG2 LYS 92 HG2 LYS 92 69.847 4.768 12.550 670 HG3 LYS 92 HG3 LYS 92 69.957 3.566 13.845 671 HD2 LYS 92 HD2 LYS 92 69.257 6.472 14.297 672 HD3 LYS 92 HD3 LYS 92 68.059 5.186 14.114 673 HE2 LYS 92 HE2 LYS 92 69.014 4.021 16.062 674 HE3 LYS 92 HE3 LYS 92 70.207 5.292 16.254 675 HZ1 LYS 92 HZ1 LYS 92 68.417 5.562 17.773 676 HZ2 LYS 92 HZ2 LYS 92 67.278 5.596 16.534 677 HZ3 LYS 92 HZ3 LYS 92 68.410 6.846 16.685 678 H GLN 93 H GLN 93 72.837 3.307 15.809 679 HA GLN 93 HA GLN 93 71.975 0.588 15.275 680 HB2 GLN 93 HB2 GLN 93 73.807 1.921 17.011 681 HB3 GLN 93 HB3 GLN 93 73.012 0.536 17.761 682 HG2 GLN 93 HG2 GLN 93 75.125 -0.224 16.851 683 HG3 GLN 93 HG3 GLN 93 73.835 -0.869 15.858 684 HE21 GLN 93 HE21 GLN 93 75.143 2.449 15.633 685 HE22 GLN 93 HE22 GLN 93 75.819 2.222 14.074 686 H GLY 94 H GLY 94 70.329 -0.134 16.230 687 HA2 GLY 94 HA2 GLY 94 69.088 0.419 18.565 688 HA3 GLY 94 HA3 GLY 94 68.432 1.609 17.432 Start of MODEL 27 1 H GLU 2 H GLU 2 60.723 1.087 7.834 2 HA GLU 2 HA GLU 2 59.828 2.767 6.323 3 HB2 GLU 2 HB2 GLU 2 60.616 3.925 9.011 4 HB3 GLU 2 HB3 GLU 2 59.300 4.486 7.989 5 HG2 GLU 2 HG2 GLU 2 59.488 1.824 9.367 6 HG3 GLU 2 HG3 GLU 2 58.442 3.171 9.817 7 H LEU 3 H LEU 3 59.986 5.314 6.197 8 HA LEU 3 HA LEU 3 62.600 5.707 5.041 9 HB2 LEU 3 HB2 LEU 3 59.945 6.927 4.552 10 HB3 LEU 3 HB3 LEU 3 61.405 7.733 4.006 11 HG LEU 3 HG LEU 3 60.622 4.935 3.225 12 HD11 LEU 3 HD11 LEU 3 60.106 5.961 1.037 13 HD12 LEU 3 HD12 LEU 3 60.415 7.565 1.722 14 HD13 LEU 3 HD13 LEU 3 59.051 6.606 2.299 15 HD21 LEU 3 HD21 LEU 3 62.384 5.266 1.543 16 HD22 LEU 3 HD22 LEU 3 62.991 5.363 3.200 17 HD23 LEU 3 HD23 LEU 3 62.748 6.835 2.271 18 H LYS 4 H LYS 4 63.974 7.055 5.746 19 HA LYS 4 HA LYS 4 63.220 8.901 7.863 20 HB2 LYS 4 HB2 LYS 4 65.969 8.115 6.860 21 HB3 LYS 4 HB3 LYS 4 65.596 9.025 8.326 22 HG2 LYS 4 HG2 LYS 4 65.362 6.121 7.710 23 HG3 LYS 4 HG3 LYS 4 66.158 6.877 9.075 24 HD2 LYS 4 HD2 LYS 4 63.722 7.669 9.584 25 HD3 LYS 4 HD3 LYS 4 63.336 6.313 8.538 26 HE2 LYS 4 HE2 LYS 4 64.877 4.897 9.955 27 HE3 LYS 4 HE3 LYS 4 64.962 6.235 11.062 28 HZ1 LYS 4 HZ1 LYS 4 62.472 6.103 11.243 29 HZ2 LYS 4 HZ2 LYS 4 63.392 4.898 11.951 30 HZ3 LYS 4 HZ3 LYS 4 62.612 4.558 10.482 31 H ASN 5 H ASN 5 65.336 10.727 7.309 32 HA ASN 5 HA ASN 5 64.785 11.414 4.534 33 HB2 ASN 5 HB2 ASN 5 65.252 13.357 6.803 34 HB3 ASN 5 HB3 ASN 5 65.171 13.815 5.102 35 HD21 ASN 5 HD21 ASN 5 63.170 13.465 3.998 36 HD22 ASN 5 HD22 ASN 5 61.681 13.451 4.860 37 H SER 6 H SER 6 67.127 10.706 6.882 38 HA SER 6 HA SER 6 69.155 11.022 4.851 39 HB2 SER 6 HB2 SER 6 70.715 11.896 6.523 40 HB3 SER 6 HB3 SER 6 69.389 13.012 6.199 41 HG SER 6 HG SER 6 69.525 12.942 8.392 42 H ILE 7 H ILE 7 71.155 9.840 5.502 43 HA ILE 7 HA ILE 7 70.662 7.121 6.092 44 HB ILE 7 HB ILE 7 72.536 8.008 4.663 45 HG12 ILE 7 HG12 ILE 7 74.334 6.471 5.532 46 HG13 ILE 7 HG13 ILE 7 73.303 6.167 6.927 47 HG21 ILE 7 HG21 ILE 7 73.817 8.779 7.258 48 HG22 ILE 7 HG22 ILE 7 73.256 9.875 5.994 49 HG23 ILE 7 HG23 ILE 7 74.604 8.774 5.681 50 HD11 ILE 7 HD11 ILE 7 71.594 5.255 5.438 51 HD12 ILE 7 HD12 ILE 7 73.146 4.423 5.264 52 HD13 ILE 7 HD13 ILE 7 72.645 5.602 4.059 53 H SER 8 H SER 8 71.294 9.822 8.082 54 HA SER 8 HA SER 8 72.679 8.538 10.180 55 HB2 SER 8 HB2 SER 8 71.322 11.219 10.020 56 HB3 SER 8 HB3 SER 8 72.452 10.703 11.281 57 HG SER 8 HG SER 8 74.023 10.483 9.777 58 H ASP 9 H ASP 9 69.364 8.724 9.369 59 HA ASP 9 HA ASP 9 68.592 8.224 12.170 60 HB2 ASP 9 HB2 ASP 9 67.359 9.966 10.582 61 HB3 ASP 9 HB3 ASP 9 66.697 8.538 9.887 62 H TYR 10 H TYR 10 69.728 6.541 9.766 63 HA TYR 10 HA TYR 10 67.672 4.471 9.656 64 HB2 TYR 10 HB2 TYR 10 69.865 5.260 7.820 65 HB3 TYR 10 HB3 TYR 10 69.491 3.548 7.926 66 HD1 TYR 10 HD1 TYR 10 67.123 2.832 7.499 67 HD2 TYR 10 HD2 TYR 10 68.548 6.695 6.470 68 HE1 TYR 10 HE1 TYR 10 65.257 3.084 5.936 69 HE2 TYR 10 HE2 TYR 10 66.672 6.963 4.891 70 HH TYR 10 HH TYR 10 64.050 4.676 4.885 71 H THR 11 H THR 11 67.884 2.887 11.088 72 HA THR 11 HA THR 11 70.474 2.097 12.034 73 HB THR 11 HB THR 11 69.149 0.144 12.947 74 HG1 THR 11 HG1 THR 11 66.732 0.821 12.891 75 HG21 THR 11 HG21 THR 11 67.919 1.429 14.651 76 HG22 THR 11 HG22 THR 11 68.117 2.890 13.682 77 HG23 THR 11 HG23 THR 11 69.528 2.078 14.367 78 H GLU 12 H GLU 12 71.147 -0.218 11.529 79 HA GLU 12 HA GLU 12 71.158 -0.552 8.770 80 HB2 GLU 12 HB2 GLU 12 72.018 -2.898 9.281 81 HB3 GLU 12 HB3 GLU 12 72.970 -1.531 9.837 82 HG2 GLU 12 HG2 GLU 12 72.207 -1.805 12.041 83 HG3 GLU 12 HG3 GLU 12 71.051 -3.048 11.610 84 H ALA 13 H ALA 13 69.068 -2.020 11.185 85 HA ALA 13 HA ALA 13 67.779 -3.713 9.297 86 HB1 ALA 13 HB1 ALA 13 66.162 -4.182 11.031 87 HB2 ALA 13 HB2 ALA 13 66.734 -2.801 11.979 88 HB3 ALA 13 HB3 ALA 13 67.794 -4.190 11.698 89 H GLU 14 H GLU 14 66.979 -0.415 10.488 90 HA GLU 14 HA GLU 14 64.523 -0.144 9.133 91 HB2 GLU 14 HB2 GLU 14 66.568 1.712 10.172 92 HB3 GLU 14 HB3 GLU 14 65.547 2.388 8.918 93 HG2 GLU 14 HG2 GLU 14 64.562 1.094 11.448 94 HG3 GLU 14 HG3 GLU 14 64.735 2.834 11.189 95 H PHE 15 H PHE 15 67.785 0.202 8.110 96 HA PHE 15 HA PHE 15 67.200 1.206 5.541 97 HB2 PHE 15 HB2 PHE 15 69.319 1.472 6.909 98 HB3 PHE 15 HB3 PHE 15 69.698 -0.184 6.479 99 HD1 PHE 15 HD1 PHE 15 69.150 3.200 5.133 100 HD2 PHE 15 HD2 PHE 15 70.653 -0.683 4.457 101 HE1 PHE 15 HE1 PHE 15 70.306 4.019 3.117 102 HE2 PHE 15 HE2 PHE 15 71.818 0.107 2.427 103 HZ PHE 15 HZ PHE 15 71.638 2.475 1.768 104 H VAL 16 H VAL 16 68.067 -2.052 6.815 105 HA VAL 16 HA VAL 16 67.938 -3.298 4.301 106 HB VAL 16 HB VAL 16 67.954 -5.420 5.303 107 HG11 VAL 16 HG11 VAL 16 69.560 -3.626 6.987 108 HG12 VAL 16 HG12 VAL 16 70.015 -4.562 5.550 109 HG13 VAL 16 HG13 VAL 16 69.646 -5.383 7.064 110 HG21 VAL 16 HG21 VAL 16 66.164 -5.479 6.745 111 HG22 VAL 16 HG22 VAL 16 66.817 -4.217 7.776 112 HG23 VAL 16 HG23 VAL 16 67.582 -5.834 7.743 113 H GLN 17 H GLN 17 65.377 -2.566 6.644 114 HA GLN 17 HA GLN 17 63.333 -4.051 5.538 115 HB2 GLN 17 HB2 GLN 17 63.150 -2.864 7.679 116 HB3 GLN 17 HB3 GLN 17 63.230 -1.319 6.828 117 HG2 GLN 17 HG2 GLN 17 61.320 -2.152 5.479 118 HG3 GLN 17 HG3 GLN 17 61.137 -3.403 6.717 119 HE21 GLN 17 HE21 GLN 17 59.407 -1.221 5.847 120 HE22 GLN 17 HE22 GLN 17 58.991 -0.283 7.223 121 H LEU 18 H LEU 18 64.413 -0.734 4.921 122 HA LEU 18 HA LEU 18 62.507 -0.083 2.971 123 HB2 LEU 18 HB2 LEU 18 63.895 1.563 4.064 124 HB3 LEU 18 HB3 LEU 18 65.334 0.973 3.323 125 HG LEU 18 HG LEU 18 64.256 1.493 1.073 126 HD11 LEU 18 HD11 LEU 18 62.510 3.171 1.070 127 HD12 LEU 18 HD12 LEU 18 62.327 2.963 2.810 128 HD13 LEU 18 HD13 LEU 18 61.987 1.618 1.717 129 HD21 LEU 18 HD21 LEU 18 64.843 3.777 2.948 130 HD22 LEU 18 HD22 LEU 18 64.830 3.865 1.186 131 HD23 LEU 18 HD23 LEU 18 66.031 2.871 2.011 132 H LEU 19 H LEU 19 65.733 -1.310 2.734 133 HA LEU 19 HA LEU 19 65.877 -1.576 -0.056 134 HB2 LEU 19 HB2 LEU 19 67.322 -2.653 2.240 135 HB3 LEU 19 HB3 LEU 19 67.542 -3.552 0.748 136 HG LEU 19 HG LEU 19 69.348 -1.940 1.058 137 HD11 LEU 19 HD11 LEU 19 68.625 -2.350 -1.209 138 HD12 LEU 19 HD12 LEU 19 69.186 -0.690 -1.013 139 HD13 LEU 19 HD13 LEU 19 67.461 -1.034 -1.110 140 HD21 LEU 19 HD21 LEU 19 68.190 -0.311 2.465 141 HD22 LEU 19 HD22 LEU 19 67.222 0.186 1.065 142 HD23 LEU 19 HD23 LEU 19 68.970 0.430 1.065 143 H LYS 20 H LYS 20 64.563 -3.835 2.301 144 HA LYS 20 HA LYS 20 64.082 -5.928 0.469 145 HB2 LYS 20 HB2 LYS 20 62.628 -5.176 3.002 146 HB3 LYS 20 HB3 LYS 20 62.252 -6.617 2.080 147 HG2 LYS 20 HG2 LYS 20 64.617 -7.307 2.371 148 HG3 LYS 20 HG3 LYS 20 64.808 -5.966 3.499 149 HD2 LYS 20 HD2 LYS 20 63.087 -6.885 4.921 150 HD3 LYS 20 HD3 LYS 20 62.773 -8.177 3.759 151 HE2 LYS 20 HE2 LYS 20 65.188 -8.837 4.044 152 HE3 LYS 20 HE3 LYS 20 65.253 -7.710 5.395 153 HZ1 LYS 20 HZ1 LYS 20 63.428 -10.019 5.157 154 HZ2 LYS 20 HZ2 LYS 20 63.539 -8.967 6.508 155 HZ3 LYS 20 HZ3 LYS 20 64.830 -9.962 6.093 156 H GLU 21 H GLU 21 62.271 -3.085 1.328 157 HA GLU 21 HA GLU 21 60.003 -3.767 -0.215 158 HB2 GLU 21 HB2 GLU 21 60.922 -1.163 0.967 159 HB3 GLU 21 HB3 GLU 21 59.367 -1.373 0.173 160 HG2 GLU 21 HG2 GLU 21 58.753 -3.070 1.813 161 HG3 GLU 21 HG3 GLU 21 60.317 -2.873 2.599 162 H ILE 22 H ILE 22 62.903 -1.921 -0.776 163 HA ILE 22 HA ILE 22 62.157 -0.919 -3.325 164 HB ILE 22 HB ILE 22 65.023 -1.513 -2.526 165 HG12 ILE 22 HG12 ILE 22 63.335 0.923 -1.844 166 HG13 ILE 22 HG13 ILE 22 64.017 -0.224 -0.725 167 HG21 ILE 22 HG21 ILE 22 64.755 -0.922 -4.838 168 HG22 ILE 22 HG22 ILE 22 65.389 0.512 -3.993 169 HG23 ILE 22 HG23 ILE 22 63.693 0.416 -4.417 170 HD11 ILE 22 HD11 ILE 22 65.651 1.595 -2.477 171 HD12 ILE 22 HD12 ILE 22 66.265 0.506 -1.232 172 HD13 ILE 22 HD13 ILE 22 65.266 1.886 -0.786 173 H GLU 23 H GLU 23 63.864 -3.833 -2.265 174 HA GLU 23 HA GLU 23 64.555 -4.998 -4.655 175 HB2 GLU 23 HB2 GLU 23 65.452 -5.999 -2.829 176 HB3 GLU 23 HB3 GLU 23 64.063 -5.653 -1.830 177 HG2 GLU 23 HG2 GLU 23 64.140 -7.874 -1.845 178 HG3 GLU 23 HG3 GLU 23 62.939 -7.548 -3.065 179 H LYS 24 H LYS 24 61.594 -5.088 -2.788 180 HA LYS 24 HA LYS 24 60.251 -7.013 -4.326 181 HB2 LYS 24 HB2 LYS 24 59.770 -6.216 -1.960 182 HB3 LYS 24 HB3 LYS 24 58.944 -4.857 -2.713 183 HG2 LYS 24 HG2 LYS 24 57.423 -6.415 -3.846 184 HG3 LYS 24 HG3 LYS 24 58.278 -7.753 -3.071 185 HD2 LYS 24 HD2 LYS 24 56.780 -5.569 -1.605 186 HD3 LYS 24 HD3 LYS 24 56.180 -7.195 -1.913 187 HE2 LYS 24 HE2 LYS 24 58.000 -8.140 -0.588 188 HE3 LYS 24 HE3 LYS 24 58.646 -6.523 -0.311 189 HZ1 LYS 24 HZ1 LYS 24 56.678 -5.954 0.914 190 HZ2 LYS 24 HZ2 LYS 24 57.341 -7.363 1.555 191 HZ3 LYS 24 HZ3 LYS 24 55.975 -7.448 0.580 192 H GLU 25 H GLU 25 60.023 -3.345 -4.410 193 HA GLU 25 HA GLU 25 58.302 -3.550 -6.638 194 HB2 GLU 25 HB2 GLU 25 59.740 -1.010 -5.725 195 HB3 GLU 25 HB3 GLU 25 58.406 -1.221 -6.797 196 HG2 GLU 25 HG2 GLU 25 58.280 -1.379 -3.795 197 HG3 GLU 25 HG3 GLU 25 57.512 -0.459 -4.985 198 H ASN 26 H ASN 26 61.650 -3.725 -6.255 199 HA ASN 26 HA ASN 26 62.434 -2.730 -8.790 200 HB2 ASN 26 HB2 ASN 26 64.087 -2.942 -7.000 201 HB3 ASN 26 HB3 ASN 26 63.827 -4.678 -6.933 202 HD21 ASN 26 HD21 ASN 26 64.834 -5.994 -8.420 203 HD22 ASN 26 HD22 ASN 26 65.980 -5.420 -9.565 204 H VAL 27 H VAL 27 61.716 -5.987 -7.569 205 HA VAL 27 HA VAL 27 62.150 -7.127 -10.139 206 HB VAL 27 HB VAL 27 61.190 -9.221 -9.276 207 HG11 VAL 27 HG11 VAL 27 63.524 -8.770 -8.877 208 HG12 VAL 27 HG12 VAL 27 62.838 -9.635 -7.502 209 HG13 VAL 27 HG13 VAL 27 63.131 -7.899 -7.396 210 HG21 VAL 27 HG21 VAL 27 59.424 -8.313 -7.844 211 HG22 VAL 27 HG22 VAL 27 60.636 -7.662 -6.743 212 HG23 VAL 27 HG23 VAL 27 60.462 -9.407 -6.932 213 H ALA 28 H ALA 28 59.424 -5.704 -8.608 214 HA ALA 28 HA ALA 28 57.483 -6.650 -10.510 215 HB1 ALA 28 HB1 ALA 28 56.859 -5.877 -8.242 216 HB2 ALA 28 HB2 ALA 28 55.993 -5.016 -9.511 217 HB3 ALA 28 HB3 ALA 28 57.347 -4.244 -8.689 218 H ALA 29 H ALA 29 59.674 -4.029 -10.216 219 HA ALA 29 HA ALA 29 60.313 -2.315 -11.403 220 HB1 ALA 29 HB1 ALA 29 60.671 -3.957 -13.220 221 HB2 ALA 29 HB2 ALA 29 60.253 -2.347 -13.816 222 HB3 ALA 29 HB3 ALA 29 59.037 -3.623 -13.810 223 H THR 30 H THR 30 58.931 -1.119 -10.114 224 HA THR 30 HA THR 30 56.613 -0.022 -11.501 225 HB THR 30 HB THR 30 56.230 1.109 -9.242 226 HG1 THR 30 HG1 THR 30 57.357 -0.064 -7.534 227 HG21 THR 30 HG21 THR 30 56.373 -1.896 -9.256 228 HG22 THR 30 HG22 THR 30 55.013 -0.916 -9.826 229 HG23 THR 30 HG23 THR 30 55.448 -0.922 -8.115 230 H ASP 31 H ASP 31 56.616 2.515 -10.519 231 HA ASP 31 HA ASP 31 59.289 3.559 -10.954 232 HB2 ASP 31 HB2 ASP 31 58.756 5.125 -12.603 233 HB3 ASP 31 HB3 ASP 31 57.951 3.664 -13.149 234 H ASP 32 H ASP 32 56.059 4.058 -9.691 235 HA ASP 32 HA ASP 32 56.654 6.642 -8.775 236 HB2 ASP 32 HB2 ASP 32 54.487 4.787 -7.809 237 HB3 ASP 32 HB3 ASP 32 54.681 6.443 -7.266 238 H VAL 33 H VAL 33 56.621 3.648 -6.947 239 HA VAL 33 HA VAL 33 57.889 5.214 -4.847 240 HB VAL 33 HB VAL 33 56.228 3.184 -4.402 241 HG11 VAL 33 HG11 VAL 33 57.138 1.566 -5.696 242 HG12 VAL 33 HG12 VAL 33 57.146 1.132 -3.981 243 HG13 VAL 33 HG13 VAL 33 58.646 1.622 -4.776 244 HG21 VAL 33 HG21 VAL 33 57.274 2.707 -2.255 245 HG22 VAL 33 HG22 VAL 33 57.271 4.434 -2.603 246 HG23 VAL 33 HG23 VAL 33 58.751 3.497 -2.805 247 H LEU 34 H LEU 34 58.616 3.020 -7.330 248 HA LEU 34 HA LEU 34 61.130 2.011 -6.536 249 HB2 LEU 34 HB2 LEU 34 59.515 1.286 -8.417 250 HB3 LEU 34 HB3 LEU 34 60.161 2.624 -9.270 251 HG LEU 34 HG LEU 34 61.051 0.284 -9.823 252 HD11 LEU 34 HD11 LEU 34 63.182 1.231 -10.484 253 HD12 LEU 34 HD12 LEU 34 62.832 2.651 -9.487 254 HD13 LEU 34 HD13 LEU 34 61.801 2.260 -10.865 255 HD21 LEU 34 HD21 LEU 34 63.087 -0.328 -8.614 256 HD22 LEU 34 HD22 LEU 34 61.681 -0.374 -7.551 257 HD23 LEU 34 HD23 LEU 34 62.808 0.981 -7.468 258 H ASP 35 H ASP 35 60.291 4.948 -8.405 259 HA ASP 35 HA ASP 35 63.126 5.473 -8.631 260 HB2 ASP 35 HB2 ASP 35 61.397 6.301 -10.332 261 HB3 ASP 35 HB3 ASP 35 60.953 7.500 -9.118 262 H VAL 36 H VAL 36 60.708 6.301 -6.405 263 HA VAL 36 HA VAL 36 62.035 8.359 -4.995 264 HB VAL 36 HB VAL 36 60.256 6.158 -3.900 265 HG11 VAL 36 HG11 VAL 36 59.888 7.699 -2.057 266 HG12 VAL 36 HG12 VAL 36 61.045 8.827 -2.826 267 HG13 VAL 36 HG13 VAL 36 61.602 7.249 -2.248 268 HG21 VAL 36 HG21 VAL 36 58.598 7.767 -3.953 269 HG22 VAL 36 HG22 VAL 36 59.271 7.332 -5.556 270 HG23 VAL 36 HG23 VAL 36 59.706 8.906 -4.786 271 H LEU 37 H LEU 37 61.886 4.922 -4.695 272 HA LEU 37 HA LEU 37 63.400 4.775 -2.356 273 HB2 LEU 37 HB2 LEU 37 63.027 2.602 -4.363 274 HB3 LEU 37 HB3 LEU 37 63.460 2.600 -2.669 275 HG LEU 37 HG LEU 37 60.742 3.522 -3.504 276 HD11 LEU 37 HD11 LEU 37 61.013 1.150 -4.091 277 HD12 LEU 37 HD12 LEU 37 59.858 1.410 -2.792 278 HD13 LEU 37 HD13 LEU 37 61.464 0.803 -2.416 279 HD21 LEU 37 HD21 LEU 37 60.230 3.198 -1.125 280 HD22 LEU 37 HD22 LEU 37 61.525 4.374 -1.362 281 HD23 LEU 37 HD23 LEU 37 61.905 2.728 -0.845 282 H LEU 38 H LEU 38 64.121 4.281 -5.725 283 HA LEU 38 HA LEU 38 66.753 3.437 -5.312 284 HB2 LEU 38 HB2 LEU 38 65.353 4.681 -7.636 285 HB3 LEU 38 HB3 LEU 38 67.004 4.090 -7.786 286 HG LEU 38 HG LEU 38 64.401 2.645 -7.435 287 HD11 LEU 38 HD11 LEU 38 65.055 3.218 -9.663 288 HD12 LEU 38 HD12 LEU 38 65.122 1.467 -9.415 289 HD13 LEU 38 HD13 LEU 38 66.607 2.416 -9.417 290 HD21 LEU 38 HD21 LEU 38 65.603 0.530 -7.251 291 HD22 LEU 38 HD22 LEU 38 65.911 1.568 -5.864 292 HD23 LEU 38 HD23 LEU 38 67.135 1.388 -7.119 293 H GLU 39 H GLU 39 65.429 6.640 -5.889 294 HA GLU 39 HA GLU 39 67.970 7.893 -5.811 295 HB2 GLU 39 HB2 GLU 39 65.171 8.853 -5.558 296 HB3 GLU 39 HB3 GLU 39 66.532 9.902 -5.208 297 HG2 GLU 39 HG2 GLU 39 65.958 8.500 -7.809 298 HG3 GLU 39 HG3 GLU 39 65.703 10.211 -7.452 299 H HIS 40 H HIS 40 65.426 7.461 -3.397 300 HA HIS 40 HA HIS 40 66.583 9.069 -1.448 301 HB2 HIS 40 HB2 HIS 40 64.248 8.223 -1.471 302 HB3 HIS 40 HB3 HIS 40 64.784 6.658 -0.975 303 HD1 HIS 40 HD1 HIS 40 63.697 9.862 0.422 304 HD2 HIS 40 HD2 HIS 40 66.111 6.719 1.686 305 HE1 HIS 40 HE1 HIS 40 63.927 10.107 2.902 306 H PHE 41 H PHE 41 66.858 5.656 -2.065 307 HA PHE 41 HA PHE 41 68.506 4.970 0.058 308 HB2 PHE 41 HB2 PHE 41 67.470 3.262 -1.101 309 HB3 PHE 41 HB3 PHE 41 67.936 3.922 -2.658 310 HD1 PHE 41 HD1 PHE 41 69.345 2.394 0.413 311 HD2 PHE 41 HD2 PHE 41 69.724 2.942 -3.768 312 HE1 PHE 41 HE1 PHE 41 71.231 0.807 0.375 313 HE2 PHE 41 HE2 PHE 41 71.600 1.380 -3.804 314 HZ PHE 41 HZ PHE 41 72.357 0.304 -1.744 315 H VAL 42 H VAL 42 69.375 5.871 -3.280 316 HA VAL 42 HA VAL 42 72.128 5.790 -2.645 317 HB VAL 42 HB VAL 42 71.319 5.345 -4.909 318 HG11 VAL 42 HG11 VAL 42 69.634 6.831 -5.140 319 HG12 VAL 42 HG12 VAL 42 70.827 6.905 -6.437 320 HG13 VAL 42 HG13 VAL 42 70.771 8.215 -5.213 321 HG21 VAL 42 HG21 VAL 42 73.271 7.606 -4.803 322 HG22 VAL 42 HG22 VAL 42 73.070 6.478 -6.144 323 HG23 VAL 42 HG23 VAL 42 73.657 5.906 -4.581 324 H LYS 43 H LYS 43 69.882 8.346 -2.524 325 HA LYS 43 HA LYS 43 71.845 10.440 -2.368 326 HB2 LYS 43 HB2 LYS 43 70.109 11.929 -1.942 327 HB3 LYS 43 HB3 LYS 43 69.265 10.630 -2.772 328 HG2 LYS 43 HG2 LYS 43 68.581 9.730 -0.491 329 HG3 LYS 43 HG3 LYS 43 69.342 11.149 0.183 330 HD2 LYS 43 HD2 LYS 43 67.847 12.574 -1.185 331 HD3 LYS 43 HD3 LYS 43 66.975 11.121 -1.666 332 HE2 LYS 43 HE2 LYS 43 65.823 12.115 0.176 333 HE3 LYS 43 HE3 LYS 43 66.584 10.628 0.737 334 HZ1 LYS 43 HZ1 LYS 43 66.928 12.397 2.348 335 HZ2 LYS 43 HZ2 LYS 43 67.595 13.391 1.179 336 HZ3 LYS 43 HZ3 LYS 43 68.415 12.020 1.663 337 H ILE 44 H ILE 44 70.560 8.298 0.031 338 HA ILE 44 HA ILE 44 71.608 9.926 2.170 339 HB ILE 44 HB ILE 44 70.775 8.111 3.700 340 HG12 ILE 44 HG12 ILE 44 69.678 6.967 1.130 341 HG13 ILE 44 HG13 ILE 44 70.936 6.217 2.086 342 HG21 ILE 44 HG21 ILE 44 68.425 8.646 3.385 343 HG22 ILE 44 HG22 ILE 44 68.760 9.194 1.744 344 HG23 ILE 44 HG23 ILE 44 69.432 10.073 3.114 345 HD11 ILE 44 HD11 ILE 44 68.772 5.164 2.416 346 HD12 ILE 44 HD12 ILE 44 68.097 6.706 2.938 347 HD13 ILE 44 HD13 ILE 44 69.337 5.914 3.909 348 H THR 45 H THR 45 72.473 6.881 0.617 349 HA THR 45 HA THR 45 74.786 6.653 2.327 350 HB THR 45 HB THR 45 73.754 4.563 1.649 351 HG1 THR 45 HG1 THR 45 75.908 4.217 1.850 352 HG21 THR 45 HG21 THR 45 72.778 5.293 -0.482 353 HG22 THR 45 HG22 THR 45 73.694 3.810 -0.700 354 HG23 THR 45 HG23 THR 45 74.381 5.352 -1.207 355 H GLU 46 H GLU 46 74.014 7.826 -0.853 356 HA GLU 46 HA GLU 46 75.018 8.983 -2.412 357 HB2 GLU 46 HB2 GLU 46 77.054 9.501 -0.290 358 HB3 GLU 46 HB3 GLU 46 76.890 10.441 -1.783 359 HG2 GLU 46 HG2 GLU 46 74.626 11.041 -1.075 360 HG3 GLU 46 HG3 GLU 46 74.872 10.126 0.401 361 H HIS 47 H HIS 47 75.497 6.291 -2.135 362 HA HIS 47 HA HIS 47 78.185 5.640 -2.839 363 HB2 HIS 47 HB2 HIS 47 76.548 4.089 -1.670 364 HB3 HIS 47 HB3 HIS 47 75.669 3.976 -3.188 365 HD1 HIS 47 HD1 HIS 47 76.526 2.215 -4.850 366 HD2 HIS 47 HD2 HIS 47 79.124 2.945 -1.716 367 HE1 HIS 47 HE1 HIS 47 78.442 0.598 -5.113 368 HA PRO 48 HA PRO 48 77.718 6.935 -7.135 369 HB2 PRO 48 HB2 PRO 48 79.686 4.885 -7.775 370 HB3 PRO 48 HB3 PRO 48 79.789 6.638 -7.991 371 HG2 PRO 48 HG2 PRO 48 81.166 5.227 -6.234 372 HG3 PRO 48 HG3 PRO 48 80.595 6.863 -5.772 373 HD2 PRO 48 HD2 PRO 48 79.539 4.140 -5.112 374 HD3 PRO 48 HD3 PRO 48 79.679 5.548 -4.048 375 H ASP 49 H ASP 49 77.221 3.803 -6.113 376 HA ASP 49 HA ASP 49 76.345 3.122 -8.696 377 HB2 ASP 49 HB2 ASP 49 77.874 1.282 -6.844 378 HB3 ASP 49 HB3 ASP 49 77.029 0.678 -8.240 379 H GLY 50 H GLY 50 75.036 4.193 -6.411 380 HA2 GLY 50 HA2 GLY 50 73.793 2.620 -4.413 381 HA3 GLY 50 HA3 GLY 50 73.116 4.015 -5.211 382 H THR 51 H THR 51 72.551 3.345 -7.493 383 HA THR 51 HA THR 51 70.299 1.695 -6.880 384 HB THR 51 HB THR 51 70.888 2.485 -9.704 385 HG1 THR 51 HG1 THR 51 69.598 4.433 -8.314 386 HG21 THR 51 HG21 THR 51 68.428 2.599 -7.947 387 HG22 THR 51 HG22 THR 51 68.856 1.221 -8.923 388 HG23 THR 51 HG23 THR 51 68.488 2.773 -9.701 389 H ALA 52 H ALA 52 73.295 1.285 -8.598 390 HA ALA 52 HA ALA 52 72.728 -1.168 -9.888 391 HB1 ALA 52 HB1 ALA 52 75.102 -1.352 -10.173 392 HB2 ALA 52 HB2 ALA 52 75.374 -0.108 -8.952 393 HB3 ALA 52 HB3 ALA 52 74.615 0.314 -10.489 394 H LEU 53 H LEU 53 73.914 -0.394 -6.702 395 HA LEU 53 HA LEU 53 74.582 -2.988 -5.884 396 HB2 LEU 53 HB2 LEU 53 73.542 -0.682 -4.307 397 HB3 LEU 53 HB3 LEU 53 74.012 -2.184 -3.558 398 HG LEU 53 HG LEU 53 75.745 -0.177 -4.966 399 HD11 LEU 53 HD11 LEU 53 75.732 -1.329 -2.192 400 HD12 LEU 53 HD12 LEU 53 75.173 0.274 -2.672 401 HD13 LEU 53 HD13 LEU 53 76.880 -0.144 -2.818 402 HD21 LEU 53 HD21 LEU 53 76.508 -2.376 -5.695 403 HD22 LEU 53 HD22 LEU 53 76.491 -2.950 -4.029 404 HD23 LEU 53 HD23 LEU 53 77.636 -1.702 -4.517 405 H ILE 54 H ILE 54 71.500 -1.403 -5.961 406 HA ILE 54 HA ILE 54 70.158 -3.435 -4.456 407 HB ILE 54 HB ILE 54 69.114 -1.299 -6.328 408 HG12 ILE 54 HG12 ILE 54 68.595 -1.709 -3.412 409 HG13 ILE 54 HG13 ILE 54 69.951 -0.751 -3.934 410 HG21 ILE 54 HG21 ILE 54 67.587 -3.208 -6.560 411 HG22 ILE 54 HG22 ILE 54 66.813 -1.897 -5.673 412 HG23 ILE 54 HG23 ILE 54 67.428 -3.304 -4.805 413 HD11 ILE 54 HD11 ILE 54 68.395 0.764 -5.064 414 HD12 ILE 54 HD12 ILE 54 68.030 0.604 -3.337 415 HD13 ILE 54 HD13 ILE 54 67.068 -0.264 -4.542 416 H TYR 55 H TYR 55 70.602 -2.809 -7.830 417 HA TYR 55 HA TYR 55 69.164 -4.946 -8.853 418 HB2 TYR 55 HB2 TYR 55 71.377 -3.250 -9.835 419 HB3 TYR 55 HB3 TYR 55 70.865 -4.604 -10.802 420 HD1 TYR 55 HD1 TYR 55 68.277 -4.646 -11.349 421 HD2 TYR 55 HD2 TYR 55 70.382 -1.198 -10.049 422 HE1 TYR 55 HE1 TYR 55 66.535 -3.216 -12.327 423 HE2 TYR 55 HE2 TYR 55 68.655 0.237 -11.009 424 HH TYR 55 HH TYR 55 65.667 -0.987 -12.096 425 H GLU 56 H GLU 56 72.645 -4.664 -8.146 426 HA GLU 56 HA GLU 56 73.156 -7.313 -9.000 427 HB2 GLU 56 HB2 GLU 56 75.440 -6.992 -7.889 428 HB3 GLU 56 HB3 GLU 56 75.066 -5.961 -9.243 429 HG2 GLU 56 HG2 GLU 56 74.509 -4.176 -7.721 430 HG3 GLU 56 HG3 GLU 56 74.922 -5.163 -6.337 431 H ALA 57 H ALA 57 72.672 -5.937 -5.789 432 HA ALA 57 HA ALA 57 73.349 -8.284 -4.405 433 HB1 ALA 57 HB1 ALA 57 71.382 -6.165 -3.569 434 HB2 ALA 57 HB2 ALA 57 73.124 -6.124 -3.290 435 HB3 ALA 57 HB3 ALA 57 72.137 -7.365 -2.519 436 H ALA 58 H ALA 58 70.292 -7.207 -5.829 437 HA ALA 58 HA ALA 58 68.724 -9.268 -4.739 438 HB1 ALA 58 HB1 ALA 58 67.082 -8.661 -6.450 439 HB2 ALA 58 HB2 ALA 58 68.308 -7.710 -7.292 440 HB3 ALA 58 HB3 ALA 58 67.765 -7.225 -5.688 441 H ALA 59 H ALA 59 70.410 -8.981 -7.853 442 HA ALA 59 HA ALA 59 69.499 -11.466 -8.884 443 HB1 ALA 59 HB1 ALA 59 71.137 -11.133 -10.650 444 HB2 ALA 59 HB2 ALA 59 71.915 -9.860 -9.709 445 HB3 ALA 59 HB3 ALA 59 70.278 -9.628 -10.321 446 H ARG 60 H ARG 60 72.489 -10.474 -7.287 447 HA ARG 60 HA ARG 60 73.812 -12.935 -7.622 448 HB2 ARG 60 HB2 ARG 60 74.307 -10.699 -5.658 449 HB3 ARG 60 HB3 ARG 60 75.370 -12.092 -5.835 450 HG2 ARG 60 HG2 ARG 60 75.855 -11.520 -8.095 451 HG3 ARG 60 HG3 ARG 60 74.652 -10.235 -8.086 452 HD2 ARG 60 HD2 ARG 60 75.987 -9.043 -6.391 453 HD3 ARG 60 HD3 ARG 60 77.215 -10.305 -6.478 454 HE ARG 60 HE ARG 60 76.786 -9.481 -9.047 455 HH11 ARG 60 HH11 ARG 60 77.954 -7.934 -6.081 456 HH12 ARG 60 HH12 ARG 60 78.849 -6.756 -6.904 457 HH21 ARG 60 HH21 ARG 60 78.061 -7.926 -10.152 458 HH22 ARG 60 HH22 ARG 60 78.989 -6.785 -9.275 459 H ALA 61 H ALA 61 71.585 -11.827 -5.192 460 HA ALA 61 HA ALA 61 72.141 -13.961 -3.370 461 HB1 ALA 61 HB1 ALA 61 70.120 -13.256 -2.216 462 HB2 ALA 61 HB2 ALA 61 69.709 -12.202 -3.575 463 HB3 ALA 61 HB3 ALA 61 71.152 -11.882 -2.610 464 H ALA 62 H ALA 62 69.887 -13.453 -6.016 465 HA ALA 62 HA ALA 62 68.192 -15.623 -5.523 466 HB1 ALA 62 HB1 ALA 62 68.893 -14.383 -8.190 467 HB2 ALA 62 HB2 ALA 62 67.639 -13.807 -7.090 468 HB3 ALA 62 HB3 ALA 62 67.485 -15.388 -7.852 469 H ALA 63 H ALA 63 71.114 -15.384 -7.468 470 HA ALA 63 HA ALA 63 71.098 -18.188 -8.137 471 HB1 ALA 63 HB1 ALA 63 73.302 -16.144 -8.407 472 HB2 ALA 63 HB2 ALA 63 72.097 -16.539 -9.634 473 HB3 ALA 63 HB3 ALA 63 73.280 -17.751 -9.142 474 H ASN 64 H ASN 64 72.987 -16.082 -6.049 475 HA ASN 64 HA ASN 64 74.260 -16.323 -4.295 476 HB2 ASN 64 HB2 ASN 64 72.238 -17.163 -3.212 477 HB3 ASN 64 HB3 ASN 64 72.629 -18.801 -3.725 478 HD21 ASN 64 HD21 ASN 64 73.508 -16.180 -1.588 479 HD22 ASN 64 HD22 ASN 64 74.461 -17.145 -0.524 480 HA PRO 65 HA PRO 65 77.324 -19.166 -5.916 481 HB2 PRO 65 HB2 PRO 65 79.271 -17.396 -6.319 482 HB3 PRO 65 HB3 PRO 65 77.891 -17.489 -7.418 483 HG2 PRO 65 HG2 PRO 65 78.467 -15.499 -5.272 484 HG3 PRO 65 HG3 PRO 65 77.698 -15.253 -6.846 485 HD2 PRO 65 HD2 PRO 65 76.381 -15.557 -4.380 486 HD3 PRO 65 HD3 PRO 65 75.628 -15.662 -5.984 487 H GLY 66 H GLY 66 76.920 -17.592 -3.069 488 HA2 GLY 66 HA2 GLY 66 77.936 -18.576 -1.073 489 HA3 GLY 66 HA3 GLY 66 79.454 -18.607 -1.967 490 H GLY 67 H GLY 67 79.182 -17.386 0.528 491 HA2 GLY 67 HA2 GLY 67 80.048 -15.469 1.480 492 HA3 GLY 67 HA3 GLY 67 80.131 -14.744 -0.120 493 H ASP 68 H ASP 68 79.330 -13.054 1.691 494 HA ASP 68 HA ASP 68 76.389 -13.023 1.576 495 HB2 ASP 68 HB2 ASP 68 77.666 -12.676 3.810 496 HB3 ASP 68 HB3 ASP 68 78.149 -11.118 3.159 497 H GLY 69 H GLY 69 76.005 -10.223 1.596 498 HA2 GLY 69 HA2 GLY 69 76.592 -8.296 0.256 499 HA3 GLY 69 HA3 GLY 69 77.367 -9.395 -0.892 500 H GLY 70 H GLY 70 75.276 -11.305 -0.857 501 HA2 GLY 70 HA2 GLY 70 73.488 -10.025 -2.704 502 HA3 GLY 70 HA3 GLY 70 73.548 -11.734 -2.292 503 H GLY 71 H GLY 71 71.347 -9.726 -2.388 504 HA2 GLY 71 HA2 GLY 71 69.316 -9.868 -1.313 505 HA3 GLY 71 HA3 GLY 71 70.087 -10.620 0.072 506 HA PRO 72 HA PRO 72 68.978 -5.994 0.511 507 HB2 PRO 72 HB2 PRO 72 67.292 -6.383 2.650 508 HB3 PRO 72 HB3 PRO 72 66.837 -6.263 0.935 509 HG2 PRO 72 HG2 PRO 72 67.268 -8.739 2.576 510 HG3 PRO 72 HG3 PRO 72 65.946 -8.375 1.455 511 HD2 PRO 72 HD2 PRO 72 67.964 -9.913 0.717 512 HD3 PRO 72 HD3 PRO 72 67.276 -8.736 -0.420 513 H GLU 73 H GLU 73 69.658 -8.442 2.952 514 HA GLU 73 HA GLU 73 70.934 -6.439 4.638 515 HB2 GLU 73 HB2 GLU 73 70.617 -9.425 5.053 516 HB3 GLU 73 HB3 GLU 73 71.226 -8.282 6.238 517 HG2 GLU 73 HG2 GLU 73 68.996 -7.126 6.113 518 HG3 GLU 73 HG3 GLU 73 68.438 -8.475 5.134 519 H GLY 74 H GLY 74 71.945 -7.952 1.974 520 HA2 GLY 74 HA2 GLY 74 74.592 -7.843 3.129 521 HA3 GLY 74 HA3 GLY 74 74.272 -8.766 1.617 522 H ILE 75 H ILE 75 72.630 -6.361 0.784 523 HA ILE 75 HA ILE 75 74.531 -4.796 -0.616 524 HB ILE 75 HB ILE 75 72.305 -3.192 0.288 525 HG12 ILE 75 HG12 ILE 75 71.551 -5.823 -1.067 526 HG13 ILE 75 HG13 ILE 75 71.184 -5.283 0.537 527 HG21 ILE 75 HG21 ILE 75 71.951 -2.903 -2.120 528 HG22 ILE 75 HG22 ILE 75 73.200 -4.113 -2.422 529 HG23 ILE 75 HG23 ILE 75 73.607 -2.606 -1.593 530 HD11 ILE 75 HD11 ILE 75 70.339 -3.728 -1.823 531 HD12 ILE 75 HD12 ILE 75 69.885 -3.582 -0.116 532 HD13 ILE 75 HD13 ILE 75 69.338 -4.982 -1.065 533 H VAL 76 H VAL 76 72.928 -4.463 2.458 534 HA VAL 76 HA VAL 76 73.620 -1.945 3.097 535 HB VAL 76 HB VAL 76 73.024 -2.639 5.288 536 HG11 VAL 76 HG11 VAL 76 71.409 -2.074 3.438 537 HG12 VAL 76 HG12 VAL 76 70.735 -2.892 4.833 538 HG13 VAL 76 HG13 VAL 76 71.069 -3.803 3.350 539 HG21 VAL 76 HG21 VAL 76 73.880 -4.827 5.425 540 HG22 VAL 76 HG22 VAL 76 72.737 -5.378 4.196 541 HG23 VAL 76 HG23 VAL 76 72.156 -4.827 5.776 542 H LYS 77 H LYS 77 75.251 -4.895 3.594 543 HA LYS 77 HA LYS 77 77.405 -4.038 5.181 544 HB2 LYS 77 HB2 LYS 77 77.231 -6.398 4.800 545 HB3 LYS 77 HB3 LYS 77 77.231 -6.173 3.056 546 HG2 LYS 77 HG2 LYS 77 79.600 -5.469 3.175 547 HG3 LYS 77 HG3 LYS 77 79.583 -5.790 4.903 548 HD2 LYS 77 HD2 LYS 77 79.243 -8.111 4.575 549 HD3 LYS 77 HD3 LYS 77 78.860 -7.885 2.868 550 HE2 LYS 77 HE2 LYS 77 81.109 -8.825 3.190 551 HE3 LYS 77 HE3 LYS 77 81.154 -7.259 2.400 552 HZ1 LYS 77 HZ1 LYS 77 81.898 -6.241 4.439 553 HZ2 LYS 77 HZ2 LYS 77 82.862 -7.582 4.146 554 HZ3 LYS 77 HZ3 LYS 77 81.650 -7.661 5.301 555 H GLU 78 H GLU 78 77.140 -4.178 1.632 556 HA GLU 78 HA GLU 78 79.625 -3.024 1.036 557 HB2 GLU 78 HB2 GLU 78 78.193 -4.230 -0.616 558 HB3 GLU 78 HB3 GLU 78 77.028 -2.930 -0.626 559 HG2 GLU 78 HG2 GLU 78 78.338 -2.784 -2.565 560 HG3 GLU 78 HG3 GLU 78 78.784 -1.442 -1.513 561 H ILE 79 H ILE 79 76.465 -1.634 1.532 562 HA ILE 79 HA ILE 79 77.071 1.076 1.089 563 HB ILE 79 HB ILE 79 74.931 -0.247 2.772 564 HG12 ILE 79 HG12 ILE 79 74.712 -0.605 0.380 565 HG13 ILE 79 HG13 ILE 79 73.431 0.446 0.965 566 HG21 ILE 79 HG21 ILE 79 75.332 1.951 3.733 567 HG22 ILE 79 HG22 ILE 79 73.764 1.874 2.930 568 HG23 ILE 79 HG23 ILE 79 75.116 2.687 2.142 569 HD11 ILE 79 HD11 ILE 79 74.752 2.385 0.172 570 HD12 ILE 79 HD12 ILE 79 74.187 1.312 -1.099 571 HD13 ILE 79 HD13 ILE 79 75.875 1.255 -0.591 572 H LYS 80 H LYS 80 77.139 -0.808 4.105 573 HA LYS 80 HA LYS 80 77.722 1.472 5.675 574 HB2 LYS 80 HB2 LYS 80 77.859 0.009 7.586 575 HB3 LYS 80 HB3 LYS 80 76.671 -0.699 6.505 576 HG2 LYS 80 HG2 LYS 80 78.236 -2.351 5.770 577 HG3 LYS 80 HG3 LYS 80 79.493 -1.652 6.780 578 HD2 LYS 80 HD2 LYS 80 78.113 -2.087 8.781 579 HD3 LYS 80 HD3 LYS 80 76.893 -2.843 7.758 580 HE2 LYS 80 HE2 LYS 80 78.279 -4.532 8.817 581 HE3 LYS 80 HE3 LYS 80 78.553 -4.542 7.076 582 HZ1 LYS 80 HZ1 LYS 80 80.606 -4.727 8.355 583 HZ2 LYS 80 HZ2 LYS 80 80.307 -3.237 9.090 584 HZ3 LYS 80 HZ3 LYS 80 80.615 -3.305 7.458 585 H GLU 81 H GLU 81 79.709 -1.037 4.238 586 HA GLU 81 HA GLU 81 82.026 -0.138 5.558 587 HB2 GLU 81 HB2 GLU 81 81.782 -2.059 3.241 588 HB3 GLU 81 HB3 GLU 81 83.212 -1.839 4.253 589 HG2 GLU 81 HG2 GLU 81 81.893 -2.454 6.228 590 HG3 GLU 81 HG3 GLU 81 80.507 -2.719 5.203 591 H TRP 82 H TRP 82 80.621 0.554 2.457 592 HA TRP 82 HA TRP 82 82.800 1.966 1.309 593 HB2 TRP 82 HB2 TRP 82 80.539 1.281 0.252 594 HB3 TRP 82 HB3 TRP 82 79.938 2.707 1.124 595 HD1 TRP 82 HD1 TRP 82 82.457 1.859 -1.665 596 HE1 TRP 82 HE1 TRP 82 82.625 3.896 -3.210 597 HE3 TRP 82 HE3 TRP 82 79.528 5.103 0.960 598 HZ2 TRP 82 HZ2 TRP 82 81.643 6.513 -3.331 599 HZ3 TRP 82 HZ3 TRP 82 79.218 7.366 0.100 600 HH2 TRP 82 HH2 TRP 82 80.245 8.068 -2.022 601 H ARG 83 H ARG 83 80.091 2.908 3.305 602 HA ARG 83 HA ARG 83 80.630 5.691 3.378 603 HB2 ARG 83 HB2 ARG 83 78.461 4.247 4.051 604 HB3 ARG 83 HB3 ARG 83 79.361 4.206 5.574 605 HG2 ARG 83 HG2 ARG 83 77.997 5.942 5.990 606 HG3 ARG 83 HG3 ARG 83 79.482 6.647 5.371 607 HD2 ARG 83 HD2 ARG 83 78.436 7.031 3.176 608 HD3 ARG 83 HD3 ARG 83 76.982 6.232 3.764 609 HE ARG 83 HE ARG 83 77.137 8.063 5.593 610 HH11 ARG 83 HH11 ARG 83 77.362 8.600 2.050 611 HH12 ARG 83 HH12 ARG 83 77.076 10.270 2.187 612 HH21 ARG 83 HH21 ARG 83 76.733 10.362 5.703 613 HH22 ARG 83 HH22 ARG 83 76.717 11.293 4.300 614 H ALA 84 H ALA 84 81.343 3.027 5.605 615 HA ALA 84 HA ALA 84 82.565 4.614 7.575 616 HB1 ALA 84 HB1 ALA 84 83.246 2.516 8.595 617 HB2 ALA 84 HB2 ALA 84 82.843 1.648 7.114 618 HB3 ALA 84 HB3 ALA 84 81.569 2.426 8.052 619 H ALA 85 H ALA 85 83.878 2.769 4.863 620 HA ALA 85 HA ALA 85 86.558 2.887 5.530 621 HB1 ALA 85 HB1 ALA 85 87.045 2.562 3.178 622 HB2 ALA 85 HB2 ALA 85 85.389 3.018 2.768 623 HB3 ALA 85 HB3 ALA 85 85.698 1.552 3.699 624 H ASN 86 H ASN 86 84.580 5.386 4.019 625 HA ASN 86 HA ASN 86 87.022 7.045 3.930 626 HB2 ASN 86 HB2 ASN 86 85.697 6.933 1.833 627 HB3 ASN 86 HB3 ASN 86 84.320 7.618 2.680 628 HD21 ASN 86 HD21 ASN 86 84.211 9.364 1.203 629 HD22 ASN 86 HD22 ASN 86 85.335 10.634 1.253 630 H GLY 87 H GLY 87 84.852 6.306 6.123 631 HA2 GLY 87 HA2 GLY 87 84.454 7.229 8.167 632 HA3 GLY 87 HA3 GLY 87 85.481 8.577 7.708 633 H LYS 88 H LYS 88 82.400 7.436 6.183 634 HA LYS 88 HA LYS 88 81.403 10.068 6.636 635 HB2 LYS 88 HB2 LYS 88 80.874 7.829 4.720 636 HB3 LYS 88 HB3 LYS 88 79.867 9.259 4.836 637 HG2 LYS 88 HG2 LYS 88 81.806 10.613 4.193 638 HG3 LYS 88 HG3 LYS 88 82.803 9.143 4.048 639 HD2 LYS 88 HD2 LYS 88 80.409 10.042 2.483 640 HD3 LYS 88 HD3 LYS 88 82.079 9.995 1.920 641 HE2 LYS 88 HE2 LYS 88 80.292 7.636 2.555 642 HE3 LYS 88 HE3 LYS 88 80.858 8.246 0.994 643 HZ1 LYS 88 HZ1 LYS 88 83.034 7.616 1.440 644 HZ2 LYS 88 HZ2 LYS 88 82.108 6.286 1.715 645 HZ3 LYS 88 HZ3 LYS 88 82.703 7.161 3.036 646 HA PRO 89 HA PRO 89 78.832 8.146 9.722 647 HB2 PRO 89 HB2 PRO 89 76.569 9.716 9.386 648 HB3 PRO 89 HB3 PRO 89 77.961 10.172 10.375 649 HG2 PRO 89 HG2 PRO 89 77.265 10.951 7.585 650 HG3 PRO 89 HG3 PRO 89 77.967 11.941 8.875 651 HD2 PRO 89 HD2 PRO 89 79.456 10.979 6.869 652 HD3 PRO 89 HD3 PRO 89 80.102 11.087 8.523 653 H GLY 90 H GLY 90 78.099 6.216 9.332 654 HA2 GLY 90 HA2 GLY 90 76.365 5.724 7.038 655 HA3 GLY 90 HA3 GLY 90 77.177 4.501 8.016 656 H PHE 91 H PHE 91 75.802 3.338 9.104 657 HA PHE 91 HA PHE 91 73.093 4.264 9.457 658 HB2 PHE 91 HB2 PHE 91 74.348 1.692 10.426 659 HB3 PHE 91 HB3 PHE 91 72.634 2.043 10.290 660 HD1 PHE 91 HD1 PHE 91 72.553 3.275 7.593 661 HD2 PHE 91 HD2 PHE 91 74.660 -0.119 9.046 662 HE1 PHE 91 HE1 PHE 91 72.575 2.331 5.344 663 HE2 PHE 91 HE2 PHE 91 74.680 -1.078 6.786 664 HZ PHE 91 HZ PHE 91 73.638 0.143 4.930 665 H LYS 92 H LYS 92 72.034 4.455 11.472 666 HA LYS 92 HA LYS 92 73.755 5.071 13.671 667 HB2 LYS 92 HB2 LYS 92 71.786 5.830 14.712 668 HB3 LYS 92 HB3 LYS 92 71.743 6.428 13.088 669 HG2 LYS 92 HG2 LYS 92 70.122 4.752 12.460 670 HG3 LYS 92 HG3 LYS 92 70.309 3.970 14.025 671 HD2 LYS 92 HD2 LYS 92 69.273 6.792 13.665 672 HD3 LYS 92 HD3 LYS 92 68.226 5.382 13.805 673 HE2 LYS 92 HE2 LYS 92 69.164 4.927 16.039 674 HE3 LYS 92 HE3 LYS 92 70.208 6.334 15.888 675 HZ1 LYS 92 HZ1 LYS 92 68.228 6.802 17.199 676 HZ2 LYS 92 HZ2 LYS 92 67.222 6.476 15.884 677 HZ3 LYS 92 HZ3 LYS 92 68.306 7.750 15.835 678 H GLN 93 H GLN 93 72.644 4.050 15.806 679 HA GLN 93 HA GLN 93 72.378 1.260 15.180 680 HB2 GLN 93 HB2 GLN 93 73.724 2.826 17.210 681 HB3 GLN 93 HB3 GLN 93 73.377 1.117 17.538 682 HG2 GLN 93 HG2 GLN 93 75.222 2.418 15.522 683 HG3 GLN 93 HG3 GLN 93 75.639 1.201 16.725 684 HE21 GLN 93 HE21 GLN 93 73.313 -0.484 16.025 685 HE22 GLN 93 HE22 GLN 93 73.652 -1.154 14.483 686 H GLY 94 H GLY 94 70.854 0.182 16.212 687 HA2 GLY 94 HA2 GLY 94 69.556 0.914 18.536 688 HA3 GLY 94 HA3 GLY 94 68.584 1.469 17.165 Start of MODEL 28 1 H GLU 2 H GLU 2 59.933 1.556 8.777 2 HA GLU 2 HA GLU 2 59.221 3.196 7.155 3 HB2 GLU 2 HB2 GLU 2 60.385 4.436 9.655 4 HB3 GLU 2 HB3 GLU 2 59.158 5.165 8.637 5 HG2 GLU 2 HG2 GLU 2 57.631 3.335 9.187 6 HG3 GLU 2 HG3 GLU 2 58.867 2.644 10.240 7 H LEU 3 H LEU 3 59.769 5.600 6.524 8 HA LEU 3 HA LEU 3 62.526 5.508 5.532 9 HB2 LEU 3 HB2 LEU 3 60.240 7.203 4.558 10 HB3 LEU 3 HB3 LEU 3 61.825 7.086 3.824 11 HG LEU 3 HG LEU 3 59.664 5.009 3.896 12 HD11 LEU 3 HD11 LEU 3 59.857 5.132 1.427 13 HD12 LEU 3 HD12 LEU 3 61.082 6.373 1.595 14 HD13 LEU 3 HD13 LEU 3 59.436 6.696 2.120 15 HD21 LEU 3 HD21 LEU 3 61.796 3.944 4.351 16 HD22 LEU 3 HD22 LEU 3 62.480 4.677 2.894 17 HD23 LEU 3 HD23 LEU 3 61.146 3.505 2.776 18 H LYS 4 H LYS 4 63.934 6.980 6.064 19 HA LYS 4 HA LYS 4 63.129 9.182 7.839 20 HB2 LYS 4 HB2 LYS 4 65.954 8.368 7.161 21 HB3 LYS 4 HB3 LYS 4 65.388 9.218 8.591 22 HG2 LYS 4 HG2 LYS 4 65.237 6.298 7.910 23 HG3 LYS 4 HG3 LYS 4 66.083 7.025 9.255 24 HD2 LYS 4 HD2 LYS 4 63.635 7.782 9.884 25 HD3 LYS 4 HD3 LYS 4 63.237 6.439 8.833 26 HE2 LYS 4 HE2 LYS 4 64.798 4.972 10.124 27 HE3 LYS 4 HE3 LYS 4 64.996 6.274 11.264 28 HZ1 LYS 4 HZ1 LYS 4 63.427 4.887 12.207 29 HZ2 LYS 4 HZ2 LYS 4 62.605 4.629 10.804 30 HZ3 LYS 4 HZ3 LYS 4 62.491 6.154 11.595 31 H ASN 5 H ASN 5 65.268 10.951 7.220 32 HA ASN 5 HA ASN 5 64.974 11.337 4.308 33 HB2 ASN 5 HB2 ASN 5 65.023 13.411 6.481 34 HB3 ASN 5 HB3 ASN 5 65.586 13.808 4.862 35 HD21 ASN 5 HD21 ASN 5 62.959 11.542 5.260 36 HD22 ASN 5 HD22 ASN 5 61.708 12.586 4.722 37 H SER 6 H SER 6 67.169 10.924 6.872 38 HA SER 6 HA SER 6 69.285 11.116 4.925 39 HB2 SER 6 HB2 SER 6 70.768 12.050 6.654 40 HB3 SER 6 HB3 SER 6 69.485 13.163 6.184 41 HG SER 6 HG SER 6 69.522 13.219 8.357 42 H ILE 7 H ILE 7 71.240 9.913 5.710 43 HA ILE 7 HA ILE 7 70.447 7.272 6.400 44 HB ILE 7 HB ILE 7 72.396 7.891 4.896 45 HG12 ILE 7 HG12 ILE 7 73.934 6.106 6.062 46 HG13 ILE 7 HG13 ILE 7 72.514 5.892 7.070 47 HG21 ILE 7 HG21 ILE 7 73.486 9.599 6.212 48 HG22 ILE 7 HG22 ILE 7 74.583 8.251 5.881 49 HG23 ILE 7 HG23 ILE 7 73.852 8.414 7.475 50 HD11 ILE 7 HD11 ILE 7 72.582 5.669 4.087 51 HD12 ILE 7 HD12 ILE 7 71.149 5.395 5.101 52 HD13 ILE 7 HD13 ILE 7 72.569 4.335 5.216 53 H SER 8 H SER 8 71.149 9.966 8.258 54 HA SER 8 HA SER 8 72.604 8.781 10.368 55 HB2 SER 8 HB2 SER 8 71.099 11.377 10.186 56 HB3 SER 8 HB3 SER 8 72.266 10.955 11.445 57 HG SER 8 HG SER 8 73.849 11.159 10.107 58 H ASP 9 H ASP 9 69.282 8.847 9.569 59 HA ASP 9 HA ASP 9 68.622 8.120 12.340 60 HB2 ASP 9 HB2 ASP 9 67.283 9.980 11.007 61 HB3 ASP 9 HB3 ASP 9 66.599 8.625 10.194 62 H TYR 10 H TYR 10 69.736 6.652 9.815 63 HA TYR 10 HA TYR 10 67.691 4.582 9.627 64 HB2 TYR 10 HB2 TYR 10 69.830 5.443 7.735 65 HB3 TYR 10 HB3 TYR 10 69.435 3.734 7.768 66 HD1 TYR 10 HD1 TYR 10 67.057 3.033 7.294 67 HD2 TYR 10 HD2 TYR 10 68.436 6.993 6.567 68 HE1 TYR 10 HE1 TYR 10 65.140 3.418 5.775 69 HE2 TYR 10 HE2 TYR 10 66.523 7.376 5.058 70 HH TYR 10 HH TYR 10 64.876 6.174 3.778 71 H THR 11 H THR 11 67.954 2.860 10.778 72 HA THR 11 HA THR 11 70.526 2.140 11.899 73 HB THR 11 HB THR 11 69.147 0.364 12.943 74 HG1 THR 11 HG1 THR 11 66.876 0.475 12.612 75 HG21 THR 11 HG21 THR 11 67.990 3.145 13.198 76 HG22 THR 11 HG22 THR 11 69.330 2.468 14.139 77 HG23 THR 11 HG23 THR 11 67.703 1.824 14.327 78 H GLU 12 H GLU 12 70.844 -0.398 11.670 79 HA GLU 12 HA GLU 12 71.281 -1.115 8.985 80 HB2 GLU 12 HB2 GLU 12 70.530 -3.103 11.123 81 HB3 GLU 12 HB3 GLU 12 71.579 -3.343 9.740 82 HG2 GLU 12 HG2 GLU 12 72.182 -1.504 11.936 83 HG3 GLU 12 HG3 GLU 12 72.599 -3.203 12.057 84 H ALA 13 H ALA 13 68.732 -1.914 11.249 85 HA ALA 13 HA ALA 13 67.527 -3.544 9.413 86 HB1 ALA 13 HB1 ALA 13 65.779 -3.962 11.026 87 HB2 ALA 13 HB2 ALA 13 66.315 -2.573 11.983 88 HB3 ALA 13 HB3 ALA 13 67.379 -3.973 11.764 89 H GLU 14 H GLU 14 66.750 -0.194 10.414 90 HA GLU 14 HA GLU 14 64.333 0.078 8.975 91 HB2 GLU 14 HB2 GLU 14 66.434 2.035 9.822 92 HB3 GLU 14 HB3 GLU 14 65.138 2.579 8.778 93 HG2 GLU 14 HG2 GLU 14 64.793 1.278 11.457 94 HG3 GLU 14 HG3 GLU 14 64.733 3.015 11.147 95 H PHE 15 H PHE 15 67.667 0.248 8.031 96 HA PHE 15 HA PHE 15 67.092 1.296 5.470 97 HB2 PHE 15 HB2 PHE 15 69.179 1.612 6.811 98 HB3 PHE 15 HB3 PHE 15 69.569 -0.068 6.491 99 HD1 PHE 15 HD1 PHE 15 68.799 3.130 4.813 100 HD2 PHE 15 HD2 PHE 15 70.731 -0.604 4.671 101 HE1 PHE 15 HE1 PHE 15 69.944 3.813 2.747 102 HE2 PHE 15 HE2 PHE 15 71.893 0.058 2.594 103 HZ PHE 15 HZ PHE 15 71.485 2.274 1.655 104 H VAL 16 H VAL 16 67.913 -1.910 6.819 105 HA VAL 16 HA VAL 16 67.851 -3.265 4.363 106 HB VAL 16 HB VAL 16 67.835 -5.322 5.474 107 HG11 VAL 16 HG11 VAL 16 69.442 -5.165 7.336 108 HG12 VAL 16 HG12 VAL 16 69.350 -3.415 7.135 109 HG13 VAL 16 HG13 VAL 16 69.877 -4.437 5.798 110 HG21 VAL 16 HG21 VAL 16 66.579 -4.013 7.849 111 HG22 VAL 16 HG22 VAL 16 67.321 -5.626 7.894 112 HG23 VAL 16 HG23 VAL 16 65.958 -5.309 6.821 113 H GLN 17 H GLN 17 65.210 -2.369 6.564 114 HA GLN 17 HA GLN 17 63.237 -3.941 5.410 115 HB2 GLN 17 HB2 GLN 17 62.936 -3.004 7.584 116 HB3 GLN 17 HB3 GLN 17 63.237 -1.378 6.995 117 HG2 GLN 17 HG2 GLN 17 60.917 -1.745 7.479 118 HG3 GLN 17 HG3 GLN 17 61.232 -1.407 5.768 119 HE21 GLN 17 HE21 GLN 17 59.328 -2.338 5.091 120 HE22 GLN 17 HE22 GLN 17 59.085 -4.039 5.044 121 H LEU 18 H LEU 18 64.254 -0.600 4.849 122 HA LEU 18 HA LEU 18 62.455 0.043 2.817 123 HB2 LEU 18 HB2 LEU 18 63.768 1.757 3.754 124 HB3 LEU 18 HB3 LEU 18 65.254 0.954 3.466 125 HG LEU 18 HG LEU 18 65.062 1.367 1.042 126 HD11 LEU 18 HD11 LEU 18 62.660 1.462 0.818 127 HD12 LEU 18 HD12 LEU 18 63.458 2.886 0.149 128 HD13 LEU 18 HD13 LEU 18 62.642 2.990 1.707 129 HD21 LEU 18 HD21 LEU 18 66.312 2.912 2.415 130 HD22 LEU 18 HD22 LEU 18 64.844 3.823 2.762 131 HD23 LEU 18 HD23 LEU 18 65.484 3.775 1.118 132 H LEU 19 H LEU 19 65.605 -1.279 2.695 133 HA LEU 19 HA LEU 19 65.891 -1.642 -0.078 134 HB2 LEU 19 HB2 LEU 19 67.144 -2.667 2.315 135 HB3 LEU 19 HB3 LEU 19 67.451 -3.585 0.839 136 HG LEU 19 HG LEU 19 68.423 -1.612 -0.205 137 HD11 LEU 19 HD11 LEU 19 67.704 -0.218 2.347 138 HD12 LEU 19 HD12 LEU 19 66.988 0.092 0.761 139 HD13 LEU 19 HD13 LEU 19 68.701 0.464 1.060 140 HD21 LEU 19 HD21 LEU 19 70.290 -1.281 1.217 141 HD22 LEU 19 HD22 LEU 19 69.756 -2.979 1.220 142 HD23 LEU 19 HD23 LEU 19 69.366 -1.924 2.585 143 H LYS 20 H LYS 20 64.511 -3.858 2.301 144 HA LYS 20 HA LYS 20 64.134 -5.937 0.482 145 HB2 LYS 20 HB2 LYS 20 62.570 -5.218 2.943 146 HB3 LYS 20 HB3 LYS 20 62.253 -6.686 2.028 147 HG2 LYS 20 HG2 LYS 20 64.841 -7.065 2.438 148 HG3 LYS 20 HG3 LYS 20 64.554 -5.940 3.738 149 HD2 LYS 20 HD2 LYS 20 62.821 -7.274 4.725 150 HD3 LYS 20 HD3 LYS 20 62.857 -8.408 3.384 151 HE2 LYS 20 HE2 LYS 20 64.006 -9.404 5.230 152 HE3 LYS 20 HE3 LYS 20 65.196 -8.985 4.003 153 HZ1 LYS 20 HZ1 LYS 20 65.665 -6.954 5.323 154 HZ2 LYS 20 HZ2 LYS 20 66.002 -8.420 6.129 155 HZ3 LYS 20 HZ3 LYS 20 64.619 -7.553 6.520 156 H GLU 21 H GLU 21 62.196 -3.143 1.340 157 HA GLU 21 HA GLU 21 59.955 -3.763 -0.223 158 HB2 GLU 21 HB2 GLU 21 60.989 -1.077 0.695 159 HB3 GLU 21 HB3 GLU 21 59.430 -1.309 -0.073 160 HG2 GLU 21 HG2 GLU 21 58.804 -2.813 1.806 161 HG3 GLU 21 HG3 GLU 21 60.332 -2.402 2.582 162 H ILE 22 H ILE 22 62.938 -2.092 -0.880 163 HA ILE 22 HA ILE 22 62.231 -1.191 -3.461 164 HB ILE 22 HB ILE 22 65.070 -1.770 -2.522 165 HG12 ILE 22 HG12 ILE 22 63.387 0.740 -2.194 166 HG13 ILE 22 HG13 ILE 22 63.922 -0.320 -0.918 167 HG21 ILE 22 HG21 ILE 22 65.613 -0.005 -4.187 168 HG22 ILE 22 HG22 ILE 22 63.907 0.078 -4.612 169 HG23 ILE 22 HG23 ILE 22 64.818 -1.397 -4.924 170 HD11 ILE 22 HD11 ILE 22 65.725 1.321 -2.668 171 HD12 ILE 22 HD12 ILE 22 66.230 0.297 -1.325 172 HD13 ILE 22 HD13 ILE 22 65.236 1.725 -1.027 173 H GLU 23 H GLU 23 63.844 -4.140 -2.333 174 HA GLU 23 HA GLU 23 64.479 -5.343 -4.796 175 HB2 GLU 23 HB2 GLU 23 63.343 -6.573 -2.335 176 HB3 GLU 23 HB3 GLU 23 64.038 -7.506 -3.627 177 HG2 GLU 23 HG2 GLU 23 66.218 -6.355 -3.099 178 HG3 GLU 23 HG3 GLU 23 65.386 -5.602 -1.739 179 H LYS 24 H LYS 24 61.619 -5.282 -2.933 180 HA LYS 24 HA LYS 24 59.970 -7.130 -4.189 181 HB2 LYS 24 HB2 LYS 24 59.684 -6.349 -2.008 182 HB3 LYS 24 HB3 LYS 24 59.564 -4.689 -2.530 183 HG2 LYS 24 HG2 LYS 24 57.399 -5.326 -3.666 184 HG3 LYS 24 HG3 LYS 24 57.516 -6.870 -2.801 185 HD2 LYS 24 HD2 LYS 24 57.688 -5.668 -0.679 186 HD3 LYS 24 HD3 LYS 24 57.567 -4.145 -1.563 187 HE2 LYS 24 HE2 LYS 24 55.326 -4.736 -2.292 188 HE3 LYS 24 HE3 LYS 24 55.439 -6.270 -1.428 189 HZ1 LYS 24 HZ1 LYS 24 54.257 -4.611 -0.118 190 HZ2 LYS 24 HZ2 LYS 24 55.566 -3.571 -0.194 191 HZ3 LYS 24 HZ3 LYS 24 55.702 -5.020 0.646 192 H GLU 25 H GLU 25 60.078 -3.553 -4.511 193 HA GLU 25 HA GLU 25 58.227 -3.774 -6.667 194 HB2 GLU 25 HB2 GLU 25 58.408 -1.173 -6.657 195 HB3 GLU 25 HB3 GLU 25 57.602 -1.978 -5.285 196 HG2 GLU 25 HG2 GLU 25 58.875 -0.339 -4.340 197 HG3 GLU 25 HG3 GLU 25 59.987 -1.714 -4.250 198 H ASN 26 H ASN 26 61.640 -3.133 -6.364 199 HA ASN 26 HA ASN 26 62.133 -2.119 -8.897 200 HB2 ASN 26 HB2 ASN 26 63.822 -2.291 -7.067 201 HB3 ASN 26 HB3 ASN 26 63.934 -4.018 -7.384 202 HD21 ASN 26 HD21 ASN 26 64.617 -0.871 -8.523 203 HD22 ASN 26 HD22 ASN 26 65.728 -1.289 -9.780 204 H VAL 27 H VAL 27 61.946 -5.510 -7.891 205 HA VAL 27 HA VAL 27 62.469 -6.421 -10.564 206 HB VAL 27 HB VAL 27 62.003 -8.692 -9.789 207 HG11 VAL 27 HG11 VAL 27 64.211 -7.812 -9.368 208 HG12 VAL 27 HG12 VAL 27 63.730 -8.884 -8.053 209 HG13 VAL 27 HG13 VAL 27 63.675 -7.135 -7.830 210 HG21 VAL 27 HG21 VAL 27 61.165 -7.415 -7.180 211 HG22 VAL 27 HG22 VAL 27 61.378 -9.145 -7.441 212 HG23 VAL 27 HG23 VAL 27 60.116 -8.268 -8.310 213 H ALA 28 H ALA 28 59.677 -5.499 -8.830 214 HA ALA 28 HA ALA 28 57.758 -6.876 -10.487 215 HB1 ALA 28 HB1 ALA 28 57.272 -6.301 -8.122 216 HB2 ALA 28 HB2 ALA 28 56.093 -5.598 -9.225 217 HB3 ALA 28 HB3 ALA 28 57.367 -4.594 -8.537 218 H ALA 29 H ALA 29 59.512 -3.997 -10.515 219 HA ALA 29 HA ALA 29 59.832 -2.328 -11.868 220 HB1 ALA 29 HB1 ALA 29 58.000 -3.621 -13.885 221 HB2 ALA 29 HB2 ALA 29 59.751 -3.897 -13.751 222 HB3 ALA 29 HB3 ALA 29 59.130 -2.290 -14.148 223 H THR 30 H THR 30 58.892 -1.128 -10.293 224 HA THR 30 HA THR 30 56.287 -0.026 -10.794 225 HB THR 30 HB THR 30 57.324 1.230 -8.684 226 HG1 THR 30 HG1 THR 30 59.061 0.069 -7.821 227 HG21 THR 30 HG21 THR 30 56.390 -0.535 -7.286 228 HG22 THR 30 HG22 THR 30 56.429 -1.652 -8.659 229 HG23 THR 30 HG23 THR 30 55.344 -0.252 -8.683 230 H ASP 31 H ASP 31 56.599 2.568 -10.226 231 HA ASP 31 HA ASP 31 59.002 3.504 -11.510 232 HB2 ASP 31 HB2 ASP 31 56.271 4.234 -12.502 233 HB3 ASP 31 HB3 ASP 31 57.703 5.245 -12.729 234 H ASP 32 H ASP 32 56.040 4.712 -9.975 235 HA ASP 32 HA ASP 32 57.273 7.119 -9.187 236 HB2 ASP 32 HB2 ASP 32 54.827 6.935 -9.099 237 HB3 ASP 32 HB3 ASP 32 54.986 5.728 -7.808 238 H VAL 33 H VAL 33 56.618 4.202 -7.346 239 HA VAL 33 HA VAL 33 58.039 5.285 -5.093 240 HB VAL 33 HB VAL 33 56.137 3.680 -4.817 241 HG11 VAL 33 HG11 VAL 33 58.106 1.610 -5.685 242 HG12 VAL 33 HG12 VAL 33 56.626 2.073 -6.530 243 HG13 VAL 33 HG13 VAL 33 56.537 1.274 -4.954 244 HG21 VAL 33 HG21 VAL 33 57.599 4.132 -2.951 245 HG22 VAL 33 HG22 VAL 33 58.698 2.860 -3.485 246 HG23 VAL 33 HG23 VAL 33 57.079 2.447 -2.929 247 H LEU 34 H LEU 34 58.685 3.273 -7.734 248 HA LEU 34 HA LEU 34 61.153 2.152 -7.001 249 HB2 LEU 34 HB2 LEU 34 59.666 1.439 -8.842 250 HB3 LEU 34 HB3 LEU 34 59.921 2.827 -9.699 251 HG LEU 34 HG LEU 34 61.076 0.873 -10.581 252 HD11 LEU 34 HD11 LEU 34 63.188 1.938 -11.078 253 HD12 LEU 34 HD12 LEU 34 62.846 3.139 -9.814 254 HD13 LEU 34 HD13 LEU 34 61.793 3.014 -11.229 255 HD21 LEU 34 HD21 LEU 34 62.847 1.137 -8.167 256 HD22 LEU 34 HD22 LEU 34 63.094 0.033 -9.525 257 HD23 LEU 34 HD23 LEU 34 61.691 -0.155 -8.468 258 H ASP 35 H ASP 35 60.412 5.082 -8.776 259 HA ASP 35 HA ASP 35 63.162 5.871 -8.736 260 HB2 ASP 35 HB2 ASP 35 61.566 6.686 -10.480 261 HB3 ASP 35 HB3 ASP 35 60.749 7.622 -9.240 262 H VAL 36 H VAL 36 60.617 6.186 -6.460 263 HA VAL 36 HA VAL 36 61.845 8.332 -4.967 264 HB VAL 36 HB VAL 36 60.197 6.021 -3.921 265 HG11 VAL 36 HG11 VAL 36 59.771 7.433 -2.040 266 HG12 VAL 36 HG12 VAL 36 60.869 8.656 -2.763 267 HG13 VAL 36 HG13 VAL 36 61.500 7.063 -2.278 268 HG21 VAL 36 HG21 VAL 36 58.973 7.246 -5.462 269 HG22 VAL 36 HG22 VAL 36 59.370 8.769 -4.569 270 HG23 VAL 36 HG23 VAL 36 58.447 7.443 -3.777 271 H LEU 37 H LEU 37 61.799 4.847 -4.751 272 HA LEU 37 HA LEU 37 63.345 4.867 -2.427 273 HB2 LEU 37 HB2 LEU 37 62.915 2.533 -4.222 274 HB3 LEU 37 HB3 LEU 37 63.370 2.646 -2.530 275 HG LEU 37 HG LEU 37 60.655 3.373 -3.566 276 HD11 LEU 37 HD11 LEU 37 60.999 0.964 -3.514 277 HD12 LEU 37 HD12 LEU 37 59.827 1.480 -2.305 278 HD13 LEU 37 HD13 LEU 37 61.461 1.063 -1.812 279 HD21 LEU 37 HD21 LEU 37 61.700 3.385 -0.730 280 HD22 LEU 37 HD22 LEU 37 60.029 3.662 -1.208 281 HD23 LEU 37 HD23 LEU 37 61.279 4.800 -1.696 282 H LEU 38 H LEU 38 64.024 4.202 -5.743 283 HA LEU 38 HA LEU 38 66.664 3.426 -5.338 284 HB2 LEU 38 HB2 LEU 38 65.190 4.574 -7.633 285 HB3 LEU 38 HB3 LEU 38 66.861 4.065 -7.845 286 HG LEU 38 HG LEU 38 64.341 2.508 -7.415 287 HD11 LEU 38 HD11 LEU 38 66.617 2.174 -9.297 288 HD12 LEU 38 HD12 LEU 38 65.091 2.984 -9.661 289 HD13 LEU 38 HD13 LEU 38 65.120 1.244 -9.311 290 HD21 LEU 38 HD21 LEU 38 65.632 0.445 -7.070 291 HD22 LEU 38 HD22 LEU 38 65.811 1.572 -5.735 292 HD23 LEU 38 HD23 LEU 38 67.110 1.393 -6.914 293 H GLU 39 H GLU 39 65.296 6.628 -5.913 294 HA GLU 39 HA GLU 39 67.833 7.923 -5.874 295 HB2 GLU 39 HB2 GLU 39 65.059 8.897 -5.330 296 HB3 GLU 39 HB3 GLU 39 66.471 9.927 -5.365 297 HG2 GLU 39 HG2 GLU 39 65.309 8.329 -7.634 298 HG3 GLU 39 HG3 GLU 39 65.235 10.074 -7.393 299 H HIS 40 H HIS 40 65.339 7.307 -3.497 300 HA HIS 40 HA HIS 40 66.288 8.881 -1.439 301 HB2 HIS 40 HB2 HIS 40 64.053 7.812 -1.627 302 HB3 HIS 40 HB3 HIS 40 64.727 6.277 -1.233 303 HD1 HIS 40 HD1 HIS 40 62.982 8.962 0.340 304 HD2 HIS 40 HD2 HIS 40 66.080 6.433 1.466 305 HE1 HIS 40 HE1 HIS 40 63.067 9.025 2.843 306 H PHE 41 H PHE 41 66.814 5.525 -2.204 307 HA PHE 41 HA PHE 41 68.456 4.803 -0.096 308 HB2 PHE 41 HB2 PHE 41 67.452 3.169 -1.421 309 HB3 PHE 41 HB3 PHE 41 68.081 3.863 -2.905 310 HD1 PHE 41 HD1 PHE 41 69.085 2.233 0.240 311 HD2 PHE 41 HD2 PHE 41 70.038 2.957 -3.813 312 HE1 PHE 41 HE1 PHE 41 70.961 0.640 0.403 313 HE2 PHE 41 HE2 PHE 41 71.915 1.388 -3.641 314 HZ PHE 41 HZ PHE 41 72.374 0.226 -1.546 315 H VAL 42 H VAL 42 69.330 5.934 -3.362 316 HA VAL 42 HA VAL 42 72.073 5.940 -2.698 317 HB VAL 42 HB VAL 42 71.335 5.569 -4.974 318 HG11 VAL 42 HG11 VAL 42 69.560 6.865 -5.179 319 HG12 VAL 42 HG12 VAL 42 70.746 7.147 -6.452 320 HG13 VAL 42 HG13 VAL 42 70.523 8.376 -5.156 321 HG21 VAL 42 HG21 VAL 42 72.986 6.920 -6.175 322 HG22 VAL 42 HG22 VAL 42 73.625 6.246 -4.674 323 HG23 VAL 42 HG23 VAL 42 73.149 7.942 -4.748 324 H LYS 43 H LYS 43 69.723 8.395 -2.457 325 HA LYS 43 HA LYS 43 71.649 10.490 -2.063 326 HB2 LYS 43 HB2 LYS 43 69.894 11.943 -1.373 327 HB3 LYS 43 HB3 LYS 43 69.201 10.918 -2.616 328 HG2 LYS 43 HG2 LYS 43 68.171 9.514 -0.725 329 HG3 LYS 43 HG3 LYS 43 68.807 10.722 0.354 330 HD2 LYS 43 HD2 LYS 43 66.945 11.455 -1.887 331 HD3 LYS 43 HD3 LYS 43 66.395 11.040 -0.268 332 HE2 LYS 43 HE2 LYS 43 67.553 12.889 0.691 333 HE3 LYS 43 HE3 LYS 43 68.394 13.240 -0.818 334 HZ1 LYS 43 HZ1 LYS 43 66.297 13.843 -1.805 335 HZ2 LYS 43 HZ2 LYS 43 66.500 14.739 -0.394 336 HZ3 LYS 43 HZ3 LYS 43 65.468 13.415 -0.420 337 H ILE 44 H ILE 44 70.104 8.329 0.213 338 HA ILE 44 HA ILE 44 71.268 9.731 2.443 339 HB ILE 44 HB ILE 44 70.421 7.821 3.824 340 HG12 ILE 44 HG12 ILE 44 69.376 6.837 1.159 341 HG13 ILE 44 HG13 ILE 44 70.588 6.033 2.134 342 HG21 ILE 44 HG21 ILE 44 69.050 9.804 3.415 343 HG22 ILE 44 HG22 ILE 44 68.050 8.358 3.525 344 HG23 ILE 44 HG23 ILE 44 68.407 9.063 1.950 345 HD11 ILE 44 HD11 ILE 44 68.379 4.985 2.289 346 HD12 ILE 44 HD12 ILE 44 67.730 6.494 2.931 347 HD13 ILE 44 HD13 ILE 44 68.935 5.597 3.847 348 H THR 45 H THR 45 72.158 7.032 0.454 349 HA THR 45 HA THR 45 74.311 6.269 2.212 350 HB THR 45 HB THR 45 74.893 4.666 0.410 351 HG1 THR 45 HG1 THR 45 72.488 5.268 -0.895 352 HG21 THR 45 HG21 THR 45 71.990 4.721 1.188 353 HG22 THR 45 HG22 THR 45 73.309 4.061 2.158 354 HG23 THR 45 HG23 THR 45 72.881 3.314 0.613 355 H GLU 46 H GLU 46 73.851 7.889 -0.854 356 HA GLU 46 HA GLU 46 74.998 9.146 -2.165 357 HB2 GLU 46 HB2 GLU 46 76.771 9.494 0.223 358 HB3 GLU 46 HB3 GLU 46 76.942 10.470 -1.252 359 HG2 GLU 46 HG2 GLU 46 74.539 11.115 -0.881 360 HG3 GLU 46 HG3 GLU 46 74.646 10.310 0.667 361 H HIS 47 H HIS 47 75.374 6.386 -1.949 362 HA HIS 47 HA HIS 47 78.098 5.807 -2.657 363 HB2 HIS 47 HB2 HIS 47 76.551 4.169 -1.482 364 HB3 HIS 47 HB3 HIS 47 75.642 4.039 -2.982 365 HD1 HIS 47 HD1 HIS 47 76.485 2.241 -4.610 366 HD2 HIS 47 HD2 HIS 47 79.258 3.284 -1.718 367 HE1 HIS 47 HE1 HIS 47 78.520 0.796 -4.994 368 HA PRO 48 HA PRO 48 77.543 7.170 -6.917 369 HB2 PRO 48 HB2 PRO 48 79.543 5.157 -7.616 370 HB3 PRO 48 HB3 PRO 48 79.592 6.908 -7.841 371 HG2 PRO 48 HG2 PRO 48 81.043 5.561 -6.111 372 HG3 PRO 48 HG3 PRO 48 80.419 7.172 -5.625 373 HD2 PRO 48 HD2 PRO 48 79.481 4.405 -4.971 374 HD3 PRO 48 HD3 PRO 48 79.587 5.795 -3.888 375 H ASP 49 H ASP 49 77.173 3.978 -5.959 376 HA ASP 49 HA ASP 49 76.300 3.270 -8.554 377 HB2 ASP 49 HB2 ASP 49 77.867 1.488 -6.671 378 HB3 ASP 49 HB3 ASP 49 77.171 0.939 -8.181 379 H GLY 50 H GLY 50 74.976 4.330 -6.292 380 HA2 GLY 50 HA2 GLY 50 73.726 2.828 -4.288 381 HA3 GLY 50 HA3 GLY 50 72.994 4.094 -5.221 382 H THR 51 H THR 51 72.555 3.255 -7.433 383 HA THR 51 HA THR 51 70.369 1.562 -6.716 384 HB THR 51 HB THR 51 70.741 2.149 -9.576 385 HG1 THR 51 HG1 THR 51 69.826 4.395 -8.404 386 HG21 THR 51 HG21 THR 51 68.539 2.666 -7.569 387 HG22 THR 51 HG22 THR 51 68.690 1.231 -8.546 388 HG23 THR 51 HG23 THR 51 68.421 2.800 -9.315 389 H ALA 52 H ALA 52 73.349 1.220 -8.489 390 HA ALA 52 HA ALA 52 72.904 -1.308 -9.689 391 HB1 ALA 52 HB1 ALA 52 74.740 0.232 -10.326 392 HB2 ALA 52 HB2 ALA 52 75.299 -1.397 -9.960 393 HB3 ALA 52 HB3 ALA 52 75.512 -0.104 -8.777 394 H LEU 53 H LEU 53 74.012 -0.381 -6.508 395 HA LEU 53 HA LEU 53 74.667 -2.979 -5.647 396 HB2 LEU 53 HB2 LEU 53 73.621 -0.691 -4.030 397 HB3 LEU 53 HB3 LEU 53 74.175 -2.201 -3.338 398 HG LEU 53 HG LEU 53 75.797 -0.117 -4.774 399 HD11 LEU 53 HD11 LEU 53 75.349 0.282 -2.454 400 HD12 LEU 53 HD12 LEU 53 77.050 -0.111 -2.702 401 HD13 LEU 53 HD13 LEU 53 75.951 -1.321 -2.032 402 HD21 LEU 53 HD21 LEU 53 76.572 -2.261 -5.603 403 HD22 LEU 53 HD22 LEU 53 76.644 -2.897 -3.959 404 HD23 LEU 53 HD23 LEU 53 77.742 -1.606 -4.456 405 H ILE 54 H ILE 54 71.555 -1.360 -5.561 406 HA ILE 54 HA ILE 54 70.355 -3.632 -4.270 407 HB ILE 54 HB ILE 54 68.892 -1.442 -5.798 408 HG12 ILE 54 HG12 ILE 54 69.180 -1.932 -2.839 409 HG13 ILE 54 HG13 ILE 54 70.152 -0.761 -3.701 410 HG21 ILE 54 HG21 ILE 54 67.547 -3.483 -5.749 411 HG22 ILE 54 HG22 ILE 54 66.866 -2.250 -4.682 412 HG23 ILE 54 HG23 ILE 54 67.776 -3.596 -4.003 413 HD11 ILE 54 HD11 ILE 54 68.077 0.407 -4.328 414 HD12 ILE 54 HD12 ILE 54 68.386 0.335 -2.595 415 HD13 ILE 54 HD13 ILE 54 67.199 -0.750 -3.319 416 H TYR 55 H TYR 55 70.650 -2.611 -7.554 417 HA TYR 55 HA TYR 55 69.180 -4.621 -8.789 418 HB2 TYR 55 HB2 TYR 55 71.309 -2.762 -9.577 419 HB3 TYR 55 HB3 TYR 55 71.032 -4.108 -10.652 420 HD1 TYR 55 HD1 TYR 55 68.792 -4.308 -11.769 421 HD2 TYR 55 HD2 TYR 55 69.785 -0.945 -9.381 422 HE1 TYR 55 HE1 TYR 55 66.918 -3.059 -12.751 423 HE2 TYR 55 HE2 TYR 55 67.933 0.312 -10.349 424 HH TYR 55 HH TYR 55 65.487 -1.167 -12.237 425 H GLU 56 H GLU 56 72.660 -4.562 -7.979 426 HA GLU 56 HA GLU 56 73.037 -7.183 -8.928 427 HB2 GLU 56 HB2 GLU 56 75.182 -7.199 -7.623 428 HB3 GLU 56 HB3 GLU 56 75.022 -5.884 -8.773 429 HG2 GLU 56 HG2 GLU 56 74.763 -4.323 -7.164 430 HG3 GLU 56 HG3 GLU 56 74.317 -5.444 -5.900 431 H ALA 57 H ALA 57 72.101 -5.913 -5.806 432 HA ALA 57 HA ALA 57 72.444 -8.217 -4.266 433 HB1 ALA 57 HB1 ALA 57 70.213 -6.206 -4.014 434 HB2 ALA 57 HB2 ALA 57 71.827 -6.024 -3.339 435 HB3 ALA 57 HB3 ALA 57 70.772 -7.313 -2.756 436 H ALA 58 H ALA 58 69.760 -7.228 -6.312 437 HA ALA 58 HA ALA 58 68.019 -9.332 -5.777 438 HB1 ALA 58 HB1 ALA 58 68.416 -7.880 -8.398 439 HB2 ALA 58 HB2 ALA 58 67.376 -7.348 -7.076 440 HB3 ALA 58 HB3 ALA 58 67.000 -8.833 -7.951 441 H ALA 59 H ALA 59 70.557 -9.078 -8.220 442 HA ALA 59 HA ALA 59 70.175 -11.686 -9.288 443 HB1 ALA 59 HB1 ALA 59 71.261 -9.903 -10.568 444 HB2 ALA 59 HB2 ALA 59 72.297 -11.327 -10.447 445 HB3 ALA 59 HB3 ALA 59 72.616 -9.915 -9.440 446 H ARG 60 H ARG 60 72.351 -10.371 -6.872 447 HA ARG 60 HA ARG 60 73.916 -12.683 -6.441 448 HB2 ARG 60 HB2 ARG 60 73.372 -10.304 -4.659 449 HB3 ARG 60 HB3 ARG 60 74.525 -11.569 -4.261 450 HG2 ARG 60 HG2 ARG 60 75.912 -11.002 -6.110 451 HG3 ARG 60 HG3 ARG 60 74.690 -9.919 -6.773 452 HD2 ARG 60 HD2 ARG 60 76.495 -8.665 -5.674 453 HD3 ARG 60 HD3 ARG 60 74.955 -8.418 -4.863 454 HE ARG 60 HE ARG 60 76.311 -10.520 -3.605 455 HH11 ARG 60 HH11 ARG 60 76.746 -6.985 -4.024 456 HH12 ARG 60 HH12 ARG 60 77.497 -6.824 -2.503 457 HH21 ARG 60 HH21 ARG 60 77.314 -10.164 -1.496 458 HH22 ARG 60 HH22 ARG 60 77.833 -8.598 -1.086 459 H ALA 61 H ALA 61 70.875 -11.626 -5.014 460 HA ALA 61 HA ALA 61 70.854 -13.799 -3.117 461 HB1 ALA 61 HB1 ALA 61 68.572 -13.066 -2.604 462 HB2 ALA 61 HB2 ALA 61 68.600 -11.979 -3.993 463 HB3 ALA 61 HB3 ALA 61 69.678 -11.694 -2.626 464 H ALA 62 H ALA 62 69.692 -13.251 -6.326 465 HA ALA 62 HA ALA 62 67.963 -15.512 -6.425 466 HB1 ALA 62 HB1 ALA 62 69.249 -13.988 -8.690 467 HB2 ALA 62 HB2 ALA 62 67.699 -13.601 -7.943 468 HB3 ALA 62 HB3 ALA 62 67.898 -15.112 -8.834 469 H ALA 63 H ALA 63 71.252 -14.902 -7.542 470 HA ALA 63 HA ALA 63 71.652 -17.785 -7.485 471 HB1 ALA 63 HB1 ALA 63 72.763 -15.888 -9.558 472 HB2 ALA 63 HB2 ALA 63 71.512 -17.101 -9.835 473 HB3 ALA 63 HB3 ALA 63 73.155 -17.601 -9.428 474 H ASN 64 H ASN 64 72.310 -17.313 -5.371 475 HA ASN 64 HA ASN 64 74.454 -15.635 -4.693 476 HB2 ASN 64 HB2 ASN 64 72.748 -16.400 -3.114 477 HB3 ASN 64 HB3 ASN 64 73.312 -18.053 -3.269 478 HD21 ASN 64 HD21 ASN 64 73.025 -16.233 -0.995 479 HD22 ASN 64 HD22 ASN 64 74.547 -16.232 -0.187 480 HA PRO 65 HA PRO 65 77.606 -18.303 -6.421 481 HB2 PRO 65 HB2 PRO 65 79.650 -16.577 -6.249 482 HB3 PRO 65 HB3 PRO 65 78.357 -16.389 -7.439 483 HG2 PRO 65 HG2 PRO 65 78.765 -14.965 -4.843 484 HG3 PRO 65 HG3 PRO 65 78.207 -14.324 -6.394 485 HD2 PRO 65 HD2 PRO 65 76.550 -14.984 -4.293 486 HD3 PRO 65 HD3 PRO 65 76.038 -14.921 -5.990 487 H GLY 66 H GLY 66 77.511 -17.177 -3.169 488 HA2 GLY 66 HA2 GLY 66 78.364 -18.916 -1.565 489 HA3 GLY 66 HA3 GLY 66 79.821 -18.902 -2.541 490 H GLY 67 H GLY 67 80.478 -18.561 -0.170 491 HA2 GLY 67 HA2 GLY 67 81.864 -17.054 0.936 492 HA3 GLY 67 HA3 GLY 67 81.177 -15.795 -0.107 493 H ASP 68 H ASP 68 79.179 -14.969 0.360 494 HA ASP 68 HA ASP 68 77.894 -15.618 2.906 495 HB2 ASP 68 HB2 ASP 68 79.449 -13.653 3.342 496 HB3 ASP 68 HB3 ASP 68 78.554 -12.745 2.129 497 H GLY 69 H GLY 69 77.938 -13.755 -0.073 498 HA2 GLY 69 HA2 GLY 69 76.342 -14.332 -1.757 499 HA3 GLY 69 HA3 GLY 69 75.158 -14.557 -0.480 500 H GLY 70 H GLY 70 73.657 -13.126 -1.118 501 HA2 GLY 70 HA2 GLY 70 74.315 -10.393 -0.674 502 HA3 GLY 70 HA3 GLY 70 73.825 -10.780 -2.327 503 H GLY 71 H GLY 71 72.326 -9.022 -0.755 504 HA2 GLY 71 HA2 GLY 71 69.837 -9.682 -1.133 505 HA3 GLY 71 HA3 GLY 71 70.174 -10.382 0.452 506 HA PRO 72 HA PRO 72 69.094 -5.817 0.713 507 HB2 PRO 72 HB2 PRO 72 67.555 -6.291 2.990 508 HB3 PRO 72 HB3 PRO 72 66.960 -5.995 1.361 509 HG2 PRO 72 HG2 PRO 72 67.256 -8.543 2.847 510 HG3 PRO 72 HG3 PRO 72 66.134 -8.143 1.547 511 HD2 PRO 72 HD2 PRO 72 68.321 -9.737 1.239 512 HD3 PRO 72 HD3 PRO 72 67.654 -8.810 -0.102 513 H GLU 73 H GLU 73 69.720 -8.151 3.269 514 HA GLU 73 HA GLU 73 70.895 -6.149 5.033 515 HB2 GLU 73 HB2 GLU 73 70.475 -9.136 5.398 516 HB3 GLU 73 HB3 GLU 73 70.917 -7.972 6.648 517 HG2 GLU 73 HG2 GLU 73 68.817 -6.840 6.432 518 HG3 GLU 73 HG3 GLU 73 68.390 -7.814 5.046 519 H GLY 74 H GLY 74 71.980 -7.794 2.469 520 HA2 GLY 74 HA2 GLY 74 74.589 -7.672 3.690 521 HA3 GLY 74 HA3 GLY 74 74.307 -8.718 2.243 522 H ILE 75 H ILE 75 72.799 -6.322 1.085 523 HA ILE 75 HA ILE 75 75.027 -4.892 0.013 524 HB ILE 75 HB ILE 75 73.145 -3.149 -0.567 525 HG12 ILE 75 HG12 ILE 75 71.538 -5.677 -0.243 526 HG13 ILE 75 HG13 ILE 75 71.515 -4.352 0.908 527 HG21 ILE 75 HG21 ILE 75 73.475 -5.795 -1.927 528 HG22 ILE 75 HG22 ILE 75 74.433 -4.317 -2.140 529 HG23 ILE 75 HG23 ILE 75 72.737 -4.338 -2.624 530 HD11 ILE 75 HD11 ILE 75 70.645 -4.205 -1.969 531 HD12 ILE 75 HD12 ILE 75 70.641 -2.910 -0.735 532 HD13 ILE 75 HD13 ILE 75 69.616 -4.317 -0.519 533 H VAL 76 H VAL 76 72.922 -4.378 2.756 534 HA VAL 76 HA VAL 76 73.460 -1.771 3.218 535 HB VAL 76 HB VAL 76 72.902 -2.333 5.462 536 HG11 VAL 76 HG11 VAL 76 71.019 -3.747 3.677 537 HG12 VAL 76 HG12 VAL 76 71.279 -2.038 3.605 538 HG13 VAL 76 HG13 VAL 76 70.628 -2.752 5.094 539 HG21 VAL 76 HG21 VAL 76 72.152 -4.529 6.137 540 HG22 VAL 76 HG22 VAL 76 73.884 -4.458 5.779 541 HG23 VAL 76 HG23 VAL 76 72.768 -5.164 4.609 542 H LYS 77 H LYS 77 75.155 -4.611 3.965 543 HA LYS 77 HA LYS 77 77.250 -3.618 5.524 544 HB2 LYS 77 HB2 LYS 77 76.957 -5.989 5.423 545 HB3 LYS 77 HB3 LYS 77 76.959 -5.937 3.669 546 HG2 LYS 77 HG2 LYS 77 79.341 -5.540 3.638 547 HG3 LYS 77 HG3 LYS 77 79.375 -5.509 5.402 548 HD2 LYS 77 HD2 LYS 77 78.940 -7.778 5.601 549 HD3 LYS 77 HD3 LYS 77 78.208 -7.877 4.005 550 HE2 LYS 77 HE2 LYS 77 80.415 -9.001 4.164 551 HE3 LYS 77 HE3 LYS 77 80.345 -7.746 2.939 552 HZ1 LYS 77 HZ1 LYS 77 81.562 -7.430 5.641 553 HZ2 LYS 77 HZ2 LYS 77 81.562 -6.278 4.377 554 HZ3 LYS 77 HZ3 LYS 77 82.384 -7.714 4.192 555 H GLU 78 H GLU 78 77.054 -4.116 1.991 556 HA GLU 78 HA GLU 78 79.581 -3.133 1.281 557 HB2 GLU 78 HB2 GLU 78 77.953 -4.338 -0.226 558 HB3 GLU 78 HB3 GLU 78 76.994 -2.885 -0.347 559 HG2 GLU 78 HG2 GLU 78 78.274 -2.972 -2.270 560 HG3 GLU 78 HG3 GLU 78 79.021 -1.745 -1.240 561 H ILE 79 H ILE 79 76.492 -1.572 1.738 562 HA ILE 79 HA ILE 79 77.175 1.020 1.061 563 HB ILE 79 HB ILE 79 75.035 -0.113 2.839 564 HG12 ILE 79 HG12 ILE 79 74.796 -0.485 0.434 565 HG13 ILE 79 HG13 ILE 79 73.524 0.565 1.043 566 HG21 ILE 79 HG21 ILE 79 75.349 2.800 2.186 567 HG22 ILE 79 HG22 ILE 79 75.499 2.055 3.776 568 HG23 ILE 79 HG23 ILE 79 73.940 2.060 2.949 569 HD11 ILE 79 HD11 ILE 79 74.271 1.404 -1.062 570 HD12 ILE 79 HD12 ILE 79 75.950 1.381 -0.536 571 HD13 ILE 79 HD13 ILE 79 74.814 2.517 0.195 572 H LYS 80 H LYS 80 77.256 -0.613 4.234 573 HA LYS 80 HA LYS 80 77.987 1.784 5.546 574 HB2 LYS 80 HB2 LYS 80 78.036 0.526 7.643 575 HB3 LYS 80 HB3 LYS 80 76.714 -0.018 6.627 576 HG2 LYS 80 HG2 LYS 80 77.843 -1.970 6.045 577 HG3 LYS 80 HG3 LYS 80 79.240 -1.531 7.032 578 HD2 LYS 80 HD2 LYS 80 77.875 -1.439 9.041 579 HD3 LYS 80 HD3 LYS 80 76.414 -1.726 8.111 580 HE2 LYS 80 HE2 LYS 80 77.241 -3.973 7.554 581 HE3 LYS 80 HE3 LYS 80 78.684 -3.665 8.525 582 HZ1 LYS 80 HZ1 LYS 80 75.912 -3.558 9.616 583 HZ2 LYS 80 HZ2 LYS 80 77.358 -3.519 10.484 584 HZ3 LYS 80 HZ3 LYS 80 76.899 -4.916 9.683 585 H GLU 81 H GLU 81 79.806 -0.924 4.318 586 HA GLU 81 HA GLU 81 82.202 -0.134 5.552 587 HB2 GLU 81 HB2 GLU 81 81.793 -1.857 3.124 588 HB3 GLU 81 HB3 GLU 81 83.298 -1.708 4.024 589 HG2 GLU 81 HG2 GLU 81 82.125 -2.571 6.021 590 HG3 GLU 81 HG3 GLU 81 80.701 -2.831 5.018 591 H TRP 82 H TRP 82 80.695 0.718 2.528 592 HA TRP 82 HA TRP 82 82.926 1.964 1.337 593 HB2 TRP 82 HB2 TRP 82 80.797 1.345 0.164 594 HB3 TRP 82 HB3 TRP 82 80.027 2.708 0.965 595 HD1 TRP 82 HD1 TRP 82 82.700 1.919 -1.665 596 HE1 TRP 82 HE1 TRP 82 82.973 3.946 -3.202 597 HE3 TRP 82 HE3 TRP 82 79.719 5.239 0.839 598 HZ2 TRP 82 HZ2 TRP 82 82.029 6.598 -3.370 599 HZ3 TRP 82 HZ3 TRP 82 79.467 7.509 -0.076 600 HH2 TRP 82 HH2 TRP 82 80.605 8.176 -2.131 601 H ARG 83 H ARG 83 80.303 3.256 3.355 602 HA ARG 83 HA ARG 83 81.381 5.881 3.355 603 HB2 ARG 83 HB2 ARG 83 79.300 4.589 5.058 604 HB3 ARG 83 HB3 ARG 83 80.038 6.073 5.627 605 HG2 ARG 83 HG2 ARG 83 78.240 6.914 4.565 606 HG3 ARG 83 HG3 ARG 83 79.384 6.937 3.230 607 HD2 ARG 83 HD2 ARG 83 77.216 6.083 2.513 608 HD3 ARG 83 HD3 ARG 83 78.382 4.791 2.399 609 HE ARG 83 HE ARG 83 77.432 3.719 4.086 610 HH11 ARG 83 HH11 ARG 83 75.925 6.857 3.556 611 HH12 ARG 83 HH12 ARG 83 74.634 6.666 4.613 612 HH21 ARG 83 HH21 ARG 83 75.658 3.327 5.617 613 HH22 ARG 83 HH22 ARG 83 74.476 4.519 5.867 614 H ALA 84 H ALA 84 81.781 3.153 5.486 615 HA ALA 84 HA ALA 84 83.211 4.385 7.515 616 HB1 ALA 84 HB1 ALA 84 83.937 2.155 8.111 617 HB2 ALA 84 HB2 ALA 84 83.503 1.572 6.508 618 HB3 ALA 84 HB3 ALA 84 82.245 2.124 7.611 619 H ALA 85 H ALA 85 84.303 3.012 4.461 620 HA ALA 85 HA ALA 85 87.061 3.128 4.934 621 HB1 ALA 85 HB1 ALA 85 86.063 1.849 3.100 622 HB2 ALA 85 HB2 ALA 85 87.319 2.945 2.520 623 HB3 ALA 85 HB3 ALA 85 85.620 3.355 2.302 624 H ASN 86 H ASN 86 84.849 5.552 3.692 625 HA ASN 86 HA ASN 86 87.070 7.379 3.218 626 HB2 ASN 86 HB2 ASN 86 85.027 7.430 1.710 627 HB3 ASN 86 HB3 ASN 86 84.125 8.040 3.082 628 HD21 ASN 86 HD21 ASN 86 83.676 9.960 1.973 629 HD22 ASN 86 HD22 ASN 86 84.857 11.202 1.789 630 H GLY 87 H GLY 87 84.485 6.970 5.528 631 HA2 GLY 87 HA2 GLY 87 84.835 7.737 7.806 632 HA3 GLY 87 HA3 GLY 87 85.682 9.133 7.137 633 H LYS 88 H LYS 88 82.785 7.837 5.700 634 HA LYS 88 HA LYS 88 81.400 10.307 6.117 635 HB2 LYS 88 HB2 LYS 88 81.256 7.909 4.381 636 HB3 LYS 88 HB3 LYS 88 79.841 8.895 4.590 637 HG2 LYS 88 HG2 LYS 88 81.051 10.808 3.644 638 HG3 LYS 88 HG3 LYS 88 82.507 9.812 3.512 639 HD2 LYS 88 HD2 LYS 88 81.513 8.402 1.895 640 HD3 LYS 88 HD3 LYS 88 79.907 9.041 2.197 641 HE2 LYS 88 HE2 LYS 88 82.215 10.547 0.963 642 HE3 LYS 88 HE3 LYS 88 80.852 9.857 0.087 643 HZ1 LYS 88 HZ1 LYS 88 80.427 12.175 0.421 644 HZ2 LYS 88 HZ2 LYS 88 80.818 12.100 2.030 645 HZ3 LYS 88 HZ3 LYS 88 79.405 11.355 1.484 646 HA PRO 89 HA PRO 89 78.751 8.444 9.218 647 HB2 PRO 89 HB2 PRO 89 76.407 9.621 7.844 648 HB3 PRO 89 HB3 PRO 89 76.987 9.885 9.492 649 HG2 PRO 89 HG2 PRO 89 77.280 11.768 7.636 650 HG3 PRO 89 HG3 PRO 89 78.552 11.460 8.833 651 HD2 PRO 89 HD2 PRO 89 78.399 10.582 5.968 652 HD3 PRO 89 HD3 PRO 89 79.774 11.251 6.875 653 H GLY 90 H GLY 90 78.032 6.479 9.434 654 HA2 GLY 90 HA2 GLY 90 76.881 5.126 7.122 655 HA3 GLY 90 HA3 GLY 90 77.597 4.339 8.533 656 H PHE 91 H PHE 91 76.022 3.227 9.526 657 HA PHE 91 HA PHE 91 73.326 4.365 9.542 658 HB2 PHE 91 HB2 PHE 91 74.216 1.604 10.422 659 HB3 PHE 91 HB3 PHE 91 72.569 2.178 10.251 660 HD1 PHE 91 HD1 PHE 91 72.164 3.253 7.790 661 HD2 PHE 91 HD2 PHE 91 74.916 0.186 8.800 662 HE1 PHE 91 HE1 PHE 91 72.118 2.428 5.477 663 HE2 PHE 91 HE2 PHE 91 74.867 -0.629 6.485 664 HZ PHE 91 HZ PHE 91 73.476 0.499 4.831 665 H LYS 92 H LYS 92 72.152 4.544 11.512 666 HA LYS 92 HA LYS 92 73.831 4.996 13.769 667 HB2 LYS 92 HB2 LYS 92 71.922 5.980 14.726 668 HB3 LYS 92 HB3 LYS 92 72.038 6.555 13.102 669 HG2 LYS 92 HG2 LYS 92 70.194 5.242 12.396 670 HG3 LYS 92 HG3 LYS 92 70.256 4.277 13.879 671 HD2 LYS 92 HD2 LYS 92 69.676 7.233 13.868 672 HD3 LYS 92 HD3 LYS 92 68.407 6.007 13.786 673 HE2 LYS 92 HE2 LYS 92 69.119 5.107 15.927 674 HE3 LYS 92 HE3 LYS 92 70.461 6.238 16.002 675 HZ1 LYS 92 HZ1 LYS 92 68.905 8.047 16.120 676 HZ2 LYS 92 HZ2 LYS 92 68.552 6.940 17.344 677 HZ3 LYS 92 HZ3 LYS 92 67.594 7.006 15.988 678 H GLN 93 H GLN 93 72.845 4.165 15.857 679 HA GLN 93 HA GLN 93 72.275 1.363 15.470 680 HB2 GLN 93 HB2 GLN 93 73.499 3.045 17.472 681 HB3 GLN 93 HB3 GLN 93 72.830 1.518 18.035 682 HG2 GLN 93 HG2 GLN 93 75.223 1.210 17.634 683 HG3 GLN 93 HG3 GLN 93 74.344 0.351 16.382 684 HE21 GLN 93 HE21 GLN 93 74.527 1.054 14.256 685 HE22 GLN 93 HE22 GLN 93 75.674 2.221 13.753 686 H GLY 94 H GLY 94 70.512 0.524 16.226 687 HA2 GLY 94 HA2 GLY 94 68.795 1.444 18.160 688 HA3 GLY 94 HA3 GLY 94 68.254 2.110 16.614 Start of MODEL 29 1 H GLU 2 H GLU 2 61.949 1.923 9.246 2 HA GLU 2 HA GLU 2 59.571 3.053 7.934 3 HB2 GLU 2 HB2 GLU 2 59.696 3.375 10.400 4 HB3 GLU 2 HB3 GLU 2 61.318 4.018 10.218 5 HG2 GLU 2 HG2 GLU 2 59.700 5.798 10.528 6 HG3 GLU 2 HG3 GLU 2 60.435 5.881 8.930 7 H LEU 3 H LEU 3 60.030 4.834 6.609 8 HA LEU 3 HA LEU 3 62.777 4.782 5.629 9 HB2 LEU 3 HB2 LEU 3 60.364 6.181 4.511 10 HB3 LEU 3 HB3 LEU 3 61.911 6.024 3.695 11 HG LEU 3 HG LEU 3 59.889 3.854 4.247 12 HD11 LEU 3 HD11 LEU 3 61.039 4.845 1.625 13 HD12 LEU 3 HD12 LEU 3 59.405 5.119 2.216 14 HD13 LEU 3 HD13 LEU 3 59.952 3.486 1.854 15 HD21 LEU 3 HD21 LEU 3 62.708 3.552 3.257 16 HD22 LEU 3 HD22 LEU 3 61.484 2.283 3.191 17 HD23 LEU 3 HD23 LEU 3 62.030 2.905 4.751 18 H LYS 4 H LYS 4 64.114 6.334 6.030 19 HA LYS 4 HA LYS 4 63.264 8.428 7.869 20 HB2 LYS 4 HB2 LYS 4 66.056 7.652 7.068 21 HB3 LYS 4 HB3 LYS 4 65.562 8.600 8.460 22 HG2 LYS 4 HG2 LYS 4 65.300 5.658 7.969 23 HG3 LYS 4 HG3 LYS 4 66.186 6.452 9.253 24 HD2 LYS 4 HD2 LYS 4 63.803 7.379 9.797 25 HD3 LYS 4 HD3 LYS 4 63.310 5.958 8.915 26 HE2 LYS 4 HE2 LYS 4 64.950 4.626 10.363 27 HE3 LYS 4 HE3 LYS 4 65.048 6.040 11.367 28 HZ1 LYS 4 HZ1 LYS 4 62.481 5.801 11.585 29 HZ2 LYS 4 HZ2 LYS 4 63.531 4.829 12.433 30 HZ3 LYS 4 HZ3 LYS 4 62.805 4.178 11.080 31 H ASN 5 H ASN 5 65.300 10.220 7.507 32 HA ASN 5 HA ASN 5 64.869 11.216 4.774 33 HB2 ASN 5 HB2 ASN 5 65.323 13.432 5.528 34 HB3 ASN 5 HB3 ASN 5 64.228 12.724 6.715 35 HD21 ASN 5 HD21 ASN 5 65.067 12.213 8.800 36 HD22 ASN 5 HD22 ASN 5 66.531 12.914 9.359 37 H SER 6 H SER 6 67.300 10.317 7.113 38 HA SER 6 HA SER 6 69.387 10.701 5.084 39 HB2 SER 6 HB2 SER 6 70.895 11.354 6.887 40 HB3 SER 6 HB3 SER 6 69.537 12.473 6.756 41 HG SER 6 HG SER 6 68.983 11.980 8.706 42 H ILE 7 H ILE 7 71.341 9.391 5.604 43 HA ILE 7 HA ILE 7 70.744 6.659 6.047 44 HB ILE 7 HB ILE 7 72.595 7.580 4.611 45 HG12 ILE 7 HG12 ILE 7 74.341 5.859 5.276 46 HG13 ILE 7 HG13 ILE 7 73.341 5.525 6.690 47 HG21 ILE 7 HG21 ILE 7 73.444 9.303 6.027 48 HG22 ILE 7 HG22 ILE 7 74.737 8.177 5.613 49 HG23 ILE 7 HG23 ILE 7 73.989 8.115 7.210 50 HD11 ILE 7 HD11 ILE 7 71.555 4.788 5.270 51 HD12 ILE 7 HD12 ILE 7 73.074 3.980 4.814 52 HD13 ILE 7 HD13 ILE 7 72.460 5.309 3.847 53 H SER 8 H SER 8 71.616 9.282 8.109 54 HA SER 8 HA SER 8 72.882 7.763 10.151 55 HB2 SER 8 HB2 SER 8 71.902 10.612 10.151 56 HB3 SER 8 HB3 SER 8 73.068 9.897 11.271 57 HG SER 8 HG SER 8 74.116 9.302 9.095 58 H ASP 9 H ASP 9 69.637 8.324 9.346 59 HA ASP 9 HA ASP 9 68.749 7.956 12.136 60 HB2 ASP 9 HB2 ASP 9 67.560 9.658 10.416 61 HB3 ASP 9 HB3 ASP 9 66.945 8.189 9.771 62 H TYR 10 H TYR 10 69.876 6.118 9.844 63 HA TYR 10 HA TYR 10 67.725 4.133 9.811 64 HB2 TYR 10 HB2 TYR 10 69.935 4.730 7.885 65 HB3 TYR 10 HB3 TYR 10 69.418 3.062 8.050 66 HD1 TYR 10 HD1 TYR 10 67.033 2.498 7.573 67 HD2 TYR 10 HD2 TYR 10 68.685 6.276 6.570 68 HE1 TYR 10 HE1 TYR 10 65.189 2.864 6.006 69 HE2 TYR 10 HE2 TYR 10 66.831 6.668 4.980 70 HH TYR 10 HH TYR 10 65.117 5.468 3.776 71 H THR 11 H THR 11 67.945 2.540 11.205 72 HA THR 11 HA THR 11 70.530 1.875 12.244 73 HB THR 11 HB THR 11 69.345 0.040 13.389 74 HG1 THR 11 HG1 THR 11 66.914 0.088 13.016 75 HG21 THR 11 HG21 THR 11 67.705 1.327 14.699 76 HG22 THR 11 HG22 THR 11 67.776 2.619 13.496 77 HG23 THR 11 HG23 THR 11 69.203 2.217 14.454 78 H GLU 12 H GLU 12 71.212 -0.509 11.895 79 HA GLU 12 HA GLU 12 71.385 -0.874 9.144 80 HB2 GLU 12 HB2 GLU 12 72.263 -3.207 9.758 81 HB3 GLU 12 HB3 GLU 12 73.169 -1.793 10.269 82 HG2 GLU 12 HG2 GLU 12 72.227 -1.984 12.483 83 HG3 GLU 12 HG3 GLU 12 71.304 -3.392 12.042 84 H ALA 13 H ALA 13 69.197 -2.406 11.448 85 HA ALA 13 HA ALA 13 68.006 -4.049 9.439 86 HB1 ALA 13 HB1 ALA 13 66.262 -4.526 11.077 87 HB2 ALA 13 HB2 ALA 13 66.818 -3.193 12.089 88 HB3 ALA 13 HB3 ALA 13 67.847 -4.606 11.847 89 H GLU 14 H GLU 14 67.177 -0.791 10.713 90 HA GLU 14 HA GLU 14 64.802 -0.449 9.243 91 HB2 GLU 14 HB2 GLU 14 66.870 1.471 10.248 92 HB3 GLU 14 HB3 GLU 14 65.585 2.066 9.214 93 HG2 GLU 14 HG2 GLU 14 65.140 0.584 11.793 94 HG3 GLU 14 HG3 GLU 14 65.185 2.342 11.650 95 H PHE 15 H PHE 15 68.149 -0.118 8.374 96 HA PHE 15 HA PHE 15 67.632 0.971 5.833 97 HB2 PHE 15 HB2 PHE 15 69.882 0.990 7.149 98 HB3 PHE 15 HB3 PHE 15 70.070 -0.620 6.498 99 HD1 PHE 15 HD1 PHE 15 69.052 2.718 5.226 100 HD2 PHE 15 HD2 PHE 15 71.291 -0.822 4.622 101 HE1 PHE 15 HE1 PHE 15 69.915 3.627 3.112 102 HE2 PHE 15 HE2 PHE 15 72.153 0.083 2.500 103 HZ PHE 15 HZ PHE 15 71.456 2.306 1.761 104 H VAL 16 H VAL 16 68.297 -2.355 6.988 105 HA VAL 16 HA VAL 16 68.157 -3.455 4.409 106 HB VAL 16 HB VAL 16 68.105 -5.627 5.316 107 HG11 VAL 16 HG11 VAL 16 69.600 -4.060 7.304 108 HG12 VAL 16 HG12 VAL 16 70.086 -4.523 5.682 109 HG13 VAL 16 HG13 VAL 16 69.803 -5.778 6.901 110 HG21 VAL 16 HG21 VAL 16 67.003 -4.506 7.832 111 HG22 VAL 16 HG22 VAL 16 67.557 -6.196 7.580 112 HG23 VAL 16 HG23 VAL 16 66.220 -5.535 6.621 113 H GLN 17 H GLN 17 65.681 -2.612 6.679 114 HA GLN 17 HA GLN 17 63.463 -3.816 5.490 115 HB2 GLN 17 HB2 GLN 17 63.174 -2.917 7.629 116 HB3 GLN 17 HB3 GLN 17 64.020 -1.438 7.227 117 HG2 GLN 17 HG2 GLN 17 61.700 -1.024 7.611 118 HG3 GLN 17 HG3 GLN 17 62.150 -0.703 5.937 119 HE21 GLN 17 HE21 GLN 17 60.135 -0.865 5.221 120 HE22 GLN 17 HE22 GLN 17 59.220 -2.292 5.092 121 H LEU 18 H LEU 18 64.901 -0.606 4.966 122 HA LEU 18 HA LEU 18 63.285 0.283 2.857 123 HB2 LEU 18 HB2 LEU 18 64.823 1.744 3.863 124 HB3 LEU 18 HB3 LEU 18 66.179 0.751 3.550 125 HG LEU 18 HG LEU 18 65.770 1.123 1.060 126 HD11 LEU 18 HD11 LEU 18 63.500 2.000 1.218 127 HD12 LEU 18 HD12 LEU 18 64.603 3.050 0.335 128 HD13 LEU 18 HD13 LEU 18 64.146 3.462 1.982 129 HD21 LEU 18 HD21 LEU 18 66.588 3.452 2.757 130 HD22 LEU 18 HD22 LEU 18 66.928 3.241 1.028 131 HD23 LEU 18 HD23 LEU 18 67.606 2.112 2.205 132 H LEU 19 H LEU 19 66.218 -1.483 2.902 133 HA LEU 19 HA LEU 19 66.756 -1.824 0.185 134 HB2 LEU 19 HB2 LEU 19 67.284 -3.383 2.571 135 HB3 LEU 19 HB3 LEU 19 68.101 -3.755 1.021 136 HG LEU 19 HG LEU 19 68.338 -1.426 2.899 137 HD11 LEU 19 HD11 LEU 19 70.327 -3.179 1.601 138 HD12 LEU 19 HD12 LEU 19 69.815 -3.182 3.289 139 HD13 LEU 19 HD13 LEU 19 70.685 -1.790 2.616 140 HD21 LEU 19 HD21 LEU 19 67.992 -0.382 0.804 141 HD22 LEU 19 HD22 LEU 19 69.229 -1.405 0.042 142 HD23 LEU 19 HD23 LEU 19 69.677 -0.236 1.298 143 H LYS 20 H LYS 20 64.823 -3.799 2.369 144 HA LYS 20 HA LYS 20 64.197 -5.791 0.440 145 HB2 LYS 20 HB2 LYS 20 62.707 -4.950 2.902 146 HB3 LYS 20 HB3 LYS 20 62.366 -6.376 1.923 147 HG2 LYS 20 HG2 LYS 20 64.642 -7.210 2.468 148 HG3 LYS 20 HG3 LYS 20 64.839 -5.822 3.523 149 HD2 LYS 20 HD2 LYS 20 62.834 -6.491 4.788 150 HD3 LYS 20 HD3 LYS 20 62.735 -7.957 3.816 151 HE2 LYS 20 HE2 LYS 20 64.919 -8.661 4.622 152 HE3 LYS 20 HE3 LYS 20 65.071 -7.174 5.555 153 HZ1 LYS 20 HZ1 LYS 20 63.108 -9.359 5.988 154 HZ2 LYS 20 HZ2 LYS 20 63.043 -7.857 6.758 155 HZ3 LYS 20 HZ3 LYS 20 64.338 -8.865 7.037 156 H GLU 21 H GLU 21 62.653 -2.805 1.510 157 HA GLU 21 HA GLU 21 60.348 -3.147 -0.020 158 HB2 GLU 21 HB2 GLU 21 61.600 -0.590 0.993 159 HB3 GLU 21 HB3 GLU 21 60.035 -0.685 0.196 160 HG2 GLU 21 HG2 GLU 21 59.303 -2.255 1.980 161 HG3 GLU 21 HG3 GLU 21 60.819 -1.930 2.814 162 H ILE 22 H ILE 22 63.461 -1.705 -0.772 163 HA ILE 22 HA ILE 22 62.775 -0.786 -3.358 164 HB ILE 22 HB ILE 22 65.485 -1.906 -2.613 165 HG12 ILE 22 HG12 ILE 22 64.418 0.877 -2.113 166 HG13 ILE 22 HG13 ILE 22 64.772 -0.312 -0.877 167 HG21 ILE 22 HG21 ILE 22 65.094 -1.378 -4.965 168 HG22 ILE 22 HG22 ILE 22 66.258 -0.272 -4.227 169 HG23 ILE 22 HG23 ILE 22 64.603 0.262 -4.519 170 HD11 ILE 22 HD11 ILE 22 66.785 0.956 -2.716 171 HD12 ILE 22 HD12 ILE 22 67.138 -0.252 -1.485 172 HD13 ILE 22 HD13 ILE 22 66.541 1.342 -1.013 173 H GLU 23 H GLU 23 64.122 -3.804 -2.177 174 HA GLU 23 HA GLU 23 64.537 -5.172 -4.543 175 HB2 GLU 23 HB2 GLU 23 64.189 -5.821 -1.712 176 HB3 GLU 23 HB3 GLU 23 63.978 -7.142 -2.850 177 HG2 GLU 23 HG2 GLU 23 66.376 -5.354 -2.969 178 HG3 GLU 23 HG3 GLU 23 66.251 -6.750 -1.850 179 H LYS 24 H LYS 24 61.687 -5.006 -2.540 180 HA LYS 24 HA LYS 24 60.198 -6.957 -3.812 181 HB2 LYS 24 HB2 LYS 24 59.521 -6.165 -1.678 182 HB3 LYS 24 HB3 LYS 24 59.356 -4.518 -2.261 183 HG2 LYS 24 HG2 LYS 24 57.185 -5.565 -1.928 184 HG3 LYS 24 HG3 LYS 24 57.455 -5.164 -3.622 185 HD2 LYS 24 HD2 LYS 24 58.149 -7.539 -3.981 186 HD3 LYS 24 HD3 LYS 24 57.625 -7.892 -2.333 187 HE2 LYS 24 HE2 LYS 24 55.849 -8.451 -3.857 188 HE3 LYS 24 HE3 LYS 24 55.374 -7.017 -2.944 189 HZ1 LYS 24 HZ1 LYS 24 56.445 -7.066 -5.707 190 HZ2 LYS 24 HZ2 LYS 24 56.107 -5.650 -4.891 191 HZ3 LYS 24 HZ3 LYS 24 54.858 -6.721 -5.281 192 H GLU 25 H GLU 25 60.222 -3.398 -4.525 193 HA GLU 25 HA GLU 25 58.587 -4.031 -6.783 194 HB2 GLU 25 HB2 GLU 25 59.498 -1.269 -5.864 195 HB3 GLU 25 HB3 GLU 25 58.338 -1.705 -7.068 196 HG2 GLU 25 HG2 GLU 25 57.998 -2.266 -4.132 197 HG3 GLU 25 HG3 GLU 25 57.238 -1.034 -5.087 198 H ASN 26 H ASN 26 61.770 -4.051 -6.140 199 HA ASN 26 HA ASN 26 62.915 -3.051 -8.550 200 HB2 ASN 26 HB2 ASN 26 64.345 -3.422 -6.605 201 HB3 ASN 26 HB3 ASN 26 63.868 -5.108 -6.540 202 HD21 ASN 26 HD21 ASN 26 66.037 -5.811 -6.591 203 HD22 ASN 26 HD22 ASN 26 66.959 -5.714 -8.030 204 H VAL 27 H VAL 27 62.117 -6.299 -7.412 205 HA VAL 27 HA VAL 27 62.650 -7.503 -9.911 206 HB VAL 27 HB VAL 27 61.498 -9.538 -8.987 207 HG11 VAL 27 HG11 VAL 27 63.884 -9.156 -8.629 208 HG12 VAL 27 HG12 VAL 27 63.159 -9.946 -7.232 209 HG13 VAL 27 HG13 VAL 27 63.522 -8.222 -7.177 210 HG21 VAL 27 HG21 VAL 27 59.834 -8.379 -7.579 211 HG22 VAL 27 HG22 VAL 27 61.131 -7.808 -6.532 212 HG23 VAL 27 HG23 VAL 27 60.788 -9.533 -6.646 213 H ALA 28 H ALA 28 59.806 -6.043 -8.603 214 HA ALA 28 HA ALA 28 58.080 -7.059 -10.682 215 HB1 ALA 28 HB1 ALA 28 56.382 -5.593 -9.703 216 HB2 ALA 28 HB2 ALA 28 57.611 -4.838 -8.688 217 HB3 ALA 28 HB3 ALA 28 57.191 -6.532 -8.448 218 H ALA 29 H ALA 29 60.197 -4.440 -10.201 219 HA ALA 29 HA ALA 29 60.786 -2.590 -11.207 220 HB1 ALA 29 HB1 ALA 29 61.338 -4.196 -13.029 221 HB2 ALA 29 HB2 ALA 29 60.998 -2.561 -13.591 222 HB3 ALA 29 HB3 ALA 29 59.779 -3.821 -13.771 223 H THR 30 H THR 30 59.100 -1.584 -9.967 224 HA THR 30 HA THR 30 56.800 -0.690 -11.497 225 HB THR 30 HB THR 30 56.145 0.369 -9.308 226 HG1 THR 30 HG1 THR 30 57.378 -0.041 -7.548 227 HG21 THR 30 HG21 THR 30 56.994 -2.500 -9.137 228 HG22 THR 30 HG22 THR 30 55.467 -1.924 -9.824 229 HG23 THR 30 HG23 THR 30 55.804 -1.717 -8.095 230 H ASP 31 H ASP 31 56.533 1.899 -10.437 231 HA ASP 31 HA ASP 31 59.076 3.139 -11.146 232 HB2 ASP 31 HB2 ASP 31 58.123 4.769 -12.579 233 HB3 ASP 31 HB3 ASP 31 57.581 3.202 -13.163 234 H ASP 32 H ASP 32 56.028 3.443 -9.531 235 HA ASP 32 HA ASP 32 56.585 6.067 -8.681 236 HB2 ASP 32 HB2 ASP 32 54.275 5.235 -8.871 237 HB3 ASP 32 HB3 ASP 32 54.581 4.129 -7.536 238 H VAL 33 H VAL 33 56.749 3.051 -6.874 239 HA VAL 33 HA VAL 33 57.947 4.618 -4.722 240 HB VAL 33 HB VAL 33 56.435 2.412 -4.452 241 HG11 VAL 33 HG11 VAL 33 57.699 0.462 -3.925 242 HG12 VAL 33 HG12 VAL 33 59.125 1.228 -4.629 243 HG13 VAL 33 HG13 VAL 33 57.717 0.899 -5.638 244 HG21 VAL 33 HG21 VAL 33 58.779 3.012 -2.675 245 HG22 VAL 33 HG22 VAL 33 57.370 2.044 -2.240 246 HG23 VAL 33 HG23 VAL 33 57.184 3.765 -2.588 247 H LEU 34 H LEU 34 58.775 2.613 -7.293 248 HA LEU 34 HA LEU 34 61.345 1.687 -6.629 249 HB2 LEU 34 HB2 LEU 34 59.706 1.011 -8.532 250 HB3 LEU 34 HB3 LEU 34 60.240 2.464 -9.272 251 HG LEU 34 HG LEU 34 61.232 0.227 -10.064 252 HD11 LEU 34 HD11 LEU 34 63.276 1.328 -10.721 253 HD12 LEU 34 HD12 LEU 34 62.899 2.652 -9.604 254 HD13 LEU 34 HD13 LEU 34 61.827 2.300 -10.966 255 HD21 LEU 34 HD21 LEU 34 63.043 0.812 -7.720 256 HD22 LEU 34 HD22 LEU 34 63.345 -0.377 -8.987 257 HD23 LEU 34 HD23 LEU 34 61.983 -0.588 -7.889 258 H ASP 35 H ASP 35 60.321 4.668 -8.440 259 HA ASP 35 HA ASP 35 63.035 5.411 -8.433 260 HB2 ASP 35 HB2 ASP 35 60.540 6.665 -9.436 261 HB3 ASP 35 HB3 ASP 35 62.038 7.571 -9.344 262 H VAL 36 H VAL 36 60.572 5.790 -6.148 263 HA VAL 36 HA VAL 36 61.734 8.104 -4.859 264 HB VAL 36 HB VAL 36 60.464 5.737 -3.485 265 HG11 VAL 36 HG11 VAL 36 60.019 7.329 -1.687 266 HG12 VAL 36 HG12 VAL 36 60.822 8.581 -2.670 267 HG13 VAL 36 HG13 VAL 36 61.744 7.186 -2.099 268 HG21 VAL 36 HG21 VAL 36 58.496 6.912 -3.316 269 HG22 VAL 36 HG22 VAL 36 58.907 6.564 -5.018 270 HG23 VAL 36 HG23 VAL 36 59.089 8.233 -4.355 271 H LEU 37 H LEU 37 61.953 4.673 -4.562 272 HA LEU 37 HA LEU 37 63.607 4.737 -2.314 273 HB2 LEU 37 HB2 LEU 37 63.242 2.454 -4.186 274 HB3 LEU 37 HB3 LEU 37 63.805 2.531 -2.532 275 HG LEU 37 HG LEU 37 60.978 3.260 -3.241 276 HD11 LEU 37 HD11 LEU 37 60.308 1.161 -2.236 277 HD12 LEU 37 HD12 LEU 37 61.999 0.709 -2.044 278 HD13 LEU 37 HD13 LEU 37 61.313 0.904 -3.661 279 HD21 LEU 37 HD21 LEU 37 62.326 2.783 -0.584 280 HD22 LEU 37 HD22 LEU 37 60.612 3.111 -0.820 281 HD23 LEU 37 HD23 LEU 37 61.802 4.343 -1.219 282 H LEU 38 H LEU 38 64.186 4.189 -5.690 283 HA LEU 38 HA LEU 38 66.865 3.507 -5.455 284 HB2 LEU 38 HB2 LEU 38 65.284 4.817 -7.598 285 HB3 LEU 38 HB3 LEU 38 66.971 4.331 -7.882 286 HG LEU 38 HG LEU 38 64.431 2.775 -7.594 287 HD11 LEU 38 HD11 LEU 38 66.717 2.613 -9.469 288 HD12 LEU 38 HD12 LEU 38 65.185 3.444 -9.778 289 HD13 LEU 38 HD13 LEU 38 65.229 1.675 -9.583 290 HD21 LEU 38 HD21 LEU 38 65.677 0.676 -7.436 291 HD22 LEU 38 HD22 LEU 38 65.904 1.673 -6.003 292 HD23 LEU 38 HD23 LEU 38 67.178 1.573 -7.220 293 H GLU 39 H GLU 39 65.341 6.687 -5.840 294 HA GLU 39 HA GLU 39 67.806 8.108 -5.836 295 HB2 GLU 39 HB2 GLU 39 64.954 8.810 -5.417 296 HB3 GLU 39 HB3 GLU 39 66.230 9.978 -5.119 297 HG2 GLU 39 HG2 GLU 39 65.673 8.574 -7.726 298 HG3 GLU 39 HG3 GLU 39 65.214 10.227 -7.278 299 H HIS 40 H HIS 40 65.410 7.332 -3.413 300 HA HIS 40 HA HIS 40 66.345 8.901 -1.342 301 HB2 HIS 40 HB2 HIS 40 64.154 7.799 -1.397 302 HB3 HIS 40 HB3 HIS 40 64.896 6.239 -1.248 303 HD1 HIS 40 HD1 HIS 40 63.524 8.959 0.773 304 HD2 HIS 40 HD2 HIS 40 66.172 5.812 1.325 305 HE1 HIS 40 HE1 HIS 40 63.741 8.649 3.249 306 H PHE 41 H PHE 41 67.011 5.597 -2.193 307 HA PHE 41 HA PHE 41 68.690 4.963 -0.081 308 HB2 PHE 41 HB2 PHE 41 67.695 3.247 -1.272 309 HB3 PHE 41 HB3 PHE 41 68.172 3.919 -2.816 310 HD1 PHE 41 HD1 PHE 41 69.487 2.325 0.254 311 HD2 PHE 41 HD2 PHE 41 70.035 3.116 -3.870 312 HE1 PHE 41 HE1 PHE 41 71.425 0.789 0.211 313 HE2 PHE 41 HE2 PHE 41 71.943 1.621 -3.909 314 HZ PHE 41 HZ PHE 41 72.651 0.449 -1.909 315 H VAL 42 H VAL 42 69.473 6.027 -3.378 316 HA VAL 42 HA VAL 42 72.258 6.128 -2.813 317 HB VAL 42 HB VAL 42 71.362 5.776 -5.085 318 HG11 VAL 42 HG11 VAL 42 70.594 8.589 -5.073 319 HG12 VAL 42 HG12 VAL 42 69.607 7.089 -5.133 320 HG13 VAL 42 HG13 VAL 42 70.729 7.463 -6.453 321 HG21 VAL 42 HG21 VAL 42 73.202 8.133 -4.878 322 HG22 VAL 42 HG22 VAL 42 72.967 7.140 -6.316 323 HG23 VAL 42 HG23 VAL 42 73.683 6.439 -4.864 324 H LYS 43 H LYS 43 69.820 8.472 -2.422 325 HA LYS 43 HA LYS 43 71.738 10.610 -2.044 326 HB2 LYS 43 HB2 LYS 43 69.958 12.048 -1.515 327 HB3 LYS 43 HB3 LYS 43 69.185 10.875 -2.562 328 HG2 LYS 43 HG2 LYS 43 68.337 9.691 -0.400 329 HG3 LYS 43 HG3 LYS 43 69.038 11.045 0.429 330 HD2 LYS 43 HD2 LYS 43 67.643 12.627 -0.740 331 HD3 LYS 43 HD3 LYS 43 66.894 11.322 -1.658 332 HE2 LYS 43 HE2 LYS 43 66.026 10.354 0.413 333 HE3 LYS 43 HE3 LYS 43 66.804 11.627 1.349 334 HZ1 LYS 43 HZ1 LYS 43 64.621 11.997 -0.638 335 HZ2 LYS 43 HZ2 LYS 43 65.414 13.241 0.155 336 HZ3 LYS 43 HZ3 LYS 43 64.509 12.132 1.033 337 H ILE 44 H ILE 44 70.258 8.330 0.141 338 HA ILE 44 HA ILE 44 71.390 9.715 2.390 339 HB ILE 44 HB ILE 44 70.537 7.811 3.757 340 HG12 ILE 44 HG12 ILE 44 69.475 6.811 1.114 341 HG13 ILE 44 HG13 ILE 44 70.757 6.040 2.019 342 HG21 ILE 44 HG21 ILE 44 69.145 9.773 3.296 343 HG22 ILE 44 HG22 ILE 44 68.171 8.311 3.431 344 HG23 ILE 44 HG23 ILE 44 68.525 8.990 1.842 345 HD11 ILE 44 HD11 ILE 44 67.911 6.387 2.904 346 HD12 ILE 44 HD12 ILE 44 69.171 5.560 3.818 347 HD13 ILE 44 HD13 ILE 44 68.619 4.910 2.267 348 H THR 45 H THR 45 72.197 6.874 0.487 349 HA THR 45 HA THR 45 74.379 6.150 2.212 350 HB THR 45 HB THR 45 74.946 4.540 0.439 351 HG1 THR 45 HG1 THR 45 72.632 5.236 -0.977 352 HG21 THR 45 HG21 THR 45 71.991 4.642 1.002 353 HG22 THR 45 HG22 THR 45 73.206 4.012 2.107 354 HG23 THR 45 HG23 THR 45 72.923 3.215 0.553 355 H GLU 46 H GLU 46 73.862 7.910 -0.728 356 HA GLU 46 HA GLU 46 75.023 9.198 -2.051 357 HB2 GLU 46 HB2 GLU 46 76.825 9.294 0.304 358 HB3 GLU 46 HB3 GLU 46 77.068 10.361 -1.098 359 HG2 GLU 46 HG2 GLU 46 74.739 11.167 -0.603 360 HG3 GLU 46 HG3 GLU 46 74.812 10.221 0.870 361 H HIS 47 H HIS 47 75.407 6.337 -1.892 362 HA HIS 47 HA HIS 47 78.105 5.808 -2.642 363 HB2 HIS 47 HB2 HIS 47 76.479 4.100 -1.645 364 HB3 HIS 47 HB3 HIS 47 75.676 4.071 -3.211 365 HD1 HIS 47 HD1 HIS 47 76.714 2.462 -4.974 366 HD2 HIS 47 HD2 HIS 47 79.140 3.147 -1.687 367 HE1 HIS 47 HE1 HIS 47 78.770 1.053 -5.301 368 HA PRO 48 HA PRO 48 77.578 7.493 -6.785 369 HB2 PRO 48 HB2 PRO 48 79.705 5.682 -7.584 370 HB3 PRO 48 HB3 PRO 48 79.660 7.449 -7.616 371 HG2 PRO 48 HG2 PRO 48 81.114 5.929 -6.005 372 HG3 PRO 48 HG3 PRO 48 80.471 7.489 -5.380 373 HD2 PRO 48 HD2 PRO 48 79.574 4.661 -4.983 374 HD3 PRO 48 HD3 PRO 48 79.604 5.981 -3.804 375 H ASP 49 H ASP 49 77.057 4.386 -6.005 376 HA ASP 49 HA ASP 49 76.356 3.847 -8.649 377 HB2 ASP 49 HB2 ASP 49 78.449 2.906 -8.383 378 HB3 ASP 49 HB3 ASP 49 78.009 1.929 -6.966 379 H GLY 50 H GLY 50 74.992 4.662 -6.361 380 HA2 GLY 50 HA2 GLY 50 73.777 3.024 -4.424 381 HA3 GLY 50 HA3 GLY 50 73.059 4.359 -5.255 382 H THR 51 H THR 51 72.518 3.785 -7.491 383 HA THR 51 HA THR 51 70.413 2.004 -6.974 384 HB THR 51 HB THR 51 70.897 2.925 -9.759 385 HG1 THR 51 HG1 THR 51 69.783 4.967 -8.573 386 HG21 THR 51 HG21 THR 51 68.498 3.347 -9.553 387 HG22 THR 51 HG22 THR 51 68.567 2.959 -7.836 388 HG23 THR 51 HG23 THR 51 68.876 1.709 -9.013 389 H ALA 52 H ALA 52 73.545 1.652 -8.681 390 HA ALA 52 HA ALA 52 72.603 -0.735 -9.957 391 HB1 ALA 52 HB1 ALA 52 74.837 -0.963 -10.781 392 HB2 ALA 52 HB2 ALA 52 75.401 0.308 -9.692 393 HB3 ALA 52 HB3 ALA 52 74.292 0.697 -11.008 394 H LEU 53 H LEU 53 74.057 0.056 -6.943 395 HA LEU 53 HA LEU 53 74.866 -2.552 -6.277 396 HB2 LEU 53 HB2 LEU 53 73.809 -0.407 -4.474 397 HB3 LEU 53 HB3 LEU 53 74.356 -1.960 -3.893 398 HG LEU 53 HG LEU 53 75.964 0.262 -5.093 399 HD11 LEU 53 HD11 LEU 53 77.191 0.031 -3.003 400 HD12 LEU 53 HD12 LEU 53 76.110 -1.275 -2.515 401 HD13 LEU 53 HD13 LEU 53 75.481 0.359 -2.732 402 HD21 LEU 53 HD21 LEU 53 77.918 -1.234 -4.956 403 HD22 LEU 53 HD22 LEU 53 76.760 -1.768 -6.165 404 HD23 LEU 53 HD23 LEU 53 76.844 -2.589 -4.603 405 H ILE 54 H ILE 54 71.719 -1.061 -6.118 406 HA ILE 54 HA ILE 54 70.501 -3.276 -4.738 407 HB ILE 54 HB ILE 54 69.122 -1.300 -6.605 408 HG12 ILE 54 HG12 ILE 54 68.642 -1.241 -3.724 409 HG13 ILE 54 HG13 ILE 54 70.244 -0.691 -4.144 410 HG21 ILE 54 HG21 ILE 54 67.911 -3.210 -4.624 411 HG22 ILE 54 HG22 ILE 54 67.853 -3.362 -6.379 412 HG23 ILE 54 HG23 ILE 54 67.044 -2.010 -5.586 413 HD11 ILE 54 HD11 ILE 54 69.282 0.969 -5.618 414 HD12 ILE 54 HD12 ILE 54 68.576 1.121 -4.007 415 HD13 ILE 54 HD13 ILE 54 67.674 0.349 -5.317 416 H TYR 55 H TYR 55 70.780 -2.318 -8.063 417 HA TYR 55 HA TYR 55 69.430 -4.396 -9.273 418 HB2 TYR 55 HB2 TYR 55 71.528 -2.502 -10.136 419 HB3 TYR 55 HB3 TYR 55 71.092 -3.802 -11.216 420 HD1 TYR 55 HD1 TYR 55 68.465 -4.045 -11.582 421 HD2 TYR 55 HD2 TYR 55 70.379 -0.496 -10.263 422 HE1 TYR 55 HE1 TYR 55 66.536 -2.733 -12.338 423 HE2 TYR 55 HE2 TYR 55 68.468 0.832 -11.008 424 HH TYR 55 HH TYR 55 65.488 -0.585 -11.892 425 H GLU 56 H GLU 56 72.939 -4.151 -8.607 426 HA GLU 56 HA GLU 56 73.302 -6.781 -9.542 427 HB2 GLU 56 HB2 GLU 56 75.591 -6.685 -8.597 428 HB3 GLU 56 HB3 GLU 56 75.198 -5.397 -9.719 429 HG2 GLU 56 HG2 GLU 56 75.146 -3.811 -8.103 430 HG3 GLU 56 HG3 GLU 56 75.003 -4.931 -6.766 431 H ALA 57 H ALA 57 72.707 -5.469 -6.333 432 HA ALA 57 HA ALA 57 73.326 -7.759 -4.871 433 HB1 ALA 57 HB1 ALA 57 72.757 -5.618 -3.802 434 HB2 ALA 57 HB2 ALA 57 71.776 -6.937 -3.162 435 HB3 ALA 57 HB3 ALA 57 71.084 -5.807 -4.324 436 H ALA 58 H ALA 58 70.391 -6.895 -6.590 437 HA ALA 58 HA ALA 58 68.825 -9.113 -5.943 438 HB1 ALA 58 HB1 ALA 58 67.948 -7.150 -7.096 439 HB2 ALA 58 HB2 ALA 58 67.609 -8.611 -8.028 440 HB3 ALA 58 HB3 ALA 58 68.920 -7.536 -8.512 441 H ALA 59 H ALA 59 71.076 -8.612 -8.626 442 HA ALA 59 HA ALA 59 70.750 -11.150 -9.851 443 HB1 ALA 59 HB1 ALA 59 73.109 -9.276 -10.008 444 HB2 ALA 59 HB2 ALA 59 71.660 -9.169 -11.000 445 HB3 ALA 59 HB3 ALA 59 72.726 -10.571 -11.146 446 H ARG 60 H ARG 60 73.029 -9.887 -7.542 447 HA ARG 60 HA ARG 60 74.673 -12.161 -7.349 448 HB2 ARG 60 HB2 ARG 60 74.229 -9.821 -5.500 449 HB3 ARG 60 HB3 ARG 60 75.425 -11.068 -5.180 450 HG2 ARG 60 HG2 ARG 60 76.680 -10.486 -7.119 451 HG3 ARG 60 HG3 ARG 60 75.379 -9.475 -7.737 452 HD2 ARG 60 HD2 ARG 60 77.190 -8.114 -6.835 453 HD3 ARG 60 HD3 ARG 60 75.719 -7.904 -5.896 454 HE ARG 60 HE ARG 60 77.297 -9.899 -4.731 455 HH11 ARG 60 HH11 ARG 60 77.434 -6.343 -5.253 456 HH12 ARG 60 HH12 ARG 60 78.246 -6.077 -3.780 457 HH21 ARG 60 HH21 ARG 60 78.497 -9.414 -2.739 458 HH22 ARG 60 HH22 ARG 60 78.833 -7.779 -2.376 459 H ALA 61 H ALA 61 71.714 -11.219 -5.698 460 HA ALA 61 HA ALA 61 71.832 -13.371 -3.807 461 HB1 ALA 61 HB1 ALA 61 70.589 -11.338 -3.330 462 HB2 ALA 61 HB2 ALA 61 69.551 -12.764 -3.243 463 HB3 ALA 61 HB3 ALA 61 69.474 -11.699 -4.649 464 H ALA 62 H ALA 62 70.756 -13.008 -7.039 465 HA ALA 62 HA ALA 62 68.993 -15.193 -7.202 466 HB1 ALA 62 HB1 ALA 62 69.375 -15.081 -9.617 467 HB2 ALA 62 HB2 ALA 62 70.779 -14.047 -9.352 468 HB3 ALA 62 HB3 ALA 62 69.168 -13.464 -8.942 469 H ALA 63 H ALA 63 72.471 -14.939 -7.409 470 HA ALA 63 HA ALA 63 72.741 -17.821 -7.768 471 HB1 ALA 63 HB1 ALA 63 74.318 -16.355 -8.967 472 HB2 ALA 63 HB2 ALA 63 75.170 -17.365 -7.797 473 HB3 ALA 63 HB3 ALA 63 74.844 -15.669 -7.429 474 H ASN 64 H ASN 64 73.563 -15.285 -5.472 475 HA ASN 64 HA ASN 64 73.875 -15.148 -3.306 476 HB2 ASN 64 HB2 ASN 64 71.512 -15.836 -3.224 477 HB3 ASN 64 HB3 ASN 64 72.004 -17.522 -3.139 478 HD21 ASN 64 HD21 ASN 64 71.798 -14.506 -1.403 479 HD22 ASN 64 HD22 ASN 64 72.098 -15.145 0.153 480 HA PRO 65 HA PRO 65 77.210 -18.202 -3.083 481 HB2 PRO 65 HB2 PRO 65 78.887 -15.947 -2.375 482 HB3 PRO 65 HB3 PRO 65 78.988 -16.990 -3.792 483 HG2 PRO 65 HG2 PRO 65 78.262 -14.381 -3.945 484 HG3 PRO 65 HG3 PRO 65 77.676 -15.617 -5.072 485 HD2 PRO 65 HD2 PRO 65 76.310 -14.442 -2.676 486 HD3 PRO 65 HD3 PRO 65 75.657 -14.792 -4.296 487 H GLY 66 H GLY 66 76.725 -19.205 -1.208 488 HA2 GLY 66 HA2 GLY 66 77.268 -19.740 1.023 489 HA3 GLY 66 HA3 GLY 66 77.906 -18.111 1.216 490 H GLY 67 H GLY 67 75.844 -16.561 0.612 491 HA2 GLY 67 HA2 GLY 67 73.339 -16.987 1.477 492 HA3 GLY 67 HA3 GLY 67 74.299 -16.970 2.963 493 H ASP 68 H ASP 68 76.188 -15.085 2.222 494 HA ASP 68 HA ASP 68 74.575 -12.641 2.357 495 HB2 ASP 68 HB2 ASP 68 77.460 -13.139 3.129 496 HB3 ASP 68 HB3 ASP 68 76.695 -11.563 3.169 497 H GLY 69 H GLY 69 75.741 -10.680 1.430 498 HA2 GLY 69 HA2 GLY 69 77.355 -9.938 -0.264 499 HA3 GLY 69 HA3 GLY 69 76.925 -11.394 -1.164 500 H GLY 70 H GLY 70 74.599 -11.603 -1.600 501 HA2 GLY 70 HA2 GLY 70 73.692 -9.063 -2.749 502 HA3 GLY 70 HA3 GLY 70 73.239 -10.661 -3.327 503 H GLY 71 H GLY 71 71.128 -9.276 -3.102 504 HA2 GLY 71 HA2 GLY 71 69.075 -9.469 -2.143 505 HA3 GLY 71 HA3 GLY 71 69.800 -10.274 -0.754 506 HA PRO 72 HA PRO 72 68.635 -5.779 0.064 507 HB2 PRO 72 HB2 PRO 72 67.124 -6.434 2.289 508 HB3 PRO 72 HB3 PRO 72 66.516 -6.084 0.665 509 HG2 PRO 72 HG2 PRO 72 66.962 -8.716 1.983 510 HG3 PRO 72 HG3 PRO 72 65.673 -8.222 0.875 511 HD2 PRO 72 HD2 PRO 72 67.779 -9.728 0.109 512 HD3 PRO 72 HD3 PRO 72 67.009 -8.599 -1.013 513 H GLU 73 H GLU 73 69.245 -8.393 2.368 514 HA GLU 73 HA GLU 73 70.576 -6.691 4.169 515 HB2 GLU 73 HB2 GLU 73 70.669 -9.702 3.999 516 HB3 GLU 73 HB3 GLU 73 71.171 -8.736 5.377 517 HG2 GLU 73 HG2 GLU 73 68.868 -7.916 5.603 518 HG3 GLU 73 HG3 GLU 73 68.393 -8.948 4.264 519 H GLY 74 H GLY 74 71.622 -7.549 1.232 520 HA2 GLY 74 HA2 GLY 74 74.341 -7.429 2.223 521 HA3 GLY 74 HA3 GLY 74 73.973 -8.183 0.637 522 H ILE 75 H ILE 75 72.117 -5.689 0.399 523 HA ILE 75 HA ILE 75 73.972 -4.025 -0.995 524 HB ILE 75 HB ILE 75 71.599 -2.573 -0.045 525 HG12 ILE 75 HG12 ILE 75 71.128 -5.277 -1.411 526 HG13 ILE 75 HG13 ILE 75 70.522 -4.673 0.079 527 HG21 ILE 75 HG21 ILE 75 71.286 -2.166 -2.440 528 HG22 ILE 75 HG22 ILE 75 72.565 -3.328 -2.791 529 HG23 ILE 75 HG23 ILE 75 72.938 -1.844 -1.912 530 HD11 ILE 75 HD11 ILE 75 69.734 -3.466 -2.552 531 HD12 ILE 75 HD12 ILE 75 69.061 -3.117 -0.953 532 HD13 ILE 75 HD13 ILE 75 68.815 -4.695 -1.682 533 H VAL 76 H VAL 76 72.461 -3.922 2.087 534 HA VAL 76 HA VAL 76 73.358 -1.508 3.148 535 HB VAL 76 HB VAL 76 71.643 -2.651 4.175 536 HG11 VAL 76 HG11 VAL 76 73.161 -5.082 4.126 537 HG12 VAL 76 HG12 VAL 76 71.518 -4.603 3.568 538 HG13 VAL 76 HG13 VAL 76 71.861 -4.789 5.288 539 HG21 VAL 76 HG21 VAL 76 73.963 -2.974 6.055 540 HG22 VAL 76 HG22 VAL 76 72.268 -3.019 6.533 541 HG23 VAL 76 HG23 VAL 76 72.962 -1.535 5.885 542 H LYS 77 H LYS 77 74.649 -4.620 3.400 543 HA LYS 77 HA LYS 77 76.908 -4.149 4.982 544 HB2 LYS 77 HB2 LYS 77 76.147 -6.389 4.465 545 HB3 LYS 77 HB3 LYS 77 76.528 -6.160 2.768 546 HG2 LYS 77 HG2 LYS 77 78.926 -5.934 3.409 547 HG3 LYS 77 HG3 LYS 77 78.468 -6.367 5.057 548 HD2 LYS 77 HD2 LYS 77 77.842 -8.017 2.653 549 HD3 LYS 77 HD3 LYS 77 79.293 -8.287 3.634 550 HE2 LYS 77 HE2 LYS 77 76.416 -8.466 4.553 551 HE3 LYS 77 HE3 LYS 77 77.466 -9.834 4.205 552 HZ1 LYS 77 HZ1 LYS 77 77.984 -7.831 6.343 553 HZ2 LYS 77 HZ2 LYS 77 78.839 -9.265 6.070 554 HZ3 LYS 77 HZ3 LYS 77 77.237 -9.315 6.557 555 H GLU 78 H GLU 78 76.568 -4.031 1.463 556 HA GLU 78 HA GLU 78 79.280 -3.377 1.096 557 HB2 GLU 78 HB2 GLU 78 77.734 -4.525 -0.572 558 HB3 GLU 78 HB3 GLU 78 77.123 -2.931 -0.985 559 HG2 GLU 78 HG2 GLU 78 79.066 -2.275 -1.939 560 HG3 GLU 78 HG3 GLU 78 80.052 -3.396 -0.996 561 H ILE 79 H ILE 79 76.399 -1.533 1.573 562 HA ILE 79 HA ILE 79 77.470 1.037 0.957 563 HB ILE 79 HB ILE 79 75.182 0.290 2.820 564 HG12 ILE 79 HG12 ILE 79 74.748 -0.265 0.463 565 HG13 ILE 79 HG13 ILE 79 73.716 1.051 1.012 566 HG21 ILE 79 HG21 ILE 79 76.093 2.403 3.506 567 HG22 ILE 79 HG22 ILE 79 74.493 2.588 2.801 568 HG23 ILE 79 HG23 ILE 79 75.923 3.034 1.865 569 HD11 ILE 79 HD11 ILE 79 74.491 1.482 -1.200 570 HD12 ILE 79 HD12 ILE 79 76.165 1.254 -0.706 571 HD13 ILE 79 HD13 ILE 79 75.248 2.633 -0.097 572 H LYS 80 H LYS 80 77.241 -0.801 3.978 573 HA LYS 80 HA LYS 80 78.147 1.321 5.571 574 HB2 LYS 80 HB2 LYS 80 78.195 -0.174 7.408 575 HB3 LYS 80 HB3 LYS 80 76.983 -0.810 6.309 576 HG2 LYS 80 HG2 LYS 80 78.410 -2.520 5.553 577 HG3 LYS 80 HG3 LYS 80 79.763 -1.872 6.468 578 HD2 LYS 80 HD2 LYS 80 78.423 -2.196 8.553 579 HD3 LYS 80 HD3 LYS 80 77.209 -3.026 7.577 580 HE2 LYS 80 HE2 LYS 80 78.648 -4.641 8.620 581 HE3 LYS 80 HE3 LYS 80 78.921 -4.646 6.878 582 HZ1 LYS 80 HZ1 LYS 80 80.651 -3.365 8.934 583 HZ2 LYS 80 HZ2 LYS 80 80.906 -3.206 7.298 584 HZ3 LYS 80 HZ3 LYS 80 81.008 -4.736 8.021 585 H GLU 81 H GLU 81 79.884 -1.183 3.853 586 HA GLU 81 HA GLU 81 82.348 -0.542 5.045 587 HB2 GLU 81 HB2 GLU 81 81.778 -2.046 2.482 588 HB3 GLU 81 HB3 GLU 81 83.376 -1.897 3.200 589 HG2 GLU 81 HG2 GLU 81 82.492 -3.000 5.256 590 HG3 GLU 81 HG3 GLU 81 80.972 -3.244 4.411 591 H TRP 82 H TRP 82 80.719 0.578 2.178 592 HA TRP 82 HA TRP 82 82.844 2.086 1.040 593 HB2 TRP 82 HB2 TRP 82 80.589 1.477 -0.035 594 HB3 TRP 82 HB3 TRP 82 79.980 2.804 0.975 595 HD1 TRP 82 HD1 TRP 82 82.470 2.282 -1.907 596 HE1 TRP 82 HE1 TRP 82 82.650 4.478 -3.218 597 HE3 TRP 82 HE3 TRP 82 79.576 5.257 1.074 598 HZ2 TRP 82 HZ2 TRP 82 81.688 7.084 -3.063 599 HZ3 TRP 82 HZ3 TRP 82 79.268 7.607 0.430 600 HH2 TRP 82 HH2 TRP 82 80.310 8.513 -1.587 601 H ARG 83 H ARG 83 80.152 2.855 3.142 602 HA ARG 83 HA ARG 83 80.442 5.636 3.276 603 HB2 ARG 83 HB2 ARG 83 78.546 3.983 4.184 604 HB3 ARG 83 HB3 ARG 83 79.640 4.027 5.579 605 HG2 ARG 83 HG2 ARG 83 78.091 5.620 6.150 606 HG3 ARG 83 HG3 ARG 83 79.503 6.446 5.478 607 HD2 ARG 83 HD2 ARG 83 78.348 6.841 3.368 608 HD3 ARG 83 HD3 ARG 83 76.955 5.936 3.949 609 HE ARG 83 HE ARG 83 77.087 7.737 5.846 610 HH11 ARG 83 HH11 ARG 83 77.092 8.285 2.314 611 HH12 ARG 83 HH12 ARG 83 76.728 9.942 2.478 612 HH21 ARG 83 HH21 ARG 83 76.463 9.990 5.981 613 HH22 ARG 83 HH22 ARG 83 76.343 10.911 4.581 614 H ALA 84 H ALA 84 81.616 3.000 5.346 615 HA ALA 84 HA ALA 84 82.975 4.617 7.193 616 HB1 ALA 84 HB1 ALA 84 82.246 2.332 7.679 617 HB2 ALA 84 HB2 ALA 84 83.972 2.544 7.968 618 HB3 ALA 84 HB3 ALA 84 83.417 1.716 6.512 619 H ALA 85 H ALA 85 84.054 2.932 4.243 620 HA ALA 85 HA ALA 85 86.792 3.525 4.559 621 HB1 ALA 85 HB1 ALA 85 85.969 1.769 3.056 622 HB2 ALA 85 HB2 ALA 85 87.034 2.897 2.220 623 HB3 ALA 85 HB3 ALA 85 85.287 3.000 1.996 624 H ASN 86 H ASN 86 84.174 5.251 2.961 625 HA ASN 86 HA ASN 86 85.861 7.291 1.859 626 HB2 ASN 86 HB2 ASN 86 83.326 6.657 1.253 627 HB3 ASN 86 HB3 ASN 86 82.979 7.829 2.506 628 HD21 ASN 86 HD21 ASN 86 83.542 10.076 2.143 629 HD22 ASN 86 HD22 ASN 86 83.861 10.620 0.550 630 H GLY 87 H GLY 87 84.219 6.767 4.857 631 HA2 GLY 87 HA2 GLY 87 85.041 7.671 6.886 632 HA3 GLY 87 HA3 GLY 87 85.638 9.067 5.996 633 H LYS 88 H LYS 88 82.341 7.629 5.721 634 HA LYS 88 HA LYS 88 81.291 10.175 6.546 635 HB2 LYS 88 HB2 LYS 88 80.636 8.053 4.576 636 HB3 LYS 88 HB3 LYS 88 79.387 9.102 5.184 637 HG2 LYS 88 HG2 LYS 88 80.552 11.033 4.206 638 HG3 LYS 88 HG3 LYS 88 81.900 9.991 3.743 639 HD2 LYS 88 HD2 LYS 88 80.524 8.777 2.204 640 HD3 LYS 88 HD3 LYS 88 79.073 9.596 2.764 641 HE2 LYS 88 HE2 LYS 88 81.395 10.953 1.395 642 HE3 LYS 88 HE3 LYS 88 79.943 10.403 0.573 643 HZ1 LYS 88 HZ1 LYS 88 79.856 12.766 1.088 644 HZ2 LYS 88 HZ2 LYS 88 80.020 12.491 2.717 645 HZ3 LYS 88 HZ3 LYS 88 78.628 11.960 1.895 646 HA PRO 89 HA PRO 89 79.294 7.784 9.830 647 HB2 PRO 89 HB2 PRO 89 77.031 9.304 10.145 648 HB3 PRO 89 HB3 PRO 89 78.602 9.766 10.806 649 HG2 PRO 89 HG2 PRO 89 77.257 10.685 8.302 650 HG3 PRO 89 HG3 PRO 89 78.160 11.638 9.492 651 HD2 PRO 89 HD2 PRO 89 79.230 10.871 7.141 652 HD3 PRO 89 HD3 PRO 89 80.202 11.003 8.620 653 H GLY 90 H GLY 90 78.166 5.946 9.559 654 HA2 GLY 90 HA2 GLY 90 76.413 5.745 7.238 655 HA3 GLY 90 HA3 GLY 90 77.132 4.400 8.118 656 H PHE 91 H PHE 91 75.877 3.339 9.428 657 HA PHE 91 HA PHE 91 73.127 4.235 9.687 658 HB2 PHE 91 HB2 PHE 91 74.331 1.641 10.634 659 HB3 PHE 91 HB3 PHE 91 72.631 2.008 10.383 660 HD1 PHE 91 HD1 PHE 91 72.410 3.110 7.798 661 HD2 PHE 91 HD2 PHE 91 75.066 0.105 9.180 662 HE1 PHE 91 HE1 PHE 91 72.612 2.231 5.517 663 HE2 PHE 91 HE2 PHE 91 75.260 -0.768 6.914 664 HZ PHE 91 HZ PHE 91 74.047 0.303 5.070 665 H LYS 92 H LYS 92 72.044 4.139 11.718 666 HA LYS 92 HA LYS 92 73.758 4.752 13.930 667 HB2 LYS 92 HB2 LYS 92 71.712 5.508 14.951 668 HB3 LYS 92 HB3 LYS 92 71.955 6.326 13.433 669 HG2 LYS 92 HG2 LYS 92 70.222 5.011 12.427 670 HG3 LYS 92 HG3 LYS 92 70.205 3.935 13.828 671 HD2 LYS 92 HD2 LYS 92 69.445 6.857 13.949 672 HD3 LYS 92 HD3 LYS 92 68.277 5.557 13.723 673 HE2 LYS 92 HE2 LYS 92 69.087 4.561 15.871 674 HE3 LYS 92 HE3 LYS 92 70.090 5.990 16.102 675 HZ1 LYS 92 HZ1 LYS 92 68.018 6.171 17.303 676 HZ2 LYS 92 HZ2 LYS 92 67.136 5.932 15.917 677 HZ3 LYS 92 HZ3 LYS 92 68.055 7.342 16.094 678 H GLN 93 H GLN 93 73.014 3.790 15.945 679 HA GLN 93 HA GLN 93 72.090 1.055 15.643 680 HB2 GLN 93 HB2 GLN 93 73.628 2.651 17.575 681 HB3 GLN 93 HB3 GLN 93 72.880 1.175 18.149 682 HG2 GLN 93 HG2 GLN 93 75.284 0.831 17.642 683 HG3 GLN 93 HG3 GLN 93 74.272 -0.140 16.590 684 HE21 GLN 93 HE21 GLN 93 74.331 0.236 14.414 685 HE22 GLN 93 HE22 GLN 93 75.444 1.310 13.644 686 H GLY 94 H GLY 94 70.162 0.651 16.672 687 HA2 GLY 94 HA2 GLY 94 69.013 2.494 18.526 688 HA3 GLY 94 HA3 GLY 94 68.287 2.608 16.929 Start of MODEL 30 1 H GLU 2 H GLU 2 59.429 1.585 9.874 2 HA GLU 2 HA GLU 2 58.890 3.189 8.119 3 HB2 GLU 2 HB2 GLU 2 60.489 4.309 10.433 4 HB3 GLU 2 HB3 GLU 2 59.333 5.213 9.467 5 HG2 GLU 2 HG2 GLU 2 57.516 3.929 10.297 6 HG3 GLU 2 HG3 GLU 2 58.604 2.781 11.070 7 H LEU 3 H LEU 3 59.620 4.922 6.796 8 HA LEU 3 HA LEU 3 62.396 4.605 5.931 9 HB2 LEU 3 HB2 LEU 3 60.133 6.214 4.708 10 HB3 LEU 3 HB3 LEU 3 61.715 5.973 4.000 11 HG LEU 3 HG LEU 3 59.583 3.901 4.422 12 HD11 LEU 3 HD11 LEU 3 60.779 5.060 1.866 13 HD12 LEU 3 HD12 LEU 3 59.166 5.384 2.470 14 HD13 LEU 3 HD13 LEU 3 59.593 3.770 1.927 15 HD21 LEU 3 HD21 LEU 3 61.143 2.362 3.221 16 HD22 LEU 3 HD22 LEU 3 61.697 2.867 4.818 17 HD23 LEU 3 HD23 LEU 3 62.387 3.612 3.379 18 H LYS 4 H LYS 4 63.813 6.344 6.029 19 HA LYS 4 HA LYS 4 62.983 8.486 7.850 20 HB2 LYS 4 HB2 LYS 4 65.807 7.817 7.010 21 HB3 LYS 4 HB3 LYS 4 65.282 8.780 8.384 22 HG2 LYS 4 HG2 LYS 4 65.224 5.807 8.020 23 HG3 LYS 4 HG3 LYS 4 66.020 6.715 9.292 24 HD2 LYS 4 HD2 LYS 4 63.572 7.491 9.775 25 HD3 LYS 4 HD3 LYS 4 63.186 6.052 8.878 26 HE2 LYS 4 HE2 LYS 4 64.727 4.758 10.380 27 HE3 LYS 4 HE3 LYS 4 64.822 6.184 11.374 28 HZ1 LYS 4 HZ1 LYS 4 62.272 6.068 11.455 29 HZ2 LYS 4 HZ2 LYS 4 63.176 5.034 12.391 30 HZ3 LYS 4 HZ3 LYS 4 62.485 4.429 10.987 31 H ASN 5 H ASN 5 65.025 10.326 7.161 32 HA ASN 5 HA ASN 5 64.385 10.925 4.349 33 HB2 ASN 5 HB2 ASN 5 64.870 12.926 6.573 34 HB3 ASN 5 HB3 ASN 5 64.669 13.328 4.871 35 HD21 ASN 5 HD21 ASN 5 62.611 13.181 3.939 36 HD22 ASN 5 HD22 ASN 5 61.197 13.021 4.898 37 H SER 6 H SER 6 66.824 10.481 6.706 38 HA SER 6 HA SER 6 68.842 10.819 4.664 39 HB2 SER 6 HB2 SER 6 70.325 11.883 6.417 40 HB3 SER 6 HB3 SER 6 69.012 12.905 5.820 41 HG SER 6 HG SER 6 67.816 12.127 7.675 42 H ILE 7 H ILE 7 70.980 9.782 5.486 43 HA ILE 7 HA ILE 7 70.346 7.091 6.203 44 HB ILE 7 HB ILE 7 72.278 7.858 4.667 45 HG12 ILE 7 HG12 ILE 7 73.859 5.992 5.642 46 HG13 ILE 7 HG13 ILE 7 72.551 5.776 6.802 47 HG21 ILE 7 HG21 ILE 7 74.425 8.313 5.652 48 HG22 ILE 7 HG22 ILE 7 73.706 8.322 7.260 49 HG23 ILE 7 HG23 ILE 7 73.253 9.560 6.087 50 HD11 ILE 7 HD11 ILE 7 72.531 4.246 4.966 51 HD12 ILE 7 HD12 ILE 7 72.416 5.572 3.838 52 HD13 ILE 7 HD13 ILE 7 71.068 5.246 4.959 53 H SER 8 H SER 8 71.043 9.877 7.982 54 HA SER 8 HA SER 8 72.490 8.800 10.153 55 HB2 SER 8 HB2 SER 8 70.868 11.333 9.970 56 HB3 SER 8 HB3 SER 8 72.205 10.996 11.087 57 HG SER 8 HG SER 8 73.067 12.136 9.440 58 H ASP 9 H ASP 9 69.158 8.767 9.336 59 HA ASP 9 HA ASP 9 68.532 8.212 12.132 60 HB2 ASP 9 HB2 ASP 9 67.124 9.898 10.723 61 HB3 ASP 9 HB3 ASP 9 66.529 8.480 9.943 62 H TYR 10 H TYR 10 69.704 6.551 9.770 63 HA TYR 10 HA TYR 10 67.699 4.441 9.750 64 HB2 TYR 10 HB2 TYR 10 69.875 5.129 7.830 65 HB3 TYR 10 HB3 TYR 10 69.449 3.436 8.004 66 HD1 TYR 10 HD1 TYR 10 67.111 2.719 7.516 67 HD2 TYR 10 HD2 TYR 10 68.497 6.620 6.580 68 HE1 TYR 10 HE1 TYR 10 65.218 3.007 5.968 69 HE2 TYR 10 HE2 TYR 10 66.616 6.922 5.029 70 HH TYR 10 HH TYR 10 65.011 5.643 3.801 71 H THR 11 H THR 11 67.931 2.821 11.021 72 HA THR 11 HA THR 11 70.495 2.239 12.206 73 HB THR 11 HB THR 11 69.238 0.468 13.397 74 HG1 THR 11 HG1 THR 11 66.820 0.644 13.009 75 HG21 THR 11 HG21 THR 11 67.633 1.874 14.632 76 HG22 THR 11 HG22 THR 11 67.773 3.110 13.379 77 HG23 THR 11 HG23 THR 11 69.172 2.685 14.369 78 H GLU 12 H GLU 12 71.077 -0.211 12.019 79 HA GLU 12 HA GLU 12 71.656 -0.937 9.391 80 HB2 GLU 12 HB2 GLU 12 71.004 -3.066 11.384 81 HB3 GLU 12 HB3 GLU 12 72.287 -2.997 10.192 82 HG2 GLU 12 HG2 GLU 12 72.173 -1.331 12.630 83 HG3 GLU 12 HG3 GLU 12 72.950 -2.900 12.565 84 H ALA 13 H ALA 13 69.104 -2.030 11.548 85 HA ALA 13 HA ALA 13 68.022 -3.729 9.646 86 HB1 ALA 13 HB1 ALA 13 66.243 -4.226 11.253 87 HB2 ALA 13 HB2 ALA 13 66.717 -2.821 12.208 88 HB3 ALA 13 HB3 ALA 13 67.824 -4.185 12.037 89 H GLU 14 H GLU 14 67.054 -0.429 10.724 90 HA GLU 14 HA GLU 14 64.674 -0.311 9.205 91 HB2 GLU 14 HB2 GLU 14 66.526 1.824 10.234 92 HB3 GLU 14 HB3 GLU 14 65.220 2.259 9.148 93 HG2 GLU 14 HG2 GLU 14 64.781 0.767 11.728 94 HG3 GLU 14 HG3 GLU 14 64.777 2.524 11.618 95 H PHE 15 H PHE 15 68.036 0.133 8.354 96 HA PHE 15 HA PHE 15 67.478 1.129 5.767 97 HB2 PHE 15 HB2 PHE 15 69.727 1.267 7.072 98 HB3 PHE 15 HB3 PHE 15 69.948 -0.376 6.535 99 HD1 PHE 15 HD1 PHE 15 69.043 2.924 5.067 100 HD2 PHE 15 HD2 PHE 15 71.122 -0.736 4.641 101 HE1 PHE 15 HE1 PHE 15 69.992 3.712 2.932 102 HE2 PHE 15 HE2 PHE 15 72.069 0.044 2.507 103 HZ PHE 15 HZ PHE 15 71.499 2.271 1.661 104 H VAL 16 H VAL 16 68.221 -2.104 7.089 105 HA VAL 16 HA VAL 16 68.137 -3.364 4.586 106 HB VAL 16 HB VAL 16 68.179 -5.468 5.602 107 HG11 VAL 16 HG11 VAL 16 69.799 -5.455 7.270 108 HG12 VAL 16 HG12 VAL 16 69.465 -3.748 7.589 109 HG13 VAL 16 HG13 VAL 16 70.080 -4.243 6.009 110 HG21 VAL 16 HG21 VAL 16 66.926 -4.335 8.057 111 HG22 VAL 16 HG22 VAL 16 67.545 -6.005 7.831 112 HG23 VAL 16 HG23 VAL 16 66.211 -5.406 6.835 113 H GLN 17 H GLN 17 65.550 -2.475 6.756 114 HA GLN 17 HA GLN 17 63.381 -3.838 5.677 115 HB2 GLN 17 HB2 GLN 17 63.183 -2.570 7.665 116 HB3 GLN 17 HB3 GLN 17 63.812 -1.125 6.893 117 HG2 GLN 17 HG2 GLN 17 61.738 -1.520 5.360 118 HG3 GLN 17 HG3 GLN 17 61.124 -2.326 6.812 119 HE21 GLN 17 HE21 GLN 17 63.317 0.444 6.812 120 HE22 GLN 17 HE22 GLN 17 62.248 1.573 7.491 121 H LEU 18 H LEU 18 64.802 -0.690 4.890 122 HA LEU 18 HA LEU 18 63.175 0.036 2.734 123 HB2 LEU 18 HB2 LEU 18 64.535 1.576 3.783 124 HB3 LEU 18 HB3 LEU 18 66.004 0.776 3.551 125 HG LEU 18 HG LEU 18 65.534 1.094 0.990 126 HD11 LEU 18 HD11 LEU 18 63.818 3.276 2.080 127 HD12 LEU 18 HD12 LEU 18 63.253 1.835 1.235 128 HD13 LEU 18 HD13 LEU 18 64.259 3.019 0.390 129 HD21 LEU 18 HD21 LEU 18 66.299 3.413 2.739 130 HD22 LEU 18 HD22 LEU 18 66.611 3.258 1.002 131 HD23 LEU 18 HD23 LEU 18 67.362 2.133 2.136 132 H LEU 19 H LEU 19 66.185 -1.579 2.948 133 HA LEU 19 HA LEU 19 66.787 -2.063 0.283 134 HB2 LEU 19 HB2 LEU 19 67.304 -3.462 2.751 135 HB3 LEU 19 HB3 LEU 19 68.138 -3.951 1.245 136 HG LEU 19 HG LEU 19 68.374 -1.521 2.980 137 HD11 LEU 19 HD11 LEU 19 69.870 -3.258 3.382 138 HD12 LEU 19 HD12 LEU 19 70.720 -1.886 2.629 139 HD13 LEU 19 HD13 LEU 19 70.324 -3.316 1.681 140 HD21 LEU 19 HD21 LEU 19 69.677 -0.397 1.276 141 HD22 LEU 19 HD22 LEU 19 67.967 -0.544 0.886 142 HD23 LEU 19 HD23 LEU 19 69.150 -1.599 0.083 143 H LYS 20 H LYS 20 64.908 -4.032 2.512 144 HA LYS 20 HA LYS 20 64.417 -6.160 0.739 145 HB2 LYS 20 HB2 LYS 20 62.858 -5.172 3.125 146 HB3 LYS 20 HB3 LYS 20 62.477 -6.662 2.287 147 HG2 LYS 20 HG2 LYS 20 64.780 -7.458 2.807 148 HG3 LYS 20 HG3 LYS 20 65.015 -5.994 3.739 149 HD2 LYS 20 HD2 LYS 20 63.165 -6.592 5.224 150 HD3 LYS 20 HD3 LYS 20 62.892 -8.070 4.296 151 HE2 LYS 20 HE2 LYS 20 65.144 -8.841 4.860 152 HE3 LYS 20 HE3 LYS 20 65.426 -7.364 5.773 153 HZ1 LYS 20 HZ1 LYS 20 63.403 -9.447 6.399 154 HZ2 LYS 20 HZ2 LYS 20 63.605 -8.031 7.268 155 HZ3 LYS 20 HZ3 LYS 20 64.839 -9.180 7.224 156 H GLU 21 H GLU 21 62.786 -3.142 1.362 157 HA GLU 21 HA GLU 21 60.561 -3.701 -0.269 158 HB2 GLU 21 HB2 GLU 21 61.622 -1.061 0.719 159 HB3 GLU 21 HB3 GLU 21 60.071 -1.284 -0.072 160 HG2 GLU 21 HG2 GLU 21 60.903 -2.554 2.526 161 HG3 GLU 21 HG3 GLU 21 59.864 -1.144 2.359 162 H ILE 22 H ILE 22 63.659 -2.081 -0.820 163 HA ILE 22 HA ILE 22 63.030 -1.141 -3.384 164 HB ILE 22 HB ILE 22 65.828 -2.074 -2.672 165 HG12 ILE 22 HG12 ILE 22 64.526 0.580 -2.042 166 HG13 ILE 22 HG13 ILE 22 64.962 -0.628 -0.850 167 HG21 ILE 22 HG21 ILE 22 65.361 -1.415 -4.998 168 HG22 ILE 22 HG22 ILE 22 66.415 -0.221 -4.221 169 HG23 ILE 22 HG23 ILE 22 64.706 0.114 -4.431 170 HD11 ILE 22 HD11 ILE 22 67.320 -0.348 -1.415 171 HD12 ILE 22 HD12 ILE 22 66.593 1.178 -0.910 172 HD13 ILE 22 HD13 ILE 22 66.887 0.866 -2.618 173 H GLU 23 H GLU 23 64.265 -4.259 -2.281 174 HA GLU 23 HA GLU 23 64.793 -5.417 -4.750 175 HB2 GLU 23 HB2 GLU 23 63.716 -6.654 -2.261 176 HB3 GLU 23 HB3 GLU 23 64.122 -7.604 -3.663 177 HG2 GLU 23 HG2 GLU 23 66.479 -6.497 -3.363 178 HG3 GLU 23 HG3 GLU 23 65.865 -6.137 -1.743 179 H LYS 24 H LYS 24 61.751 -5.293 -2.922 180 HA LYS 24 HA LYS 24 60.404 -6.963 -4.756 181 HB2 LYS 24 HB2 LYS 24 58.445 -6.675 -3.489 182 HB3 LYS 24 HB3 LYS 24 59.782 -6.559 -2.354 183 HG2 LYS 24 HG2 LYS 24 59.558 -4.146 -2.302 184 HG3 LYS 24 HG3 LYS 24 58.270 -4.232 -3.505 185 HD2 LYS 24 HD2 LYS 24 56.998 -5.670 -1.893 186 HD3 LYS 24 HD3 LYS 24 58.233 -5.308 -0.689 187 HE2 LYS 24 HE2 LYS 24 56.421 -3.804 -0.326 188 HE3 LYS 24 HE3 LYS 24 57.746 -2.889 -1.024 189 HZ1 LYS 24 HZ1 LYS 24 56.631 -2.923 -3.185 190 HZ2 LYS 24 HZ2 LYS 24 55.585 -2.329 -2.022 191 HZ3 LYS 24 HZ3 LYS 24 55.402 -3.899 -2.566 192 H GLU 25 H GLU 25 60.692 -3.433 -4.536 193 HA GLU 25 HA GLU 25 58.833 -2.952 -6.597 194 HB2 GLU 25 HB2 GLU 25 61.076 -1.219 -5.514 195 HB3 GLU 25 HB3 GLU 25 59.826 -0.692 -6.628 196 HG2 GLU 25 HG2 GLU 25 59.423 -1.643 -3.820 197 HG3 GLU 25 HG3 GLU 25 59.300 0.015 -4.410 198 H ASN 26 H ASN 26 62.228 -3.644 -6.453 199 HA ASN 26 HA ASN 26 62.788 -3.039 -9.169 200 HB2 ASN 26 HB2 ASN 26 64.624 -3.059 -7.607 201 HB3 ASN 26 HB3 ASN 26 64.290 -4.724 -7.153 202 HD21 ASN 26 HD21 ASN 26 65.017 -6.389 -8.468 203 HD22 ASN 26 HD22 ASN 26 66.064 -6.136 -9.805 204 H VAL 27 H VAL 27 62.167 -6.109 -7.481 205 HA VAL 27 HA VAL 27 62.481 -7.627 -9.857 206 HB VAL 27 HB VAL 27 61.651 -9.577 -8.616 207 HG11 VAL 27 HG11 VAL 27 63.971 -8.967 -8.367 208 HG12 VAL 27 HG12 VAL 27 63.348 -9.640 -6.860 209 HG13 VAL 27 HG13 VAL 27 63.569 -7.898 -7.023 210 HG21 VAL 27 HG21 VAL 27 59.877 -8.555 -7.315 211 HG22 VAL 27 HG22 VAL 27 61.067 -7.593 -6.446 212 HG23 VAL 27 HG23 VAL 27 61.024 -9.342 -6.217 213 H ALA 28 H ALA 28 59.654 -6.192 -8.361 214 HA ALA 28 HA ALA 28 57.914 -7.454 -10.312 215 HB1 ALA 28 HB1 ALA 28 56.111 -6.228 -9.209 216 HB2 ALA 28 HB2 ALA 28 57.292 -5.328 -8.260 217 HB3 ALA 28 HB3 ALA 28 57.105 -7.065 -8.015 218 H ALA 29 H ALA 29 59.945 -4.880 -10.157 219 HA ALA 29 HA ALA 29 60.397 -3.045 -11.265 220 HB1 ALA 29 HB1 ALA 29 60.227 -3.075 -13.644 221 HB2 ALA 29 HB2 ALA 29 59.014 -4.357 -13.595 222 HB3 ALA 29 HB3 ALA 29 60.675 -4.683 -13.075 223 H THR 30 H THR 30 59.112 -1.752 -9.963 224 HA THR 30 HA THR 30 56.739 -0.713 -11.305 225 HB THR 30 HB THR 30 56.301 0.370 -9.109 226 HG1 THR 30 HG1 THR 30 57.638 -0.411 -7.329 227 HG21 THR 30 HG21 THR 30 55.785 -1.677 -7.855 228 HG22 THR 30 HG22 THR 30 56.834 -2.581 -8.953 229 HG23 THR 30 HG23 THR 30 55.355 -1.835 -9.565 230 H ASP 31 H ASP 31 56.802 1.895 -10.355 231 HA ASP 31 HA ASP 31 59.491 2.867 -10.854 232 HB2 ASP 31 HB2 ASP 31 58.993 4.412 -12.582 233 HB3 ASP 31 HB3 ASP 31 58.376 2.854 -13.102 234 H ASP 32 H ASP 32 56.318 3.515 -9.571 235 HA ASP 32 HA ASP 32 57.048 6.158 -8.765 236 HB2 ASP 32 HB2 ASP 32 54.786 4.390 -7.829 237 HB3 ASP 32 HB3 ASP 32 55.094 5.983 -7.154 238 H VAL 33 H VAL 33 56.874 3.232 -6.818 239 HA VAL 33 HA VAL 33 58.270 4.725 -4.838 240 HB VAL 33 HB VAL 33 57.134 1.924 -4.843 241 HG11 VAL 33 HG11 VAL 33 59.146 2.068 -3.590 242 HG12 VAL 33 HG12 VAL 33 57.725 1.908 -2.502 243 HG13 VAL 33 HG13 VAL 33 58.531 3.493 -2.752 244 HG21 VAL 33 HG21 VAL 33 56.602 4.448 -3.468 245 HG22 VAL 33 HG22 VAL 33 55.749 2.909 -3.154 246 HG23 VAL 33 HG23 VAL 33 55.600 3.739 -4.748 247 H LEU 34 H LEU 34 58.842 2.376 -7.242 248 HA LEU 34 HA LEU 34 61.337 1.388 -6.434 249 HB2 LEU 34 HB2 LEU 34 59.871 0.615 -8.395 250 HB3 LEU 34 HB3 LEU 34 60.396 2.038 -9.202 251 HG LEU 34 HG LEU 34 61.479 -0.243 -9.785 252 HD11 LEU 34 HD11 LEU 34 63.026 2.294 -9.532 253 HD12 LEU 34 HD12 LEU 34 61.963 1.795 -10.858 254 HD13 LEU 34 HD13 LEU 34 63.458 0.906 -10.545 255 HD21 LEU 34 HD21 LEU 34 62.265 -0.811 -7.548 256 HD22 LEU 34 HD22 LEU 34 63.221 0.670 -7.494 257 HD23 LEU 34 HD23 LEU 34 63.625 -0.599 -8.652 258 H ASP 35 H ASP 35 60.485 4.298 -8.268 259 HA ASP 35 HA ASP 35 63.255 5.031 -8.380 260 HB2 ASP 35 HB2 ASP 35 61.443 5.887 -10.036 261 HB3 ASP 35 HB3 ASP 35 61.035 6.972 -8.694 262 H VAL 36 H VAL 36 60.676 5.744 -6.157 263 HA VAL 36 HA VAL 36 61.874 7.838 -4.737 264 HB VAL 36 HB VAL 36 60.509 5.482 -3.453 265 HG11 VAL 36 HG11 VAL 36 60.057 7.044 -1.618 266 HG12 VAL 36 HG12 VAL 36 60.989 8.268 -2.535 267 HG13 VAL 36 HG13 VAL 36 61.786 6.795 -1.976 268 HG21 VAL 36 HG21 VAL 36 59.096 6.515 -5.054 269 HG22 VAL 36 HG22 VAL 36 59.328 8.089 -4.196 270 HG23 VAL 36 HG23 VAL 36 58.592 6.677 -3.360 271 H LEU 37 H LEU 37 62.062 4.404 -4.403 272 HA LEU 37 HA LEU 37 63.666 4.438 -2.106 273 HB2 LEU 37 HB2 LEU 37 63.418 2.159 -4.008 274 HB3 LEU 37 HB3 LEU 37 63.830 2.260 -2.305 275 HG LEU 37 HG LEU 37 61.083 2.932 -3.275 276 HD11 LEU 37 HD11 LEU 37 61.479 0.577 -3.604 277 HD12 LEU 37 HD12 LEU 37 60.335 0.880 -2.305 278 HD13 LEU 37 HD13 LEU 37 62.000 0.411 -1.918 279 HD21 LEU 37 HD21 LEU 37 61.708 4.081 -1.223 280 HD22 LEU 37 HD22 LEU 37 62.191 2.546 -0.498 281 HD23 LEU 37 HD23 LEU 37 60.501 2.838 -0.895 282 H LEU 38 H LEU 38 64.268 3.933 -5.491 283 HA LEU 38 HA LEU 38 66.953 3.285 -5.264 284 HB2 LEU 38 HB2 LEU 38 65.299 4.483 -7.379 285 HB3 LEU 38 HB3 LEU 38 67.006 4.185 -7.672 286 HG LEU 38 HG LEU 38 64.669 2.320 -7.303 287 HD11 LEU 38 HD11 LEU 38 65.216 3.019 -9.528 288 HD12 LEU 38 HD12 LEU 38 65.523 1.282 -9.301 289 HD13 LEU 38 HD13 LEU 38 66.865 2.430 -9.280 290 HD21 LEU 38 HD21 LEU 38 66.321 1.419 -5.774 291 HD22 LEU 38 HD22 LEU 38 67.549 1.479 -7.040 292 HD23 LEU 38 HD23 LEU 38 66.177 0.388 -7.196 293 H GLU 39 H GLU 39 65.430 6.470 -5.839 294 HA GLU 39 HA GLU 39 67.995 7.679 -5.753 295 HB2 GLU 39 HB2 GLU 39 66.798 9.839 -5.679 296 HB3 GLU 39 HB3 GLU 39 66.315 8.813 -7.006 297 HG2 GLU 39 HG2 GLU 39 64.259 8.447 -6.220 298 HG3 GLU 39 HG3 GLU 39 64.641 8.737 -4.545 299 H HIS 40 H HIS 40 65.543 7.060 -3.371 300 HA HIS 40 HA HIS 40 66.481 8.741 -1.301 301 HB2 HIS 40 HB2 HIS 40 64.279 7.593 -1.341 302 HB3 HIS 40 HB3 HIS 40 65.046 6.067 -1.102 303 HD1 HIS 40 HD1 HIS 40 63.513 8.775 0.785 304 HD2 HIS 40 HD2 HIS 40 66.473 5.946 1.472 305 HE1 HIS 40 HE1 HIS 40 63.809 8.658 3.247 306 H PHE 41 H PHE 41 67.088 5.419 -2.105 307 HA PHE 41 HA PHE 41 68.779 4.734 -0.046 308 HB2 PHE 41 HB2 PHE 41 67.819 3.072 -1.360 309 HB3 PHE 41 HB3 PHE 41 68.366 3.810 -2.849 310 HD1 PHE 41 HD1 PHE 41 69.435 1.955 0.152 311 HD2 PHE 41 HD2 PHE 41 70.406 3.178 -3.785 312 HE1 PHE 41 HE1 PHE 41 71.372 0.432 0.159 313 HE2 PHE 41 HE2 PHE 41 72.339 1.690 -3.769 314 HZ PHE 41 HZ PHE 41 72.827 0.312 -1.826 315 H VAL 42 H VAL 42 69.630 5.804 -3.328 316 HA VAL 42 HA VAL 42 72.380 5.880 -2.688 317 HB VAL 42 HB VAL 42 71.617 5.503 -4.985 318 HG11 VAL 42 HG11 VAL 42 70.759 8.317 -5.008 319 HG12 VAL 42 HG12 VAL 42 69.806 6.799 -5.133 320 HG13 VAL 42 HG13 VAL 42 70.987 7.213 -6.389 321 HG21 VAL 42 HG21 VAL 42 73.221 6.938 -6.151 322 HG22 VAL 42 HG22 VAL 42 73.896 6.252 -4.674 323 HG23 VAL 42 HG23 VAL 42 73.358 7.928 -4.702 324 H LYS 43 H LYS 43 69.938 8.301 -2.516 325 HA LYS 43 HA LYS 43 71.788 10.470 -2.221 326 HB2 LYS 43 HB2 LYS 43 69.954 11.859 -1.883 327 HB3 LYS 43 HB3 LYS 43 69.190 10.522 -2.718 328 HG2 LYS 43 HG2 LYS 43 68.541 9.632 -0.389 329 HG3 LYS 43 HG3 LYS 43 69.111 11.178 0.210 330 HD2 LYS 43 HD2 LYS 43 67.556 12.247 -1.496 331 HD3 LYS 43 HD3 LYS 43 66.818 10.669 -1.655 332 HE2 LYS 43 HE2 LYS 43 65.534 11.874 -0.037 333 HE3 LYS 43 HE3 LYS 43 66.472 10.668 0.838 334 HZ1 LYS 43 HZ1 LYS 43 66.545 12.803 1.957 335 HZ2 LYS 43 HZ2 LYS 43 67.170 13.551 0.586 336 HZ3 LYS 43 HZ3 LYS 43 68.094 12.428 1.405 337 H ILE 44 H ILE 44 70.429 8.207 0.045 338 HA ILE 44 HA ILE 44 71.440 9.760 2.242 339 HB ILE 44 HB ILE 44 70.560 7.965 3.735 340 HG12 ILE 44 HG12 ILE 44 69.605 6.727 1.146 341 HG13 ILE 44 HG13 ILE 44 70.837 6.039 2.184 342 HG21 ILE 44 HG21 ILE 44 68.227 8.451 3.347 343 HG22 ILE 44 HG22 ILE 44 68.577 8.896 1.682 344 HG23 ILE 44 HG23 ILE 44 69.201 9.890 2.992 345 HD11 ILE 44 HD11 ILE 44 68.618 4.975 2.405 346 HD12 ILE 44 HD12 ILE 44 67.979 6.516 2.976 347 HD13 ILE 44 HD13 ILE 44 69.201 5.670 3.918 348 H THR 45 H THR 45 72.404 6.850 0.531 349 HA THR 45 HA THR 45 74.646 6.593 2.321 350 HB THR 45 HB THR 45 73.765 4.505 1.492 351 HG1 THR 45 HG1 THR 45 76.339 5.308 0.823 352 HG21 THR 45 HG21 THR 45 74.517 5.456 -1.279 353 HG22 THR 45 HG22 THR 45 72.875 5.296 -0.665 354 HG23 THR 45 HG23 THR 45 73.876 3.863 -0.875 355 H GLU 46 H GLU 46 74.033 8.094 -0.763 356 HA GLU 46 HA GLU 46 75.195 9.157 -2.232 357 HB2 GLU 46 HB2 GLU 46 76.839 9.695 0.203 358 HB3 GLU 46 HB3 GLU 46 77.282 10.420 -1.347 359 HG2 GLU 46 HG2 GLU 46 74.602 10.649 -0.026 360 HG3 GLU 46 HG3 GLU 46 75.873 11.886 0.110 361 H HIS 47 H HIS 47 75.503 6.502 -2.190 362 HA HIS 47 HA HIS 47 78.270 5.846 -2.700 363 HB2 HIS 47 HB2 HIS 47 76.645 4.218 -1.606 364 HB3 HIS 47 HB3 HIS 47 75.824 4.103 -3.160 365 HD1 HIS 47 HD1 HIS 47 76.777 2.334 -4.779 366 HD2 HIS 47 HD2 HIS 47 79.323 3.284 -1.662 367 HE1 HIS 47 HE1 HIS 47 78.846 0.904 -5.057 368 HA PRO 48 HA PRO 48 77.858 7.194 -6.964 369 HB2 PRO 48 HB2 PRO 48 79.978 5.267 -7.566 370 HB3 PRO 48 HB3 PRO 48 79.949 7.026 -7.766 371 HG2 PRO 48 HG2 PRO 48 81.366 5.716 -5.979 372 HG3 PRO 48 HG3 PRO 48 80.662 7.306 -5.530 373 HD2 PRO 48 HD2 PRO 48 79.775 4.510 -4.917 374 HD3 PRO 48 HD3 PRO 48 79.790 5.904 -3.835 375 H ASP 49 H ASP 49 77.518 3.971 -6.023 376 HA ASP 49 HA ASP 49 76.805 3.318 -8.685 377 HB2 ASP 49 HB2 ASP 49 77.984 1.355 -6.689 378 HB3 ASP 49 HB3 ASP 49 77.516 0.966 -8.319 379 H GLY 50 H GLY 50 75.349 4.385 -6.453 380 HA2 GLY 50 HA2 GLY 50 74.034 2.812 -4.508 381 HA3 GLY 50 HA3 GLY 50 73.369 4.191 -5.347 382 H THR 51 H THR 51 72.917 3.449 -7.625 383 HA THR 51 HA THR 51 70.694 1.758 -6.949 384 HB THR 51 HB THR 51 70.950 2.512 -9.780 385 HG1 THR 51 HG1 THR 51 70.173 4.749 -8.772 386 HG21 THR 51 HG21 THR 51 68.630 3.192 -9.336 387 HG22 THR 51 HG22 THR 51 68.875 2.921 -7.617 388 HG23 THR 51 HG23 THR 51 68.937 1.572 -8.715 389 H ALA 52 H ALA 52 73.589 1.512 -8.825 390 HA ALA 52 HA ALA 52 73.164 -0.956 -10.132 391 HB1 ALA 52 HB1 ALA 52 75.024 0.585 -10.630 392 HB2 ALA 52 HB2 ALA 52 75.570 -1.057 -10.275 393 HB3 ALA 52 HB3 ALA 52 75.718 0.205 -9.055 394 H LEU 53 H LEU 53 74.229 -0.210 -6.881 395 HA LEU 53 HA LEU 53 74.908 -2.804 -6.093 396 HB2 LEU 53 HB2 LEU 53 73.701 -0.606 -4.454 397 HB3 LEU 53 HB3 LEU 53 74.284 -2.118 -3.795 398 HG LEU 53 HG LEU 53 75.902 0.058 -5.101 399 HD11 LEU 53 HD11 LEU 53 75.231 0.453 -2.820 400 HD12 LEU 53 HD12 LEU 53 76.964 0.149 -2.923 401 HD13 LEU 53 HD13 LEU 53 75.878 -1.116 -2.336 402 HD21 LEU 53 HD21 LEU 53 77.857 -1.341 -4.613 403 HD22 LEU 53 HD22 LEU 53 76.806 -2.083 -5.810 404 HD23 LEU 53 HD23 LEU 53 76.789 -2.662 -4.142 405 H ILE 54 H ILE 54 71.731 -1.244 -6.074 406 HA ILE 54 HA ILE 54 70.556 -3.568 -4.819 407 HB ILE 54 HB ILE 54 68.864 -1.720 -6.535 408 HG12 ILE 54 HG12 ILE 54 68.236 -0.893 -4.072 409 HG13 ILE 54 HG13 ILE 54 69.903 -1.356 -3.776 410 HG21 ILE 54 HG21 ILE 54 67.026 -2.502 -5.127 411 HG22 ILE 54 HG22 ILE 54 68.143 -3.564 -4.273 412 HG23 ILE 54 HG23 ILE 54 67.818 -3.824 -5.986 413 HD11 ILE 54 HD11 ILE 54 70.661 0.115 -5.518 414 HD12 ILE 54 HD12 ILE 54 69.696 0.991 -4.327 415 HD13 ILE 54 HD13 ILE 54 68.998 0.562 -5.887 416 H TYR 55 H TYR 55 70.808 -2.463 -8.082 417 HA TYR 55 HA TYR 55 69.462 -4.472 -9.402 418 HB2 TYR 55 HB2 TYR 55 71.671 -2.629 -10.085 419 HB3 TYR 55 HB3 TYR 55 71.331 -3.919 -11.211 420 HD1 TYR 55 HD1 TYR 55 70.034 -0.875 -9.610 421 HD2 TYR 55 HD2 TYR 55 69.296 -3.835 -12.563 422 HE1 TYR 55 HE1 TYR 55 68.251 0.512 -10.531 423 HE2 TYR 55 HE2 TYR 55 67.491 -2.451 -13.501 424 HH TYR 55 HH TYR 55 66.016 -0.676 -12.848 425 H GLU 56 H GLU 56 72.907 -4.370 -8.474 426 HA GLU 56 HA GLU 56 73.222 -7.025 -9.359 427 HB2 GLU 56 HB2 GLU 56 75.465 -6.974 -8.146 428 HB3 GLU 56 HB3 GLU 56 75.262 -5.869 -9.473 429 HG2 GLU 56 HG2 GLU 56 74.878 -4.082 -7.969 430 HG3 GLU 56 HG3 GLU 56 75.119 -5.109 -6.574 431 H ALA 57 H ALA 57 72.462 -5.669 -6.234 432 HA ALA 57 HA ALA 57 72.845 -7.965 -4.689 433 HB1 ALA 57 HB1 ALA 57 70.646 -5.922 -4.372 434 HB2 ALA 57 HB2 ALA 57 72.281 -5.775 -3.724 435 HB3 ALA 57 HB3 ALA 57 71.209 -7.045 -3.135 436 H ALA 58 H ALA 58 70.068 -6.976 -6.585 437 HA ALA 58 HA ALA 58 68.423 -9.140 -5.952 438 HB1 ALA 58 HB1 ALA 58 68.482 -7.530 -8.500 439 HB2 ALA 58 HB2 ALA 58 67.619 -7.089 -7.026 440 HB3 ALA 58 HB3 ALA 58 67.141 -8.524 -7.929 441 H ALA 59 H ALA 59 70.689 -8.686 -8.653 442 HA ALA 59 HA ALA 59 70.213 -11.196 -9.882 443 HB1 ALA 59 HB1 ALA 59 71.227 -9.297 -11.074 444 HB2 ALA 59 HB2 ALA 59 72.230 -10.742 -11.181 445 HB3 ALA 59 HB3 ALA 59 72.670 -9.445 -10.070 446 H ARG 60 H ARG 60 72.662 -10.097 -7.604 447 HA ARG 60 HA ARG 60 74.103 -12.524 -7.494 448 HB2 ARG 60 HB2 ARG 60 73.916 -10.341 -5.419 449 HB3 ARG 60 HB3 ARG 60 75.106 -11.632 -5.416 450 HG2 ARG 60 HG2 ARG 60 76.102 -10.805 -7.448 451 HG3 ARG 60 HG3 ARG 60 74.829 -9.596 -7.618 452 HD2 ARG 60 HD2 ARG 60 77.006 -9.700 -5.519 453 HD3 ARG 60 HD3 ARG 60 76.734 -8.499 -6.764 454 HE ARG 60 HE ARG 60 74.483 -8.708 -5.069 455 HH11 ARG 60 HH11 ARG 60 77.725 -7.275 -5.161 456 HH12 ARG 60 HH12 ARG 60 77.331 -6.030 -4.070 457 HH21 ARG 60 HH21 ARG 60 74.006 -6.952 -3.542 458 HH22 ARG 60 HH22 ARG 60 75.281 -5.856 -3.178 459 H ALA 61 H ALA 61 71.273 -11.368 -5.779 460 HA ALA 61 HA ALA 61 71.272 -13.588 -3.945 461 HB1 ALA 61 HB1 ALA 61 69.064 -12.823 -3.306 462 HB2 ALA 61 HB2 ALA 61 69.004 -11.758 -4.711 463 HB3 ALA 61 HB3 ALA 61 70.156 -11.438 -3.415 464 H ALA 62 H ALA 62 69.798 -12.897 -7.059 465 HA ALA 62 HA ALA 62 68.156 -15.155 -7.178 466 HB1 ALA 62 HB1 ALA 62 68.156 -14.806 -9.611 467 HB2 ALA 62 HB2 ALA 62 69.514 -13.687 -9.446 468 HB3 ALA 62 HB3 ALA 62 67.951 -13.283 -8.745 469 H ALA 63 H ALA 63 71.471 -14.655 -8.295 470 HA ALA 63 HA ALA 63 71.914 -17.367 -9.014 471 HB1 ALA 63 HB1 ALA 63 74.295 -16.766 -9.040 472 HB2 ALA 63 HB2 ALA 63 73.928 -15.256 -8.207 473 HB3 ALA 63 HB3 ALA 63 73.333 -15.526 -9.844 474 H ASN 64 H ASN 64 72.710 -15.453 -6.181 475 HA ASN 64 HA ASN 64 73.055 -15.827 -4.045 476 HB2 ASN 64 HB2 ASN 64 70.900 -16.998 -4.139 477 HB3 ASN 64 HB3 ASN 64 71.734 -18.499 -4.499 478 HD21 ASN 64 HD21 ASN 64 70.823 -16.238 -2.115 479 HD22 ASN 64 HD22 ASN 64 71.403 -17.092 -0.739 480 HA PRO 65 HA PRO 65 76.819 -18.328 -4.370 481 HB2 PRO 65 HB2 PRO 65 78.589 -16.276 -4.244 482 HB3 PRO 65 HB3 PRO 65 77.832 -16.797 -5.750 483 HG2 PRO 65 HG2 PRO 65 77.420 -14.326 -4.257 484 HG3 PRO 65 HG3 PRO 65 76.878 -14.742 -5.888 485 HD2 PRO 65 HD2 PRO 65 75.391 -14.825 -3.361 486 HD3 PRO 65 HD3 PRO 65 74.779 -14.909 -5.025 487 H GLY 66 H GLY 66 75.297 -16.635 -2.037 488 HA2 GLY 66 HA2 GLY 66 76.028 -17.629 0.239 489 HA3 GLY 66 HA3 GLY 66 77.455 -16.641 -0.078 490 H GLY 67 H GLY 67 77.036 -15.331 1.733 491 HA2 GLY 67 HA2 GLY 67 74.538 -13.826 1.741 492 HA3 GLY 67 HA3 GLY 67 75.755 -13.844 3.008 493 H ASP 68 H ASP 68 77.726 -13.485 0.647 494 HA ASP 68 HA ASP 68 78.036 -10.677 0.988 495 HB2 ASP 68 HB2 ASP 68 79.416 -12.502 -0.995 496 HB3 ASP 68 HB3 ASP 68 79.829 -10.815 -0.761 497 H GLY 69 H GLY 69 76.269 -9.646 0.340 498 HA2 GLY 69 HA2 GLY 69 75.264 -8.205 -1.169 499 HA3 GLY 69 HA3 GLY 69 76.217 -8.934 -2.451 500 H GLY 70 H GLY 70 74.804 -11.364 -0.811 501 HA2 GLY 70 HA2 GLY 70 72.810 -11.696 -2.908 502 HA3 GLY 70 HA3 GLY 70 73.371 -12.951 -1.811 503 H GLY 71 H GLY 71 71.606 -9.891 -1.821 504 HA2 GLY 71 HA2 GLY 71 69.274 -10.395 -1.085 505 HA3 GLY 71 HA3 GLY 71 70.044 -10.916 0.409 506 HA PRO 72 HA PRO 72 68.984 -6.328 0.383 507 HB2 PRO 72 HB2 PRO 72 67.441 -6.501 2.666 508 HB3 PRO 72 HB3 PRO 72 66.827 -6.502 1.011 509 HG2 PRO 72 HG2 PRO 72 67.261 -8.786 2.869 510 HG3 PRO 72 HG3 PRO 72 65.992 -8.553 1.656 511 HD2 PRO 72 HD2 PRO 72 68.132 -10.174 1.288 512 HD3 PRO 72 HD3 PRO 72 67.321 -9.354 -0.057 513 H GLU 73 H GLU 73 69.670 -8.577 3.025 514 HA GLU 73 HA GLU 73 70.832 -6.601 4.636 515 HB2 GLU 73 HB2 GLU 73 71.091 -9.593 4.811 516 HB3 GLU 73 HB3 GLU 73 71.518 -8.449 6.078 517 HG2 GLU 73 HG2 GLU 73 69.220 -7.729 6.233 518 HG3 GLU 73 HG3 GLU 73 68.764 -8.824 4.935 519 H GLY 74 H GLY 74 72.002 -7.852 1.860 520 HA2 GLY 74 HA2 GLY 74 74.653 -7.392 2.892 521 HA3 GLY 74 HA3 GLY 74 74.412 -8.342 1.383 522 H ILE 75 H ILE 75 72.434 -5.963 0.826 523 HA ILE 75 HA ILE 75 74.264 -4.327 -0.634 524 HB ILE 75 HB ILE 75 71.849 -2.874 0.081 525 HG12 ILE 75 HG12 ILE 75 71.424 -5.684 -1.049 526 HG13 ILE 75 HG13 ILE 75 70.855 -5.023 0.443 527 HG21 ILE 75 HG21 ILE 75 72.897 -3.931 -2.534 528 HG22 ILE 75 HG22 ILE 75 73.195 -2.340 -1.832 529 HG23 ILE 75 HG23 ILE 75 71.570 -2.781 -2.361 530 HD11 ILE 75 HD11 ILE 75 69.067 -5.098 -1.231 531 HD12 ILE 75 HD12 ILE 75 69.989 -3.946 -2.212 532 HD13 ILE 75 HD13 ILE 75 69.414 -3.486 -0.611 533 H VAL 76 H VAL 76 72.535 -4.014 2.338 534 HA VAL 76 HA VAL 76 73.340 -1.502 3.231 535 HB VAL 76 HB VAL 76 71.601 -2.574 4.245 536 HG11 VAL 76 HG11 VAL 76 73.185 -4.931 4.574 537 HG12 VAL 76 HG12 VAL 76 71.537 -4.586 3.932 538 HG13 VAL 76 HG13 VAL 76 71.846 -4.561 5.666 539 HG21 VAL 76 HG21 VAL 76 72.800 -1.197 5.870 540 HG22 VAL 76 HG22 VAL 76 73.772 -2.593 6.328 541 HG23 VAL 76 HG23 VAL 76 72.044 -2.575 6.668 542 H LYS 77 H LYS 77 74.676 -4.546 3.678 543 HA LYS 77 HA LYS 77 76.853 -3.859 5.310 544 HB2 LYS 77 HB2 LYS 77 76.142 -6.199 4.747 545 HB3 LYS 77 HB3 LYS 77 76.950 -5.991 3.200 546 HG2 LYS 77 HG2 LYS 77 79.080 -5.627 4.353 547 HG3 LYS 77 HG3 LYS 77 78.262 -5.823 5.896 548 HD2 LYS 77 HD2 LYS 77 79.278 -7.921 5.380 549 HD3 LYS 77 HD3 LYS 77 77.510 -8.014 5.164 550 HE2 LYS 77 HE2 LYS 77 78.697 -9.187 3.376 551 HE3 LYS 77 HE3 LYS 77 77.739 -7.839 2.783 552 HZ1 LYS 77 HZ1 LYS 77 79.822 -7.768 1.685 553 HZ2 LYS 77 HZ2 LYS 77 80.679 -7.994 3.096 554 HZ3 LYS 77 HZ3 LYS 77 79.958 -6.530 2.830 555 H GLU 78 H GLU 78 76.712 -4.123 1.781 556 HA GLU 78 HA GLU 78 79.265 -3.200 1.120 557 HB2 GLU 78 HB2 GLU 78 76.601 -2.947 -0.189 558 HB3 GLU 78 HB3 GLU 78 77.958 -2.392 -1.098 559 HG2 GLU 78 HG2 GLU 78 78.896 -4.750 -0.730 560 HG3 GLU 78 HG3 GLU 78 77.288 -5.134 -0.113 561 H ILE 79 H ILE 79 76.306 -1.474 1.530 562 HA ILE 79 HA ILE 79 77.199 1.175 1.230 563 HB ILE 79 HB ILE 79 74.823 0.088 2.809 564 HG12 ILE 79 HG12 ILE 79 74.645 -0.334 0.449 565 HG13 ILE 79 HG13 ILE 79 73.522 0.946 0.902 566 HG21 ILE 79 HG21 ILE 79 73.871 2.286 2.849 567 HG22 ILE 79 HG22 ILE 79 75.368 2.951 2.196 568 HG23 ILE 79 HG23 ILE 79 75.364 2.187 3.782 569 HD11 ILE 79 HD11 ILE 79 76.145 1.238 -0.533 570 HD12 ILE 79 HD12 ILE 79 75.193 2.584 0.077 571 HD13 ILE 79 HD13 ILE 79 74.523 1.526 -1.171 572 H LYS 80 H LYS 80 77.089 -0.818 4.110 573 HA LYS 80 HA LYS 80 77.859 1.292 5.828 574 HB2 LYS 80 HB2 LYS 80 77.419 -0.183 7.501 575 HB3 LYS 80 HB3 LYS 80 76.761 -1.167 6.213 576 HG2 LYS 80 HG2 LYS 80 78.994 -2.305 6.075 577 HG3 LYS 80 HG3 LYS 80 79.439 -1.466 7.557 578 HD2 LYS 80 HD2 LYS 80 77.176 -3.434 7.171 579 HD3 LYS 80 HD3 LYS 80 78.637 -3.660 8.127 580 HE2 LYS 80 HE2 LYS 80 76.470 -1.634 8.701 581 HE3 LYS 80 HE3 LYS 80 76.610 -3.210 9.459 582 HZ1 LYS 80 HZ1 LYS 80 77.478 -1.449 10.816 583 HZ2 LYS 80 HZ2 LYS 80 78.626 -1.041 9.658 584 HZ3 LYS 80 HZ3 LYS 80 78.689 -2.550 10.428 585 H GLU 81 H GLU 81 79.562 -1.264 4.128 586 HA GLU 81 HA GLU 81 82.057 -0.813 5.293 587 HB2 GLU 81 HB2 GLU 81 81.313 -2.136 2.683 588 HB3 GLU 81 HB3 GLU 81 82.940 -2.132 3.349 589 HG2 GLU 81 HG2 GLU 81 82.155 -3.341 5.318 590 HG3 GLU 81 HG3 GLU 81 80.510 -3.311 4.688 591 H TRP 82 H TRP 82 80.578 0.434 2.348 592 HA TRP 82 HA TRP 82 82.849 1.772 1.387 593 HB2 TRP 82 HB2 TRP 82 80.715 1.275 0.126 594 HB3 TRP 82 HB3 TRP 82 79.994 2.633 0.976 595 HD1 TRP 82 HD1 TRP 82 82.672 1.847 -1.660 596 HE1 TRP 82 HE1 TRP 82 83.035 3.947 -3.108 597 HE3 TRP 82 HE3 TRP 82 79.827 5.158 0.985 598 HZ2 TRP 82 HZ2 TRP 82 82.207 6.620 -3.148 599 HZ3 TRP 82 HZ3 TRP 82 79.666 7.466 0.190 600 HH2 TRP 82 HH2 TRP 82 80.841 8.198 -1.833 601 H ARG 83 H ARG 83 80.149 2.977 3.425 602 HA ARG 83 HA ARG 83 81.354 5.520 3.698 603 HB2 ARG 83 HB2 ARG 83 79.090 4.300 5.268 604 HB3 ARG 83 HB3 ARG 83 79.948 5.686 5.894 605 HG2 ARG 83 HG2 ARG 83 78.296 6.712 4.831 606 HG3 ARG 83 HG3 ARG 83 79.490 6.685 3.540 607 HD2 ARG 83 HD2 ARG 83 77.267 6.052 2.712 608 HD3 ARG 83 HD3 ARG 83 78.363 4.701 2.536 609 HE ARG 83 HE ARG 83 77.141 3.539 3.915 610 HH11 ARG 83 HH11 ARG 83 76.333 6.952 4.319 611 HH12 ARG 83 HH12 ARG 83 75.260 6.759 5.578 612 HH21 ARG 83 HH21 ARG 83 75.491 3.162 5.619 613 HH22 ARG 83 HH22 ARG 83 74.679 4.503 6.289 614 H ALA 84 H ALA 84 81.632 2.628 5.650 615 HA ALA 84 HA ALA 84 83.010 3.850 7.776 616 HB1 ALA 84 HB1 ALA 84 82.005 1.621 7.970 617 HB2 ALA 84 HB2 ALA 84 83.716 1.590 8.401 618 HB3 ALA 84 HB3 ALA 84 83.191 0.990 6.828 619 H ALA 85 H ALA 85 84.119 2.367 4.791 620 HA ALA 85 HA ALA 85 86.873 2.589 5.325 621 HB1 ALA 85 HB1 ALA 85 85.426 2.517 2.680 622 HB2 ALA 85 HB2 ALA 85 85.980 1.114 3.593 623 HB3 ALA 85 HB3 ALA 85 87.150 2.250 2.915 624 H ASN 86 H ASN 86 84.535 4.756 3.920 625 HA ASN 86 HA ASN 86 86.460 6.668 2.946 626 HB2 ASN 86 HB2 ASN 86 84.007 6.287 2.150 627 HB3 ASN 86 HB3 ASN 86 83.581 7.284 3.525 628 HD21 ASN 86 HD21 ASN 86 84.728 7.254 0.348 629 HD22 ASN 86 HD22 ASN 86 84.970 8.938 0.138 630 H GLY 87 H GLY 87 84.206 6.519 5.678 631 HA2 GLY 87 HA2 GLY 87 84.772 7.474 7.824 632 HA3 GLY 87 HA3 GLY 87 85.634 8.753 6.967 633 H LYS 88 H LYS 88 82.517 7.537 5.861 634 HA LYS 88 HA LYS 88 81.405 10.153 6.225 635 HB2 LYS 88 HB2 LYS 88 80.964 7.777 4.517 636 HB3 LYS 88 HB3 LYS 88 79.711 8.978 4.693 637 HG2 LYS 88 HG2 LYS 88 81.274 10.660 3.807 638 HG3 LYS 88 HG3 LYS 88 82.510 9.406 3.643 639 HD2 LYS 88 HD2 LYS 88 80.998 8.196 2.095 640 HD3 LYS 88 HD3 LYS 88 79.850 9.531 2.218 641 HE2 LYS 88 HE2 LYS 88 82.689 9.803 1.294 642 HE3 LYS 88 HE3 LYS 88 81.351 9.602 0.189 643 HZ1 LYS 88 HZ1 LYS 88 82.062 11.903 0.487 644 HZ2 LYS 88 HZ2 LYS 88 81.646 11.896 2.112 645 HZ3 LYS 88 HZ3 LYS 88 80.465 11.725 0.910 646 HA PRO 89 HA PRO 89 78.671 8.698 9.371 647 HB2 PRO 89 HB2 PRO 89 76.295 9.879 8.610 648 HB3 PRO 89 HB3 PRO 89 77.575 10.724 9.484 649 HG2 PRO 89 HG2 PRO 89 76.929 10.726 6.570 650 HG3 PRO 89 HG3 PRO 89 77.473 12.065 7.599 651 HD2 PRO 89 HD2 PRO 89 79.128 10.781 5.906 652 HD3 PRO 89 HD3 PRO 89 79.685 11.432 7.459 653 H GLY 90 H GLY 90 78.227 6.639 9.358 654 HA2 GLY 90 HA2 GLY 90 76.860 5.461 7.104 655 HA3 GLY 90 HA3 GLY 90 77.547 4.587 8.466 656 H PHE 91 H PHE 91 76.188 3.855 9.920 657 HA PHE 91 HA PHE 91 73.391 4.796 9.730 658 HB2 PHE 91 HB2 PHE 91 74.287 2.091 10.792 659 HB3 PHE 91 HB3 PHE 91 72.652 2.659 10.556 660 HD1 PHE 91 HD1 PHE 91 72.041 3.407 8.160 661 HD2 PHE 91 HD2 PHE 91 75.253 0.812 9.142 662 HE1 PHE 91 HE1 PHE 91 72.025 2.520 5.878 663 HE2 PHE 91 HE2 PHE 91 75.244 -0.065 6.857 664 HZ PHE 91 HZ PHE 91 73.635 0.791 5.221 665 H LYS 92 H LYS 92 72.131 4.702 11.748 666 HA LYS 92 HA LYS 92 73.700 5.609 13.974 667 HB2 LYS 92 HB2 LYS 92 71.636 6.346 14.817 668 HB3 LYS 92 HB3 LYS 92 71.592 6.708 13.132 669 HG2 LYS 92 HG2 LYS 92 70.230 4.695 12.735 670 HG3 LYS 92 HG3 LYS 92 70.286 4.362 14.466 671 HD2 LYS 92 HD2 LYS 92 69.133 6.829 13.216 672 HD3 LYS 92 HD3 LYS 92 68.176 5.441 13.718 673 HE2 LYS 92 HE2 LYS 92 68.903 5.820 16.033 674 HE3 LYS 92 HE3 LYS 92 69.852 7.208 15.506 675 HZ1 LYS 92 HZ1 LYS 92 67.717 7.912 16.366 676 HZ2 LYS 92 HZ2 LYS 92 66.912 6.933 15.243 677 HZ3 LYS 92 HZ3 LYS 92 67.806 8.251 14.714 678 H GLN 93 H GLN 93 72.966 4.677 16.057 679 HA GLN 93 HA GLN 93 72.925 1.796 15.852 680 HB2 GLN 93 HB2 GLN 93 73.538 3.832 17.805 681 HB3 GLN 93 HB3 GLN 93 73.177 2.229 18.444 682 HG2 GLN 93 HG2 GLN 93 75.568 2.322 18.303 683 HG3 GLN 93 HG3 GLN 93 75.071 1.401 16.897 684 HE21 GLN 93 HE21 GLN 93 74.926 4.922 17.211 685 HE22 GLN 93 HE22 GLN 93 76.117 5.259 16.023 686 H GLY 94 H GLY 94 71.293 0.642 16.581 687 HA2 GLY 94 HA2 GLY 94 69.404 0.828 18.345 688 HA3 GLY 94 HA3 GLY 94 68.807 2.013 17.178
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