NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
5019 | 1g9l | 4915 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLY 1 HT1 GLY 1 25.181 0.488 -5.155 2 2H GLY 1 HT2 GLY 1 25.767 -0.281 -3.767 3 3H GLY 1 HT3 GLY 1 26.722 0.862 -4.567 4 1HA GLY 1 HA1 GLY 1 24.461 2.258 -4.043 5 2HA GLY 1 HA2 GLY 1 24.641 1.244 -2.621 6 HA PRO 2 HA PRO 2 27.763 5.016 -2.989 7 1HB PRO 2 HB2 PRO 2 25.683 6.526 -1.506 8 2HB PRO 2 HB1 PRO 2 26.763 7.068 -2.795 9 1HG PRO 2 HG2 PRO 2 24.173 6.644 -3.269 10 2HG PRO 2 HG1 PRO 2 25.407 6.215 -4.471 11 1HD PRO 2 HD1 PRO 2 23.894 4.447 -2.590 12 2HD PRO 2 HD2 PRO 2 24.361 4.159 -4.279 13 H LEU 3 HN LEU 3 25.401 4.960 -0.315 14 HA LEU 3 HA LEU 3 27.590 4.815 1.597 15 1HB LEU 3 HB2 LEU 3 24.723 4.790 2.421 16 2HB LEU 3 HB1 LEU 3 26.101 5.537 3.206 17 HG LEU 3 HG LEU 3 25.037 6.588 0.598 18 1HD1 LEU 3 HD11 LEU 3 23.950 6.947 3.348 19 2HD1 LEU 3 HD12 LEU 3 23.104 6.829 1.806 20 3HD1 LEU 3 HD13 LEU 3 23.946 8.316 2.237 21 1HD2 LEU 3 HD21 LEU 3 26.547 7.899 2.853 22 2HD2 LEU 3 HD22 LEU 3 26.105 8.636 1.313 23 3HD2 LEU 3 HD23 LEU 3 27.266 7.310 1.355 24 H GLY 4 HN GLY 4 26.632 3.436 3.687 25 1HA GLY 4 HA2 GLY 4 26.531 0.696 2.624 26 2HA GLY 4 HA1 GLY 4 27.090 1.151 4.226 27 H SER 5 HN SER 5 24.110 1.640 2.323 28 HA SER 5 HA SER 5 22.571 0.925 4.720 29 1HB SER 5 HB2 SER 5 22.161 3.151 3.593 30 2HB SER 5 HB1 SER 5 21.533 2.255 2.210 31 HG SER 5 HG SER 5 19.844 1.568 3.403 32 H ALA 6 HN ALA 6 22.251 0.550 1.183 33 HA ALA 6 HA ALA 6 21.022 -2.081 1.666 34 1HB ALA 6 HB1 ALA 6 20.520 -1.431 -0.975 35 2HB ALA 6 HB2 ALA 6 20.359 0.102 -0.120 36 3HB ALA 6 HB3 ALA 6 19.393 -1.287 0.374 37 H ALA 7 HN ALA 7 21.255 -3.287 -0.723 38 HA ALA 7 HA ALA 7 23.975 -3.149 -1.697 39 1HB ALA 7 HB1 ALA 7 24.857 -4.982 -0.744 40 2HB ALA 7 HB2 ALA 7 23.337 -5.874 -0.812 41 3HB ALA 7 HB3 ALA 7 23.623 -4.716 0.486 42 H ALA 8 HN ALA 8 23.390 -2.987 -3.789 43 HA ALA 8 HA ALA 8 21.990 -5.275 -4.967 44 1HB ALA 8 HB1 ALA 8 20.207 -3.754 -4.800 45 2HB ALA 8 HB2 ALA 8 20.764 -3.630 -6.469 46 3HB ALA 8 HB3 ALA 8 21.213 -2.393 -5.295 47 H ALA 9 HN ALA 9 24.248 -2.662 -5.201 48 HA ALA 9 HA ALA 9 25.901 -2.146 -6.679 49 1HB ALA 9 HB1 ALA 9 27.215 -3.896 -7.403 50 2HB ALA 9 HB2 ALA 9 25.832 -4.939 -7.733 51 3HB ALA 9 HB3 ALA 9 26.332 -4.635 -6.068 52 H THR 10 HN THR 10 24.166 -0.880 -7.782 53 HA THR 10 HA THR 10 24.079 -1.649 -10.593 54 HB THR 10 HB THR 10 21.973 -2.492 -10.012 55 HG1 THR 10 HG1 THR 10 20.613 -0.361 -10.534 56 1HG2 THR 10 HG21 THR 10 20.966 -2.015 -8.113 57 2HG2 THR 10 HG22 THR 10 20.586 -0.405 -8.724 58 3HG2 THR 10 HG23 THR 10 22.084 -0.680 -7.834 59 HA PRO 11 HA PRO 11 25.159 2.711 -10.616 60 1HB PRO 11 HB1 PRO 11 25.664 2.890 -13.269 61 2HB PRO 11 HB2 PRO 11 26.799 2.154 -12.131 62 1HG PRO 11 HG1 PRO 11 24.825 0.836 -13.959 63 2HG PRO 11 HG2 PRO 11 26.510 0.393 -13.627 64 1HD PRO 11 HD2 PRO 11 24.409 -0.870 -12.469 65 2HD PRO 11 HD1 PRO 11 25.972 -0.668 -11.653 66 H ALA 12 HN ALA 12 22.482 1.160 -11.919 67 HA ALA 12 HA ALA 12 21.398 3.487 -13.278 68 1HB ALA 12 HB1 ALA 12 20.944 0.685 -13.388 69 2HB ALA 12 HB2 ALA 12 20.289 1.950 -14.427 70 3HB ALA 12 HB3 ALA 12 19.427 1.477 -12.963 71 H VAL 13 HN VAL 13 21.506 4.791 -11.271 72 HA VAL 13 HA VAL 13 19.531 4.152 -9.231 73 HB VAL 13 HB VAL 13 20.982 6.753 -9.219 74 1HG1 VAL 13 HG11 VAL 13 20.547 6.717 -7.009 75 2HG1 VAL 13 HG12 VAL 13 20.896 4.994 -6.862 76 3HG1 VAL 13 HG13 VAL 13 19.328 5.526 -7.467 77 1HG2 VAL 13 HG21 VAL 13 22.837 5.468 -9.804 78 2HG2 VAL 13 HG22 VAL 13 22.276 4.068 -8.890 79 3HG2 VAL 13 HG23 VAL 13 22.888 5.488 -8.042 80 H ARG 14 HN ARG 14 18.831 4.907 -12.055 81 HA ARG 14 HA ARG 14 17.388 7.416 -11.626 82 1HB ARG 14 HB2 ARG 14 18.739 7.061 -13.710 83 2HB ARG 14 HB1 ARG 14 17.614 5.787 -14.161 84 1HG ARG 14 HG1 ARG 14 15.806 7.617 -13.897 85 2HG ARG 14 HG2 ARG 14 17.166 8.736 -14.021 86 1HD ARG 14 HD2 ARG 14 17.732 7.168 -16.102 87 2HD ARG 14 HD1 ARG 14 15.983 6.943 -16.061 88 HE ARG 14 HE ARG 14 15.696 9.169 -16.651 89 1HH1 ARG 14 HH11 ARG 14 19.064 8.451 -16.114 90 2HH1 ARG 14 HH12 ARG 14 19.625 9.917 -16.846 91 1HH2 ARG 14 HH21 ARG 14 16.426 11.101 -17.616 92 2HH2 ARG 14 HH22 ARG 14 18.126 11.423 -17.699 93 H THR 15 HN THR 15 16.748 4.114 -12.806 94 HA THR 15 HA THR 15 13.895 4.513 -12.297 95 HB THR 15 HB THR 15 13.495 2.616 -13.667 96 HG1 THR 15 HG1 THR 15 16.030 1.863 -14.241 97 1HG2 THR 15 HG21 THR 15 15.509 4.502 -14.682 98 2HG2 THR 15 HG22 THR 15 13.922 4.073 -15.318 99 3HG2 THR 15 HG23 THR 15 15.300 3.009 -15.598 100 H VAL 16 HN VAL 16 12.694 2.691 -11.295 101 HA VAL 16 HA VAL 16 14.063 1.857 -8.870 102 HB VAL 16 HB VAL 16 11.778 1.009 -8.215 103 1HG1 VAL 16 HG21 VAL 16 12.560 3.816 -8.686 104 2HG1 VAL 16 HG22 VAL 16 12.115 2.996 -7.190 105 3HG1 VAL 16 HG23 VAL 16 10.861 3.532 -8.309 106 1HG2 VAL 16 HG11 VAL 16 9.997 1.117 -9.581 107 2HG2 VAL 16 HG12 VAL 16 11.206 1.172 -10.863 108 3HG2 VAL 16 HG13 VAL 16 10.487 2.666 -10.265 109 HA PRO 17 HA PRO 17 15.006 -2.302 -10.003 110 1HB PRO 17 HB1 PRO 17 13.787 -3.067 -7.397 111 2HB PRO 17 HB2 PRO 17 15.383 -3.452 -8.049 112 1HG PRO 17 HG2 PRO 17 15.104 -1.614 -6.143 113 2HG PRO 17 HG1 PRO 17 16.262 -1.382 -7.467 114 1HD PRO 17 HD2 PRO 17 13.582 -0.131 -7.048 115 2HD PRO 17 HD1 PRO 17 15.064 0.572 -7.728 116 H GLN 18 HN GLN 18 14.028 -4.100 -10.873 117 HA GLN 18 HA GLN 18 11.225 -3.909 -11.416 118 1HB GLN 18 HB1 GLN 18 13.090 -6.209 -12.024 119 2HB GLN 18 HB2 GLN 18 11.540 -5.879 -12.786 120 1HG GLN 18 HG1 GLN 18 12.376 -4.225 -14.101 121 2HG GLN 18 HG2 GLN 18 13.621 -3.775 -12.936 122 1HE2 GLN 18 HE21 GLN 18 15.492 -3.970 -13.946 123 2HE2 GLN 18 HE22 GLN 18 16.018 -5.350 -14.842 124 H TYR 19 HN TYR 19 10.302 -4.052 -9.318 125 HA TYR 19 HA TYR 19 10.696 -6.349 -7.665 126 1HB TYR 19 HB1 TYR 19 9.219 -3.846 -7.532 127 2HB TYR 19 HB2 TYR 19 8.280 -5.194 -6.898 128 HD1 TYR 19 HD1 TYR 19 8.527 -5.739 -4.669 129 HD2 TYR 19 HD2 TYR 19 11.724 -3.761 -6.660 130 HE1 TYR 19 HE1 TYR 19 9.761 -5.609 -2.546 131 HE2 TYR 19 HE2 TYR 19 12.967 -3.625 -4.543 132 HH TYR 19 HH TYR 19 12.444 -3.638 -2.096 133 H LYS 20 HN LYS 20 8.868 -5.749 -10.451 134 HA LYS 20 HA LYS 20 6.906 -7.831 -9.842 135 1HB LYS 20 HB2 LYS 20 7.123 -5.683 -11.910 136 2HB LYS 20 HB1 LYS 20 6.150 -7.103 -12.264 137 1HG LYS 20 HG2 LYS 20 4.575 -5.701 -11.380 138 2HG LYS 20 HG1 LYS 20 5.077 -6.586 -9.938 139 1HD LYS 20 HD2 LYS 20 6.293 -4.794 -9.105 140 2HD LYS 20 HD1 LYS 20 6.445 -4.033 -10.690 141 1HE LYS 20 HE2 LYS 20 4.123 -3.408 -10.670 142 2HE LYS 20 HE1 LYS 20 3.853 -4.304 -9.176 143 1HZ LYS 20 HZ1 LYS 20 4.230 -1.747 -9.122 144 2HZ LYS 20 HZ2 LYS 20 5.867 -2.166 -9.214 145 3HZ LYS 20 HZ3 LYS 20 4.920 -2.728 -7.928 146 H TYR 21 HN TYR 21 8.243 -9.656 -9.910 147 HA TYR 21 HA TYR 21 9.854 -10.235 -12.218 148 1HB TYR 21 HB2 TYR 21 9.890 -11.096 -9.625 149 2HB TYR 21 HB1 TYR 21 9.146 -12.472 -10.435 150 HD1 TYR 21 HD1 TYR 21 10.383 -13.670 -12.222 151 HD2 TYR 21 HD2 TYR 21 12.207 -10.601 -9.907 152 HE1 TYR 21 HE1 TYR 21 12.599 -14.450 -12.944 153 HE2 TYR 21 HE2 TYR 21 14.429 -11.375 -10.622 154 HH TYR 21 HH TYR 21 14.858 -13.651 -13.152 155 H ALA 22 HN ALA 22 8.518 -10.283 -14.004 156 HA ALA 22 HA ALA 22 6.123 -11.877 -14.049 157 1HB ALA 22 HB1 ALA 22 6.152 -11.288 -16.504 158 2HB ALA 22 HB2 ALA 22 7.606 -10.346 -16.171 159 3HB ALA 22 HB3 ALA 22 6.083 -9.927 -15.384 160 H ALA 23 HN ALA 23 6.402 -14.026 -13.903 161 HA ALA 23 HA ALA 23 8.615 -15.380 -15.149 162 1HB ALA 23 HB1 ALA 23 6.176 -16.471 -13.752 163 2HB ALA 23 HB2 ALA 23 7.760 -16.185 -13.030 164 3HB ALA 23 HB3 ALA 23 7.566 -17.423 -14.271 165 H GLY 24 HN GLY 24 8.644 -16.495 -17.032 166 1HA GLY 24 HA1 GLY 24 6.331 -16.169 -18.786 167 2HA GLY 24 HA2 GLY 24 7.948 -16.654 -19.276 168 H VAL 25 HN VAL 25 5.706 -17.974 -16.847 169 HA VAL 25 HA VAL 25 6.194 -20.646 -17.898 170 HB VAL 25 HB VAL 25 4.422 -19.993 -15.557 171 1HG1 VAL 25 HG21 VAL 25 5.627 -22.399 -16.734 172 2HG1 VAL 25 HG22 VAL 25 4.168 -22.218 -15.762 173 3HG1 VAL 25 HG23 VAL 25 5.747 -22.287 -14.978 174 1HG2 VAL 25 HG11 VAL 25 6.842 -20.708 -14.470 175 2HG2 VAL 25 HG12 VAL 25 6.187 -19.072 -14.542 176 3HG2 VAL 25 HG13 VAL 25 7.304 -19.631 -15.788 177 H ARG 26 HN ARG 26 3.808 -18.184 -18.032 178 HA ARG 26 HA ARG 26 1.595 -19.917 -18.650 179 1HB ARG 26 HB1 ARG 26 2.039 -16.962 -18.571 180 2HB ARG 26 HB2 ARG 26 0.656 -17.583 -19.460 181 1HG ARG 26 HG2 ARG 26 -0.215 -18.632 -17.483 182 2HG ARG 26 HG1 ARG 26 1.233 -18.200 -16.571 183 1HD ARG 26 HD2 ARG 26 0.557 -15.765 -17.354 184 2HD ARG 26 HD1 ARG 26 -1.043 -16.501 -17.449 185 HE ARG 26 HE ARG 26 -0.419 -17.229 -15.022 186 1HH1 ARG 26 HH11 ARG 26 0.269 -14.180 -16.564 187 2HH1 ARG 26 HH12 ARG 26 0.236 -13.279 -15.086 188 1HH2 ARG 26 HH21 ARG 26 -0.464 -16.050 -13.072 189 2HH2 ARG 26 HH22 ARG 26 -0.180 -14.341 -13.100 190 H ASN 27 HN ASN 27 0.338 -19.416 -20.746 191 HA ASN 27 HA ASN 27 2.142 -19.959 -22.948 192 1HB ASN 27 HB2 ASN 27 -0.808 -20.149 -22.506 193 2HB ASN 27 HB1 ASN 27 -0.210 -20.045 -24.160 194 1HD2 ASN 27 HD21 ASN 27 2.076 -21.485 -24.070 195 2HD2 ASN 27 HD22 ASN 27 1.731 -23.134 -23.685 196 HA PRO 28 HA PRO 28 2.006 -15.589 -24.040 197 1HB PRO 28 HB2 PRO 28 3.913 -15.689 -25.946 198 2HB PRO 28 HB1 PRO 28 4.299 -15.715 -24.221 199 1HG PRO 28 HG2 PRO 28 4.138 -17.988 -26.165 200 2HG PRO 28 HG1 PRO 28 5.350 -17.676 -24.909 201 1HD PRO 28 HD2 PRO 28 3.299 -19.438 -24.594 202 2HD PRO 28 HD1 PRO 28 4.027 -18.546 -23.243 203 H GLN 29 HN GLN 29 -0.129 -15.771 -24.935 204 HA GLN 29 HA GLN 29 -0.489 -16.758 -27.615 205 1HB GLN 29 HB2 GLN 29 -2.402 -15.078 -25.987 206 2HB GLN 29 HB1 GLN 29 -2.792 -16.101 -27.362 207 1HG GLN 29 HG1 GLN 29 -1.499 -17.444 -25.082 208 2HG GLN 29 HG2 GLN 29 -3.131 -16.836 -24.806 209 1HE2 GLN 29 HE21 GLN 29 -1.229 -19.273 -26.206 210 2HE2 GLN 29 HE22 GLN 29 -2.499 -20.160 -26.971 211 H GLN 30 HN GLN 30 -2.032 -15.032 -28.934 212 HA GLN 30 HA GLN 30 -0.163 -13.048 -29.806 213 1HB GLN 30 HB1 GLN 30 -3.029 -13.551 -30.627 214 2HB GLN 30 HB2 GLN 30 -1.929 -12.446 -31.440 215 1HG GLN 30 HG2 GLN 30 -1.363 -14.140 -32.747 216 2HG GLN 30 HG1 GLN 30 -0.538 -14.836 -31.354 217 1HE2 GLN 30 HE21 GLN 30 -3.999 -14.454 -31.935 218 2HE2 GLN 30 HE22 GLN 30 -4.373 -16.139 -31.894 219 H HIS 31 HN HIS 31 -3.485 -12.063 -29.711 220 HA HIS 31 HA HIS 31 -4.478 -10.189 -28.885 221 1HB HIS 31 HB2 HIS 31 -2.896 -11.057 -26.458 222 2HB HIS 31 HB1 HIS 31 -4.155 -9.827 -26.427 223 HD2 HIS 31 HD2 HIS 31 -6.495 -11.294 -28.063 224 HE1 HIS 31 HE1 HIS 31 -5.904 -14.454 -25.310 225 HE2 HIS 31 HE2 HIS 31 -7.491 -13.446 -27.011 226 H LEU 32 HN LEU 32 -1.949 -9.820 -30.276 227 HA LEU 32 HA LEU 32 -0.621 -7.651 -28.876 228 1HB LEU 32 HB2 LEU 32 -0.154 -9.072 -31.480 229 2HB LEU 32 HB1 LEU 32 0.676 -7.572 -31.117 230 HG LEU 32 HG LEU 32 1.084 -9.160 -28.858 231 1HD1 LEU 32 HD11 LEU 32 2.272 -11.085 -30.296 232 2HD1 LEU 32 HD12 LEU 32 0.858 -10.790 -31.307 233 3HD1 LEU 32 HD13 LEU 32 0.653 -11.243 -29.616 234 1HD2 LEU 32 HD21 LEU 32 2.597 -7.894 -30.963 235 2HD2 LEU 32 HD22 LEU 32 3.352 -9.402 -30.450 236 3HD2 LEU 32 HD23 LEU 32 3.014 -8.139 -29.267 237 H ASN 33 HN ASN 33 -3.299 -7.094 -29.362 238 HA ASN 33 HA ASN 33 -3.278 -5.217 -31.617 239 1HB ASN 33 HB2 ASN 33 -5.205 -7.009 -30.781 240 2HB ASN 33 HB1 ASN 33 -5.788 -5.481 -30.130 241 1HD2 ASN 33 HD21 ASN 33 -6.252 -3.777 -31.562 242 2HD2 ASN 33 HD22 ASN 33 -6.579 -4.075 -33.231 243 H ALA 34 HN ALA 34 -2.277 -5.087 -28.615 244 HA ALA 34 HA ALA 34 -3.658 -2.664 -27.766 245 1HB ALA 34 HB1 ALA 34 -1.430 -3.401 -26.098 246 2HB ALA 34 HB2 ALA 34 -2.474 -4.790 -26.403 247 3HB ALA 34 HB3 ALA 34 -3.147 -3.316 -25.706 248 H GLN 35 HN GLN 35 -2.766 -1.574 -29.751 249 HA GLN 35 HA GLN 35 0.035 -0.789 -29.492 250 1HB GLN 35 HB1 GLN 35 -1.974 -0.674 -31.699 251 2HB GLN 35 HB2 GLN 35 -0.635 0.466 -31.716 252 1HG GLN 35 HG2 GLN 35 0.035 -1.363 -33.031 253 2HG GLN 35 HG1 GLN 35 0.905 -1.512 -31.504 254 1HE2 GLN 35 HE21 GLN 35 -1.388 -2.919 -33.629 255 2HE2 GLN 35 HE22 GLN 35 -1.653 -4.376 -32.739 256 HA PRO 36 HA PRO 36 -2.279 3.509 -29.433 257 1HB PRO 36 HB2 PRO 36 -4.965 2.731 -28.484 258 2HB PRO 36 HB1 PRO 36 -4.506 3.877 -29.748 259 1HG PRO 36 HG2 PRO 36 -5.593 1.508 -30.350 260 2HG PRO 36 HG1 PRO 36 -4.324 2.228 -31.360 261 1HD PRO 36 HD2 PRO 36 -4.112 0.043 -29.321 262 2HD PRO 36 HD1 PRO 36 -3.344 0.172 -30.918 263 H GLN 37 HN GLN 37 -3.528 4.705 -27.490 264 HA GLN 37 HA GLN 37 -2.135 3.861 -25.109 265 1HB GLN 37 HB1 GLN 37 -3.113 6.308 -26.144 266 2HB GLN 37 HB2 GLN 37 -3.953 6.030 -24.625 267 1HG GLN 37 HG1 GLN 37 -1.353 5.424 -23.997 268 2HG GLN 37 HG2 GLN 37 -1.186 6.769 -25.127 269 1HE2 GLN 37 HE21 GLN 37 -3.672 6.048 -22.713 270 2HE2 GLN 37 HE22 GLN 37 -3.475 7.513 -21.818 271 H VAL 38 HN VAL 38 -2.950 2.748 -23.454 272 HA VAL 38 HA VAL 38 -5.718 1.890 -23.571 273 HB VAL 38 HB VAL 38 -4.124 0.173 -23.081 274 1HG1 VAL 38 HG11 VAL 38 -3.260 1.085 -20.456 275 2HG1 VAL 38 HG12 VAL 38 -2.707 2.129 -21.766 276 3HG1 VAL 38 HG13 VAL 38 -2.322 0.408 -21.788 277 1HG2 VAL 38 HG21 VAL 38 -5.401 -0.855 -21.555 278 2HG2 VAL 38 HG22 VAL 38 -6.365 0.622 -21.593 279 3HG2 VAL 38 HG23 VAL 38 -5.138 0.401 -20.346 280 H THR 39 HN THR 39 -7.321 2.795 -22.472 281 HA THR 39 HA THR 39 -6.653 4.644 -20.286 282 HB THR 39 HB THR 39 -7.851 5.630 -22.207 283 HG1 THR 39 HG1 THR 39 -9.047 6.819 -20.922 284 1HG2 THR 39 HG21 THR 39 -9.158 3.722 -22.944 285 2HG2 THR 39 HG22 THR 39 -10.188 5.115 -22.612 286 3HG2 THR 39 HG23 THR 39 -10.103 3.786 -21.456 287 H MET 40 HN MET 40 -7.628 1.558 -20.729 288 HA MET 40 HA MET 40 -9.648 1.496 -18.637 289 1HB MET 40 HB2 MET 40 -8.429 -0.913 -19.965 290 2HB MET 40 HB1 MET 40 -10.016 -0.757 -19.227 291 1HG MET 40 HG2 MET 40 -9.654 1.094 -21.423 292 2HG MET 40 HG1 MET 40 -9.416 -0.581 -21.915 293 1HE MET 40 HE1 MET 40 -11.605 2.083 -21.967 294 2HE MET 40 HE2 MET 40 -12.170 1.957 -20.300 295 3HE MET 40 HE3 MET 40 -13.251 1.541 -21.630 296 H GLN 41 HN GLN 41 -9.319 -0.515 -17.092 297 HA GLN 41 HA GLN 41 -8.245 -1.356 -15.276 298 1HB GLN 41 HB2 GLN 41 -6.140 -1.195 -17.335 299 2HB GLN 41 HB1 GLN 41 -5.554 -1.278 -15.680 300 1HG GLN 41 HG2 GLN 41 -7.514 -3.226 -16.867 301 2HG GLN 41 HG1 GLN 41 -5.769 -3.476 -16.828 302 1HE2 GLN 41 HE21 GLN 41 -4.830 -3.080 -14.546 303 2HE2 GLN 41 HE22 GLN 41 -5.677 -3.859 -13.258 304 H GLN 42 HN GLN 42 -8.608 1.619 -15.731 305 HA GLN 42 HA GLN 42 -7.273 2.438 -13.313 306 1HB GLN 42 HB2 GLN 42 -6.341 4.524 -14.491 307 2HB GLN 42 HB1 GLN 42 -5.457 3.016 -14.672 308 1HG GLN 42 HG1 GLN 42 -6.788 2.729 -16.844 309 2HG GLN 42 HG2 GLN 42 -7.168 4.442 -16.671 310 1HE2 GLN 42 HE21 GLN 42 -5.107 2.315 -18.067 311 2HE2 GLN 42 HE22 GLN 42 -3.744 3.346 -18.319 312 HA PRO 43 HA PRO 43 -11.492 4.184 -13.604 313 1HB PRO 43 HB1 PRO 43 -10.880 4.670 -10.742 314 2HB PRO 43 HB2 PRO 43 -12.299 3.918 -11.478 315 1HG PRO 43 HG1 PRO 43 -10.474 2.445 -10.207 316 2HG PRO 43 HG2 PRO 43 -11.262 1.855 -11.683 317 1HD PRO 43 HD2 PRO 43 -8.520 2.996 -11.323 318 2HD PRO 43 HD1 PRO 43 -9.056 1.649 -12.348 319 H ALA 44 HN ALA 44 -12.365 6.329 -12.838 320 HA ALA 44 HA ALA 44 -10.429 8.392 -13.459 321 1HB ALA 44 HB1 ALA 44 -12.526 8.602 -14.552 322 2HB ALA 44 HB2 ALA 44 -12.440 9.894 -13.357 323 3HB ALA 44 HB3 ALA 44 -13.408 8.456 -13.032 324 H VAL 45 HN VAL 45 -9.487 7.488 -11.221 325 HA VAL 45 HA VAL 45 -10.577 9.107 -9.025 326 HB VAL 45 HB VAL 45 -8.858 7.684 -7.676 327 1HG1 VAL 45 HG11 VAL 45 -10.667 5.725 -7.843 328 2HG1 VAL 45 HG12 VAL 45 -11.560 7.003 -8.668 329 3HG1 VAL 45 HG13 VAL 45 -10.984 7.253 -7.020 330 1HG2 VAL 45 HG21 VAL 45 -8.286 5.567 -8.561 331 2HG2 VAL 45 HG22 VAL 45 -7.858 6.748 -9.799 332 3HG2 VAL 45 HG23 VAL 45 -9.330 5.791 -9.965 333 H HIS 46 HN HIS 46 -9.692 11.106 -9.482 334 HA HIS 46 HA HIS 46 -6.848 11.375 -9.950 335 1HB HIS 46 HB1 HIS 46 -9.217 13.079 -10.175 336 2HB HIS 46 HB2 HIS 46 -7.825 13.922 -9.504 337 HD2 HIS 46 HD2 HIS 46 -9.267 13.048 -12.845 338 HE1 HIS 46 HE1 HIS 46 -5.146 13.770 -13.483 339 HE2 HIS 46 HE2 HIS 46 -7.401 13.460 -14.601 340 H VAL 47 HN VAL 47 -5.875 13.377 -8.626 341 HA VAL 47 HA VAL 47 -6.014 12.531 -5.829 342 HB VAL 47 HB VAL 47 -3.791 12.515 -6.647 343 1HG1 VAL 47 HG11 VAL 47 -4.631 14.575 -8.323 344 2HG1 VAL 47 HG12 VAL 47 -3.028 13.842 -8.255 345 3HG1 VAL 47 HG13 VAL 47 -3.378 15.290 -7.310 346 1HG2 VAL 47 HG21 VAL 47 -3.813 15.141 -5.220 347 2HG2 VAL 47 HG22 VAL 47 -2.706 13.779 -5.046 348 3HG2 VAL 47 HG23 VAL 47 -4.340 13.676 -4.390 349 H GLN 48 HN GLN 48 -7.701 13.569 -4.895 350 HA GLN 48 HA GLN 48 -7.966 16.462 -5.261 351 1HB GLN 48 HB2 GLN 48 -9.948 14.887 -5.492 352 2HB GLN 48 HB1 GLN 48 -9.841 14.637 -3.755 353 1HG GLN 48 HG2 GLN 48 -9.837 17.423 -4.186 354 2HG GLN 48 HG1 GLN 48 -11.111 16.740 -5.197 355 1HE2 GLN 48 HE21 GLN 48 -12.763 17.603 -3.980 356 2HE2 GLN 48 HE22 GLN 48 -13.155 17.031 -2.398 357 H GLY 49 HN GLY 49 -7.222 14.033 -2.860 358 1HA GLY 49 HA2 GLY 49 -7.282 15.899 -0.653 359 2HA GLY 49 HA1 GLY 49 -6.759 14.223 -0.591 360 H GLN 50 HN GLN 50 -5.074 15.182 0.810 361 HA GLN 50 HA GLN 50 -2.959 16.571 -0.667 362 1HB GLN 50 HB2 GLN 50 -3.543 16.183 2.256 363 2HB GLN 50 HB1 GLN 50 -1.945 16.678 1.719 364 1HG GLN 50 HG1 GLN 50 -3.442 18.460 0.386 365 2HG GLN 50 HG2 GLN 50 -4.476 18.182 1.787 366 1HE2 GLN 50 HE22 GLN 50 -1.473 19.464 0.649 367 2HE2 GLN 50 HE21 GLN 50 -1.016 20.259 2.113 368 H GLU 51 HN GLU 51 -0.676 15.870 0.391 369 HA GLU 51 HA GLU 51 -0.123 13.326 -0.680 370 1HB GLU 51 HB1 GLU 51 2.101 13.678 0.636 371 2HB GLU 51 HB2 GLU 51 1.713 14.738 -0.712 372 1HG GLU 51 HG2 GLU 51 2.339 16.301 0.796 373 2HG GLU 51 HG1 GLU 51 0.631 16.187 1.221 374 HA PRO 52 HA PRO 52 -1.271 10.854 2.851 375 1HB PRO 52 HB1 PRO 52 -0.527 8.454 1.896 376 2HB PRO 52 HB2 PRO 52 -1.941 9.309 1.269 377 1HG PRO 52 HG1 PRO 52 0.825 9.126 0.130 378 2HG PRO 52 HG2 PRO 52 -0.737 8.992 -0.701 379 1HD PRO 52 HD1 PRO 52 0.762 11.273 -0.681 380 2HD PRO 52 HD2 PRO 52 -1.007 11.270 -0.819 381 H LEU 53 HN LEU 53 -0.172 8.988 4.117 382 HA LEU 53 HA LEU 53 2.503 9.906 4.834 383 1HB LEU 53 HB2 LEU 53 0.290 8.998 6.279 384 2HB LEU 53 HB1 LEU 53 1.456 7.696 6.383 385 HG LEU 53 HG LEU 53 1.416 9.486 8.237 386 1HD1 LEU 53 HD11 LEU 53 3.127 8.055 8.546 387 2HD1 LEU 53 HD12 LEU 53 4.077 9.467 8.079 388 3HD1 LEU 53 HD13 LEU 53 3.712 8.217 6.889 389 1HD2 LEU 53 HD21 LEU 53 1.817 11.202 6.121 390 2HD2 LEU 53 HD22 LEU 53 3.418 11.047 6.845 391 3HD2 LEU 53 HD23 LEU 53 2.052 11.570 7.831 392 H THR 54 HN THR 54 4.318 8.685 4.694 393 HA THR 54 HA THR 54 4.427 5.908 4.343 394 HB THR 54 HB THR 54 5.508 6.747 1.825 395 HG1 THR 54 HG1 THR 54 3.441 7.246 0.847 396 1HG2 THR 54 HG21 THR 54 3.739 5.149 0.953 397 2HG2 THR 54 HG22 THR 54 3.333 4.862 2.645 398 3HG2 THR 54 HG23 THR 54 4.953 4.492 2.053 399 H ALA 55 HN ALA 55 6.771 5.663 2.840 400 HA ALA 55 HA ALA 55 8.722 6.272 4.725 401 1HB ALA 55 HB1 ALA 55 10.340 5.547 3.101 402 2HB ALA 55 HB2 ALA 55 9.177 5.766 1.792 403 3HB ALA 55 HB3 ALA 55 8.912 4.514 3.007 404 H SER 56 HN SER 56 7.864 7.987 1.737 405 HA SER 56 HA SER 56 9.915 9.878 1.748 406 1HB SER 56 HB1 SER 56 7.057 10.285 0.826 407 2HB SER 56 HB2 SER 56 8.452 11.250 0.346 408 HG SER 56 HG SER 56 8.107 9.742 -1.244 409 H MET 57 HN MET 57 6.725 9.966 3.288 410 HA MET 57 HA MET 57 6.917 12.546 4.389 411 1HB MET 57 HB1 MET 57 5.346 10.087 5.118 412 2HB MET 57 HB2 MET 57 5.264 11.533 6.112 413 1HG MET 57 HG1 MET 57 3.660 10.959 3.975 414 2HG MET 57 HG2 MET 57 3.887 12.551 4.695 415 1HE MET 57 HE1 MET 57 4.450 11.293 0.577 416 2HE MET 57 HE2 MET 57 3.947 10.339 1.974 417 3HE MET 57 HE3 MET 57 5.639 10.350 1.476 418 H LEU 58 HN LEU 58 7.896 9.381 5.580 419 HA LEU 58 HA LEU 58 8.623 10.114 8.189 420 1HB LEU 58 HB1 LEU 58 9.545 7.934 6.332 421 2HB LEU 58 HB2 LEU 58 10.210 8.101 7.943 422 HG LEU 58 HG LEU 58 8.478 7.025 8.854 423 1HD1 LEU 58 HD11 LEU 58 7.104 9.043 8.771 424 2HD1 LEU 58 HD12 LEU 58 6.137 7.594 8.493 425 3HD1 LEU 58 HD13 LEU 58 6.588 8.627 7.136 426 1HD2 LEU 58 HD21 LEU 58 7.181 6.507 6.238 427 2HD2 LEU 58 HD22 LEU 58 7.579 5.395 7.547 428 3HD2 LEU 58 HD23 LEU 58 8.846 5.968 6.461 429 H ALA 59 HN ALA 59 10.488 9.977 5.185 430 HA ALA 59 HA ALA 59 12.950 10.806 6.334 431 1HB ALA 59 HB1 ALA 59 11.906 10.505 3.559 432 2HB ALA 59 HB2 ALA 59 13.273 9.713 4.343 433 3HB ALA 59 HB3 ALA 59 13.409 11.392 3.821 434 H SER 60 HN SER 60 10.110 12.477 5.772 435 HA SER 60 HA SER 60 11.297 15.023 5.094 436 1HB SER 60 HB1 SER 60 8.998 14.312 4.344 437 2HB SER 60 HB2 SER 60 8.468 14.482 6.017 438 HG SER 60 HG SER 60 8.511 16.356 4.245 439 H ALA 61 HN ALA 61 10.985 13.238 7.897 440 HA ALA 61 HA ALA 61 11.403 15.643 9.538 441 1HB ALA 61 HB1 ALA 61 9.332 15.256 10.350 442 2HB ALA 61 HB2 ALA 61 10.177 14.059 11.331 443 3HB ALA 61 HB3 ALA 61 9.338 13.561 9.862 444 HA PRO 62 HA PRO 62 14.657 12.165 9.920 445 1HB PRO 62 HB2 PRO 62 16.404 14.555 9.640 446 2HB PRO 62 HB1 PRO 62 16.587 12.934 8.959 447 1HG PRO 62 HG1 PRO 62 15.790 14.973 7.437 448 2HG PRO 62 HG2 PRO 62 15.102 13.352 7.226 449 1HD PRO 62 HD1 PRO 62 13.920 15.762 8.538 450 2HD PRO 62 HD2 PRO 62 13.132 14.511 7.556 451 HA PRO 63 HA PRO 63 16.010 14.437 13.821 452 1HB PRO 63 HB1 PRO 63 16.030 17.083 14.050 453 2HB PRO 63 HB2 PRO 63 17.198 16.268 13.003 454 1HG PRO 63 HG2 PRO 63 14.747 17.798 12.284 455 2HG PRO 63 HG1 PRO 63 16.284 17.666 11.414 456 1HD PRO 63 HD2 PRO 63 13.910 16.206 10.908 457 2HD PRO 63 HD1 PRO 63 15.508 15.925 10.192 458 H GLN 64 HN GLN 64 13.019 14.479 12.734 459 HA GLN 64 HA GLN 64 11.891 15.560 15.231 460 1HB GLN 64 HB2 GLN 64 11.020 15.910 12.401 461 2HB GLN 64 HB1 GLN 64 9.778 15.809 13.641 462 1HG GLN 64 HG1 GLN 64 10.224 17.849 14.430 463 2HG GLN 64 HG2 GLN 64 11.965 17.628 14.285 464 1HE2 GLN 64 HE22 GLN 64 9.252 19.146 13.028 465 2HE2 GLN 64 HE21 GLN 64 9.950 19.758 11.572 466 H GLU 65 HN GLU 65 9.861 14.087 12.856 467 HA GLU 65 HA GLU 65 9.444 11.827 14.681 468 1HB GLU 65 HB1 GLU 65 7.461 12.321 12.558 469 2HB GLU 65 HB2 GLU 65 7.222 11.952 14.259 470 1HG GLU 65 HG2 GLU 65 8.342 14.568 14.013 471 2HG GLU 65 HG1 GLU 65 6.940 14.426 12.953 472 H GLN 66 HN GLN 66 11.608 11.506 13.073 473 HA GLN 66 HA GLN 66 11.043 10.244 10.591 474 1HB GLN 66 HB1 GLN 66 13.312 11.116 11.828 475 2HB GLN 66 HB2 GLN 66 13.467 9.373 12.010 476 1HG GLN 66 HG1 GLN 66 12.838 9.406 9.449 477 2HG GLN 66 HG2 GLN 66 13.488 11.038 9.562 478 1HE2 GLN 66 HE22 GLN 66 14.396 7.941 11.028 479 2HE2 GLN 66 HE21 GLN 66 16.040 7.973 10.498 480 H LYS 67 HN LYS 67 10.989 9.214 13.862 481 HA LYS 67 HA LYS 67 10.419 6.456 12.997 482 1HB LYS 67 HB1 LYS 67 11.482 6.907 15.739 483 2HB LYS 67 HB2 LYS 67 11.705 5.538 14.659 484 1HG LYS 67 HG1 LYS 67 12.962 7.881 13.570 485 2HG LYS 67 HG2 LYS 67 13.524 7.579 15.216 486 1HD LYS 67 HD2 LYS 67 13.882 5.172 14.499 487 2HD LYS 67 HD1 LYS 67 13.638 5.732 12.843 488 1HE LYS 67 HE2 LYS 67 15.483 7.353 13.167 489 2HE LYS 67 HE1 LYS 67 15.762 6.666 14.768 490 1HZ LYS 67 HZ1 LYS 67 17.188 5.351 13.681 491 2HZ LYS 67 HZ2 LYS 67 16.485 5.634 12.169 492 3HZ LYS 67 HZ3 LYS 67 15.815 4.481 13.211 493 H GLN 68 HN GLN 68 8.544 8.607 13.341 494 HA GLN 68 HA GLN 68 6.985 7.514 15.590 495 1HB GLN 68 HB2 GLN 68 7.930 9.730 16.150 496 2HB GLN 68 HB1 GLN 68 7.105 10.416 14.758 497 1HG GLN 68 HG1 GLN 68 5.109 10.460 15.789 498 2HG GLN 68 HG2 GLN 68 5.394 8.940 16.637 499 1HE2 GLN 68 HE22 GLN 68 6.264 12.360 16.612 500 2HE2 GLN 68 HE21 GLN 68 6.530 12.489 18.315 501 H MET 69 HN MET 69 6.519 9.729 12.815 502 HA MET 69 HA MET 69 3.791 9.278 12.528 503 1HB MET 69 HB1 MET 69 5.600 9.905 10.204 504 2HB MET 69 HB2 MET 69 3.931 10.401 10.450 505 1HG MET 69 HG1 MET 69 4.658 11.824 12.318 506 2HG MET 69 HG2 MET 69 6.328 11.367 11.992 507 1HE MET 69 HE1 MET 69 7.810 12.420 10.171 508 2HE MET 69 HE2 MET 69 7.148 13.031 8.655 509 3HE MET 69 HE3 MET 69 6.872 11.353 9.125 510 H LEU 70 HN LEU 70 6.243 7.091 11.939 511 HA LEU 70 HA LEU 70 5.227 5.774 9.632 512 1HB LEU 70 HB1 LEU 70 6.626 3.840 11.004 513 2HB LEU 70 HB2 LEU 70 7.295 4.944 9.821 514 HG LEU 70 HG LEU 70 7.189 5.642 12.741 515 1HD1 LEU 70 HD11 LEU 70 8.496 3.800 12.987 516 2HD1 LEU 70 HD12 LEU 70 9.731 4.953 12.479 517 3HD1 LEU 70 HD13 LEU 70 9.043 3.824 11.311 518 1HD2 LEU 70 HD21 LEU 70 9.335 6.872 11.784 519 2HD2 LEU 70 HD22 LEU 70 7.717 7.567 11.673 520 3HD2 LEU 70 HD23 LEU 70 8.422 6.739 10.283 521 H GLY 71 HN GLY 71 4.534 5.616 13.025 522 1HA GLY 71 HA2 GLY 71 2.367 3.760 12.438 523 2HA GLY 71 HA1 GLY 71 3.526 3.262 13.654 524 H GLU 72 HN GLU 72 3.142 6.616 13.626 525 HA GLU 72 HA GLU 72 1.093 6.445 15.739 526 1HB GLU 72 HB1 GLU 72 3.485 8.294 15.743 527 2HB GLU 72 HB2 GLU 72 2.276 8.145 17.011 528 1HG GLU 72 HG2 GLU 72 3.440 5.585 16.446 529 2HG GLU 72 HG1 GLU 72 4.697 6.773 16.786 530 H ARG 73 HN ARG 73 1.933 7.819 12.796 531 HA ARG 73 HA ARG 73 -0.107 9.911 13.162 532 1HB ARG 73 HB1 ARG 73 2.480 10.525 12.821 533 2HB ARG 73 HB2 ARG 73 2.018 10.336 11.135 534 1HG ARG 73 HG1 ARG 73 0.315 12.024 12.897 535 2HG ARG 73 HG2 ARG 73 1.867 12.662 12.347 536 1HD ARG 73 HD2 ARG 73 1.107 11.969 10.003 537 2HD ARG 73 HD1 ARG 73 -0.502 11.818 10.708 538 HE ARG 73 HE ARG 73 1.052 14.322 10.617 539 1HH1 ARG 73 HH22 ARG 73 -1.973 12.593 10.667 540 2HH1 ARG 73 HH21 ARG 73 -2.939 14.019 10.489 541 1HH2 ARG 73 HH12 ARG 73 -0.213 16.205 10.380 542 2HH2 ARG 73 HH11 ARG 73 -1.939 16.071 10.325 543 H LEU 74 HN LEU 74 0.963 7.201 11.479 544 HA LEU 74 HA LEU 74 -0.277 7.741 8.962 545 1HB LEU 74 HB1 LEU 74 1.271 5.620 10.186 546 2HB LEU 74 HB2 LEU 74 -0.054 4.984 9.232 547 HG LEU 74 HG LEU 74 1.575 7.087 7.972 548 1HD1 LEU 74 HD11 LEU 74 2.707 4.355 7.892 549 2HD1 LEU 74 HD12 LEU 74 3.023 5.336 9.324 550 3HD1 LEU 74 HD13 LEU 74 3.503 5.920 7.729 551 1HD2 LEU 74 HD21 LEU 74 -0.244 6.083 6.764 552 2HD2 LEU 74 HD22 LEU 74 0.390 4.466 7.081 553 3HD2 LEU 74 HD23 LEU 74 1.280 5.573 6.036 554 H PHE 75 HN PHE 75 -1.436 6.698 11.991 555 HA PHE 75 HA PHE 75 -3.383 4.872 11.431 556 1HB PHE 75 HB1 PHE 75 -2.974 5.520 13.703 557 2HB PHE 75 HB2 PHE 75 -3.501 7.170 13.386 558 HD1 PHE 75 HD1 PHE 75 -5.290 7.430 14.851 559 HD2 PHE 75 HD2 PHE 75 -5.132 4.015 12.306 560 HE1 PHE 75 HE1 PHE 75 -7.586 6.839 15.512 561 HE2 PHE 75 HE2 PHE 75 -7.432 3.422 12.968 562 HZ PHE 75 HZ PHE 75 -8.658 4.833 14.569 563 HA PRO 76 HA PRO 76 -6.610 8.313 10.289 564 1HB PRO 76 HB2 PRO 76 -4.925 10.602 9.515 565 2HB PRO 76 HB1 PRO 76 -6.375 10.564 10.522 566 1HG PRO 76 HG1 PRO 76 -3.944 10.993 11.572 567 2HG PRO 76 HG2 PRO 76 -5.189 10.077 12.442 568 1HD PRO 76 HD2 PRO 76 -2.814 9.073 10.917 569 2HD PRO 76 HD1 PRO 76 -3.474 8.515 12.468 570 H LEU 77 HN LEU 77 -3.673 7.552 8.776 571 HA LEU 77 HA LEU 77 -4.624 8.267 6.115 572 1HB LEU 77 HB1 LEU 77 -1.984 7.313 7.184 573 2HB LEU 77 HB2 LEU 77 -2.314 7.334 5.468 574 HG LEU 77 HG LEU 77 -1.239 9.338 5.706 575 1HD1 LEU 77 HD21 LEU 77 -3.994 10.281 6.449 576 2HD1 LEU 77 HD22 LEU 77 -3.585 9.681 4.841 577 3HD1 LEU 77 HD23 LEU 77 -2.776 11.113 5.481 578 1HD2 LEU 77 HD11 LEU 77 -2.615 9.904 8.311 579 2HD2 LEU 77 HD12 LEU 77 -1.191 10.693 7.632 580 3HD2 LEU 77 HD13 LEU 77 -1.091 9.024 8.192 581 H ILE 78 HN ILE 78 -3.795 5.378 8.011 582 HA ILE 78 HA ILE 78 -3.980 3.511 5.926 583 HB ILE 78 HB ILE 78 -4.946 2.777 8.649 584 1HG1 ILE 78 HG12 ILE 78 -2.940 4.250 8.936 585 2HG1 ILE 78 HG11 ILE 78 -2.707 2.601 9.503 586 1HG2 ILE 78 HG21 ILE 78 -3.029 1.010 7.526 587 2HG2 ILE 78 HG22 ILE 78 -4.195 1.439 6.269 588 3HG2 ILE 78 HG23 ILE 78 -4.752 0.746 7.794 589 1HD1 ILE 78 HD11 ILE 78 -1.266 2.076 7.791 590 2HD1 ILE 78 HD12 ILE 78 -0.851 3.754 8.145 591 3HD1 ILE 78 HD13 ILE 78 -1.863 3.371 6.751 592 H GLN 79 HN GLN 79 -6.433 4.843 8.083 593 HA GLN 79 HA GLN 79 -8.604 3.255 7.532 594 1HB GLN 79 HB1 GLN 79 -8.207 6.063 8.351 595 2HB GLN 79 HB2 GLN 79 -9.773 5.715 7.633 596 1HG GLN 79 HG1 GLN 79 -10.355 4.227 9.317 597 2HG GLN 79 HG2 GLN 79 -8.683 4.001 9.827 598 1HE2 GLN 79 HE21 GLN 79 -7.686 6.344 10.325 599 2HE2 GLN 79 HE22 GLN 79 -8.604 7.228 11.492 600 H ALA 80 HN ALA 80 -6.925 5.349 5.438 601 HA ALA 80 HA ALA 80 -9.043 5.664 3.493 602 1HB ALA 80 HB1 ALA 80 -7.446 6.890 2.201 603 2HB ALA 80 HB2 ALA 80 -6.108 6.273 3.172 604 3HB ALA 80 HB3 ALA 80 -7.275 7.389 3.884 605 H MET 81 HN MET 81 -6.040 3.824 3.837 606 HA MET 81 HA MET 81 -6.149 2.560 1.288 607 1HB MET 81 HB1 MET 81 -4.825 1.331 3.689 608 2HB MET 81 HB2 MET 81 -4.296 1.301 2.013 609 1HG MET 81 HG1 MET 81 -4.319 3.996 2.745 610 2HG MET 81 HG2 MET 81 -3.630 3.135 4.117 611 1HE MET 81 HE1 MET 81 -0.229 2.145 3.138 612 2HE MET 81 HE2 MET 81 -1.604 1.120 3.558 613 3HE MET 81 HE3 MET 81 -1.371 2.667 4.377 614 H HIS 82 HN HIS 82 -7.210 1.701 4.514 615 HA HIS 82 HA HIS 82 -8.672 -0.609 3.423 616 1HB HIS 82 HB2 HIS 82 -7.666 -0.388 6.259 617 2HB HIS 82 HB1 HIS 82 -8.140 -1.838 5.390 618 HD2 HIS 82 HD2 HIS 82 -6.214 -1.423 2.771 619 HE1 HIS 82 HE1 HIS 82 -3.168 -1.484 5.684 620 HE2 HIS 82 HE2 HIS 82 -3.682 -1.723 3.212 621 HA PRO 83 HA PRO 83 -12.428 1.278 4.844 622 1HB PRO 83 HB2 PRO 83 -13.210 -1.448 5.729 623 2HB PRO 83 HB1 PRO 83 -14.047 -0.333 4.644 624 1HG PRO 83 HG1 PRO 83 -12.781 -2.476 3.689 625 2HG PRO 83 HG2 PRO 83 -12.753 -0.933 2.816 626 1HD PRO 83 HD1 PRO 83 -10.630 -2.204 4.495 627 2HD PRO 83 HD2 PRO 83 -10.473 -1.281 2.986 628 H THR 84 HN THR 84 -11.178 2.287 6.589 629 HA THR 84 HA THR 84 -10.544 2.680 8.740 630 HB THR 84 HB THR 84 -12.996 3.215 8.665 631 HG1 THR 84 HG1 THR 84 -11.457 2.749 10.853 632 1HG2 THR 84 HG21 THR 84 -14.508 1.794 9.998 633 2HG2 THR 84 HG22 THR 84 -13.278 0.530 9.979 634 3HG2 THR 84 HG23 THR 84 -14.016 1.066 8.469 635 H LEU 85 HN LEU 85 -9.868 0.025 7.767 636 HA LEU 85 HA LEU 85 -10.265 -1.810 9.948 637 1HB LEU 85 HB1 LEU 85 -9.348 -1.931 7.239 638 2HB LEU 85 HB2 LEU 85 -8.149 -2.679 8.276 639 HG LEU 85 HG LEU 85 -9.952 -4.132 9.216 640 1HD1 LEU 85 HD11 LEU 85 -11.635 -2.321 7.920 641 2HD1 LEU 85 HD12 LEU 85 -12.096 -3.807 8.750 642 3HD1 LEU 85 HD13 LEU 85 -11.778 -3.827 7.015 643 1HD2 LEU 85 HD21 LEU 85 -9.373 -5.661 7.708 644 2HD2 LEU 85 HD22 LEU 85 -8.530 -4.367 6.857 645 3HD2 LEU 85 HD23 LEU 85 -10.182 -4.792 6.404 646 H ALA 86 HN ALA 86 -8.405 0.842 9.690 647 HA ALA 86 HA ALA 86 -5.861 -0.028 10.600 648 1HB ALA 86 HB1 ALA 86 -5.328 2.224 10.832 649 2HB ALA 86 HB2 ALA 86 -6.989 2.684 11.205 650 3HB ALA 86 HB3 ALA 86 -6.547 2.230 9.558 651 H GLY 87 HN GLY 87 -6.029 2.124 12.839 652 1HA GLY 87 HA2 GLY 87 -6.557 2.213 15.100 653 2HA GLY 87 HA1 GLY 87 -7.606 0.819 14.879 654 H LYS 88 HN LYS 88 -4.967 -0.207 13.450 655 HA LYS 88 HA LYS 88 -3.231 -0.731 15.665 656 1HB LYS 88 HB1 LYS 88 -4.887 -2.355 16.257 657 2HB LYS 88 HB2 LYS 88 -5.001 -2.931 14.601 658 1HG LYS 88 HG2 LYS 88 -3.767 -4.544 15.816 659 2HG LYS 88 HG1 LYS 88 -2.613 -3.677 14.798 660 1HD LYS 88 HD1 LYS 88 -2.721 -2.241 17.198 661 2HD LYS 88 HD2 LYS 88 -2.684 -3.942 17.667 662 1HE LYS 88 HE1 LYS 88 -0.767 -4.111 15.919 663 2HE LYS 88 HE2 LYS 88 -0.671 -2.363 16.113 664 1HZ LYS 88 HZ1 LYS 88 -0.791 -3.585 18.649 665 2HZ LYS 88 HZ2 LYS 88 0.445 -2.638 17.988 666 3HZ LYS 88 HZ3 LYS 88 0.440 -4.311 17.746 667 H ILE 89 HN ILE 89 -4.115 -1.135 12.311 668 HA ILE 89 HA ILE 89 -2.141 -2.715 11.325 669 HB ILE 89 HB ILE 89 -3.143 -0.199 10.009 670 1HG1 ILE 89 HG11 ILE 89 -4.145 -3.032 9.657 671 2HG1 ILE 89 HG12 ILE 89 -4.870 -1.905 10.798 672 1HG2 ILE 89 HG21 ILE 89 -1.728 -0.700 8.369 673 2HG2 ILE 89 HG22 ILE 89 -2.577 -2.231 8.144 674 3HG2 ILE 89 HG23 ILE 89 -1.193 -2.146 9.233 675 1HD1 ILE 89 HD11 ILE 89 -6.156 -1.953 8.770 676 2HD1 ILE 89 HD12 ILE 89 -4.723 -1.587 7.812 677 3HD1 ILE 89 HD13 ILE 89 -5.369 -0.384 8.928 678 H THR 90 HN THR 90 -1.785 0.780 10.833 679 HA THR 90 HA THR 90 0.995 0.713 10.528 680 HB THR 90 HB THR 90 -1.064 2.631 10.474 681 HG1 THR 90 HG1 THR 90 0.601 2.310 8.932 682 1HG2 THR 90 HG21 THR 90 0.462 4.568 11.366 683 2HG2 THR 90 HG22 THR 90 0.988 3.317 12.492 684 3HG2 THR 90 HG23 THR 90 -0.716 3.763 12.406 685 H GLY 91 HN GLY 91 -0.977 1.173 13.430 686 1HA GLY 91 HA2 GLY 91 1.069 1.917 15.212 687 2HA GLY 91 HA1 GLY 91 -0.403 1.055 15.656 688 H MET 92 HN MET 92 0.202 -1.092 13.752 689 HA MET 92 HA MET 92 1.827 -2.746 15.477 690 1HB MET 92 HB1 MET 92 -0.236 -3.330 13.836 691 2HB MET 92 HB2 MET 92 1.103 -3.674 12.752 692 1HG MET 92 HG1 MET 92 1.785 -5.473 13.914 693 2HG MET 92 HG2 MET 92 1.298 -4.802 15.467 694 1HE MET 92 HE1 MET 92 -1.017 -7.043 12.356 695 2HE MET 92 HE2 MET 92 0.051 -5.659 12.111 696 3HE MET 92 HE3 MET 92 -1.668 -5.404 12.420 697 H LEU 93 HN LEU 93 2.081 -1.101 12.428 698 HA LEU 93 HA LEU 93 4.362 -2.274 11.389 699 1HB LEU 93 HB2 LEU 93 2.977 0.310 11.074 700 2HB LEU 93 HB1 LEU 93 4.588 0.183 10.408 701 HG LEU 93 HG LEU 93 2.827 -0.293 8.739 702 1HD1 LEU 93 HD11 LEU 93 4.749 -1.312 8.060 703 2HD1 LEU 93 HD12 LEU 93 3.732 -2.736 8.266 704 3HD1 LEU 93 HD13 LEU 93 4.882 -2.285 9.525 705 1HD2 LEU 93 HD21 LEU 93 2.022 -2.878 9.373 706 2HD2 LEU 93 HD22 LEU 93 1.029 -1.421 9.404 707 3HD2 LEU 93 HD23 LEU 93 1.833 -1.971 10.875 708 H LEU 94 HN LEU 94 4.113 -0.567 14.231 709 HA LEU 94 HA LEU 94 6.952 0.205 14.153 710 1HB LEU 94 HB1 LEU 94 4.576 1.386 15.408 711 2HB LEU 94 HB2 LEU 94 5.957 1.261 16.476 712 HG LEU 94 HG LEU 94 7.303 2.618 15.006 713 1HD1 LEU 94 HD11 LEU 94 4.947 2.516 13.128 714 2HD1 LEU 94 HD12 LEU 94 6.553 1.839 12.860 715 3HD1 LEU 94 HD13 LEU 94 6.336 3.588 12.939 716 1HD2 LEU 94 HD21 LEU 94 5.269 3.559 16.485 717 2HD2 LEU 94 HD22 LEU 94 4.821 4.202 14.906 718 3HD2 LEU 94 HD23 LEU 94 6.394 4.591 15.603 719 H GLU 95 HN GLU 95 5.784 -2.448 14.454 720 HA GLU 95 HA GLU 95 7.334 -3.403 16.621 721 1HB GLU 95 HB2 GLU 95 5.703 -4.070 18.187 722 2HB GLU 95 HB1 GLU 95 5.293 -2.409 17.784 723 1HG GLU 95 HG1 GLU 95 3.474 -3.081 16.434 724 2HG GLU 95 HG2 GLU 95 3.989 -4.766 16.461 725 H ILE 96 HN ILE 96 5.842 -3.793 13.742 726 HA ILE 96 HA ILE 96 4.946 -6.452 13.742 727 HB ILE 96 HB ILE 96 5.265 -6.481 11.342 728 1HG1 ILE 96 HG12 ILE 96 7.454 -5.434 11.197 729 2HG1 ILE 96 HG11 ILE 96 6.307 -4.612 10.148 730 1HG2 ILE 96 HG21 ILE 96 3.314 -5.420 11.516 731 2HG2 ILE 96 HG22 ILE 96 4.231 -4.019 10.958 732 3HG2 ILE 96 HG23 ILE 96 3.932 -4.252 12.682 733 1HD1 ILE 96 HD11 ILE 96 7.162 -2.766 11.045 734 2HD1 ILE 96 HD12 ILE 96 7.793 -3.624 12.452 735 3HD1 ILE 96 HD13 ILE 96 6.097 -3.140 12.402 736 H ASP 97 HN ASP 97 6.503 -7.457 11.512 737 HA ASP 97 HA ASP 97 8.351 -9.090 12.815 738 1HB ASP 97 HB1 ASP 97 7.143 -9.219 10.459 739 2HB ASP 97 HB2 ASP 97 8.644 -8.483 9.901 740 H ASN 98 HN ASN 98 8.610 -5.873 12.276 741 HA ASN 98 HA ASN 98 10.286 -4.404 12.637 742 1HB ASN 98 HB1 ASN 98 11.664 -6.942 13.229 743 2HB ASN 98 HB2 ASN 98 12.715 -5.619 12.733 744 1HD2 ASN 98 HD21 ASN 98 11.915 -7.091 15.345 745 2HD2 ASN 98 HD22 ASN 98 11.741 -5.794 16.472 746 H SER 99 HN SER 99 10.630 -6.871 10.220 747 HA SER 99 HA SER 99 12.516 -5.438 8.605 748 1HB SER 99 HB1 SER 99 10.625 -7.514 7.526 749 2HB SER 99 HB2 SER 99 12.281 -7.157 7.032 750 HG SER 99 HG SER 99 11.784 -8.065 9.640 751 H GLU 100 HN GLU 100 9.059 -5.593 8.939 752 HA GLU 100 HA GLU 100 8.474 -4.083 6.561 753 1HB GLU 100 HB1 GLU 100 6.562 -4.306 8.835 754 2HB GLU 100 HB2 GLU 100 6.249 -4.332 7.106 755 1HG GLU 100 HG1 GLU 100 7.838 -6.567 7.614 756 2HG GLU 100 HG2 GLU 100 6.650 -6.517 8.918 757 H LEU 101 HN LEU 101 9.367 -3.445 9.805 758 HA LEU 101 HA LEU 101 8.421 -0.732 9.892 759 1HB LEU 101 HB1 LEU 101 8.689 -1.789 11.995 760 2HB LEU 101 HB2 LEU 101 10.297 -2.360 11.594 761 HG LEU 101 HG LEU 101 10.421 0.453 11.467 762 1HD1 LEU 101 HD11 LEU 101 9.285 -0.338 14.122 763 2HD1 LEU 101 HD12 LEU 101 8.241 0.219 12.815 764 3HD1 LEU 101 HD13 LEU 101 9.510 1.273 13.440 765 1HD2 LEU 101 HD21 LEU 101 11.368 -1.498 13.562 766 2HD2 LEU 101 HD22 LEU 101 11.926 0.167 13.391 767 3HD2 LEU 101 HD23 LEU 101 12.241 -1.004 12.111 768 H LEU 102 HN LEU 102 11.170 -2.409 8.675 769 HA LEU 102 HA LEU 102 12.805 -0.006 8.486 770 1HB LEU 102 HB2 LEU 102 13.234 -2.901 8.278 771 2HB LEU 102 HB1 LEU 102 14.118 -1.968 7.084 772 HG LEU 102 HG LEU 102 14.991 -0.571 9.034 773 1HD1 LEU 102 HD21 LEU 102 15.022 -2.255 11.118 774 2HD1 LEU 102 HD22 LEU 102 13.428 -2.629 10.459 775 3HD1 LEU 102 HD23 LEU 102 13.824 -0.975 10.925 776 1HD2 LEU 102 HD11 LEU 102 15.771 -3.481 8.963 777 2HD2 LEU 102 HD12 LEU 102 16.767 -2.128 9.499 778 3HD2 LEU 102 HD13 LEU 102 16.305 -2.265 7.803 779 H HIS 103 HN HIS 103 11.234 -2.344 6.327 780 HA HIS 103 HA HIS 103 12.093 -1.141 3.924 781 1HB HIS 103 HB1 HIS 103 10.764 -3.447 4.620 782 2HB HIS 103 HB2 HIS 103 9.501 -2.517 3.825 783 HD2 HIS 103 HD2 HIS 103 12.902 -1.870 2.247 784 HE1 HIS 103 HE1 HIS 103 10.983 -4.852 -0.063 785 HE2 HIS 103 HE2 HIS 103 12.938 -3.242 0.044 786 H MET 104 HN MET 104 9.216 -0.716 5.924 787 HA MET 104 HA MET 104 7.722 0.894 4.197 788 1HB MET 104 HB2 MET 104 6.469 1.551 6.144 789 2HB MET 104 HB1 MET 104 6.890 -0.151 6.300 790 1HG MET 104 HG1 MET 104 8.102 0.204 8.136 791 2HG MET 104 HG2 MET 104 8.863 1.638 7.451 792 1HE MET 104 HE1 MET 104 4.840 1.787 7.567 793 2HE MET 104 HE2 MET 104 4.684 1.600 9.317 794 3HE MET 104 HE3 MET 104 5.449 0.330 8.354 795 H LEU 105 HN LEU 105 10.386 1.704 6.343 796 HA LEU 105 HA LEU 105 9.983 4.556 5.998 797 1HB LEU 105 HB1 LEU 105 12.410 3.249 7.202 798 2HB LEU 105 HB2 LEU 105 11.800 4.867 7.484 799 HG LEU 105 HG LEU 105 10.415 2.346 8.388 800 1HD1 LEU 105 HD11 LEU 105 12.558 3.966 9.576 801 2HD1 LEU 105 HD12 LEU 105 12.090 2.294 9.887 802 3HD1 LEU 105 HD13 LEU 105 11.199 3.615 10.644 803 1HD2 LEU 105 HD21 LEU 105 8.927 4.249 8.007 804 2HD2 LEU 105 HD22 LEU 105 9.928 5.237 9.071 805 3HD2 LEU 105 HD23 LEU 105 9.055 3.849 9.720 806 H GLU 106 HN GLU 106 11.490 2.055 4.308 807 HA GLU 106 HA GLU 106 13.428 3.890 3.114 808 1HB GLU 106 HB1 GLU 106 14.821 2.120 2.791 809 2HB GLU 106 HB2 GLU 106 13.863 1.433 4.098 810 1HG GLU 106 HG1 GLU 106 13.564 -0.302 2.750 811 2HG GLU 106 HG2 GLU 106 12.424 0.724 1.881 812 H SER 107 HN SER 107 10.386 2.621 2.436 813 HA SER 107 HA SER 107 10.711 3.372 -0.378 814 1HB SER 107 HB2 SER 107 10.792 0.762 0.226 815 2HB SER 107 HB1 SER 107 9.045 0.968 0.137 816 HG SER 107 HG SER 107 9.353 0.771 -1.932 817 HA PRO 108 HA PRO 108 6.890 5.479 0.512 818 1HB PRO 108 HB1 PRO 108 6.625 5.825 -2.385 819 2HB PRO 108 HB2 PRO 108 6.866 7.044 -1.132 820 1HG PRO 108 HG2 PRO 108 8.794 6.409 -2.906 821 2HG PRO 108 HG1 PRO 108 9.161 6.899 -1.242 822 1HD PRO 108 HD1 PRO 108 9.092 4.152 -2.439 823 2HD PRO 108 HD2 PRO 108 10.261 4.854 -1.300 824 H GLU 109 HN GLU 109 7.244 2.548 -0.932 825 HA GLU 109 HA GLU 109 4.340 2.224 -1.343 826 1HB GLU 109 HB1 GLU 109 5.000 1.708 -3.453 827 2HB GLU 109 HB2 GLU 109 6.657 1.392 -2.968 828 1HG GLU 109 HG2 GLU 109 6.127 -0.823 -2.304 829 2HG GLU 109 HG1 GLU 109 4.397 -0.522 -2.461 830 H SER 110 HN SER 110 7.260 1.070 0.121 831 HA SER 110 HA SER 110 6.370 -1.472 0.909 832 1HB SER 110 HB1 SER 110 8.641 0.240 1.464 833 2HB SER 110 HB2 SER 110 8.106 -0.611 2.916 834 HG SER 110 HG SER 110 9.335 -1.575 0.662 835 H LEU 111 HN LEU 111 6.266 1.647 2.546 836 HA LEU 111 HA LEU 111 5.197 0.762 4.952 837 1HB LEU 111 HB1 LEU 111 6.054 3.042 4.492 838 2HB LEU 111 HB2 LEU 111 4.604 3.363 3.555 839 HG LEU 111 HG LEU 111 4.069 2.388 6.259 840 1HD1 LEU 111 HD11 LEU 111 4.759 5.169 6.458 841 2HD1 LEU 111 HD12 LEU 111 6.165 4.196 6.013 842 3HD1 LEU 111 HD13 LEU 111 5.241 3.807 7.471 843 1HD2 LEU 111 HD21 LEU 111 2.425 4.139 6.214 844 2HD2 LEU 111 HD22 LEU 111 2.382 3.264 4.682 845 3HD2 LEU 111 HD23 LEU 111 3.161 4.845 4.774 846 H ARG 112 HN ARG 112 3.724 1.161 1.849 847 HA ARG 112 HA ARG 112 1.030 1.007 2.906 848 1HB ARG 112 HB2 ARG 112 0.760 2.257 1.058 849 2HB ARG 112 HB1 ARG 112 2.276 1.707 0.358 850 1HG ARG 112 HG1 ARG 112 1.237 -0.251 -0.521 851 2HG ARG 112 HG2 ARG 112 -0.269 0.109 0.326 852 1HD ARG 112 HD2 ARG 112 -0.602 2.093 -1.005 853 2HD ARG 112 HD1 ARG 112 0.958 1.862 -1.797 854 HE ARG 112 HE ARG 112 -0.154 -0.364 -2.532 855 1HH1 ARG 112 HH22 ARG 112 -1.727 2.731 -2.216 856 2HH1 ARG 112 HH21 ARG 112 -2.910 2.397 -3.435 857 1HH2 ARG 112 HH11 ARG 112 -1.709 -0.809 -4.139 858 2HH2 ARG 112 HH12 ARG 112 -2.900 0.387 -4.528 859 H SER 113 HN SER 113 3.186 -1.006 0.927 860 HA SER 113 HA SER 113 1.338 -3.145 0.641 861 1HB SER 113 HB2 SER 113 3.225 -2.790 -0.918 862 2HB SER 113 HB1 SER 113 4.356 -3.180 0.377 863 HG SER 113 HG SER 113 2.770 -5.186 0.386 864 H LYS 114 HN LYS 114 3.777 -2.316 2.990 865 HA LYS 114 HA LYS 114 3.679 -4.872 4.321 866 1HB LYS 114 HB1 LYS 114 4.914 -2.262 5.217 867 2HB LYS 114 HB2 LYS 114 5.129 -3.819 6.005 868 1HG LYS 114 HG1 LYS 114 5.966 -3.189 3.184 869 2HG LYS 114 HG2 LYS 114 7.038 -3.173 4.587 870 1HD LYS 114 HD1 LYS 114 7.101 -5.441 4.738 871 2HD LYS 114 HD2 LYS 114 5.449 -5.633 4.144 872 1HE LYS 114 HE1 LYS 114 7.001 -4.541 2.039 873 2HE LYS 114 HE2 LYS 114 7.902 -5.895 2.719 874 1HZ LYS 114 HZ1 LYS 114 5.872 -7.252 2.470 875 2HZ LYS 114 HZ2 LYS 114 6.479 -6.694 0.992 876 3HZ LYS 114 HZ3 LYS 114 5.121 -5.957 1.683 877 H VAL 115 HN VAL 115 2.073 -1.792 4.484 878 HA VAL 115 HA VAL 115 0.964 -2.215 7.108 879 HB VAL 115 HB VAL 115 0.704 -0.133 5.042 880 1HG1 VAL 115 HG11 VAL 115 -1.666 -1.026 6.648 881 2HG1 VAL 115 HG12 VAL 115 -1.593 -0.507 4.965 882 3HG1 VAL 115 HG13 VAL 115 -1.445 0.680 6.262 883 1HG2 VAL 115 HG21 VAL 115 1.518 1.072 6.709 884 2HG2 VAL 115 HG22 VAL 115 1.543 -0.383 7.705 885 3HG2 VAL 115 HG23 VAL 115 0.133 0.678 7.729 886 H ASP 116 HN ASP 116 -0.427 -2.317 3.812 887 HA ASP 116 HA ASP 116 -2.870 -3.452 4.411 888 1HB ASP 116 HB1 ASP 116 -1.924 -2.633 2.146 889 2HB ASP 116 HB2 ASP 116 -1.323 -4.278 1.968 890 H GLU 117 HN GLU 117 0.258 -5.035 3.984 891 HA GLU 117 HA GLU 117 -0.756 -7.697 4.152 892 1HB GLU 117 HB1 GLU 117 1.932 -6.410 4.211 893 2HB GLU 117 HB2 GLU 117 1.798 -8.031 4.874 894 1HG GLU 117 HG1 GLU 117 2.314 -7.483 2.291 895 2HG GLU 117 HG2 GLU 117 1.573 -8.977 2.859 896 H ALA 118 HN ALA 118 0.547 -5.380 6.477 897 HA ALA 118 HA ALA 118 0.594 -7.136 8.700 898 1HB ALA 118 HB1 ALA 118 0.169 -4.170 8.885 899 2HB ALA 118 HB2 ALA 118 1.741 -4.878 8.506 900 3HB ALA 118 HB3 ALA 118 0.956 -5.245 10.043 901 H VAL 119 HN VAL 119 -1.892 -5.515 7.011 902 HA VAL 119 HA VAL 119 -3.876 -5.365 9.019 903 HB VAL 119 HB VAL 119 -4.200 -5.681 6.042 904 1HG1 VAL 119 HG11 VAL 119 -6.100 -4.838 8.216 905 2HG1 VAL 119 HG12 VAL 119 -6.304 -6.121 7.022 906 3HG1 VAL 119 HG13 VAL 119 -6.349 -4.428 6.517 907 1HG2 VAL 119 HG21 VAL 119 -3.348 -3.505 7.777 908 2HG2 VAL 119 HG22 VAL 119 -4.662 -3.077 6.681 909 3HG2 VAL 119 HG23 VAL 119 -3.149 -3.720 6.041 910 H ALA 120 HN ALA 120 -3.017 -7.749 6.584 911 HA ALA 120 HA ALA 120 -5.018 -9.652 7.124 912 1HB ALA 120 HB1 ALA 120 -2.531 -10.866 6.335 913 2HB ALA 120 HB2 ALA 120 -2.816 -9.391 5.403 914 3HB ALA 120 HB3 ALA 120 -4.023 -10.682 5.412 915 H VAL 121 HN VAL 121 -2.092 -8.742 8.686 916 HA VAL 121 HA VAL 121 -1.939 -11.093 10.365 917 HB VAL 121 HB VAL 121 -0.303 -8.595 10.066 918 1HG1 VAL 121 HG21 VAL 121 0.296 -8.626 12.196 919 2HG1 VAL 121 HG22 VAL 121 1.026 -10.206 11.909 920 3HG1 VAL 121 HG23 VAL 121 -0.634 -10.097 12.495 921 1HG2 VAL 121 HG11 VAL 121 -0.089 -10.715 8.628 922 2HG2 VAL 121 HG12 VAL 121 0.656 -11.432 10.058 923 3HG2 VAL 121 HG13 VAL 121 1.380 -10.010 9.307 924 H LEU 122 HN LEU 122 -3.092 -7.797 10.522 925 HA LEU 122 HA LEU 122 -3.397 -7.711 13.361 926 1HB LEU 122 HB2 LEU 122 -3.686 -5.550 12.932 927 2HB LEU 122 HB1 LEU 122 -3.629 -5.894 11.216 928 HG LEU 122 HG LEU 122 -6.261 -6.497 12.053 929 1HD1 LEU 122 HD11 LEU 122 -6.383 -3.792 12.737 930 2HD1 LEU 122 HD12 LEU 122 -5.078 -4.470 13.711 931 3HD1 LEU 122 HD13 LEU 122 -6.690 -5.178 13.783 932 1HD2 LEU 122 HD21 LEU 122 -6.673 -4.305 10.724 933 2HD2 LEU 122 HD22 LEU 122 -6.002 -5.715 9.903 934 3HD2 LEU 122 HD23 LEU 122 -4.942 -4.394 10.398 935 H GLN 123 HN GLN 123 -5.470 -8.479 10.628 936 HA GLN 123 HA GLN 123 -7.855 -8.822 12.128 937 1HB GLN 123 HB1 GLN 123 -6.963 -9.672 9.382 938 2HB GLN 123 HB2 GLN 123 -8.511 -10.193 10.032 939 1HG GLN 123 HG1 GLN 123 -7.652 -7.325 9.724 940 2HG GLN 123 HG2 GLN 123 -8.670 -8.205 8.584 941 1HE2 GLN 123 HE22 GLN 123 -9.064 -5.833 10.432 942 2HE2 GLN 123 HE21 GLN 123 -10.534 -6.195 11.266 943 H ALA 124 HN ALA 124 -5.155 -10.862 11.282 944 HA ALA 124 HA ALA 124 -6.388 -13.312 12.160 945 1HB ALA 124 HB1 ALA 124 -4.601 -13.172 10.409 946 2HB ALA 124 HB2 ALA 124 -4.290 -14.344 11.690 947 3HB ALA 124 HB3 ALA 124 -3.457 -12.789 11.696 948 H HIS 125 HN HIS 125 -5.026 -10.663 13.716 949 HA HIS 125 HA HIS 125 -4.457 -12.266 16.122 950 1HB HIS 125 HB1 HIS 125 -2.709 -10.619 14.825 951 2HB HIS 125 HB2 HIS 125 -3.391 -9.517 16.017 952 HD2 HIS 125 HD2 HIS 125 -2.721 -10.012 18.657 953 HE1 HIS 125 HE1 HIS 125 0.003 -13.127 17.766 954 HE2 HIS 125 HE2 HIS 125 -0.867 -11.577 19.576 955 H GLN 126 HN GLN 126 -6.723 -10.331 14.789 956 HA GLN 126 HA GLN 126 -7.304 -8.658 17.058 957 1HB GLN 126 HB1 GLN 126 -8.352 -9.006 14.326 958 2HB GLN 126 HB2 GLN 126 -9.547 -8.522 15.523 959 1HG GLN 126 HG1 GLN 126 -7.588 -6.796 16.126 960 2HG GLN 126 HG2 GLN 126 -7.262 -7.030 14.409 961 1HE2 GLN 126 HE21 GLN 126 -9.992 -6.458 16.602 962 2HE2 GLN 126 HE22 GLN 126 -10.813 -5.346 15.566 963 H ALA 127 HN ALA 127 -9.951 -10.327 15.521 964 HA ALA 127 HA ALA 127 -10.776 -11.320 18.137 965 1HB ALA 127 HB1 ALA 127 -12.226 -10.882 15.549 966 2HB ALA 127 HB2 ALA 127 -12.489 -10.104 17.110 967 3HB ALA 127 HB3 ALA 127 -12.944 -11.792 16.878 968 H LYS 128 HN LYS 128 -8.694 -12.620 16.345 969 HA LYS 128 HA LYS 128 -9.948 -15.154 15.674 970 1HB LYS 128 HB2 LYS 128 -7.055 -14.295 15.483 971 2HB LYS 128 HB1 LYS 128 -7.731 -15.777 14.823 972 1HG LYS 128 HG2 LYS 128 -9.257 -13.600 13.837 973 2HG LYS 128 HG1 LYS 128 -7.544 -13.229 13.621 974 1HD LYS 128 HD2 LYS 128 -7.197 -15.315 12.453 975 2HD LYS 128 HD1 LYS 128 -8.867 -15.799 12.759 976 1HE LYS 128 HE1 LYS 128 -9.493 -13.635 11.512 977 2HE LYS 128 HE2 LYS 128 -7.829 -13.664 10.930 978 1HZ LYS 128 HZ1 LYS 128 -9.816 -14.868 9.670 979 2HZ LYS 128 HZ2 LYS 128 -9.333 -16.141 10.673 980 3HZ LYS 128 HZ3 LYS 128 -8.223 -15.433 9.612 981 H GLU 129 HN GLU 129 -7.558 -16.713 16.238 982 HA GLU 129 HA GLU 129 -8.115 -17.301 19.032 983 1HB GLU 129 HB2 GLU 129 -7.409 -18.842 16.784 984 2HB GLU 129 HB1 GLU 129 -6.031 -18.930 17.872 985 1HG GLU 129 HG2 GLU 129 -8.478 -19.275 19.335 986 2HG GLU 129 HG1 GLU 129 -8.399 -20.406 17.985 987 H ALA 130 HN ALA 130 -6.170 -15.230 17.457 988 HA ALA 130 HA ALA 130 -3.758 -15.615 19.019 989 1HB ALA 130 HB1 ALA 130 -3.341 -13.274 17.770 990 2HB ALA 130 HB2 ALA 130 -4.565 -13.969 16.705 991 3HB ALA 130 HB3 ALA 130 -3.063 -14.842 17.013 992 H ALA 131 HN ALA 131 -6.460 -14.832 20.181 993 HA ALA 131 HA ALA 131 -6.389 -12.178 21.080 994 1HB ALA 131 HB1 ALA 131 -8.396 -13.544 21.215 995 2HB ALA 131 HB2 ALA 131 -7.971 -12.910 22.805 996 3HB ALA 131 HB3 ALA 131 -7.622 -14.591 22.403 997 H GLN 132 HN GLN 132 -5.110 -11.178 22.482 998 HA GLN 132 HA GLN 132 -3.206 -12.723 24.037 999 1HB GLN 132 HB1 GLN 132 -2.192 -10.533 24.546 1000 2HB GLN 132 HB2 GLN 132 -2.378 -10.790 22.818 1001 1HG GLN 132 HG2 GLN 132 -4.697 -9.524 23.395 1002 2HG GLN 132 HG1 GLN 132 -3.610 -8.794 24.576 1003 1HE2 GLN 132 HE22 GLN 132 -1.577 -7.912 23.729 1004 2HE2 GLN 132 HE21 GLN 132 -1.588 -7.173 22.167 1005 H LYS 133 HN LYS 133 -3.139 -12.878 26.224 1006 HA LYS 133 HA LYS 133 -5.548 -12.101 27.657 1007 1HB LYS 133 HB1 LYS 133 -3.385 -13.438 29.148 1008 2HB LYS 133 HB2 LYS 133 -5.103 -13.804 29.088 1009 1HG LYS 133 HG1 LYS 133 -4.648 -15.549 27.810 1010 2HG LYS 133 HG2 LYS 133 -4.067 -14.449 26.556 1011 1HD LYS 133 HD2 LYS 133 -1.842 -14.614 27.290 1012 2HD LYS 133 HD1 LYS 133 -2.317 -15.316 28.838 1013 1HE LYS 133 HE1 LYS 133 -2.767 -17.395 27.901 1014 2HE LYS 133 HE2 LYS 133 -2.923 -16.734 26.274 1015 1HZ LYS 133 HZ1 LYS 133 -0.679 -16.692 25.972 1016 2HZ LYS 133 HZ2 LYS 133 -0.789 -18.027 27.006 1017 3HZ LYS 133 HZ3 LYS 133 -0.330 -16.519 27.618 1018 H ALA 134 HN ALA 134 -2.217 -11.191 27.390 1019 HA ALA 134 HA ALA 134 -1.994 -9.786 29.848 1020 1HB ALA 134 HB1 ALA 134 0.018 -8.795 28.872 1021 2HB ALA 134 HB2 ALA 134 -0.428 -9.446 27.295 1022 3HB ALA 134 HB3 ALA 134 -0.030 -10.540 28.620 1023 H VAL 135 HN VAL 135 -3.296 -8.145 30.343 1024 HA VAL 135 HA VAL 135 -4.045 -6.234 28.240 1025 HB VAL 135 HB VAL 135 -5.755 -5.443 29.908 1026 1HG1 VAL 135 HG21 VAL 135 -5.952 -7.327 28.050 1027 2HG1 VAL 135 HG22 VAL 135 -7.295 -6.926 29.121 1028 3HG1 VAL 135 HG23 VAL 135 -6.284 -8.329 29.462 1029 1HG2 VAL 135 HG11 VAL 135 -5.136 -6.099 32.008 1030 2HG2 VAL 135 HG12 VAL 135 -4.518 -7.657 31.460 1031 3HG2 VAL 135 HG13 VAL 135 -6.257 -7.401 31.606 1032 H ASN 136 HN ASN 136 -1.750 -6.582 30.539 1033 HA ASN 136 HA ASN 136 -1.786 -3.845 31.527 1034 1HB ASN 136 HB2 ASN 136 0.378 -5.884 32.024 1035 2HB ASN 136 HB1 ASN 136 -0.061 -4.494 33.012 1036 1HD2 ASN 136 HD21 ASN 136 0.161 -7.341 33.686 1037 2HD2 ASN 136 HD22 ASN 136 -1.373 -7.784 34.348 1038 H SER 137 HN SER 137 -0.526 -5.573 28.911 1039 HA SER 137 HA SER 137 1.814 -3.912 28.534 1040 1HB SER 137 HB1 SER 137 2.212 -5.232 26.546 1041 2HB SER 137 HB2 SER 137 1.752 -6.322 27.854 1042 HG SER 137 HG SER 137 -0.493 -5.864 26.850 1043 H ALA 138 HN ALA 138 -1.438 -3.509 28.043 1044 HA ALA 138 HA ALA 138 -1.325 -2.104 25.528 1045 1HB ALA 138 HB1 ALA 138 -3.402 -3.005 25.740 1046 2HB ALA 138 HB2 ALA 138 -3.722 -1.414 26.429 1047 3HB ALA 138 HB3 ALA 138 -3.439 -2.794 27.490 1048 H THR 139 HN THR 139 -2.738 0.129 25.760 1049 HA THR 139 HA THR 139 -0.969 1.863 27.302 1050 HB THR 139 HB THR 139 -1.727 3.650 25.921 1051 HG1 THR 139 HG1 THR 139 -3.508 2.565 24.318 1052 1HG2 THR 139 HG21 THR 139 -1.534 2.789 23.600 1053 2HG2 THR 139 HG22 THR 139 -1.509 1.156 24.264 1054 3HG2 THR 139 HG23 THR 139 -0.226 2.294 24.675 1055 H GLY 140 HN GLY 140 -1.795 3.578 28.624 1056 1HA GLY 140 HA1 GLY 140 -4.288 2.801 29.971 1057 2HA GLY 140 HA2 GLY 140 -3.015 3.795 30.664 1058 H VAL 141 HN VAL 141 -2.829 5.996 29.985 1059 HA VAL 141 HA VAL 141 -5.415 7.118 29.194 1060 HB VAL 141 HB VAL 141 -3.083 8.759 30.128 1061 1HG1 VAL 141 HG21 VAL 141 -4.576 10.388 29.931 1062 2HG1 VAL 141 HG22 VAL 141 -5.559 9.611 31.173 1063 3HG1 VAL 141 HG23 VAL 141 -5.822 9.227 29.471 1064 1HG2 VAL 141 HG11 VAL 141 -4.453 8.452 32.413 1065 2HG2 VAL 141 HG12 VAL 141 -3.060 7.461 31.982 1066 3HG2 VAL 141 HG13 VAL 141 -4.693 6.852 31.709 1067 HA PRO 142 HA PRO 142 -3.588 7.538 25.059 1068 1HB PRO 142 HB1 PRO 142 -6.168 8.971 24.686 1069 2HB PRO 142 HB2 PRO 142 -5.434 7.702 23.702 1070 1HG PRO 142 HG2 PRO 142 -7.493 7.159 25.299 1071 2HG PRO 142 HG1 PRO 142 -6.155 6.008 25.116 1072 1HD PRO 142 HD1 PRO 142 -6.753 7.882 27.368 1073 2HD PRO 142 HD2 PRO 142 -6.110 6.229 27.416 1074 H THR 143 HN THR 143 -2.178 9.087 24.573 1075 HA THR 143 HA THR 143 -2.426 11.725 25.736 1076 HB THR 143 HB THR 143 -0.204 12.124 24.814 1077 HG1 THR 143 HG1 THR 143 -0.860 9.917 23.275 1078 1HG2 THR 143 HG21 THR 143 0.884 10.897 26.316 1079 2HG2 THR 143 HG22 THR 143 0.290 9.376 25.647 1080 3HG2 THR 143 HG23 THR 143 -0.715 10.301 26.765 1081 H VAL 144 HN VAL 144 -1.785 13.617 24.222 1082 HA VAL 144 HA VAL 144 -3.014 13.355 21.580 1083 HB VAL 144 HB VAL 144 -4.806 14.111 23.103 1084 1HG1 VAL 144 HG11 VAL 144 -2.755 15.727 24.176 1085 2HG1 VAL 144 HG12 VAL 144 -4.431 15.598 24.706 1086 3HG1 VAL 144 HG13 VAL 144 -3.977 16.809 23.508 1087 1HG2 VAL 144 HG21 VAL 144 -4.865 14.775 20.770 1088 2HG2 VAL 144 HG22 VAL 144 -3.872 16.188 21.127 1089 3HG2 VAL 144 HG23 VAL 144 -5.501 16.066 21.789 Start of MODEL 2 1 1H GLY 1 HT1 GLY 1 -7.397 -23.659 -5.324 2 2H GLY 1 HT2 GLY 1 -8.205 -24.002 -3.878 3 3H GLY 1 HT3 GLY 1 -9.082 -23.801 -5.310 4 1HA GLY 1 HA1 GLY 1 -7.229 -25.791 -5.829 5 2HA GLY 1 HA2 GLY 1 -7.914 -26.150 -4.252 6 HA PRO 2 HA PRO 2 -8.508 -28.071 -3.983 7 1HB PRO 2 HB1 PRO 2 -9.094 -30.490 -5.513 8 2HB PRO 2 HB2 PRO 2 -9.564 -30.072 -3.864 9 1HG PRO 2 HG2 PRO 2 -11.348 -30.203 -5.889 10 2HG PRO 2 HG1 PRO 2 -11.524 -29.074 -4.533 11 1HD PRO 2 HD1 PRO 2 -10.507 -28.559 -7.306 12 2HD PRO 2 HD2 PRO 2 -11.596 -27.574 -6.304 13 H LEU 3 HN LEU 3 -8.338 -28.985 -7.426 14 HA LEU 3 HA LEU 3 -5.503 -29.619 -7.105 15 1HB LEU 3 HB2 LEU 3 -7.581 -30.232 -9.156 16 2HB LEU 3 HB1 LEU 3 -5.897 -30.226 -9.647 17 HG LEU 3 HG LEU 3 -6.077 -31.763 -7.267 18 1HD1 LEU 3 HD11 LEU 3 -8.478 -31.900 -8.826 19 2HD1 LEU 3 HD12 LEU 3 -8.069 -32.736 -7.327 20 3HD1 LEU 3 HD13 LEU 3 -7.631 -33.446 -8.881 21 1HD2 LEU 3 HD21 LEU 3 -4.427 -32.002 -9.068 22 2HD2 LEU 3 HD22 LEU 3 -5.692 -32.619 -10.132 23 3HD2 LEU 3 HD23 LEU 3 -5.228 -33.529 -8.693 24 H GLY 4 HN GLY 4 -3.868 -28.528 -8.107 25 1HA GLY 4 HA2 GLY 4 -4.609 -25.925 -9.257 26 2HA GLY 4 HA1 GLY 4 -3.054 -26.321 -8.539 27 H SER 5 HN SER 5 -5.050 -26.544 -11.388 28 HA SER 5 HA SER 5 -2.914 -27.829 -12.905 29 1HB SER 5 HB2 SER 5 -5.489 -28.319 -13.084 30 2HB SER 5 HB1 SER 5 -5.489 -26.900 -14.131 31 HG SER 5 HG SER 5 -5.147 -28.709 -15.393 32 H ALA 6 HN ALA 6 -1.959 -25.509 -12.087 33 HA ALA 6 HA ALA 6 -0.926 -23.609 -12.783 34 1HB ALA 6 HB1 ALA 6 -0.081 -24.551 -14.701 35 2HB ALA 6 HB2 ALA 6 -1.015 -23.207 -15.358 36 3HB ALA 6 HB3 ALA 6 -1.677 -24.842 -15.393 37 H ALA 7 HN ALA 7 -1.330 -21.415 -13.509 38 HA ALA 7 HA ALA 7 -3.934 -20.616 -14.372 39 1HB ALA 7 HB1 ALA 7 -3.488 -19.414 -11.744 40 2HB ALA 7 HB2 ALA 7 -3.824 -21.145 -11.698 41 3HB ALA 7 HB3 ALA 7 -4.967 -20.046 -12.470 42 H ALA 8 HN ALA 8 -1.025 -20.225 -14.896 43 HA ALA 8 HA ALA 8 0.384 -18.583 -15.588 44 1HB ALA 8 HB1 ALA 8 -1.074 -17.659 -17.063 45 2HB ALA 8 HB2 ALA 8 -0.885 -16.287 -15.972 46 3HB ALA 8 HB3 ALA 8 -2.294 -17.338 -15.829 47 H ALA 9 HN ALA 9 -1.586 -16.155 -14.020 48 HA ALA 9 HA ALA 9 0.508 -15.857 -11.968 49 1HB ALA 9 HB1 ALA 9 0.377 -13.540 -12.101 50 2HB ALA 9 HB2 ALA 9 -1.187 -13.577 -12.913 51 3HB ALA 9 HB3 ALA 9 0.269 -14.054 -13.784 52 H THR 10 HN THR 10 -2.405 -13.944 -11.994 53 HA THR 10 HA THR 10 -3.967 -15.587 -10.299 54 HB THR 10 HB THR 10 -2.462 -15.187 -8.538 55 HG1 THR 10 HG1 THR 10 -4.569 -14.688 -7.898 56 1HG2 THR 10 HG21 THR 10 -2.408 -12.254 -8.662 57 2HG2 THR 10 HG22 THR 10 -1.480 -13.099 -9.901 58 3HG2 THR 10 HG23 THR 10 -1.155 -13.403 -8.194 59 HA PRO 11 HA PRO 11 -6.181 -12.012 -12.188 60 1HB PRO 11 HB1 PRO 11 -7.958 -13.392 -13.638 61 2HB PRO 11 HB2 PRO 11 -6.299 -13.153 -14.201 62 1HG PRO 11 HG1 PRO 11 -7.545 -15.554 -12.925 63 2HG PRO 11 HG2 PRO 11 -6.395 -15.470 -14.272 64 1HD PRO 11 HD2 PRO 11 -5.714 -16.027 -11.651 65 2HD PRO 11 HD1 PRO 11 -4.594 -15.395 -12.875 66 H ALA 12 HN ALA 12 -6.527 -13.126 -9.540 67 HA ALA 12 HA ALA 12 -9.334 -13.716 -9.214 68 1HB ALA 12 HB1 ALA 12 -8.383 -14.809 -7.512 69 2HB ALA 12 HB2 ALA 12 -8.382 -13.247 -6.694 70 3HB ALA 12 HB3 ALA 12 -6.939 -13.796 -7.547 71 H VAL 13 HN VAL 13 -10.555 -11.970 -9.791 72 HA VAL 13 HA VAL 13 -10.019 -9.426 -8.411 73 HB VAL 13 HB VAL 13 -11.823 -9.840 -10.793 74 1HG1 VAL 13 HG11 VAL 13 -10.571 -7.283 -9.832 75 2HG1 VAL 13 HG12 VAL 13 -12.138 -7.842 -9.249 76 3HG1 VAL 13 HG13 VAL 13 -11.907 -7.494 -10.963 77 1HG2 VAL 13 HG21 VAL 13 -9.957 -8.760 -12.079 78 2HG2 VAL 13 HG22 VAL 13 -9.630 -10.403 -11.529 79 3HG2 VAL 13 HG23 VAL 13 -8.924 -9.031 -10.676 80 H ARG 14 HN ARG 14 -10.997 -10.090 -6.448 81 HA ARG 14 HA ARG 14 -13.666 -11.066 -6.322 82 1HB ARG 14 HB2 ARG 14 -11.802 -11.284 -4.565 83 2HB ARG 14 HB1 ARG 14 -12.240 -9.650 -4.079 84 1HG ARG 14 HG2 ARG 14 -14.191 -10.303 -3.133 85 2HG ARG 14 HG1 ARG 14 -14.436 -11.621 -4.282 86 1HD ARG 14 HD2 ARG 14 -12.154 -11.841 -2.400 87 2HD ARG 14 HD1 ARG 14 -13.776 -12.049 -1.742 88 HE ARG 14 HE ARG 14 -13.173 -13.610 -4.107 89 1HH1 ARG 14 HH11 ARG 14 -13.277 -13.496 -0.626 90 2HH1 ARG 14 HH12 ARG 14 -13.334 -15.217 -0.443 91 1HH2 ARG 14 HH21 ARG 14 -13.249 -15.877 -3.875 92 2HH2 ARG 14 HH22 ARG 14 -13.318 -16.570 -2.289 93 H THR 15 HN THR 15 -15.569 -10.023 -6.080 94 HA THR 15 HA THR 15 -15.561 -7.146 -6.527 95 HB THR 15 HB THR 15 -18.204 -7.910 -6.403 96 HG1 THR 15 HG1 THR 15 -18.253 -9.868 -7.617 97 1HG2 THR 15 HG21 THR 15 -16.509 -8.119 -8.874 98 2HG2 THR 15 HG22 THR 15 -17.117 -6.605 -8.204 99 3HG2 THR 15 HG23 THR 15 -18.247 -7.829 -8.783 100 H VAL 16 HN VAL 16 -15.905 -5.697 -4.983 101 HA VAL 16 HA VAL 16 -16.906 -6.642 -2.381 102 HB VAL 16 HB VAL 16 -15.875 -4.352 -1.631 103 1HG1 VAL 16 HG21 VAL 16 -13.700 -6.235 -2.226 104 2HG1 VAL 16 HG22 VAL 16 -15.103 -6.941 -1.424 105 3HG1 VAL 16 HG23 VAL 16 -14.253 -5.586 -0.682 106 1HG2 VAL 16 HG11 VAL 16 -14.611 -4.847 -4.298 107 2HG2 VAL 16 HG12 VAL 16 -13.709 -4.043 -3.013 108 3HG2 VAL 16 HG13 VAL 16 -15.212 -3.338 -3.609 109 HA PRO 17 HA PRO 17 -20.565 -4.220 -3.048 110 1HB PRO 17 HB2 PRO 17 -21.374 -3.992 -0.454 111 2HB PRO 17 HB1 PRO 17 -21.584 -5.461 -1.414 112 1HG PRO 17 HG2 PRO 17 -19.466 -4.796 0.598 113 2HG PRO 17 HG1 PRO 17 -20.364 -6.311 0.376 114 1HD PRO 17 HD1 PRO 17 -17.850 -5.991 -0.544 115 2HD PRO 17 HD2 PRO 17 -19.050 -6.973 -1.409 116 H GLN 18 HN GLN 18 -20.522 -2.129 -3.538 117 HA GLN 18 HA GLN 18 -18.843 -0.274 -2.113 118 1HB GLN 18 HB1 GLN 18 -20.601 -0.136 -4.532 119 2HB GLN 18 HB2 GLN 18 -20.085 1.359 -3.761 120 1HG GLN 18 HG2 GLN 18 -17.766 0.769 -4.083 121 2HG GLN 18 HG1 GLN 18 -18.230 -0.794 -4.756 122 1HE2 GLN 18 HE21 GLN 18 -16.794 0.124 -6.488 123 2HE2 GLN 18 HE22 GLN 18 -17.560 1.043 -7.735 124 H TYR 19 HN TYR 19 -19.648 -0.025 -0.057 125 HA TYR 19 HA TYR 19 -22.390 0.421 0.530 126 1HB TYR 19 HB1 TYR 19 -19.842 0.418 2.015 127 2HB TYR 19 HB2 TYR 19 -21.082 1.476 2.681 128 HD1 TYR 19 HD1 TYR 19 -23.180 0.550 3.538 129 HD2 TYR 19 HD2 TYR 19 -20.092 -1.980 2.067 130 HE1 TYR 19 HE1 TYR 19 -24.252 -1.380 4.623 131 HE2 TYR 19 HE2 TYR 19 -21.155 -3.917 3.148 132 HH TYR 19 HH TYR 19 -23.185 -4.640 4.048 133 H LYS 20 HN LYS 20 -23.539 2.181 0.132 134 HA LYS 20 HA LYS 20 -22.161 4.718 -0.340 135 1HB LYS 20 HB1 LYS 20 -24.972 3.789 -0.938 136 2HB LYS 20 HB2 LYS 20 -24.428 5.442 -1.192 137 1HG LYS 20 HG2 LYS 20 -22.809 3.288 -2.418 138 2HG LYS 20 HG1 LYS 20 -24.400 3.604 -3.113 139 1HD LYS 20 HD2 LYS 20 -23.627 5.406 -4.155 140 2HD LYS 20 HD1 LYS 20 -23.076 6.090 -2.624 141 1HE LYS 20 HE1 LYS 20 -21.026 5.906 -3.504 142 2HE LYS 20 HE2 LYS 20 -21.176 4.196 -3.103 143 1HZ LYS 20 HZ1 LYS 20 -21.091 3.694 -5.242 144 2HZ LYS 20 HZ2 LYS 20 -20.841 5.325 -5.616 145 3HZ LYS 20 HZ3 LYS 20 -22.411 4.694 -5.586 146 H TYR 21 HN TYR 21 -22.235 3.906 2.322 147 HA TYR 21 HA TYR 21 -24.405 5.342 3.615 148 1HB TYR 21 HB1 TYR 21 -22.552 3.262 4.365 149 2HB TYR 21 HB2 TYR 21 -22.494 4.574 5.538 150 HD1 TYR 21 HD1 TYR 21 -24.280 4.939 7.063 151 HD2 TYR 21 HD2 TYR 21 -24.719 2.109 3.918 152 HE1 TYR 21 HE1 TYR 21 -26.334 4.094 8.119 153 HE2 TYR 21 HE2 TYR 21 -26.774 1.255 4.964 154 HH TYR 21 HH TYR 21 -27.692 2.065 8.140 155 H ALA 22 HN ALA 22 -22.089 6.561 1.997 156 HA ALA 22 HA ALA 22 -20.620 8.139 3.886 157 1HB ALA 22 HB1 ALA 22 -19.535 9.086 2.054 158 2HB ALA 22 HB2 ALA 22 -20.902 8.803 0.977 159 3HB ALA 22 HB3 ALA 22 -19.912 7.448 1.518 160 H ALA 23 HN ALA 23 -20.634 10.675 2.919 161 HA ALA 23 HA ALA 23 -23.189 11.653 3.887 162 1HB ALA 23 HB1 ALA 23 -20.472 12.720 3.633 163 2HB ALA 23 HB2 ALA 23 -21.708 13.032 4.851 164 3HB ALA 23 HB3 ALA 23 -21.754 13.887 3.309 165 H GLY 24 HN GLY 24 -23.794 10.473 1.609 166 1HA GLY 24 HA1 GLY 24 -23.585 12.289 -0.639 167 2HA GLY 24 HA2 GLY 24 -24.406 10.736 -0.622 168 H VAL 25 HN VAL 25 -24.699 13.996 0.778 169 HA VAL 25 HA VAL 25 -27.623 13.744 0.519 170 HB VAL 25 HB VAL 25 -27.180 15.985 2.082 171 1HG1 VAL 25 HG11 VAL 25 -28.074 14.605 3.903 172 2HG1 VAL 25 HG12 VAL 25 -27.764 13.155 2.948 173 3HG1 VAL 25 HG13 VAL 25 -28.944 14.343 2.392 174 1HG2 VAL 25 HG21 VAL 25 -25.716 15.144 3.910 175 2HG2 VAL 25 HG22 VAL 25 -24.855 15.492 2.411 176 3HG2 VAL 25 HG23 VAL 25 -25.223 13.824 2.850 177 H ARG 26 HN ARG 26 -24.903 15.266 -0.753 178 HA ARG 26 HA ARG 26 -26.217 17.717 -1.542 179 1HB ARG 26 HB1 ARG 26 -23.518 16.528 -2.193 180 2HB ARG 26 HB2 ARG 26 -24.084 18.048 -2.873 181 1HG ARG 26 HG2 ARG 26 -24.465 18.680 -0.362 182 2HG ARG 26 HG1 ARG 26 -23.283 17.399 -0.081 183 1HD ARG 26 HD1 ARG 26 -22.233 18.913 -2.173 184 2HD ARG 26 HD2 ARG 26 -22.886 20.093 -1.039 185 HE ARG 26 HE ARG 26 -21.261 19.508 0.476 186 1HH1 ARG 26 HH12 ARG 26 -21.315 17.197 -2.133 187 2HH1 ARG 26 HH11 ARG 26 -19.843 16.424 -1.649 188 1HH2 ARG 26 HH22 ARG 26 -19.322 18.495 1.119 189 2HH2 ARG 26 HH21 ARG 26 -18.710 17.161 0.199 190 H ASN 27 HN ASN 27 -26.003 14.538 -2.712 191 HA ASN 27 HA ASN 27 -26.568 15.327 -5.471 192 1HB ASN 27 HB1 ASN 27 -25.101 13.232 -4.391 193 2HB ASN 27 HB2 ASN 27 -26.593 12.464 -4.925 194 1HD2 ASN 27 HD21 ASN 27 -25.743 11.372 -6.629 195 2HD2 ASN 27 HD22 ASN 27 -25.109 12.142 -8.039 196 HA PRO 28 HA PRO 28 -27.607 14.575 -7.307 197 1HB PRO 28 HB1 PRO 28 -30.033 15.976 -8.143 198 2HB PRO 28 HB2 PRO 28 -29.264 14.556 -8.854 199 1HG PRO 28 HG2 PRO 28 -31.625 14.420 -7.550 200 2HG PRO 28 HG1 PRO 28 -30.453 13.089 -7.539 201 1HD PRO 28 HD2 PRO 28 -30.990 15.160 -5.438 202 2HD PRO 28 HD1 PRO 28 -30.705 13.416 -5.253 203 H GLN 29 HN GLN 29 -26.739 16.444 -8.264 204 HA GLN 29 HA GLN 29 -26.842 18.799 -6.546 205 1HB GLN 29 HB2 GLN 29 -25.004 18.171 -8.864 206 2HB GLN 29 HB1 GLN 29 -24.844 19.530 -7.760 207 1HG GLN 29 HG2 GLN 29 -24.286 18.125 -5.952 208 2HG GLN 29 HG1 GLN 29 -24.782 16.678 -6.830 209 1HE2 GLN 29 HE21 GLN 29 -22.240 17.266 -5.565 210 2HE2 GLN 29 HE22 GLN 29 -21.042 17.161 -6.804 211 H GLN 30 HN GLN 30 -26.332 18.640 -10.052 212 HA GLN 30 HA GLN 30 -28.251 20.833 -10.353 213 1HB GLN 30 HB1 GLN 30 -25.704 20.460 -11.382 214 2HB GLN 30 HB2 GLN 30 -26.753 20.083 -12.742 215 1HG GLN 30 HG1 GLN 30 -27.034 22.237 -13.125 216 2HG GLN 30 HG2 GLN 30 -27.744 22.435 -11.523 217 1HE2 GLN 30 HE21 GLN 30 -25.835 24.038 -13.271 218 2HE2 GLN 30 HE22 GLN 30 -24.544 24.450 -12.200 219 H HIS 31 HN HIS 31 -30.254 20.166 -10.766 220 HA HIS 31 HA HIS 31 -30.658 17.807 -12.460 221 1HB HIS 31 HB1 HIS 31 -32.999 17.883 -11.623 222 2HB HIS 31 HB2 HIS 31 -31.815 17.714 -10.331 223 HD2 HIS 31 HD2 HIS 31 -34.725 19.928 -11.333 224 HE1 HIS 31 HE1 HIS 31 -32.640 21.920 -8.232 225 HE2 HIS 31 HE2 HIS 31 -34.760 21.882 -9.624 226 H LEU 32 HN LEU 32 -30.157 20.866 -13.053 227 HA LEU 32 HA LEU 32 -32.444 21.325 -14.822 228 1HB LEU 32 HB1 LEU 32 -31.271 23.055 -13.192 229 2HB LEU 32 HB2 LEU 32 -30.195 23.265 -14.560 230 HG LEU 32 HG LEU 32 -33.137 23.451 -15.026 231 1HD1 LEU 32 HD11 LEU 32 -33.299 25.669 -14.286 232 2HD1 LEU 32 HD12 LEU 32 -31.555 25.814 -14.066 233 3HD1 LEU 32 HD13 LEU 32 -32.502 24.812 -12.967 234 1HD2 LEU 32 HD21 LEU 32 -32.454 24.169 -17.008 235 2HD2 LEU 32 HD22 LEU 32 -30.787 23.870 -16.513 236 3HD2 LEU 32 HD23 LEU 32 -31.512 25.457 -16.255 237 H ASN 33 HN ASN 33 -28.993 22.090 -15.202 238 HA ASN 33 HA ASN 33 -29.157 21.069 -17.952 239 1HB ASN 33 HB1 ASN 33 -26.880 22.421 -18.047 240 2HB ASN 33 HB2 ASN 33 -28.431 23.239 -18.204 241 1HD2 ASN 33 HD22 ASN 33 -29.069 24.664 -16.673 242 2HD2 ASN 33 HD21 ASN 33 -28.099 25.123 -15.319 243 H ALA 34 HN ALA 34 -28.963 19.032 -16.306 244 HA ALA 34 HA ALA 34 -26.290 18.352 -15.551 245 1HB ALA 34 HB1 ALA 34 -28.514 17.487 -14.571 246 2HB ALA 34 HB2 ALA 34 -27.165 16.362 -14.734 247 3HB ALA 34 HB3 ALA 34 -28.478 16.341 -15.912 248 H GLN 35 HN GLN 35 -25.946 15.763 -16.366 249 HA GLN 35 HA GLN 35 -25.454 16.104 -19.245 250 1HB GLN 35 HB2 GLN 35 -24.106 14.170 -17.354 251 2HB GLN 35 HB1 GLN 35 -23.632 14.538 -19.006 252 1HG GLN 35 HG1 GLN 35 -23.655 16.596 -16.820 253 2HG GLN 35 HG2 GLN 35 -22.252 15.591 -17.184 254 1HE2 GLN 35 HE21 GLN 35 -23.717 18.486 -17.784 255 2HE2 GLN 35 HE22 GLN 35 -22.914 18.912 -19.253 256 HA PRO 36 HA PRO 36 -28.711 12.902 -19.318 257 1HB PRO 36 HB2 PRO 36 -29.497 13.392 -21.862 258 2HB PRO 36 HB1 PRO 36 -30.046 14.362 -20.490 259 1HG PRO 36 HG1 PRO 36 -27.879 14.940 -22.475 260 2HG PRO 36 HG2 PRO 36 -29.124 16.027 -21.832 261 1HD PRO 36 HD2 PRO 36 -26.572 16.015 -20.914 262 2HD PRO 36 HD1 PRO 36 -27.961 16.405 -19.879 263 H GLN 37 HN GLN 37 -25.809 13.347 -21.028 264 HA GLN 37 HA GLN 37 -26.087 10.851 -22.528 265 1HB GLN 37 HB1 GLN 37 -23.820 12.855 -22.528 266 2HB GLN 37 HB2 GLN 37 -23.995 11.489 -23.620 267 1HG GLN 37 HG1 GLN 37 -26.322 13.221 -23.635 268 2HG GLN 37 HG2 GLN 37 -24.840 14.070 -24.072 269 1HE2 GLN 37 HE21 GLN 37 -26.998 13.608 -25.812 270 2HE2 GLN 37 HE22 GLN 37 -26.450 12.579 -27.088 271 H VAL 38 HN VAL 38 -25.966 9.307 -20.906 272 HA VAL 38 HA VAL 38 -23.686 9.294 -19.105 273 HB VAL 38 HB VAL 38 -24.726 7.146 -18.278 274 1HG1 VAL 38 HG21 VAL 38 -25.540 8.535 -16.751 275 2HG1 VAL 38 HG22 VAL 38 -26.950 8.810 -17.774 276 3HG1 VAL 38 HG23 VAL 38 -25.537 9.856 -17.919 277 1HG2 VAL 38 HG11 VAL 38 -26.086 6.246 -19.858 278 2HG2 VAL 38 HG12 VAL 38 -26.596 7.818 -20.475 279 3HG2 VAL 38 HG13 VAL 38 -27.293 7.189 -18.981 280 H THR 39 HN THR 39 -24.049 8.488 -22.227 281 HA THR 39 HA THR 39 -22.634 5.946 -22.152 282 HB THR 39 HB THR 39 -22.848 7.038 -24.799 283 HG1 THR 39 HG1 THR 39 -25.417 6.728 -24.079 284 1HG2 THR 39 HG21 THR 39 -23.324 4.595 -23.492 285 2HG2 THR 39 HG22 THR 39 -23.312 4.929 -25.224 286 3HG2 THR 39 HG23 THR 39 -24.818 5.049 -24.313 287 H MET 40 HN MET 40 -21.427 8.533 -21.250 288 HA MET 40 HA MET 40 -19.264 8.859 -23.196 289 1HB MET 40 HB1 MET 40 -20.639 10.702 -21.697 290 2HB MET 40 HB2 MET 40 -19.174 10.482 -20.750 291 1HG MET 40 HG1 MET 40 -18.750 12.280 -22.198 292 2HG MET 40 HG2 MET 40 -17.881 10.901 -22.869 293 1HE MET 40 HE1 MET 40 -19.768 13.924 -24.340 294 2HE MET 40 HE2 MET 40 -19.074 13.229 -25.806 295 3HE MET 40 HE3 MET 40 -18.115 13.310 -24.326 296 H GLN 41 HN GLN 41 -17.178 9.619 -21.639 297 HA GLN 41 HA GLN 41 -16.231 7.102 -20.652 298 1HB GLN 41 HB2 GLN 41 -14.845 9.762 -20.339 299 2HB GLN 41 HB1 GLN 41 -14.118 8.163 -20.416 300 1HG GLN 41 HG2 GLN 41 -15.685 9.063 -22.761 301 2HG GLN 41 HG1 GLN 41 -14.122 9.827 -22.476 302 1HE2 GLN 41 HE21 GLN 41 -14.984 8.063 -24.636 303 2HE2 GLN 41 HE22 GLN 41 -13.897 6.721 -24.619 304 H GLN 42 HN GLN 42 -14.568 8.048 -18.525 305 HA GLN 42 HA GLN 42 -16.591 8.574 -16.447 306 1HB GLN 42 HB1 GLN 42 -14.362 6.584 -16.555 307 2HB GLN 42 HB2 GLN 42 -14.817 7.260 -14.996 308 1HG GLN 42 HG1 GLN 42 -17.211 6.570 -15.639 309 2HG GLN 42 HG2 GLN 42 -16.429 5.556 -16.851 310 1HE2 GLN 42 HE21 GLN 42 -17.071 3.643 -15.915 311 2HE2 GLN 42 HE22 GLN 42 -16.423 3.067 -14.421 312 HA PRO 43 HA PRO 43 -13.423 11.948 -16.222 313 1HB PRO 43 HB1 PRO 43 -15.196 13.916 -15.632 314 2HB PRO 43 HB2 PRO 43 -14.833 13.417 -17.288 315 1HG PRO 43 HG1 PRO 43 -17.147 12.660 -15.542 316 2HG PRO 43 HG2 PRO 43 -17.139 13.101 -17.260 317 1HD PRO 43 HD1 PRO 43 -17.266 10.532 -16.414 318 2HD PRO 43 HD2 PRO 43 -16.461 11.001 -17.925 319 H ALA 44 HN ALA 44 -12.702 10.816 -14.305 320 HA ALA 44 HA ALA 44 -14.105 11.304 -11.815 321 1HB ALA 44 HB1 ALA 44 -12.009 10.086 -10.899 322 2HB ALA 44 HB2 ALA 44 -11.694 9.717 -12.594 323 3HB ALA 44 HB3 ALA 44 -13.194 9.178 -11.839 324 H VAL 45 HN VAL 45 -13.350 13.690 -13.002 325 HA VAL 45 HA VAL 45 -10.920 14.599 -11.685 326 HB VAL 45 HB VAL 45 -11.429 16.772 -12.803 327 1HG1 VAL 45 HG21 VAL 45 -10.019 14.937 -13.799 328 2HG1 VAL 45 HG22 VAL 45 -10.708 16.079 -14.953 329 3HG1 VAL 45 HG23 VAL 45 -11.430 14.482 -14.753 330 1HG2 VAL 45 HG11 VAL 45 -13.150 16.724 -14.608 331 2HG2 VAL 45 HG12 VAL 45 -13.811 16.670 -12.975 332 3HG2 VAL 45 HG13 VAL 45 -13.730 15.198 -13.942 333 H HIS 46 HN HIS 46 -13.913 14.050 -10.626 334 HA HIS 46 HA HIS 46 -14.209 16.540 -9.116 335 1HB HIS 46 HB1 HIS 46 -16.112 14.214 -8.986 336 2HB HIS 46 HB2 HIS 46 -16.435 15.921 -8.699 337 HD2 HIS 46 HD2 HIS 46 -16.932 13.369 -11.384 338 HE1 HIS 46 HE1 HIS 46 -16.974 17.137 -13.313 339 HE2 HIS 46 HE2 HIS 46 -17.483 14.664 -13.564 340 H VAL 47 HN VAL 47 -12.251 14.182 -8.687 341 HA VAL 47 HA VAL 47 -12.993 13.404 -5.970 342 HB VAL 47 HB VAL 47 -12.155 11.671 -7.526 343 1HG1 VAL 47 HG11 VAL 47 -9.356 12.520 -7.268 344 2HG1 VAL 47 HG12 VAL 47 -10.344 13.519 -8.335 345 3HG1 VAL 47 HG13 VAL 47 -10.202 11.786 -8.630 346 1HG2 VAL 47 HG21 VAL 47 -9.989 11.468 -5.674 347 2HG2 VAL 47 HG22 VAL 47 -11.515 10.585 -5.701 348 3HG2 VAL 47 HG23 VAL 47 -11.402 12.126 -4.850 349 H GLN 48 HN GLN 48 -11.768 13.878 -4.160 350 HA GLN 48 HA GLN 48 -10.210 16.307 -4.333 351 1HB GLN 48 HB2 GLN 48 -10.615 14.699 -1.826 352 2HB GLN 48 HB1 GLN 48 -10.386 16.434 -1.994 353 1HG GLN 48 HG1 GLN 48 -12.607 16.606 -3.032 354 2HG GLN 48 HG2 GLN 48 -12.835 14.874 -2.786 355 1HE2 GLN 48 HE21 GLN 48 -13.799 17.681 -1.638 356 2HE2 GLN 48 HE22 GLN 48 -13.983 17.316 0.041 357 H GLY 49 HN GLY 49 -8.087 16.532 -3.377 358 1HA GLY 49 HA2 GLY 49 -6.357 14.353 -4.143 359 2HA GLY 49 HA1 GLY 49 -5.854 15.930 -3.553 360 H GLN 50 HN GLN 50 -6.344 12.650 -2.783 361 HA GLN 50 HA GLN 50 -5.982 13.183 0.086 362 1HB GLN 50 HB1 GLN 50 -6.499 10.600 0.144 363 2HB GLN 50 HB2 GLN 50 -7.799 11.775 0.008 364 1HG GLN 50 HG1 GLN 50 -8.207 11.274 -2.199 365 2HG GLN 50 HG2 GLN 50 -6.583 10.640 -2.465 366 1HE2 GLN 50 HE22 GLN 50 -9.799 9.929 -1.544 367 2HE2 GLN 50 HE21 GLN 50 -9.596 8.231 -1.301 368 H GLU 51 HN GLU 51 -3.781 13.530 0.143 369 HA GLU 51 HA GLU 51 -1.973 11.590 -1.026 370 1HB GLU 51 HB2 GLU 51 -1.581 14.158 0.497 371 2HB GLU 51 HB1 GLU 51 -0.232 13.097 0.114 372 1HG GLU 51 HG1 GLU 51 -0.926 13.278 -2.300 373 2HG GLU 51 HG2 GLU 51 -2.034 14.554 -1.796 374 HA PRO 52 HA PRO 52 -2.003 9.349 2.871 375 1HB PRO 52 HB1 PRO 52 -0.892 7.089 1.971 376 2HB PRO 52 HB2 PRO 52 -2.553 7.527 1.550 377 1HG PRO 52 HG1 PRO 52 -0.050 7.797 -0.069 378 2HG PRO 52 HG2 PRO 52 -1.661 7.263 -0.581 379 1HD PRO 52 HD2 PRO 52 -0.671 9.806 -0.959 380 2HD PRO 52 HD1 PRO 52 -2.397 9.403 -0.890 381 H LEU 53 HN LEU 53 -0.360 8.298 4.236 382 HA LEU 53 HA LEU 53 2.184 9.708 4.046 383 1HB LEU 53 HB2 LEU 53 0.535 9.133 6.156 384 2HB LEU 53 HB1 LEU 53 1.749 7.876 6.301 385 HG LEU 53 HG LEU 53 3.141 10.307 5.892 386 1HD1 LEU 53 HD21 LEU 53 2.006 11.046 8.324 387 2HD1 LEU 53 HD22 LEU 53 0.637 10.705 7.264 388 3HD1 LEU 53 HD23 LEU 53 1.855 11.886 6.780 389 1HD2 LEU 53 HD11 LEU 53 3.789 8.247 7.184 390 2HD2 LEU 53 HD12 LEU 53 2.744 8.826 8.482 391 3HD2 LEU 53 HD13 LEU 53 4.140 9.782 7.979 392 H THR 54 HN THR 54 4.207 8.650 4.165 393 HA THR 54 HA THR 54 4.480 5.836 4.185 394 HB THR 54 HB THR 54 5.547 6.323 1.628 395 HG1 THR 54 HG1 THR 54 3.552 6.915 0.543 396 1HG2 THR 54 HG21 THR 54 3.305 4.709 2.709 397 2HG2 THR 54 HG22 THR 54 4.781 4.194 1.891 398 3HG2 THR 54 HG23 THR 54 3.455 4.896 0.962 399 H ALA 55 HN ALA 55 6.845 5.508 2.831 400 HA ALA 55 HA ALA 55 8.725 6.384 4.623 401 1HB ALA 55 HB1 ALA 55 8.995 4.558 2.958 402 2HB ALA 55 HB2 ALA 55 10.398 5.617 3.113 403 3HB ALA 55 HB3 ALA 55 9.311 5.790 1.734 404 H SER 56 HN SER 56 7.844 7.897 1.529 405 HA SER 56 HA SER 56 9.804 9.887 1.491 406 1HB SER 56 HB1 SER 56 7.112 10.636 0.494 407 2HB SER 56 HB2 SER 56 8.680 10.733 -0.307 408 HG SER 56 HG SER 56 7.017 9.071 -1.002 409 H MET 57 HN MET 57 6.486 10.027 2.764 410 HA MET 57 HA MET 57 6.568 12.642 3.750 411 1HB MET 57 HB1 MET 57 5.012 10.194 4.562 412 2HB MET 57 HB2 MET 57 4.815 11.720 5.406 413 1HG MET 57 HG1 MET 57 3.338 10.924 3.291 414 2HG MET 57 HG2 MET 57 3.572 12.603 3.774 415 1HE MET 57 HE1 MET 57 4.449 10.658 -0.073 416 2HE MET 57 HE2 MET 57 3.739 9.982 1.394 417 3HE MET 57 HE3 MET 57 5.482 9.890 1.133 418 H LEU 58 HN LEU 58 7.565 9.587 5.151 419 HA LEU 58 HA LEU 58 8.091 10.478 7.766 420 1HB LEU 58 HB1 LEU 58 9.376 8.239 6.202 421 2HB LEU 58 HB2 LEU 58 9.453 8.434 7.943 422 HG LEU 58 HG LEU 58 6.818 8.158 6.534 423 1HD1 LEU 58 HD21 LEU 58 8.840 6.227 6.438 424 2HD1 LEU 58 HD22 LEU 58 7.127 6.011 6.070 425 3HD1 LEU 58 HD23 LEU 58 7.725 5.692 7.698 426 1HD2 LEU 58 HD11 LEU 58 5.940 7.936 8.586 427 2HD2 LEU 58 HD12 LEU 58 7.418 8.752 9.101 428 3HD2 LEU 58 HD13 LEU 58 7.306 6.993 9.184 429 H ALA 59 HN ALA 59 10.120 10.241 4.886 430 HA ALA 59 HA ALA 59 12.553 10.985 6.098 431 1HB ALA 59 HB1 ALA 59 11.593 10.461 3.435 432 2HB ALA 59 HB2 ALA 59 13.221 10.302 4.093 433 3HB ALA 59 HB3 ALA 59 12.678 11.851 3.448 434 H SER 60 HN SER 60 9.770 12.784 5.376 435 HA SER 60 HA SER 60 11.012 15.322 4.929 436 1HB SER 60 HB2 SER 60 8.183 14.620 5.750 437 2HB SER 60 HB1 SER 60 8.722 16.230 5.274 438 HG SER 60 HG SER 60 9.307 14.170 3.513 439 H ALA 61 HN ALA 61 10.756 13.408 7.635 440 HA ALA 61 HA ALA 61 11.203 15.723 9.393 441 1HB ALA 61 HB1 ALA 61 8.880 14.703 9.605 442 2HB ALA 61 HB2 ALA 61 9.816 14.870 11.089 443 3HB ALA 61 HB3 ALA 61 9.680 13.296 10.306 444 HA PRO 62 HA PRO 62 14.552 12.355 9.483 445 1HB PRO 62 HB2 PRO 62 16.232 14.804 9.435 446 2HB PRO 62 HB1 PRO 62 16.437 13.275 8.575 447 1HG PRO 62 HG1 PRO 62 15.571 15.457 7.305 448 2HG PRO 62 HG2 PRO 62 14.924 13.852 6.916 449 1HD PRO 62 HD1 PRO 62 13.696 16.060 8.513 450 2HD PRO 62 HD2 PRO 62 12.929 14.915 7.395 451 HA PRO 63 HA PRO 63 15.855 14.222 13.590 452 1HB PRO 63 HB2 PRO 63 16.001 16.845 14.028 453 2HB PRO 63 HB1 PRO 63 17.136 16.053 12.930 454 1HG PRO 63 HG2 PRO 63 14.825 17.808 12.318 455 2HG PRO 63 HG1 PRO 63 16.320 17.556 11.402 456 1HD PRO 63 HD2 PRO 63 13.764 16.336 10.968 457 2HD PRO 63 HD1 PRO 63 15.273 16.048 10.081 458 H GLN 64 HN GLN 64 12.895 14.259 12.666 459 HA GLN 64 HA GLN 64 11.839 15.332 15.192 460 1HB GLN 64 HB1 GLN 64 11.355 16.716 13.077 461 2HB GLN 64 HB2 GLN 64 10.267 15.411 12.629 462 1HG GLN 64 HG1 GLN 64 8.687 16.379 13.829 463 2HG GLN 64 HG2 GLN 64 9.637 16.056 15.279 464 1HE2 GLN 64 HE21 GLN 64 9.467 18.367 12.592 465 2HE2 GLN 64 HE22 GLN 64 9.807 19.766 13.548 466 H GLU 65 HN GLU 65 9.804 13.901 12.744 467 HA GLU 65 HA GLU 65 9.310 11.665 14.582 468 1HB GLU 65 HB1 GLU 65 7.401 12.168 12.384 469 2HB GLU 65 HB2 GLU 65 7.099 11.780 14.071 470 1HG GLU 65 HG2 GLU 65 8.247 14.404 13.831 471 2HG GLU 65 HG1 GLU 65 6.816 14.252 12.813 472 H GLN 66 HN GLN 66 11.517 11.529 12.770 473 HA GLN 66 HA GLN 66 10.871 10.061 10.439 474 1HB GLN 66 HB1 GLN 66 13.203 11.082 11.620 475 2HB GLN 66 HB2 GLN 66 13.458 9.347 11.500 476 1HG GLN 66 HG1 GLN 66 12.543 9.735 9.058 477 2HG GLN 66 HG2 GLN 66 13.121 11.370 9.365 478 1HE2 GLN 66 HE21 GLN 66 14.792 11.303 7.916 479 2HE2 GLN 66 HE22 GLN 66 16.187 10.304 8.122 480 H LYS 67 HN LYS 67 11.124 9.212 13.754 481 HA LYS 67 HA LYS 67 10.661 6.390 13.055 482 1HB LYS 67 HB1 LYS 67 12.122 7.096 15.573 483 2HB LYS 67 HB2 LYS 67 12.146 5.597 14.657 484 1HG LYS 67 HG2 LYS 67 14.139 6.293 13.941 485 2HG LYS 67 HG1 LYS 67 13.220 7.355 12.873 486 1HD LYS 67 HD1 LYS 67 13.715 9.213 14.069 487 2HD LYS 67 HD2 LYS 67 13.696 8.353 15.611 488 1HE LYS 67 HE1 LYS 67 15.882 7.510 15.273 489 2HE LYS 67 HE2 LYS 67 15.886 8.004 13.580 490 1HZ LYS 67 HZ1 LYS 67 15.555 10.061 15.645 491 2HZ LYS 67 HZ2 LYS 67 16.272 10.175 14.117 492 3HZ LYS 67 HZ3 LYS 67 17.098 9.420 15.384 493 H GLN 68 HN GLN 68 8.832 8.612 13.726 494 HA GLN 68 HA GLN 68 7.542 7.345 16.047 495 1HB GLN 68 HB2 GLN 68 8.624 9.494 16.668 496 2HB GLN 68 HB1 GLN 68 7.621 10.312 15.478 497 1HG GLN 68 HG2 GLN 68 6.028 10.553 16.987 498 2HG GLN 68 HG1 GLN 68 5.909 8.802 17.149 499 1HE2 GLN 68 HE22 GLN 68 8.469 11.087 18.027 500 2HE2 GLN 68 HE21 GLN 68 8.515 10.662 19.700 501 H MET 69 HN MET 69 6.918 9.687 13.416 502 HA MET 69 HA MET 69 4.113 9.182 13.431 503 1HB MET 69 HB2 MET 69 3.976 10.759 11.656 504 2HB MET 69 HB1 MET 69 5.225 11.335 12.750 505 1HG MET 69 HG2 MET 69 6.829 11.170 11.207 506 2HG MET 69 HG1 MET 69 6.221 9.631 10.596 507 1HE MET 69 HE1 MET 69 6.650 13.408 9.575 508 2HE MET 69 HE2 MET 69 6.549 12.786 7.928 509 3HE MET 69 HE3 MET 69 7.567 11.973 9.116 510 H LEU 70 HN LEU 70 6.102 6.946 12.744 511 HA LEU 70 HA LEU 70 5.238 6.204 10.062 512 1HB LEU 70 HB1 LEU 70 6.622 4.051 11.181 513 2HB LEU 70 HB2 LEU 70 7.248 5.236 10.053 514 HG LEU 70 HG LEU 70 7.314 5.651 13.032 515 1HD1 LEU 70 HD11 LEU 70 8.546 3.571 12.222 516 2HD1 LEU 70 HD12 LEU 70 9.466 4.753 13.154 517 3HD1 LEU 70 HD13 LEU 70 9.636 4.687 11.400 518 1HD2 LEU 70 HD21 LEU 70 8.377 7.042 10.634 519 2HD2 LEU 70 HD22 LEU 70 9.321 7.083 12.121 520 3HD2 LEU 70 HD23 LEU 70 7.668 7.700 12.109 521 H GLY 71 HN GLY 71 4.680 5.384 13.399 522 1HA GLY 71 HA2 GLY 71 2.499 3.628 12.519 523 2HA GLY 71 HA1 GLY 71 3.599 3.084 13.770 524 H GLU 72 HN GLU 72 3.078 6.427 13.885 525 HA GLU 72 HA GLU 72 0.915 6.083 15.858 526 1HB GLU 72 HB2 GLU 72 2.070 7.121 17.508 527 2HB GLU 72 HB1 GLU 72 3.456 6.559 16.587 528 1HG GLU 72 HG2 GLU 72 4.161 8.648 16.509 529 2HG GLU 72 HG1 GLU 72 2.799 9.011 15.451 530 H ARG 73 HN ARG 73 1.909 7.638 13.071 531 HA ARG 73 HA ARG 73 -0.150 9.707 13.462 532 1HB ARG 73 HB1 ARG 73 2.414 10.386 13.340 533 2HB ARG 73 HB2 ARG 73 2.125 10.240 11.612 534 1HG ARG 73 HG1 ARG 73 0.127 11.802 13.102 535 2HG ARG 73 HG2 ARG 73 1.747 12.499 13.024 536 1HD ARG 73 HD2 ARG 73 1.728 12.485 10.647 537 2HD ARG 73 HD1 ARG 73 0.263 11.504 10.602 538 HE ARG 73 HE ARG 73 -0.794 13.546 11.713 539 1HH1 ARG 73 HH12 ARG 73 1.843 13.700 9.441 540 2HH1 ARG 73 HH11 ARG 73 1.429 15.282 8.870 541 1HH2 ARG 73 HH22 ARG 73 -1.347 15.628 10.967 542 2HH2 ARG 73 HH21 ARG 73 -0.385 16.378 9.738 543 H LEU 74 HN LEU 74 1.031 7.125 11.617 544 HA LEU 74 HA LEU 74 -0.139 7.876 9.110 545 1HB LEU 74 HB1 LEU 74 1.435 5.690 10.161 546 2HB LEU 74 HB2 LEU 74 0.126 5.101 9.157 547 HG LEU 74 HG LEU 74 1.657 7.343 8.041 548 1HD1 LEU 74 HD11 LEU 74 3.658 6.312 7.727 549 2HD1 LEU 74 HD12 LEU 74 2.966 4.693 7.833 550 3HD1 LEU 74 HD13 LEU 74 3.226 5.638 9.300 551 1HD2 LEU 74 HD21 LEU 74 0.569 4.724 7.043 552 2HD2 LEU 74 HD22 LEU 74 1.515 5.824 6.040 553 3HD2 LEU 74 HD23 LEU 74 -0.031 6.349 6.709 554 H PHE 75 HN PHE 75 -1.415 6.761 12.014 555 HA PHE 75 HA PHE 75 -3.324 4.918 11.348 556 1HB PHE 75 HB1 PHE 75 -3.026 5.524 13.643 557 2HB PHE 75 HB2 PHE 75 -3.511 7.187 13.330 558 HD1 PHE 75 HD1 PHE 75 -5.119 4.035 12.191 559 HD2 PHE 75 HD2 PHE 75 -5.387 7.499 14.656 560 HE1 PHE 75 HE1 PHE 75 -7.455 3.469 12.739 561 HE2 PHE 75 HE2 PHE 75 -7.718 6.937 15.205 562 HZ PHE 75 HZ PHE 75 -8.754 4.920 14.246 563 HA PRO 76 HA PRO 76 -6.514 8.408 10.165 564 1HB PRO 76 HB2 PRO 76 -4.719 10.642 9.436 565 2HB PRO 76 HB1 PRO 76 -6.235 10.666 10.343 566 1HG PRO 76 HG2 PRO 76 -3.890 11.038 11.569 567 2HG PRO 76 HG1 PRO 76 -5.199 10.125 12.344 568 1HD PRO 76 HD1 PRO 76 -2.739 9.112 10.967 569 2HD PRO 76 HD2 PRO 76 -3.502 8.547 12.468 570 H LEU 77 HN LEU 77 -3.554 7.575 8.728 571 HA LEU 77 HA LEU 77 -4.473 8.234 6.031 572 1HB LEU 77 HB1 LEU 77 -1.813 7.311 7.101 573 2HB LEU 77 HB2 LEU 77 -2.154 7.438 5.391 574 HG LEU 77 HG LEU 77 -1.041 9.418 5.852 575 1HD1 LEU 77 HD21 LEU 77 -2.732 11.227 5.798 576 2HD1 LEU 77 HD22 LEU 77 -3.979 10.028 6.138 577 3HD1 LEU 77 HD23 LEU 77 -3.053 9.936 4.640 578 1HD2 LEU 77 HD11 LEU 77 -1.469 8.913 8.413 579 2HD2 LEU 77 HD12 LEU 77 -2.668 10.188 8.200 580 3HD2 LEU 77 HD13 LEU 77 -0.970 10.505 7.838 581 H ILE 78 HN ILE 78 -3.933 5.498 8.136 582 HA ILE 78 HA ILE 78 -3.905 3.527 6.084 583 HB ILE 78 HB ILE 78 -4.811 2.955 8.877 584 1HG1 ILE 78 HG12 ILE 78 -2.765 4.361 8.987 585 2HG1 ILE 78 HG11 ILE 78 -2.492 2.722 9.568 586 1HG2 ILE 78 HG21 ILE 78 -4.947 0.978 7.789 587 2HG2 ILE 78 HG22 ILE 78 -3.228 0.922 8.177 588 3HG2 ILE 78 HG23 ILE 78 -3.755 1.440 6.575 589 1HD1 ILE 78 HD11 ILE 78 -1.867 3.457 6.741 590 2HD1 ILE 78 HD12 ILE 78 -1.220 2.144 7.725 591 3HD1 ILE 78 HD13 ILE 78 -0.737 3.811 8.047 592 H GLN 79 HN GLN 79 -6.441 4.903 8.113 593 HA GLN 79 HA GLN 79 -8.561 3.220 7.481 594 1HB GLN 79 HB1 GLN 79 -8.265 6.048 8.329 595 2HB GLN 79 HB2 GLN 79 -9.803 5.623 7.597 596 1HG GLN 79 HG1 GLN 79 -10.371 4.185 9.303 597 2HG GLN 79 HG2 GLN 79 -8.694 3.923 9.781 598 1HE2 GLN 79 HE21 GLN 79 -7.813 6.521 10.005 599 2HE2 GLN 79 HE22 GLN 79 -8.635 7.295 11.313 600 H ALA 80 HN ALA 80 -6.808 5.372 5.536 601 HA ALA 80 HA ALA 80 -8.809 5.785 3.505 602 1HB ALA 80 HB1 ALA 80 -5.870 6.242 3.132 603 2HB ALA 80 HB2 ALA 80 -6.851 7.339 4.108 604 3HB ALA 80 HB3 ALA 80 -7.231 7.099 2.403 605 H MET 81 HN MET 81 -6.007 3.694 4.006 606 HA MET 81 HA MET 81 -6.090 2.549 1.372 607 1HB MET 81 HB1 MET 81 -4.852 1.109 3.684 608 2HB MET 81 HB2 MET 81 -4.300 1.227 2.020 609 1HG MET 81 HG2 MET 81 -3.132 3.104 2.399 610 2HG MET 81 HG1 MET 81 -4.311 3.748 3.535 611 1HE MET 81 HE1 MET 81 -0.334 2.541 4.374 612 2HE MET 81 HE2 MET 81 -1.160 2.651 2.819 613 3HE MET 81 HE3 MET 81 -0.974 1.082 3.609 614 H HIS 82 HN HIS 82 -7.051 1.489 4.601 615 HA HIS 82 HA HIS 82 -8.708 -0.617 3.385 616 1HB HIS 82 HB1 HIS 82 -7.157 -0.424 5.930 617 2HB HIS 82 HB2 HIS 82 -8.628 -1.386 5.933 618 HD2 HIS 82 HD2 HIS 82 -5.742 -1.264 3.234 619 HE1 HIS 82 HE1 HIS 82 -6.380 -5.243 4.519 620 HE2 HIS 82 HE2 HIS 82 -5.068 -3.750 2.943 621 HA PRO 83 HA PRO 83 -12.397 1.492 4.640 622 1HB PRO 83 HB2 PRO 83 -13.408 -1.168 5.486 623 2HB PRO 83 HB1 PRO 83 -14.103 -0.008 4.348 624 1HG PRO 83 HG1 PRO 83 -12.933 -2.242 3.479 625 2HG PRO 83 HG2 PRO 83 -12.749 -0.712 2.602 626 1HD PRO 83 HD2 PRO 83 -10.819 -2.103 4.414 627 2HD PRO 83 HD1 PRO 83 -10.512 -1.218 2.907 628 H THR 84 HN THR 84 -11.086 2.369 6.465 629 HA THR 84 HA THR 84 -10.659 2.785 8.657 630 HB THR 84 HB THR 84 -13.346 1.677 9.371 631 HG1 THR 84 HG1 THR 84 -13.779 4.060 8.415 632 1HG2 THR 84 HG21 THR 84 -13.583 3.647 10.672 633 2HG2 THR 84 HG22 THR 84 -12.149 4.370 9.943 634 3HG2 THR 84 HG23 THR 84 -11.988 2.970 11.004 635 H LEU 85 HN LEU 85 -9.760 0.235 7.789 636 HA LEU 85 HA LEU 85 -10.374 -1.604 9.963 637 1HB LEU 85 HB1 LEU 85 -9.170 -1.807 7.283 638 2HB LEU 85 HB2 LEU 85 -8.462 -2.859 8.492 639 HG LEU 85 HG LEU 85 -11.392 -2.914 8.461 640 1HD1 LEU 85 HD11 LEU 85 -9.942 -4.101 6.108 641 2HD1 LEU 85 HD12 LEU 85 -10.816 -2.571 6.038 642 3HD1 LEU 85 HD13 LEU 85 -11.679 -4.064 6.407 643 1HD2 LEU 85 HD21 LEU 85 -9.153 -4.915 8.479 644 2HD2 LEU 85 HD22 LEU 85 -10.845 -5.392 8.351 645 3HD2 LEU 85 HD23 LEU 85 -10.282 -4.515 9.773 646 H ALA 86 HN ALA 86 -8.463 0.963 9.761 647 HA ALA 86 HA ALA 86 -5.922 -0.006 10.615 648 1HB ALA 86 HB1 ALA 86 -5.555 2.388 11.272 649 2HB ALA 86 HB2 ALA 86 -7.211 2.712 10.759 650 3HB ALA 86 HB3 ALA 86 -6.025 2.135 9.590 651 H GLY 87 HN GLY 87 -5.997 2.164 12.842 652 1HA GLY 87 HA1 GLY 87 -6.521 2.286 15.106 653 2HA GLY 87 HA2 GLY 87 -7.568 0.886 14.911 654 H LYS 88 HN LYS 88 -4.982 -0.185 13.458 655 HA LYS 88 HA LYS 88 -3.202 -0.681 15.653 656 1HB LYS 88 HB1 LYS 88 -4.837 -2.293 16.292 657 2HB LYS 88 HB2 LYS 88 -5.028 -2.856 14.641 658 1HG LYS 88 HG2 LYS 88 -3.786 -4.514 15.745 659 2HG LYS 88 HG1 LYS 88 -2.618 -3.622 14.766 660 1HD LYS 88 HD1 LYS 88 -2.721 -2.293 17.233 661 2HD LYS 88 HD2 LYS 88 -2.686 -4.017 17.614 662 1HE LYS 88 HE1 LYS 88 -0.767 -4.128 15.892 663 2HE LYS 88 HE2 LYS 88 -0.683 -2.380 16.099 664 1HZ LYS 88 HZ1 LYS 88 -0.525 -4.299 18.355 665 2HZ LYS 88 HZ2 LYS 88 -0.209 -2.638 18.396 666 3HZ LYS 88 HZ3 LYS 88 0.832 -3.677 17.561 667 H ILE 89 HN ILE 89 -4.111 -1.047 12.309 668 HA ILE 89 HA ILE 89 -2.178 -2.656 11.290 669 HB ILE 89 HB ILE 89 -3.178 -0.115 10.021 670 1HG1 ILE 89 HG11 ILE 89 -4.168 -2.946 9.633 671 2HG1 ILE 89 HG12 ILE 89 -4.895 -1.830 10.786 672 1HG2 ILE 89 HG21 ILE 89 -2.623 -2.114 8.117 673 2HG2 ILE 89 HG22 ILE 89 -1.226 -2.035 9.193 674 3HG2 ILE 89 HG23 ILE 89 -1.781 -0.582 8.357 675 1HD1 ILE 89 HD11 ILE 89 -4.711 -1.403 7.815 676 2HD1 ILE 89 HD12 ILE 89 -5.473 -0.317 8.978 677 3HD1 ILE 89 HD13 ILE 89 -6.144 -1.924 8.701 678 H THR 90 HN THR 90 -1.744 0.826 10.769 679 HA THR 90 HA THR 90 1.038 0.692 10.463 680 HB THR 90 HB THR 90 -0.986 2.674 10.432 681 HG1 THR 90 HG1 THR 90 1.613 3.375 9.795 682 1HG2 THR 90 HG21 THR 90 0.699 4.544 11.236 683 2HG2 THR 90 HG22 THR 90 1.129 3.284 12.393 684 3HG2 THR 90 HG23 THR 90 -0.537 3.857 12.294 685 H GLY 91 HN GLY 91 -0.934 1.197 13.356 686 1HA GLY 91 HA2 GLY 91 1.123 1.907 15.143 687 2HA GLY 91 HA1 GLY 91 -0.369 1.086 15.586 688 H MET 92 HN MET 92 0.196 -1.085 13.692 689 HA MET 92 HA MET 92 1.761 -2.778 15.432 690 1HB MET 92 HB1 MET 92 -0.300 -3.328 13.795 691 2HB MET 92 HB2 MET 92 1.022 -3.652 12.685 692 1HG MET 92 HG1 MET 92 1.747 -5.464 13.827 693 2HG MET 92 HG2 MET 92 1.186 -4.859 15.383 694 1HE MET 92 HE1 MET 92 -1.702 -5.219 12.292 695 2HE MET 92 HE2 MET 92 -1.105 -6.864 12.062 696 3HE MET 92 HE3 MET 92 0.007 -5.499 11.948 697 H LEU 93 HN LEU 93 2.085 -1.127 12.401 698 HA LEU 93 HA LEU 93 4.358 -2.350 11.392 699 1HB LEU 93 HB2 LEU 93 2.999 0.237 11.028 700 2HB LEU 93 HB1 LEU 93 4.618 0.091 10.383 701 HG LEU 93 HG LEU 93 2.892 -0.395 8.689 702 1HD1 LEU 93 HD11 LEU 93 3.773 -2.970 8.472 703 2HD1 LEU 93 HD12 LEU 93 5.004 -2.247 9.508 704 3HD1 LEU 93 HD13 LEU 93 4.656 -1.544 7.927 705 1HD2 LEU 93 HD21 LEU 93 1.805 -1.990 10.835 706 2HD2 LEU 93 HD22 LEU 93 2.027 -2.954 9.372 707 3HD2 LEU 93 HD23 LEU 93 1.060 -1.480 9.318 708 H LEU 94 HN LEU 94 4.128 -0.710 14.242 709 HA LEU 94 HA LEU 94 6.963 0.079 14.164 710 1HB LEU 94 HB1 LEU 94 4.601 1.308 15.368 711 2HB LEU 94 HB2 LEU 94 5.921 1.113 16.504 712 HG LEU 94 HG LEU 94 7.394 2.424 15.101 713 1HD1 LEU 94 HD11 LEU 94 5.081 2.528 13.167 714 2HD1 LEU 94 HD12 LEU 94 6.638 1.739 12.915 715 3HD1 LEU 94 HD13 LEU 94 6.550 3.497 13.039 716 1HD2 LEU 94 HD21 LEU 94 4.829 3.462 16.056 717 2HD2 LEU 94 HD22 LEU 94 5.640 4.490 14.875 718 3HD2 LEU 94 HD23 LEU 94 6.470 4.029 16.361 719 H GLU 95 HN GLU 95 5.721 -2.560 14.480 720 HA GLU 95 HA GLU 95 7.283 -3.523 16.652 721 1HB GLU 95 HB2 GLU 95 5.609 -4.253 18.159 722 2HB GLU 95 HB1 GLU 95 5.229 -2.573 17.805 723 1HG GLU 95 HG1 GLU 95 3.426 -3.167 16.410 724 2HG GLU 95 HG2 GLU 95 3.933 -4.854 16.349 725 H ILE 96 HN ILE 96 5.796 -3.888 13.752 726 HA ILE 96 HA ILE 96 4.968 -6.570 13.708 727 HB ILE 96 HB ILE 96 5.279 -6.544 11.304 728 1HG1 ILE 96 HG12 ILE 96 7.430 -5.442 11.159 729 2HG1 ILE 96 HG11 ILE 96 6.254 -4.609 10.151 730 1HG2 ILE 96 HG21 ILE 96 4.211 -4.022 11.073 731 2HG2 ILE 96 HG22 ILE 96 3.822 -4.490 12.731 732 3HG2 ILE 96 HG23 ILE 96 3.322 -5.514 11.385 733 1HD1 ILE 96 HD11 ILE 96 5.980 -2.950 11.982 734 2HD1 ILE 96 HD12 ILE 96 7.574 -2.975 11.227 735 3HD1 ILE 96 HD13 ILE 96 7.331 -3.730 12.803 736 H ASP 97 HN ASP 97 6.503 -7.509 11.464 737 HA ASP 97 HA ASP 97 8.431 -9.099 12.712 738 1HB ASP 97 HB1 ASP 97 7.160 -9.281 10.407 739 2HB ASP 97 HB2 ASP 97 8.586 -8.452 9.788 740 H ASN 98 HN ASN 98 8.578 -5.867 12.164 741 HA ASN 98 HA ASN 98 10.235 -4.355 12.482 742 1HB ASN 98 HB2 ASN 98 12.005 -5.036 13.645 743 2HB ASN 98 HB1 ASN 98 11.472 -6.694 13.402 744 1HD2 ASN 98 HD21 ASN 98 12.722 -8.018 12.250 745 2HD2 ASN 98 HD22 ASN 98 14.127 -7.541 11.365 746 H SER 99 HN SER 99 10.703 -6.853 10.102 747 HA SER 99 HA SER 99 12.417 -5.382 8.383 748 1HB SER 99 HB1 SER 99 10.475 -7.480 7.428 749 2HB SER 99 HB2 SER 99 12.065 -7.072 6.780 750 HG SER 99 HG SER 99 12.989 -7.947 8.660 751 H GLU 100 HN GLU 100 9.017 -5.407 8.966 752 HA GLU 100 HA GLU 100 8.358 -3.884 6.588 753 1HB GLU 100 HB1 GLU 100 6.456 -4.126 8.855 754 2HB GLU 100 HB2 GLU 100 6.164 -4.209 7.126 755 1HG GLU 100 HG1 GLU 100 7.663 -6.428 7.497 756 2HG GLU 100 HG2 GLU 100 6.797 -6.336 9.031 757 H LEU 101 HN LEU 101 9.248 -3.377 9.873 758 HA LEU 101 HA LEU 101 8.367 -0.644 10.020 759 1HB LEU 101 HB1 LEU 101 8.555 -1.645 12.119 760 2HB LEU 101 HB2 LEU 101 10.069 -2.430 11.719 761 HG LEU 101 HG LEU 101 10.925 0.089 11.624 762 1HD1 LEU 101 HD11 LEU 101 9.498 1.596 12.395 763 2HD1 LEU 101 HD12 LEU 101 9.451 0.749 13.941 764 3HD1 LEU 101 HD13 LEU 101 8.293 0.339 12.676 765 1HD2 LEU 101 HD21 LEU 101 10.493 -1.362 14.228 766 2HD2 LEU 101 HD22 LEU 101 11.758 -0.191 13.855 767 3HD2 LEU 101 HD23 LEU 101 11.749 -1.764 13.057 768 H LEU 102 HN LEU 102 11.095 -2.389 8.864 769 HA LEU 102 HA LEU 102 12.802 -0.042 8.710 770 1HB LEU 102 HB2 LEU 102 13.120 -2.957 8.379 771 2HB LEU 102 HB1 LEU 102 14.112 -1.973 7.318 772 HG LEU 102 HG LEU 102 15.006 -0.794 9.330 773 1HD1 LEU 102 HD21 LEU 102 13.100 -1.259 10.819 774 2HD1 LEU 102 HD22 LEU 102 14.642 -1.739 11.527 775 3HD1 LEU 102 HD23 LEU 102 13.563 -2.960 10.853 776 1HD2 LEU 102 HD11 LEU 102 16.623 -2.387 9.741 777 2HD2 LEU 102 HD12 LEU 102 15.965 -2.929 8.197 778 3HD2 LEU 102 HD13 LEU 102 15.472 -3.722 9.693 779 H HIS 103 HN HIS 103 11.256 -2.328 6.472 780 HA HIS 103 HA HIS 103 12.174 -1.096 4.118 781 1HB HIS 103 HB1 HIS 103 10.775 -3.391 4.776 782 2HB HIS 103 HB2 HIS 103 9.595 -2.449 3.879 783 HD2 HIS 103 HD2 HIS 103 11.937 -1.226 1.753 784 HE1 HIS 103 HE1 HIS 103 12.176 -5.323 0.717 785 HE2 HIS 103 HE2 HIS 103 12.724 -2.957 -0.012 786 H MET 104 HN MET 104 9.281 -0.600 6.079 787 HA MET 104 HA MET 104 7.824 0.987 4.282 788 1HB MET 104 HB2 MET 104 6.549 1.708 6.178 789 2HB MET 104 HB1 MET 104 6.973 0.019 6.441 790 1HG MET 104 HG2 MET 104 8.941 0.901 7.767 791 2HG MET 104 HG1 MET 104 8.137 2.466 7.724 792 1HE MET 104 HE1 MET 104 4.709 1.620 9.337 793 2HE MET 104 HE2 MET 104 4.918 0.476 8.007 794 3HE MET 104 HE3 MET 104 5.411 2.158 7.809 795 H LEU 105 HN LEU 105 10.373 1.799 6.575 796 HA LEU 105 HA LEU 105 10.104 4.637 6.142 797 1HB LEU 105 HB1 LEU 105 12.370 3.171 7.488 798 2HB LEU 105 HB2 LEU 105 11.960 4.867 7.653 799 HG LEU 105 HG LEU 105 10.240 2.579 8.611 800 1HD1 LEU 105 HD11 LEU 105 11.129 4.147 10.752 801 2HD1 LEU 105 HD12 LEU 105 12.554 3.823 9.765 802 3HD1 LEU 105 HD13 LEU 105 11.581 2.484 10.374 803 1HD2 LEU 105 HD21 LEU 105 9.243 4.587 9.921 804 2HD2 LEU 105 HD22 LEU 105 8.761 4.309 8.248 805 3HD2 LEU 105 HD23 LEU 105 9.954 5.550 8.628 806 H GLU 106 HN GLU 106 11.570 2.089 4.507 807 HA GLU 106 HA GLU 106 13.549 3.892 3.313 808 1HB GLU 106 HB1 GLU 106 14.992 2.152 3.144 809 2HB GLU 106 HB2 GLU 106 13.977 1.451 4.397 810 1HG GLU 106 HG2 GLU 106 12.684 0.287 2.640 811 2HG GLU 106 HG1 GLU 106 13.815 0.913 1.442 812 H SER 107 HN SER 107 10.551 2.525 2.678 813 HA SER 107 HA SER 107 10.881 3.144 -0.170 814 1HB SER 107 HB2 SER 107 10.988 0.577 0.499 815 2HB SER 107 HB1 SER 107 9.233 0.751 0.500 816 HG SER 107 HG SER 107 11.051 1.027 -1.623 817 HA PRO 108 HA PRO 108 7.111 5.366 0.700 818 1HB PRO 108 HB2 PRO 108 6.959 5.712 -2.215 819 2HB PRO 108 HB1 PRO 108 7.123 6.931 -0.948 820 1HG PRO 108 HG1 PRO 108 9.149 6.336 -2.609 821 2HG PRO 108 HG2 PRO 108 9.426 6.777 -0.913 822 1HD PRO 108 HD2 PRO 108 9.413 4.064 -2.190 823 2HD PRO 108 HD1 PRO 108 10.524 4.731 -0.974 824 H GLU 109 HN GLU 109 7.392 2.403 -0.593 825 HA GLU 109 HA GLU 109 4.496 2.163 -1.079 826 1HB GLU 109 HB1 GLU 109 5.130 1.709 -3.212 827 2HB GLU 109 HB2 GLU 109 6.784 1.342 -2.754 828 1HG GLU 109 HG2 GLU 109 6.174 -0.881 -2.109 829 2HG GLU 109 HG1 GLU 109 4.464 -0.529 -2.357 830 H SER 110 HN SER 110 7.407 0.890 0.334 831 HA SER 110 HA SER 110 6.432 -1.642 1.056 832 1HB SER 110 HB1 SER 110 8.751 -0.014 1.697 833 2HB SER 110 HB2 SER 110 8.163 -0.902 3.107 834 HG SER 110 HG SER 110 8.740 -2.043 0.569 835 H LEU 111 HN LEU 111 6.465 1.438 2.783 836 HA LEU 111 HA LEU 111 5.299 0.677 5.148 837 1HB LEU 111 HB1 LEU 111 6.101 2.958 4.539 838 2HB LEU 111 HB2 LEU 111 4.633 3.177 3.603 839 HG LEU 111 HG LEU 111 4.161 2.349 6.371 840 1HD1 LEU 111 HD11 LEU 111 4.681 5.123 6.514 841 2HD1 LEU 111 HD12 LEU 111 6.131 4.327 5.894 842 3HD1 LEU 111 HD13 LEU 111 5.419 3.809 7.430 843 1HD2 LEU 111 HD21 LEU 111 2.439 4.006 6.246 844 2HD2 LEU 111 HD22 LEU 111 2.435 3.081 4.740 845 3HD2 LEU 111 HD23 LEU 111 3.145 4.696 4.782 846 H ARG 112 HN ARG 112 3.915 0.787 2.008 847 HA ARG 112 HA ARG 112 1.188 0.594 3.012 848 1HB ARG 112 HB1 ARG 112 2.407 0.881 0.277 849 2HB ARG 112 HB2 ARG 112 0.704 0.465 0.494 850 1HG ARG 112 HG2 ARG 112 0.197 2.487 1.460 851 2HG ARG 112 HG1 ARG 112 1.874 2.787 1.927 852 1HD ARG 112 HD2 ARG 112 1.424 4.268 0.134 853 2HD ARG 112 HD1 ARG 112 2.395 2.962 -0.542 854 HE ARG 112 HE ARG 112 0.206 2.024 -1.336 855 1HH1 ARG 112 HH21 ARG 112 0.641 5.436 -0.776 856 2HH1 ARG 112 HH22 ARG 112 -0.579 5.908 -1.911 857 1HH2 ARG 112 HH12 ARG 112 -1.401 2.638 -2.831 858 2HH2 ARG 112 HH11 ARG 112 -1.739 4.318 -3.079 859 H SER 113 HN SER 113 3.136 -1.247 0.664 860 HA SER 113 HA SER 113 1.562 -3.518 0.546 861 1HB SER 113 HB2 SER 113 3.640 -2.974 -0.837 862 2HB SER 113 HB1 SER 113 4.583 -3.609 0.513 863 HG SER 113 HG SER 113 3.979 -5.113 -1.256 864 H LYS 114 HN LYS 114 3.694 -2.399 3.020 865 HA LYS 114 HA LYS 114 3.731 -4.913 4.468 866 1HB LYS 114 HB1 LYS 114 4.753 -2.170 5.218 867 2HB LYS 114 HB2 LYS 114 4.914 -3.601 6.227 868 1HG LYS 114 HG1 LYS 114 6.094 -3.219 3.485 869 2HG LYS 114 HG2 LYS 114 6.968 -3.154 5.017 870 1HD LYS 114 HD2 LYS 114 7.336 -5.339 4.818 871 2HD LYS 114 HD1 LYS 114 5.604 -5.594 5.042 872 1HE LYS 114 HE1 LYS 114 6.143 -4.793 2.338 873 2HE LYS 114 HE2 LYS 114 7.150 -6.174 2.770 874 1HZ LYS 114 HZ1 LYS 114 4.741 -6.869 3.761 875 2HZ LYS 114 HZ2 LYS 114 5.347 -7.363 2.262 876 3HZ LYS 114 HZ3 LYS 114 4.304 -6.035 2.356 877 H VAL 115 HN VAL 115 2.214 -1.709 4.716 878 HA VAL 115 HA VAL 115 0.885 -2.229 7.170 879 HB VAL 115 HB VAL 115 0.728 -0.122 5.114 880 1HG1 VAL 115 HG11 VAL 115 -1.510 -0.013 4.996 881 2HG1 VAL 115 HG12 VAL 115 -1.456 0.522 6.677 882 3HG1 VAL 115 HG13 VAL 115 -1.713 -1.180 6.306 883 1HG2 VAL 115 HG21 VAL 115 0.137 0.604 7.847 884 2HG2 VAL 115 HG22 VAL 115 1.476 1.098 6.811 885 3HG2 VAL 115 HG23 VAL 115 1.584 -0.398 7.737 886 H ASP 116 HN ASP 116 -0.423 -2.213 3.839 887 HA ASP 116 HA ASP 116 -2.909 -3.276 4.351 888 1HB ASP 116 HB1 ASP 116 -2.653 -2.614 2.150 889 2HB ASP 116 HB2 ASP 116 -1.073 -3.374 1.994 890 H GLU 117 HN GLU 117 0.142 -5.015 3.875 891 HA GLU 117 HA GLU 117 -1.024 -7.614 4.060 892 1HB GLU 117 HB1 GLU 117 1.728 -6.493 4.005 893 2HB GLU 117 HB2 GLU 117 1.536 -8.085 4.725 894 1HG GLU 117 HG2 GLU 117 0.154 -8.493 2.492 895 2HG GLU 117 HG1 GLU 117 1.228 -7.220 1.914 896 H ALA 118 HN ALA 118 0.253 -5.298 6.342 897 HA ALA 118 HA ALA 118 0.407 -7.077 8.558 898 1HB ALA 118 HB1 ALA 118 1.472 -4.718 8.246 899 2HB ALA 118 HB2 ALA 118 0.972 -5.267 9.847 900 3HB ALA 118 HB3 ALA 118 -0.053 -4.159 8.934 901 H VAL 119 HN VAL 119 -2.132 -5.366 6.983 902 HA VAL 119 HA VAL 119 -4.031 -5.297 9.080 903 HB VAL 119 HB VAL 119 -4.628 -5.613 6.150 904 1HG1 VAL 119 HG11 VAL 119 -6.544 -5.950 7.556 905 2HG1 VAL 119 HG12 VAL 119 -6.679 -4.366 6.790 906 3HG1 VAL 119 HG13 VAL 119 -6.179 -4.489 8.476 907 1HG2 VAL 119 HG21 VAL 119 -4.867 -2.928 6.889 908 2HG2 VAL 119 HG22 VAL 119 -3.667 -3.645 5.814 909 3HG2 VAL 119 HG23 VAL 119 -3.316 -3.470 7.533 910 H ALA 120 HN ALA 120 -3.297 -7.590 6.519 911 HA ALA 120 HA ALA 120 -5.258 -9.503 7.096 912 1HB ALA 120 HB1 ALA 120 -3.147 -9.211 5.293 913 2HB ALA 120 HB2 ALA 120 -4.316 -10.534 5.349 914 3HB ALA 120 HB3 ALA 120 -2.776 -10.683 6.197 915 H VAL 121 HN VAL 121 -2.276 -8.667 8.591 916 HA VAL 121 HA VAL 121 -2.100 -11.067 10.200 917 HB VAL 121 HB VAL 121 -0.445 -8.581 9.906 918 1HG1 VAL 121 HG21 VAL 121 0.852 -10.335 11.703 919 2HG1 VAL 121 HG22 VAL 121 -0.756 -10.001 12.342 920 3HG1 VAL 121 HG23 VAL 121 0.337 -8.668 11.967 921 1HG2 VAL 121 HG11 VAL 121 1.084 -9.920 8.895 922 2HG2 VAL 121 HG12 VAL 121 -0.366 -10.857 8.535 923 3HG2 VAL 121 HG13 VAL 121 0.673 -11.324 9.883 924 H LEU 122 HN LEU 122 -3.167 -7.748 10.481 925 HA LEU 122 HA LEU 122 -3.383 -7.710 13.320 926 1HB LEU 122 HB2 LEU 122 -3.683 -5.541 12.926 927 2HB LEU 122 HB1 LEU 122 -3.703 -5.867 11.204 928 HG LEU 122 HG LEU 122 -6.285 -6.482 11.975 929 1HD1 LEU 122 HD11 LEU 122 -5.240 -4.203 13.626 930 2HD1 LEU 122 HD12 LEU 122 -6.121 -5.632 14.166 931 3HD1 LEU 122 HD13 LEU 122 -6.949 -4.388 13.231 932 1HD2 LEU 122 HD21 LEU 122 -5.269 -5.080 10.051 933 2HD2 LEU 122 HD22 LEU 122 -5.546 -3.715 11.132 934 3HD2 LEU 122 HD23 LEU 122 -6.900 -4.720 10.617 935 H GLN 123 HN GLN 123 -5.534 -8.509 10.665 936 HA GLN 123 HA GLN 123 -7.839 -8.917 12.321 937 1HB GLN 123 HB1 GLN 123 -7.186 -9.685 9.474 938 2HB GLN 123 HB2 GLN 123 -8.722 -10.072 10.237 939 1HG GLN 123 HG1 GLN 123 -7.623 -7.290 9.901 940 2HG GLN 123 HG2 GLN 123 -8.798 -8.050 8.827 941 1HE2 GLN 123 HE22 GLN 123 -10.887 -7.898 9.311 942 2HE2 GLN 123 HE21 GLN 123 -11.527 -7.282 10.792 943 H ALA 124 HN ALA 124 -5.119 -10.776 11.274 944 HA ALA 124 HA ALA 124 -6.237 -13.343 12.041 945 1HB ALA 124 HB1 ALA 124 -3.697 -13.945 11.684 946 2HB ALA 124 HB2 ALA 124 -3.676 -12.385 10.863 947 3HB ALA 124 HB3 ALA 124 -4.767 -13.656 10.314 948 H HIS 125 HN HIS 125 -5.097 -10.759 13.736 949 HA HIS 125 HA HIS 125 -4.206 -12.514 15.920 950 1HB HIS 125 HB1 HIS 125 -2.580 -10.719 14.758 951 2HB HIS 125 HB2 HIS 125 -3.365 -9.656 15.920 952 HD2 HIS 125 HD2 HIS 125 -2.849 -13.161 17.327 953 HE1 HIS 125 HE1 HIS 125 0.343 -10.744 18.699 954 HE2 HIS 125 HE2 HIS 125 -0.835 -12.976 18.952 955 H GLN 126 HN GLN 126 -6.244 -9.928 14.903 956 HA GLN 126 HA GLN 126 -7.090 -9.241 17.593 957 1HB GLN 126 HB1 GLN 126 -7.647 -8.234 14.851 958 2HB GLN 126 HB2 GLN 126 -8.914 -8.016 16.052 959 1HG GLN 126 HG2 GLN 126 -6.072 -7.050 16.286 960 2HG GLN 126 HG1 GLN 126 -7.479 -6.060 15.902 961 1HE2 GLN 126 HE22 GLN 126 -5.583 -5.880 18.125 962 2HE2 GLN 126 HE21 GLN 126 -6.534 -5.970 19.565 963 H ALA 127 HN ALA 127 -8.249 -11.030 14.803 964 HA ALA 127 HA ALA 127 -10.664 -11.831 16.243 965 1HB ALA 127 HB1 ALA 127 -10.495 -11.108 13.722 966 2HB ALA 127 HB2 ALA 127 -11.598 -12.387 14.228 967 3HB ALA 127 HB3 ALA 127 -10.048 -12.800 13.496 968 H LYS 128 HN LYS 128 -8.147 -13.470 14.297 969 HA LYS 128 HA LYS 128 -8.585 -15.880 15.893 970 1HB LYS 128 HB1 LYS 128 -6.957 -16.849 14.084 971 2HB LYS 128 HB2 LYS 128 -8.648 -16.626 13.703 972 1HG LYS 128 HG1 LYS 128 -6.548 -14.593 13.034 973 2HG LYS 128 HG2 LYS 128 -6.991 -15.911 11.950 974 1HD LYS 128 HD2 LYS 128 -8.783 -13.709 12.962 975 2HD LYS 128 HD1 LYS 128 -8.186 -13.918 11.314 976 1HE LYS 128 HE1 LYS 128 -10.164 -14.924 10.966 977 2HE LYS 128 HE2 LYS 128 -9.381 -16.311 11.721 978 1HZ LYS 128 HZ1 LYS 128 -11.140 -16.223 13.084 979 2HZ LYS 128 HZ2 LYS 128 -11.489 -14.605 12.730 980 3HZ LYS 128 HZ3 LYS 128 -10.288 -14.983 13.858 981 H GLU 129 HN GLU 129 -6.587 -17.184 16.117 982 HA GLU 129 HA GLU 129 -4.475 -15.572 17.348 983 1HB GLU 129 HB2 GLU 129 -5.757 -17.853 18.269 984 2HB GLU 129 HB1 GLU 129 -4.249 -18.477 17.615 985 1HG GLU 129 HG2 GLU 129 -3.219 -17.874 19.470 986 2HG GLU 129 HG1 GLU 129 -3.596 -16.187 19.118 987 H ALA 130 HN ALA 130 -5.087 -16.097 14.471 988 HA ALA 130 HA ALA 130 -3.446 -17.969 13.321 989 1HB ALA 130 HB1 ALA 130 -3.453 -15.903 11.487 990 2HB ALA 130 HB2 ALA 130 -4.925 -15.657 12.426 991 3HB ALA 130 HB3 ALA 130 -4.640 -17.200 11.622 992 H ALA 131 HN ALA 131 -2.667 -14.678 14.324 993 HA ALA 131 HA ALA 131 -0.019 -14.751 13.195 994 1HB ALA 131 HB1 ALA 131 -1.534 -12.691 13.620 995 2HB ALA 131 HB2 ALA 131 0.207 -12.556 13.880 996 3HB ALA 131 HB3 ALA 131 -0.877 -12.764 15.256 997 H GLN 132 HN GLN 132 1.273 -16.275 14.075 998 HA GLN 132 HA GLN 132 1.360 -16.624 16.966 999 1HB GLN 132 HB2 GLN 132 2.641 -18.101 14.667 1000 2HB GLN 132 HB1 GLN 132 3.039 -18.440 16.345 1001 1HG GLN 132 HG1 GLN 132 0.284 -18.520 16.309 1002 2HG GLN 132 HG2 GLN 132 0.744 -19.254 14.773 1003 1HE2 GLN 132 HE21 GLN 132 -0.448 -20.429 17.189 1004 2HE2 GLN 132 HE22 GLN 132 0.612 -21.712 17.656 1005 H LYS 133 HN LYS 133 3.532 -16.791 18.014 1006 HA LYS 133 HA LYS 133 4.989 -14.379 17.565 1007 1HB LYS 133 HB1 LYS 133 6.488 -15.304 19.385 1008 2HB LYS 133 HB2 LYS 133 4.796 -15.098 19.819 1009 1HG LYS 133 HG1 LYS 133 4.567 -17.253 20.287 1010 2HG LYS 133 HG2 LYS 133 5.295 -17.736 18.753 1011 1HD LYS 133 HD2 LYS 133 7.388 -17.925 19.643 1012 2HD LYS 133 HD1 LYS 133 7.095 -16.692 20.872 1013 1HE LYS 133 HE1 LYS 133 5.695 -19.343 20.954 1014 2HE LYS 133 HE2 LYS 133 7.310 -19.138 21.629 1015 1HZ LYS 133 HZ1 LYS 133 5.028 -17.415 22.400 1016 2HZ LYS 133 HZ2 LYS 133 6.520 -17.575 23.180 1017 3HZ LYS 133 HZ3 LYS 133 5.406 -18.847 23.218 1018 H ALA 134 HN ALA 134 5.138 -17.413 16.154 1019 HA ALA 134 HA ALA 134 7.972 -17.568 15.730 1020 1HB ALA 134 HB1 ALA 134 5.997 -19.393 15.608 1021 2HB ALA 134 HB2 ALA 134 7.567 -19.596 14.833 1022 3HB ALA 134 HB3 ALA 134 6.188 -19.025 13.894 1023 H VAL 135 HN VAL 135 9.141 -16.571 14.223 1024 HA VAL 135 HA VAL 135 7.757 -15.006 12.180 1025 HB VAL 135 HB VAL 135 10.002 -13.986 11.776 1026 1HG1 VAL 135 HG21 VAL 135 8.662 -13.865 14.449 1027 2HG1 VAL 135 HG22 VAL 135 8.634 -12.694 13.130 1028 3HG1 VAL 135 HG23 VAL 135 10.086 -12.881 14.113 1029 1HG2 VAL 135 HG11 VAL 135 10.859 -15.415 14.281 1030 2HG2 VAL 135 HG12 VAL 135 11.839 -14.418 13.206 1031 3HG2 VAL 135 HG13 VAL 135 11.255 -15.992 12.663 1032 H ASN 136 HN ASN 136 8.435 -18.034 12.221 1033 HA ASN 136 HA ASN 136 10.181 -18.347 9.953 1034 1HB ASN 136 HB2 ASN 136 10.029 -20.033 11.785 1035 2HB ASN 136 HB1 ASN 136 8.386 -20.399 11.267 1036 1HD2 ASN 136 HD22 ASN 136 8.650 -22.452 10.603 1037 2HD2 ASN 136 HD21 ASN 136 9.689 -22.932 9.308 1038 H SER 137 HN SER 137 6.705 -18.506 10.563 1039 HA SER 137 HA SER 137 6.054 -19.304 7.891 1040 1HB SER 137 HB1 SER 137 4.702 -19.361 10.263 1041 2HB SER 137 HB2 SER 137 3.946 -17.979 9.469 1042 HG SER 137 HG SER 137 2.904 -19.955 8.954 1043 H ALA 138 HN ALA 138 7.099 -16.425 9.189 1044 HA ALA 138 HA ALA 138 5.492 -14.634 7.606 1045 1HB ALA 138 HB1 ALA 138 6.227 -13.173 9.101 1046 2HB ALA 138 HB2 ALA 138 7.864 -13.351 8.472 1047 3HB ALA 138 HB3 ALA 138 7.306 -14.393 9.780 1048 H THR 139 HN THR 139 5.943 -15.808 5.567 1049 HA THR 139 HA THR 139 8.507 -14.966 4.384 1050 HB THR 139 HB THR 139 7.999 -16.839 2.703 1051 HG1 THR 139 HG1 THR 139 6.467 -18.252 3.189 1052 1HG2 THR 139 HG21 THR 139 8.505 -17.706 5.536 1053 2HG2 THR 139 HG22 THR 139 9.726 -17.065 4.437 1054 3HG2 THR 139 HG23 THR 139 8.918 -18.587 4.066 1055 H GLY 140 HN GLY 140 8.063 -15.192 1.759 1056 1HA GLY 140 HA2 GLY 140 6.223 -12.996 1.268 1057 2HA GLY 140 HA1 GLY 140 7.369 -13.674 0.122 1058 H VAL 141 HN VAL 141 6.826 -15.940 -0.634 1059 HA VAL 141 HA VAL 141 3.999 -15.975 -1.372 1060 HB VAL 141 HB VAL 141 4.736 -17.778 -2.983 1061 1HG1 VAL 141 HG11 VAL 141 5.753 -16.192 -4.548 1062 2HG1 VAL 141 HG12 VAL 141 6.043 -15.070 -3.219 1063 3HG1 VAL 141 HG13 VAL 141 4.391 -15.474 -3.688 1064 1HG2 VAL 141 HG21 VAL 141 7.394 -17.305 -3.333 1065 2HG2 VAL 141 HG22 VAL 141 6.722 -18.697 -2.483 1066 3HG2 VAL 141 HG23 VAL 141 7.258 -17.284 -1.575 1067 HA PRO 142 HA PRO 142 2.952 -19.314 1.326 1068 1HB PRO 142 HB1 PRO 142 1.061 -20.588 -0.180 1069 2HB PRO 142 HB2 PRO 142 0.761 -19.089 0.706 1070 1HG PRO 142 HG2 PRO 142 1.395 -19.485 -2.194 1071 2HG PRO 142 HG1 PRO 142 0.201 -18.408 -1.446 1072 1HD PRO 142 HD2 PRO 142 2.578 -17.501 -2.326 1073 2HD PRO 142 HD1 PRO 142 1.795 -16.827 -0.882 1074 H THR 143 HN THR 143 3.659 -21.341 1.736 1075 HA THR 143 HA THR 143 4.977 -22.766 -0.470 1076 HB THR 143 HB THR 143 6.620 -22.462 1.123 1077 HG1 THR 143 HG1 THR 143 5.922 -24.817 0.810 1078 1HG2 THR 143 HG21 THR 143 6.291 -22.731 3.559 1079 2HG2 THR 143 HG22 THR 143 4.558 -22.883 3.266 1080 3HG2 THR 143 HG23 THR 143 5.395 -21.384 2.859 1081 H VAL 144 HN VAL 144 3.346 -23.652 2.584 1082 HA VAL 144 HA VAL 144 2.479 -26.157 1.403 1083 HB VAL 144 HB VAL 144 1.734 -25.178 4.147 1084 1HG1 VAL 144 HG21 VAL 144 1.645 -27.725 2.670 1085 2HG1 VAL 144 HG22 VAL 144 0.608 -27.123 3.964 1086 3HG1 VAL 144 HG23 VAL 144 2.177 -27.830 4.348 1087 1HG2 VAL 144 HG11 VAL 144 4.357 -25.443 3.246 1088 2HG2 VAL 144 HG12 VAL 144 4.024 -26.932 4.130 1089 3HG2 VAL 144 HG13 VAL 144 3.810 -25.370 4.920 Start of MODEL 3 1 1H GLY 1 HT1 GLY 1 -41.814 70.072 48.523 2 2H GLY 1 HT2 GLY 1 -42.113 70.225 50.181 3 3H GLY 1 HT3 GLY 1 -41.829 71.604 49.242 4 1HA GLY 1 HA2 GLY 1 -43.899 71.633 48.343 5 2HA GLY 1 HA1 GLY 1 -44.056 69.887 48.454 6 HA PRO 2 HA PRO 2 -46.712 70.551 51.926 7 1HB PRO 2 HB2 PRO 2 -46.474 68.154 53.186 8 2HB PRO 2 HB1 PRO 2 -47.405 68.375 51.700 9 1HG PRO 2 HG1 PRO 2 -44.628 67.313 52.059 10 2HG PRO 2 HG2 PRO 2 -45.928 66.713 51.013 11 1HD PRO 2 HD2 PRO 2 -43.892 68.224 50.073 12 2HD PRO 2 HD1 PRO 2 -45.528 68.305 49.391 13 H LEU 3 HN LEU 3 -46.704 70.244 54.387 14 HA LEU 3 HA LEU 3 -44.286 71.443 55.397 15 1HB LEU 3 HB2 LEU 3 -46.752 70.609 56.922 16 2HB LEU 3 HB1 LEU 3 -45.505 71.713 57.469 17 HG LEU 3 HG LEU 3 -46.405 72.852 55.101 18 1HD1 LEU 3 HD11 LEU 3 -48.440 71.118 56.094 19 2HD1 LEU 3 HD12 LEU 3 -48.484 72.203 54.703 20 3HD1 LEU 3 HD13 LEU 3 -48.956 72.793 56.298 21 1HD2 LEU 3 HD21 LEU 3 -45.860 74.249 56.872 22 2HD2 LEU 3 HD22 LEU 3 -46.891 73.377 58.008 23 3HD2 LEU 3 HD23 LEU 3 -47.614 74.404 56.768 24 H GLY 4 HN GLY 4 -45.339 68.299 54.961 25 1HA GLY 4 HA2 GLY 4 -43.855 67.267 57.276 26 2HA GLY 4 HA1 GLY 4 -44.943 66.339 56.255 27 H SER 5 HN SER 5 -41.869 66.489 57.101 28 HA SER 5 HA SER 5 -40.704 66.186 54.441 29 1HB SER 5 HB2 SER 5 -39.728 67.229 56.828 30 2HB SER 5 HB1 SER 5 -38.911 65.673 56.683 31 HG SER 5 HG SER 5 -38.426 67.941 55.360 32 H ALA 6 HN ALA 6 -38.997 64.351 54.321 33 HA ALA 6 HA ALA 6 -40.425 61.881 54.664 34 1HB ALA 6 HB1 ALA 6 -38.118 61.007 53.735 35 2HB ALA 6 HB2 ALA 6 -37.899 62.712 53.336 36 3HB ALA 6 HB3 ALA 6 -39.280 61.825 52.690 37 H ALA 7 HN ALA 7 -38.674 63.668 56.770 38 HA ALA 7 HA ALA 7 -37.579 61.312 58.159 39 1HB ALA 7 HB1 ALA 7 -36.767 64.017 59.030 40 2HB ALA 7 HB2 ALA 7 -36.187 63.482 57.452 41 3HB ALA 7 HB3 ALA 7 -35.822 62.534 58.893 42 H ALA 8 HN ALA 8 -40.368 62.514 58.152 43 HA ALA 8 HA ALA 8 -40.674 62.535 61.065 44 1HB ALA 8 HB1 ALA 8 -42.457 64.424 59.720 45 2HB ALA 8 HB2 ALA 8 -40.753 64.882 59.682 46 3HB ALA 8 HB3 ALA 8 -41.554 64.588 61.226 47 H ALA 9 HN ALA 9 -41.971 61.988 57.882 48 HA ALA 9 HA ALA 9 -44.061 60.304 59.068 49 1HB ALA 9 HB1 ALA 9 -45.793 61.337 58.073 50 2HB ALA 9 HB2 ALA 9 -44.871 61.704 56.614 51 3HB ALA 9 HB3 ALA 9 -44.704 62.724 58.043 52 H THR 10 HN THR 10 -42.898 58.456 58.529 53 HA THR 10 HA THR 10 -42.326 58.010 55.688 54 HB THR 10 HB THR 10 -41.543 56.073 57.829 55 HG1 THR 10 HG1 THR 10 -40.655 57.759 58.786 56 1HG2 THR 10 HG21 THR 10 -41.048 56.122 55.164 57 2HG2 THR 10 HG22 THR 10 -40.061 55.290 56.363 58 3HG2 THR 10 HG23 THR 10 -39.603 56.900 55.810 59 HA PRO 11 HA PRO 11 -46.063 55.531 55.669 60 1HB PRO 11 HB1 PRO 11 -46.059 54.951 53.037 61 2HB PRO 11 HB2 PRO 11 -46.510 56.547 53.648 62 1HG PRO 11 HG2 PRO 11 -43.906 55.627 52.486 63 2HG PRO 11 HG1 PRO 11 -44.795 57.132 52.182 64 1HD PRO 11 HD2 PRO 11 -42.671 56.976 53.878 65 2HD PRO 11 HD1 PRO 11 -44.000 58.132 54.094 66 H ALA 12 HN ALA 12 -42.937 54.543 55.527 67 HA ALA 12 HA ALA 12 -43.361 51.857 54.548 68 1HB ALA 12 HB1 ALA 12 -40.901 51.993 55.902 69 2HB ALA 12 HB2 ALA 12 -41.107 53.537 55.075 70 3HB ALA 12 HB3 ALA 12 -41.185 52.031 54.162 71 H VAL 13 HN VAL 13 -45.164 51.670 56.234 72 HA VAL 13 HA VAL 13 -44.363 51.227 58.958 73 HB VAL 13 HB VAL 13 -46.959 50.351 57.704 74 1HG1 VAL 13 HG21 VAL 13 -46.585 49.481 59.920 75 2HG1 VAL 13 HG22 VAL 13 -47.818 50.740 59.994 76 3HG1 VAL 13 HG23 VAL 13 -46.171 51.087 60.520 77 1HG2 VAL 13 HG11 VAL 13 -46.094 52.891 57.507 78 2HG2 VAL 13 HG12 VAL 13 -46.850 52.947 59.099 79 3HG2 VAL 13 HG13 VAL 13 -47.791 52.450 57.692 80 H ARG 14 HN ARG 14 -44.878 49.272 56.107 81 HA ARG 14 HA ARG 14 -44.836 46.764 57.505 82 1HB ARG 14 HB2 ARG 14 -45.296 47.677 54.807 83 2HB ARG 14 HB1 ARG 14 -44.173 46.326 54.805 84 1HG ARG 14 HG1 ARG 14 -45.731 44.900 55.860 85 2HG ARG 14 HG2 ARG 14 -46.796 46.248 56.264 86 1HD ARG 14 HD1 ARG 14 -47.876 45.370 54.436 87 2HD ARG 14 HD2 ARG 14 -46.857 46.591 53.673 88 HE ARG 14 HE ARG 14 -45.267 44.545 53.410 89 1HH1 ARG 14 HH22 ARG 14 -48.739 44.563 53.100 90 2HH1 ARG 14 HH21 ARG 14 -48.774 43.253 51.969 91 1HH2 ARG 14 HH12 ARG 14 -45.305 42.817 51.920 92 2HH2 ARG 14 HH11 ARG 14 -46.823 42.261 51.299 93 H THR 15 HN THR 15 -43.182 45.066 56.620 94 HA THR 15 HA THR 15 -40.560 46.082 57.325 95 HB THR 15 HB THR 15 -40.863 43.252 56.509 96 HG1 THR 15 HG1 THR 15 -41.881 42.851 58.608 97 1HG2 THR 15 HG21 THR 15 -39.477 44.771 58.644 98 2HG2 THR 15 HG22 THR 15 -38.873 43.510 57.569 99 3HG2 THR 15 HG23 THR 15 -39.894 43.083 58.942 100 H VAL 16 HN VAL 16 -41.032 47.315 55.078 101 HA VAL 16 HA VAL 16 -39.740 45.743 52.951 102 HB VAL 16 HB VAL 16 -41.853 46.449 52.159 103 1HG1 VAL 16 HG21 VAL 16 -41.986 49.197 52.169 104 2HG1 VAL 16 HG22 VAL 16 -41.309 48.820 53.754 105 3HG1 VAL 16 HG23 VAL 16 -42.848 48.113 53.261 106 1HG2 VAL 16 HG11 VAL 16 -41.221 48.196 50.410 107 2HG2 VAL 16 HG12 VAL 16 -40.290 46.698 50.433 108 3HG2 VAL 16 HG13 VAL 16 -39.614 48.167 51.136 109 HA PRO 17 HA PRO 17 -36.376 48.601 54.054 110 1HB PRO 17 HB2 PRO 17 -34.415 47.155 52.866 111 2HB PRO 17 HB1 PRO 17 -35.053 46.765 54.468 112 1HG PRO 17 HG2 PRO 17 -35.712 45.541 51.814 113 2HG PRO 17 HG1 PRO 17 -35.424 44.745 53.373 114 1HD PRO 17 HD1 PRO 17 -37.912 45.183 52.392 115 2HD PRO 17 HD2 PRO 17 -37.556 45.182 54.132 116 H GLN 18 HN GLN 18 -34.433 49.339 52.539 117 HA GLN 18 HA GLN 18 -35.670 50.614 50.288 118 1HB GLN 18 HB2 GLN 18 -33.385 51.053 51.922 119 2HB GLN 18 HB1 GLN 18 -32.830 50.941 50.258 120 1HG GLN 18 HG1 GLN 18 -33.470 53.024 49.915 121 2HG GLN 18 HG2 GLN 18 -35.138 52.563 50.256 122 1HE2 GLN 18 HE21 GLN 18 -36.092 53.403 51.983 123 2HE2 GLN 18 HE22 GLN 18 -35.296 54.273 53.245 124 H TYR 19 HN TYR 19 -33.630 50.743 48.421 125 HA TYR 19 HA TYR 19 -34.087 48.395 46.923 126 1HB TYR 19 HB1 TYR 19 -32.996 50.960 46.459 127 2HB TYR 19 HB2 TYR 19 -31.760 49.800 45.983 128 HD1 TYR 19 HD1 TYR 19 -32.253 48.122 44.219 129 HD2 TYR 19 HD2 TYR 19 -34.983 51.243 45.171 130 HE1 TYR 19 HE1 TYR 19 -33.418 47.744 42.088 131 HE2 TYR 19 HE2 TYR 19 -36.156 50.874 43.042 132 HH TYR 19 HH TYR 19 -36.440 49.299 41.343 133 H LYS 20 HN LYS 20 -32.731 46.695 46.372 134 HA LYS 20 HA LYS 20 -30.600 46.169 48.311 135 1HB LYS 20 HB1 LYS 20 -32.556 44.549 47.808 136 2HB LYS 20 HB2 LYS 20 -31.677 44.177 46.332 137 1HG LYS 20 HG2 LYS 20 -29.700 43.606 47.765 138 2HG LYS 20 HG1 LYS 20 -30.764 43.760 49.165 139 1HD LYS 20 HD2 LYS 20 -32.090 42.119 47.285 140 2HD LYS 20 HD1 LYS 20 -30.427 41.538 47.402 141 1HE LYS 20 HE1 LYS 20 -30.843 40.606 49.373 142 2HE LYS 20 HE2 LYS 20 -31.420 42.142 50.018 143 1HZ LYS 20 HZ1 LYS 20 -33.597 41.639 48.974 144 2HZ LYS 20 HZ2 LYS 20 -33.162 40.548 50.193 145 3HZ LYS 20 HZ3 LYS 20 -33.015 40.104 48.566 146 H TYR 21 HN TYR 21 -28.662 46.855 47.665 147 HA TYR 21 HA TYR 21 -27.950 47.029 44.884 148 1HB TYR 21 HB2 TYR 21 -27.108 48.292 47.212 149 2HB TYR 21 HB1 TYR 21 -25.735 47.284 46.765 150 HD1 TYR 21 HD1 TYR 21 -25.356 47.373 44.030 151 HD2 TYR 21 HD2 TYR 21 -26.954 50.463 46.479 152 HE1 TYR 21 HE1 TYR 21 -24.666 49.043 42.362 153 HE2 TYR 21 HE2 TYR 21 -26.269 52.142 44.818 154 HH TYR 21 HH TYR 21 -24.541 51.203 41.859 155 H ALA 22 HN ALA 22 -28.130 44.473 46.912 156 HA ALA 22 HA ALA 22 -25.667 43.138 46.480 157 1HB ALA 22 HB1 ALA 22 -28.298 42.457 47.604 158 2HB ALA 22 HB2 ALA 22 -26.677 42.102 48.202 159 3HB ALA 22 HB3 ALA 22 -27.387 41.104 46.933 160 H ALA 23 HN ALA 23 -25.021 41.724 44.924 161 HA ALA 23 HA ALA 23 -26.497 41.772 42.432 162 1HB ALA 23 HB1 ALA 23 -23.796 41.676 43.106 163 2HB ALA 23 HB2 ALA 23 -24.495 41.587 41.489 164 3HB ALA 23 HB3 ALA 23 -24.145 40.107 42.381 165 H GLY 24 HN GLY 24 -25.792 39.534 45.012 166 1HA GLY 24 HA1 GLY 24 -26.976 37.325 43.478 167 2HA GLY 24 HA2 GLY 24 -26.051 37.160 44.961 168 H VAL 25 HN VAL 25 -29.162 37.962 43.585 169 HA VAL 25 HA VAL 25 -30.373 38.120 46.242 170 HB VAL 25 HB VAL 25 -31.015 39.818 44.579 171 1HG1 VAL 25 HG11 VAL 25 -31.532 39.325 42.475 172 2HG1 VAL 25 HG12 VAL 25 -32.782 38.194 42.990 173 3HG1 VAL 25 HG13 VAL 25 -31.114 37.648 42.824 174 1HG2 VAL 25 HG21 VAL 25 -33.585 38.513 44.753 175 2HG2 VAL 25 HG22 VAL 25 -32.996 39.956 45.578 176 3HG2 VAL 25 HG23 VAL 25 -32.683 38.361 46.262 177 H ARG 26 HN ARG 26 -30.152 36.035 43.464 178 HA ARG 26 HA ARG 26 -32.274 34.285 44.407 179 1HB ARG 26 HB1 ARG 26 -31.373 34.879 41.906 180 2HB ARG 26 HB2 ARG 26 -30.537 33.363 42.210 181 1HG ARG 26 HG2 ARG 26 -32.814 32.429 42.865 182 2HG ARG 26 HG1 ARG 26 -33.488 33.882 42.122 183 1HD ARG 26 HD1 ARG 26 -31.934 33.182 40.120 184 2HD ARG 26 HD2 ARG 26 -32.060 31.589 40.865 185 HE ARG 26 HE ARG 26 -34.608 32.838 40.515 186 1HH1 ARG 26 HH11 ARG 26 -32.114 31.011 38.902 187 2HH1 ARG 26 HH12 ARG 26 -33.191 30.340 37.723 188 1HH2 ARG 26 HH22 ARG 26 -36.030 31.957 38.964 189 2HH2 ARG 26 HH21 ARG 26 -35.415 30.877 37.759 190 H ASN 27 HN ASN 27 -31.729 33.137 46.163 191 HA ASN 27 HA ASN 27 -29.053 32.062 46.459 192 1HB ASN 27 HB2 ASN 27 -31.289 31.435 48.352 193 2HB ASN 27 HB1 ASN 27 -29.574 31.658 48.686 194 1HD2 ASN 27 HD21 ASN 27 -32.353 32.933 49.422 195 2HD2 ASN 27 HD22 ASN 27 -31.975 34.619 49.457 196 HA PRO 28 HA PRO 28 -31.598 27.921 46.284 197 1HB PRO 28 HB2 PRO 28 -34.004 28.048 45.008 198 2HB PRO 28 HB1 PRO 28 -33.821 28.190 46.760 199 1HG PRO 28 HG2 PRO 28 -34.139 30.345 44.705 200 2HG PRO 28 HG1 PRO 28 -34.903 30.197 46.298 201 1HD PRO 28 HD2 PRO 28 -32.794 31.816 45.873 202 2HD PRO 28 HD1 PRO 28 -33.026 30.959 47.411 203 H GLN 29 HN GLN 29 -30.093 27.299 44.796 204 HA GLN 29 HA GLN 29 -30.497 28.022 41.988 205 1HB GLN 29 HB1 GLN 29 -28.218 27.911 43.489 206 2HB GLN 29 HB2 GLN 29 -28.184 26.341 42.699 207 1HG GLN 29 HG1 GLN 29 -27.272 27.340 40.950 208 2HG GLN 29 HG2 GLN 29 -28.827 28.123 40.671 209 1HE2 GLN 29 HE21 GLN 29 -28.007 30.010 39.874 210 2HE2 GLN 29 HE22 GLN 29 -27.117 31.141 40.829 211 H GLN 30 HN GLN 30 -29.566 26.037 40.547 212 HA GLN 30 HA GLN 30 -31.579 23.999 40.816 213 1HB GLN 30 HB2 GLN 30 -29.317 24.037 38.820 214 2HB GLN 30 HB1 GLN 30 -30.875 23.236 38.672 215 1HG GLN 30 HG2 GLN 30 -31.852 25.056 37.851 216 2HG GLN 30 HG1 GLN 30 -31.127 26.100 39.073 217 1HE2 GLN 30 HE22 GLN 30 -31.486 26.791 36.368 218 2HE2 GLN 30 HE21 GLN 30 -29.926 27.016 35.662 219 H HIS 31 HN HIS 31 -28.215 24.338 41.557 220 HA HIS 31 HA HIS 31 -26.678 22.962 42.510 221 1HB HIS 31 HB1 HIS 31 -29.281 21.900 43.522 222 2HB HIS 31 HB2 HIS 31 -27.816 20.976 43.842 223 HD2 HIS 31 HD2 HIS 31 -29.560 24.258 44.927 224 HE1 HIS 31 HE1 HIS 31 -26.037 23.758 47.220 225 HE2 HIS 31 HE2 HIS 31 -28.159 25.117 46.936 226 H LEU 32 HN LEU 32 -27.656 22.407 39.773 227 HA LEU 32 HA LEU 32 -27.331 19.511 39.566 228 1HB LEU 32 HB2 LEU 32 -29.128 20.729 38.305 229 2HB LEU 32 HB1 LEU 32 -27.867 21.508 37.369 230 HG LEU 32 HG LEU 32 -27.192 18.915 37.000 231 1HD1 LEU 32 HD21 LEU 32 -30.193 18.976 37.273 232 2HD1 LEU 32 HD22 LEU 32 -29.065 18.040 38.253 233 3HD1 LEU 32 HD23 LEU 32 -29.265 17.666 36.541 234 1HD2 LEU 32 HD11 LEU 32 -29.130 20.615 35.447 235 2HD2 LEU 32 HD12 LEU 32 -28.449 19.105 34.841 236 3HD2 LEU 32 HD13 LEU 32 -27.389 20.466 35.209 237 H ASN 33 HN ASN 33 -25.391 18.667 39.262 238 HA ASN 33 HA ASN 33 -23.269 20.359 38.137 239 1HB ASN 33 HB2 ASN 33 -23.122 17.861 39.839 240 2HB ASN 33 HB1 ASN 33 -21.718 18.671 39.150 241 1HD2 ASN 33 HD22 ASN 33 -22.359 21.301 39.513 242 2HD2 ASN 33 HD21 ASN 33 -22.432 21.655 41.202 243 H ALA 34 HN ALA 34 -24.020 19.993 35.966 244 HA ALA 34 HA ALA 34 -23.853 17.283 34.921 245 1HB ALA 34 HB1 ALA 34 -24.262 18.830 32.737 246 2HB ALA 34 HB2 ALA 34 -24.967 19.839 34.000 247 3HB ALA 34 HB3 ALA 34 -25.548 18.191 33.761 248 H GLN 35 HN GLN 35 -22.752 17.232 32.613 249 HA GLN 35 HA GLN 35 -19.977 18.006 33.081 250 1HB GLN 35 HB2 GLN 35 -19.520 16.500 31.125 251 2HB GLN 35 HB1 GLN 35 -20.267 15.704 32.504 252 1HG GLN 35 HG1 GLN 35 -22.464 15.925 31.358 253 2HG GLN 35 HG2 GLN 35 -21.608 16.546 29.946 254 1HE2 GLN 35 HE22 GLN 35 -23.168 13.991 30.743 255 2HE2 GLN 35 HE21 GLN 35 -22.183 12.725 30.098 256 HA PRO 36 HA PRO 36 -20.434 21.358 30.171 257 1HB PRO 36 HB2 PRO 36 -17.891 22.230 30.199 258 2HB PRO 36 HB1 PRO 36 -18.975 22.473 31.574 259 1HG PRO 36 HG1 PRO 36 -16.846 20.403 31.178 260 2HG PRO 36 HG2 PRO 36 -17.216 21.363 32.623 261 1HD PRO 36 HD2 PRO 36 -18.042 18.783 32.276 262 2HD PRO 36 HD1 PRO 36 -18.922 19.968 33.262 263 H GLN 37 HN GLN 37 -20.877 20.100 28.305 264 HA GLN 37 HA GLN 37 -18.651 18.963 26.826 265 1HB GLN 37 HB2 GLN 37 -21.383 18.390 27.008 266 2HB GLN 37 HB1 GLN 37 -21.164 19.031 25.385 267 1HG GLN 37 HG1 GLN 37 -20.057 17.221 24.683 268 2HG GLN 37 HG2 GLN 37 -19.145 17.073 26.185 269 1HE2 GLN 37 HE21 GLN 37 -20.030 14.835 24.961 270 2HE2 GLN 37 HE22 GLN 37 -21.316 14.119 25.867 271 H VAL 38 HN VAL 38 -17.411 20.340 25.735 272 HA VAL 38 HA VAL 38 -18.558 22.743 24.552 273 HB VAL 38 HB VAL 38 -16.457 22.980 25.769 274 1HG1 VAL 38 HG21 VAL 38 -15.651 20.655 25.212 275 2HG1 VAL 38 HG22 VAL 38 -14.434 21.928 25.130 276 3HG1 VAL 38 HG23 VAL 38 -15.148 21.296 23.647 277 1HG2 VAL 38 HG11 VAL 38 -16.536 24.667 24.237 278 2HG2 VAL 38 HG12 VAL 38 -16.600 23.566 22.861 279 3HG2 VAL 38 HG13 VAL 38 -15.071 23.852 23.691 280 H THR 39 HN THR 39 -18.667 23.162 22.379 281 HA THR 39 HA THR 39 -18.153 20.867 20.610 282 HB THR 39 HB THR 39 -19.801 22.865 19.373 283 HG1 THR 39 HG1 THR 39 -21.526 22.151 21.135 284 1HG2 THR 39 HG21 THR 39 -20.678 20.186 20.395 285 2HG2 THR 39 HG22 THR 39 -19.752 20.402 18.909 286 3HG2 THR 39 HG23 THR 39 -21.355 21.123 19.062 287 H MET 40 HN MET 40 -15.889 21.645 20.574 288 HA MET 40 HA MET 40 -15.385 24.096 19.115 289 1HB MET 40 HB2 MET 40 -13.945 22.606 20.975 290 2HB MET 40 HB1 MET 40 -13.089 22.343 19.461 291 1HG MET 40 HG1 MET 40 -12.223 24.385 19.482 292 2HG MET 40 HG2 MET 40 -13.779 25.127 19.845 293 1HE MET 40 HE1 MET 40 -10.650 23.258 22.136 294 2HE MET 40 HE2 MET 40 -10.210 24.963 22.244 295 3HE MET 40 HE3 MET 40 -10.503 24.226 20.669 296 H GLN 41 HN GLN 41 -15.478 20.676 18.551 297 HA GLN 41 HA GLN 41 -15.190 19.379 16.701 298 1HB GLN 41 HB2 GLN 41 -16.765 21.657 15.987 299 2HB GLN 41 HB1 GLN 41 -15.754 21.224 14.615 300 1HG GLN 41 HG1 GLN 41 -16.594 18.825 15.039 301 2HG GLN 41 HG2 GLN 41 -17.858 19.606 15.988 302 1HE2 GLN 41 HE21 GLN 41 -19.575 19.209 14.706 303 2HE2 GLN 41 HE22 GLN 41 -19.744 19.804 13.092 304 H GLN 42 HN GLN 42 -12.905 19.233 16.966 305 HA GLN 42 HA GLN 42 -11.183 21.065 15.557 306 1HB GLN 42 HB1 GLN 42 -10.859 18.802 17.407 307 2HB GLN 42 HB2 GLN 42 -9.601 18.921 16.184 308 1HG GLN 42 HG1 GLN 42 -8.889 20.096 18.135 309 2HG GLN 42 HG2 GLN 42 -9.226 21.271 16.864 310 1HE2 GLN 42 HE21 GLN 42 -10.112 20.087 19.972 311 2HE2 GLN 42 HE22 GLN 42 -11.285 21.300 20.340 312 HA PRO 43 HA PRO 43 -11.769 18.653 11.788 313 1HB PRO 43 HB2 PRO 43 -10.687 20.445 10.098 314 2HB PRO 43 HB1 PRO 43 -12.300 20.668 10.787 315 1HG PRO 43 HG1 PRO 43 -9.693 21.878 11.636 316 2HG PRO 43 HG2 PRO 43 -11.276 22.657 11.448 317 1HD PRO 43 HD1 PRO 43 -10.285 21.865 13.857 318 2HD PRO 43 HD2 PRO 43 -12.021 21.912 13.493 319 H ALA 44 HN ALA 44 -10.244 18.077 9.933 320 HA ALA 44 HA ALA 44 -7.790 17.084 11.075 321 1HB ALA 44 HB1 ALA 44 -9.505 16.155 9.149 322 2HB ALA 44 HB2 ALA 44 -7.892 15.523 9.478 323 3HB ALA 44 HB3 ALA 44 -8.128 16.716 8.201 324 H VAL 45 HN VAL 45 -5.792 17.176 9.547 325 HA VAL 45 HA VAL 45 -5.055 19.940 9.333 326 HB VAL 45 HB VAL 45 -2.892 18.954 8.389 327 1HG1 VAL 45 HG11 VAL 45 -2.086 18.379 10.565 328 2HG1 VAL 45 HG12 VAL 45 -3.713 17.989 11.124 329 3HG1 VAL 45 HG13 VAL 45 -3.283 19.660 10.752 330 1HG2 VAL 45 HG21 VAL 45 -3.921 16.817 7.660 331 2HG2 VAL 45 HG22 VAL 45 -4.132 16.381 9.356 332 3HG2 VAL 45 HG23 VAL 45 -2.511 16.597 8.695 333 H HIS 46 HN HIS 46 -3.459 20.187 7.187 334 HA HIS 46 HA HIS 46 -5.360 20.026 4.955 335 1HB HIS 46 HB2 HIS 46 -3.218 21.669 4.191 336 2HB HIS 46 HB1 HIS 46 -4.834 22.182 4.664 337 HD2 HIS 46 HD2 HIS 46 -1.286 22.749 5.683 338 HE1 HIS 46 HE1 HIS 46 -3.645 23.636 9.085 339 HE2 HIS 46 HE2 HIS 46 -1.340 23.827 8.043 340 H VAL 47 HN VAL 47 -4.839 17.823 4.490 341 HA VAL 47 HA VAL 47 -2.178 17.442 3.282 342 HB VAL 47 HB VAL 47 -2.856 14.945 3.440 343 1HG1 VAL 47 HG21 VAL 47 -1.094 15.282 4.791 344 2HG1 VAL 47 HG22 VAL 47 -2.296 15.218 6.081 345 3HG1 VAL 47 HG23 VAL 47 -1.759 16.777 5.453 346 1HG2 VAL 47 HG11 VAL 47 -5.230 15.648 4.142 347 2HG2 VAL 47 HG12 VAL 47 -4.523 15.906 5.737 348 3HG2 VAL 47 HG13 VAL 47 -4.467 14.307 4.996 349 H GLN 48 HN GLN 48 -3.668 18.786 1.622 350 HA GLN 48 HA GLN 48 -5.410 17.197 -0.001 351 1HB GLN 48 HB2 GLN 48 -5.617 19.663 0.205 352 2HB GLN 48 HB1 GLN 48 -4.086 19.840 -0.642 353 1HG GLN 48 HG1 GLN 48 -5.644 20.194 -2.306 354 2HG GLN 48 HG2 GLN 48 -5.220 18.497 -2.522 355 1HE2 GLN 48 HE22 GLN 48 -7.660 20.733 -1.470 356 2HE2 GLN 48 HE21 GLN 48 -8.965 19.602 -1.421 357 H GLY 49 HN GLY 49 -2.018 18.084 -0.079 358 1HA GLY 49 HA1 GLY 49 -1.625 16.925 -2.713 359 2HA GLY 49 HA2 GLY 49 -0.390 17.659 -1.701 360 H GLN 50 HN GLN 50 0.302 16.392 0.215 361 HA GLN 50 HA GLN 50 0.715 13.634 -0.558 362 1HB GLN 50 HB2 GLN 50 1.705 14.970 1.957 363 2HB GLN 50 HB1 GLN 50 2.371 13.560 1.147 364 1HG GLN 50 HG2 GLN 50 3.129 14.918 -0.693 365 2HG GLN 50 HG1 GLN 50 2.364 16.344 0.008 366 1HE2 GLN 50 HE21 GLN 50 3.049 16.182 2.616 367 2HE2 GLN 50 HE22 GLN 50 4.764 16.300 2.798 368 H GLU 51 HN GLU 51 -1.594 13.097 -0.297 369 HA GLU 51 HA GLU 51 -2.807 13.126 2.271 370 1HB GLU 51 HB2 GLU 51 -3.596 11.280 0.029 371 2HB GLU 51 HB1 GLU 51 -4.614 11.965 1.288 372 1HG GLU 51 HG1 GLU 51 -3.815 14.228 0.139 373 2HG GLU 51 HG2 GLU 51 -3.667 13.152 -1.249 374 HA PRO 52 HA PRO 52 -1.595 8.528 2.573 375 1HB PRO 52 HB1 PRO 52 -0.108 7.333 0.701 376 2HB PRO 52 HB2 PRO 52 -1.842 7.587 0.469 377 1HG PRO 52 HG1 PRO 52 0.469 9.133 -0.634 378 2HG PRO 52 HG2 PRO 52 -1.037 8.647 -1.433 379 1HD PRO 52 HD2 PRO 52 -0.558 11.152 -0.370 380 2HD PRO 52 HD1 PRO 52 -2.169 10.465 -0.649 381 H LEU 53 HN LEU 53 -0.169 8.275 4.162 382 HA LEU 53 HA LEU 53 2.411 9.590 4.081 383 1HB LEU 53 HB2 LEU 53 0.691 9.120 6.097 384 2HB LEU 53 HB1 LEU 53 1.729 7.720 6.277 385 HG LEU 53 HG LEU 53 3.343 10.086 5.996 386 1HD1 LEU 53 HD21 LEU 53 2.347 11.619 7.249 387 2HD1 LEU 53 HD22 LEU 53 2.129 10.456 8.558 388 3HD1 LEU 53 HD23 LEU 53 0.906 10.603 7.295 389 1HD2 LEU 53 HD11 LEU 53 3.905 7.863 7.040 390 2HD2 LEU 53 HD12 LEU 53 2.932 8.359 8.426 391 3HD2 LEU 53 HD13 LEU 53 4.367 9.283 7.977 392 H THR 54 HN THR 54 4.421 8.515 4.344 393 HA THR 54 HA THR 54 4.684 5.700 4.353 394 HB THR 54 HB THR 54 5.892 6.130 1.878 395 HG1 THR 54 HG1 THR 54 4.603 8.038 1.686 396 1HG2 THR 54 HG21 THR 54 3.770 4.865 1.047 397 2HG2 THR 54 HG22 THR 54 3.442 4.710 2.773 398 3HG2 THR 54 HG23 THR 54 4.940 4.069 2.100 399 H ALA 55 HN ALA 55 7.125 5.539 2.893 400 HA ALA 55 HA ALA 55 8.937 6.362 4.855 401 1HB ALA 55 HB1 ALA 55 9.705 5.805 2.006 402 2HB ALA 55 HB2 ALA 55 9.211 4.531 3.122 403 3HB ALA 55 HB3 ALA 55 10.635 5.510 3.476 404 H SER 56 HN SER 56 7.941 7.887 1.837 405 HA SER 56 HA SER 56 9.908 9.883 1.714 406 1HB SER 56 HB1 SER 56 7.040 10.228 0.827 407 2HB SER 56 HB2 SER 56 8.479 11.011 0.172 408 HG SER 56 HG SER 56 7.383 8.852 -0.726 409 H MET 57 HN MET 57 6.712 9.855 3.245 410 HA MET 57 HA MET 57 6.755 12.485 4.242 411 1HB MET 57 HB1 MET 57 5.317 9.970 5.043 412 2HB MET 57 HB2 MET 57 5.170 11.426 6.014 413 1HG MET 57 HG1 MET 57 3.565 10.747 3.924 414 2HG MET 57 HG2 MET 57 3.752 12.370 4.582 415 1HE MET 57 HE1 MET 57 5.419 10.108 1.362 416 2HE MET 57 HE2 MET 57 4.193 11.036 0.498 417 3HE MET 57 HE3 MET 57 3.751 10.110 1.933 418 H LEU 58 HN LEU 58 7.896 9.423 5.543 419 HA LEU 58 HA LEU 58 8.585 10.236 8.127 420 1HB LEU 58 HB1 LEU 58 9.583 8.107 6.269 421 2HB LEU 58 HB2 LEU 58 10.383 8.366 7.805 422 HG LEU 58 HG LEU 58 8.815 7.226 8.920 423 1HD1 LEU 58 HD11 LEU 58 7.276 9.175 8.729 424 2HD1 LEU 58 HD12 LEU 58 6.456 7.615 8.810 425 3HD1 LEU 58 HD13 LEU 58 6.615 8.448 7.263 426 1HD2 LEU 58 HD21 LEU 58 7.798 5.500 7.737 427 2HD2 LEU 58 HD22 LEU 58 9.159 5.959 6.709 428 3HD2 LEU 58 HD23 LEU 58 7.527 6.505 6.314 429 H ALA 59 HN ALA 59 10.489 10.181 5.143 430 HA ALA 59 HA ALA 59 12.857 11.236 6.302 431 1HB ALA 59 HB1 ALA 59 12.960 9.965 4.255 432 2HB ALA 59 HB2 ALA 59 13.575 11.592 3.966 433 3HB ALA 59 HB3 ALA 59 11.954 11.155 3.427 434 H SER 60 HN SER 60 9.902 12.675 5.531 435 HA SER 60 HA SER 60 10.886 15.271 4.813 436 1HB SER 60 HB1 SER 60 8.672 14.519 4.070 437 2HB SER 60 HB2 SER 60 8.138 14.405 5.747 438 HG SER 60 HG SER 60 9.178 16.843 5.224 439 H ALA 61 HN ALA 61 10.817 13.594 7.686 440 HA ALA 61 HA ALA 61 11.063 16.092 9.216 441 1HB ALA 61 HB1 ALA 61 8.908 15.367 9.819 442 2HB ALA 61 HB2 ALA 61 9.958 14.858 11.141 443 3HB ALA 61 HB3 ALA 61 9.419 13.683 9.940 444 HA PRO 62 HA PRO 62 14.656 12.995 9.634 445 1HB PRO 62 HB1 PRO 62 16.126 15.560 9.311 446 2HB PRO 62 HB2 PRO 62 16.477 13.965 8.639 447 1HG PRO 62 HG2 PRO 62 15.441 15.889 7.112 448 2HG PRO 62 HG1 PRO 62 14.933 14.200 6.925 449 1HD PRO 62 HD2 PRO 62 13.510 16.478 8.234 450 2HD PRO 62 HD1 PRO 62 12.852 15.139 7.272 451 HA PRO 63 HA PRO 63 15.888 15.484 13.461 452 1HB PRO 63 HB1 PRO 63 15.395 18.084 13.751 453 2HB PRO 63 HB2 PRO 63 16.672 17.521 12.666 454 1HG PRO 63 HG2 PRO 63 13.932 18.514 12.022 455 2HG PRO 63 HG1 PRO 63 15.452 18.768 11.148 456 1HD PRO 63 HD2 PRO 63 13.490 16.873 10.517 457 2HD PRO 63 HD1 PRO 63 15.157 16.888 9.912 458 H GLN 64 HN GLN 64 12.691 16.240 12.279 459 HA GLN 64 HA GLN 64 11.563 16.716 14.881 460 1HB GLN 64 HB1 GLN 64 10.720 17.669 12.667 461 2HB GLN 64 HB2 GLN 64 10.034 16.079 12.362 462 1HG GLN 64 HG1 GLN 64 8.783 16.302 14.516 463 2HG GLN 64 HG2 GLN 64 9.347 17.971 14.593 464 1HE2 GLN 64 HE21 GLN 64 7.253 18.774 14.490 465 2HE2 GLN 64 HE22 GLN 64 6.331 18.757 13.030 466 H GLU 65 HN GLU 65 9.988 14.496 12.676 467 HA GLU 65 HA GLU 65 9.869 12.523 14.822 468 1HB GLU 65 HB1 GLU 65 8.430 12.254 12.210 469 2HB GLU 65 HB2 GLU 65 7.959 11.675 13.803 470 1HG GLU 65 HG2 GLU 65 8.164 14.602 13.462 471 2HG GLU 65 HG1 GLU 65 6.841 13.790 12.625 472 H GLN 66 HN GLN 66 9.652 11.715 11.424 473 HA GLN 66 HA GLN 66 10.904 10.408 10.042 474 1HB GLN 66 HB1 GLN 66 12.844 11.711 11.500 475 2HB GLN 66 HB2 GLN 66 13.234 10.018 11.770 476 1HG GLN 66 HG1 GLN 66 12.910 9.910 9.145 477 2HG GLN 66 HG2 GLN 66 13.328 11.618 9.279 478 1HE2 GLN 66 HE22 GLN 66 15.204 10.992 8.021 479 2HE2 GLN 66 HE21 GLN 66 16.585 10.342 8.829 480 H LYS 67 HN LYS 67 11.049 9.583 13.472 481 HA LYS 67 HA LYS 67 10.528 6.783 12.746 482 1HB LYS 67 HB1 LYS 67 11.949 7.529 15.284 483 2HB LYS 67 HB2 LYS 67 11.933 5.986 14.440 484 1HG LYS 67 HG1 LYS 67 13.132 7.419 12.565 485 2HG LYS 67 HG2 LYS 67 13.586 8.398 13.962 486 1HD LYS 67 HD2 LYS 67 15.284 6.956 14.191 487 2HD LYS 67 HD1 LYS 67 14.072 5.856 14.851 488 1HE LYS 67 HE2 LYS 67 13.737 4.856 12.680 489 2HE LYS 67 HE1 LYS 67 14.837 6.018 11.940 490 1HZ LYS 67 HZ1 LYS 67 15.452 3.721 13.664 491 2HZ LYS 67 HZ2 LYS 67 16.502 5.048 13.658 492 3HZ LYS 67 HZ3 LYS 67 16.189 4.209 12.222 493 H GLN 68 HN GLN 68 8.892 9.246 13.570 494 HA GLN 68 HA GLN 68 7.521 8.013 15.866 495 1HB GLN 68 HB1 GLN 68 7.576 10.911 15.002 496 2HB GLN 68 HB2 GLN 68 6.643 10.278 16.352 497 1HG GLN 68 HG1 GLN 68 9.428 9.532 16.543 498 2HG GLN 68 HG2 GLN 68 9.225 11.280 16.428 499 1HE2 GLN 68 HE21 GLN 68 7.013 11.826 17.773 500 2HE2 GLN 68 HE22 GLN 68 7.132 11.327 19.423 501 H MET 69 HN MET 69 6.991 9.728 12.797 502 HA MET 69 HA MET 69 4.156 9.312 12.858 503 1HB MET 69 HB1 MET 69 5.732 9.975 10.383 504 2HB MET 69 HB2 MET 69 4.077 10.415 10.781 505 1HG MET 69 HG1 MET 69 4.936 11.907 12.546 506 2HG MET 69 HG2 MET 69 6.580 11.516 12.043 507 1HE MET 69 HE1 MET 69 6.383 11.798 8.573 508 2HE MET 69 HE2 MET 69 7.516 11.811 9.925 509 3HE MET 69 HE3 MET 69 7.287 13.265 8.953 510 H LEU 70 HN LEU 70 6.726 7.275 12.135 511 HA LEU 70 HA LEU 70 5.832 5.874 9.903 512 1HB LEU 70 HB1 LEU 70 7.019 3.887 11.299 513 2HB LEU 70 HB2 LEU 70 7.877 5.073 10.342 514 HG LEU 70 HG LEU 70 8.470 6.342 12.288 515 1HD1 LEU 70 HD21 LEU 70 6.548 6.263 13.657 516 2HD1 LEU 70 HD22 LEU 70 7.823 5.458 14.571 517 3HD1 LEU 70 HD23 LEU 70 6.591 4.504 13.747 518 1HD2 LEU 70 HD11 LEU 70 9.699 4.605 13.593 519 2HD2 LEU 70 HD12 LEU 70 9.928 4.507 11.846 520 3HD2 LEU 70 HD13 LEU 70 8.840 3.379 12.659 521 H GLY 71 HN GLY 71 4.962 5.458 13.307 522 1HA GLY 71 HA2 GLY 71 2.703 3.834 12.423 523 2HA GLY 71 HA1 GLY 71 3.783 3.130 13.608 524 H GLU 72 HN GLU 72 3.038 6.550 13.578 525 HA GLU 72 HA GLU 72 1.160 6.194 15.801 526 1HB GLU 72 HB1 GLU 72 3.469 8.142 15.901 527 2HB GLU 72 HB2 GLU 72 2.287 7.841 17.166 528 1HG GLU 72 HG1 GLU 72 3.702 5.438 16.333 529 2HG GLU 72 HG2 GLU 72 4.768 6.693 16.962 530 H ARG 73 HN ARG 73 1.985 7.716 12.922 531 HA ARG 73 HA ARG 73 -0.096 9.753 13.363 532 1HB ARG 73 HB1 ARG 73 2.515 10.357 13.011 533 2HB ARG 73 HB2 ARG 73 1.985 10.308 11.336 534 1HG ARG 73 HG1 ARG 73 0.410 11.872 13.328 535 2HG ARG 73 HG2 ARG 73 1.914 12.537 12.688 536 1HD ARG 73 HD2 ARG 73 1.012 12.956 10.680 537 2HD ARG 73 HD1 ARG 73 0.145 11.421 10.645 538 HE ARG 73 HE ARG 73 -1.688 12.449 11.646 539 1HH1 ARG 73 HH11 ARG 73 0.997 14.654 11.370 540 2HH1 ARG 73 HH12 ARG 73 0.041 16.061 11.699 541 1HH2 ARG 73 HH21 ARG 73 -2.953 14.297 12.078 542 2HH2 ARG 73 HH22 ARG 73 -2.203 15.858 12.102 543 H LEU 74 HN LEU 74 1.034 7.147 11.511 544 HA LEU 74 HA LEU 74 -0.235 7.798 9.037 545 1HB LEU 74 HB1 LEU 74 1.338 5.628 10.147 546 2HB LEU 74 HB2 LEU 74 0.019 5.033 9.160 547 HG LEU 74 HG LEU 74 1.637 7.208 8.005 548 1HD1 LEU 74 HD11 LEU 74 3.552 6.005 7.621 549 2HD1 LEU 74 HD12 LEU 74 2.756 4.452 7.877 550 3HD1 LEU 74 HD13 LEU 74 3.141 5.483 9.256 551 1HD2 LEU 74 HD21 LEU 74 0.534 4.608 6.948 552 2HD2 LEU 74 HD22 LEU 74 1.322 5.859 5.985 553 3HD2 LEU 74 HD23 LEU 74 -0.213 6.200 6.787 554 H PHE 75 HN PHE 75 -1.248 6.323 11.987 555 HA PHE 75 HA PHE 75 -3.215 4.598 11.328 556 1HB PHE 75 HB1 PHE 75 -2.846 4.875 13.616 557 2HB PHE 75 HB2 PHE 75 -3.078 6.618 13.544 558 HD1 PHE 75 HD1 PHE 75 -5.220 3.834 12.300 559 HD2 PHE 75 HD2 PHE 75 -4.806 7.115 14.984 560 HE1 PHE 75 HE1 PHE 75 -7.565 3.554 13.006 561 HE2 PHE 75 HE2 PHE 75 -7.146 6.840 15.691 562 HZ PHE 75 HZ PHE 75 -8.528 5.058 14.702 563 HA PRO 76 HA PRO 76 -6.566 8.109 10.810 564 1HB PRO 76 HB1 PRO 76 -5.522 10.526 9.992 565 2HB PRO 76 HB2 PRO 76 -5.998 10.148 11.650 566 1HG PRO 76 HG1 PRO 76 -3.282 10.097 10.398 567 2HG PRO 76 HG2 PRO 76 -3.767 10.680 12.002 568 1HD PRO 76 HD1 PRO 76 -2.586 8.297 11.680 569 2HD PRO 76 HD2 PRO 76 -3.866 8.538 12.887 570 H LEU 77 HN LEU 77 -3.690 7.679 8.946 571 HA LEU 77 HA LEU 77 -5.082 8.307 6.460 572 1HB LEU 77 HB1 LEU 77 -2.184 7.730 7.049 573 2HB LEU 77 HB2 LEU 77 -2.815 8.008 5.437 574 HG LEU 77 HG LEU 77 -2.851 9.990 7.719 575 1HD1 LEU 77 HD11 LEU 77 -1.291 11.251 6.266 576 2HD1 LEU 77 HD12 LEU 77 -1.215 9.852 5.195 577 3HD1 LEU 77 HD13 LEU 77 -0.629 9.724 6.854 578 1HD2 LEU 77 HD21 LEU 77 -3.798 10.257 4.870 579 2HD2 LEU 77 HD22 LEU 77 -3.650 11.584 6.023 580 3HD2 LEU 77 HD23 LEU 77 -4.801 10.281 6.321 581 H ILE 78 HN ILE 78 -4.052 5.565 8.311 582 HA ILE 78 HA ILE 78 -3.839 3.688 6.196 583 HB ILE 78 HB ILE 78 -4.782 2.985 8.956 584 1HG1 ILE 78 HG12 ILE 78 -2.759 4.464 9.051 585 2HG1 ILE 78 HG11 ILE 78 -2.496 2.847 9.694 586 1HG2 ILE 78 HG21 ILE 78 -3.204 0.986 8.286 587 2HG2 ILE 78 HG22 ILE 78 -3.588 1.539 6.656 588 3HG2 ILE 78 HG23 ILE 78 -4.882 1.055 7.751 589 1HD1 ILE 78 HD11 ILE 78 -1.859 3.130 6.853 590 2HD1 ILE 78 HD12 ILE 78 -0.958 2.357 8.158 591 3HD1 ILE 78 HD13 ILE 78 -0.866 4.104 7.938 592 H GLN 79 HN GLN 79 -6.520 4.856 8.151 593 HA GLN 79 HA GLN 79 -8.514 3.048 7.450 594 1HB GLN 79 HB1 GLN 79 -8.403 5.838 8.408 595 2HB GLN 79 HB2 GLN 79 -9.885 5.400 7.572 596 1HG GLN 79 HG1 GLN 79 -10.580 4.044 9.230 597 2HG GLN 79 HG2 GLN 79 -8.948 3.495 9.612 598 1HE2 GLN 79 HE22 GLN 79 -11.475 5.031 10.879 599 2HE2 GLN 79 HE21 GLN 79 -10.685 6.087 11.994 600 H ALA 80 HN ALA 80 -6.861 5.308 5.551 601 HA ALA 80 HA ALA 80 -8.871 5.643 3.508 602 1HB ALA 80 HB1 ALA 80 -5.931 6.307 3.377 603 2HB ALA 80 HB2 ALA 80 -7.157 7.376 4.065 604 3HB ALA 80 HB3 ALA 80 -7.222 6.948 2.356 605 H MET 81 HN MET 81 -6.036 3.670 4.077 606 HA MET 81 HA MET 81 -5.935 2.619 1.400 607 1HB MET 81 HB1 MET 81 -4.580 1.225 3.651 608 2HB MET 81 HB2 MET 81 -3.975 1.612 2.045 609 1HG MET 81 HG1 MET 81 -4.418 4.055 3.390 610 2HG MET 81 HG2 MET 81 -3.565 2.988 4.499 611 1HE MET 81 HE1 MET 81 -0.485 2.684 3.969 612 2HE MET 81 HE2 MET 81 -0.667 1.746 2.478 613 3HE MET 81 HE3 MET 81 -1.805 1.521 3.814 614 H HIS 82 HN HIS 82 -7.067 1.502 4.542 615 HA HIS 82 HA HIS 82 -8.359 -0.787 3.207 616 1HB HIS 82 HB1 HIS 82 -6.838 -0.557 5.730 617 2HB HIS 82 HB2 HIS 82 -8.324 -1.492 5.841 618 HD2 HIS 82 HD2 HIS 82 -5.370 -1.527 3.206 619 HE1 HIS 82 HE1 HIS 82 -6.365 -5.467 4.378 620 HE2 HIS 82 HE2 HIS 82 -4.861 -4.052 2.903 621 HA PRO 83 HA PRO 83 -12.301 0.731 4.530 622 1HB PRO 83 HB1 PRO 83 -13.559 -1.514 5.438 623 2HB PRO 83 HB2 PRO 83 -13.323 -1.156 3.724 624 1HG PRO 83 HG1 PRO 83 -11.732 -2.945 5.524 625 2HG PRO 83 HG2 PRO 83 -12.273 -3.229 3.859 626 1HD PRO 83 HD2 PRO 83 -9.752 -2.474 4.427 627 2HD PRO 83 HD1 PRO 83 -10.584 -1.930 2.957 628 H THR 84 HN THR 84 -11.025 1.830 6.298 629 HA THR 84 HA THR 84 -10.591 2.370 8.465 630 HB THR 84 HB THR 84 -12.552 2.410 9.902 631 HG1 THR 84 HG1 THR 84 -14.478 1.345 9.130 632 1HG2 THR 84 HG21 THR 84 -13.302 4.081 8.678 633 2HG2 THR 84 HG22 THR 84 -14.238 2.923 7.734 634 3HG2 THR 84 HG23 THR 84 -12.615 3.376 7.215 635 H LEU 85 HN LEU 85 -9.614 -0.193 7.726 636 HA LEU 85 HA LEU 85 -10.156 -1.984 9.943 637 1HB LEU 85 HB1 LEU 85 -9.063 -2.204 7.295 638 2HB LEU 85 HB2 LEU 85 -7.941 -2.896 8.449 639 HG LEU 85 HG LEU 85 -9.471 -4.576 7.505 640 1HD1 LEU 85 HD21 LEU 85 -10.550 -4.915 10.051 641 2HD1 LEU 85 HD22 LEU 85 -9.037 -4.044 10.302 642 3HD1 LEU 85 HD23 LEU 85 -9.038 -5.580 9.435 643 1HD2 LEU 85 HD11 LEU 85 -11.758 -4.493 7.649 644 2HD2 LEU 85 HD12 LEU 85 -11.378 -2.786 7.424 645 3HD2 LEU 85 HD13 LEU 85 -11.742 -3.403 9.036 646 H ALA 86 HN ALA 86 -8.386 0.713 9.672 647 HA ALA 86 HA ALA 86 -5.845 -0.005 10.698 648 1HB ALA 86 HB1 ALA 86 -6.725 2.221 9.618 649 2HB ALA 86 HB2 ALA 86 -5.407 2.244 10.790 650 3HB ALA 86 HB3 ALA 86 -7.045 2.659 11.296 651 H GLY 87 HN GLY 87 -6.023 2.099 12.881 652 1HA GLY 87 HA1 GLY 87 -6.656 2.235 15.129 653 2HA GLY 87 HA2 GLY 87 -7.604 0.766 14.927 654 H LYS 88 HN LYS 88 -4.973 -0.180 13.509 655 HA LYS 88 HA LYS 88 -3.154 -0.510 15.704 656 1HB LYS 88 HB1 LYS 88 -4.842 -2.179 16.289 657 2HB LYS 88 HB2 LYS 88 -4.702 -2.902 14.693 658 1HG LYS 88 HG1 LYS 88 -2.152 -3.071 15.430 659 2HG LYS 88 HG2 LYS 88 -2.900 -3.087 17.032 660 1HD LYS 88 HD2 LYS 88 -3.395 -5.234 16.767 661 2HD LYS 88 HD1 LYS 88 -4.398 -4.823 15.372 662 1HE LYS 88 HE2 LYS 88 -2.653 -5.189 13.862 663 2HE LYS 88 HE1 LYS 88 -1.424 -5.093 15.120 664 1HZ LYS 88 HZ1 LYS 88 -1.794 -7.225 15.780 665 2HZ LYS 88 HZ2 LYS 88 -2.200 -7.384 14.146 666 3HZ LYS 88 HZ3 LYS 88 -3.419 -7.228 15.308 667 H ILE 89 HN ILE 89 -4.019 -0.977 12.363 668 HA ILE 89 HA ILE 89 -2.051 -2.580 11.400 669 HB ILE 89 HB ILE 89 -3.109 -0.066 10.103 670 1HG1 ILE 89 HG11 ILE 89 -3.936 -2.915 9.560 671 2HG1 ILE 89 HG12 ILE 89 -4.711 -1.952 10.814 672 1HG2 ILE 89 HG21 ILE 89 -2.417 -1.965 8.160 673 2HG2 ILE 89 HG22 ILE 89 -1.051 -1.883 9.272 674 3HG2 ILE 89 HG23 ILE 89 -1.634 -0.418 8.483 675 1HD1 ILE 89 HD11 ILE 89 -4.672 -1.425 7.860 676 2HD1 ILE 89 HD12 ILE 89 -5.250 -0.262 9.053 677 3HD1 ILE 89 HD13 ILE 89 -6.059 -1.819 8.876 678 H THR 90 HN THR 90 -1.636 0.906 10.850 679 HA THR 90 HA THR 90 1.129 0.772 10.521 680 HB THR 90 HB THR 90 -0.870 2.764 10.523 681 HG1 THR 90 HG1 THR 90 1.884 2.890 9.867 682 1HG2 THR 90 HG21 THR 90 1.311 3.384 12.444 683 2HG2 THR 90 HG22 THR 90 -0.401 3.806 12.503 684 3HG2 THR 90 HG23 THR 90 0.679 4.651 11.391 685 H GLY 91 HN GLY 91 -0.774 1.286 13.466 686 1HA GLY 91 HA2 GLY 91 1.375 1.897 15.199 687 2HA GLY 91 HA1 GLY 91 -0.157 1.172 15.683 688 H MET 92 HN MET 92 0.233 -1.008 13.752 689 HA MET 92 HA MET 92 1.695 -2.839 15.435 690 1HB MET 92 HB1 MET 92 -0.408 -3.234 13.847 691 2HB MET 92 HB2 MET 92 0.845 -3.531 12.653 692 1HG MET 92 HG1 MET 92 1.714 -5.014 14.735 693 2HG MET 92 HG2 MET 92 -0.025 -5.156 14.902 694 1HE MET 92 HE1 MET 92 -1.202 -6.551 11.609 695 2HE MET 92 HE2 MET 92 -0.400 -5.044 11.167 696 3HE MET 92 HE3 MET 92 -1.361 -5.130 12.645 697 H LEU 93 HN LEU 93 2.057 -1.206 12.404 698 HA LEU 93 HA LEU 93 4.253 -2.511 11.341 699 1HB LEU 93 HB2 LEU 93 3.042 0.160 11.044 700 2HB LEU 93 HB1 LEU 93 4.645 -0.065 10.382 701 HG LEU 93 HG LEU 93 2.843 -0.415 8.711 702 1HD1 LEU 93 HD11 LEU 93 4.807 -2.514 9.454 703 2HD1 LEU 93 HD12 LEU 93 4.710 -1.515 8.004 704 3HD1 LEU 93 HD13 LEU 93 3.626 -2.893 8.198 705 1HD2 LEU 93 HD21 LEU 93 1.021 -1.557 9.231 706 2HD2 LEU 93 HD22 LEU 93 1.694 -1.941 10.817 707 3HD2 LEU 93 HD23 LEU 93 1.992 -3.012 9.445 708 H LEU 94 HN LEU 94 4.122 -0.855 14.201 709 HA LEU 94 HA LEU 94 6.998 -0.254 14.147 710 1HB LEU 94 HB1 LEU 94 4.681 1.012 15.460 711 2HB LEU 94 HB2 LEU 94 6.095 0.828 16.476 712 HG LEU 94 HG LEU 94 5.854 3.036 15.243 713 1HD1 LEU 94 HD21 LEU 94 7.998 3.177 15.778 714 2HD1 LEU 94 HD22 LEU 94 8.420 2.335 14.287 715 3HD1 LEU 94 HD23 LEU 94 8.134 1.419 15.767 716 1HD2 LEU 94 HD11 LEU 94 6.650 3.053 12.906 717 2HD2 LEU 94 HD12 LEU 94 5.112 2.207 13.097 718 3HD2 LEU 94 HD13 LEU 94 6.606 1.289 12.903 719 H GLU 95 HN GLU 95 5.656 -2.837 14.383 720 HA GLU 95 HA GLU 95 7.139 -3.944 16.525 721 1HB GLU 95 HB2 GLU 95 5.434 -4.588 18.042 722 2HB GLU 95 HB1 GLU 95 5.180 -2.877 17.730 723 1HG GLU 95 HG1 GLU 95 3.320 -3.304 16.341 724 2HG GLU 95 HG2 GLU 95 3.683 -5.027 16.265 725 H ILE 96 HN ILE 96 5.628 -4.153 13.630 726 HA ILE 96 HA ILE 96 4.595 -6.764 13.544 727 HB ILE 96 HB ILE 96 4.886 -6.719 11.146 728 1HG1 ILE 96 HG12 ILE 96 7.144 -5.807 11.036 729 2HG1 ILE 96 HG11 ILE 96 6.047 -4.911 9.994 730 1HG2 ILE 96 HG21 ILE 96 3.806 -4.497 10.628 731 2HG2 ILE 96 HG22 ILE 96 3.942 -4.151 12.352 732 3HG2 ILE 96 HG23 ILE 96 2.988 -5.531 11.804 733 1HD1 ILE 96 HD11 ILE 96 5.996 -3.552 12.407 734 2HD1 ILE 96 HD12 ILE 96 6.818 -3.071 10.922 735 3HD1 ILE 96 HD13 ILE 96 7.687 -3.987 12.155 736 H ASP 97 HN ASP 97 6.123 -7.709 11.242 737 HA ASP 97 HA ASP 97 7.885 -9.509 12.443 738 1HB ASP 97 HB1 ASP 97 6.696 -9.462 10.097 739 2HB ASP 97 HB2 ASP 97 8.184 -8.674 9.575 740 H ASN 98 HN ASN 98 8.260 -6.267 12.079 741 HA ASN 98 HA ASN 98 9.969 -4.877 12.557 742 1HB ASN 98 HB1 ASN 98 11.468 -7.464 12.819 743 2HB ASN 98 HB2 ASN 98 12.324 -5.925 12.859 744 1HD2 ASN 98 HD21 ASN 98 12.231 -4.681 14.651 745 2HD2 ASN 98 HD22 ASN 98 11.402 -5.130 16.099 746 H SER 99 HN SER 99 10.195 -7.167 9.982 747 HA SER 99 HA SER 99 12.208 -5.739 8.507 748 1HB SER 99 HB2 SER 99 12.246 -7.631 7.319 749 2HB SER 99 HB1 SER 99 10.894 -8.246 8.272 750 HG SER 99 HG SER 99 10.875 -7.677 5.732 751 H GLU 100 HN GLU 100 8.743 -5.758 8.767 752 HA GLU 100 HA GLU 100 8.256 -4.082 6.483 753 1HB GLU 100 HB1 GLU 100 6.329 -4.316 8.747 754 2HB GLU 100 HB2 GLU 100 6.019 -4.232 7.019 755 1HG GLU 100 HG1 GLU 100 7.384 -6.561 7.189 756 2HG GLU 100 HG2 GLU 100 6.523 -6.549 8.730 757 H LEU 101 HN LEU 101 9.119 -3.665 9.782 758 HA LEU 101 HA LEU 101 8.344 -0.906 9.987 759 1HB LEU 101 HB1 LEU 101 8.476 -1.936 12.064 760 2HB LEU 101 HB2 LEU 101 9.931 -2.820 11.648 761 HG LEU 101 HG LEU 101 10.979 -0.381 11.623 762 1HD1 LEU 101 HD11 LEU 101 9.012 -0.004 13.829 763 2HD1 LEU 101 HD12 LEU 101 8.567 0.452 12.184 764 3HD1 LEU 101 HD13 LEU 101 9.970 1.191 12.956 765 1HD2 LEU 101 HD21 LEU 101 10.477 -2.266 13.879 766 2HD2 LEU 101 HD22 LEU 101 11.313 -0.743 14.182 767 3HD2 LEU 101 HD23 LEU 101 11.979 -1.901 13.031 768 H LEU 102 HN LEU 102 11.021 -2.696 8.781 769 HA LEU 102 HA LEU 102 12.800 -0.396 8.722 770 1HB LEU 102 HB2 LEU 102 13.049 -3.298 8.432 771 2HB LEU 102 HB1 LEU 102 14.000 -2.405 7.258 772 HG LEU 102 HG LEU 102 14.942 -1.101 9.250 773 1HD1 LEU 102 HD21 LEU 102 14.720 -1.937 11.408 774 2HD1 LEU 102 HD22 LEU 102 14.093 -3.487 10.847 775 3HD1 LEU 102 HD23 LEU 102 13.083 -2.044 10.760 776 1HD2 LEU 102 HD11 LEU 102 16.495 -3.012 9.831 777 2HD2 LEU 102 HD12 LEU 102 16.356 -2.610 8.119 778 3HD2 LEU 102 HD13 LEU 102 15.506 -4.013 8.768 779 H HIS 103 HN HIS 103 11.183 -2.563 6.421 780 HA HIS 103 HA HIS 103 12.153 -1.298 4.104 781 1HB HIS 103 HB1 HIS 103 10.683 -3.565 4.692 782 2HB HIS 103 HB2 HIS 103 9.534 -2.559 3.822 783 HD2 HIS 103 HD2 HIS 103 11.445 -5.332 2.817 784 HE1 HIS 103 HE1 HIS 103 12.385 -2.514 -0.199 785 HE2 HIS 103 HE2 HIS 103 12.434 -4.967 0.446 786 H MET 104 HN MET 104 9.274 -0.766 6.076 787 HA MET 104 HA MET 104 7.889 0.948 4.336 788 1HB MET 104 HB2 MET 104 6.644 1.666 6.260 789 2HB MET 104 HB1 MET 104 6.965 -0.057 6.443 790 1HG MET 104 HG2 MET 104 8.952 0.613 7.837 791 2HG MET 104 HG1 MET 104 8.290 2.245 7.838 792 1HE MET 104 HE1 MET 104 5.474 2.019 7.778 793 2HE MET 104 HE2 MET 104 4.690 1.466 9.257 794 3HE MET 104 HE3 MET 104 4.967 0.337 7.931 795 H LEU 105 HN LEU 105 10.443 1.562 6.690 796 HA LEU 105 HA LEU 105 10.333 4.418 6.368 797 1HB LEU 105 HB1 LEU 105 12.517 2.728 7.590 798 2HB LEU 105 HB2 LEU 105 12.305 4.457 7.786 799 HG LEU 105 HG LEU 105 10.370 2.365 8.784 800 1HD1 LEU 105 HD11 LEU 105 11.227 2.843 10.990 801 2HD1 LEU 105 HD12 LEU 105 12.365 4.016 10.326 802 3HD1 LEU 105 HD13 LEU 105 12.543 2.303 9.947 803 1HD2 LEU 105 HD21 LEU 105 9.861 4.610 10.184 804 2HD2 LEU 105 HD22 LEU 105 9.004 4.149 8.711 805 3HD2 LEU 105 HD23 LEU 105 10.337 5.303 8.631 806 H GLU 106 HN GLU 106 11.644 1.850 4.621 807 HA GLU 106 HA GLU 106 13.655 3.595 3.403 808 1HB GLU 106 HB1 GLU 106 14.996 1.774 3.086 809 2HB GLU 106 HB2 GLU 106 14.058 1.161 4.442 810 1HG GLU 106 HG2 GLU 106 12.524 0.096 2.756 811 2HG GLU 106 HG1 GLU 106 13.715 0.522 1.527 812 H SER 107 HN SER 107 10.559 2.503 2.818 813 HA SER 107 HA SER 107 10.863 3.147 -0.019 814 1HB SER 107 HB2 SER 107 11.011 0.579 0.473 815 2HB SER 107 HB1 SER 107 9.262 0.705 0.650 816 HG SER 107 HG SER 107 10.290 1.950 -1.582 817 HA PRO 108 HA PRO 108 6.968 5.133 0.770 818 1HB PRO 108 HB2 PRO 108 6.435 5.999 -1.706 819 2HB PRO 108 HB1 PRO 108 7.776 6.670 -0.769 820 1HG PRO 108 HG2 PRO 108 7.823 4.617 -2.948 821 2HG PRO 108 HG1 PRO 108 8.917 5.986 -2.679 822 1HD PRO 108 HD2 PRO 108 9.479 3.397 -1.949 823 2HD PRO 108 HD1 PRO 108 10.186 4.825 -1.170 824 H GLU 109 HN GLU 109 7.364 2.225 -0.690 825 HA GLU 109 HA GLU 109 4.469 1.905 -1.179 826 1HB GLU 109 HB2 GLU 109 6.762 0.519 -2.595 827 2HB GLU 109 HB1 GLU 109 5.058 0.151 -2.834 828 1HG GLU 109 HG1 GLU 109 4.661 2.088 -3.999 829 2HG GLU 109 HG2 GLU 109 6.019 2.937 -3.262 830 H SER 110 HN SER 110 7.277 0.885 0.474 831 HA SER 110 HA SER 110 6.375 -1.748 1.151 832 1HB SER 110 HB1 SER 110 8.671 -0.043 1.803 833 2HB SER 110 HB2 SER 110 8.127 -1.047 3.148 834 HG SER 110 HG SER 110 8.256 -2.353 0.730 835 H LEU 111 HN LEU 111 6.529 1.355 2.865 836 HA LEU 111 HA LEU 111 5.321 0.652 5.220 837 1HB LEU 111 HB1 LEU 111 6.239 2.889 4.669 838 2HB LEU 111 HB2 LEU 111 4.821 3.197 3.682 839 HG LEU 111 HG LEU 111 4.238 2.391 6.446 840 1HD1 LEU 111 HD11 LEU 111 6.266 4.323 5.991 841 2HD1 LEU 111 HD12 LEU 111 5.514 3.831 7.516 842 3HD1 LEU 111 HD13 LEU 111 4.820 5.153 6.579 843 1HD2 LEU 111 HD21 LEU 111 2.574 3.152 4.749 844 2HD2 LEU 111 HD22 LEU 111 3.310 4.754 4.827 845 3HD2 LEU 111 HD23 LEU 111 2.546 4.065 6.260 846 H ARG 112 HN ARG 112 3.835 1.203 2.098 847 HA ARG 112 HA ARG 112 1.165 1.055 3.192 848 1HB ARG 112 HB2 ARG 112 1.062 2.471 1.423 849 2HB ARG 112 HB1 ARG 112 2.368 1.669 0.557 850 1HG ARG 112 HG1 ARG 112 0.949 0.062 -0.334 851 2HG ARG 112 HG2 ARG 112 -0.322 0.388 0.847 852 1HD ARG 112 HD1 ARG 112 0.511 2.587 -0.970 853 2HD ARG 112 HD2 ARG 112 -0.465 1.279 -1.627 854 HE ARG 112 HE ARG 112 -1.291 3.115 0.503 855 1HH1 ARG 112 HH22 ARG 112 -2.034 0.713 -1.911 856 2HH1 ARG 112 HH21 ARG 112 -3.747 0.928 -1.786 857 1HH2 ARG 112 HH11 ARG 112 -3.553 3.405 0.672 858 2HH2 ARG 112 HH12 ARG 112 -4.610 2.456 -0.320 859 H SER 113 HN SER 113 2.934 -0.835 0.730 860 HA SER 113 HA SER 113 1.130 -2.915 0.489 861 1HB SER 113 HB1 SER 113 4.082 -2.682 0.051 862 2HB SER 113 HB2 SER 113 3.327 -4.272 -0.049 863 HG SER 113 HG SER 113 1.999 -3.509 -1.682 864 H LYS 114 HN LYS 114 3.624 -2.403 2.894 865 HA LYS 114 HA LYS 114 3.308 -5.004 4.090 866 1HB LYS 114 HB1 LYS 114 4.729 -2.547 5.134 867 2HB LYS 114 HB2 LYS 114 4.826 -4.158 5.830 868 1HG LYS 114 HG1 LYS 114 5.602 -3.658 2.986 869 2HG LYS 114 HG2 LYS 114 6.730 -3.359 4.311 870 1HD LYS 114 HD1 LYS 114 6.522 -5.670 5.038 871 2HD LYS 114 HD2 LYS 114 5.338 -5.980 3.766 872 1HE LYS 114 HE2 LYS 114 6.917 -6.229 2.202 873 2HE LYS 114 HE1 LYS 114 7.825 -4.829 2.772 874 1HZ LYS 114 HZ1 LYS 114 7.883 -7.299 4.356 875 2HZ LYS 114 HZ2 LYS 114 9.060 -6.094 4.201 876 3HZ LYS 114 HZ3 LYS 114 8.822 -7.210 2.952 877 H VAL 115 HN VAL 115 1.956 -1.820 4.471 878 HA VAL 115 HA VAL 115 0.860 -2.280 7.083 879 HB VAL 115 HB VAL 115 0.810 -0.086 5.166 880 1HG1 VAL 115 HG11 VAL 115 -1.673 -0.376 6.843 881 2HG1 VAL 115 HG12 VAL 115 -1.619 -0.829 5.139 882 3HG1 VAL 115 HG13 VAL 115 -1.317 0.841 5.618 883 1HG2 VAL 115 HG21 VAL 115 1.110 1.203 7.037 884 2HG2 VAL 115 HG22 VAL 115 1.747 -0.345 7.593 885 3HG2 VAL 115 HG23 VAL 115 0.120 0.156 8.053 886 H ASP 116 HN ASP 116 -0.498 -2.296 3.791 887 HA ASP 116 HA ASP 116 -3.063 -3.190 4.451 888 1HB ASP 116 HB1 ASP 116 -3.193 -2.674 2.264 889 2HB ASP 116 HB2 ASP 116 -1.459 -2.876 2.041 890 H GLU 117 HN GLU 117 -0.073 -4.943 3.841 891 HA GLU 117 HA GLU 117 -1.283 -7.544 3.955 892 1HB GLU 117 HB1 GLU 117 1.521 -6.490 3.931 893 2HB GLU 117 HB2 GLU 117 1.243 -8.147 4.445 894 1HG GLU 117 HG2 GLU 117 -0.220 -7.845 2.086 895 2HG GLU 117 HG1 GLU 117 1.324 -7.043 1.798 896 H ALA 118 HN ALA 118 0.147 -5.289 6.208 897 HA ALA 118 HA ALA 118 0.336 -7.055 8.419 898 1HB ALA 118 HB1 ALA 118 1.429 -4.764 8.178 899 2HB ALA 118 HB2 ALA 118 0.747 -5.179 9.752 900 3HB ALA 118 HB3 ALA 118 -0.133 -4.104 8.664 901 H VAL 119 HN VAL 119 -2.232 -5.218 6.959 902 HA VAL 119 HA VAL 119 -4.117 -5.214 9.026 903 HB VAL 119 HB VAL 119 -4.754 -5.626 6.122 904 1HG1 VAL 119 HG11 VAL 119 -6.545 -5.920 7.859 905 2HG1 VAL 119 HG12 VAL 119 -6.865 -4.673 6.649 906 3HG1 VAL 119 HG13 VAL 119 -6.326 -4.214 8.264 907 1HG2 VAL 119 HG21 VAL 119 -4.844 -2.909 7.198 908 2HG2 VAL 119 HG22 VAL 119 -4.270 -3.493 5.638 909 3HG2 VAL 119 HG23 VAL 119 -3.224 -3.587 7.054 910 H ALA 120 HN ALA 120 -3.600 -7.509 6.399 911 HA ALA 120 HA ALA 120 -5.469 -9.429 7.097 912 1HB ALA 120 HB1 ALA 120 -4.614 -10.437 5.317 913 2HB ALA 120 HB2 ALA 120 -3.053 -10.640 6.116 914 3HB ALA 120 HB3 ALA 120 -3.408 -9.147 5.235 915 H VAL 121 HN VAL 121 -2.443 -8.613 8.515 916 HA VAL 121 HA VAL 121 -2.249 -11.037 10.093 917 HB VAL 121 HB VAL 121 -0.571 -8.573 9.764 918 1HG1 VAL 121 HG21 VAL 121 0.771 -10.266 11.553 919 2HG1 VAL 121 HG22 VAL 121 -0.846 -10.020 12.213 920 3HG1 VAL 121 HG23 VAL 121 0.176 -8.631 11.840 921 1HG2 VAL 121 HG11 VAL 121 0.294 -11.445 9.689 922 2HG2 VAL 121 HG12 VAL 121 1.060 -10.037 8.952 923 3HG2 VAL 121 HG13 VAL 121 -0.453 -10.663 8.293 924 H LEU 122 HN LEU 122 -3.269 -7.712 10.412 925 HA LEU 122 HA LEU 122 -3.469 -7.682 13.251 926 1HB LEU 122 HB2 LEU 122 -3.736 -5.511 12.863 927 2HB LEU 122 HB1 LEU 122 -3.765 -5.833 11.141 928 HG LEU 122 HG LEU 122 -6.353 -6.410 11.906 929 1HD1 LEU 122 HD11 LEU 122 -5.958 -5.529 14.140 930 2HD1 LEU 122 HD12 LEU 122 -7.088 -4.510 13.248 931 3HD1 LEU 122 HD13 LEU 122 -5.410 -4.001 13.450 932 1HD2 LEU 122 HD21 LEU 122 -6.078 -5.248 9.943 933 2HD2 LEU 122 HD22 LEU 122 -5.006 -4.054 10.674 934 3HD2 LEU 122 HD23 LEU 122 -6.738 -4.003 11.003 935 H GLN 123 HN GLN 123 -5.655 -8.409 10.605 936 HA GLN 123 HA GLN 123 -7.969 -8.773 12.254 937 1HB GLN 123 HB2 GLN 123 -8.813 -9.960 10.125 938 2HB GLN 123 HB1 GLN 123 -8.449 -8.247 10.020 939 1HG GLN 123 HG1 GLN 123 -7.072 -8.594 8.360 940 2HG GLN 123 HG2 GLN 123 -6.092 -9.646 9.377 941 1HE2 GLN 123 HE21 GLN 123 -8.338 -9.469 6.811 942 2HE2 GLN 123 HE22 GLN 123 -8.436 -11.161 6.473 943 H ALA 124 HN ALA 124 -5.301 -10.647 11.184 944 HA ALA 124 HA ALA 124 -6.451 -13.190 11.999 945 1HB ALA 124 HB1 ALA 124 -4.226 -14.091 11.317 946 2HB ALA 124 HB2 ALA 124 -3.747 -12.446 10.900 947 3HB ALA 124 HB3 ALA 124 -5.075 -13.223 10.036 948 H HIS 125 HN HIS 125 -5.227 -10.686 13.664 949 HA HIS 125 HA HIS 125 -4.152 -12.480 15.731 950 1HB HIS 125 HB1 HIS 125 -2.753 -10.428 14.440 951 2HB HIS 125 HB2 HIS 125 -3.199 -9.750 16.002 952 HD2 HIS 125 HD2 HIS 125 -1.638 -10.496 18.063 953 HE1 HIS 125 HE1 HIS 125 0.364 -13.651 16.073 954 HE2 HIS 125 HE2 HIS 125 0.248 -12.273 18.200 955 H GLN 126 HN GLN 126 -6.189 -9.827 14.886 956 HA GLN 126 HA GLN 126 -6.868 -9.225 17.652 957 1HB GLN 126 HB1 GLN 126 -7.652 -8.018 15.010 958 2HB GLN 126 HB2 GLN 126 -8.486 -7.592 16.499 959 1HG GLN 126 HG2 GLN 126 -5.510 -7.378 16.280 960 2HG GLN 126 HG1 GLN 126 -6.566 -6.098 15.686 961 1HE2 GLN 126 HE22 GLN 126 -4.610 -6.391 17.991 962 2HE2 GLN 126 HE21 GLN 126 -5.489 -5.798 19.355 963 H ALA 127 HN ALA 127 -9.011 -9.581 14.848 964 HA ALA 127 HA ALA 127 -11.057 -10.726 16.516 965 1HB ALA 127 HB1 ALA 127 -12.490 -10.532 14.605 966 2HB ALA 127 HB2 ALA 127 -11.108 -10.293 13.536 967 3HB ALA 127 HB3 ALA 127 -11.521 -9.064 14.732 968 H LYS 128 HN LYS 128 -8.447 -12.183 15.396 969 HA LYS 128 HA LYS 128 -9.472 -14.439 13.987 970 1HB LYS 128 HB2 LYS 128 -7.275 -15.469 14.537 971 2HB LYS 128 HB1 LYS 128 -7.118 -13.873 13.810 972 1HG LYS 128 HG1 LYS 128 -5.965 -13.157 15.560 973 2HG LYS 128 HG2 LYS 128 -7.246 -13.654 16.666 974 1HD LYS 128 HD2 LYS 128 -6.240 -15.630 17.166 975 2HD LYS 128 HD1 LYS 128 -5.534 -15.799 15.556 976 1HE LYS 128 HE2 LYS 128 -3.778 -14.299 16.065 977 2HE LYS 128 HE1 LYS 128 -4.573 -13.758 17.543 978 1HZ LYS 128 HZ1 LYS 128 -2.718 -15.308 17.938 979 2HZ LYS 128 HZ2 LYS 128 -3.559 -16.512 17.099 980 3HZ LYS 128 HZ3 LYS 128 -4.191 -15.886 18.538 981 H GLU 129 HN GLU 129 -7.974 -16.384 15.652 982 HA GLU 129 HA GLU 129 -10.109 -17.030 17.531 983 1HB GLU 129 HB2 GLU 129 -8.229 -18.543 15.995 984 2HB GLU 129 HB1 GLU 129 -7.937 -18.873 17.697 985 1HG GLU 129 HG2 GLU 129 -9.519 -20.426 17.425 986 2HG GLU 129 HG1 GLU 129 -10.628 -19.069 17.608 987 H ALA 130 HN ALA 130 -8.230 -14.769 17.779 988 HA ALA 130 HA ALA 130 -6.329 -15.334 19.788 989 1HB ALA 130 HB1 ALA 130 -6.724 -13.284 18.067 990 2HB ALA 130 HB2 ALA 130 -5.650 -13.216 19.466 991 3HB ALA 130 HB3 ALA 130 -7.284 -12.566 19.578 992 H ALA 131 HN ALA 131 -9.296 -15.945 20.288 993 HA ALA 131 HA ALA 131 -9.946 -14.255 22.543 994 1HB ALA 131 HB1 ALA 131 -11.411 -16.755 21.789 995 2HB ALA 131 HB2 ALA 131 -11.595 -15.268 20.861 996 3HB ALA 131 HB3 ALA 131 -12.027 -15.299 22.570 997 H GLN 132 HN GLN 132 -7.514 -15.684 22.831 998 HA GLN 132 HA GLN 132 -7.972 -17.954 24.541 999 1HB GLN 132 HB2 GLN 132 -5.478 -16.389 23.863 1000 2HB GLN 132 HB1 GLN 132 -5.486 -17.796 24.917 1001 1HG GLN 132 HG1 GLN 132 -6.396 -19.138 23.053 1002 2HG GLN 132 HG2 GLN 132 -6.255 -17.723 22.010 1003 1HE2 GLN 132 HE21 GLN 132 -4.956 -20.403 21.972 1004 2HE2 GLN 132 HE22 GLN 132 -3.261 -20.075 21.901 1005 H LYS 133 HN LYS 133 -5.931 -15.157 25.300 1006 HA LYS 133 HA LYS 133 -6.747 -15.293 28.070 1007 1HB LYS 133 HB2 LYS 133 -5.023 -13.088 27.040 1008 2HB LYS 133 HB1 LYS 133 -4.912 -13.984 28.548 1009 1HG LYS 133 HG2 LYS 133 -3.567 -15.550 27.668 1010 2HG LYS 133 HG1 LYS 133 -4.426 -15.570 26.126 1011 1HD LYS 133 HD2 LYS 133 -2.385 -14.682 25.515 1012 2HD LYS 133 HD1 LYS 133 -3.339 -13.226 25.802 1013 1HE LYS 133 HE1 LYS 133 -2.414 -13.343 28.197 1014 2HE LYS 133 HE2 LYS 133 -1.224 -14.460 27.530 1015 1HZ LYS 133 HZ1 LYS 133 -0.300 -12.288 27.485 1016 2HZ LYS 133 HZ2 LYS 133 -1.671 -11.638 26.739 1017 3HZ LYS 133 HZ3 LYS 133 -0.667 -12.701 25.887 1018 H ALA 134 HN ALA 134 -6.554 -12.596 25.739 1019 HA ALA 134 HA ALA 134 -8.332 -10.954 27.234 1020 1HB ALA 134 HB1 ALA 134 -6.674 -9.931 25.830 1021 2HB ALA 134 HB2 ALA 134 -8.274 -9.485 25.235 1022 3HB ALA 134 HB3 ALA 134 -7.336 -10.723 24.399 1023 H VAL 135 HN VAL 135 -10.456 -11.190 27.386 1024 HA VAL 135 HA VAL 135 -11.895 -12.710 25.348 1025 HB VAL 135 HB VAL 135 -13.116 -11.624 27.870 1026 1HG1 VAL 135 HG11 VAL 135 -14.905 -12.729 27.165 1027 2HG1 VAL 135 HG12 VAL 135 -13.983 -14.231 27.119 1028 3HG1 VAL 135 HG13 VAL 135 -14.036 -13.185 25.700 1029 1HG2 VAL 135 HG21 VAL 135 -12.465 -13.570 29.082 1030 2HG2 VAL 135 HG22 VAL 135 -11.003 -12.870 28.389 1031 3HG2 VAL 135 HG23 VAL 135 -11.735 -14.293 27.648 1032 H ASN 136 HN ASN 136 -12.195 -9.607 27.073 1033 HA ASN 136 HA ASN 136 -14.288 -8.652 25.385 1034 1HB ASN 136 HB1 ASN 136 -13.490 -6.389 26.493 1035 2HB ASN 136 HB2 ASN 136 -14.360 -7.597 27.434 1036 1HD2 ASN 136 HD21 ASN 136 -13.428 -8.426 29.187 1037 2HD2 ASN 136 HD22 ASN 136 -11.800 -8.128 29.681 1038 H SER 137 HN SER 137 -13.856 -8.419 23.274 1039 HA SER 137 HA SER 137 -11.331 -7.173 22.462 1040 1HB SER 137 HB1 SER 137 -12.598 -7.848 20.127 1041 2HB SER 137 HB2 SER 137 -11.464 -8.887 20.988 1042 HG SER 137 HG SER 137 -13.729 -9.666 20.402 1043 H ALA 138 HN ALA 138 -12.855 -5.342 23.642 1044 HA ALA 138 HA ALA 138 -14.732 -4.020 21.993 1045 1HB ALA 138 HB1 ALA 138 -13.834 -3.754 24.601 1046 2HB ALA 138 HB2 ALA 138 -15.051 -2.761 23.799 1047 3HB ALA 138 HB3 ALA 138 -13.365 -2.243 23.822 1048 H THR 139 HN THR 139 -14.373 -2.970 20.165 1049 HA THR 139 HA THR 139 -11.684 -2.057 19.514 1050 HB THR 139 HB THR 139 -13.370 -1.403 17.390 1051 HG1 THR 139 HG1 THR 139 -15.013 -2.642 18.435 1052 1HG2 THR 139 HG21 THR 139 -12.447 -4.002 16.903 1053 2HG2 THR 139 HG22 THR 139 -11.221 -3.208 17.892 1054 3HG2 THR 139 HG23 THR 139 -11.738 -2.477 16.374 1055 H GLY 140 HN GLY 140 -11.773 0.081 18.084 1056 1HA GLY 140 HA2 GLY 140 -12.729 2.130 19.916 1057 2HA GLY 140 HA1 GLY 140 -11.650 2.374 18.552 1058 H VAL 141 HN VAL 141 -14.578 3.173 19.677 1059 HA VAL 141 HA VAL 141 -16.102 2.897 17.236 1060 HB VAL 141 HB VAL 141 -16.947 4.616 19.542 1061 1HG1 VAL 141 HG21 VAL 141 -19.008 2.986 18.506 1062 2HG1 VAL 141 HG22 VAL 141 -18.131 3.660 17.132 1063 3HG1 VAL 141 HG23 VAL 141 -18.817 4.732 18.354 1064 1HG2 VAL 141 HG11 VAL 141 -18.102 2.281 20.179 1065 2HG2 VAL 141 HG12 VAL 141 -16.568 2.818 20.864 1066 3HG2 VAL 141 HG13 VAL 141 -16.581 1.685 19.512 1067 HA PRO 142 HA PRO 142 -15.593 7.798 17.425 1068 1HB PRO 142 HB2 PRO 142 -12.920 7.876 18.722 1069 2HB PRO 142 HB1 PRO 142 -14.287 8.981 18.892 1070 1HG PRO 142 HG2 PRO 142 -13.690 7.249 20.825 1071 2HG PRO 142 HG1 PRO 142 -15.378 7.606 20.410 1072 1HD PRO 142 HD2 PRO 142 -13.717 5.217 19.720 1073 2HD PRO 142 HD1 PRO 142 -15.434 5.309 20.163 1074 H THR 143 HN THR 143 -14.591 8.914 15.760 1075 HA THR 143 HA THR 143 -12.649 7.344 14.214 1076 HB THR 143 HB THR 143 -13.457 8.382 12.266 1077 HG1 THR 143 HG1 THR 143 -13.815 10.433 12.354 1078 1HG2 THR 143 HG21 THR 143 -15.153 6.883 13.300 1079 2HG2 THR 143 HG22 THR 143 -15.811 8.115 12.221 1080 3HG2 THR 143 HG23 THR 143 -15.928 8.320 13.969 1081 H VAL 144 HN VAL 144 -13.265 10.571 15.500 1082 HA VAL 144 HA VAL 144 -11.925 12.372 15.862 1083 HB VAL 144 HB VAL 144 -9.583 10.480 15.787 1084 1HG1 VAL 144 HG11 VAL 144 -8.977 12.802 15.962 1085 2HG1 VAL 144 HG12 VAL 144 -8.718 12.027 17.524 1086 3HG1 VAL 144 HG13 VAL 144 -10.134 13.046 17.270 1087 1HG2 VAL 144 HG21 VAL 144 -9.983 9.874 18.050 1088 2HG2 VAL 144 HG22 VAL 144 -11.483 9.587 17.167 1089 3HG2 VAL 144 HG23 VAL 144 -11.320 11.017 18.187 Start of MODEL 4 1 1H GLY 1 HT1 GLY 1 -4.697 -46.284 34.525 2 2H GLY 1 HT2 GLY 1 -5.777 -46.598 33.261 3 3H GLY 1 HT3 GLY 1 -4.601 -45.394 33.091 4 1HA GLY 1 HA2 GLY 1 -2.868 -46.893 32.871 5 2HA GLY 1 HA1 GLY 1 -3.808 -48.186 33.598 6 HA PRO 2 HA PRO 2 -3.956 -48.479 28.901 7 1HB PRO 2 HB2 PRO 2 -2.774 -50.898 28.646 8 2HB PRO 2 HB1 PRO 2 -1.854 -49.391 28.688 9 1HG PRO 2 HG2 PRO 2 -2.355 -51.370 30.879 10 2HG PRO 2 HG1 PRO 2 -0.852 -50.533 30.451 11 1HD PRO 2 HD2 PRO 2 -2.449 -49.740 32.499 12 2HD PRO 2 HD1 PRO 2 -1.463 -48.608 31.553 13 H LEU 3 HN LEU 3 -4.995 -50.234 31.623 14 HA LEU 3 HA LEU 3 -6.639 -52.083 30.083 15 1HB LEU 3 HB2 LEU 3 -5.358 -52.365 32.459 16 2HB LEU 3 HB1 LEU 3 -6.964 -51.935 33.011 17 HG LEU 3 HG LEU 3 -7.601 -53.851 31.223 18 1HD1 LEU 3 HD11 LEU 3 -5.885 -55.710 31.854 19 2HD1 LEU 3 HD12 LEU 3 -4.788 -54.349 32.084 20 3HD1 LEU 3 HD13 LEU 3 -5.550 -54.613 30.515 21 1HD2 LEU 3 HD21 LEU 3 -7.123 -55.339 33.478 22 2HD2 LEU 3 HD22 LEU 3 -8.563 -54.368 33.169 23 3HD2 LEU 3 HD23 LEU 3 -7.230 -53.695 34.109 24 H GLY 4 HN GLY 4 -7.364 -50.037 32.913 25 1HA GLY 4 HA2 GLY 4 -10.076 -49.666 31.908 26 2HA GLY 4 HA1 GLY 4 -9.484 -49.211 33.498 27 H SER 5 HN SER 5 -10.404 -48.085 30.488 28 HA SER 5 HA SER 5 -8.762 -45.693 30.525 29 1HB SER 5 HB2 SER 5 -9.518 -46.908 28.407 30 2HB SER 5 HB1 SER 5 -11.116 -46.226 28.710 31 HG SER 5 HG SER 5 -9.903 -44.138 28.809 32 H ALA 6 HN ALA 6 -9.445 -43.639 31.001 33 HA ALA 6 HA ALA 6 -11.725 -43.436 32.752 34 1HB ALA 6 HB1 ALA 6 -9.338 -41.882 32.199 35 2HB ALA 6 HB2 ALA 6 -10.305 -41.985 33.670 36 3HB ALA 6 HB3 ALA 6 -10.772 -40.872 32.383 37 H ALA 7 HN ALA 7 -13.587 -42.260 32.433 38 HA ALA 7 HA ALA 7 -14.225 -41.670 29.638 39 1HB ALA 7 HB1 ALA 7 -16.594 -41.452 30.689 40 2HB ALA 7 HB2 ALA 7 -15.863 -42.297 32.054 41 3HB ALA 7 HB3 ALA 7 -15.881 -43.048 30.459 42 H ALA 8 HN ALA 8 -12.679 -39.742 30.143 43 HA ALA 8 HA ALA 8 -14.356 -37.414 30.403 44 1HB ALA 8 HB1 ALA 8 -13.614 -38.122 32.767 45 2HB ALA 8 HB2 ALA 8 -13.426 -36.433 32.294 46 3HB ALA 8 HB3 ALA 8 -12.031 -37.512 32.287 47 H ALA 9 HN ALA 9 -13.332 -35.482 29.682 48 HA ALA 9 HA ALA 9 -10.853 -35.971 28.164 49 1HB ALA 9 HB1 ALA 9 -13.090 -35.492 26.944 50 2HB ALA 9 HB2 ALA 9 -11.624 -34.668 26.417 51 3HB ALA 9 HB3 ALA 9 -12.795 -33.822 27.428 52 H THR 10 HN THR 10 -9.142 -34.943 28.937 53 HA THR 10 HA THR 10 -9.263 -32.990 30.959 54 HB THR 10 HB THR 10 -6.887 -33.386 29.154 55 HG1 THR 10 HG1 THR 10 -6.397 -35.219 30.237 56 1HG2 THR 10 HG21 THR 10 -7.289 -32.005 31.591 57 2HG2 THR 10 HG22 THR 10 -5.802 -32.211 30.667 58 3HG2 THR 10 HG23 THR 10 -6.242 -33.390 31.902 59 HA PRO 11 HA PRO 11 -8.021 -29.851 27.348 60 1HB PRO 11 HB1 PRO 11 -9.592 -31.164 25.189 61 2HB PRO 11 HB2 PRO 11 -8.056 -30.298 25.095 62 1HG PRO 11 HG2 PRO 11 -8.123 -32.952 24.936 63 2HG PRO 11 HG1 PRO 11 -6.828 -32.128 25.826 64 1HD PRO 11 HD2 PRO 11 -9.235 -33.560 26.872 65 2HD PRO 11 HD1 PRO 11 -7.582 -33.514 27.515 66 H ALA 12 HN ALA 12 -9.251 -28.148 27.797 67 HA ALA 12 HA ALA 12 -12.090 -28.444 28.245 68 1HB ALA 12 HB1 ALA 12 -12.016 -26.141 29.007 69 2HB ALA 12 HB2 ALA 12 -10.367 -25.975 28.404 70 3HB ALA 12 HB3 ALA 12 -10.710 -27.072 29.741 71 H VAL 13 HN VAL 13 -10.019 -27.356 25.705 72 HA VAL 13 HA VAL 13 -12.097 -25.843 24.362 73 HB VAL 13 HB VAL 13 -9.539 -26.621 23.021 74 1HG1 VAL 13 HG11 VAL 13 -11.411 -24.274 22.944 75 2HG1 VAL 13 HG12 VAL 13 -10.981 -25.384 21.642 76 3HG1 VAL 13 HG13 VAL 13 -9.800 -24.213 22.229 77 1HG2 VAL 13 HG21 VAL 13 -9.790 -25.018 25.472 78 2HG2 VAL 13 HG22 VAL 13 -8.861 -24.266 24.175 79 3HG2 VAL 13 HG23 VAL 13 -8.389 -25.849 24.794 80 H ARG 14 HN ARG 14 -13.708 -27.322 23.890 81 HA ARG 14 HA ARG 14 -13.028 -29.687 22.324 82 1HB ARG 14 HB2 ARG 14 -15.380 -30.311 22.615 83 2HB ARG 14 HB1 ARG 14 -14.626 -29.946 24.160 84 1HG ARG 14 HG1 ARG 14 -15.783 -27.558 23.129 85 2HG ARG 14 HG2 ARG 14 -16.980 -28.853 23.057 86 1HD ARG 14 HD2 ARG 14 -16.112 -29.339 25.492 87 2HD ARG 14 HD1 ARG 14 -15.622 -27.647 25.417 88 HE ARG 14 HE ARG 14 -18.352 -28.680 25.392 89 1HH1 ARG 14 HH11 ARG 14 -16.191 -25.949 25.224 90 2HH1 ARG 14 HH12 ARG 14 -17.428 -24.786 25.568 91 1HH2 ARG 14 HH21 ARG 14 -19.986 -27.154 25.845 92 2HH2 ARG 14 HH22 ARG 14 -19.584 -25.471 25.921 93 H THR 15 HN THR 15 -14.131 -30.170 20.329 94 HA THR 15 HA THR 15 -14.378 -27.813 18.653 95 HB THR 15 HB THR 15 -14.885 -30.475 17.479 96 HG1 THR 15 HG1 THR 15 -12.248 -29.876 18.260 97 1HG2 THR 15 HG21 THR 15 -13.105 -29.704 15.906 98 2HG2 THR 15 HG22 THR 15 -13.084 -28.178 16.789 99 3HG2 THR 15 HG23 THR 15 -14.552 -28.698 15.960 100 H VAL 16 HN VAL 16 -16.184 -27.369 17.320 101 HA VAL 16 HA VAL 16 -18.712 -28.345 18.450 102 HB VAL 16 HB VAL 16 -18.587 -25.978 18.595 103 1HG1 VAL 16 HG21 VAL 16 -16.801 -25.561 17.021 104 2HG1 VAL 16 HG22 VAL 16 -18.185 -24.540 16.635 105 3HG1 VAL 16 HG23 VAL 16 -17.856 -25.978 15.671 106 1HG2 VAL 16 HG11 VAL 16 -20.734 -26.988 17.785 107 2HG2 VAL 16 HG12 VAL 16 -20.260 -26.518 16.152 108 3HG2 VAL 16 HG13 VAL 16 -20.514 -25.284 17.386 109 HA PRO 17 HA PRO 17 -19.046 -30.587 14.564 110 1HB PRO 17 HB1 PRO 17 -21.195 -32.066 15.231 111 2HB PRO 17 HB2 PRO 17 -19.583 -32.415 15.865 112 1HG PRO 17 HG2 PRO 17 -21.859 -30.966 17.164 113 2HG PRO 17 HG1 PRO 17 -20.764 -32.177 17.856 114 1HD PRO 17 HD2 PRO 17 -20.471 -29.493 18.245 115 2HD PRO 17 HD1 PRO 17 -19.112 -30.632 18.255 116 H GLN 18 HN GLN 18 -19.648 -28.888 13.203 117 HA GLN 18 HA GLN 18 -22.413 -27.968 13.249 118 1HB GLN 18 HB2 GLN 18 -20.102 -27.147 11.477 119 2HB GLN 18 HB1 GLN 18 -21.686 -26.385 11.506 120 1HG GLN 18 HG1 GLN 18 -20.951 -26.258 14.129 121 2HG GLN 18 HG2 GLN 18 -19.407 -26.062 13.301 122 1HE2 GLN 18 HE21 GLN 18 -18.920 -23.995 13.226 123 2HE2 GLN 18 HE22 GLN 18 -19.997 -22.708 12.815 124 H TYR 19 HN TYR 19 -23.671 -29.601 12.478 125 HA TYR 19 HA TYR 19 -22.950 -31.141 10.170 126 1HB TYR 19 HB2 TYR 19 -25.449 -31.860 10.402 127 2HB TYR 19 HB1 TYR 19 -24.287 -32.359 11.627 128 HD1 TYR 19 HD1 TYR 19 -27.033 -30.005 10.887 129 HD2 TYR 19 HD2 TYR 19 -24.480 -31.621 13.882 130 HE1 TYR 19 HE1 TYR 19 -28.435 -28.981 12.628 131 HE2 TYR 19 HE2 TYR 19 -25.875 -30.603 15.631 132 HH TYR 19 HH TYR 19 -28.631 -28.533 14.810 133 H LYS 20 HN LYS 20 -23.887 -28.035 10.417 134 HA LYS 20 HA LYS 20 -25.806 -27.941 8.263 135 1HB LYS 20 HB2 LYS 20 -24.455 -25.926 10.011 136 2HB LYS 20 HB1 LYS 20 -25.181 -25.387 8.504 137 1HG LYS 20 HG2 LYS 20 -26.828 -27.084 10.294 138 2HG LYS 20 HG1 LYS 20 -26.518 -25.416 10.785 139 1HD LYS 20 HD2 LYS 20 -27.191 -24.996 8.229 140 2HD LYS 20 HD1 LYS 20 -28.117 -26.469 8.528 141 1HE LYS 20 HE1 LYS 20 -29.648 -24.908 9.187 142 2HE LYS 20 HE2 LYS 20 -28.814 -25.174 10.717 143 1HZ LYS 20 HZ1 LYS 20 -28.153 -22.993 8.814 144 2HZ LYS 20 HZ2 LYS 20 -27.516 -23.213 10.367 145 3HZ LYS 20 HZ3 LYS 20 -29.147 -22.806 10.171 146 H TYR 21 HN TYR 21 -24.351 -29.144 6.779 147 HA TYR 21 HA TYR 21 -22.047 -27.737 5.752 148 1HB TYR 21 HB1 TYR 21 -23.346 -30.373 5.259 149 2HB TYR 21 HB2 TYR 21 -22.349 -29.703 3.971 150 HD1 TYR 21 HD1 TYR 21 -22.329 -30.867 7.475 151 HD2 TYR 21 HD2 TYR 21 -19.974 -29.679 4.138 152 HE1 TYR 21 HE1 TYR 21 -20.315 -31.711 8.605 153 HE2 TYR 21 HE2 TYR 21 -17.953 -30.519 5.257 154 HH TYR 21 HH TYR 21 -17.673 -31.073 8.376 155 H ALA 22 HN ALA 22 -22.356 -26.003 4.519 156 HA ALA 22 HA ALA 22 -24.725 -25.579 2.979 157 1HB ALA 22 HB1 ALA 22 -23.488 -23.567 2.142 158 2HB ALA 22 HB2 ALA 22 -22.118 -24.083 3.125 159 3HB ALA 22 HB3 ALA 22 -23.650 -23.665 3.895 160 H ALA 23 HN ALA 23 -25.113 -25.957 0.874 161 HA ALA 23 HA ALA 23 -23.353 -27.671 -0.582 162 1HB ALA 23 HB1 ALA 23 -25.384 -26.567 -2.262 163 2HB ALA 23 HB2 ALA 23 -26.078 -26.975 -0.693 164 3HB ALA 23 HB3 ALA 23 -25.232 -28.207 -1.630 165 H GLY 24 HN GLY 24 -23.363 -26.949 -3.153 166 1HA GLY 24 HA1 GLY 24 -21.398 -24.858 -3.223 167 2HA GLY 24 HA2 GLY 24 -21.990 -25.778 -4.597 168 H VAL 25 HN VAL 25 -22.621 -23.030 -2.500 169 HA VAL 25 HA VAL 25 -24.619 -22.026 -4.402 170 HB VAL 25 HB VAL 25 -25.056 -20.288 -2.634 171 1HG1 VAL 25 HG21 VAL 25 -25.839 -22.354 -0.994 172 2HG1 VAL 25 HG22 VAL 25 -25.685 -23.129 -2.571 173 3HG1 VAL 25 HG23 VAL 25 -26.741 -21.730 -2.376 174 1HG2 VAL 25 HG11 VAL 25 -22.865 -20.511 -1.502 175 2HG2 VAL 25 HG12 VAL 25 -23.366 -22.095 -0.911 176 3HG2 VAL 25 HG13 VAL 25 -24.233 -20.647 -0.398 177 H ARG 26 HN ARG 26 -24.557 -19.485 -4.481 178 HA ARG 26 HA ARG 26 -21.935 -18.808 -5.542 179 1HB ARG 26 HB1 ARG 26 -24.219 -18.360 -6.681 180 2HB ARG 26 HB2 ARG 26 -24.336 -16.999 -5.576 181 1HG ARG 26 HG2 ARG 26 -21.785 -16.834 -6.714 182 2HG ARG 26 HG1 ARG 26 -22.885 -17.227 -8.037 183 1HD ARG 26 HD1 ARG 26 -22.539 -14.769 -7.571 184 2HD ARG 26 HD2 ARG 26 -24.212 -15.320 -7.635 185 HE ARG 26 HE ARG 26 -22.735 -14.720 -5.156 186 1HH1 ARG 26 HH11 ARG 26 -25.701 -14.991 -6.963 187 2HH1 ARG 26 HH12 ARG 26 -26.689 -14.371 -5.684 188 1HH2 ARG 26 HH21 ARG 26 -24.029 -13.900 -3.465 189 2HH2 ARG 26 HH22 ARG 26 -25.739 -13.750 -3.696 190 H ASN 27 HN ASN 27 -20.480 -17.673 -4.459 191 HA ASN 27 HA ASN 27 -21.277 -16.337 -1.984 192 1HB ASN 27 HB2 ASN 27 -18.534 -17.007 -3.078 193 2HB ASN 27 HB1 ASN 27 -18.842 -16.253 -1.517 194 1HD2 ASN 27 HD21 ASN 27 -17.472 -18.314 -1.124 195 2HD2 ASN 27 HD22 ASN 27 -18.379 -19.713 -0.673 196 HA PRO 28 HA PRO 28 -21.151 -12.230 -3.586 197 1HB PRO 28 HB1 PRO 28 -19.627 -11.545 -1.124 198 2HB PRO 28 HB2 PRO 28 -21.111 -10.833 -1.764 199 1HG PRO 28 HG2 PRO 28 -21.188 -12.466 0.337 200 2HG PRO 28 HG1 PRO 28 -22.448 -12.527 -0.910 201 1HD PRO 28 HD2 PRO 28 -20.143 -14.374 -0.449 202 2HD PRO 28 HD1 PRO 28 -21.801 -14.745 -0.966 203 H GLN 29 HN GLN 29 -18.171 -12.472 -1.658 204 HA GLN 29 HA GLN 29 -16.662 -11.351 -3.875 205 1HB GLN 29 HB2 GLN 29 -15.774 -12.068 -1.073 206 2HB GLN 29 HB1 GLN 29 -14.822 -11.184 -2.258 207 1HG GLN 29 HG1 GLN 29 -16.785 -9.514 -2.257 208 2HG GLN 29 HG2 GLN 29 -17.239 -10.296 -0.743 209 1HE2 GLN 29 HE21 GLN 29 -14.202 -9.228 -2.243 210 2HE2 GLN 29 HE22 GLN 29 -13.636 -8.346 -0.869 211 H GLN 30 HN GLN 30 -16.002 -12.730 -5.386 212 HA GLN 30 HA GLN 30 -15.205 -15.440 -4.611 213 1HB GLN 30 HB1 GLN 30 -16.873 -15.067 -6.460 214 2HB GLN 30 HB2 GLN 30 -15.579 -14.335 -7.398 215 1HG GLN 30 HG2 GLN 30 -14.385 -16.376 -7.515 216 2HG GLN 30 HG1 GLN 30 -15.430 -17.131 -6.312 217 1HE2 GLN 30 HE21 GLN 30 -17.311 -18.049 -6.937 218 2HE2 GLN 30 HE22 GLN 30 -17.849 -18.142 -8.575 219 H HIS 31 HN HIS 31 -14.036 -13.490 -7.326 220 HA HIS 31 HA HIS 31 -11.396 -13.231 -6.199 221 1HB HIS 31 HB2 HIS 31 -12.000 -15.552 -7.694 222 2HB HIS 31 HB1 HIS 31 -11.022 -14.527 -8.740 223 HD2 HIS 31 HD2 HIS 31 -8.511 -13.716 -7.461 224 HE1 HIS 31 HE1 HIS 31 -8.479 -17.245 -5.122 225 HE2 HIS 31 HE2 HIS 31 -7.098 -15.286 -5.952 226 H LEU 32 HN LEU 32 -13.847 -12.203 -8.136 227 HA LEU 32 HA LEU 32 -12.163 -10.705 -9.992 228 1HB LEU 32 HB2 LEU 32 -15.173 -10.745 -9.790 229 2HB LEU 32 HB1 LEU 32 -14.218 -10.088 -11.105 230 HG LEU 32 HG LEU 32 -14.106 -13.006 -10.383 231 1HD1 LEU 32 HD21 LEU 32 -15.867 -11.907 -12.542 232 2HD1 LEU 32 HD22 LEU 32 -16.463 -12.131 -10.898 233 3HD1 LEU 32 HD23 LEU 32 -15.869 -13.514 -11.817 234 1HD2 LEU 32 HD11 LEU 32 -12.321 -12.117 -11.801 235 2HD2 LEU 32 HD12 LEU 32 -13.528 -11.506 -12.933 236 3HD2 LEU 32 HD13 LEU 32 -13.353 -13.242 -12.684 237 H ASN 33 HN ASN 33 -11.231 -9.038 -8.930 238 HA ASN 33 HA ASN 33 -12.927 -7.312 -7.268 239 1HB ASN 33 HB2 ASN 33 -9.921 -7.558 -7.490 240 2HB ASN 33 HB1 ASN 33 -10.730 -6.326 -6.527 241 1HD2 ASN 33 HD22 ASN 33 -9.336 -9.303 -6.440 242 2HD2 ASN 33 HD21 ASN 33 -10.053 -9.912 -4.991 243 H ALA 34 HN ALA 34 -13.929 -5.880 -8.564 244 HA ALA 34 HA ALA 34 -12.714 -4.749 -10.891 245 1HB ALA 34 HB1 ALA 34 -15.131 -5.083 -10.730 246 2HB ALA 34 HB2 ALA 34 -14.732 -3.395 -11.048 247 3HB ALA 34 HB3 ALA 34 -15.209 -3.898 -9.426 248 H GLN 35 HN GLN 35 -10.785 -3.808 -10.112 249 HA GLN 35 HA GLN 35 -11.103 -1.467 -8.369 250 1HB GLN 35 HB2 GLN 35 -9.027 -3.470 -8.725 251 2HB GLN 35 HB1 GLN 35 -8.379 -1.841 -8.840 252 1HG GLN 35 HG1 GLN 35 -8.182 -2.412 -6.588 253 2HG GLN 35 HG2 GLN 35 -9.599 -1.368 -6.664 254 1HE2 GLN 35 HE21 GLN 35 -11.619 -2.215 -6.270 255 2HE2 GLN 35 HE22 GLN 35 -11.859 -3.789 -5.599 256 HA PRO 36 HA PRO 36 -9.870 0.228 -7.833 257 1HB PRO 36 HB2 PRO 36 -10.125 2.887 -7.940 258 2HB PRO 36 HB1 PRO 36 -8.606 2.093 -8.374 259 1HG PRO 36 HG1 PRO 36 -10.748 3.194 -10.148 260 2HG PRO 36 HG2 PRO 36 -8.988 3.286 -10.329 261 1HD PRO 36 HD1 PRO 36 -10.615 1.476 -11.640 262 2HD PRO 36 HD2 PRO 36 -8.878 1.255 -11.361 263 H GLN 37 HN GLN 37 -11.396 1.108 -6.290 264 HA GLN 37 HA GLN 37 -14.129 0.708 -7.135 265 1HB GLN 37 HB2 GLN 37 -13.207 1.557 -4.392 266 2HB GLN 37 HB1 GLN 37 -14.688 0.715 -4.824 267 1HG GLN 37 HG2 GLN 37 -13.356 -1.250 -5.469 268 2HG GLN 37 HG1 GLN 37 -11.896 -0.402 -4.958 269 1HE2 GLN 37 HE22 GLN 37 -12.639 0.774 -2.649 270 2HE2 GLN 37 HE21 GLN 37 -13.062 -0.417 -1.471 271 H VAL 38 HN VAL 38 -15.626 2.359 -5.628 272 HA VAL 38 HA VAL 38 -15.413 4.847 -7.058 273 HB VAL 38 HB VAL 38 -17.438 5.429 -5.524 274 1HG1 VAL 38 HG21 VAL 38 -18.909 4.507 -7.115 275 2HG1 VAL 38 HG22 VAL 38 -17.819 3.166 -7.465 276 3HG1 VAL 38 HG23 VAL 38 -17.402 4.799 -7.982 277 1HG2 VAL 38 HG11 VAL 38 -18.440 3.791 -4.305 278 2HG2 VAL 38 HG12 VAL 38 -16.768 3.247 -4.161 279 3HG2 VAL 38 HG13 VAL 38 -17.841 2.497 -5.343 280 H THR 39 HN THR 39 -14.014 6.349 -6.420 281 HA THR 39 HA THR 39 -13.471 6.685 -3.559 282 HB THR 39 HB THR 39 -11.946 8.304 -5.493 283 HG1 THR 39 HG1 THR 39 -11.347 5.560 -5.387 284 1HG2 THR 39 HG21 THR 39 -11.074 6.424 -3.316 285 2HG2 THR 39 HG22 THR 39 -11.286 8.167 -3.154 286 3HG2 THR 39 HG23 THR 39 -10.036 7.524 -4.222 287 H MET 40 HN MET 40 -14.162 8.401 -2.451 288 HA MET 40 HA MET 40 -15.845 10.337 -3.790 289 1HB MET 40 HB1 MET 40 -16.140 9.166 -1.432 290 2HB MET 40 HB2 MET 40 -15.176 10.531 -0.886 291 1HG MET 40 HG2 MET 40 -17.265 11.381 -0.607 292 2HG MET 40 HG1 MET 40 -16.937 11.911 -2.255 293 1HE MET 40 HE1 MET 40 -20.804 10.888 -1.796 294 2HE MET 40 HE2 MET 40 -19.633 12.123 -1.330 295 3HE MET 40 HE3 MET 40 -19.893 10.718 -0.295 296 H GLN 41 HN GLN 41 -15.642 12.682 -3.092 297 HA GLN 41 HA GLN 41 -12.952 13.552 -3.701 298 1HB GLN 41 HB2 GLN 41 -14.084 15.861 -3.561 299 2HB GLN 41 HB1 GLN 41 -14.562 14.785 -4.866 300 1HG GLN 41 HG1 GLN 41 -16.639 14.405 -3.983 301 2HG GLN 41 HG2 GLN 41 -16.120 14.746 -2.333 302 1HE2 GLN 41 HE21 GLN 41 -17.839 15.895 -4.906 303 2HE2 GLN 41 HE22 GLN 41 -17.891 17.569 -4.485 304 H GLN 42 HN GLN 42 -11.488 14.226 -2.283 305 HA GLN 42 HA GLN 42 -12.384 15.041 0.399 306 1HB GLN 42 HB1 GLN 42 -11.192 12.659 -0.024 307 2HB GLN 42 HB2 GLN 42 -9.766 13.666 0.184 308 1HG GLN 42 HG1 GLN 42 -10.825 14.483 2.332 309 2HG GLN 42 HG2 GLN 42 -11.990 13.174 2.137 310 1HE2 GLN 42 HE21 GLN 42 -11.495 11.299 3.022 311 2HE2 GLN 42 HE22 GLN 42 -9.917 10.789 3.504 312 HA PRO 43 HA PRO 43 -9.824 18.460 -1.243 313 1HB PRO 43 HB2 PRO 43 -10.898 20.350 0.388 314 2HB PRO 43 HB1 PRO 43 -11.650 19.846 -1.130 315 1HG PRO 43 HG1 PRO 43 -12.277 18.991 1.672 316 2HG PRO 43 HG2 PRO 43 -13.389 19.417 0.359 317 1HD PRO 43 HD1 PRO 43 -12.846 16.854 1.011 318 2HD PRO 43 HD2 PRO 43 -13.173 17.355 -0.661 319 H ALA 44 HN ALA 44 -7.802 18.105 -0.487 320 HA ALA 44 HA ALA 44 -7.279 18.026 2.369 321 1HB ALA 44 HB1 ALA 44 -4.863 17.719 1.469 322 2HB ALA 44 HB2 ALA 44 -5.666 17.456 -0.080 323 3HB ALA 44 HB3 ALA 44 -6.031 16.409 1.292 324 H VAL 45 HN VAL 45 -8.166 20.406 2.201 325 HA VAL 45 HA VAL 45 -6.101 22.317 1.463 326 HB VAL 45 HB VAL 45 -7.814 24.007 2.264 327 1HG1 VAL 45 HG11 VAL 45 -8.031 22.204 -0.065 328 2HG1 VAL 45 HG12 VAL 45 -7.828 23.954 0.002 329 3HG1 VAL 45 HG13 VAL 45 -9.419 23.241 0.264 330 1HG2 VAL 45 HG21 VAL 45 -10.093 22.321 1.970 331 2HG2 VAL 45 HG22 VAL 45 -9.633 23.331 3.341 332 3HG2 VAL 45 HG23 VAL 45 -9.058 21.666 3.240 333 H HIS 46 HN HIS 46 -5.634 20.471 3.681 334 HA HIS 46 HA HIS 46 -5.757 22.162 6.049 335 1HB HIS 46 HB2 HIS 46 -4.939 19.298 5.583 336 2HB HIS 46 HB1 HIS 46 -4.654 20.108 7.120 337 HD2 HIS 46 HD2 HIS 46 -6.999 20.823 8.547 338 HE1 HIS 46 HE1 HIS 46 -9.463 18.238 6.274 339 HE2 HIS 46 HE2 HIS 46 -9.316 19.669 8.363 340 H VAL 47 HN VAL 47 -3.135 20.074 4.856 341 HA VAL 47 HA VAL 47 -1.231 22.194 5.570 342 HB VAL 47 HB VAL 47 -0.303 19.462 4.827 343 1HG1 VAL 47 HG21 VAL 47 1.523 20.685 5.380 344 2HG1 VAL 47 HG22 VAL 47 1.083 20.158 7.005 345 3HG1 VAL 47 HG23 VAL 47 0.617 21.763 6.441 346 1HG2 VAL 47 HG11 VAL 47 -1.776 20.141 7.356 347 2HG2 VAL 47 HG12 VAL 47 -0.607 18.824 7.274 348 3HG2 VAL 47 HG13 VAL 47 -2.045 18.791 6.255 349 H GLN 48 HN GLN 48 0.540 22.668 4.158 350 HA GLN 48 HA GLN 48 -0.229 22.531 1.352 351 1HB GLN 48 HB1 GLN 48 1.546 24.192 1.001 352 2HB GLN 48 HB2 GLN 48 0.426 24.704 2.256 353 1HG GLN 48 HG2 GLN 48 2.133 23.677 3.889 354 2HG GLN 48 HG1 GLN 48 3.247 23.755 2.524 355 1HE2 GLN 48 HE21 GLN 48 4.504 25.457 2.635 356 2HE2 GLN 48 HE22 GLN 48 4.054 27.030 3.191 357 H GLY 49 HN GLY 49 1.500 20.648 3.407 358 1HA GLY 49 HA1 GLY 49 3.661 20.004 1.553 359 2HA GLY 49 HA2 GLY 49 3.447 19.349 3.170 360 H GLN 50 HN GLN 50 3.757 17.224 2.468 361 HA GLN 50 HA GLN 50 1.959 16.129 0.469 362 1HB GLN 50 HB2 GLN 50 4.113 14.811 2.134 363 2HB GLN 50 HB1 GLN 50 3.218 14.034 0.836 364 1HG GLN 50 HG1 GLN 50 4.758 16.540 0.319 365 2HG GLN 50 HG2 GLN 50 5.575 14.978 0.371 366 1HE2 GLN 50 HE22 GLN 50 4.333 13.249 -0.945 367 2HE2 GLN 50 HE21 GLN 50 3.863 13.737 -2.534 368 H GLU 51 HN GLU 51 0.131 15.065 0.886 369 HA GLU 51 HA GLU 51 -0.736 14.806 3.632 370 1HB GLU 51 HB1 GLU 51 -2.009 15.152 1.109 371 2HB GLU 51 HB2 GLU 51 -2.629 13.672 1.827 372 1HG GLU 51 HG2 GLU 51 -2.518 16.282 3.308 373 2HG GLU 51 HG1 GLU 51 -3.903 15.780 2.339 374 HA PRO 52 HA PRO 52 -0.996 10.133 2.240 375 1HB PRO 52 HB1 PRO 52 0.739 9.437 0.237 376 2HB PRO 52 HB2 PRO 52 -0.965 9.828 -0.025 377 1HG PRO 52 HG2 PRO 52 1.452 11.562 -0.365 378 2HG PRO 52 HG1 PRO 52 0.033 11.401 -1.417 379 1HD PRO 52 HD2 PRO 52 0.304 13.472 0.268 380 2HD PRO 52 HD1 PRO 52 -1.282 12.741 -0.056 381 H LEU 53 HN LEU 53 0.008 9.454 4.030 382 HA LEU 53 HA LEU 53 2.730 10.028 4.658 383 1HB LEU 53 HB2 LEU 53 0.454 8.919 5.963 384 2HB LEU 53 HB1 LEU 53 1.784 7.797 6.144 385 HG LEU 53 HG LEU 53 1.350 9.604 7.960 386 1HD1 LEU 53 HD11 LEU 53 3.155 8.220 8.304 387 2HD1 LEU 53 HD12 LEU 53 3.909 9.815 8.220 388 3HD1 LEU 53 HD13 LEU 53 3.970 8.739 6.824 389 1HD2 LEU 53 HD21 LEU 53 2.050 11.727 7.657 390 2HD2 LEU 53 HD22 LEU 53 1.562 11.379 5.996 391 3HD2 LEU 53 HD23 LEU 53 3.262 11.279 6.457 392 H THR 54 HN THR 54 4.525 8.824 4.365 393 HA THR 54 HA THR 54 4.599 6.058 3.924 394 HB THR 54 HB THR 54 5.638 7.049 1.420 395 HG1 THR 54 HG1 THR 54 3.710 7.662 0.470 396 1HG2 THR 54 HG21 THR 54 4.117 5.361 0.457 397 2HG2 THR 54 HG22 THR 54 3.474 5.069 2.071 398 3HG2 THR 54 HG23 THR 54 5.167 4.720 1.722 399 H ALA 55 HN ALA 55 6.906 5.587 2.736 400 HA ALA 55 HA ALA 55 8.850 6.259 4.533 401 1HB ALA 55 HB1 ALA 55 9.224 5.615 1.616 402 2HB ALA 55 HB2 ALA 55 9.134 4.466 2.952 403 3HB ALA 55 HB3 ALA 55 10.498 5.581 2.835 404 H SER 56 HN SER 56 8.104 7.962 1.504 405 HA SER 56 HA SER 56 10.224 9.792 1.581 406 1HB SER 56 HB1 SER 56 7.454 10.153 0.412 407 2HB SER 56 HB2 SER 56 8.853 11.164 0.051 408 HG SER 56 HG SER 56 8.191 9.113 -1.284 409 H MET 57 HN MET 57 6.903 10.083 2.811 410 HA MET 57 HA MET 57 7.070 12.688 3.810 411 1HB MET 57 HB1 MET 57 5.434 10.282 4.558 412 2HB MET 57 HB2 MET 57 5.289 11.770 5.475 413 1HG MET 57 HG1 MET 57 3.719 11.186 3.423 414 2HG MET 57 HG2 MET 57 4.180 12.841 3.820 415 1HE MET 57 HE1 MET 57 6.022 10.119 0.718 416 2HE MET 57 HE2 MET 57 4.289 10.357 0.500 417 3HE MET 57 HE3 MET 57 4.908 9.726 2.027 418 H LEU 58 HN LEU 58 7.855 9.587 5.262 419 HA LEU 58 HA LEU 58 8.431 10.474 7.860 420 1HB LEU 58 HB1 LEU 58 9.659 8.152 6.378 421 2HB LEU 58 HB2 LEU 58 9.555 8.343 8.118 422 HG LEU 58 HG LEU 58 7.060 8.281 6.463 423 1HD1 LEU 58 HD21 LEU 58 7.247 6.140 5.920 424 2HD1 LEU 58 HD22 LEU 58 7.682 5.706 7.572 425 3HD1 LEU 58 HD23 LEU 58 8.935 6.207 6.432 426 1HD2 LEU 58 HD11 LEU 58 7.376 8.805 9.033 427 2HD2 LEU 58 HD12 LEU 58 7.360 7.043 9.140 428 3HD2 LEU 58 HD13 LEU 58 5.988 7.894 8.427 429 H ALA 59 HN ALA 59 10.500 9.998 5.032 430 HA ALA 59 HA ALA 59 12.945 10.655 6.252 431 1HB ALA 59 HB1 ALA 59 11.984 10.156 3.576 432 2HB ALA 59 HB2 ALA 59 13.580 9.875 4.270 433 3HB ALA 59 HB3 ALA 59 13.176 11.455 3.599 434 H SER 60 HN SER 60 10.273 12.593 5.469 435 HA SER 60 HA SER 60 11.680 15.049 5.008 436 1HB SER 60 HB1 SER 60 9.356 14.560 4.173 437 2HB SER 60 HB2 SER 60 8.792 14.702 5.838 438 HG SER 60 HG SER 60 9.342 16.647 4.055 439 H ALA 61 HN ALA 61 11.206 13.200 7.729 440 HA ALA 61 HA ALA 61 11.697 15.524 9.469 441 1HB ALA 61 HB1 ALA 61 10.416 14.030 11.216 442 2HB ALA 61 HB2 ALA 61 9.658 13.375 9.764 443 3HB ALA 61 HB3 ALA 61 9.543 15.100 10.119 444 HA PRO 62 HA PRO 62 14.898 12.002 9.726 445 1HB PRO 62 HB2 PRO 62 16.671 14.386 9.636 446 2HB PRO 62 HB1 PRO 62 16.853 12.812 8.854 447 1HG PRO 62 HG1 PRO 62 16.106 14.951 7.450 448 2HG PRO 62 HG2 PRO 62 15.400 13.356 7.128 449 1HD PRO 62 HD1 PRO 62 14.229 15.693 8.579 450 2HD PRO 62 HD2 PRO 62 13.442 14.526 7.497 451 HA PRO 63 HA PRO 63 16.172 13.970 13.796 452 1HB PRO 63 HB1 PRO 63 16.401 16.595 14.150 453 2HB PRO 63 HB2 PRO 63 17.527 15.732 13.094 454 1HG PRO 63 HG1 PRO 63 15.262 17.524 12.392 455 2HG PRO 63 HG2 PRO 63 16.779 17.236 11.524 456 1HD PRO 63 HD1 PRO 63 14.231 16.050 11.020 457 2HD PRO 63 HD2 PRO 63 15.771 15.686 10.219 458 H GLN 64 HN GLN 64 13.250 13.970 12.867 459 HA GLN 64 HA GLN 64 12.180 15.142 15.334 460 1HB GLN 64 HB1 GLN 64 11.817 16.596 13.254 461 2HB GLN 64 HB2 GLN 64 10.687 15.355 12.732 462 1HG GLN 64 HG1 GLN 64 9.190 15.814 14.427 463 2HG GLN 64 HG2 GLN 64 10.416 16.573 15.442 464 1HE2 GLN 64 HE21 GLN 64 8.305 16.988 12.702 465 2HE2 GLN 64 HE22 GLN 64 8.400 18.711 12.637 466 H GLU 65 HN GLU 65 10.181 13.840 12.774 467 HA GLU 65 HA GLU 65 9.438 11.661 14.593 468 1HB GLU 65 HB1 GLU 65 7.683 12.188 12.298 469 2HB GLU 65 HB2 GLU 65 7.283 11.964 13.994 470 1HG GLU 65 HG2 GLU 65 8.569 14.430 13.884 471 2HG GLU 65 HG1 GLU 65 7.525 14.391 12.464 472 H GLN 66 HN GLN 66 11.738 11.358 12.903 473 HA GLN 66 HA GLN 66 11.087 9.849 10.586 474 1HB GLN 66 HB1 GLN 66 13.443 10.781 11.839 475 2HB GLN 66 HB2 GLN 66 13.607 9.038 11.687 476 1HG GLN 66 HG1 GLN 66 12.796 9.472 9.244 477 2HG GLN 66 HG2 GLN 66 13.352 11.111 9.572 478 1HE2 GLN 66 HE21 GLN 66 15.507 10.361 11.291 479 2HE2 GLN 66 HE22 GLN 66 16.729 9.650 10.300 480 H LYS 67 HN LYS 67 11.130 9.150 13.925 481 HA LYS 67 HA LYS 67 10.592 6.318 13.345 482 1HB LYS 67 HB2 LYS 67 11.821 5.646 15.327 483 2HB LYS 67 HB1 LYS 67 12.873 6.575 14.271 484 1HG LYS 67 HG2 LYS 67 13.043 8.311 15.725 485 2HG LYS 67 HG1 LYS 67 11.435 8.046 16.404 486 1HD LYS 67 HD2 LYS 67 12.179 6.533 17.930 487 2HD LYS 67 HD1 LYS 67 13.456 5.931 16.871 488 1HE LYS 67 HE2 LYS 67 14.844 7.808 17.348 489 2HE LYS 67 HE1 LYS 67 13.534 8.637 18.188 490 1HZ LYS 67 HZ1 LYS 67 14.328 6.014 19.198 491 2HZ LYS 67 HZ2 LYS 67 13.805 7.385 20.041 492 3HZ LYS 67 HZ3 LYS 67 15.394 7.300 19.469 493 H GLN 68 HN GLN 68 8.855 8.687 13.849 494 HA GLN 68 HA GLN 68 7.404 7.578 16.157 495 1HB GLN 68 HB1 GLN 68 7.883 10.480 15.494 496 2HB GLN 68 HB2 GLN 68 6.676 9.940 16.653 497 1HG GLN 68 HG2 GLN 68 9.029 8.655 17.407 498 2HG GLN 68 HG1 GLN 68 9.510 10.298 16.985 499 1HE2 GLN 68 HE22 GLN 68 9.559 9.127 19.580 500 2HE2 GLN 68 HE21 GLN 68 8.484 10.038 20.579 501 H MET 69 HN MET 69 6.960 9.857 13.431 502 HA MET 69 HA MET 69 4.139 9.403 13.387 503 1HB MET 69 HB2 MET 69 4.048 10.996 11.638 504 2HB MET 69 HB1 MET 69 5.292 11.552 12.751 505 1HG MET 69 HG2 MET 69 6.842 11.510 11.168 506 2HG MET 69 HG1 MET 69 6.409 9.868 10.693 507 1HE MET 69 HE1 MET 69 7.273 11.892 8.114 508 2HE MET 69 HE2 MET 69 7.196 12.905 9.555 509 3HE MET 69 HE3 MET 69 6.222 13.308 8.141 510 H LEU 70 HN LEU 70 6.106 7.142 12.734 511 HA LEU 70 HA LEU 70 5.281 6.441 10.025 512 1HB LEU 70 HB1 LEU 70 6.581 4.237 11.133 513 2HB LEU 70 HB2 LEU 70 7.270 5.426 10.051 514 HG LEU 70 HG LEU 70 7.284 5.761 13.041 515 1HD1 LEU 70 HD11 LEU 70 9.502 4.890 13.100 516 2HD1 LEU 70 HD12 LEU 70 9.530 4.693 11.347 517 3HD1 LEU 70 HD13 LEU 70 8.470 3.684 12.331 518 1HD2 LEU 70 HD21 LEU 70 9.304 7.201 12.300 519 2HD2 LEU 70 HD22 LEU 70 7.667 7.830 12.102 520 3HD2 LEU 70 HD23 LEU 70 8.530 7.160 10.717 521 H GLY 71 HN GLY 71 4.644 5.623 13.346 522 1HA GLY 71 HA2 GLY 71 2.439 3.919 12.420 523 2HA GLY 71 HA1 GLY 71 3.471 3.382 13.733 524 H GLU 72 HN GLU 72 3.020 6.744 13.688 525 HA GLU 72 HA GLU 72 0.795 6.546 15.613 526 1HB GLU 72 HB1 GLU 72 3.212 8.344 15.865 527 2HB GLU 72 HB2 GLU 72 1.860 8.270 16.985 528 1HG GLU 72 HG2 GLU 72 2.778 5.646 16.773 529 2HG GLU 72 HG1 GLU 72 4.228 6.646 16.859 530 H ARG 73 HN ARG 73 1.781 7.829 12.725 531 HA ARG 73 HA ARG 73 -0.141 10.056 12.960 532 1HB ARG 73 HB1 ARG 73 2.208 10.845 12.801 533 2HB ARG 73 HB2 ARG 73 2.358 10.011 11.262 534 1HG ARG 73 HG2 ARG 73 1.610 11.818 10.235 535 2HG ARG 73 HG1 ARG 73 0.071 11.645 11.081 536 1HD ARG 73 HD1 ARG 73 1.946 12.757 12.892 537 2HD ARG 73 HD2 ARG 73 2.052 13.662 11.383 538 HE ARG 73 HE ARG 73 -0.062 14.487 11.755 539 1HH1 ARG 73 HH11 ARG 73 0.593 11.893 13.988 540 2HH1 ARG 73 HH12 ARG 73 -0.812 12.199 14.954 541 1HH2 ARG 73 HH21 ARG 73 -1.914 14.895 13.020 542 2HH2 ARG 73 HH22 ARG 73 -2.237 13.905 14.404 543 H LEU 74 HN LEU 74 0.948 7.302 11.277 544 HA LEU 74 HA LEU 74 -0.336 7.837 8.782 545 1HB LEU 74 HB1 LEU 74 1.283 5.745 9.979 546 2HB LEU 74 HB2 LEU 74 -0.010 5.090 8.991 547 HG LEU 74 HG LEU 74 1.536 7.285 7.792 548 1HD1 LEU 74 HD11 LEU 74 3.159 5.776 9.078 549 2HD1 LEU 74 HD12 LEU 74 3.488 6.104 7.376 550 3HD1 LEU 74 HD13 LEU 74 2.771 4.565 7.856 551 1HD2 LEU 74 HD21 LEU 74 -0.233 6.195 6.567 552 2HD2 LEU 74 HD22 LEU 74 0.519 4.620 6.827 553 3HD2 LEU 74 HD23 LEU 74 1.322 5.824 5.818 554 H PHE 75 HN PHE 75 -1.354 6.551 11.793 555 HA PHE 75 HA PHE 75 -3.282 4.735 11.219 556 1HB PHE 75 HB1 PHE 75 -2.909 5.176 13.494 557 2HB PHE 75 HB2 PHE 75 -3.231 6.897 13.308 558 HD1 PHE 75 HD1 PHE 75 -5.180 3.874 12.315 559 HD2 PHE 75 HD2 PHE 75 -5.031 7.455 14.614 560 HE1 PHE 75 HE1 PHE 75 -7.514 3.521 13.019 561 HE2 PHE 75 HE2 PHE 75 -7.361 7.106 15.318 562 HZ PHE 75 HZ PHE 75 -8.607 5.138 14.521 563 HA PRO 76 HA PRO 76 -6.669 8.179 10.482 564 1HB PRO 76 HB2 PRO 76 -4.962 10.430 9.579 565 2HB PRO 76 HB1 PRO 76 -6.400 10.447 10.605 566 1HG PRO 76 HG2 PRO 76 -3.978 10.827 11.647 567 2HG PRO 76 HG1 PRO 76 -5.205 9.880 12.512 568 1HD PRO 76 HD1 PRO 76 -2.845 8.933 10.930 569 2HD PRO 76 HD2 PRO 76 -3.484 8.326 12.472 570 H LEU 77 HN LEU 77 -3.815 7.595 8.638 571 HA LEU 77 HA LEU 77 -5.177 8.172 6.127 572 1HB LEU 77 HB2 LEU 77 -2.412 8.067 7.041 573 2HB LEU 77 HB1 LEU 77 -2.651 7.255 5.510 574 HG LEU 77 HG LEU 77 -3.128 9.202 4.385 575 1HD1 LEU 77 HD21 LEU 77 -4.988 10.123 5.349 576 2HD1 LEU 77 HD22 LEU 77 -3.777 11.322 5.800 577 3HD1 LEU 77 HD23 LEU 77 -4.294 10.108 6.969 578 1HD2 LEU 77 HD11 LEU 77 -0.878 9.431 5.129 579 2HD2 LEU 77 HD12 LEU 77 -1.398 10.038 6.701 580 3HD2 LEU 77 HD13 LEU 77 -1.645 11.014 5.252 581 H ILE 78 HN ILE 78 -4.064 5.455 8.032 582 HA ILE 78 HA ILE 78 -4.012 3.503 6.002 583 HB ILE 78 HB ILE 78 -4.943 2.857 8.772 584 1HG1 ILE 78 HG12 ILE 78 -3.000 4.419 8.924 585 2HG1 ILE 78 HG11 ILE 78 -2.663 2.814 9.563 586 1HG2 ILE 78 HG21 ILE 78 -3.075 1.014 7.951 587 2HG2 ILE 78 HG22 ILE 78 -3.922 1.427 6.458 588 3HG2 ILE 78 HG23 ILE 78 -4.826 0.833 7.852 589 1HD1 ILE 78 HD11 ILE 78 -1.918 3.634 6.778 590 2HD1 ILE 78 HD12 ILE 78 -1.356 2.237 7.700 591 3HD1 ILE 78 HD13 ILE 78 -0.858 3.864 8.169 592 H GLN 79 HN GLN 79 -6.606 4.729 8.053 593 HA GLN 79 HA GLN 79 -8.641 2.942 7.487 594 1HB GLN 79 HB1 GLN 79 -8.455 5.749 8.364 595 2HB GLN 79 HB2 GLN 79 -9.978 5.323 7.598 596 1HG GLN 79 HG1 GLN 79 -10.371 3.590 9.204 597 2HG GLN 79 HG2 GLN 79 -8.767 3.811 9.900 598 1HE2 GLN 79 HE22 GLN 79 -11.067 3.899 11.428 599 2HE2 GLN 79 HE21 GLN 79 -11.292 5.507 12.020 600 H ALA 80 HN ALA 80 -7.081 5.109 5.399 601 HA ALA 80 HA ALA 80 -9.238 5.338 3.481 602 1HB ALA 80 HB1 ALA 80 -7.568 7.153 3.872 603 2HB ALA 80 HB2 ALA 80 -7.723 6.661 2.185 604 3HB ALA 80 HB3 ALA 80 -6.345 6.111 3.141 605 H MET 81 HN MET 81 -6.280 3.491 3.919 606 HA MET 81 HA MET 81 -6.312 2.333 1.293 607 1HB MET 81 HB1 MET 81 -4.873 1.045 3.572 608 2HB MET 81 HB2 MET 81 -4.356 1.260 1.905 609 1HG MET 81 HG1 MET 81 -4.599 3.838 2.935 610 2HG MET 81 HG2 MET 81 -3.845 2.894 4.216 611 1HE MET 81 HE1 MET 81 -0.347 2.357 3.163 612 2HE MET 81 HE2 MET 81 -1.645 1.272 3.664 613 3HE MET 81 HE3 MET 81 -1.455 2.844 4.445 614 H HIS 82 HN HIS 82 -7.401 1.380 4.490 615 HA HIS 82 HA HIS 82 -8.703 -0.982 3.300 616 1HB HIS 82 HB1 HIS 82 -7.113 -0.634 5.775 617 2HB HIS 82 HB2 HIS 82 -8.561 -1.622 5.932 618 HD2 HIS 82 HD2 HIS 82 -5.801 -1.605 3.100 619 HE1 HIS 82 HE1 HIS 82 -6.382 -5.529 4.573 620 HE2 HIS 82 HE2 HIS 82 -5.133 -4.103 2.887 621 HA PRO 83 HA PRO 83 -12.592 0.535 4.770 622 1HB PRO 83 HB2 PRO 83 -13.802 -1.668 5.809 623 2HB PRO 83 HB1 PRO 83 -13.604 -1.406 4.073 624 1HG PRO 83 HG2 PRO 83 -11.963 -3.078 5.940 625 2HG PRO 83 HG1 PRO 83 -12.538 -3.463 4.308 626 1HD PRO 83 HD1 PRO 83 -10.009 -2.650 4.788 627 2HD PRO 83 HD2 PRO 83 -10.868 -2.231 3.292 628 H THR 84 HN THR 84 -11.155 1.661 6.452 629 HA THR 84 HA THR 84 -10.682 2.303 8.579 630 HB THR 84 HB THR 84 -12.557 2.602 9.963 631 HG1 THR 84 HG1 THR 84 -14.221 0.744 8.791 632 1HG2 THR 84 HG21 THR 84 -14.283 2.226 7.635 633 2HG2 THR 84 HG22 THR 84 -12.848 3.209 7.342 634 3HG2 THR 84 HG23 THR 84 -13.981 3.662 8.615 635 H LEU 85 HN LEU 85 -9.818 -0.368 7.861 636 HA LEU 85 HA LEU 85 -10.239 -2.016 10.200 637 1HB LEU 85 HB1 LEU 85 -8.727 -2.329 7.635 638 2HB LEU 85 HB2 LEU 85 -8.414 -3.417 8.972 639 HG LEU 85 HG LEU 85 -11.128 -3.008 7.716 640 1HD1 LEU 85 HD11 LEU 85 -10.102 -4.121 6.021 641 2HD1 LEU 85 HD12 LEU 85 -10.517 -5.499 7.041 642 3HD1 LEU 85 HD13 LEU 85 -8.884 -4.836 7.078 643 1HD2 LEU 85 HD21 LEU 85 -10.114 -5.036 9.702 644 2HD2 LEU 85 HD22 LEU 85 -11.710 -5.047 8.953 645 3HD2 LEU 85 HD23 LEU 85 -11.249 -3.728 10.029 646 H ALA 86 HN ALA 86 -8.515 0.657 9.841 647 HA ALA 86 HA ALA 86 -5.912 -0.047 10.736 648 1HB ALA 86 HB1 ALA 86 -6.890 2.175 9.682 649 2HB ALA 86 HB2 ALA 86 -5.472 2.193 10.731 650 3HB ALA 86 HB3 ALA 86 -7.054 2.624 11.379 651 H GLY 87 HN GLY 87 -6.067 2.119 12.905 652 1HA GLY 87 HA2 GLY 87 -6.520 2.254 15.180 653 2HA GLY 87 HA1 GLY 87 -7.577 0.857 15.022 654 H LYS 88 HN LYS 88 -5.045 -0.267 13.524 655 HA LYS 88 HA LYS 88 -3.241 -0.746 15.718 656 1HB LYS 88 HB1 LYS 88 -4.905 -2.393 16.263 657 2HB LYS 88 HB2 LYS 88 -4.971 -2.954 14.601 658 1HG LYS 88 HG2 LYS 88 -3.735 -4.568 15.772 659 2HG LYS 88 HG1 LYS 88 -2.544 -3.621 14.877 660 1HD LYS 88 HD2 LYS 88 -3.039 -2.464 17.472 661 2HD LYS 88 HD1 LYS 88 -2.563 -4.157 17.618 662 1HE LYS 88 HE1 LYS 88 -0.549 -3.767 16.378 663 2HE LYS 88 HE2 LYS 88 -1.048 -2.131 15.976 664 1HZ LYS 88 HZ1 LYS 88 0.388 -2.990 18.213 665 2HZ LYS 88 HZ2 LYS 88 -1.099 -2.405 18.766 666 3HZ LYS 88 HZ3 LYS 88 -0.097 -1.417 17.827 667 H ILE 89 HN ILE 89 -4.123 -1.095 12.350 668 HA ILE 89 HA ILE 89 -2.122 -2.635 11.345 669 HB ILE 89 HB ILE 89 -3.188 -0.115 10.080 670 1HG1 ILE 89 HG12 ILE 89 -4.055 -2.954 9.543 671 2HG1 ILE 89 HG11 ILE 89 -4.814 -1.985 10.802 672 1HG2 ILE 89 HG21 ILE 89 -2.537 -1.992 8.124 673 2HG2 ILE 89 HG22 ILE 89 -1.180 -2.010 9.250 674 3HG2 ILE 89 HG23 ILE 89 -1.677 -0.496 8.494 675 1HD1 ILE 89 HD11 ILE 89 -6.128 -1.913 8.788 676 2HD1 ILE 89 HD12 ILE 89 -4.735 -1.351 7.864 677 3HD1 ILE 89 HD13 ILE 89 -5.440 -0.321 9.110 678 H THR 90 HN THR 90 -1.782 0.814 10.728 679 HA THR 90 HA THR 90 0.982 0.798 10.514 680 HB THR 90 HB THR 90 -1.123 2.721 10.486 681 HG1 THR 90 HG1 THR 90 1.576 2.942 9.653 682 1HG2 THR 90 HG21 THR 90 -0.595 4.020 12.237 683 2HG2 THR 90 HG22 THR 90 0.630 4.625 11.117 684 3HG2 THR 90 HG23 THR 90 1.061 3.416 12.327 685 H GLY 91 HN GLY 91 -1.031 1.366 13.371 686 1HA GLY 91 HA2 GLY 91 0.982 2.198 15.140 687 2HA GLY 91 HA1 GLY 91 -0.487 1.347 15.606 688 H MET 92 HN MET 92 0.144 -0.923 13.866 689 HA MET 92 HA MET 92 1.861 -2.354 15.717 690 1HB MET 92 HB2 MET 92 0.335 -3.905 15.170 691 2HB MET 92 HB1 MET 92 -0.142 -3.063 13.706 692 1HG MET 92 HG2 MET 92 1.265 -4.259 12.401 693 2HG MET 92 HG1 MET 92 2.447 -4.485 13.687 694 1HE MET 92 HE1 MET 92 -1.378 -5.559 12.862 695 2HE MET 92 HE2 MET 92 -0.912 -7.204 12.423 696 3HE MET 92 HE3 MET 92 -0.180 -5.830 11.591 697 H LEU 93 HN LEU 93 2.010 -0.890 12.610 698 HA LEU 93 HA LEU 93 4.205 -2.229 11.508 699 1HB LEU 93 HB2 LEU 93 2.900 0.391 11.129 700 2HB LEU 93 HB1 LEU 93 4.513 0.211 10.478 701 HG LEU 93 HG LEU 93 2.738 -0.248 8.808 702 1HD1 LEU 93 HD11 LEU 93 3.668 -2.856 8.659 703 2HD1 LEU 93 HD12 LEU 93 4.936 -1.994 9.529 704 3HD1 LEU 93 HD13 LEU 93 4.416 -1.431 7.941 705 1HD2 LEU 93 HD21 LEU 93 1.719 -1.864 10.967 706 2HD2 LEU 93 HD22 LEU 93 1.913 -2.814 9.489 707 3HD2 LEU 93 HD23 LEU 93 0.934 -1.349 9.470 708 H LEU 94 HN LEU 94 4.036 -0.447 14.296 709 HA LEU 94 HA LEU 94 6.890 0.258 14.190 710 1HB LEU 94 HB1 LEU 94 4.542 1.478 15.478 711 2HB LEU 94 HB2 LEU 94 5.939 1.334 16.524 712 HG LEU 94 HG LEU 94 5.690 3.529 15.289 713 1HD1 LEU 94 HD21 LEU 94 8.197 1.893 14.982 714 2HD1 LEU 94 HD22 LEU 94 7.778 2.987 16.300 715 3HD1 LEU 94 HD23 LEU 94 8.111 3.630 14.693 716 1HD2 LEU 94 HD11 LEU 94 6.455 1.798 12.940 717 2HD2 LEU 94 HD12 LEU 94 6.505 3.562 12.951 718 3HD2 LEU 94 HD13 LEU 94 4.964 2.721 13.136 719 H GLU 95 HN GLU 95 5.612 -2.370 14.518 720 HA GLU 95 HA GLU 95 7.167 -3.344 16.696 721 1HB GLU 95 HB2 GLU 95 5.546 -3.943 18.255 722 2HB GLU 95 HB1 GLU 95 5.016 -2.347 17.746 723 1HG GLU 95 HG1 GLU 95 3.222 -3.182 16.542 724 2HG GLU 95 HG2 GLU 95 3.932 -4.790 16.406 725 H ILE 96 HN ILE 96 5.691 -3.724 13.787 726 HA ILE 96 HA ILE 96 4.832 -6.390 13.763 727 HB ILE 96 HB ILE 96 5.127 -6.390 11.369 728 1HG1 ILE 96 HG12 ILE 96 7.330 -5.388 11.209 729 2HG1 ILE 96 HG11 ILE 96 6.193 -4.532 10.177 730 1HG2 ILE 96 HG21 ILE 96 4.153 -3.875 11.035 731 2HG2 ILE 96 HG22 ILE 96 3.812 -4.182 12.741 732 3HG2 ILE 96 HG23 ILE 96 3.204 -5.286 11.506 733 1HD1 ILE 96 HD11 ILE 96 6.070 -2.715 11.712 734 2HD1 ILE 96 HD12 ILE 96 7.765 -3.065 11.377 735 3HD1 ILE 96 HD13 ILE 96 7.039 -3.592 12.895 736 H ASP 97 HN ASP 97 6.384 -7.365 11.532 737 HA ASP 97 HA ASP 97 8.254 -9.001 12.798 738 1HB ASP 97 HB1 ASP 97 7.028 -9.108 10.458 739 2HB ASP 97 HB2 ASP 97 8.500 -8.324 9.889 740 H ASN 98 HN ASN 98 8.478 -5.768 12.279 741 HA ASN 98 HA ASN 98 10.141 -4.283 12.635 742 1HB ASN 98 HB1 ASN 98 11.832 -6.762 12.901 743 2HB ASN 98 HB2 ASN 98 12.517 -5.142 12.988 744 1HD2 ASN 98 HD22 ASN 98 10.162 -7.306 14.453 745 2HD2 ASN 98 HD21 ASN 98 10.206 -6.587 16.023 746 H SER 99 HN SER 99 10.457 -6.731 10.206 747 HA SER 99 HA SER 99 12.345 -5.308 8.587 748 1HB SER 99 HB1 SER 99 10.417 -7.344 7.497 749 2HB SER 99 HB2 SER 99 12.076 -7.005 7.000 750 HG SER 99 HG SER 99 12.406 -8.730 8.201 751 H GLU 100 HN GLU 100 8.896 -5.389 8.977 752 HA GLU 100 HA GLU 100 8.318 -3.834 6.614 753 1HB GLU 100 HB1 GLU 100 6.386 -4.050 8.864 754 2HB GLU 100 HB2 GLU 100 6.104 -4.114 7.133 755 1HG GLU 100 HG1 GLU 100 7.568 -6.350 7.476 756 2HG GLU 100 HG2 GLU 100 6.718 -6.266 9.021 757 H LEU 101 HN LEU 101 9.251 -3.294 9.858 758 HA LEU 101 HA LEU 101 8.340 -0.575 10.035 759 1HB LEU 101 HB1 LEU 101 8.636 -1.689 12.104 760 2HB LEU 101 HB2 LEU 101 10.228 -2.268 11.657 761 HG LEU 101 HG LEU 101 10.636 0.416 11.583 762 1HD1 LEU 101 HD11 LEU 101 9.202 1.596 12.797 763 2HD1 LEU 101 HD12 LEU 101 9.282 0.442 14.127 764 3HD1 LEU 101 HD13 LEU 101 8.146 0.183 12.803 765 1HD2 LEU 101 HD21 LEU 101 10.831 -1.233 14.093 766 2HD2 LEU 101 HD22 LEU 101 11.830 0.143 13.625 767 3HD2 LEU 101 HD23 LEU 101 11.947 -1.376 12.735 768 H LEU 102 HN LEU 102 11.047 -2.265 8.756 769 HA LEU 102 HA LEU 102 12.702 0.123 8.551 770 1HB LEU 102 HB2 LEU 102 13.096 -2.781 8.322 771 2HB LEU 102 HB1 LEU 102 13.998 -1.840 7.147 772 HG LEU 102 HG LEU 102 14.834 -0.469 9.157 773 1HD1 LEU 102 HD21 LEU 102 13.062 -2.189 10.499 774 2HD1 LEU 102 HD22 LEU 102 14.171 -1.011 11.200 775 3HD1 LEU 102 HD23 LEU 102 14.691 -2.680 10.964 776 1HD2 LEU 102 HD11 LEU 102 15.798 -3.292 9.249 777 2HD2 LEU 102 HD12 LEU 102 16.717 -1.788 9.296 778 3HD2 LEU 102 HD13 LEU 102 16.007 -2.339 7.779 779 H HIS 103 HN HIS 103 11.143 -2.220 6.387 780 HA HIS 103 HA HIS 103 11.970 -0.970 4.016 781 1HB HIS 103 HB1 HIS 103 10.632 -3.288 4.707 782 2HB HIS 103 HB2 HIS 103 9.409 -2.367 3.844 783 HD2 HIS 103 HD2 HIS 103 11.556 -5.038 2.904 784 HE1 HIS 103 HE1 HIS 103 12.057 -2.305 -0.289 785 HE2 HIS 103 HE2 HIS 103 12.398 -4.701 0.473 786 H MET 104 HN MET 104 9.109 -0.510 6.044 787 HA MET 104 HA MET 104 7.592 1.033 4.267 788 1HB MET 104 HB2 MET 104 6.342 1.758 6.173 789 2HB MET 104 HB1 MET 104 6.813 0.088 6.471 790 1HG MET 104 HG2 MET 104 8.811 1.096 7.696 791 2HG MET 104 HG1 MET 104 7.895 2.599 7.683 792 1HE MET 104 HE1 MET 104 4.617 1.570 9.438 793 2HE MET 104 HE2 MET 104 4.829 0.488 8.058 794 3HE MET 104 HE3 MET 104 5.244 2.196 7.913 795 H LEU 105 HN LEU 105 10.189 1.934 6.481 796 HA LEU 105 HA LEU 105 9.903 4.760 5.846 797 1HB LEU 105 HB1 LEU 105 12.247 3.659 7.330 798 2HB LEU 105 HB2 LEU 105 11.430 5.195 7.533 799 HG LEU 105 HG LEU 105 10.181 2.576 8.334 800 1HD1 LEU 105 HD11 LEU 105 11.070 2.727 10.454 801 2HD1 LEU 105 HD12 LEU 105 11.442 4.444 10.291 802 3HD1 LEU 105 HD13 LEU 105 12.435 3.245 9.463 803 1HD2 LEU 105 HD21 LEU 105 8.623 4.395 8.036 804 2HD2 LEU 105 HD22 LEU 105 9.613 5.444 9.052 805 3HD2 LEU 105 HD23 LEU 105 8.808 4.041 9.755 806 H GLU 106 HN GLU 106 11.298 2.079 4.494 807 HA GLU 106 HA GLU 106 13.488 3.611 3.300 808 1HB GLU 106 HB2 GLU 106 13.046 0.673 3.776 809 2HB GLU 106 HB1 GLU 106 14.256 1.231 2.622 810 1HG GLU 106 HG2 GLU 106 14.130 1.816 5.563 811 2HG GLU 106 HG1 GLU 106 15.290 0.777 4.736 812 H SER 107 HN SER 107 10.403 2.589 2.595 813 HA SER 107 HA SER 107 10.895 2.973 -0.263 814 1HB SER 107 HB2 SER 107 10.837 0.446 0.495 815 2HB SER 107 HB1 SER 107 9.094 0.709 0.495 816 HG SER 107 HG SER 107 10.376 0.030 -1.549 817 HA PRO 108 HA PRO 108 7.200 5.398 0.306 818 1HB PRO 108 HB2 PRO 108 6.772 6.036 -2.292 819 2HB PRO 108 HB1 PRO 108 8.040 6.791 -1.319 820 1HG PRO 108 HG1 PRO 108 8.248 4.553 -3.299 821 2HG PRO 108 HG2 PRO 108 9.312 5.956 -3.082 822 1HD PRO 108 HD2 PRO 108 9.917 3.500 -2.109 823 2HD PRO 108 HD1 PRO 108 10.418 4.999 -1.299 824 H GLU 109 HN GLU 109 7.362 2.348 -0.722 825 HA GLU 109 HA GLU 109 4.475 2.201 -1.293 826 1HB GLU 109 HB1 GLU 109 5.129 1.536 -3.363 827 2HB GLU 109 HB2 GLU 109 6.759 1.152 -2.839 828 1HG GLU 109 HG2 GLU 109 6.064 -0.988 -2.033 829 2HG GLU 109 HG1 GLU 109 4.369 -0.599 -2.322 830 H SER 110 HN SER 110 7.292 0.893 0.293 831 HA SER 110 HA SER 110 6.127 -1.501 1.185 832 1HB SER 110 HB1 SER 110 8.539 0.045 1.827 833 2HB SER 110 HB2 SER 110 7.906 -0.902 3.174 834 HG SER 110 HG SER 110 7.841 -2.405 0.979 835 H LEU 111 HN LEU 111 6.348 1.703 2.641 836 HA LEU 111 HA LEU 111 5.110 1.347 5.044 837 1HB LEU 111 HB1 LEU 111 5.967 3.472 3.879 838 2HB LEU 111 HB2 LEU 111 4.389 3.562 3.124 839 HG LEU 111 HG LEU 111 4.262 5.051 4.901 840 1HD1 LEU 111 HD21 LEU 111 2.495 4.303 6.154 841 2HD1 LEU 111 HD22 LEU 111 3.181 2.694 6.363 842 3HD1 LEU 111 HD23 LEU 111 2.473 3.158 4.816 843 1HD2 LEU 111 HD11 LEU 111 5.395 3.037 6.809 844 2HD2 LEU 111 HD12 LEU 111 5.145 4.764 7.060 845 3HD2 LEU 111 HD13 LEU 111 6.392 4.209 5.938 846 H ARG 112 HN ARG 112 3.618 1.607 1.844 847 HA ARG 112 HA ARG 112 0.960 1.295 2.863 848 1HB ARG 112 HB2 ARG 112 0.707 2.435 0.953 849 2HB ARG 112 HB1 ARG 112 2.226 1.850 0.284 850 1HG ARG 112 HG1 ARG 112 1.207 -0.097 -0.562 851 2HG ARG 112 HG2 ARG 112 -0.273 0.182 0.364 852 1HD ARG 112 HD2 ARG 112 -0.589 2.293 -0.945 853 2HD ARG 112 HD1 ARG 112 0.759 1.790 -1.966 854 HE ARG 112 HE ARG 112 -0.742 -0.310 -2.270 855 1HH1 ARG 112 HH11 ARG 112 -1.809 3.000 -2.025 856 2HH1 ARG 112 HH12 ARG 112 -3.222 2.750 -2.995 857 1HH2 ARG 112 HH22 ARG 112 -2.598 -0.647 -3.548 858 2HH2 ARG 112 HH21 ARG 112 -3.671 0.678 -3.861 859 H SER 113 HN SER 113 2.786 -0.730 0.553 860 HA SER 113 HA SER 113 1.160 -2.918 0.524 861 1HB SER 113 HB2 SER 113 3.142 -2.636 -0.926 862 2HB SER 113 HB1 SER 113 4.188 -2.973 0.453 863 HG SER 113 HG SER 113 3.475 -5.050 0.497 864 H LYS 114 HN LYS 114 3.929 -2.454 2.711 865 HA LYS 114 HA LYS 114 3.585 -4.804 4.180 866 1HB LYS 114 HB1 LYS 114 4.745 -2.186 5.149 867 2HB LYS 114 HB2 LYS 114 4.992 -3.762 5.887 868 1HG LYS 114 HG1 LYS 114 5.872 -2.989 3.112 869 2HG LYS 114 HG2 LYS 114 6.909 -3.038 4.540 870 1HD LYS 114 HD2 LYS 114 7.049 -5.294 4.525 871 2HD LYS 114 HD1 LYS 114 5.379 -5.496 3.990 872 1HE LYS 114 HE1 LYS 114 7.117 -4.282 1.981 873 2HE LYS 114 HE2 LYS 114 7.610 -5.908 2.452 874 1HZ LYS 114 HZ1 LYS 114 5.267 -6.600 2.031 875 2HZ LYS 114 HZ2 LYS 114 6.109 -6.107 0.648 876 3HZ LYS 114 HZ3 LYS 114 4.980 -5.071 1.366 877 H VAL 115 HN VAL 115 1.978 -1.690 4.424 878 HA VAL 115 HA VAL 115 0.835 -2.183 7.004 879 HB VAL 115 HB VAL 115 0.581 -0.089 4.946 880 1HG1 VAL 115 HG11 VAL 115 -1.519 0.800 5.834 881 2HG1 VAL 115 HG12 VAL 115 -1.709 -0.640 6.830 882 3HG1 VAL 115 HG13 VAL 115 -1.759 -0.772 5.072 883 1HG2 VAL 115 HG21 VAL 115 1.409 -0.375 7.642 884 2HG2 VAL 115 HG22 VAL 115 0.093 0.799 7.599 885 3HG2 VAL 115 HG23 VAL 115 1.528 1.043 6.601 886 H ASP 116 HN ASP 116 -0.487 -2.267 3.688 887 HA ASP 116 HA ASP 116 -2.993 -3.302 4.247 888 1HB ASP 116 HB1 ASP 116 -1.326 -2.947 1.943 889 2HB ASP 116 HB2 ASP 116 -2.096 -4.526 1.854 890 H GLU 117 HN GLU 117 0.105 -4.930 3.959 891 HA GLU 117 HA GLU 117 -0.997 -7.583 4.123 892 1HB GLU 117 HB1 GLU 117 1.692 -6.370 3.931 893 2HB GLU 117 HB2 GLU 117 1.617 -7.892 4.807 894 1HG GLU 117 HG2 GLU 117 0.110 -8.357 2.537 895 2HG GLU 117 HG1 GLU 117 1.459 -7.377 1.966 896 H ALA 118 HN ALA 118 0.292 -5.186 6.319 897 HA ALA 118 HA ALA 118 0.495 -6.875 8.593 898 1HB ALA 118 HB1 ALA 118 1.497 -4.514 8.197 899 2HB ALA 118 HB2 ALA 118 0.983 -4.985 9.818 900 3HB ALA 118 HB3 ALA 118 -0.051 -3.949 8.831 901 H VAL 119 HN VAL 119 -2.114 -5.306 6.974 902 HA VAL 119 HA VAL 119 -3.987 -5.256 9.104 903 HB VAL 119 HB VAL 119 -4.647 -5.599 6.195 904 1HG1 VAL 119 HG11 VAL 119 -6.475 -5.959 7.761 905 2HG1 VAL 119 HG12 VAL 119 -6.719 -4.468 6.850 906 3HG1 VAL 119 HG13 VAL 119 -6.151 -4.398 8.517 907 1HG2 VAL 119 HG21 VAL 119 -3.840 -3.581 5.768 908 2HG2 VAL 119 HG22 VAL 119 -3.259 -3.455 7.428 909 3HG2 VAL 119 HG23 VAL 119 -4.881 -2.897 7.016 910 H ALA 120 HN ALA 120 -3.316 -7.529 6.484 911 HA ALA 120 HA ALA 120 -5.196 -9.490 7.159 912 1HB ALA 120 HB1 ALA 120 -2.712 -10.611 6.174 913 2HB ALA 120 HB2 ALA 120 -3.178 -9.173 5.262 914 3HB ALA 120 HB3 ALA 120 -4.294 -10.535 5.397 915 H VAL 121 HN VAL 121 -2.145 -8.596 8.499 916 HA VAL 121 HA VAL 121 -1.832 -10.972 10.107 917 HB VAL 121 HB VAL 121 -0.294 -8.420 9.763 918 1HG1 VAL 121 HG21 VAL 121 -0.422 -9.951 12.190 919 2HG1 VAL 121 HG22 VAL 121 0.454 -8.459 11.845 920 3HG1 VAL 121 HG23 VAL 121 1.197 -10.021 11.494 921 1HG2 VAL 121 HG11 VAL 121 0.596 -11.289 9.576 922 2HG2 VAL 121 HG12 VAL 121 1.453 -9.854 9.012 923 3HG2 VAL 121 HG13 VAL 121 -0.034 -10.364 8.212 924 H LEU 122 HN LEU 122 -3.086 -7.735 10.434 925 HA LEU 122 HA LEU 122 -3.230 -7.763 13.297 926 1HB LEU 122 HB2 LEU 122 -3.509 -5.579 12.943 927 2HB LEU 122 HB1 LEU 122 -3.612 -5.870 11.218 928 HG LEU 122 HG LEU 122 -6.153 -6.497 12.077 929 1HD1 LEU 122 HD11 LEU 122 -6.522 -4.162 13.335 930 2HD1 LEU 122 HD12 LEU 122 -4.915 -4.569 13.937 931 3HD1 LEU 122 HD13 LEU 122 -6.258 -5.687 14.183 932 1HD2 LEU 122 HD21 LEU 122 -5.745 -3.684 11.374 933 2HD2 LEU 122 HD22 LEU 122 -6.725 -4.923 10.591 934 3HD2 LEU 122 HD23 LEU 122 -4.991 -4.838 10.273 935 H GLN 123 HN GLN 123 -5.395 -8.503 10.634 936 HA GLN 123 HA GLN 123 -7.693 -8.935 12.296 937 1HB GLN 123 HB1 GLN 123 -7.142 -9.784 9.442 938 2HB GLN 123 HB2 GLN 123 -8.706 -9.858 10.242 939 1HG GLN 123 HG2 GLN 123 -7.665 -7.213 10.471 940 2HG GLN 123 HG1 GLN 123 -7.578 -7.728 8.788 941 1HE2 GLN 123 HE21 GLN 123 -9.389 -7.812 7.603 942 2HE2 GLN 123 HE22 GLN 123 -10.973 -7.465 8.201 943 H ALA 124 HN ALA 124 -4.940 -10.710 11.348 944 HA ALA 124 HA ALA 124 -6.082 -13.323 11.878 945 1HB ALA 124 HB1 ALA 124 -4.449 -13.041 10.088 946 2HB ALA 124 HB2 ALA 124 -3.849 -14.148 11.325 947 3HB ALA 124 HB3 ALA 124 -3.255 -12.488 11.262 948 H HIS 125 HN HIS 125 -4.573 -10.843 13.662 949 HA HIS 125 HA HIS 125 -3.841 -12.747 15.786 950 1HB HIS 125 HB1 HIS 125 -2.279 -10.783 14.595 951 2HB HIS 125 HB2 HIS 125 -2.807 -10.026 16.094 952 HD2 HIS 125 HD2 HIS 125 0.200 -11.643 15.107 953 HE1 HIS 125 HE1 HIS 125 -0.598 -13.408 18.871 954 HE2 HIS 125 HE2 HIS 125 1.161 -13.023 17.084 955 H GLN 126 HN GLN 126 -5.169 -9.487 15.258 956 HA GLN 126 HA GLN 126 -6.048 -9.049 17.904 957 1HB GLN 126 HB1 GLN 126 -6.797 -7.936 15.235 958 2HB GLN 126 HB2 GLN 126 -7.872 -7.632 16.591 959 1HG GLN 126 HG2 GLN 126 -4.970 -6.872 16.371 960 2HG GLN 126 HG1 GLN 126 -6.363 -5.790 16.356 961 1HE2 GLN 126 HE22 GLN 126 -3.900 -6.623 18.189 962 2HE2 GLN 126 HE21 GLN 126 -4.588 -6.483 19.768 963 H ALA 127 HN ALA 127 -8.066 -9.866 15.099 964 HA ALA 127 HA ALA 127 -9.887 -11.349 16.856 965 1HB ALA 127 HB1 ALA 127 -10.581 -9.617 14.973 966 2HB ALA 127 HB2 ALA 127 -11.545 -11.055 15.309 967 3HB ALA 127 HB3 ALA 127 -10.424 -11.043 13.947 968 H LYS 128 HN LYS 128 -7.577 -12.555 16.795 969 HA LYS 128 HA LYS 128 -6.942 -14.163 14.617 970 1HB LYS 128 HB2 LYS 128 -5.579 -15.465 16.253 971 2HB LYS 128 HB1 LYS 128 -5.296 -13.731 16.306 972 1HG LYS 128 HG2 LYS 128 -6.534 -13.502 18.316 973 2HG LYS 128 HG1 LYS 128 -7.144 -15.153 18.196 974 1HD LYS 128 HD2 LYS 128 -4.451 -15.559 18.143 975 2HD LYS 128 HD1 LYS 128 -4.582 -14.162 19.214 976 1HE LYS 128 HE2 LYS 128 -6.621 -15.962 19.958 977 2HE LYS 128 HE1 LYS 128 -5.149 -16.912 19.757 978 1HZ LYS 128 HZ1 LYS 128 -4.017 -15.543 21.314 979 2HZ LYS 128 HZ2 LYS 128 -5.485 -15.991 22.025 980 3HZ LYS 128 HZ3 LYS 128 -5.295 -14.436 21.385 981 H GLU 129 HN GLU 129 -7.958 -15.751 13.776 982 HA GLU 129 HA GLU 129 -10.039 -17.181 15.198 983 1HB GLU 129 HB1 GLU 129 -10.217 -18.415 12.962 984 2HB GLU 129 HB2 GLU 129 -10.618 -16.703 12.966 985 1HG GLU 129 HG1 GLU 129 -9.211 -16.459 11.279 986 2HG GLU 129 HG2 GLU 129 -7.898 -16.782 12.411 987 H ALA 130 HN ALA 130 -6.897 -17.376 15.427 988 HA ALA 130 HA ALA 130 -6.485 -20.215 15.034 989 1HB ALA 130 HB1 ALA 130 -4.210 -19.707 15.954 990 2HB ALA 130 HB2 ALA 130 -4.708 -18.020 16.080 991 3HB ALA 130 HB3 ALA 130 -4.641 -18.805 14.501 992 H ALA 131 HN ALA 131 -8.409 -19.030 17.073 993 HA ALA 131 HA ALA 131 -7.348 -19.651 19.650 994 1HB ALA 131 HB1 ALA 131 -10.165 -19.779 19.734 995 2HB ALA 131 HB2 ALA 131 -9.735 -18.501 18.598 996 3HB ALA 131 HB3 ALA 131 -9.117 -18.457 20.248 997 H GLN 132 HN GLN 132 -8.088 -21.618 17.129 998 HA GLN 132 HA GLN 132 -9.480 -23.725 18.468 999 1HB GLN 132 HB2 GLN 132 -8.395 -23.218 15.800 1000 2HB GLN 132 HB1 GLN 132 -8.220 -24.893 16.306 1001 1HG GLN 132 HG1 GLN 132 -10.594 -25.064 16.699 1002 2HG GLN 132 HG2 GLN 132 -10.807 -23.355 16.319 1003 1HE2 GLN 132 HE21 GLN 132 -12.259 -23.855 14.668 1004 2HE2 GLN 132 HE22 GLN 132 -11.733 -24.498 13.153 1005 H LYS 133 HN LYS 133 -6.163 -23.591 17.155 1006 HA LYS 133 HA LYS 133 -5.363 -25.789 18.860 1007 1HB LYS 133 HB2 LYS 133 -4.395 -24.556 16.441 1008 2HB LYS 133 HB1 LYS 133 -3.093 -24.673 17.616 1009 1HG LYS 133 HG1 LYS 133 -4.257 -27.147 17.780 1010 2HG LYS 133 HG2 LYS 133 -4.413 -26.756 16.065 1011 1HD LYS 133 HD1 LYS 133 -1.839 -25.970 16.661 1012 2HD LYS 133 HD2 LYS 133 -2.045 -27.439 17.616 1013 1HE LYS 133 HE1 LYS 133 -1.618 -28.597 15.766 1014 2HE LYS 133 HE2 LYS 133 -3.169 -28.036 15.141 1015 1HZ LYS 133 HZ1 LYS 133 -1.008 -27.626 13.798 1016 2HZ LYS 133 HZ2 LYS 133 -0.794 -26.326 14.859 1017 3HZ LYS 133 HZ3 LYS 133 -2.178 -26.408 13.889 1018 H ALA 134 HN ALA 134 -5.851 -24.545 20.842 1019 HA ALA 134 HA ALA 134 -4.195 -22.314 21.542 1020 1HB ALA 134 HB1 ALA 134 -5.489 -22.122 23.389 1021 2HB ALA 134 HB2 ALA 134 -5.524 -23.861 23.681 1022 3HB ALA 134 HB3 ALA 134 -6.567 -23.153 22.448 1023 H VAL 135 HN VAL 135 -4.316 -25.727 22.540 1024 HA VAL 135 HA VAL 135 -1.758 -25.427 23.914 1025 HB VAL 135 HB VAL 135 -2.155 -27.824 24.590 1026 1HG1 VAL 135 HG21 VAL 135 -3.421 -27.198 26.407 1027 2HG1 VAL 135 HG22 VAL 135 -4.500 -26.189 25.444 1028 3HG1 VAL 135 HG23 VAL 135 -2.869 -25.630 25.819 1029 1HG2 VAL 135 HG11 VAL 135 -4.762 -28.297 24.389 1030 2HG2 VAL 135 HG12 VAL 135 -3.613 -28.827 23.161 1031 3HG2 VAL 135 HG13 VAL 135 -4.554 -27.357 22.912 1032 H ASN 136 HN ASN 136 -0.170 -27.264 23.633 1033 HA ASN 136 HA ASN 136 0.486 -27.473 20.839 1034 1HB ASN 136 HB1 ASN 136 1.842 -27.927 23.408 1035 2HB ASN 136 HB2 ASN 136 2.314 -29.053 22.138 1036 1HD2 ASN 136 HD21 ASN 136 3.983 -28.435 20.995 1037 2HD2 ASN 136 HD22 ASN 136 4.455 -26.805 20.669 1038 H SER 137 HN SER 137 -1.347 -29.304 22.984 1039 HA SER 137 HA SER 137 -0.827 -31.838 21.625 1040 1HB SER 137 HB2 SER 137 -1.817 -32.902 23.423 1041 2HB SER 137 HB1 SER 137 -1.205 -31.449 24.215 1042 HG SER 137 HG SER 137 -3.578 -32.200 24.418 1043 H ALA 138 HN ALA 138 -2.284 -32.878 20.333 1044 HA ALA 138 HA ALA 138 -4.244 -31.286 19.019 1045 1HB ALA 138 HB1 ALA 138 -3.710 -34.247 18.832 1046 2HB ALA 138 HB2 ALA 138 -3.004 -32.991 17.816 1047 3HB ALA 138 HB3 ALA 138 -4.734 -33.321 17.737 1048 H THR 139 HN THR 139 -6.516 -32.108 18.680 1049 HA THR 139 HA THR 139 -7.645 -32.892 21.283 1050 HB THR 139 HB THR 139 -9.638 -31.689 20.686 1051 HG1 THR 139 HG1 THR 139 -9.821 -30.685 18.651 1052 1HG2 THR 139 HG21 THR 139 -8.463 -29.963 21.484 1053 2HG2 THR 139 HG22 THR 139 -8.464 -29.436 19.802 1054 3HG2 THR 139 HG23 THR 139 -7.069 -30.296 20.456 1055 H GLY 140 HN GLY 140 -9.070 -34.568 21.436 1056 1HA GLY 140 HA2 GLY 140 -9.184 -36.350 19.125 1057 2HA GLY 140 HA1 GLY 140 -9.604 -36.765 20.782 1058 H VAL 141 HN VAL 141 -11.043 -37.115 18.185 1059 HA VAL 141 HA VAL 141 -13.432 -35.483 18.649 1060 HB VAL 141 HB VAL 141 -12.881 -37.359 16.348 1061 1HG1 VAL 141 HG11 VAL 141 -14.949 -35.201 16.754 1062 2HG1 VAL 141 HG12 VAL 141 -15.237 -36.940 16.666 1063 3HG1 VAL 141 HG13 VAL 141 -14.674 -36.065 15.241 1064 1HG2 VAL 141 HG21 VAL 141 -12.295 -35.396 15.048 1065 2HG2 VAL 141 HG22 VAL 141 -11.229 -35.541 16.444 1066 3HG2 VAL 141 HG23 VAL 141 -12.542 -34.364 16.457 1067 HA PRO 142 HA PRO 142 -15.222 -38.988 20.785 1068 1HB PRO 142 HB2 PRO 142 -17.738 -37.959 21.013 1069 2HB PRO 142 HB1 PRO 142 -16.399 -37.502 22.072 1070 1HG PRO 142 HG2 PRO 142 -17.494 -36.080 19.675 1071 2HG PRO 142 HG1 PRO 142 -16.988 -35.412 21.239 1072 1HD PRO 142 HD1 PRO 142 -15.418 -35.283 19.049 1073 2HD PRO 142 HD2 PRO 142 -14.747 -35.473 20.682 1074 H THR 143 HN THR 143 -15.840 -40.811 19.836 1075 HA THR 143 HA THR 143 -17.016 -40.824 17.219 1076 HB THR 143 HB THR 143 -16.566 -43.145 19.107 1077 HG1 THR 143 HG1 THR 143 -14.701 -41.736 18.401 1078 1HG2 THR 143 HG21 THR 143 -17.331 -42.967 16.258 1079 2HG2 THR 143 HG22 THR 143 -17.760 -44.162 17.482 1080 3HG2 THR 143 HG23 THR 143 -16.170 -44.211 16.722 1081 H VAL 144 HN VAL 144 -18.157 -41.183 20.491 1082 HA VAL 144 HA VAL 144 -20.710 -42.288 19.761 1083 HB VAL 144 HB VAL 144 -20.053 -40.946 22.378 1084 1HG1 VAL 144 HG11 VAL 144 -21.787 -42.268 23.285 1085 2HG1 VAL 144 HG12 VAL 144 -21.873 -43.280 21.842 1086 3HG1 VAL 144 HG13 VAL 144 -22.424 -41.605 21.779 1087 1HG2 VAL 144 HG21 VAL 144 -19.761 -43.871 22.180 1088 2HG2 VAL 144 HG22 VAL 144 -18.831 -42.696 23.109 1089 3HG2 VAL 144 HG23 VAL 144 -18.504 -42.920 21.391 Start of MODEL 5 1 1H GLY 1 HT1 GLY 1 21.340 28.168 30.114 2 2H GLY 1 HT2 GLY 1 21.639 26.854 31.137 3 3H GLY 1 HT3 GLY 1 20.812 28.210 31.721 4 1HA GLY 1 HA2 GLY 1 18.991 27.766 30.154 5 2HA GLY 1 HA1 GLY 1 19.837 26.308 29.660 6 HA PRO 2 HA PRO 2 18.527 24.892 29.271 7 1HB PRO 2 HB1 PRO 2 16.220 23.523 29.308 8 2HB PRO 2 HB2 PRO 2 17.714 22.835 29.954 9 1HG PRO 2 HG2 PRO 2 15.424 24.104 31.409 10 2HG PRO 2 HG1 PRO 2 16.332 22.637 31.817 11 1HD PRO 2 HD1 PRO 2 16.785 25.081 32.970 12 2HD PRO 2 HD2 PRO 2 18.022 23.817 32.818 13 H LEU 3 HN LEU 3 16.202 24.768 27.870 14 HA LEU 3 HA LEU 3 15.484 27.548 27.656 15 1HB LEU 3 HB2 LEU 3 15.487 25.268 25.954 16 2HB LEU 3 HB1 LEU 3 13.852 25.898 25.998 17 HG LEU 3 HG LEU 3 14.999 28.192 25.516 18 1HD1 LEU 3 HD11 LEU 3 16.999 27.655 23.935 19 2HD1 LEU 3 HD12 LEU 3 17.151 26.208 24.934 20 3HD1 LEU 3 HD13 LEU 3 17.263 27.806 25.673 21 1HD2 LEU 3 HD21 LEU 3 15.193 26.523 23.111 22 2HD2 LEU 3 HD22 LEU 3 14.220 27.961 23.424 23 3HD2 LEU 3 HD23 LEU 3 13.672 26.384 23.994 24 H GLY 4 HN GLY 4 14.383 27.909 29.633 25 1HA GLY 4 HA1 GLY 4 11.988 26.396 30.227 26 2HA GLY 4 HA2 GLY 4 12.615 27.760 31.139 27 H SER 5 HN SER 5 10.284 28.309 31.202 28 HA SER 5 HA SER 5 9.091 29.267 28.750 29 1HB SER 5 HB2 SER 5 8.163 28.551 31.368 30 2HB SER 5 HB1 SER 5 7.620 30.187 30.995 31 HG SER 5 HG SER 5 7.189 28.877 28.815 32 H ALA 6 HN ALA 6 7.842 31.543 29.274 33 HA ALA 6 HA ALA 6 9.842 33.458 30.244 34 1HB ALA 6 HB1 ALA 6 9.986 33.164 27.740 35 2HB ALA 6 HB2 ALA 6 9.727 34.813 28.311 36 3HB ALA 6 HB3 ALA 6 8.379 33.886 27.652 37 H ALA 7 HN ALA 7 8.766 34.268 31.950 38 HA ALA 7 HA ALA 7 5.921 34.793 31.826 39 1HB ALA 7 HB1 ALA 7 6.539 35.796 34.190 40 2HB ALA 7 HB2 ALA 7 7.999 34.836 33.950 41 3HB ALA 7 HB3 ALA 7 6.417 34.056 33.929 42 H ALA 8 HN ALA 8 5.101 36.945 32.608 43 HA ALA 8 HA ALA 8 6.812 39.210 31.935 44 1HB ALA 8 HB1 ALA 8 4.891 40.140 30.519 45 2HB ALA 8 HB2 ALA 8 4.320 38.473 30.439 46 3HB ALA 8 HB3 ALA 8 5.911 38.891 29.806 47 H ALA 9 HN ALA 9 6.518 40.821 33.325 48 HA ALA 9 HA ALA 9 5.691 42.070 35.036 49 1HB ALA 9 HB1 ALA 9 2.895 41.854 34.673 50 2HB ALA 9 HB2 ALA 9 3.642 41.858 33.076 51 3HB ALA 9 HB3 ALA 9 3.963 43.175 34.204 52 H THR 10 HN THR 10 6.323 40.681 36.712 53 HA THR 10 HA THR 10 4.084 39.275 37.988 54 HB THR 10 HB THR 10 5.370 37.507 37.036 55 HG1 THR 10 HG1 THR 10 5.850 37.922 39.778 56 1HG2 THR 10 HG21 THR 10 7.818 38.761 38.245 57 2HG2 THR 10 HG22 THR 10 7.434 38.652 36.527 58 3HG2 THR 10 HG23 THR 10 7.750 37.187 37.454 59 HA PRO 11 HA PRO 11 5.311 41.956 41.341 60 1HB PRO 11 HB2 PRO 11 3.602 40.167 42.958 61 2HB PRO 11 HB1 PRO 11 3.484 41.911 42.705 62 1HG PRO 11 HG2 PRO 11 1.739 40.228 41.578 63 2HG PRO 11 HG1 PRO 11 2.302 41.679 40.728 64 1HD PRO 11 HD2 PRO 11 3.148 38.826 40.377 65 2HD PRO 11 HD1 PRO 11 2.850 40.073 39.146 66 H ALA 12 HN ALA 12 7.491 41.138 41.373 67 HA ALA 12 HA ALA 12 7.977 38.896 43.202 68 1HB ALA 12 HB1 ALA 12 10.245 40.168 41.803 69 2HB ALA 12 HB2 ALA 12 9.068 39.327 40.795 70 3HB ALA 12 HB3 ALA 12 9.896 38.463 42.090 71 H VAL 13 HN VAL 13 7.600 42.126 43.401 72 HA VAL 13 HA VAL 13 9.743 42.541 45.363 73 HB VAL 13 HB VAL 13 8.805 44.957 45.290 74 1HG1 VAL 13 HG11 VAL 13 10.175 43.900 42.824 75 2HG1 VAL 13 HG12 VAL 13 10.983 44.152 44.371 76 3HG1 VAL 13 HG13 VAL 13 10.290 45.523 43.504 77 1HG2 VAL 13 HG21 VAL 13 7.824 45.508 43.054 78 2HG2 VAL 13 HG22 VAL 13 6.763 44.585 44.118 79 3HG2 VAL 13 HG23 VAL 13 7.602 43.777 42.793 80 H ARG 14 HN ARG 14 9.319 42.479 47.470 81 HA ARG 14 HA ARG 14 6.534 42.329 48.339 82 1HB ARG 14 HB2 ARG 14 9.154 41.591 49.623 83 2HB ARG 14 HB1 ARG 14 7.671 41.692 50.562 84 1HG ARG 14 HG2 ARG 14 6.646 39.982 49.191 85 2HG ARG 14 HG1 ARG 14 8.078 39.920 48.161 86 1HD ARG 14 HD2 ARG 14 8.764 39.583 50.948 87 2HD ARG 14 HD1 ARG 14 7.575 38.389 50.432 88 HE ARG 14 HE ARG 14 10.328 38.519 49.669 89 1HH1 ARG 14 HH11 ARG 14 7.158 37.504 48.636 90 2HH1 ARG 14 HH12 ARG 14 7.759 36.291 47.557 91 1HH2 ARG 14 HH21 ARG 14 11.126 36.924 48.251 92 2HH2 ARG 14 HH22 ARG 14 10.014 35.961 47.338 93 H THR 15 HN THR 15 5.687 44.300 48.646 94 HA THR 15 HA THR 15 7.272 46.297 50.110 95 HB THR 15 HB THR 15 4.858 47.436 49.154 96 HG1 THR 15 HG1 THR 15 6.202 45.857 47.223 97 1HG2 THR 15 HG21 THR 15 7.348 48.292 49.310 98 2HG2 THR 15 HG22 THR 15 6.186 48.990 48.181 99 3HG2 THR 15 HG23 THR 15 7.359 47.800 47.617 100 H VAL 16 HN VAL 16 6.908 45.491 52.191 101 HA VAL 16 HA VAL 16 4.122 45.490 53.128 102 HB VAL 16 HB VAL 16 5.351 44.515 55.256 103 1HG1 VAL 16 HG11 VAL 16 3.626 43.429 53.804 104 2HG1 VAL 16 HG12 VAL 16 4.799 42.318 54.514 105 3HG1 VAL 16 HG13 VAL 16 4.944 42.791 52.821 106 1HG2 VAL 16 HG21 VAL 16 7.597 44.869 54.146 107 2HG2 VAL 16 HG22 VAL 16 7.175 43.532 53.076 108 3HG2 VAL 16 HG23 VAL 16 7.305 43.264 54.815 109 HA PRO 17 HA PRO 17 3.046 45.581 55.082 110 1HB PRO 17 HB2 PRO 17 1.456 47.929 55.732 111 2HB PRO 17 HB1 PRO 17 1.835 46.531 56.741 112 1HG PRO 17 HG1 PRO 17 2.829 49.015 57.218 113 2HG PRO 17 HG2 PRO 17 3.690 47.527 57.651 114 1HD PRO 17 HD2 PRO 17 4.099 49.336 55.299 115 2HD PRO 17 HD1 PRO 17 5.306 48.534 56.326 116 H GLN 18 HN GLN 18 0.967 45.444 53.990 117 HA GLN 18 HA GLN 18 1.083 46.654 51.359 118 1HB GLN 18 HB2 GLN 18 -0.741 44.576 52.575 119 2HB GLN 18 HB1 GLN 18 -0.919 45.174 50.931 120 1HG GLN 18 HG2 GLN 18 0.866 44.025 50.169 121 2HG GLN 18 HG1 GLN 18 1.755 44.184 51.683 122 1HE2 GLN 18 HE21 GLN 18 1.228 42.772 53.418 123 2HE2 GLN 18 HE22 GLN 18 0.513 41.230 53.108 124 H TYR 19 HN TYR 19 -1.330 47.092 50.483 125 HA TYR 19 HA TYR 19 -2.118 49.515 51.707 126 1HB TYR 19 HB1 TYR 19 -3.260 47.809 49.511 127 2HB TYR 19 HB2 TYR 19 -4.145 49.212 50.105 128 HD1 TYR 19 HD1 TYR 19 -0.901 48.175 48.619 129 HD2 TYR 19 HD2 TYR 19 -3.621 51.366 49.343 130 HE1 TYR 19 HE1 TYR 19 0.422 49.631 47.141 131 HE2 TYR 19 HE2 TYR 19 -2.307 52.829 47.868 132 HH TYR 19 HH TYR 19 -0.303 53.054 46.805 133 H LYS 20 HN LYS 20 -4.569 49.889 52.149 134 HA LYS 20 HA LYS 20 -5.347 47.914 54.173 135 1HB LYS 20 HB1 LYS 20 -7.033 50.033 54.557 136 2HB LYS 20 HB2 LYS 20 -5.507 49.798 55.397 137 1HG LYS 20 HG1 LYS 20 -4.688 51.657 54.523 138 2HG LYS 20 HG2 LYS 20 -5.027 51.087 52.888 139 1HD LYS 20 HD2 LYS 20 -7.445 51.805 53.346 140 2HD LYS 20 HD1 LYS 20 -6.781 52.696 54.716 141 1HE LYS 20 HE1 LYS 20 -5.189 53.775 53.079 142 2HE LYS 20 HE2 LYS 20 -6.159 53.057 51.795 143 1HZ LYS 20 HZ1 LYS 20 -6.613 55.454 53.065 144 2HZ LYS 20 HZ2 LYS 20 -7.800 54.414 53.672 145 3HZ LYS 20 HZ3 LYS 20 -7.661 54.655 52.004 146 H TYR 21 HN TYR 21 -5.877 48.102 51.107 147 HA TYR 21 HA TYR 21 -8.795 47.999 51.118 148 1HB TYR 21 HB2 TYR 21 -6.716 48.077 48.944 149 2HB TYR 21 HB1 TYR 21 -8.377 47.613 48.588 150 HD1 TYR 21 HD1 TYR 21 -6.154 50.298 48.677 151 HD2 TYR 21 HD2 TYR 21 -10.189 49.304 49.589 152 HE1 TYR 21 HE1 TYR 21 -6.773 52.669 48.492 153 HE2 TYR 21 HE2 TYR 21 -10.821 51.673 49.406 154 HH TYR 21 HH TYR 21 -9.764 53.763 48.080 155 H ALA 22 HN ALA 22 -9.631 46.121 51.754 156 HA ALA 22 HA ALA 22 -8.232 43.627 51.357 157 1HB ALA 22 HB1 ALA 22 -9.309 43.603 53.383 158 2HB ALA 22 HB2 ALA 22 -10.480 42.755 52.373 159 3HB ALA 22 HB3 ALA 22 -10.723 44.457 52.765 160 H ALA 23 HN ALA 23 -11.658 44.328 50.723 161 HA ALA 23 HA ALA 23 -11.568 42.569 48.407 162 1HB ALA 23 HB1 ALA 23 -14.118 43.289 48.447 163 2HB ALA 23 HB2 ALA 23 -13.711 43.714 50.110 164 3HB ALA 23 HB3 ALA 23 -13.476 42.062 49.540 165 H GLY 24 HN GLY 24 -10.040 44.630 47.758 166 1HA GLY 24 HA2 GLY 24 -11.718 46.541 46.277 167 2HA GLY 24 HA1 GLY 24 -10.020 46.768 46.673 168 H VAL 25 HN VAL 25 -10.253 43.649 45.726 169 HA VAL 25 HA VAL 25 -9.473 44.331 42.975 170 HB VAL 25 HB VAL 25 -8.605 41.869 43.056 171 1HG1 VAL 25 HG11 VAL 25 -6.448 42.649 43.838 172 2HG1 VAL 25 HG12 VAL 25 -7.205 44.045 44.605 173 3HG1 VAL 25 HG13 VAL 25 -7.217 43.890 42.848 174 1HG2 VAL 25 HG21 VAL 25 -9.647 41.318 45.207 175 2HG2 VAL 25 HG22 VAL 25 -8.661 42.550 45.994 176 3HG2 VAL 25 HG23 VAL 25 -7.894 41.140 45.264 177 H ARG 26 HN ARG 26 -11.132 44.148 41.609 178 HA ARG 26 HA ARG 26 -13.241 42.213 42.064 179 1HB ARG 26 HB2 ARG 26 -13.346 44.689 41.080 180 2HB ARG 26 HB1 ARG 26 -13.114 43.829 39.564 181 1HG ARG 26 HG2 ARG 26 -15.403 43.930 39.700 182 2HG ARG 26 HG1 ARG 26 -15.077 42.348 40.414 183 1HD ARG 26 HD2 ARG 26 -15.417 43.143 42.598 184 2HD ARG 26 HD1 ARG 26 -15.304 44.827 42.091 185 HE ARG 26 HE ARG 26 -17.472 44.537 41.010 186 1HH1 ARG 26 HH11 ARG 26 -16.511 42.149 43.361 187 2HH1 ARG 26 HH12 ARG 26 -18.133 41.650 43.706 188 1HH2 ARG 26 HH21 ARG 26 -19.611 43.885 41.459 189 2HH2 ARG 26 HH22 ARG 26 -19.894 42.636 42.625 190 H ASN 27 HN ASN 27 -14.055 41.212 39.820 191 HA ASN 27 HA ASN 27 -11.892 39.459 38.990 192 1HB ASN 27 HB2 ASN 27 -14.883 39.412 38.600 193 2HB ASN 27 HB1 ASN 27 -13.817 38.288 37.760 194 1HD2 ASN 27 HD21 ASN 27 -15.899 37.779 39.734 195 2HD2 ASN 27 HD22 ASN 27 -15.132 36.935 41.031 196 HA PRO 28 HA PRO 28 -11.840 37.936 37.295 197 1HB PRO 28 HB1 PRO 28 -10.064 37.345 35.387 198 2HB PRO 28 HB2 PRO 28 -11.794 37.425 35.034 199 1HG PRO 28 HG1 PRO 28 -9.650 39.441 34.495 200 2HG PRO 28 HG2 PRO 28 -11.006 38.946 33.466 201 1HD PRO 28 HD1 PRO 28 -10.971 41.218 35.038 202 2HD PRO 28 HD2 PRO 28 -12.444 40.409 34.468 203 H GLN 29 HN GLN 29 -9.688 36.787 37.704 204 HA GLN 29 HA GLN 29 -7.997 38.593 39.221 205 1HB GLN 29 HB2 GLN 29 -8.856 35.959 39.563 206 2HB GLN 29 HB1 GLN 29 -7.143 35.816 39.191 207 1HG GLN 29 HG1 GLN 29 -7.213 37.867 41.020 208 2HG GLN 29 HG2 GLN 29 -8.460 36.763 41.600 209 1HE2 GLN 29 HE21 GLN 29 -7.199 36.283 43.420 210 2HE2 GLN 29 HE22 GLN 29 -5.830 35.234 43.321 211 H GLN 30 HN GLN 30 -5.580 37.184 39.144 212 HA GLN 30 HA GLN 30 -4.397 38.298 36.809 213 1HB GLN 30 HB1 GLN 30 -3.456 36.781 39.182 214 2HB GLN 30 HB2 GLN 30 -2.433 36.727 37.754 215 1HG GLN 30 HG2 GLN 30 -1.536 38.602 38.543 216 2HG GLN 30 HG1 GLN 30 -2.999 39.389 37.949 217 1HE2 GLN 30 HE21 GLN 30 -4.621 39.953 39.405 218 2HE2 GLN 30 HE22 GLN 30 -4.334 40.046 41.106 219 H HIS 31 HN HIS 31 -2.903 36.954 35.402 220 HA HIS 31 HA HIS 31 -4.190 34.391 34.730 221 1HB HIS 31 HB2 HIS 31 -3.542 36.730 33.024 222 2HB HIS 31 HB1 HIS 31 -3.213 35.144 32.333 223 HD2 HIS 31 HD2 HIS 31 -5.638 37.066 31.193 224 HE1 HIS 31 HE1 HIS 31 -8.095 34.130 33.003 225 HE2 HIS 31 HE2 HIS 31 -8.014 36.028 31.322 226 H LEU 32 HN LEU 32 -2.405 33.721 36.268 227 HA LEU 32 HA LEU 32 0.284 33.782 35.232 228 1HB LEU 32 HB1 LEU 32 -1.043 32.979 37.704 229 2HB LEU 32 HB2 LEU 32 0.233 31.873 37.232 230 HG LEU 32 HG LEU 32 1.683 34.013 36.993 231 1HD1 LEU 32 HD21 LEU 32 -0.643 35.001 38.619 232 2HD1 LEU 32 HD22 LEU 32 0.064 35.717 37.170 233 3HD1 LEU 32 HD23 LEU 32 0.956 35.742 38.692 234 1HD2 LEU 32 HD11 LEU 32 0.830 32.621 39.485 235 2HD2 LEU 32 HD12 LEU 32 1.937 33.989 39.595 236 3HD2 LEU 32 HD13 LEU 32 2.376 32.573 38.640 237 H ASN 33 HN ASN 33 1.541 31.793 34.877 238 HA ASN 33 HA ASN 33 0.000 29.928 33.253 239 1HB ASN 33 HB2 ASN 33 2.996 30.210 33.588 240 2HB ASN 33 HB1 ASN 33 2.186 29.172 32.419 241 1HD2 ASN 33 HD21 ASN 33 3.404 32.256 33.059 242 2HD2 ASN 33 HD22 ASN 33 2.839 33.045 31.630 243 H ALA 34 HN ALA 34 -0.482 29.644 35.967 244 HA ALA 34 HA ALA 34 1.142 27.524 37.045 245 1HB ALA 34 HB1 ALA 34 -1.394 28.848 37.964 246 2HB ALA 34 HB2 ALA 34 0.225 28.982 38.651 247 3HB ALA 34 HB3 ALA 34 -0.679 27.477 38.811 248 H GLN 35 HN GLN 35 -1.194 27.632 34.705 249 HA GLN 35 HA GLN 35 -2.205 24.941 35.313 250 1HB GLN 35 HB2 GLN 35 -3.599 27.168 34.586 251 2HB GLN 35 HB1 GLN 35 -3.357 26.396 33.023 252 1HG GLN 35 HG2 GLN 35 -5.427 25.630 33.847 253 2HG GLN 35 HG1 GLN 35 -4.289 24.296 34.030 254 1HE2 GLN 35 HE21 GLN 35 -6.503 26.325 35.578 255 2HE2 GLN 35 HE22 GLN 35 -6.218 25.807 37.202 256 HA PRO 36 HA PRO 36 0.701 23.600 32.158 257 1HB PRO 36 HB1 PRO 36 0.101 20.956 32.315 258 2HB PRO 36 HB2 PRO 36 1.128 21.779 33.495 259 1HG PRO 36 HG1 PRO 36 -1.782 21.086 33.671 260 2HG PRO 36 HG2 PRO 36 -0.516 20.908 34.900 261 1HD PRO 36 HD2 PRO 36 -2.263 22.967 34.921 262 2HD PRO 36 HD1 PRO 36 -0.585 23.145 35.475 263 H GLN 37 HN GLN 37 -2.731 22.921 32.275 264 HA GLN 37 HA GLN 37 -2.747 22.175 29.446 265 1HB GLN 37 HB2 GLN 37 -4.240 21.334 31.678 266 2HB GLN 37 HB1 GLN 37 -5.362 22.234 30.666 267 1HG GLN 37 HG2 GLN 37 -5.460 19.925 30.065 268 2HG GLN 37 HG1 GLN 37 -4.701 20.819 28.749 269 1HE2 GLN 37 HE21 GLN 37 -4.196 18.556 31.345 270 2HE2 GLN 37 HE22 GLN 37 -2.652 17.989 30.818 271 H VAL 38 HN VAL 38 -2.050 24.779 29.773 272 HA VAL 38 HA VAL 38 -4.377 26.480 29.585 273 HB VAL 38 HB VAL 38 -2.455 27.436 30.644 274 1HG1 VAL 38 HG21 VAL 38 -0.568 26.352 29.919 275 2HG1 VAL 38 HG22 VAL 38 -0.414 27.883 29.056 276 3HG1 VAL 38 HG23 VAL 38 -1.028 26.456 28.220 277 1HG2 VAL 38 HG11 VAL 38 -2.446 28.785 27.973 278 2HG2 VAL 38 HG12 VAL 38 -2.396 29.497 29.587 279 3HG2 VAL 38 HG13 VAL 38 -3.896 28.795 28.979 280 H THR 39 HN THR 39 -5.481 26.861 27.789 281 HA THR 39 HA THR 39 -4.210 26.250 25.205 282 HB THR 39 HB THR 39 -7.168 26.504 25.434 283 HG1 THR 39 HG1 THR 39 -6.705 24.007 25.918 284 1HG2 THR 39 HG21 THR 39 -5.804 24.232 24.117 285 2HG2 THR 39 HG22 THR 39 -5.688 25.823 23.365 286 3HG2 THR 39 HG23 THR 39 -7.269 25.101 23.659 287 H MET 40 HN MET 40 -3.265 28.415 25.266 288 HA MET 40 HA MET 40 -5.149 30.617 24.894 289 1HB MET 40 HB1 MET 40 -3.019 32.003 24.863 290 2HB MET 40 HB2 MET 40 -3.397 31.192 26.376 291 1HG MET 40 HG2 MET 40 -1.765 29.502 25.958 292 2HG MET 40 HG1 MET 40 -1.488 30.105 24.325 293 1HE MET 40 HE1 MET 40 0.730 31.589 23.888 294 2HE MET 40 HE2 MET 40 0.943 30.023 24.670 295 3HE MET 40 HE3 MET 40 1.837 31.428 25.251 296 H GLN 41 HN GLN 41 -3.354 28.420 23.056 297 HA GLN 41 HA GLN 41 -4.084 29.781 20.608 298 1HB GLN 41 HB2 GLN 41 -1.871 30.748 21.147 299 2HB GLN 41 HB1 GLN 41 -1.185 29.130 21.184 300 1HG GLN 41 HG2 GLN 41 -0.672 30.214 19.091 301 2HG GLN 41 HG1 GLN 41 -1.746 28.843 18.819 302 1HE2 GLN 41 HE21 GLN 41 -1.645 32.348 19.129 303 2HE2 GLN 41 HE22 GLN 41 -3.034 32.658 18.151 304 H GLN 42 HN GLN 42 -4.210 28.401 18.831 305 HA GLN 42 HA GLN 42 -3.307 25.655 19.094 306 1HB GLN 42 HB2 GLN 42 -6.038 26.439 19.614 307 2HB GLN 42 HB1 GLN 42 -5.962 25.363 18.226 308 1HG GLN 42 HG2 GLN 42 -4.438 24.610 20.658 309 2HG GLN 42 HG1 GLN 42 -6.194 24.455 20.692 310 1HE2 GLN 42 HE22 GLN 42 -6.849 23.617 18.252 311 2HE2 GLN 42 HE21 GLN 42 -6.115 22.095 17.893 312 HA PRO 43 HA PRO 43 -2.829 26.814 14.758 313 1HB PRO 43 HB2 PRO 43 -1.143 24.809 14.106 314 2HB PRO 43 HB1 PRO 43 -0.610 26.240 14.996 315 1HG PRO 43 HG2 PRO 43 -1.317 23.518 16.032 316 2HG PRO 43 HG1 PRO 43 0.052 24.557 16.467 317 1HD PRO 43 HD1 PRO 43 -2.190 24.366 17.985 318 2HD PRO 43 HD2 PRO 43 -1.219 25.848 17.888 319 H ALA 44 HN ALA 44 -5.009 26.301 14.220 320 HA ALA 44 HA ALA 44 -5.788 23.557 13.801 321 1HB ALA 44 HB1 ALA 44 -7.285 26.011 12.916 322 2HB ALA 44 HB2 ALA 44 -7.339 25.387 14.565 323 3HB ALA 44 HB3 ALA 44 -7.926 24.397 13.228 324 H VAL 45 HN VAL 45 -5.574 22.414 11.994 325 HA VAL 45 HA VAL 45 -4.469 23.697 9.627 326 HB VAL 45 HB VAL 45 -3.475 21.591 10.457 327 1HG1 VAL 45 HG11 VAL 45 -4.746 19.884 11.078 328 2HG1 VAL 45 HG12 VAL 45 -5.340 19.714 9.426 329 3HG1 VAL 45 HG13 VAL 45 -6.185 20.765 10.565 330 1HG2 VAL 45 HG21 VAL 45 -2.983 21.971 8.223 331 2HG2 VAL 45 HG22 VAL 45 -4.653 21.734 7.711 332 3HG2 VAL 45 HG23 VAL 45 -3.675 20.349 8.197 333 H HIS 46 HN HIS 46 -5.433 23.706 7.606 334 HA HIS 46 HA HIS 46 -8.312 23.637 7.614 335 1HB HIS 46 HB1 HIS 46 -6.190 24.638 5.825 336 2HB HIS 46 HB2 HIS 46 -7.641 24.068 5.006 337 HD2 HIS 46 HD2 HIS 46 -8.867 26.378 4.378 338 HE1 HIS 46 HE1 HIS 46 -8.720 28.108 8.238 339 HE2 HIS 46 HE2 HIS 46 -9.594 28.371 5.872 340 H VAL 47 HN VAL 47 -6.206 22.353 5.067 341 HA VAL 47 HA VAL 47 -8.041 20.144 4.669 342 HB VAL 47 HB VAL 47 -7.089 21.384 2.739 343 1HG1 VAL 47 HG11 VAL 47 -4.760 20.884 2.063 344 2HG1 VAL 47 HG12 VAL 47 -4.510 20.098 3.622 345 3HG1 VAL 47 HG13 VAL 47 -4.865 21.824 3.552 346 1HG2 VAL 47 HG21 VAL 47 -7.332 19.567 1.461 347 2HG2 VAL 47 HG22 VAL 47 -7.600 18.707 2.978 348 3HG2 VAL 47 HG23 VAL 47 -5.996 18.724 2.245 349 H GLN 48 HN GLN 48 -7.545 17.970 4.875 350 HA GLN 48 HA GLN 48 -5.723 17.289 6.946 351 1HB GLN 48 HB2 GLN 48 -7.946 16.117 5.941 352 2HB GLN 48 HB1 GLN 48 -6.707 15.132 5.176 353 1HG GLN 48 HG1 GLN 48 -6.141 14.121 7.092 354 2HG GLN 48 HG2 GLN 48 -6.308 15.597 8.042 355 1HE2 GLN 48 HE22 GLN 48 -7.882 15.590 9.463 356 2HE2 GLN 48 HE21 GLN 48 -9.329 14.649 9.383 357 H GLY 49 HN GLY 49 -4.170 15.363 6.599 358 1HA GLY 49 HA2 GLY 49 -2.407 16.117 4.375 359 2HA GLY 49 HA1 GLY 49 -1.917 15.264 5.831 360 H GLN 50 HN GLN 50 -4.003 14.864 2.973 361 HA GLN 50 HA GLN 50 -3.555 11.975 3.088 362 1HB GLN 50 HB2 GLN 50 -5.719 13.652 2.226 363 2HB GLN 50 HB1 GLN 50 -5.198 12.646 0.882 364 1HG GLN 50 HG2 GLN 50 -5.276 10.822 2.875 365 2HG GLN 50 HG1 GLN 50 -6.565 11.918 3.373 366 1HE2 GLN 50 HE21 GLN 50 -5.403 10.664 0.259 367 2HE2 GLN 50 HE22 GLN 50 -6.946 10.110 -0.286 368 H GLU 51 HN GLU 51 -1.395 11.923 2.393 369 HA GLU 51 HA GLU 51 -0.768 13.003 -0.231 370 1HB GLU 51 HB2 GLU 51 0.848 11.860 2.009 371 2HB GLU 51 HB1 GLU 51 1.535 11.909 0.390 372 1HG GLU 51 HG1 GLU 51 0.312 14.418 1.301 373 2HG GLU 51 HG2 GLU 51 1.733 13.899 2.206 374 HA PRO 52 HA PRO 52 -1.332 10.410 2.258 375 1HB PRO 52 HB1 PRO 52 -1.313 7.844 2.948 376 2HB PRO 52 HB2 PRO 52 -2.643 8.508 1.993 377 1HG PRO 52 HG2 PRO 52 -0.320 6.849 1.117 378 2HG PRO 52 HG1 PRO 52 -2.005 6.795 0.572 379 1HD PRO 52 HD1 PRO 52 0.100 8.095 -0.733 380 2HD PRO 52 HD2 PRO 52 -1.629 8.360 -1.031 381 H LEU 53 HN LEU 53 -0.234 9.157 4.236 382 HA LEU 53 HA LEU 53 2.484 9.953 4.227 383 1HB LEU 53 HB2 LEU 53 0.577 9.416 6.145 384 2HB LEU 53 HB1 LEU 53 1.715 8.097 6.349 385 HG LEU 53 HG LEU 53 3.188 10.540 6.137 386 1HD1 LEU 53 HD21 LEU 53 0.639 10.854 7.420 387 2HD1 LEU 53 HD22 LEU 53 1.904 12.050 7.134 388 3HD1 LEU 53 HD23 LEU 53 1.943 11.054 8.590 389 1HD2 LEU 53 HD11 LEU 53 4.100 9.849 8.225 390 2HD2 LEU 53 HD12 LEU 53 3.816 8.396 7.266 391 3HD2 LEU 53 HD13 LEU 53 2.701 8.826 8.565 392 H THR 54 HN THR 54 4.362 8.757 4.306 393 HA THR 54 HA THR 54 4.446 5.928 4.337 394 HB THR 54 HB THR 54 5.608 6.387 1.800 395 HG1 THR 54 HG1 THR 54 4.344 7.746 0.859 396 1HG2 THR 54 HG21 THR 54 3.743 4.603 2.985 397 2HG2 THR 54 HG22 THR 54 4.701 4.398 1.519 398 3HG2 THR 54 HG23 THR 54 3.107 5.150 1.433 399 H ALA 55 HN ALA 55 6.855 5.637 2.810 400 HA ALA 55 HA ALA 55 8.745 6.358 4.736 401 1HB ALA 55 HB1 ALA 55 9.275 5.673 1.855 402 2HB ALA 55 HB2 ALA 55 9.016 4.503 3.149 403 3HB ALA 55 HB3 ALA 55 10.419 5.572 3.193 404 H SER 56 HN SER 56 7.863 7.925 1.687 405 HA SER 56 HA SER 56 9.908 9.835 1.611 406 1HB SER 56 HB1 SER 56 7.056 10.200 0.661 407 2HB SER 56 HB2 SER 56 8.472 11.100 0.116 408 HG SER 56 HG SER 56 7.688 9.224 -1.197 409 H MET 57 HN MET 57 6.696 9.951 3.107 410 HA MET 57 HA MET 57 6.825 12.573 4.098 411 1HB MET 57 HB1 MET 57 5.329 10.108 4.946 412 2HB MET 57 HB2 MET 57 5.227 11.581 5.894 413 1HG MET 57 HG1 MET 57 3.571 10.919 3.853 414 2HG MET 57 HG2 MET 57 3.841 12.557 4.446 415 1HE MET 57 HE1 MET 57 5.145 10.740 0.480 416 2HE MET 57 HE2 MET 57 3.553 10.599 1.224 417 3HE MET 57 HE3 MET 57 4.952 9.837 1.982 418 H LEU 58 HN LEU 58 7.818 9.484 5.475 419 HA LEU 58 HA LEU 58 8.581 10.307 8.023 420 1HB LEU 58 HB1 LEU 58 9.546 8.137 6.180 421 2HB LEU 58 HB2 LEU 58 10.290 8.371 7.749 422 HG LEU 58 HG LEU 58 8.647 7.270 8.794 423 1HD1 LEU 58 HD11 LEU 58 7.165 9.258 8.546 424 2HD1 LEU 58 HD12 LEU 58 6.307 7.718 8.589 425 3HD1 LEU 58 HD13 LEU 58 6.548 8.550 7.053 426 1HD2 LEU 58 HD21 LEU 58 7.410 6.577 6.164 427 2HD2 LEU 58 HD22 LEU 58 7.688 5.558 7.576 428 3HD2 LEU 58 HD23 LEU 58 9.045 6.035 6.551 429 H ALA 59 HN ALA 59 10.487 10.102 5.044 430 HA ALA 59 HA ALA 59 12.885 11.107 6.163 431 1HB ALA 59 HB1 ALA 59 13.719 11.179 3.934 432 2HB ALA 59 HB2 ALA 59 12.088 11.202 3.261 433 3HB ALA 59 HB3 ALA 59 12.691 9.753 4.068 434 H SER 60 HN SER 60 9.997 12.671 5.460 435 HA SER 60 HA SER 60 11.163 15.206 4.696 436 1HB SER 60 HB2 SER 60 8.304 14.499 5.403 437 2HB SER 60 HB1 SER 60 8.841 16.031 4.713 438 HG SER 60 HG SER 60 9.370 14.995 2.834 439 H ALA 61 HN ALA 61 10.738 13.580 7.585 440 HA ALA 61 HA ALA 61 10.999 16.098 9.080 441 1HB ALA 61 HB1 ALA 61 8.891 15.746 9.790 442 2HB ALA 61 HB2 ALA 61 9.668 14.605 10.888 443 3HB ALA 61 HB3 ALA 61 8.930 14.027 9.393 444 HA PRO 62 HA PRO 62 14.049 12.928 10.580 445 1HB PRO 62 HB2 PRO 62 16.187 13.312 9.032 446 2HB PRO 62 HB1 PRO 62 14.809 12.368 8.456 447 1HG PRO 62 HG1 PRO 62 15.659 15.115 7.727 448 2HG PRO 62 HG2 PRO 62 14.789 13.913 6.762 449 1HD PRO 62 HD1 PRO 62 13.687 16.111 8.213 450 2HD PRO 62 HD2 PRO 62 12.809 14.849 7.328 451 HA PRO 63 HA PRO 63 14.835 12.386 12.010 452 1HB PRO 63 HB2 PRO 63 15.861 12.256 14.466 453 2HB PRO 63 HB1 PRO 63 16.919 12.299 13.051 454 1HG PRO 63 HG1 PRO 63 16.338 14.415 15.044 455 2HG PRO 63 HG2 PRO 63 17.789 14.165 14.060 456 1HD PRO 63 HD1 PRO 63 15.594 15.948 13.555 457 2HD PRO 63 HD2 PRO 63 17.041 15.686 12.561 458 H GLN 64 HN GLN 64 13.262 15.017 12.587 459 HA GLN 64 HA GLN 64 12.066 15.006 15.059 460 1HB GLN 64 HB1 GLN 64 11.763 16.598 13.026 461 2HB GLN 64 HB2 GLN 64 10.436 15.528 12.592 462 1HG GLN 64 HG1 GLN 64 9.106 16.588 13.997 463 2HG GLN 64 HG2 GLN 64 10.173 16.175 15.339 464 1HE2 GLN 64 HE21 GLN 64 9.330 18.589 12.981 465 2HE2 GLN 64 HE22 GLN 64 10.171 19.901 13.725 466 H GLU 65 HN GLU 65 10.041 13.947 12.366 467 HA GLU 65 HA GLU 65 9.018 11.807 14.096 468 1HB GLU 65 HB1 GLU 65 7.689 12.832 11.597 469 2HB GLU 65 HB2 GLU 65 6.965 11.947 12.931 470 1HG GLU 65 HG2 GLU 65 8.169 14.579 13.546 471 2HG GLU 65 HG1 GLU 65 6.672 14.564 12.615 472 H GLN 66 HN GLN 66 11.435 11.813 12.263 473 HA GLN 66 HA GLN 66 11.002 10.234 10.009 474 1HB GLN 66 HB1 GLN 66 13.200 11.333 11.285 475 2HB GLN 66 HB2 GLN 66 13.488 9.603 11.406 476 1HG GLN 66 HG1 GLN 66 12.773 9.777 8.823 477 2HG GLN 66 HG2 GLN 66 13.489 11.369 9.058 478 1HE2 GLN 66 HE22 GLN 66 15.082 10.626 7.518 479 2HE2 GLN 66 HE21 GLN 66 16.411 9.667 8.064 480 H LYS 67 HN LYS 67 11.266 9.375 13.380 481 HA LYS 67 HA LYS 67 10.596 6.599 12.672 482 1HB LYS 67 HB1 LYS 67 12.648 7.548 14.673 483 2HB LYS 67 HB2 LYS 67 11.980 5.922 14.701 484 1HG LYS 67 HG2 LYS 67 12.937 5.383 12.617 485 2HG LYS 67 HG1 LYS 67 13.317 7.071 12.270 486 1HD LYS 67 HD1 LYS 67 14.491 5.831 14.707 487 2HD LYS 67 HD2 LYS 67 15.162 5.387 13.135 488 1HE LYS 67 HE1 LYS 67 15.605 7.711 12.629 489 2HE LYS 67 HE2 LYS 67 14.836 8.214 14.135 490 1HZ LYS 67 HZ1 LYS 67 16.781 7.999 15.136 491 2HZ LYS 67 HZ2 LYS 67 17.505 7.461 13.705 492 3HZ LYS 67 HZ3 LYS 67 16.807 6.348 14.772 493 H GLN 68 HN GLN 68 8.946 8.895 13.548 494 HA GLN 68 HA GLN 68 7.846 7.657 15.981 495 1HB GLN 68 HB1 GLN 68 7.945 10.601 15.301 496 2HB GLN 68 HB2 GLN 68 7.116 9.915 16.691 497 1HG GLN 68 HG2 GLN 68 9.668 8.900 16.905 498 2HG GLN 68 HG1 GLN 68 9.921 10.543 16.316 499 1HE2 GLN 68 HE21 GLN 68 8.484 12.196 17.488 500 2HE2 GLN 68 HE22 GLN 68 8.444 12.059 19.210 501 H MET 69 HN MET 69 7.049 9.720 13.188 502 HA MET 69 HA MET 69 4.234 9.280 13.514 503 1HB MET 69 HB2 MET 69 3.949 10.728 11.633 504 2HB MET 69 HB1 MET 69 5.234 11.393 12.631 505 1HG MET 69 HG2 MET 69 6.848 10.992 11.082 506 2HG MET 69 HG1 MET 69 6.008 9.594 10.408 507 1HE MET 69 HE1 MET 69 7.022 13.195 9.717 508 2HE MET 69 HE2 MET 69 6.558 13.031 8.023 509 3HE MET 69 HE3 MET 69 7.538 11.783 8.793 510 H LEU 70 HN LEU 70 6.269 7.031 12.674 511 HA LEU 70 HA LEU 70 5.143 6.178 10.152 512 1HB LEU 70 HB1 LEU 70 6.468 4.006 11.401 513 2HB LEU 70 HB2 LEU 70 6.986 4.943 10.019 514 HG LEU 70 HG LEU 70 8.743 4.884 11.643 515 1HD1 LEU 70 HD11 LEU 70 7.356 7.436 11.117 516 2HD1 LEU 70 HD12 LEU 70 8.953 6.884 10.606 517 3HD1 LEU 70 HD13 LEU 70 8.700 7.443 12.257 518 1HD2 LEU 70 HD21 LEU 70 8.386 4.819 13.819 519 2HD2 LEU 70 HD22 LEU 70 6.657 5.000 13.521 520 3HD2 LEU 70 HD23 LEU 70 7.663 6.426 13.775 521 H GLY 71 HN GLY 71 4.875 5.312 13.558 522 1HA GLY 71 HA2 GLY 71 2.490 3.785 12.814 523 2HA GLY 71 HA1 GLY 71 3.622 3.134 13.981 524 H GLU 72 HN GLU 72 2.599 6.504 13.720 525 HA GLU 72 HA GLU 72 0.803 6.237 15.984 526 1HB GLU 72 HB2 GLU 72 2.036 7.308 17.555 527 2HB GLU 72 HB1 GLU 72 3.378 6.702 16.597 528 1HG GLU 72 HG1 GLU 72 3.722 8.788 15.564 529 2HG GLU 72 HG2 GLU 72 2.177 9.412 16.141 530 H ARG 73 HN ARG 73 1.784 7.792 13.147 531 HA ARG 73 HA ARG 73 -0.291 9.842 13.530 532 1HB ARG 73 HB1 ARG 73 2.333 10.445 13.339 533 2HB ARG 73 HB2 ARG 73 1.912 10.417 11.633 534 1HG ARG 73 HG1 ARG 73 0.248 11.978 13.561 535 2HG ARG 73 HG2 ARG 73 1.769 12.637 12.958 536 1HD ARG 73 HD2 ARG 73 0.722 13.301 11.119 537 2HD ARG 73 HD1 ARG 73 0.386 11.614 10.727 538 HE ARG 73 HE ARG 73 -1.777 11.889 11.481 539 1HH1 ARG 73 HH22 ARG 73 0.130 14.695 12.275 540 2HH1 ARG 73 HH21 ARG 73 -1.238 15.655 12.729 541 1HH2 ARG 73 HH12 ARG 73 -3.584 13.147 12.077 542 2HH2 ARG 73 HH11 ARG 73 -3.348 14.775 12.616 543 H LEU 74 HN LEU 74 0.932 7.266 11.686 544 HA LEU 74 HA LEU 74 -0.271 7.980 9.182 545 1HB LEU 74 HB1 LEU 74 1.359 5.829 10.246 546 2HB LEU 74 HB2 LEU 74 0.083 5.219 9.213 547 HG LEU 74 HG LEU 74 1.615 7.498 8.150 548 1HD1 LEU 74 HD11 LEU 74 3.615 6.451 7.818 549 2HD1 LEU 74 HD12 LEU 74 2.916 4.836 7.938 550 3HD1 LEU 74 HD13 LEU 74 3.178 5.795 9.397 551 1HD2 LEU 74 HD21 LEU 74 -0.197 6.276 6.946 552 2HD2 LEU 74 HD22 LEU 74 0.845 4.854 6.933 553 3HD2 LEU 74 HD23 LEU 74 1.343 6.321 6.088 554 H PHE 75 HN PHE 75 -1.459 6.788 12.099 555 HA PHE 75 HA PHE 75 -3.313 4.885 11.465 556 1HB PHE 75 HB1 PHE 75 -3.035 5.438 13.749 557 2HB PHE 75 HB2 PHE 75 -3.462 7.123 13.476 558 HD1 PHE 75 HD1 PHE 75 -5.178 3.996 12.402 559 HD2 PHE 75 HD2 PHE 75 -5.329 7.539 14.761 560 HE1 PHE 75 HE1 PHE 75 -7.520 3.506 12.993 561 HE2 PHE 75 HE2 PHE 75 -7.668 7.053 15.353 562 HZ PHE 75 HZ PHE 75 -8.766 5.035 14.468 563 HA PRO 76 HA PRO 76 -6.656 8.214 10.328 564 1HB PRO 76 HB1 PRO 76 -5.711 10.665 9.578 565 2HB PRO 76 HB2 PRO 76 -6.253 10.284 11.216 566 1HG PRO 76 HG2 PRO 76 -3.473 10.376 10.109 567 2HG PRO 76 HG1 PRO 76 -4.081 10.982 11.661 568 1HD PRO 76 HD2 PRO 76 -2.747 8.650 11.464 569 2HD PRO 76 HD1 PRO 76 -4.066 8.883 12.630 570 H LEU 77 HN LEU 77 -3.682 7.564 8.865 571 HA LEU 77 HA LEU 77 -4.620 8.278 6.190 572 1HB LEU 77 HB1 LEU 77 -1.941 7.436 7.272 573 2HB LEU 77 HB2 LEU 77 -2.262 7.515 5.555 574 HG LEU 77 HG LEU 77 -1.275 9.554 5.904 575 1HD1 LEU 77 HD21 LEU 77 -3.852 10.711 6.704 576 2HD1 LEU 77 HD22 LEU 77 -3.913 9.641 5.304 577 3HD1 LEU 77 HD23 LEU 77 -2.842 11.042 5.297 578 1HD2 LEU 77 HD11 LEU 77 -1.378 9.058 8.461 579 2HD2 LEU 77 HD12 LEU 77 -2.741 10.176 8.418 580 3HD2 LEU 77 HD13 LEU 77 -1.148 10.707 7.877 581 H ILE 78 HN ILE 78 -3.996 5.497 8.213 582 HA ILE 78 HA ILE 78 -3.902 3.578 6.127 583 HB ILE 78 HB ILE 78 -4.894 2.882 8.854 584 1HG1 ILE 78 HG12 ILE 78 -2.948 4.405 9.135 585 2HG1 ILE 78 HG11 ILE 78 -2.612 2.766 9.680 586 1HG2 ILE 78 HG21 ILE 78 -4.835 0.936 7.719 587 2HG2 ILE 78 HG22 ILE 78 -3.126 0.987 8.150 588 3HG2 ILE 78 HG23 ILE 78 -3.651 1.528 6.553 589 1HD1 ILE 78 HD11 ILE 78 -1.849 3.699 6.939 590 2HD1 ILE 78 HD12 ILE 78 -1.239 2.315 7.849 591 3HD1 ILE 78 HD13 ILE 78 -0.814 3.955 8.343 592 H GLN 79 HN GLN 79 -6.514 4.852 8.122 593 HA GLN 79 HA GLN 79 -8.578 3.134 7.446 594 1HB GLN 79 HB1 GLN 79 -8.357 5.947 8.325 595 2HB GLN 79 HB2 GLN 79 -9.855 5.546 7.498 596 1HG GLN 79 HG2 GLN 79 -10.177 3.683 9.104 597 2HG GLN 79 HG1 GLN 79 -8.744 4.237 9.969 598 1HE2 GLN 79 HE22 GLN 79 -8.808 6.570 10.628 599 2HE2 GLN 79 HE21 GLN 79 -10.308 7.171 11.240 600 H ALA 80 HN ALA 80 -6.836 5.282 5.491 601 HA ALA 80 HA ALA 80 -8.830 5.625 3.432 602 1HB ALA 80 HB1 ALA 80 -5.914 6.179 3.051 603 2HB ALA 80 HB2 ALA 80 -6.894 7.227 4.079 604 3HB ALA 80 HB3 ALA 80 -7.310 7.022 2.378 605 H MET 81 HN MET 81 -5.925 3.675 3.957 606 HA MET 81 HA MET 81 -5.917 2.531 1.332 607 1HB MET 81 HB1 MET 81 -4.641 1.191 3.690 608 2HB MET 81 HB2 MET 81 -4.080 1.279 2.028 609 1HG MET 81 HG2 MET 81 -2.992 3.206 2.363 610 2HG MET 81 HG1 MET 81 -4.244 3.859 3.412 611 1HE MET 81 HE1 MET 81 -0.883 1.203 3.852 612 2HE MET 81 HE2 MET 81 -0.249 2.762 4.396 613 3HE MET 81 HE3 MET 81 -1.058 2.635 2.832 614 H HIS 82 HN HIS 82 -6.999 1.464 4.514 615 HA HIS 82 HA HIS 82 -8.425 -0.775 3.236 616 1HB HIS 82 HB1 HIS 82 -6.886 -0.519 5.754 617 2HB HIS 82 HB2 HIS 82 -8.373 -1.452 5.863 618 HD2 HIS 82 HD2 HIS 82 -5.476 -1.502 3.164 619 HE1 HIS 82 HE1 HIS 82 -6.348 -5.429 4.473 620 HE2 HIS 82 HE2 HIS 82 -4.925 -4.023 2.912 621 HA PRO 83 HA PRO 83 -12.306 0.917 4.515 622 1HB PRO 83 HB1 PRO 83 -13.127 -1.742 5.498 623 2HB PRO 83 HB2 PRO 83 -13.830 -0.752 4.216 624 1HG PRO 83 HG1 PRO 83 -12.438 -2.973 3.659 625 2HG PRO 83 HG2 PRO 83 -12.358 -1.540 2.617 626 1HD PRO 83 HD2 PRO 83 -10.396 -2.510 4.662 627 2HD PRO 83 HD1 PRO 83 -10.097 -1.818 3.054 628 H THR 84 HN THR 84 -11.035 1.967 6.300 629 HA THR 84 HA THR 84 -10.618 2.488 8.475 630 HB THR 84 HB THR 84 -12.561 2.600 9.869 631 HG1 THR 84 HG1 THR 84 -14.467 1.403 9.243 632 1HG2 THR 84 HG21 THR 84 -13.439 4.130 8.551 633 2HG2 THR 84 HG22 THR 84 -14.323 2.859 7.705 634 3HG2 THR 84 HG23 THR 84 -12.733 3.361 7.130 635 H LEU 85 HN LEU 85 -9.695 -0.119 7.675 636 HA LEU 85 HA LEU 85 -10.215 -1.883 9.918 637 1HB LEU 85 HB1 LEU 85 -8.703 -2.097 7.350 638 2HB LEU 85 HB2 LEU 85 -8.337 -3.218 8.646 639 HG LEU 85 HG LEU 85 -11.062 -2.841 7.398 640 1HD1 LEU 85 HD21 LEU 85 -10.200 -4.065 5.741 641 2HD1 LEU 85 HD22 LEU 85 -10.252 -5.404 6.888 642 3HD1 LEU 85 HD23 LEU 85 -8.763 -4.482 6.674 643 1HD2 LEU 85 HD11 LEU 85 -10.143 -5.010 9.268 644 2HD2 LEU 85 HD12 LEU 85 -11.781 -4.682 8.706 645 3HD2 LEU 85 HD13 LEU 85 -10.986 -3.559 9.809 646 H ALA 86 HN ALA 86 -8.470 0.784 9.732 647 HA ALA 86 HA ALA 86 -5.890 -0.007 10.652 648 1HB ALA 86 HB1 ALA 86 -7.094 2.366 9.821 649 2HB ALA 86 HB2 ALA 86 -5.423 2.144 10.338 650 3HB ALA 86 HB3 ALA 86 -6.648 2.646 11.504 651 H GLY 87 HN GLY 87 -6.186 2.179 12.857 652 1HA GLY 87 HA1 GLY 87 -6.777 2.268 15.108 653 2HA GLY 87 HA2 GLY 87 -7.688 0.777 14.901 654 H LYS 88 HN LYS 88 -5.106 -0.235 13.527 655 HA LYS 88 HA LYS 88 -3.272 -0.469 15.739 656 1HB LYS 88 HB1 LYS 88 -4.960 -2.163 16.299 657 2HB LYS 88 HB2 LYS 88 -4.742 -2.906 14.722 658 1HG LYS 88 HG1 LYS 88 -2.217 -2.994 15.554 659 2HG LYS 88 HG2 LYS 88 -3.024 -3.009 17.127 660 1HD LYS 88 HD1 LYS 88 -3.440 -5.176 16.873 661 2HD LYS 88 HD2 LYS 88 -4.417 -4.809 15.450 662 1HE LYS 88 HE2 LYS 88 -2.628 -5.149 13.986 663 2HE LYS 88 HE1 LYS 88 -1.432 -4.992 15.271 664 1HZ LYS 88 HZ1 LYS 88 -1.616 -7.280 14.671 665 2HZ LYS 88 HZ2 LYS 88 -3.298 -7.261 14.846 666 3HZ LYS 88 HZ3 LYS 88 -2.305 -7.096 16.205 667 H ILE 89 HN ILE 89 -4.083 -0.962 12.392 668 HA ILE 89 HA ILE 89 -2.072 -2.542 11.472 669 HB ILE 89 HB ILE 89 -3.136 -0.061 10.121 670 1HG1 ILE 89 HG11 ILE 89 -3.940 -2.922 9.614 671 2HG1 ILE 89 HG12 ILE 89 -4.743 -1.941 10.836 672 1HG2 ILE 89 HG21 ILE 89 -1.091 -1.955 9.342 673 2HG2 ILE 89 HG22 ILE 89 -1.565 -0.432 8.586 674 3HG2 ILE 89 HG23 ILE 89 -2.425 -1.920 8.186 675 1HD1 ILE 89 HD11 ILE 89 -6.034 -1.888 8.829 676 2HD1 ILE 89 HD12 ILE 89 -4.625 -1.415 7.879 677 3HD1 ILE 89 HD13 ILE 89 -5.302 -0.300 9.065 678 H THR 90 HN THR 90 -1.708 0.947 10.887 679 HA THR 90 HA THR 90 1.064 0.858 10.609 680 HB THR 90 HB THR 90 -0.978 2.833 10.609 681 HG1 THR 90 HG1 THR 90 1.515 3.668 9.893 682 1HG2 THR 90 HG21 THR 90 1.195 3.450 12.511 683 2HG2 THR 90 HG22 THR 90 -0.482 4.001 12.475 684 3HG2 THR 90 HG23 THR 90 0.706 4.710 11.376 685 H GLY 91 HN GLY 91 -0.888 1.374 13.523 686 1HA GLY 91 HA2 GLY 91 1.223 2.028 15.281 687 2HA GLY 91 HA1 GLY 91 -0.297 1.272 15.749 688 H MET 92 HN MET 92 0.156 -0.917 13.848 689 HA MET 92 HA MET 92 1.645 -2.697 15.559 690 1HB MET 92 HB1 MET 92 -0.433 -3.151 13.958 691 2HB MET 92 HB2 MET 92 0.835 -3.438 12.778 692 1HG MET 92 HG1 MET 92 1.713 -4.876 14.888 693 2HG MET 92 HG2 MET 92 -0.024 -5.052 15.038 694 1HE MET 92 HE1 MET 92 -1.359 -5.134 12.786 695 2HE MET 92 HE2 MET 92 -1.106 -6.512 11.710 696 3HE MET 92 HE3 MET 92 -0.371 -4.952 11.335 697 H LEU 93 HN LEU 93 2.005 -1.108 12.499 698 HA LEU 93 HA LEU 93 4.231 -2.378 11.476 699 1HB LEU 93 HB2 LEU 93 3.005 0.287 11.157 700 2HB LEU 93 HB1 LEU 93 4.605 0.053 10.490 701 HG LEU 93 HG LEU 93 2.824 -0.314 8.818 702 1HD1 LEU 93 HD11 LEU 93 4.777 -2.383 9.612 703 2HD1 LEU 93 HD12 LEU 93 4.608 -1.501 8.093 704 3HD1 LEU 93 HD13 LEU 93 3.550 -2.869 8.441 705 1HD2 LEU 93 HD21 LEU 93 1.771 -2.777 9.363 706 2HD2 LEU 93 HD22 LEU 93 0.943 -1.237 9.594 707 3HD2 LEU 93 HD23 LEU 93 1.763 -2.007 10.955 708 H LEU 94 HN LEU 94 4.067 -0.719 14.333 709 HA LEU 94 HA LEU 94 6.935 -0.068 14.279 710 1HB LEU 94 HB1 LEU 94 4.601 1.193 15.549 711 2HB LEU 94 HB2 LEU 94 5.990 1.013 16.601 712 HG LEU 94 HG LEU 94 5.815 3.218 15.390 713 1HD1 LEU 94 HD21 LEU 94 7.963 3.284 15.927 714 2HD1 LEU 94 HD22 LEU 94 8.350 2.518 14.386 715 3HD1 LEU 94 HD23 LEU 94 8.077 1.527 15.820 716 1HD2 LEU 94 HD11 LEU 94 6.674 3.179 13.028 717 2HD2 LEU 94 HD12 LEU 94 5.039 2.555 13.244 718 3HD2 LEU 94 HD13 LEU 94 6.387 1.440 13.029 719 H GLU 95 HN GLU 95 5.647 -2.664 14.533 720 HA GLU 95 HA GLU 95 7.131 -3.714 16.704 721 1HB GLU 95 HB2 GLU 95 5.437 -4.380 18.214 722 2HB GLU 95 HB1 GLU 95 5.117 -2.687 17.871 723 1HG GLU 95 HG1 GLU 95 3.268 -3.191 16.523 724 2HG GLU 95 HG2 GLU 95 3.730 -4.887 16.379 725 H ILE 96 HN ILE 96 5.628 -3.977 13.801 726 HA ILE 96 HA ILE 96 4.699 -6.628 13.725 727 HB ILE 96 HB ILE 96 5.004 -6.582 11.323 728 1HG1 ILE 96 HG12 ILE 96 7.198 -5.578 11.172 729 2HG1 ILE 96 HG11 ILE 96 6.056 -4.676 10.186 730 1HG2 ILE 96 HG21 ILE 96 3.041 -5.507 11.789 731 2HG2 ILE 96 HG22 ILE 96 3.902 -4.265 10.875 732 3HG2 ILE 96 HG23 ILE 96 3.841 -4.183 12.636 733 1HD1 ILE 96 HD11 ILE 96 6.925 -2.882 11.145 734 2HD1 ILE 96 HD12 ILE 96 7.651 -3.819 12.449 735 3HD1 ILE 96 HD13 ILE 96 5.960 -3.332 12.551 736 H ASP 97 HN ASP 97 6.224 -7.583 11.468 737 HA ASP 97 HA ASP 97 8.095 -9.250 12.699 738 1HB ASP 97 HB1 ASP 97 6.848 -9.318 10.364 739 2HB ASP 97 HB2 ASP 97 8.329 -8.547 9.797 740 H ASN 98 HN ASN 98 8.327 -6.009 12.211 741 HA ASN 98 HA ASN 98 10.005 -4.536 12.581 742 1HB ASN 98 HB2 ASN 98 11.784 -5.234 13.731 743 2HB ASN 98 HB1 ASN 98 11.137 -6.861 13.578 744 1HD2 ASN 98 HD22 ASN 98 13.337 -4.515 12.172 745 2HD2 ASN 98 HD21 ASN 98 14.364 -5.665 11.392 746 H SER 99 HN SER 99 10.440 -7.005 10.177 747 HA SER 99 HA SER 99 12.252 -5.555 8.527 748 1HB SER 99 HB1 SER 99 10.314 -7.607 7.482 749 2HB SER 99 HB2 SER 99 11.947 -7.241 6.921 750 HG SER 99 HG SER 99 12.385 -7.942 9.307 751 H GLU 100 HN GLU 100 8.853 -5.507 9.045 752 HA GLU 100 HA GLU 100 8.261 -3.994 6.646 753 1HB GLU 100 HB1 GLU 100 6.357 -4.266 8.926 754 2HB GLU 100 HB2 GLU 100 6.032 -4.196 7.203 755 1HG GLU 100 HG1 GLU 100 7.419 -6.480 7.295 756 2HG GLU 100 HG2 GLU 100 6.706 -6.498 8.908 757 H LEU 101 HN LEU 101 9.133 -3.460 9.929 758 HA LEU 101 HA LEU 101 8.271 -0.717 10.061 759 1HB LEU 101 HB1 LEU 101 8.566 -2.105 12.085 760 2HB LEU 101 HB2 LEU 101 10.278 -2.232 11.742 761 HG LEU 101 HG LEU 101 9.401 -0.534 13.527 762 1HD1 LEU 101 HD21 LEU 101 11.730 -0.788 12.887 763 2HD1 LEU 101 HD22 LEU 101 11.317 0.916 13.082 764 3HD1 LEU 101 HD23 LEU 101 11.464 0.223 11.467 765 1HD2 LEU 101 HD11 LEU 101 8.774 1.589 12.805 766 2HD2 LEU 101 HD12 LEU 101 7.837 0.500 11.783 767 3HD2 LEU 101 HD13 LEU 101 9.285 1.280 11.145 768 H LEU 102 HN LEU 102 11.015 -2.505 8.965 769 HA LEU 102 HA LEU 102 12.752 -0.186 8.762 770 1HB LEU 102 HB2 LEU 102 13.010 -3.109 8.457 771 2HB LEU 102 HB1 LEU 102 14.018 -2.159 7.382 772 HG LEU 102 HG LEU 102 14.870 -0.946 9.440 773 1HD1 LEU 102 HD21 LEU 102 14.354 -1.619 11.550 774 2HD1 LEU 102 HD22 LEU 102 14.014 -3.278 11.059 775 3HD1 LEU 102 HD23 LEU 102 12.828 -2.008 10.757 776 1HD2 LEU 102 HD11 LEU 102 15.372 -3.850 8.902 777 2HD2 LEU 102 HD12 LEU 102 16.267 -2.977 10.145 778 3HD2 LEU 102 HD13 LEU 102 16.354 -2.453 8.464 779 H HIS 103 HN HIS 103 11.115 -2.414 6.538 780 HA HIS 103 HA HIS 103 12.058 -1.146 4.204 781 1HB HIS 103 HB1 HIS 103 10.643 -3.447 4.811 782 2HB HIS 103 HB2 HIS 103 9.465 -2.473 3.944 783 HD2 HIS 103 HD2 HIS 103 12.337 -1.362 2.128 784 HE1 HIS 103 HE1 HIS 103 11.615 -5.194 0.483 785 HE2 HIS 103 HE2 HIS 103 12.822 -2.987 0.164 786 H MET 104 HN MET 104 9.156 -0.694 6.171 787 HA MET 104 HA MET 104 7.717 0.969 4.446 788 1HB MET 104 HB2 MET 104 6.490 1.703 6.398 789 2HB MET 104 HB1 MET 104 6.808 -0.025 6.529 790 1HG MET 104 HG1 MET 104 8.030 0.226 8.377 791 2HG MET 104 HG2 MET 104 8.863 1.637 7.734 792 1HE MET 104 HE1 MET 104 4.757 1.511 9.635 793 2HE MET 104 HE2 MET 104 5.395 0.537 8.306 794 3HE MET 104 HE3 MET 104 4.745 2.147 7.989 795 H LEU 105 HN LEU 105 10.358 1.699 6.652 796 HA LEU 105 HA LEU 105 10.119 4.565 6.187 797 1HB LEU 105 HB1 LEU 105 12.371 3.170 7.616 798 2HB LEU 105 HB2 LEU 105 11.857 4.836 7.780 799 HG LEU 105 HG LEU 105 10.206 2.478 8.679 800 1HD1 LEU 105 HD11 LEU 105 12.512 3.722 9.889 801 2HD1 LEU 105 HD12 LEU 105 11.601 2.301 10.401 802 3HD1 LEU 105 HD13 LEU 105 11.079 3.909 10.900 803 1HD2 LEU 105 HD21 LEU 105 9.219 4.425 10.085 804 2HD2 LEU 105 HD22 LEU 105 8.726 4.219 8.404 805 3HD2 LEU 105 HD23 LEU 105 9.922 5.445 8.826 806 H GLU 106 HN GLU 106 11.478 1.898 4.724 807 HA GLU 106 HA GLU 106 13.656 3.441 3.546 808 1HB GLU 106 HB2 GLU 106 13.136 0.512 3.961 809 2HB GLU 106 HB1 GLU 106 14.317 1.037 2.758 810 1HG GLU 106 HG2 GLU 106 14.332 1.590 5.706 811 2HG GLU 106 HG1 GLU 106 15.425 0.527 4.821 812 H SER 107 HN SER 107 10.544 2.497 2.796 813 HA SER 107 HA SER 107 11.018 3.051 -0.030 814 1HB SER 107 HB2 SER 107 10.978 0.466 0.644 815 2HB SER 107 HB1 SER 107 9.241 0.734 0.521 816 HG SER 107 HG SER 107 10.977 1.590 -1.526 817 HA PRO 108 HA PRO 108 7.302 5.390 0.709 818 1HB PRO 108 HB2 PRO 108 7.174 5.676 -2.213 819 2HB PRO 108 HB1 PRO 108 7.384 6.915 -0.973 820 1HG PRO 108 HG1 PRO 108 9.388 6.198 -2.614 821 2HG PRO 108 HG2 PRO 108 9.678 6.670 -0.929 822 1HD PRO 108 HD1 PRO 108 9.562 3.929 -2.135 823 2HD PRO 108 HD2 PRO 108 10.694 4.582 -0.932 824 H GLU 109 HN GLU 109 7.503 2.419 -0.746 825 HA GLU 109 HA GLU 109 4.577 2.280 -1.109 826 1HB GLU 109 HB2 GLU 109 6.725 0.816 -2.661 827 2HB GLU 109 HB1 GLU 109 5.001 0.499 -2.802 828 1HG GLU 109 HG1 GLU 109 4.598 2.647 -3.732 829 2HG GLU 109 HG2 GLU 109 6.236 3.181 -3.360 830 H SER 110 HN SER 110 7.312 1.166 0.523 831 HA SER 110 HA SER 110 6.410 -1.479 1.131 832 1HB SER 110 HB1 SER 110 8.699 0.166 1.761 833 2HB SER 110 HB2 SER 110 8.090 -0.646 3.206 834 HG SER 110 HG SER 110 8.053 -2.433 1.289 835 H LEU 111 HN LEU 111 6.355 1.627 2.799 836 HA LEU 111 HA LEU 111 5.170 0.789 5.161 837 1HB LEU 111 HB1 LEU 111 6.113 3.049 4.688 838 2HB LEU 111 HB2 LEU 111 4.675 3.404 3.749 839 HG LEU 111 HG LEU 111 4.175 2.463 6.491 840 1HD1 LEU 111 HD11 LEU 111 4.740 5.256 6.626 841 2HD1 LEU 111 HD12 LEU 111 6.182 4.380 6.100 842 3HD1 LEU 111 HD13 LEU 111 5.372 3.935 7.609 843 1HD2 LEU 111 HD21 LEU 111 2.426 3.222 4.925 844 2HD2 LEU 111 HD22 LEU 111 3.158 4.827 4.927 845 3HD2 LEU 111 HD23 LEU 111 2.475 4.168 6.414 846 H ARG 112 HN ARG 112 3.784 1.319 2.015 847 HA ARG 112 HA ARG 112 1.070 1.204 3.025 848 1HB ARG 112 HB2 ARG 112 0.868 2.540 1.238 849 2HB ARG 112 HB1 ARG 112 2.384 1.986 0.536 850 1HG ARG 112 HG1 ARG 112 1.274 0.062 -0.410 851 2HG ARG 112 HG2 ARG 112 -0.245 0.533 0.357 852 1HD ARG 112 HD2 ARG 112 -0.625 2.234 -1.115 853 2HD ARG 112 HD1 ARG 112 1.093 2.531 -1.381 854 HE ARG 112 HE ARG 112 -0.398 0.287 -2.581 855 1HH1 ARG 112 HH21 ARG 112 2.098 2.718 -2.687 856 2HH1 ARG 112 HH22 ARG 112 2.610 2.304 -4.289 857 1HH2 ARG 112 HH11 ARG 112 0.271 -0.262 -4.688 858 2HH2 ARG 112 HH12 ARG 112 1.572 0.610 -5.425 859 H SER 113 HN SER 113 3.099 -0.743 0.840 860 HA SER 113 HA SER 113 1.230 -2.815 0.482 861 1HB SER 113 HB1 SER 113 4.249 -2.985 0.295 862 2HB SER 113 HB2 SER 113 3.092 -4.099 -0.433 863 HG SER 113 HG SER 113 2.283 -2.196 -1.588 864 H LYS 114 HN LYS 114 3.689 -2.249 2.908 865 HA LYS 114 HA LYS 114 3.430 -4.867 4.087 866 1HB LYS 114 HB1 LYS 114 4.799 -2.389 5.148 867 2HB LYS 114 HB2 LYS 114 4.923 -4.002 5.838 868 1HG LYS 114 HG1 LYS 114 5.701 -3.467 3.000 869 2HG LYS 114 HG2 LYS 114 6.820 -3.167 4.331 870 1HD LYS 114 HD1 LYS 114 7.005 -5.402 4.859 871 2HD LYS 114 HD2 LYS 114 5.434 -5.804 4.163 872 1HE LYS 114 HE2 LYS 114 6.568 -5.112 1.919 873 2HE LYS 114 HE1 LYS 114 8.065 -5.403 2.806 874 1HZ LYS 114 HZ1 LYS 114 7.291 -7.363 1.580 875 2HZ LYS 114 HZ2 LYS 114 5.870 -7.380 2.496 876 3HZ LYS 114 HZ3 LYS 114 7.362 -7.647 3.246 877 H VAL 115 HN VAL 115 2.022 -1.702 4.496 878 HA VAL 115 HA VAL 115 0.915 -2.203 7.092 879 HB VAL 115 HB VAL 115 0.758 -0.028 5.132 880 1HG1 VAL 115 HG11 VAL 115 -1.650 -0.861 5.250 881 2HG1 VAL 115 HG12 VAL 115 -1.378 0.832 5.660 882 3HG1 VAL 115 HG13 VAL 115 -1.629 -0.354 6.940 883 1HG2 VAL 115 HG21 VAL 115 0.115 0.692 7.822 884 2HG2 VAL 115 HG22 VAL 115 1.557 1.061 6.876 885 3HG2 VAL 115 HG23 VAL 115 1.473 -0.433 7.811 886 H ASP 116 HN ASP 116 -0.430 -2.231 3.794 887 HA ASP 116 HA ASP 116 -2.977 -3.164 4.434 888 1HB ASP 116 HB1 ASP 116 -3.056 -2.637 2.241 889 2HB ASP 116 HB2 ASP 116 -1.334 -2.931 2.024 890 H GLU 117 HN GLU 117 0.041 -4.886 3.925 891 HA GLU 117 HA GLU 117 -1.113 -7.507 4.007 892 1HB GLU 117 HB2 GLU 117 0.923 -7.876 3.120 893 2HB GLU 117 HB1 GLU 117 1.509 -6.314 3.675 894 1HG GLU 117 HG1 GLU 117 2.314 -7.166 5.662 895 2HG GLU 117 HG2 GLU 117 1.300 -8.606 5.576 896 H ALA 118 HN ALA 118 0.319 -5.255 6.274 897 HA ALA 118 HA ALA 118 0.429 -6.966 8.510 898 1HB ALA 118 HB1 ALA 118 0.942 -5.116 9.777 899 2HB ALA 118 HB2 ALA 118 -0.089 -4.046 8.824 900 3HB ALA 118 HB3 ALA 118 1.451 -4.601 8.168 901 H VAL 119 HN VAL 119 -2.148 -5.255 6.955 902 HA VAL 119 HA VAL 119 -4.031 -5.239 9.063 903 HB VAL 119 HB VAL 119 -4.675 -5.571 6.151 904 1HG1 VAL 119 HG11 VAL 119 -6.498 -5.906 7.779 905 2HG1 VAL 119 HG12 VAL 119 -6.755 -4.492 6.752 906 3HG1 VAL 119 HG13 VAL 119 -6.198 -4.284 8.412 907 1HG2 VAL 119 HG21 VAL 119 -3.897 -3.131 7.710 908 2HG2 VAL 119 HG22 VAL 119 -4.855 -3.036 6.232 909 3HG2 VAL 119 HG23 VAL 119 -3.230 -3.724 6.190 910 H ALA 120 HN ALA 120 -3.339 -7.509 6.467 911 HA ALA 120 HA ALA 120 -5.269 -9.434 7.105 912 1HB ALA 120 HB1 ALA 120 -3.250 -9.118 5.211 913 2HB ALA 120 HB2 ALA 120 -4.387 -10.467 5.323 914 3HB ALA 120 HB3 ALA 120 -2.805 -10.580 6.098 915 H VAL 121 HN VAL 121 -2.285 -8.559 8.534 916 HA VAL 121 HA VAL 121 -2.002 -10.989 10.088 917 HB VAL 121 HB VAL 121 -0.421 -8.453 9.808 918 1HG1 VAL 121 HG21 VAL 121 0.391 -8.562 11.857 919 2HG1 VAL 121 HG22 VAL 121 0.967 -10.200 11.537 920 3HG1 VAL 121 HG23 VAL 121 -0.642 -9.948 12.215 921 1HG2 VAL 121 HG11 VAL 121 1.181 -9.759 8.814 922 2HG2 VAL 121 HG12 VAL 121 -0.286 -10.613 8.331 923 3HG2 VAL 121 HG13 VAL 121 0.685 -11.216 9.675 924 H LEU 122 HN LEU 122 -3.077 -7.677 10.456 925 HA LEU 122 HA LEU 122 -3.290 -7.676 13.289 926 1HB LEU 122 HB2 LEU 122 -3.641 -5.515 12.897 927 2HB LEU 122 HB1 LEU 122 -3.700 -5.840 11.177 928 HG LEU 122 HG LEU 122 -6.242 -6.515 11.980 929 1HD1 LEU 122 HD11 LEU 122 -5.214 -4.271 13.689 930 2HD1 LEU 122 HD12 LEU 122 -6.100 -5.714 14.183 931 3HD1 LEU 122 HD13 LEU 122 -6.923 -4.439 13.283 932 1HD2 LEU 122 HD21 LEU 122 -5.680 -5.244 10.004 933 2HD2 LEU 122 HD22 LEU 122 -5.205 -3.864 10.996 934 3HD2 LEU 122 HD23 LEU 122 -6.891 -4.379 10.949 935 H GLN 123 HN GLN 123 -5.395 -8.495 10.625 936 HA GLN 123 HA GLN 123 -7.700 -9.058 12.222 937 1HB GLN 123 HB1 GLN 123 -6.929 -9.825 9.397 938 2HB GLN 123 HB2 GLN 123 -8.489 -10.201 10.118 939 1HG GLN 123 HG2 GLN 123 -7.944 -7.421 10.453 940 2HG GLN 123 HG1 GLN 123 -7.698 -7.862 8.765 941 1HE2 GLN 123 HE21 GLN 123 -9.496 -6.735 8.070 942 2HE2 GLN 123 HE22 GLN 123 -11.109 -7.271 8.382 943 H ALA 124 HN ALA 124 -4.859 -10.738 11.168 944 HA ALA 124 HA ALA 124 -5.828 -13.344 12.033 945 1HB ALA 124 HB1 ALA 124 -3.017 -13.247 11.418 946 2HB ALA 124 HB2 ALA 124 -3.970 -12.494 10.140 947 3HB ALA 124 HB3 ALA 124 -4.308 -14.154 10.629 948 H HIS 125 HN HIS 125 -4.988 -10.821 13.747 949 HA HIS 125 HA HIS 125 -3.682 -12.485 15.774 950 1HB HIS 125 HB1 HIS 125 -2.334 -10.475 14.389 951 2HB HIS 125 HB2 HIS 125 -2.776 -9.721 15.917 952 HD2 HIS 125 HD2 HIS 125 -1.596 -10.836 18.202 953 HE1 HIS 125 HE1 HIS 125 1.147 -13.198 16.008 954 HE2 HIS 125 HE2 HIS 125 0.532 -12.318 18.305 955 H GLN 126 HN GLN 126 -6.012 -10.187 14.898 956 HA GLN 126 HA GLN 126 -6.454 -9.230 17.608 957 1HB GLN 126 HB1 GLN 126 -7.550 -8.543 14.920 958 2HB GLN 126 HB2 GLN 126 -8.507 -8.149 16.342 959 1HG GLN 126 HG2 GLN 126 -5.677 -7.253 15.839 960 2HG GLN 126 HG1 GLN 126 -7.123 -6.274 15.598 961 1HE2 GLN 126 HE22 GLN 126 -7.955 -5.194 17.273 962 2HE2 GLN 126 HE21 GLN 126 -7.386 -5.303 18.901 963 H ALA 127 HN ALA 127 -8.894 -10.283 15.262 964 HA ALA 127 HA ALA 127 -10.407 -11.497 17.414 965 1HB ALA 127 HB1 ALA 127 -11.617 -10.103 15.890 966 2HB ALA 127 HB2 ALA 127 -12.161 -11.766 15.676 967 3HB ALA 127 HB3 ALA 127 -11.055 -11.044 14.509 968 H LYS 128 HN LYS 128 -7.889 -12.720 16.028 969 HA LYS 128 HA LYS 128 -8.973 -15.199 14.990 970 1HB LYS 128 HB2 LYS 128 -6.686 -15.846 14.580 971 2HB LYS 128 HB1 LYS 128 -6.910 -14.191 14.031 972 1HG LYS 128 HG1 LYS 128 -5.170 -13.590 15.254 973 2HG LYS 128 HG2 LYS 128 -6.046 -14.062 16.709 974 1HD LYS 128 HD2 LYS 128 -3.783 -15.139 16.396 975 2HD LYS 128 HD1 LYS 128 -5.126 -16.246 16.672 976 1HE LYS 128 HE2 LYS 128 -5.134 -16.110 13.968 977 2HE LYS 128 HE1 LYS 128 -3.417 -15.894 14.304 978 1HZ LYS 128 HZ1 LYS 128 -5.137 -18.211 14.839 979 2HZ LYS 128 HZ2 LYS 128 -3.814 -17.931 15.855 980 3HZ LYS 128 HZ3 LYS 128 -3.572 -18.159 14.197 981 H GLU 129 HN GLU 129 -6.906 -16.898 16.013 982 HA GLU 129 HA GLU 129 -8.064 -17.499 18.625 983 1HB GLU 129 HB2 GLU 129 -6.523 -19.001 16.581 984 2HB GLU 129 HB1 GLU 129 -6.233 -19.451 18.255 985 1HG GLU 129 HG2 GLU 129 -8.796 -19.598 18.433 986 2HG GLU 129 HG1 GLU 129 -8.761 -19.628 16.669 987 H ALA 130 HN ALA 130 -6.315 -15.195 18.111 988 HA ALA 130 HA ALA 130 -3.710 -15.605 18.981 989 1HB ALA 130 HB1 ALA 130 -4.987 -13.035 19.688 990 2HB ALA 130 HB2 ALA 130 -5.016 -13.502 17.986 991 3HB ALA 130 HB3 ALA 130 -3.477 -13.360 18.836 992 H ALA 131 HN ALA 131 -6.679 -15.312 20.767 993 HA ALA 131 HA ALA 131 -5.579 -14.680 23.298 994 1HB ALA 131 HB1 ALA 131 -7.763 -14.329 23.562 995 2HB ALA 131 HB2 ALA 131 -7.898 -16.066 23.834 996 3HB ALA 131 HB3 ALA 131 -8.180 -15.401 22.224 997 H GLN 132 HN GLN 132 -5.804 -16.203 25.206 998 HA GLN 132 HA GLN 132 -4.202 -18.524 24.695 999 1HB GLN 132 HB2 GLN 132 -5.443 -17.361 27.183 1000 2HB GLN 132 HB1 GLN 132 -4.570 -18.887 27.205 1001 1HG GLN 132 HG1 GLN 132 -2.558 -17.789 26.444 1002 2HG GLN 132 HG2 GLN 132 -3.420 -16.256 26.299 1003 1HE2 GLN 132 HE21 GLN 132 -3.150 -14.914 27.920 1004 2HE2 GLN 132 HE22 GLN 132 -2.768 -15.341 29.549 1005 H LYS 133 HN LYS 133 -7.360 -18.159 26.315 1006 HA LYS 133 HA LYS 133 -7.954 -20.952 25.937 1007 1HB LYS 133 HB1 LYS 133 -10.166 -20.301 26.978 1008 2HB LYS 133 HB2 LYS 133 -8.743 -20.006 27.967 1009 1HG LYS 133 HG2 LYS 133 -9.003 -17.629 26.668 1010 2HG LYS 133 HG1 LYS 133 -10.687 -18.126 26.856 1011 1HD LYS 133 HD2 LYS 133 -10.258 -18.493 29.271 1012 2HD LYS 133 HD1 LYS 133 -8.627 -17.858 29.044 1013 1HE LYS 133 HE1 LYS 133 -11.230 -16.394 28.640 1014 2HE LYS 133 HE2 LYS 133 -10.023 -16.101 29.893 1015 1HZ LYS 133 HZ1 LYS 133 -9.708 -15.641 26.979 1016 2HZ LYS 133 HZ2 LYS 133 -8.449 -15.508 28.101 1017 3HZ LYS 133 HZ3 LYS 133 -9.778 -14.465 28.194 1018 H ALA 134 HN ALA 134 -9.422 -21.862 24.561 1019 HA ALA 134 HA ALA 134 -10.068 -20.335 22.195 1020 1HB ALA 134 HB1 ALA 134 -11.198 -22.709 21.703 1021 2HB ALA 134 HB2 ALA 134 -10.050 -23.191 22.951 1022 3HB ALA 134 HB3 ALA 134 -9.476 -22.400 21.484 1023 H VAL 135 HN VAL 135 -11.594 -18.841 23.016 1024 HA VAL 135 HA VAL 135 -14.087 -19.866 24.108 1025 HB VAL 135 HB VAL 135 -13.641 -16.986 23.414 1026 1HG1 VAL 135 HG11 VAL 135 -15.243 -18.502 25.453 1027 2HG1 VAL 135 HG12 VAL 135 -15.816 -17.415 24.187 1028 3HG1 VAL 135 HG13 VAL 135 -14.959 -16.766 25.584 1029 1HG2 VAL 135 HG21 VAL 135 -12.450 -16.560 25.413 1030 2HG2 VAL 135 HG22 VAL 135 -11.622 -17.904 24.626 1031 3HG2 VAL 135 HG23 VAL 135 -12.693 -18.207 25.995 1032 H ASN 136 HN ASN 136 -16.160 -19.245 23.187 1033 HA ASN 136 HA ASN 136 -16.265 -19.768 20.390 1034 1HB ASN 136 HB2 ASN 136 -18.120 -19.648 22.600 1035 2HB ASN 136 HB1 ASN 136 -18.779 -18.803 21.202 1036 1HD2 ASN 136 HD22 ASN 136 -18.871 -19.970 19.183 1037 2HD2 ASN 136 HD21 ASN 136 -19.087 -21.684 19.202 1038 H SER 137 HN SER 137 -15.038 -18.033 19.502 1039 HA SER 137 HA SER 137 -16.221 -15.365 19.681 1040 1HB SER 137 HB2 SER 137 -14.189 -14.532 18.743 1041 2HB SER 137 HB1 SER 137 -13.720 -15.746 19.933 1042 HG SER 137 HG SER 137 -12.693 -16.657 18.355 1043 H ALA 138 HN ALA 138 -17.178 -14.339 17.994 1044 HA ALA 138 HA ALA 138 -17.898 -15.989 15.709 1045 1HB ALA 138 HB1 ALA 138 -19.066 -13.446 15.455 1046 2HB ALA 138 HB2 ALA 138 -19.133 -13.860 17.167 1047 3HB ALA 138 HB3 ALA 138 -19.837 -14.946 15.970 1048 H THR 139 HN THR 139 -16.957 -15.850 13.786 1049 HA THR 139 HA THR 139 -15.113 -13.632 13.277 1050 HB THR 139 HB THR 139 -14.017 -15.691 12.957 1051 HG1 THR 139 HG1 THR 139 -13.542 -14.439 11.213 1052 1HG2 THR 139 HG21 THR 139 -16.597 -16.621 11.921 1053 2HG2 THR 139 HG22 THR 139 -15.346 -17.483 12.817 1054 3HG2 THR 139 HG23 THR 139 -15.172 -17.234 11.080 1055 H GLY 140 HN GLY 140 -15.602 -12.061 11.894 1056 1HA GLY 140 HA1 GLY 140 -17.986 -12.406 10.203 1057 2HA GLY 140 HA2 GLY 140 -17.333 -10.865 10.739 1058 H VAL 141 HN VAL 141 -15.504 -13.540 9.347 1059 HA VAL 141 HA VAL 141 -14.666 -11.742 7.185 1060 HB VAL 141 HB VAL 141 -13.416 -14.362 8.017 1061 1HG1 VAL 141 HG11 VAL 141 -12.784 -13.932 5.799 1062 2HG1 VAL 141 HG12 VAL 141 -11.444 -13.321 6.771 1063 3HG1 VAL 141 HG13 VAL 141 -12.622 -12.200 6.089 1064 1HG2 VAL 141 HG21 VAL 141 -12.301 -13.329 9.643 1065 2HG2 VAL 141 HG22 VAL 141 -13.411 -11.975 9.438 1066 3HG2 VAL 141 HG23 VAL 141 -11.868 -11.987 8.585 1067 HA PRO 142 HA PRO 142 -14.155 -11.484 5.283 1068 1HB PRO 142 HB2 PRO 142 -15.282 -10.719 2.977 1069 2HB PRO 142 HB1 PRO 142 -14.117 -12.047 3.038 1070 1HG PRO 142 HG1 PRO 142 -17.105 -12.149 2.899 1071 2HG PRO 142 HG2 PRO 142 -15.913 -13.131 2.031 1072 1HD PRO 142 HD2 PRO 142 -17.246 -13.964 4.283 1073 2HD PRO 142 HD1 PRO 142 -15.662 -14.583 3.781 1074 H THR 143 HN THR 143 -14.779 -9.176 4.946 1075 HA THR 143 HA THR 143 -17.334 -8.627 6.291 1076 HB THR 143 HB THR 143 -16.369 -6.561 7.056 1077 HG1 THR 143 HG1 THR 143 -13.929 -7.113 5.790 1078 1HG2 THR 143 HG21 THR 143 -15.612 -8.764 8.146 1079 2HG2 THR 143 HG22 THR 143 -14.741 -7.277 8.520 1080 3HG2 THR 143 HG23 THR 143 -14.066 -8.428 7.368 1081 H VAL 144 HN VAL 144 -16.559 -8.978 3.307 1082 HA VAL 144 HA VAL 144 -17.205 -8.135 1.296 1083 HB VAL 144 HB VAL 144 -19.202 -6.427 2.761 1084 1HG1 VAL 144 HG11 VAL 144 -20.456 -7.472 0.602 1085 2HG1 VAL 144 HG12 VAL 144 -18.799 -7.374 0.007 1086 3HG1 VAL 144 HG13 VAL 144 -19.608 -5.925 0.604 1087 1HG2 VAL 144 HG21 VAL 144 -20.452 -8.178 3.397 1088 2HG2 VAL 144 HG22 VAL 144 -18.944 -9.087 3.277 1089 3HG2 VAL 144 HG23 VAL 144 -20.089 -9.095 1.934 Start of MODEL 6 1 1H GLY 1 HT1 GLY 1 -21.324 2.299 34.957 2 2H GLY 1 HT2 GLY 1 -20.844 0.794 34.353 3 3H GLY 1 HT3 GLY 1 -19.690 1.863 34.976 4 1HA GLY 1 HA1 GLY 1 -21.637 0.184 36.397 5 2HA GLY 1 HA2 GLY 1 -19.924 0.407 36.719 6 HA PRO 2 HA PRO 2 -21.172 2.981 40.113 7 1HB PRO 2 HB2 PRO 2 -18.531 4.271 39.778 8 2HB PRO 2 HB1 PRO 2 -19.216 3.458 41.188 9 1HG PRO 2 HG1 PRO 2 -17.281 2.319 39.737 10 2HG PRO 2 HG2 PRO 2 -18.592 1.357 40.446 11 1HD PRO 2 HD1 PRO 2 -18.220 2.269 37.620 12 2HD PRO 2 HD2 PRO 2 -18.824 0.715 38.234 13 H LEU 3 HN LEU 3 -19.019 4.868 37.990 14 HA LEU 3 HA LEU 3 -20.873 7.111 38.141 15 1HB LEU 3 HB2 LEU 3 -18.139 6.969 38.179 16 2HB LEU 3 HB1 LEU 3 -18.447 7.409 36.510 17 HG LEU 3 HG LEU 3 -18.039 9.377 37.915 18 1HD1 LEU 3 HD21 LEU 3 -19.783 9.222 35.959 19 2HD1 LEU 3 HD22 LEU 3 -19.636 10.686 36.931 20 3HD1 LEU 3 HD23 LEU 3 -20.936 9.540 37.255 21 1HD2 LEU 3 HD11 LEU 3 -19.246 8.142 39.914 22 2HD2 LEU 3 HD12 LEU 3 -20.640 9.034 39.305 23 3HD2 LEU 3 HD13 LEU 3 -19.190 9.901 39.809 24 H GLY 4 HN GLY 4 -22.545 6.832 36.766 25 1HA GLY 4 HA2 GLY 4 -21.934 6.051 33.991 26 2HA GLY 4 HA1 GLY 4 -23.504 5.892 34.763 27 H SER 5 HN SER 5 -22.271 7.386 32.325 28 HA SER 5 HA SER 5 -23.309 10.064 32.933 29 1HB SER 5 HB2 SER 5 -21.116 10.174 31.994 30 2HB SER 5 HB1 SER 5 -21.532 9.028 30.719 31 HG SER 5 HG SER 5 -22.036 11.741 30.903 32 H ALA 6 HN ALA 6 -24.085 7.172 31.315 33 HA ALA 6 HA ALA 6 -26.404 8.480 30.077 34 1HB ALA 6 HB1 ALA 6 -25.956 7.782 27.999 35 2HB ALA 6 HB2 ALA 6 -25.378 6.210 28.547 36 3HB ALA 6 HB3 ALA 6 -24.300 7.605 28.578 37 H ALA 7 HN ALA 7 -28.298 7.330 30.146 38 HA ALA 7 HA ALA 7 -28.417 5.177 32.047 39 1HB ALA 7 HB1 ALA 7 -30.590 6.436 30.380 40 2HB ALA 7 HB2 ALA 7 -30.147 6.880 32.028 41 3HB ALA 7 HB3 ALA 7 -30.841 5.292 31.698 42 H ALA 8 HN ALA 8 -29.949 5.358 28.839 43 HA ALA 8 HA ALA 8 -28.821 2.754 28.145 44 1HB ALA 8 HB1 ALA 8 -31.640 2.847 27.468 45 2HB ALA 8 HB2 ALA 8 -31.367 2.926 29.208 46 3HB ALA 8 HB3 ALA 8 -30.711 1.582 28.273 47 H ALA 9 HN ALA 9 -30.888 5.456 27.138 48 HA ALA 9 HA ALA 9 -29.618 5.342 24.492 49 1HB ALA 9 HB1 ALA 9 -32.018 6.126 23.700 50 2HB ALA 9 HB2 ALA 9 -32.517 5.197 25.115 51 3HB ALA 9 HB3 ALA 9 -31.594 4.419 23.830 52 H THR 10 HN THR 10 -28.778 7.236 23.934 53 HA THR 10 HA THR 10 -29.699 9.638 25.350 54 HB THR 10 HB THR 10 -27.245 9.991 23.848 55 HG1 THR 10 HG1 THR 10 -26.756 7.892 24.203 56 1HG2 THR 10 HG21 THR 10 -27.196 9.960 26.787 57 2HG2 THR 10 HG22 THR 10 -28.283 11.126 26.033 58 3HG2 THR 10 HG23 THR 10 -26.562 11.145 25.646 59 HA PRO 11 HA PRO 11 -29.228 11.001 20.638 60 1HB PRO 11 HB2 PRO 11 -29.746 8.352 19.395 61 2HB PRO 11 HB1 PRO 11 -28.670 9.651 18.870 62 1HG PRO 11 HG2 PRO 11 -27.686 7.442 19.981 63 2HG PRO 11 HG1 PRO 11 -26.991 9.032 20.349 64 1HD PRO 11 HD2 PRO 11 -28.825 7.337 21.995 65 2HD PRO 11 HD1 PRO 11 -27.448 8.334 22.507 66 H ALA 12 HN ALA 12 -31.109 12.042 20.508 67 HA ALA 12 HA ALA 12 -33.616 10.576 20.794 68 1HB ALA 12 HB1 ALA 12 -33.226 12.645 22.102 69 2HB ALA 12 HB2 ALA 12 -34.665 12.719 21.085 70 3HB ALA 12 HB3 ALA 12 -33.192 13.552 20.590 71 H VAL 13 HN VAL 13 -31.722 10.831 18.325 72 HA VAL 13 HA VAL 13 -33.766 11.696 16.394 73 HB VAL 13 HB VAL 13 -31.689 11.499 14.790 74 1HG1 VAL 13 HG11 VAL 13 -31.712 13.842 16.659 75 2HG1 VAL 13 HG12 VAL 13 -33.054 13.538 15.555 76 3HG1 VAL 13 HG13 VAL 13 -31.432 13.812 14.917 77 1HG2 VAL 13 HG21 VAL 13 -29.595 12.125 15.891 78 2HG2 VAL 13 HG22 VAL 13 -30.174 10.555 16.450 79 3HG2 VAL 13 HG23 VAL 13 -30.380 11.983 17.465 80 H ARG 14 HN ARG 14 -34.913 9.692 16.563 81 HA ARG 14 HA ARG 14 -33.597 7.233 15.832 82 1HB ARG 14 HB1 ARG 14 -36.523 7.885 16.229 83 2HB ARG 14 HB2 ARG 14 -35.886 6.270 15.952 84 1HG ARG 14 HG2 ARG 14 -34.384 7.051 18.064 85 2HG ARG 14 HG1 ARG 14 -35.892 7.909 18.385 86 1HD ARG 14 HD1 ARG 14 -37.133 5.816 18.200 87 2HD ARG 14 HD2 ARG 14 -35.636 4.952 17.850 88 HE ARG 14 HE ARG 14 -34.918 5.450 20.111 89 1HH1 ARG 14 HH11 ARG 14 -38.291 5.963 19.395 90 2HH1 ARG 14 HH12 ARG 14 -38.791 5.849 21.049 91 1HH2 ARG 14 HH22 ARG 14 -35.570 5.298 22.291 92 2HH2 ARG 14 HH21 ARG 14 -37.244 5.471 22.695 93 H THR 15 HN THR 15 -36.431 8.876 14.416 94 HA THR 15 HA THR 15 -35.718 7.760 11.809 95 HB THR 15 HB THR 15 -38.194 9.349 12.474 96 HG1 THR 15 HG1 THR 15 -38.754 6.787 12.441 97 1HG2 THR 15 HG21 THR 15 -39.203 7.941 10.711 98 2HG2 THR 15 HG22 THR 15 -37.598 7.298 10.362 99 3HG2 THR 15 HG23 THR 15 -37.931 9.014 10.126 100 H VAL 16 HN VAL 16 -35.201 8.986 10.046 101 HA VAL 16 HA VAL 16 -34.699 11.838 10.574 102 HB VAL 16 HB VAL 16 -33.394 10.941 8.187 103 1HG1 VAL 16 HG21 VAL 16 -31.903 12.396 8.959 104 2HG1 VAL 16 HG22 VAL 16 -31.632 11.429 10.409 105 3HG1 VAL 16 HG23 VAL 16 -32.932 12.619 10.374 106 1HG2 VAL 16 HG11 VAL 16 -33.037 9.200 10.605 107 2HG2 VAL 16 HG12 VAL 16 -31.753 9.407 9.414 108 3HG2 VAL 16 HG13 VAL 16 -33.305 8.724 8.929 109 HA PRO 17 HA PRO 17 -37.787 12.770 7.517 110 1HB PRO 17 HB2 PRO 17 -37.238 15.389 7.153 111 2HB PRO 17 HB1 PRO 17 -38.014 14.780 8.621 112 1HG PRO 17 HG1 PRO 17 -35.147 15.503 8.151 113 2HG PRO 17 HG2 PRO 17 -36.174 15.859 9.550 114 1HD PRO 17 HD2 PRO 17 -34.365 13.824 9.509 115 2HD PRO 17 HD1 PRO 17 -35.857 13.776 10.469 116 H GLN 18 HN GLN 18 -34.397 13.568 7.016 117 HA GLN 18 HA GLN 18 -34.787 13.776 4.131 118 1HB GLN 18 HB1 GLN 18 -32.346 14.185 5.867 119 2HB GLN 18 HB2 GLN 18 -32.350 14.352 4.117 120 1HG GLN 18 HG2 GLN 18 -33.980 16.161 4.291 121 2HG GLN 18 HG1 GLN 18 -33.977 15.994 6.046 122 1HE2 GLN 18 HE22 GLN 18 -32.276 16.784 7.225 123 2HE2 GLN 18 HE21 GLN 18 -31.043 17.787 6.548 124 H TYR 19 HN TYR 19 -33.335 12.571 2.683 125 HA TYR 19 HA TYR 19 -33.465 9.800 3.168 126 1HB TYR 19 HB1 TYR 19 -31.893 11.347 1.096 127 2HB TYR 19 HB2 TYR 19 -32.119 9.601 1.080 128 HD1 TYR 19 HD1 TYR 19 -33.756 12.848 0.595 129 HD2 TYR 19 HD2 TYR 19 -34.236 8.623 0.450 130 HE1 TYR 19 HE1 TYR 19 -35.856 13.136 -0.651 131 HE2 TYR 19 HE2 TYR 19 -36.338 8.899 -0.795 132 HH TYR 19 HH TYR 19 -38.141 10.957 -0.933 133 H LYS 20 HN LYS 20 -32.105 8.430 4.122 134 HA LYS 20 HA LYS 20 -29.655 9.474 5.275 135 1HB LYS 20 HB1 LYS 20 -29.580 7.102 6.280 136 2HB LYS 20 HB2 LYS 20 -30.852 8.190 6.821 137 1HG LYS 20 HG2 LYS 20 -32.295 7.078 5.014 138 2HG LYS 20 HG1 LYS 20 -31.054 5.823 5.000 139 1HD LYS 20 HD1 LYS 20 -31.508 6.116 7.670 140 2HD LYS 20 HD2 LYS 20 -33.113 6.420 7.002 141 1HE LYS 20 HE2 LYS 20 -33.057 4.108 7.374 142 2HE LYS 20 HE1 LYS 20 -32.765 4.290 5.644 143 1HZ LYS 20 HZ1 LYS 20 -31.147 2.801 6.257 144 2HZ LYS 20 HZ2 LYS 20 -30.887 3.513 7.769 145 3HZ LYS 20 HZ3 LYS 20 -30.295 4.259 6.372 146 H TYR 21 HN TYR 21 -28.126 7.139 5.403 147 HA TYR 21 HA TYR 21 -26.997 7.142 2.734 148 1HB TYR 21 HB1 TYR 21 -25.952 5.586 5.095 149 2HB TYR 21 HB2 TYR 21 -25.060 6.183 3.699 150 HD1 TYR 21 HD1 TYR 21 -25.829 6.765 7.082 151 HD2 TYR 21 HD2 TYR 21 -25.039 8.803 3.431 152 HE1 TYR 21 HE1 TYR 21 -25.208 8.779 8.347 153 HE2 TYR 21 HE2 TYR 21 -24.416 10.822 4.686 154 HH TYR 21 HH TYR 21 -23.657 10.864 7.842 155 H ALA 22 HN ALA 22 -29.509 5.878 2.886 156 HA ALA 22 HA ALA 22 -29.005 3.013 2.879 157 1HB ALA 22 HB1 ALA 22 -31.230 2.732 3.133 158 2HB ALA 22 HB2 ALA 22 -31.634 4.034 2.017 159 3HB ALA 22 HB3 ALA 22 -31.156 4.409 3.672 160 H ALA 23 HN ALA 23 -30.465 5.346 0.605 161 HA ALA 23 HA ALA 23 -30.380 3.619 -1.621 162 1HB ALA 23 HB1 ALA 23 -31.297 5.334 -2.805 163 2HB ALA 23 HB2 ALA 23 -30.270 6.553 -2.051 164 3HB ALA 23 HB3 ALA 23 -31.652 5.898 -1.172 165 H GLY 24 HN GLY 24 -28.544 2.789 -2.396 166 1HA GLY 24 HA2 GLY 24 -26.051 4.245 -2.254 167 2HA GLY 24 HA1 GLY 24 -26.281 2.627 -2.899 168 H VAL 25 HN VAL 25 -26.263 2.363 -5.045 169 HA VAL 25 HA VAL 25 -26.063 4.767 -6.703 170 HB VAL 25 HB VAL 25 -25.587 2.005 -7.752 171 1HG1 VAL 25 HG21 VAL 25 -24.933 3.156 -9.533 172 2HG1 VAL 25 HG22 VAL 25 -23.668 3.922 -8.571 173 3HG1 VAL 25 HG23 VAL 25 -25.261 4.669 -8.689 174 1HG2 VAL 25 HG11 VAL 25 -24.283 1.880 -5.801 175 2HG2 VAL 25 HG12 VAL 25 -23.767 3.561 -5.937 176 3HG2 VAL 25 HG13 VAL 25 -23.158 2.358 -7.073 177 H ARG 26 HN ARG 26 -27.747 5.426 -7.848 178 HA ARG 26 HA ARG 26 -29.955 3.566 -8.340 179 1HB ARG 26 HB2 ARG 26 -29.863 6.574 -8.649 180 2HB ARG 26 HB1 ARG 26 -31.292 5.563 -8.809 181 1HG ARG 26 HG2 ARG 26 -31.647 6.094 -6.669 182 2HG ARG 26 HG1 ARG 26 -30.421 4.872 -6.329 183 1HD ARG 26 HD2 ARG 26 -30.039 7.037 -5.166 184 2HD ARG 26 HD1 ARG 26 -28.704 6.531 -6.201 185 HE ARG 26 HE ARG 26 -29.868 8.116 -7.883 186 1HH1 ARG 26 HH21 ARG 26 -29.641 8.584 -4.437 187 2HH1 ARG 26 HH22 ARG 26 -29.686 10.312 -4.539 188 1HH2 ARG 26 HH12 ARG 26 -29.926 10.392 -8.026 189 2HH2 ARG 26 HH11 ARG 26 -29.847 11.340 -6.578 190 H ASN 27 HN ASN 27 -28.182 6.121 -10.090 191 HA ASN 27 HA ASN 27 -29.093 5.108 -12.638 192 1HB ASN 27 HB1 ASN 27 -27.355 7.409 -11.785 193 2HB ASN 27 HB2 ASN 27 -27.451 6.932 -13.478 194 1HD2 ASN 27 HD21 ASN 27 -28.336 9.363 -12.022 195 2HD2 ASN 27 HD22 ASN 27 -30.005 9.547 -12.432 196 HA PRO 28 HA PRO 28 -25.615 2.416 -13.234 197 1HB PRO 28 HB1 PRO 28 -25.947 1.846 -15.839 198 2HB PRO 28 HB2 PRO 28 -27.067 1.252 -14.607 199 1HG PRO 28 HG1 PRO 28 -27.352 3.585 -16.464 200 2HG PRO 28 HG2 PRO 28 -28.554 2.361 -16.015 201 1HD PRO 28 HD1 PRO 28 -28.445 4.859 -14.903 202 2HD PRO 28 HD2 PRO 28 -29.099 3.438 -14.065 203 H GLN 29 HN GLN 29 -24.348 4.570 -12.889 204 HA GLN 29 HA GLN 29 -23.191 5.621 -15.345 205 1HB GLN 29 HB2 GLN 29 -23.842 6.916 -13.126 206 2HB GLN 29 HB1 GLN 29 -22.222 6.434 -12.640 207 1HG GLN 29 HG2 GLN 29 -22.221 7.531 -15.305 208 2HG GLN 29 HG1 GLN 29 -22.939 8.653 -14.149 209 1HE2 GLN 29 HE21 GLN 29 -21.690 9.355 -12.375 210 2HE2 GLN 29 HE22 GLN 29 -19.963 9.305 -12.425 211 H GLN 30 HN GLN 30 -21.374 4.878 -16.202 212 HA GLN 30 HA GLN 30 -19.728 3.036 -14.629 213 1HB GLN 30 HB2 GLN 30 -18.699 2.545 -16.912 214 2HB GLN 30 HB1 GLN 30 -20.368 2.049 -16.674 215 1HG GLN 30 HG1 GLN 30 -21.192 3.804 -17.997 216 2HG GLN 30 HG2 GLN 30 -19.651 4.660 -17.963 217 1HE2 GLN 30 HE22 GLN 30 -21.337 1.862 -19.232 218 2HE2 GLN 30 HE21 GLN 30 -20.287 1.604 -20.580 219 H HIS 31 HN HIS 31 -17.929 3.756 -13.728 220 HA HIS 31 HA HIS 31 -16.828 6.321 -14.410 221 1HB HIS 31 HB2 HIS 31 -16.914 5.381 -12.075 222 2HB HIS 31 HB1 HIS 31 -15.665 4.236 -12.554 223 HD2 HIS 31 HD2 HIS 31 -15.997 8.176 -12.465 224 HE1 HIS 31 HE1 HIS 31 -12.021 7.005 -11.606 225 HE2 HIS 31 HE2 HIS 31 -13.612 8.969 -11.823 226 H LEU 32 HN LEU 32 -16.350 3.122 -15.455 227 HA LEU 32 HA LEU 32 -13.593 3.338 -16.188 228 1HB LEU 32 HB2 LEU 32 -15.795 1.414 -16.888 229 2HB LEU 32 HB1 LEU 32 -14.215 1.308 -17.640 230 HG LEU 32 HG LEU 32 -13.869 1.453 -14.803 231 1HD1 LEU 32 HD21 LEU 32 -15.891 0.549 -14.237 232 2HD1 LEU 32 HD22 LEU 32 -14.960 -0.923 -14.515 233 3HD1 LEU 32 HD23 LEU 32 -16.054 -0.323 -15.761 234 1HD2 LEU 32 HD11 LEU 32 -13.099 -0.207 -17.084 235 2HD2 LEU 32 HD12 LEU 32 -13.203 -1.082 -15.557 236 3HD2 LEU 32 HD13 LEU 32 -12.153 0.327 -15.695 237 H ASN 33 HN ASN 33 -12.800 4.477 -17.818 238 HA ASN 33 HA ASN 33 -14.588 5.221 -20.029 239 1HB ASN 33 HB2 ASN 33 -12.302 6.552 -18.680 240 2HB ASN 33 HB1 ASN 33 -12.448 6.808 -20.417 241 1HD2 ASN 33 HD21 ASN 33 -12.902 8.992 -20.097 242 2HD2 ASN 33 HD22 ASN 33 -14.442 9.528 -19.525 243 H ALA 34 HN ALA 34 -12.025 3.181 -19.245 244 HA ALA 34 HA ALA 34 -10.814 3.147 -21.873 245 1HB ALA 34 HB1 ALA 34 -9.652 1.070 -20.770 246 2HB ALA 34 HB2 ALA 34 -10.297 1.769 -19.284 247 3HB ALA 34 HB3 ALA 34 -9.205 2.710 -20.300 248 H GLN 35 HN GLN 35 -12.064 2.318 -23.445 249 HA GLN 35 HA GLN 35 -13.618 -0.101 -22.899 250 1HB GLN 35 HB2 GLN 35 -13.698 1.860 -25.193 251 2HB GLN 35 HB1 GLN 35 -14.636 0.373 -25.156 252 1HG GLN 35 HG2 GLN 35 -15.727 1.150 -23.086 253 2HG GLN 35 HG1 GLN 35 -14.840 2.668 -23.221 254 1HE2 GLN 35 HE21 GLN 35 -16.792 0.575 -25.328 255 2HE2 GLN 35 HE22 GLN 35 -17.739 1.853 -26.003 256 HA PRO 36 HA PRO 36 -10.983 -1.430 -26.728 257 1HB PRO 36 HB2 PRO 36 -8.799 0.509 -26.910 258 2HB PRO 36 HB1 PRO 36 -9.906 -0.047 -28.167 259 1HG PRO 36 HG2 PRO 36 -10.016 2.452 -27.158 260 2HG PRO 36 HG1 PRO 36 -11.464 1.584 -27.703 261 1HD PRO 36 HD1 PRO 36 -10.435 1.990 -24.917 262 2HD PRO 36 HD2 PRO 36 -12.101 2.093 -25.529 263 H GLN 37 HN GLN 37 -9.927 -0.364 -23.719 264 HA GLN 37 HA GLN 37 -7.350 -1.658 -23.744 265 1HB GLN 37 HB2 GLN 37 -8.472 0.335 -22.222 266 2HB GLN 37 HB1 GLN 37 -8.527 -1.040 -21.128 267 1HG GLN 37 HG2 GLN 37 -6.483 -0.167 -20.617 268 2HG GLN 37 HG1 GLN 37 -6.037 -1.342 -21.854 269 1HE2 GLN 37 HE21 GLN 37 -4.148 -0.170 -22.294 270 2HE2 GLN 37 HE22 GLN 37 -4.187 1.295 -23.209 271 H VAL 38 HN VAL 38 -7.175 -3.792 -23.690 272 HA VAL 38 HA VAL 38 -9.229 -5.368 -22.301 273 HB VAL 38 HB VAL 38 -7.108 -6.648 -23.967 274 1HG1 VAL 38 HG11 VAL 38 -9.719 -7.637 -24.437 275 2HG1 VAL 38 HG12 VAL 38 -9.535 -7.416 -22.696 276 3HG1 VAL 38 HG13 VAL 38 -8.388 -8.419 -23.584 277 1HG2 VAL 38 HG21 VAL 38 -9.517 -5.212 -25.077 278 2HG2 VAL 38 HG22 VAL 38 -8.507 -6.339 -25.983 279 3HG2 VAL 38 HG23 VAL 38 -7.822 -4.829 -25.384 280 H THR 39 HN THR 39 -6.794 -3.887 -21.185 281 HA THR 39 HA THR 39 -5.104 -5.984 -20.169 282 HB THR 39 HB THR 39 -4.272 -3.685 -20.645 283 HG1 THR 39 HG1 THR 39 -3.254 -5.097 -19.084 284 1HG2 THR 39 HG21 THR 39 -5.170 -2.589 -18.101 285 2HG2 THR 39 HG22 THR 39 -6.450 -2.765 -19.301 286 3HG2 THR 39 HG23 THR 39 -5.009 -1.823 -19.681 287 H MET 40 HN MET 40 -4.647 -5.795 -17.663 288 HA MET 40 HA MET 40 -7.194 -6.402 -16.375 289 1HB MET 40 HB2 MET 40 -4.330 -7.046 -15.806 290 2HB MET 40 HB1 MET 40 -5.489 -7.088 -14.484 291 1HG MET 40 HG2 MET 40 -6.876 -8.613 -15.991 292 2HG MET 40 HG1 MET 40 -5.413 -8.767 -16.963 293 1HE MET 40 HE1 MET 40 -3.317 -10.880 -15.896 294 2HE MET 40 HE2 MET 40 -4.665 -10.683 -17.017 295 3HE MET 40 HE3 MET 40 -4.702 -11.968 -15.810 296 H GLN 41 HN GLN 41 -6.667 -5.942 -13.744 297 HA GLN 41 HA GLN 41 -6.651 -3.011 -13.653 298 1HB GLN 41 HB1 GLN 41 -7.659 -3.396 -11.351 299 2HB GLN 41 HB2 GLN 41 -8.650 -3.874 -12.723 300 1HG GLN 41 HG1 GLN 41 -8.431 -6.110 -12.281 301 2HG GLN 41 HG2 GLN 41 -6.893 -5.905 -11.443 302 1HE2 GLN 41 HE22 GLN 41 -6.883 -5.747 -9.291 303 2HE2 GLN 41 HE21 GLN 41 -8.294 -5.666 -8.297 304 H GLN 42 HN GLN 42 -5.520 -1.898 -11.981 305 HA GLN 42 HA GLN 42 -3.584 -3.350 -10.396 306 1HB GLN 42 HB2 GLN 42 -2.704 -2.757 -12.841 307 2HB GLN 42 HB1 GLN 42 -2.395 -1.202 -12.083 308 1HG GLN 42 HG2 GLN 42 -1.118 -2.429 -10.310 309 2HG GLN 42 HG1 GLN 42 -1.279 -3.879 -11.301 310 1HE2 GLN 42 HE22 GLN 42 -0.840 -3.081 -13.787 311 2HE2 GLN 42 HE21 GLN 42 0.731 -2.388 -13.966 312 HA PRO 43 HA PRO 43 -4.613 -0.064 -7.604 313 1HB PRO 43 HB1 PRO 43 -1.942 -0.597 -6.433 314 2HB PRO 43 HB2 PRO 43 -3.533 -0.620 -5.666 315 1HG PRO 43 HG2 PRO 43 -2.238 -2.891 -6.194 316 2HG PRO 43 HG1 PRO 43 -3.996 -2.774 -6.390 317 1HD PRO 43 HD2 PRO 43 -1.848 -2.713 -8.473 318 2HD PRO 43 HD1 PRO 43 -3.437 -3.505 -8.516 319 H ALA 44 HN ALA 44 -4.384 2.076 -7.780 320 HA ALA 44 HA ALA 44 -2.207 3.157 -9.347 321 1HB ALA 44 HB1 ALA 44 -3.786 5.248 -8.307 322 2HB ALA 44 HB2 ALA 44 -4.883 3.933 -8.726 323 3HB ALA 44 HB3 ALA 44 -3.789 4.590 -9.943 324 H VAL 45 HN VAL 45 -0.349 3.051 -8.135 325 HA VAL 45 HA VAL 45 -0.342 4.270 -5.474 326 HB VAL 45 HB VAL 45 0.754 2.073 -5.757 327 1HG1 VAL 45 HG11 VAL 45 2.663 3.588 -7.534 328 2HG1 VAL 45 HG12 VAL 45 1.554 2.311 -8.034 329 3HG1 VAL 45 HG13 VAL 45 2.898 1.939 -6.954 330 1HG2 VAL 45 HG21 VAL 45 1.517 4.022 -4.167 331 2HG2 VAL 45 HG22 VAL 45 2.969 3.973 -5.166 332 3HG2 VAL 45 HG23 VAL 45 2.452 2.532 -4.290 333 H HIS 46 HN HIS 46 0.755 4.806 -8.729 334 HA HIS 46 HA HIS 46 2.395 7.084 -7.909 335 1HB HIS 46 HB2 HIS 46 2.422 5.240 -10.126 336 2HB HIS 46 HB1 HIS 46 2.354 6.896 -10.721 337 HD2 HIS 46 HD2 HIS 46 4.567 8.504 -10.072 338 HE1 HIS 46 HE1 HIS 46 6.937 5.229 -8.811 339 HE2 HIS 46 HE2 HIS 46 6.945 7.692 -9.425 340 H VAL 47 HN VAL 47 0.973 8.679 -7.349 341 HA VAL 47 HA VAL 47 -1.005 9.493 -9.372 342 HB VAL 47 HB VAL 47 -1.912 10.897 -7.393 343 1HG1 VAL 47 HG11 VAL 47 -2.223 7.919 -7.136 344 2HG1 VAL 47 HG12 VAL 47 -2.912 8.831 -8.479 345 3HG1 VAL 47 HG13 VAL 47 -3.418 9.179 -6.826 346 1HG2 VAL 47 HG21 VAL 47 -0.395 8.791 -5.858 347 2HG2 VAL 47 HG22 VAL 47 -1.482 10.009 -5.189 348 3HG2 VAL 47 HG23 VAL 47 0.041 10.498 -5.932 349 H GLN 48 HN GLN 48 -1.501 12.024 -8.916 350 HA GLN 48 HA GLN 48 0.825 13.371 -9.871 351 1HB GLN 48 HB2 GLN 48 -2.013 14.066 -9.368 352 2HB GLN 48 HB1 GLN 48 -0.869 15.401 -9.341 353 1HG GLN 48 HG1 GLN 48 -0.845 15.460 -11.546 354 2HG GLN 48 HG2 GLN 48 -0.321 13.778 -11.613 355 1HE2 GLN 48 HE22 GLN 48 -2.915 15.970 -12.019 356 2HE2 GLN 48 HE21 GLN 48 -4.106 14.822 -12.523 357 H GLY 49 HN GLY 49 -1.144 13.798 -6.923 358 1HA GLY 49 HA2 GLY 49 1.116 15.238 -5.714 359 2HA GLY 49 HA1 GLY 49 -0.552 15.308 -5.163 360 H GLN 50 HN GLN 50 1.677 14.814 -3.506 361 HA GLN 50 HA GLN 50 1.336 11.977 -2.813 362 1HB GLN 50 HB1 GLN 50 3.409 12.675 -1.279 363 2HB GLN 50 HB2 GLN 50 3.604 12.148 -2.945 364 1HG GLN 50 HG1 GLN 50 3.603 14.525 -3.644 365 2HG GLN 50 HG2 GLN 50 3.552 14.984 -1.942 366 1HE2 GLN 50 HE22 GLN 50 5.430 15.409 -1.047 367 2HE2 GLN 50 HE21 GLN 50 6.967 14.813 -1.564 368 H GLU 51 HN GLU 51 -0.642 12.283 -1.721 369 HA GLU 51 HA GLU 51 -0.658 14.025 0.610 370 1HB GLU 51 HB2 GLU 51 -2.731 12.554 -0.940 371 2HB GLU 51 HB1 GLU 51 -3.062 12.893 0.753 372 1HG GLU 51 HG2 GLU 51 -2.275 14.989 -1.255 373 2HG GLU 51 HG1 GLU 51 -3.942 14.585 -0.849 374 HA PRO 52 HA PRO 52 -1.455 9.585 2.593 375 1HB PRO 52 HB2 PRO 52 0.083 7.983 0.616 376 2HB PRO 52 HB1 PRO 52 -1.389 7.569 1.500 377 1HG PRO 52 HG1 PRO 52 -1.492 8.189 -1.085 378 2HG PRO 52 HG2 PRO 52 -2.754 8.746 0.032 379 1HD PRO 52 HD2 PRO 52 -0.457 10.262 -1.144 380 2HD PRO 52 HD1 PRO 52 -2.129 10.789 -0.858 381 H LEU 53 HN LEU 53 -0.008 8.654 4.054 382 HA LEU 53 HA LEU 53 2.644 9.849 4.049 383 1HB LEU 53 HB2 LEU 53 0.817 9.377 6.027 384 2HB LEU 53 HB1 LEU 53 1.920 8.031 6.242 385 HG LEU 53 HG LEU 53 3.580 10.263 5.979 386 1HD1 LEU 53 HD21 LEU 53 1.007 11.127 6.844 387 2HD1 LEU 53 HD22 LEU 53 2.488 12.066 6.656 388 3HD1 LEU 53 HD23 LEU 53 2.140 11.265 8.188 389 1HD2 LEU 53 HD11 LEU 53 3.426 8.151 7.588 390 2HD2 LEU 53 HD12 LEU 53 2.792 9.373 8.692 391 3HD2 LEU 53 HD13 LEU 53 4.394 9.572 7.979 392 H THR 54 HN THR 54 4.575 8.670 4.236 393 HA THR 54 HA THR 54 4.670 5.838 4.272 394 HB THR 54 HB THR 54 5.884 6.197 1.788 395 HG1 THR 54 HG1 THR 54 4.885 7.912 1.064 396 1HG2 THR 54 HG21 THR 54 3.655 5.067 0.988 397 2HG2 THR 54 HG22 THR 54 3.395 4.889 2.724 398 3HG2 THR 54 HG23 THR 54 4.830 4.194 1.970 399 H ALA 55 HN ALA 55 7.085 5.473 2.869 400 HA ALA 55 HA ALA 55 8.946 6.243 4.795 401 1HB ALA 55 HB1 ALA 55 9.169 4.335 3.211 402 2HB ALA 55 HB2 ALA 55 10.621 5.323 3.379 403 3HB ALA 55 HB3 ALA 55 9.595 5.500 1.955 404 H SER 56 HN SER 56 8.050 7.761 1.744 405 HA SER 56 HA SER 56 10.151 9.620 1.595 406 1HB SER 56 HB1 SER 56 7.354 10.239 0.667 407 2HB SER 56 HB2 SER 56 8.889 10.729 -0.049 408 HG SER 56 HG SER 56 8.731 8.050 0.044 409 H MET 57 HN MET 57 6.949 9.821 3.104 410 HA MET 57 HA MET 57 7.145 12.470 4.030 411 1HB MET 57 HB1 MET 57 5.551 10.071 4.884 412 2HB MET 57 HB2 MET 57 5.508 11.543 5.840 413 1HG MET 57 HG1 MET 57 3.859 10.949 3.750 414 2HG MET 57 HG2 MET 57 4.139 12.559 4.413 415 1HE MET 57 HE1 MET 57 4.938 9.933 1.929 416 2HE MET 57 HE2 MET 57 5.645 10.747 0.534 417 3HE MET 57 HE3 MET 57 3.923 10.921 0.878 418 H LEU 58 HN LEU 58 8.094 9.384 5.416 419 HA LEU 58 HA LEU 58 8.845 10.221 7.973 420 1HB LEU 58 HB1 LEU 58 9.722 7.996 6.164 421 2HB LEU 58 HB2 LEU 58 10.515 8.235 7.706 422 HG LEU 58 HG LEU 58 8.884 7.169 8.797 423 1HD1 LEU 58 HD11 LEU 58 7.501 9.247 8.627 424 2HD1 LEU 58 HD12 LEU 58 6.575 7.751 8.746 425 3HD1 LEU 58 HD13 LEU 58 6.752 8.557 7.188 426 1HD2 LEU 58 HD21 LEU 58 7.498 6.587 6.211 427 2HD2 LEU 58 HD22 LEU 58 7.748 5.538 7.606 428 3HD2 LEU 58 HD23 LEU 58 9.104 5.933 6.545 429 H ALA 59 HN ALA 59 10.743 9.951 4.995 430 HA ALA 59 HA ALA 59 13.168 10.901 6.128 431 1HB ALA 59 HB1 ALA 59 12.988 9.519 4.059 432 2HB ALA 59 HB2 ALA 59 14.018 10.940 3.896 433 3HB ALA 59 HB3 ALA 59 12.390 10.950 3.220 434 H SER 60 HN SER 60 10.320 12.500 5.411 435 HA SER 60 HA SER 60 11.489 15.000 4.561 436 1HB SER 60 HB1 SER 60 9.107 14.043 4.029 437 2HB SER 60 HB2 SER 60 8.678 14.760 5.582 438 HG SER 60 HG SER 60 9.941 16.170 3.470 439 H ALA 61 HN ALA 61 11.155 13.424 7.492 440 HA ALA 61 HA ALA 61 11.591 15.943 8.943 441 1HB ALA 61 HB1 ALA 61 10.294 14.591 10.844 442 2HB ALA 61 HB2 ALA 61 9.489 13.915 9.428 443 3HB ALA 61 HB3 ALA 61 9.474 15.658 9.704 444 HA PRO 62 HA PRO 62 14.790 12.482 9.635 445 1HB PRO 62 HB2 PRO 62 16.536 14.873 9.353 446 2HB PRO 62 HB1 PRO 62 16.763 13.231 8.742 447 1HG PRO 62 HG2 PRO 62 16.024 15.208 7.110 448 2HG PRO 62 HG1 PRO 62 15.363 13.573 6.926 449 1HD PRO 62 HD2 PRO 62 14.091 16.017 8.077 450 2HD PRO 62 HD1 PRO 62 13.365 14.708 7.122 451 HA PRO 63 HA PRO 63 15.935 14.865 13.522 452 1HB PRO 63 HB1 PRO 63 16.054 17.525 13.628 453 2HB PRO 63 HB2 PRO 63 17.249 16.604 12.708 454 1HG PRO 63 HG1 PRO 63 14.981 18.252 11.743 455 2HG PRO 63 HG2 PRO 63 16.524 17.889 10.954 456 1HD PRO 63 HD1 PRO 63 13.995 16.615 10.536 457 2HD PRO 63 HD2 PRO 63 15.552 16.215 9.786 458 H GLN 64 HN GLN 64 13.072 14.573 12.616 459 HA GLN 64 HA GLN 64 11.877 15.894 14.933 460 1HB GLN 64 HB1 GLN 64 11.540 17.280 12.818 461 2HB GLN 64 HB2 GLN 64 10.504 15.976 12.251 462 1HG GLN 64 HG2 GLN 64 8.960 17.380 13.172 463 2HG GLN 64 HG1 GLN 64 9.306 16.331 14.546 464 1HE2 GLN 64 HE21 GLN 64 10.536 19.307 13.053 465 2HE2 GLN 64 HE22 GLN 64 10.776 20.155 14.538 466 H GLU 65 HN GLU 65 9.979 14.461 12.373 467 HA GLU 65 HA GLU 65 9.289 12.280 14.214 468 1HB GLU 65 HB1 GLU 65 7.559 12.726 11.874 469 2HB GLU 65 HB2 GLU 65 7.130 12.458 13.558 470 1HG GLU 65 HG2 GLU 65 8.352 15.024 13.302 471 2HG GLU 65 HG1 GLU 65 7.068 14.863 12.104 472 H GLN 66 HN GLN 66 11.623 11.918 12.781 473 HA GLN 66 HA GLN 66 11.174 10.469 10.363 474 1HB GLN 66 HB1 GLN 66 13.372 11.575 11.537 475 2HB GLN 66 HB2 GLN 66 13.630 9.868 11.872 476 1HG GLN 66 HG1 GLN 66 13.017 9.667 9.300 477 2HG GLN 66 HG2 GLN 66 13.620 11.322 9.298 478 1HE2 GLN 66 HE21 GLN 66 14.436 8.055 9.228 479 2HE2 GLN 66 HE22 GLN 66 16.146 8.220 9.413 480 H LYS 67 HN LYS 67 11.368 9.646 13.742 481 HA LYS 67 HA LYS 67 10.721 6.855 13.056 482 1HB LYS 67 HB1 LYS 67 12.272 7.512 15.539 483 2HB LYS 67 HB2 LYS 67 12.173 5.991 14.662 484 1HG LYS 67 HG2 LYS 67 14.172 6.519 13.842 485 2HG LYS 67 HG1 LYS 67 13.315 7.675 12.821 486 1HD LYS 67 HD2 LYS 67 14.317 9.378 13.839 487 2HD LYS 67 HD1 LYS 67 13.737 8.820 15.411 488 1HE LYS 67 HE2 LYS 67 15.829 8.317 15.956 489 2HE LYS 67 HE1 LYS 67 15.826 7.089 14.690 490 1HZ LYS 67 HZ1 LYS 67 17.591 8.987 14.693 491 2HZ LYS 67 HZ2 LYS 67 16.359 9.879 13.951 492 3HZ LYS 67 HZ3 LYS 67 16.919 8.451 13.237 493 H GLN 68 HN GLN 68 8.912 9.019 13.638 494 HA GLN 68 HA GLN 68 7.685 7.921 16.074 495 1HB GLN 68 HB2 GLN 68 8.703 10.069 16.636 496 2HB GLN 68 HB1 GLN 68 7.842 10.843 15.313 497 1HG GLN 68 HG1 GLN 68 5.722 10.409 16.399 498 2HG GLN 68 HG2 GLN 68 6.543 9.548 17.700 499 1HE2 GLN 68 HE22 GLN 68 7.586 10.684 19.286 500 2HE2 GLN 68 HE21 GLN 68 7.457 12.399 19.462 501 H MET 69 HN MET 69 7.009 10.046 13.278 502 HA MET 69 HA MET 69 4.203 9.463 13.403 503 1HB MET 69 HB2 MET 69 3.962 10.984 11.583 504 2HB MET 69 HB1 MET 69 5.160 11.658 12.680 505 1HG MET 69 HG2 MET 69 6.854 11.441 11.196 506 2HG MET 69 HG1 MET 69 6.171 9.992 10.459 507 1HE MET 69 HE1 MET 69 7.178 11.964 7.990 508 2HE MET 69 HE2 MET 69 7.584 12.673 9.555 509 3HE MET 69 HE3 MET 69 6.659 13.605 8.377 510 H LEU 70 HN LEU 70 6.167 7.251 12.781 511 HA LEU 70 HA LEU 70 5.378 6.468 10.086 512 1HB LEU 70 HB1 LEU 70 6.708 4.323 11.326 513 2HB LEU 70 HB2 LEU 70 7.355 5.438 10.141 514 HG LEU 70 HG LEU 70 7.408 5.997 13.099 515 1HD1 LEU 70 HD11 LEU 70 9.616 5.164 13.216 516 2HD1 LEU 70 HD12 LEU 70 9.694 4.923 11.470 517 3HD1 LEU 70 HD13 LEU 70 8.650 3.899 12.457 518 1HD2 LEU 70 HD21 LEU 70 8.501 7.279 10.647 519 2HD2 LEU 70 HD22 LEU 70 9.395 7.414 12.159 520 3HD2 LEU 70 HD23 LEU 70 7.734 8.005 12.061 521 H GLY 71 HN GLY 71 4.893 5.495 13.432 522 1HA GLY 71 HA2 GLY 71 2.632 3.844 12.517 523 2HA GLY 71 HA1 GLY 71 3.689 3.311 13.813 524 H GLU 72 HN GLU 72 3.158 6.675 13.794 525 HA GLU 72 HA GLU 72 0.973 6.382 15.752 526 1HB GLU 72 HB1 GLU 72 3.224 8.366 16.061 527 2HB GLU 72 HB2 GLU 72 2.005 7.921 17.248 528 1HG GLU 72 HG1 GLU 72 3.745 5.750 16.258 529 2HG GLU 72 HG2 GLU 72 4.498 6.973 17.280 530 H ARG 73 HN ARG 73 1.858 7.765 12.879 531 HA ARG 73 HA ARG 73 -0.081 9.957 13.248 532 1HB ARG 73 HB1 ARG 73 2.143 10.886 13.048 533 2HB ARG 73 HB2 ARG 73 2.456 9.934 11.610 534 1HG ARG 73 HG2 ARG 73 1.999 12.024 10.750 535 2HG ARG 73 HG1 ARG 73 0.446 11.198 10.607 536 1HD ARG 73 HD2 ARG 73 0.144 13.448 11.472 537 2HD ARG 73 HD1 ARG 73 -0.301 12.247 12.683 538 HE ARG 73 HE ARG 73 2.400 13.031 13.007 539 1HH1 ARG 73 HH21 ARG 73 -0.864 14.142 13.527 540 2HH1 ARG 73 HH22 ARG 73 -0.438 15.172 14.852 541 1HH2 ARG 73 HH12 ARG 73 2.967 14.386 14.749 542 2HH2 ARG 73 HH11 ARG 73 1.739 15.310 15.547 543 H LEU 74 HN LEU 74 1.027 7.318 11.367 544 HA LEU 74 HA LEU 74 -0.384 7.935 8.968 545 1HB LEU 74 HB1 LEU 74 1.303 5.797 9.989 546 2HB LEU 74 HB2 LEU 74 -0.006 5.194 8.995 547 HG LEU 74 HG LEU 74 1.478 7.477 7.880 548 1HD1 LEU 74 HD11 LEU 74 2.780 4.781 7.805 549 2HD1 LEU 74 HD12 LEU 74 3.174 5.960 9.057 550 3HD1 LEU 74 HD13 LEU 74 3.448 6.350 7.359 551 1HD2 LEU 74 HD21 LEU 74 -0.353 6.210 6.744 552 2HD2 LEU 74 HD22 LEU 74 0.726 4.814 6.693 553 3HD2 LEU 74 HD23 LEU 74 1.157 6.294 5.836 554 H PHE 75 HN PHE 75 -1.341 6.615 11.970 555 HA PHE 75 HA PHE 75 -3.243 4.759 11.414 556 1HB PHE 75 HB1 PHE 75 -2.803 5.238 13.685 557 2HB PHE 75 HB2 PHE 75 -3.241 6.933 13.498 558 HD1 PHE 75 HD1 PHE 75 -5.005 3.786 12.548 559 HD2 PHE 75 HD2 PHE 75 -5.048 7.373 14.843 560 HE1 PHE 75 HE1 PHE 75 -7.297 3.280 13.298 561 HE2 PHE 75 HE2 PHE 75 -7.338 6.873 15.592 562 HZ PHE 75 HZ PHE 75 -8.464 4.824 14.819 563 HA PRO 76 HA PRO 76 -6.680 8.138 10.698 564 1HB PRO 76 HB2 PRO 76 -5.740 10.564 9.820 565 2HB PRO 76 HB1 PRO 76 -6.172 10.213 11.498 566 1HG PRO 76 HG1 PRO 76 -3.478 10.223 10.192 567 2HG PRO 76 HG2 PRO 76 -3.956 10.852 11.781 568 1HD PRO 76 HD1 PRO 76 -2.696 8.497 11.524 569 2HD PRO 76 HD2 PRO 76 -3.956 8.746 12.752 570 H LEU 77 HN LEU 77 -3.804 7.659 8.875 571 HA LEU 77 HA LEU 77 -5.161 8.245 6.358 572 1HB LEU 77 HB1 LEU 77 -2.280 7.661 7.013 573 2HB LEU 77 HB2 LEU 77 -2.876 7.829 5.373 574 HG LEU 77 HG LEU 77 -2.861 9.960 7.513 575 1HD1 LEU 77 HD11 LEU 77 -1.341 9.611 4.940 576 2HD1 LEU 77 HD12 LEU 77 -0.689 9.664 6.578 577 3HD1 LEU 77 HD13 LEU 77 -1.391 11.114 5.860 578 1HD2 LEU 77 HD21 LEU 77 -4.239 9.799 4.880 579 2HD2 LEU 77 HD22 LEU 77 -3.565 11.345 5.397 580 3HD2 LEU 77 HD23 LEU 77 -4.773 10.533 6.393 581 H ILE 78 HN ILE 78 -4.162 5.535 8.284 582 HA ILE 78 HA ILE 78 -4.010 3.607 6.203 583 HB ILE 78 HB ILE 78 -4.918 2.939 8.982 584 1HG1 ILE 78 HG12 ILE 78 -2.945 4.438 9.134 585 2HG1 ILE 78 HG11 ILE 78 -2.599 2.804 9.690 586 1HG2 ILE 78 HG21 ILE 78 -3.972 1.499 6.640 587 2HG2 ILE 78 HG22 ILE 78 -4.874 0.920 8.041 588 3HG2 ILE 78 HG23 ILE 78 -3.117 1.057 8.119 589 1HD1 ILE 78 HD11 ILE 78 -2.001 3.598 6.878 590 2HD1 ILE 78 HD12 ILE 78 -1.284 2.322 7.863 591 3HD1 ILE 78 HD13 ILE 78 -0.898 4.011 8.190 592 H GLN 79 HN GLN 79 -6.622 4.767 8.279 593 HA GLN 79 HA GLN 79 -8.642 2.980 7.622 594 1HB GLN 79 HB1 GLN 79 -8.487 5.745 8.635 595 2HB GLN 79 HB2 GLN 79 -10.007 5.326 7.857 596 1HG GLN 79 HG1 GLN 79 -10.286 3.449 9.374 597 2HG GLN 79 HG2 GLN 79 -8.737 3.814 10.130 598 1HE2 GLN 79 HE22 GLN 79 -10.084 3.870 12.075 599 2HE2 GLN 79 HE21 GLN 79 -10.875 5.348 12.490 600 H ALA 80 HN ALA 80 -7.080 5.284 5.697 601 HA ALA 80 HA ALA 80 -9.176 5.629 3.742 602 1HB ALA 80 HB1 ALA 80 -6.253 6.328 3.502 603 2HB ALA 80 HB2 ALA 80 -7.463 7.375 4.246 604 3HB ALA 80 HB3 ALA 80 -7.588 6.961 2.536 605 H MET 81 HN MET 81 -6.271 3.703 4.157 606 HA MET 81 HA MET 81 -6.256 2.653 1.489 607 1HB MET 81 HB1 MET 81 -4.919 1.297 3.804 608 2HB MET 81 HB2 MET 81 -4.368 1.448 2.141 609 1HG MET 81 HG1 MET 81 -4.580 4.056 3.218 610 2HG MET 81 HG2 MET 81 -3.724 3.058 4.389 611 1HE MET 81 HE1 MET 81 -0.560 1.993 2.824 612 2HE MET 81 HE2 MET 81 -1.828 1.718 4.022 613 3HE MET 81 HE3 MET 81 -0.858 3.194 4.084 614 H HIS 82 HN HIS 82 -7.094 1.320 4.668 615 HA HIS 82 HA HIS 82 -8.536 -0.868 3.336 616 1HB HIS 82 HB1 HIS 82 -7.029 -0.608 5.859 617 2HB HIS 82 HB2 HIS 82 -8.531 -1.515 5.993 618 HD2 HIS 82 HD2 HIS 82 -5.614 -1.658 3.319 619 HE1 HIS 82 HE1 HIS 82 -6.630 -5.552 4.628 620 HE2 HIS 82 HE2 HIS 82 -5.140 -4.200 3.087 621 HA PRO 83 HA PRO 83 -12.464 0.718 4.611 622 1HB PRO 83 HB1 PRO 83 -13.797 -1.489 5.477 623 2HB PRO 83 HB2 PRO 83 -13.481 -1.160 3.769 624 1HG PRO 83 HG1 PRO 83 -12.011 -2.962 5.657 625 2HG PRO 83 HG2 PRO 83 -12.487 -3.253 3.974 626 1HD PRO 83 HD1 PRO 83 -9.973 -2.538 4.662 627 2HD PRO 83 HD2 PRO 83 -10.716 -2.034 3.131 628 H THR 84 HN THR 84 -11.109 1.734 6.429 629 HA THR 84 HA THR 84 -10.788 2.297 8.606 630 HB THR 84 HB THR 84 -13.468 1.090 9.230 631 HG1 THR 84 HG1 THR 84 -13.196 3.559 7.893 632 1HG2 THR 84 HG21 THR 84 -13.540 3.643 10.093 633 2HG2 THR 84 HG22 THR 84 -11.826 3.273 10.278 634 3HG2 THR 84 HG23 THR 84 -13.036 2.268 11.075 635 H LEU 85 HN LEU 85 -9.704 -0.203 7.909 636 HA LEU 85 HA LEU 85 -10.299 -1.975 10.153 637 1HB LEU 85 HB1 LEU 85 -8.797 -2.277 7.581 638 2HB LEU 85 HB2 LEU 85 -8.502 -3.396 8.896 639 HG LEU 85 HG LEU 85 -11.224 -2.900 7.686 640 1HD1 LEU 85 HD21 LEU 85 -9.046 -4.281 6.566 641 2HD1 LEU 85 HD22 LEU 85 -10.727 -4.283 6.028 642 3HD1 LEU 85 HD23 LEU 85 -10.165 -5.505 7.169 643 1HD2 LEU 85 HD11 LEU 85 -10.813 -5.427 9.003 644 2HD2 LEU 85 HD12 LEU 85 -12.039 -4.193 9.296 645 3HD2 LEU 85 HD13 LEU 85 -10.471 -4.085 10.096 646 H ALA 86 HN ALA 86 -8.571 0.665 9.977 647 HA ALA 86 HA ALA 86 -5.962 -0.102 10.794 648 1HB ALA 86 HB1 ALA 86 -5.503 2.111 10.840 649 2HB ALA 86 HB2 ALA 86 -7.007 2.520 11.667 650 3HB ALA 86 HB3 ALA 86 -7.013 2.205 9.931 651 H GLY 87 HN GLY 87 -6.110 1.912 13.110 652 1HA GLY 87 HA2 GLY 87 -6.685 1.896 15.380 653 2HA GLY 87 HA1 GLY 87 -7.558 0.390 15.125 654 H LYS 88 HN LYS 88 -5.181 -0.708 13.668 655 HA LYS 88 HA LYS 88 -3.095 -0.828 15.647 656 1HB LYS 88 HB1 LYS 88 -4.773 -2.456 16.506 657 2HB LYS 88 HB2 LYS 88 -4.625 -3.354 15.006 658 1HG LYS 88 HG2 LYS 88 -3.307 -4.403 16.735 659 2HG LYS 88 HG1 LYS 88 -2.245 -3.736 15.489 660 1HD LYS 88 HD2 LYS 88 -2.846 -1.910 17.712 661 2HD LYS 88 HD1 LYS 88 -1.923 -3.346 18.158 662 1HE LYS 88 HE1 LYS 88 -0.116 -2.756 16.863 663 2HE LYS 88 HE2 LYS 88 -1.091 -1.820 15.737 664 1HZ LYS 88 HZ1 LYS 88 0.462 -0.667 17.491 665 2HZ LYS 88 HZ2 LYS 88 -0.883 -0.860 18.497 666 3HZ LYS 88 HZ3 LYS 88 -1.022 0.017 17.058 667 H ILE 89 HN ILE 89 -3.803 -0.500 12.573 668 HA ILE 89 HA ILE 89 -2.138 -2.528 11.420 669 HB ILE 89 HB ILE 89 -3.210 0.003 10.188 670 1HG1 ILE 89 HG11 ILE 89 -4.077 -2.868 9.781 671 2HG1 ILE 89 HG12 ILE 89 -4.846 -1.793 10.941 672 1HG2 ILE 89 HG21 ILE 89 -1.132 -1.698 9.334 673 2HG2 ILE 89 HG22 ILE 89 -1.913 -0.400 8.426 674 3HG2 ILE 89 HG23 ILE 89 -2.531 -2.049 8.316 675 1HD1 ILE 89 HD11 ILE 89 -4.696 -1.329 7.976 676 2HD1 ILE 89 HD12 ILE 89 -5.522 -0.309 9.154 677 3HD1 ILE 89 HD13 ILE 89 -6.093 -1.950 8.854 678 H THR 90 HN THR 90 -1.639 0.864 10.663 679 HA THR 90 HA THR 90 1.116 0.773 10.478 680 HB THR 90 HB THR 90 -0.945 2.753 10.483 681 HG1 THR 90 HG1 THR 90 1.396 3.647 9.548 682 1HG2 THR 90 HG21 THR 90 0.762 4.648 11.085 683 2HG2 THR 90 HG22 THR 90 1.368 3.424 12.200 684 3HG2 THR 90 HG23 THR 90 -0.311 3.952 12.299 685 H GLY 91 HN GLY 91 -0.881 1.449 13.322 686 1HA GLY 91 HA2 GLY 91 1.115 2.283 15.086 687 2HA GLY 91 HA1 GLY 91 -0.354 1.438 15.558 688 H MET 92 HN MET 92 0.237 -0.906 13.947 689 HA MET 92 HA MET 92 1.977 -2.233 15.830 690 1HB MET 92 HB2 MET 92 0.392 -3.752 15.406 691 2HB MET 92 HB1 MET 92 -0.102 -2.953 13.920 692 1HG MET 92 HG1 MET 92 2.416 -4.292 13.609 693 2HG MET 92 HG2 MET 92 1.163 -5.369 14.196 694 1HE MET 92 HE1 MET 92 -1.398 -5.499 12.762 695 2HE MET 92 HE2 MET 92 -0.074 -6.663 12.869 696 3HE MET 92 HE3 MET 92 -0.802 -6.300 11.304 697 H LEU 93 HN LEU 93 2.120 -0.898 12.672 698 HA LEU 93 HA LEU 93 4.245 -2.368 11.586 699 1HB LEU 93 HB2 LEU 93 3.054 0.298 11.118 700 2HB LEU 93 HB1 LEU 93 4.632 -0.012 10.428 701 HG LEU 93 HG LEU 93 2.791 -0.439 8.834 702 1HD1 LEU 93 HD11 LEU 93 4.498 -1.694 8.082 703 2HD1 LEU 93 HD12 LEU 93 3.492 -3.039 8.618 704 3HD1 LEU 93 HD13 LEU 93 4.785 -2.437 9.656 705 1HD2 LEU 93 HD21 LEU 93 0.940 -1.467 9.484 706 2HD2 LEU 93 HD22 LEU 93 1.645 -1.764 11.080 707 3HD2 LEU 93 HD23 LEU 93 1.862 -2.940 9.778 708 H LEU 94 HN LEU 94 4.175 -0.514 14.319 709 HA LEU 94 HA LEU 94 7.042 0.135 14.155 710 1HB LEU 94 HB1 LEU 94 4.746 1.425 15.441 711 2HB LEU 94 HB2 LEU 94 6.115 1.220 16.516 712 HG LEU 94 HG LEU 94 6.017 3.430 15.339 713 1HD1 LEU 94 HD21 LEU 94 8.097 2.836 16.249 714 2HD1 LEU 94 HD22 LEU 94 8.442 3.327 14.591 715 3HD1 LEU 94 HD23 LEU 94 8.385 1.615 15.010 716 1HD2 LEU 94 HD11 LEU 94 6.642 1.746 12.917 717 2HD2 LEU 94 HD12 LEU 94 6.732 3.506 12.989 718 3HD2 LEU 94 HD13 LEU 94 5.179 2.694 13.186 719 H GLU 95 HN GLU 95 5.690 -2.474 14.569 720 HA GLU 95 HA GLU 95 7.303 -3.440 16.710 721 1HB GLU 95 HB2 GLU 95 5.684 -4.024 18.309 722 2HB GLU 95 HB1 GLU 95 5.271 -2.376 17.855 723 1HG GLU 95 HG1 GLU 95 3.438 -3.093 16.549 724 2HG GLU 95 HG2 GLU 95 3.959 -4.776 16.616 725 H ILE 96 HN ILE 96 5.717 -3.855 13.859 726 HA ILE 96 HA ILE 96 4.812 -6.510 13.929 727 HB ILE 96 HB ILE 96 5.036 -6.576 11.529 728 1HG1 ILE 96 HG12 ILE 96 7.264 -5.612 11.312 729 2HG1 ILE 96 HG11 ILE 96 6.117 -4.809 10.249 730 1HG2 ILE 96 HG21 ILE 96 3.119 -5.438 11.849 731 2HG2 ILE 96 HG22 ILE 96 4.041 -4.161 11.051 732 3HG2 ILE 96 HG23 ILE 96 3.894 -4.178 12.809 733 1HD1 ILE 96 HD11 ILE 96 6.086 -2.880 11.560 734 2HD1 ILE 96 HD12 ILE 96 7.781 -3.355 11.456 735 3HD1 ILE 96 HD13 ILE 96 6.859 -3.694 12.921 736 H ASP 97 HN ASP 97 6.312 -7.535 11.659 737 HA ASP 97 HA ASP 97 8.187 -9.174 12.918 738 1HB ASP 97 HB1 ASP 97 6.922 -9.289 10.589 739 2HB ASP 97 HB2 ASP 97 8.411 -8.556 9.998 740 H ASN 98 HN ASN 98 8.422 -5.950 12.340 741 HA ASN 98 HA ASN 98 10.096 -4.470 12.653 742 1HB ASN 98 HB1 ASN 98 11.438 -6.983 13.340 743 2HB ASN 98 HB2 ASN 98 12.527 -5.743 12.724 744 1HD2 ASN 98 HD21 ASN 98 13.446 -5.788 14.858 745 2HD2 ASN 98 HD22 ASN 98 12.706 -4.880 16.128 746 H SER 99 HN SER 99 10.386 -6.956 10.258 747 HA SER 99 HA SER 99 12.274 -5.533 8.627 748 1HB SER 99 HB1 SER 99 10.422 -7.620 7.527 749 2HB SER 99 HB2 SER 99 12.101 -7.281 7.106 750 HG SER 99 HG SER 99 11.227 -9.106 8.764 751 H GLU 100 HN GLU 100 8.873 -5.543 9.126 752 HA GLU 100 HA GLU 100 8.253 -4.106 6.683 753 1HB GLU 100 HB1 GLU 100 6.332 -4.279 8.948 754 2HB GLU 100 HB2 GLU 100 6.040 -4.373 7.219 755 1HG GLU 100 HG1 GLU 100 7.591 -6.603 7.793 756 2HG GLU 100 HG2 GLU 100 6.446 -6.486 9.129 757 H LEU 101 HN LEU 101 9.091 -3.478 9.968 758 HA LEU 101 HA LEU 101 8.250 -0.723 9.993 759 1HB LEU 101 HB1 LEU 101 8.399 -1.568 12.143 760 2HB LEU 101 HB2 LEU 101 9.838 -2.503 11.789 761 HG LEU 101 HG LEU 101 10.982 -0.155 11.598 762 1HD1 LEU 101 HD11 LEU 101 9.657 1.575 12.006 763 2HD1 LEU 101 HD12 LEU 101 9.542 1.018 13.676 764 3HD1 LEU 101 HD13 LEU 101 8.332 0.518 12.494 765 1HD2 LEU 101 HD21 LEU 101 11.807 -0.446 13.726 766 2HD2 LEU 101 HD22 LEU 101 11.169 -2.052 13.370 767 3HD2 LEU 101 HD23 LEU 101 10.245 -0.938 14.380 768 H LEU 102 HN LEU 102 10.961 -2.570 8.964 769 HA LEU 102 HA LEU 102 12.772 -0.317 8.751 770 1HB LEU 102 HB2 LEU 102 12.926 -3.244 8.085 771 2HB LEU 102 HB1 LEU 102 14.168 -2.139 7.542 772 HG LEU 102 HG LEU 102 13.774 -3.363 10.152 773 1HD1 LEU 102 HD11 LEU 102 15.795 -3.677 8.944 774 2HD1 LEU 102 HD12 LEU 102 16.173 -2.693 10.358 775 3HD1 LEU 102 HD13 LEU 102 16.033 -1.939 8.769 776 1HD2 LEU 102 HD21 LEU 102 14.618 -1.366 11.417 777 2HD2 LEU 102 HD22 LEU 102 12.927 -1.286 10.920 778 3HD2 LEU 102 HD23 LEU 102 14.153 -0.382 10.029 779 H HIS 103 HN HIS 103 11.078 -2.503 6.539 780 HA HIS 103 HA HIS 103 12.008 -1.246 4.196 781 1HB HIS 103 HB1 HIS 103 10.586 -3.537 4.825 782 2HB HIS 103 HB2 HIS 103 9.408 -2.563 3.960 783 HD2 HIS 103 HD2 HIS 103 10.809 -5.314 2.704 784 HE1 HIS 103 HE1 HIS 103 12.611 -2.512 0.093 785 HE2 HIS 103 HE2 HIS 103 12.047 -4.958 0.451 786 H MET 104 HN MET 104 9.123 -0.771 6.184 787 HA MET 104 HA MET 104 7.672 0.884 4.467 788 1HB MET 104 HB2 MET 104 6.497 1.670 6.450 789 2HB MET 104 HB1 MET 104 6.766 -0.068 6.564 790 1HG MET 104 HG1 MET 104 8.077 0.136 8.365 791 2HG MET 104 HG2 MET 104 8.868 1.580 7.739 792 1HE MET 104 HE1 MET 104 4.816 2.103 7.948 793 2HE MET 104 HE2 MET 104 4.717 1.484 9.596 794 3HE MET 104 HE3 MET 104 5.379 0.469 8.312 795 H LEU 105 HN LEU 105 10.356 1.633 6.616 796 HA LEU 105 HA LEU 105 10.110 4.493 6.106 797 1HB LEU 105 HB1 LEU 105 12.422 3.176 7.499 798 2HB LEU 105 HB2 LEU 105 11.819 4.810 7.689 799 HG LEU 105 HG LEU 105 10.322 2.358 8.604 800 1HD1 LEU 105 HD11 LEU 105 11.527 2.303 10.470 801 2HD1 LEU 105 HD12 LEU 105 11.351 4.043 10.700 802 3HD1 LEU 105 HD13 LEU 105 12.659 3.414 9.698 803 1HD2 LEU 105 HD21 LEU 105 9.456 4.454 10.079 804 2HD2 LEU 105 HD22 LEU 105 8.669 3.872 8.613 805 3HD2 LEU 105 HD23 LEU 105 9.781 5.239 8.533 806 H GLU 106 HN GLU 106 11.503 1.768 4.745 807 HA GLU 106 HA GLU 106 13.664 3.267 3.502 808 1HB GLU 106 HB2 GLU 106 13.070 0.362 3.949 809 2HB GLU 106 HB1 GLU 106 14.212 0.825 2.686 810 1HG GLU 106 HG2 GLU 106 14.380 1.433 5.619 811 2HG GLU 106 HG1 GLU 106 15.386 0.303 4.714 812 H SER 107 HN SER 107 10.521 2.359 2.783 813 HA SER 107 HA SER 107 10.976 2.926 -0.049 814 1HB SER 107 HB2 SER 107 10.879 0.344 0.629 815 2HB SER 107 HB1 SER 107 9.148 0.653 0.524 816 HG SER 107 HG SER 107 9.389 0.480 -1.546 817 HA PRO 108 HA PRO 108 7.263 5.282 0.646 818 1HB PRO 108 HB2 PRO 108 6.772 6.000 -1.913 819 2HB PRO 108 HB1 PRO 108 8.077 6.717 -0.961 820 1HG PRO 108 HG1 PRO 108 8.201 4.533 -3.007 821 2HG PRO 108 HG2 PRO 108 9.282 5.922 -2.788 822 1HD PRO 108 HD2 PRO 108 9.893 3.432 -1.901 823 2HD PRO 108 HD1 PRO 108 10.444 4.906 -1.079 824 H GLU 109 HN GLU 109 7.443 2.284 -0.690 825 HA GLU 109 HA GLU 109 4.521 2.144 -1.074 826 1HB GLU 109 HB2 GLU 109 6.655 0.647 -2.619 827 2HB GLU 109 HB1 GLU 109 4.924 0.377 -2.771 828 1HG GLU 109 HG1 GLU 109 4.613 2.211 -4.036 829 2HG GLU 109 HG2 GLU 109 5.817 3.152 -3.156 830 H SER 110 HN SER 110 7.264 1.038 0.559 831 HA SER 110 HA SER 110 6.337 -1.595 1.205 832 1HB SER 110 HB1 SER 110 8.664 0.019 1.775 833 2HB SER 110 HB2 SER 110 8.062 -0.759 3.243 834 HG SER 110 HG SER 110 9.461 -1.844 1.271 835 H LEU 111 HN LEU 111 6.345 1.543 2.809 836 HA LEU 111 HA LEU 111 5.190 0.773 5.210 837 1HB LEU 111 HB1 LEU 111 6.158 2.995 4.720 838 2HB LEU 111 HB2 LEU 111 4.765 3.356 3.717 839 HG LEU 111 HG LEU 111 4.153 2.522 6.475 840 1HD1 LEU 111 HD11 LEU 111 6.216 4.374 6.068 841 2HD1 LEU 111 HD12 LEU 111 5.347 4.020 7.569 842 3HD1 LEU 111 HD13 LEU 111 4.783 5.311 6.508 843 1HD2 LEU 111 HD21 LEU 111 2.703 3.527 4.464 844 2HD2 LEU 111 HD22 LEU 111 3.160 5.030 5.264 845 3HD2 LEU 111 HD23 LEU 111 2.294 3.781 6.161 846 H ARG 112 HN ARG 112 3.757 1.312 2.076 847 HA ARG 112 HA ARG 112 1.069 1.232 3.151 848 1HB ARG 112 HB2 ARG 112 0.908 2.647 1.410 849 2HB ARG 112 HB1 ARG 112 2.356 2.012 0.637 850 1HG ARG 112 HG1 ARG 112 1.085 0.160 -0.264 851 2HG ARG 112 HG2 ARG 112 -0.371 0.750 0.539 852 1HD ARG 112 HD1 ARG 112 0.725 1.502 -1.988 853 2HD ARG 112 HD2 ARG 112 -0.807 1.976 -1.253 854 HE ARG 112 HE ARG 112 1.716 3.397 -0.695 855 1HH1 ARG 112 HH21 ARG 112 -1.664 3.378 -1.549 856 2HH1 ARG 112 HH22 ARG 112 -1.811 5.103 -1.526 857 1HH2 ARG 112 HH11 ARG 112 1.529 5.669 -0.661 858 2HH2 ARG 112 HH12 ARG 112 0.003 6.404 -1.021 859 H SER 113 HN SER 113 3.141 -0.753 1.067 860 HA SER 113 HA SER 113 1.202 -2.773 0.599 861 1HB SER 113 HB1 SER 113 3.970 -2.281 -0.101 862 2HB SER 113 HB2 SER 113 3.730 -3.965 0.361 863 HG SER 113 HG SER 113 1.980 -2.674 -1.435 864 H LYS 114 HN LYS 114 3.648 -2.260 3.049 865 HA LYS 114 HA LYS 114 3.314 -4.863 4.234 866 1HB LYS 114 HB1 LYS 114 4.725 -2.405 5.289 867 2HB LYS 114 HB2 LYS 114 4.787 -4.005 6.017 868 1HG LYS 114 HG1 LYS 114 5.654 -3.519 3.192 869 2HG LYS 114 HG2 LYS 114 6.747 -3.290 4.560 870 1HD LYS 114 HD1 LYS 114 6.977 -5.503 4.911 871 2HD LYS 114 HD2 LYS 114 5.279 -5.835 4.561 872 1HE LYS 114 HE2 LYS 114 5.709 -5.686 2.181 873 2HE LYS 114 HE1 LYS 114 7.391 -5.256 2.489 874 1HZ LYS 114 HZ1 LYS 114 7.940 -7.377 2.977 875 2HZ LYS 114 HZ2 LYS 114 6.614 -7.726 1.987 876 3HZ LYS 114 HZ3 LYS 114 6.441 -7.744 3.669 877 H VAL 115 HN VAL 115 1.973 -1.668 4.606 878 HA VAL 115 HA VAL 115 0.804 -2.145 7.184 879 HB VAL 115 HB VAL 115 0.743 0.045 5.230 880 1HG1 VAL 115 HG11 VAL 115 -1.588 -0.263 5.072 881 2HG1 VAL 115 HG12 VAL 115 -1.375 0.989 6.297 882 3HG1 VAL 115 HG13 VAL 115 -1.731 -0.667 6.784 883 1HG2 VAL 115 HG21 VAL 115 1.565 1.109 6.986 884 2HG2 VAL 115 HG22 VAL 115 1.455 -0.395 7.902 885 3HG2 VAL 115 HG23 VAL 115 0.119 0.756 7.935 886 H ASP 116 HN ASP 116 -0.480 -2.087 3.865 887 HA ASP 116 HA ASP 116 -3.058 -3.010 4.436 888 1HB ASP 116 HB1 ASP 116 -2.436 -2.046 2.267 889 2HB ASP 116 HB2 ASP 116 -1.373 -3.412 1.946 890 H GLU 117 HN GLU 117 -0.022 -4.707 3.979 891 HA GLU 117 HA GLU 117 -1.241 -7.324 3.951 892 1HB GLU 117 HB1 GLU 117 1.560 -6.268 3.935 893 2HB GLU 117 HB2 GLU 117 1.290 -7.941 4.401 894 1HG GLU 117 HG1 GLU 117 1.701 -7.082 1.866 895 2HG GLU 117 HG2 GLU 117 0.903 -8.591 2.303 896 H ALA 118 HN ALA 118 0.071 -5.101 6.269 897 HA ALA 118 HA ALA 118 0.334 -6.957 8.419 898 1HB ALA 118 HB1 ALA 118 -0.159 -4.048 8.866 899 2HB ALA 118 HB2 ALA 118 1.368 -4.588 8.166 900 3HB ALA 118 HB3 ALA 118 0.876 -5.164 9.758 901 H VAL 119 HN VAL 119 -2.256 -5.209 6.964 902 HA VAL 119 HA VAL 119 -4.107 -5.276 9.108 903 HB VAL 119 HB VAL 119 -4.828 -5.411 6.200 904 1HG1 VAL 119 HG11 VAL 119 -6.779 -4.081 7.058 905 2HG1 VAL 119 HG12 VAL 119 -6.193 -4.404 8.688 906 3HG1 VAL 119 HG13 VAL 119 -6.688 -5.742 7.649 907 1HG2 VAL 119 HG21 VAL 119 -4.961 -2.766 6.924 908 2HG2 VAL 119 HG22 VAL 119 -3.707 -3.508 5.931 909 3HG2 VAL 119 HG23 VAL 119 -3.456 -3.314 7.666 910 H ALA 120 HN ALA 120 -3.591 -7.355 6.293 911 HA ALA 120 HA ALA 120 -5.498 -9.308 6.900 912 1HB ALA 120 HB1 ALA 120 -3.465 -8.923 4.983 913 2HB ALA 120 HB2 ALA 120 -4.730 -10.155 4.983 914 3HB ALA 120 HB3 ALA 120 -3.166 -10.497 5.725 915 H VAL 121 HN VAL 121 -2.439 -8.545 8.241 916 HA VAL 121 HA VAL 121 -2.079 -11.062 9.618 917 HB VAL 121 HB VAL 121 -0.541 -8.480 9.493 918 1HG1 VAL 121 HG21 VAL 121 0.940 -10.423 10.931 919 2HG1 VAL 121 HG22 VAL 121 -0.617 -10.210 11.729 920 3HG1 VAL 121 HG23 VAL 121 0.427 -8.817 11.446 921 1HG2 VAL 121 HG11 VAL 121 0.437 -11.262 8.927 922 2HG2 VAL 121 HG12 VAL 121 1.098 -9.723 8.375 923 3HG2 VAL 121 HG13 VAL 121 -0.426 -10.315 7.715 924 H LEU 122 HN LEU 122 -3.240 -7.830 10.264 925 HA LEU 122 HA LEU 122 -3.273 -8.104 13.112 926 1HB LEU 122 HB2 LEU 122 -3.478 -5.898 12.961 927 2HB LEU 122 HB1 LEU 122 -3.664 -6.024 11.224 928 HG LEU 122 HG LEU 122 -6.193 -6.636 12.235 929 1HD1 LEU 122 HD11 LEU 122 -4.748 -4.758 13.995 930 2HD1 LEU 122 HD12 LEU 122 -6.111 -5.823 14.342 931 3HD1 LEU 122 HD13 LEU 122 -6.378 -4.291 13.512 932 1HD2 LEU 122 HD21 LEU 122 -6.473 -4.084 11.493 933 2HD2 LEU 122 HD22 LEU 122 -6.274 -5.405 10.342 934 3HD2 LEU 122 HD23 LEU 122 -4.887 -4.413 10.795 935 H GLN 123 HN GLN 123 -5.575 -8.573 10.501 936 HA GLN 123 HA GLN 123 -7.787 -9.114 12.263 937 1HB GLN 123 HB1 GLN 123 -7.418 -9.571 9.296 938 2HB GLN 123 HB2 GLN 123 -8.920 -9.865 10.162 939 1HG GLN 123 HG1 GLN 123 -7.541 -7.194 10.028 940 2HG GLN 123 HG2 GLN 123 -8.835 -7.702 8.943 941 1HE2 GLN 123 HE22 GLN 123 -8.013 -6.897 12.242 942 2HE2 GLN 123 HE21 GLN 123 -9.627 -6.586 12.774 943 H ALA 124 HN ALA 124 -5.173 -10.855 10.881 944 HA ALA 124 HA ALA 124 -6.332 -13.482 11.177 945 1HB ALA 124 HB1 ALA 124 -4.141 -14.285 10.506 946 2HB ALA 124 HB2 ALA 124 -3.476 -12.661 10.687 947 3HB ALA 124 HB3 ALA 124 -4.674 -12.989 9.435 948 H HIS 125 HN HIS 125 -4.799 -11.244 13.228 949 HA HIS 125 HA HIS 125 -4.043 -13.372 15.109 950 1HB HIS 125 HB1 HIS 125 -2.539 -11.252 14.255 951 2HB HIS 125 HB2 HIS 125 -3.238 -10.596 15.731 952 HD2 HIS 125 HD2 HIS 125 -0.727 -13.341 14.595 953 HE1 HIS 125 HE1 HIS 125 -0.590 -12.985 18.811 954 HE2 HIS 125 HE2 HIS 125 0.486 -14.053 16.777 955 H GLN 126 HN GLN 126 -5.717 -10.257 14.885 956 HA GLN 126 HA GLN 126 -6.661 -10.158 17.547 957 1HB GLN 126 HB1 GLN 126 -7.606 -8.949 14.962 958 2HB GLN 126 HB2 GLN 126 -8.567 -8.778 16.424 959 1HG GLN 126 HG1 GLN 126 -6.020 -8.072 17.226 960 2HG GLN 126 HG2 GLN 126 -6.166 -7.386 15.608 961 1HE2 GLN 126 HE22 GLN 126 -7.928 -7.654 18.667 962 2HE2 GLN 126 HE21 GLN 126 -8.625 -6.073 18.605 963 H ALA 127 HN ALA 127 -8.794 -10.667 14.773 964 HA ALA 127 HA ALA 127 -10.314 -12.648 16.293 965 1HB ALA 127 HB1 ALA 127 -12.064 -11.862 15.166 966 2HB ALA 127 HB2 ALA 127 -11.307 -12.317 13.640 967 3HB ALA 127 HB3 ALA 127 -11.006 -10.724 14.334 968 H LYS 128 HN LYS 128 -8.094 -13.786 16.091 969 HA LYS 128 HA LYS 128 -7.219 -14.795 13.665 970 1HB LYS 128 HB2 LYS 128 -5.667 -16.058 14.877 971 2HB LYS 128 HB1 LYS 128 -5.974 -14.660 15.896 972 1HG LYS 128 HG1 LYS 128 -7.296 -15.919 17.390 973 2HG LYS 128 HG2 LYS 128 -7.379 -17.287 16.280 974 1HD LYS 128 HD1 LYS 128 -5.608 -18.152 17.309 975 2HD LYS 128 HD2 LYS 128 -4.650 -16.803 16.694 976 1HE LYS 128 HE1 LYS 128 -5.497 -15.504 18.720 977 2HE LYS 128 HE2 LYS 128 -6.026 -17.063 19.351 978 1HZ LYS 128 HZ1 LYS 128 -3.460 -15.938 19.426 979 2HZ LYS 128 HZ2 LYS 128 -3.388 -17.340 18.482 980 3HZ LYS 128 HZ3 LYS 128 -3.977 -17.416 20.066 981 H GLU 129 HN GLU 129 -7.864 -16.282 12.418 982 HA GLU 129 HA GLU 129 -10.050 -18.056 13.184 983 1HB GLU 129 HB2 GLU 129 -9.551 -16.728 10.859 984 2HB GLU 129 HB1 GLU 129 -8.875 -18.308 10.487 985 1HG GLU 129 HG1 GLU 129 -11.404 -18.688 11.721 986 2HG GLU 129 HG2 GLU 129 -11.579 -17.489 10.441 987 H ALA 130 HN ALA 130 -6.897 -18.069 13.626 988 HA ALA 130 HA ALA 130 -5.891 -20.457 12.594 989 1HB ALA 130 HB1 ALA 130 -4.450 -18.771 13.532 990 2HB ALA 130 HB2 ALA 130 -4.221 -20.282 14.415 991 3HB ALA 130 HB3 ALA 130 -5.180 -18.981 15.125 992 H ALA 131 HN ALA 131 -8.142 -19.894 15.132 993 HA ALA 131 HA ALA 131 -7.713 -22.333 16.563 994 1HB ALA 131 HB1 ALA 131 -10.213 -21.661 17.270 995 2HB ALA 131 HB2 ALA 131 -9.646 -20.107 16.660 996 3HB ALA 131 HB3 ALA 131 -8.774 -20.914 17.962 997 H GLN 132 HN GLN 132 -8.399 -24.314 16.076 998 HA GLN 132 HA GLN 132 -9.830 -24.816 13.661 999 1HB GLN 132 HB2 GLN 132 -9.230 -26.771 15.886 1000 2HB GLN 132 HB1 GLN 132 -9.595 -27.153 14.209 1001 1HG GLN 132 HG2 GLN 132 -7.385 -25.414 14.174 1002 2HG GLN 132 HG1 GLN 132 -7.075 -26.611 15.431 1003 1HE2 GLN 132 HE21 GLN 132 -5.337 -26.891 13.639 1004 2HE2 GLN 132 HE22 GLN 132 -5.678 -28.133 12.487 1005 H LYS 133 HN LYS 133 -10.637 -26.009 16.919 1006 HA LYS 133 HA LYS 133 -13.449 -26.024 16.202 1007 1HB LYS 133 HB1 LYS 133 -13.676 -27.027 18.541 1008 2HB LYS 133 HB2 LYS 133 -12.796 -27.973 17.350 1009 1HG LYS 133 HG2 LYS 133 -10.977 -27.996 18.613 1010 2HG LYS 133 HG1 LYS 133 -11.007 -26.240 18.790 1011 1HD LYS 133 HD2 LYS 133 -11.244 -26.931 20.979 1012 2HD LYS 133 HD1 LYS 133 -12.926 -26.723 20.487 1013 1HE LYS 133 HE1 LYS 133 -12.769 -28.797 21.653 1014 2HE LYS 133 HE2 LYS 133 -12.987 -29.159 19.942 1015 1HZ LYS 133 HZ1 LYS 133 -10.271 -29.012 21.061 1016 2HZ LYS 133 HZ2 LYS 133 -10.833 -29.888 19.728 1017 3HZ LYS 133 HZ3 LYS 133 -11.195 -30.409 21.297 1018 H ALA 134 HN ALA 134 -13.354 -23.599 16.046 1019 HA ALA 134 HA ALA 134 -13.334 -22.177 18.576 1020 1HB ALA 134 HB1 ALA 134 -14.186 -20.828 16.079 1021 2HB ALA 134 HB2 ALA 134 -12.518 -21.395 16.173 1022 3HB ALA 134 HB3 ALA 134 -13.133 -20.260 17.375 1023 H VAL 135 HN VAL 135 -15.088 -21.286 19.588 1024 HA VAL 135 HA VAL 135 -17.641 -22.475 19.038 1025 HB VAL 135 HB VAL 135 -18.415 -20.998 20.946 1026 1HG1 VAL 135 HG21 VAL 135 -17.472 -22.414 22.606 1027 2HG1 VAL 135 HG22 VAL 135 -16.055 -22.745 21.611 1028 3HG1 VAL 135 HG23 VAL 135 -17.632 -23.377 21.138 1029 1HG2 VAL 135 HG11 VAL 135 -15.645 -20.541 21.796 1030 2HG2 VAL 135 HG12 VAL 135 -17.066 -19.507 21.946 1031 3HG2 VAL 135 HG13 VAL 135 -16.169 -19.559 20.428 1032 H ASN 136 HN ASN 136 -19.416 -21.581 18.127 1033 HA ASN 136 HA ASN 136 -19.047 -19.098 16.673 1034 1HB ASN 136 HB1 ASN 136 -21.445 -19.748 15.863 1035 2HB ASN 136 HB2 ASN 136 -20.060 -20.680 15.303 1036 1HD2 ASN 136 HD21 ASN 136 -19.956 -22.797 15.738 1037 2HD2 ASN 136 HD22 ASN 136 -21.116 -23.665 16.682 1038 H SER 137 HN SER 137 -20.383 -17.286 16.839 1039 HA SER 137 HA SER 137 -21.635 -16.976 19.468 1040 1HB SER 137 HB2 SER 137 -21.065 -14.782 17.473 1041 2HB SER 137 HB1 SER 137 -21.346 -14.626 19.207 1042 HG SER 137 HG SER 137 -19.353 -15.364 19.617 1043 H ALA 138 HN ALA 138 -22.390 -17.221 16.127 1044 HA ALA 138 HA ALA 138 -24.883 -15.857 16.148 1045 1HB ALA 138 HB1 ALA 138 -24.374 -16.075 13.983 1046 2HB ALA 138 HB2 ALA 138 -25.098 -17.677 14.115 1047 3HB ALA 138 HB3 ALA 138 -23.351 -17.482 14.270 1048 H THR 139 HN THR 139 -26.783 -16.478 16.936 1049 HA THR 139 HA THR 139 -27.107 -19.284 17.753 1050 HB THR 139 HB THR 139 -29.184 -17.829 18.894 1051 HG1 THR 139 HG1 THR 139 -27.223 -16.308 19.849 1052 1HG2 THR 139 HG21 THR 139 -28.440 -18.813 20.722 1053 2HG2 THR 139 HG22 THR 139 -26.937 -17.891 20.670 1054 3HG2 THR 139 HG23 THR 139 -27.071 -19.408 19.782 1055 H GLY 140 HN GLY 140 -29.192 -20.289 17.473 1056 1HA GLY 140 HA1 GLY 140 -30.483 -19.375 14.995 1057 2HA GLY 140 HA2 GLY 140 -30.525 -21.015 15.626 1058 H VAL 141 HN VAL 141 -32.836 -20.889 15.262 1059 HA VAL 141 HA VAL 141 -34.373 -19.077 16.915 1060 HB VAL 141 HB VAL 141 -35.679 -21.365 15.533 1061 1HG1 VAL 141 HG21 VAL 141 -37.459 -19.870 15.258 1062 2HG1 VAL 141 HG22 VAL 141 -36.426 -18.459 15.485 1063 3HG1 VAL 141 HG23 VAL 141 -36.815 -19.496 16.856 1064 1HG2 VAL 141 HG11 VAL 141 -33.836 -20.409 14.028 1065 2HG2 VAL 141 HG12 VAL 141 -34.841 -18.961 13.946 1066 3HG2 VAL 141 HG13 VAL 141 -35.469 -20.506 13.372 1067 HA PRO 142 HA PRO 142 -34.354 -21.911 20.374 1068 1HB PRO 142 HB2 PRO 142 -36.453 -20.171 21.469 1069 2HB PRO 142 HB1 PRO 142 -34.842 -20.520 22.103 1070 1HG PRO 142 HG2 PRO 142 -35.465 -18.122 21.056 1071 2HG PRO 142 HG1 PRO 142 -33.850 -18.832 20.884 1072 1HD PRO 142 HD1 PRO 142 -36.095 -18.725 18.902 1073 2HD PRO 142 HD2 PRO 142 -34.355 -18.469 18.649 1074 H THR 143 HN THR 143 -35.398 -23.541 18.987 1075 HA THR 143 HA THR 143 -38.310 -23.636 19.116 1076 HB THR 143 HB THR 143 -37.002 -25.958 17.938 1077 HG1 THR 143 HG1 THR 143 -35.393 -24.771 17.184 1078 1HG2 THR 143 HG21 THR 143 -38.425 -25.571 16.105 1079 2HG2 THR 143 HG22 THR 143 -38.688 -23.890 16.571 1080 3HG2 THR 143 HG23 THR 143 -39.360 -25.192 17.552 1081 H VAL 144 HN VAL 144 -39.227 -25.919 19.537 1082 HA VAL 144 HA VAL 144 -38.093 -26.837 22.082 1083 HB VAL 144 HB VAL 144 -40.434 -26.072 22.130 1084 1HG1 VAL 144 HG11 VAL 144 -41.950 -26.660 20.611 1085 2HG1 VAL 144 HG12 VAL 144 -41.611 -28.374 20.841 1086 3HG1 VAL 144 HG13 VAL 144 -40.643 -27.428 19.712 1087 1HG2 VAL 144 HG21 VAL 144 -39.384 -28.221 23.378 1088 2HG2 VAL 144 HG22 VAL 144 -40.769 -28.963 22.578 1089 3HG2 VAL 144 HG23 VAL 144 -41.009 -27.605 23.678 Start of MODEL 7 1 1H GLY 1 HT1 GLY 1 -45.520 51.205 -0.299 2 2H GLY 1 HT2 GLY 1 -45.122 49.640 -0.802 3 3H GLY 1 HT3 GLY 1 -45.697 50.768 -1.923 4 1HA GLY 1 HA2 GLY 1 -43.289 51.473 -0.430 5 2HA GLY 1 HA1 GLY 1 -43.136 50.234 -1.666 6 HA PRO 2 HA PRO 2 -43.299 54.844 -3.274 7 1HB PRO 2 HB1 PRO 2 -40.359 54.471 -3.468 8 2HB PRO 2 HB2 PRO 2 -41.285 55.904 -3.010 9 1HG PRO 2 HG1 PRO 2 -39.982 54.479 -1.174 10 2HG PRO 2 HG2 PRO 2 -41.573 55.179 -0.824 11 1HD PRO 2 HD2 PRO 2 -40.845 52.352 -1.480 12 2HD PRO 2 HD1 PRO 2 -42.034 52.970 -0.314 13 H LEU 3 HN LEU 3 -43.098 55.313 -5.476 14 HA LEU 3 HA LEU 3 -42.717 52.966 -7.163 15 1HB LEU 3 HB2 LEU 3 -44.000 55.647 -7.551 16 2HB LEU 3 HB1 LEU 3 -43.579 54.662 -8.938 17 HG LEU 3 HG LEU 3 -45.173 53.369 -6.789 18 1HD1 LEU 3 HD21 LEU 3 -46.402 55.371 -6.868 19 2HD1 LEU 3 HD22 LEU 3 -47.252 54.262 -7.943 20 3HD1 LEU 3 HD23 LEU 3 -46.210 55.517 -8.615 21 1HD2 LEU 3 HD11 LEU 3 -45.145 51.830 -8.392 22 2HD2 LEU 3 HD12 LEU 3 -44.518 52.972 -9.580 23 3HD2 LEU 3 HD13 LEU 3 -46.254 52.868 -9.287 24 H GLY 4 HN GLY 4 -41.339 56.144 -6.598 25 1HA GLY 4 HA2 GLY 4 -39.423 55.736 -8.785 26 2HA GLY 4 HA1 GLY 4 -39.692 57.242 -7.920 27 H SER 5 HN SER 5 -39.031 53.967 -6.711 28 HA SER 5 HA SER 5 -36.817 55.082 -5.145 29 1HB SER 5 HB1 SER 5 -37.092 53.293 -3.634 30 2HB SER 5 HB2 SER 5 -38.740 53.722 -4.093 31 HG SER 5 HG SER 5 -38.236 51.429 -4.143 32 H ALA 6 HN ALA 6 -37.301 53.502 -8.011 33 HA ALA 6 HA ALA 6 -35.311 51.519 -8.036 34 1HB ALA 6 HB1 ALA 6 -35.404 51.722 -10.483 35 2HB ALA 6 HB2 ALA 6 -36.361 53.194 -10.313 36 3HB ALA 6 HB3 ALA 6 -37.012 51.650 -9.761 37 H ALA 7 HN ALA 7 -35.197 54.975 -8.772 38 HA ALA 7 HA ALA 7 -32.371 54.872 -9.407 39 1HB ALA 7 HB1 ALA 7 -32.703 56.830 -10.426 40 2HB ALA 7 HB2 ALA 7 -33.515 57.523 -9.022 41 3HB ALA 7 HB3 ALA 7 -34.422 56.535 -10.167 42 H ALA 8 HN ALA 8 -31.150 56.911 -8.341 43 HA ALA 8 HA ALA 8 -31.493 56.638 -5.425 44 1HB ALA 8 HB1 ALA 8 -28.991 56.656 -7.079 45 2HB ALA 8 HB2 ALA 8 -29.521 55.471 -5.885 46 3HB ALA 8 HB3 ALA 8 -28.969 57.063 -5.363 47 H ALA 9 HN ALA 9 -29.578 58.715 -7.598 48 HA ALA 9 HA ALA 9 -31.047 61.074 -6.896 49 1HB ALA 9 HB1 ALA 9 -28.277 60.715 -5.764 50 2HB ALA 9 HB2 ALA 9 -29.780 60.886 -4.857 51 3HB ALA 9 HB3 ALA 9 -29.161 62.240 -5.801 52 H THR 10 HN THR 10 -28.074 59.700 -8.221 53 HA THR 10 HA THR 10 -28.290 61.578 -10.467 54 HB THR 10 HB THR 10 -25.764 61.668 -10.494 55 HG1 THR 10 HG1 THR 10 -25.846 60.944 -7.790 56 1HG2 THR 10 HG21 THR 10 -27.110 63.533 -9.595 57 2HG2 THR 10 HG22 THR 10 -25.530 63.366 -8.829 58 3HG2 THR 10 HG23 THR 10 -26.978 62.807 -7.993 59 HA PRO 11 HA PRO 11 -28.040 57.656 -12.603 60 1HB PRO 11 HB1 PRO 11 -28.224 58.624 -15.119 61 2HB PRO 11 HB2 PRO 11 -29.618 58.520 -14.039 62 1HG PRO 11 HG1 PRO 11 -27.895 60.884 -14.687 63 2HG PRO 11 HG2 PRO 11 -29.662 60.790 -14.559 64 1HD PRO 11 HD2 PRO 11 -28.095 61.755 -12.565 65 2HD PRO 11 HD1 PRO 11 -29.626 60.912 -12.259 66 H ALA 12 HN ALA 12 -25.832 60.252 -12.727 67 HA ALA 12 HA ALA 12 -24.002 58.987 -14.585 68 1HB ALA 12 HB1 ALA 12 -22.526 60.919 -14.013 69 2HB ALA 12 HB2 ALA 12 -23.793 61.494 -12.929 70 3HB ALA 12 HB3 ALA 12 -24.103 61.370 -14.661 71 H VAL 13 HN VAL 13 -23.963 57.002 -13.188 72 HA VAL 13 HA VAL 13 -22.096 57.282 -10.931 73 HB VAL 13 HB VAL 13 -23.728 54.830 -11.560 74 1HG1 VAL 13 HG11 VAL 13 -23.289 55.107 -8.817 75 2HG1 VAL 13 HG12 VAL 13 -21.760 55.542 -9.581 76 3HG1 VAL 13 HG13 VAL 13 -22.500 53.977 -9.917 77 1HG2 VAL 13 HG21 VAL 13 -24.594 57.380 -10.434 78 2HG2 VAL 13 HG22 VAL 13 -24.948 55.994 -9.401 79 3HG2 VAL 13 HG23 VAL 13 -25.546 56.035 -11.060 80 H ARG 14 HN ARG 14 -20.176 56.210 -10.905 81 HA ARG 14 HA ARG 14 -19.279 55.093 -13.439 82 1HB ARG 14 HB1 ARG 14 -17.034 55.048 -12.184 83 2HB ARG 14 HB2 ARG 14 -17.718 56.616 -12.588 84 1HG ARG 14 HG1 ARG 14 -18.561 56.850 -10.314 85 2HG ARG 14 HG2 ARG 14 -17.905 55.264 -9.903 86 1HD ARG 14 HD1 ARG 14 -16.353 56.875 -9.112 87 2HD ARG 14 HD2 ARG 14 -15.643 56.143 -10.552 88 HE ARG 14 HE ARG 14 -17.058 58.716 -10.721 89 1HH1 ARG 14 HH21 ARG 14 -14.181 56.792 -11.140 90 2HH1 ARG 14 HH22 ARG 14 -13.329 58.026 -12.008 91 1HH2 ARG 14 HH11 ARG 14 -15.943 60.343 -11.862 92 2HH2 ARG 14 HH12 ARG 14 -14.331 60.044 -12.418 93 H THR 15 HN THR 15 -20.816 53.237 -12.980 94 HA THR 15 HA THR 15 -19.597 51.240 -11.203 95 HB THR 15 HB THR 15 -22.185 50.601 -12.454 96 HG1 THR 15 HG1 THR 15 -22.810 52.624 -12.111 97 1HG2 THR 15 HG21 THR 15 -20.822 50.164 -9.915 98 2HG2 THR 15 HG22 THR 15 -22.003 49.165 -10.765 99 3HG2 THR 15 HG23 THR 15 -22.545 50.511 -9.762 100 H VAL 16 HN VAL 16 -18.913 49.282 -11.952 101 HA VAL 16 HA VAL 16 -18.641 49.062 -14.858 102 HB VAL 16 HB VAL 16 -17.263 47.003 -13.344 103 1HG1 VAL 16 HG21 VAL 16 -16.414 47.209 -15.438 104 2HG1 VAL 16 HG22 VAL 16 -15.339 48.344 -14.619 105 3HG1 VAL 16 HG23 VAL 16 -16.734 48.942 -15.516 106 1HG2 VAL 16 HG11 VAL 16 -17.347 49.089 -11.776 107 2HG2 VAL 16 HG12 VAL 16 -16.132 49.726 -12.884 108 3HG2 VAL 16 HG13 VAL 16 -15.831 48.221 -12.015 109 HA PRO 17 HA PRO 17 -20.502 44.776 -13.750 110 1HB PRO 17 HB1 PRO 17 -21.471 44.319 -11.285 111 2HB PRO 17 HB2 PRO 17 -19.761 44.098 -11.674 112 1HG PRO 17 HG2 PRO 17 -21.115 46.399 -10.315 113 2HG PRO 17 HG1 PRO 17 -19.589 45.597 -9.901 114 1HD PRO 17 HD2 PRO 17 -19.729 47.949 -11.280 115 2HD PRO 17 HD1 PRO 17 -18.399 46.789 -11.459 116 H GLN 18 HN GLN 18 -21.900 46.459 -15.015 117 HA GLN 18 HA GLN 18 -24.344 47.295 -13.781 118 1HB GLN 18 HB2 GLN 18 -23.643 47.119 -16.718 119 2HB GLN 18 HB1 GLN 18 -24.994 48.007 -16.027 120 1HG GLN 18 HG2 GLN 18 -22.817 49.007 -14.671 121 2HG GLN 18 HG1 GLN 18 -22.208 48.766 -16.307 122 1HE2 GLN 18 HE21 GLN 18 -24.483 49.266 -17.777 123 2HE2 GLN 18 HE22 GLN 18 -24.921 50.929 -17.604 124 H TYR 19 HN TYR 19 -26.356 46.715 -15.455 125 HA TYR 19 HA TYR 19 -26.899 43.956 -14.831 126 1HB TYR 19 HB1 TYR 19 -28.475 46.164 -14.990 127 2HB TYR 19 HB2 TYR 19 -28.801 45.421 -16.552 128 HD1 TYR 19 HD1 TYR 19 -30.349 43.683 -16.719 129 HD2 TYR 19 HD2 TYR 19 -28.740 44.670 -12.905 130 HE1 TYR 19 HE1 TYR 19 -31.936 42.136 -15.655 131 HE2 TYR 19 HE2 TYR 19 -30.324 43.125 -11.832 132 HH TYR 19 HH TYR 19 -32.524 42.103 -12.329 133 H LYS 20 HN LYS 20 -24.897 43.575 -16.384 134 HA LYS 20 HA LYS 20 -25.852 43.218 -19.137 135 1HB LYS 20 HB2 LYS 20 -23.032 42.613 -18.432 136 2HB LYS 20 HB1 LYS 20 -23.691 43.395 -19.862 137 1HG LYS 20 HG1 LYS 20 -23.583 45.467 -18.954 138 2HG LYS 20 HG2 LYS 20 -23.881 44.885 -17.314 139 1HD LYS 20 HD2 LYS 20 -21.313 44.259 -18.729 140 2HD LYS 20 HD1 LYS 20 -21.538 45.800 -17.899 141 1HE LYS 20 HE2 LYS 20 -22.088 44.571 -15.830 142 2HE LYS 20 HE1 LYS 20 -21.770 43.055 -16.672 143 1HZ LYS 20 HZ1 LYS 20 -19.942 44.410 -15.266 144 2HZ LYS 20 HZ2 LYS 20 -19.635 45.000 -16.821 145 3HZ LYS 20 HZ3 LYS 20 -19.567 43.337 -16.518 146 H TYR 21 HN TYR 21 -25.968 41.229 -20.091 147 HA TYR 21 HA TYR 21 -26.322 38.977 -18.417 148 1HB TYR 21 HB2 TYR 21 -25.966 39.013 -21.422 149 2HB TYR 21 HB1 TYR 21 -26.702 37.729 -20.467 150 HD1 TYR 21 HD1 TYR 21 -28.708 38.637 -18.901 151 HD2 TYR 21 HD2 TYR 21 -27.407 40.407 -22.544 152 HE1 TYR 21 HE1 TYR 21 -30.913 39.694 -19.167 153 HE2 TYR 21 HE2 TYR 21 -29.608 41.469 -22.821 154 HH TYR 21 HH TYR 21 -32.119 40.784 -21.849 155 H ALA 22 HN ALA 22 -24.634 38.152 -17.345 156 HA ALA 22 HA ALA 22 -22.044 37.895 -18.661 157 1HB ALA 22 HB1 ALA 22 -21.102 37.644 -16.562 158 2HB ALA 22 HB2 ALA 22 -22.591 37.019 -15.855 159 3HB ALA 22 HB3 ALA 22 -22.452 38.733 -16.245 160 H ALA 23 HN ALA 23 -24.819 36.066 -18.217 161 HA ALA 23 HA ALA 23 -23.499 33.491 -18.044 162 1HB ALA 23 HB1 ALA 23 -25.634 32.544 -17.837 163 2HB ALA 23 HB2 ALA 23 -26.417 33.932 -18.593 164 3HB ALA 23 HB3 ALA 23 -25.736 34.077 -16.973 165 H GLY 24 HN GLY 24 -23.436 31.936 -19.666 166 1HA GLY 24 HA1 GLY 24 -23.593 33.032 -22.374 167 2HA GLY 24 HA2 GLY 24 -22.763 31.558 -21.899 168 H VAL 25 HN VAL 25 -25.711 32.952 -23.000 169 HA VAL 25 HA VAL 25 -27.289 30.562 -22.615 170 HB VAL 25 HB VAL 25 -28.951 31.827 -24.089 171 1HG1 VAL 25 HG11 VAL 25 -29.583 33.344 -22.237 172 2HG1 VAL 25 HG12 VAL 25 -28.036 32.998 -21.466 173 3HG1 VAL 25 HG13 VAL 25 -29.214 31.707 -21.696 174 1HG2 VAL 25 HG21 VAL 25 -26.677 33.679 -24.088 175 2HG2 VAL 25 HG22 VAL 25 -28.235 34.421 -23.725 176 3HG2 VAL 25 HG23 VAL 25 -28.016 33.522 -25.226 177 H ARG 26 HN ARG 26 -25.649 32.206 -25.275 178 HA ARG 26 HA ARG 26 -26.541 30.285 -27.233 179 1HB ARG 26 HB2 ARG 26 -24.894 32.756 -27.240 180 2HB ARG 26 HB1 ARG 26 -24.572 31.588 -28.514 181 1HG ARG 26 HG2 ARG 26 -27.381 32.432 -27.973 182 2HG ARG 26 HG1 ARG 26 -26.303 33.496 -28.881 183 1HD ARG 26 HD2 ARG 26 -25.821 31.561 -30.397 184 2HD ARG 26 HD1 ARG 26 -27.092 30.670 -29.564 185 HE ARG 26 HE ARG 26 -27.514 33.114 -31.154 186 1HH1 ARG 26 HH12 ARG 26 -28.656 30.124 -29.776 187 2HH1 ARG 26 HH11 ARG 26 -30.200 30.205 -30.559 188 1HH2 ARG 26 HH21 ARG 26 -29.543 33.227 -32.189 189 2HH2 ARG 26 HH22 ARG 26 -30.704 31.968 -31.930 190 H ASN 27 HN ASN 27 -25.498 28.511 -27.929 191 HA ASN 27 HA ASN 27 -23.017 27.787 -26.559 192 1HB ASN 27 HB2 ASN 27 -24.807 26.058 -28.281 193 2HB ASN 27 HB1 ASN 27 -23.492 25.508 -27.247 194 1HD2 ASN 27 HD22 ASN 27 -23.915 26.928 -24.967 195 2HD2 ASN 27 HD21 ASN 27 -25.422 26.469 -24.257 196 HA PRO 28 HA PRO 28 -20.968 29.108 -30.385 197 1HB PRO 28 HB1 PRO 28 -18.610 28.174 -28.850 198 2HB PRO 28 HB2 PRO 28 -18.889 29.721 -29.656 199 1HG PRO 28 HG2 PRO 28 -18.975 29.527 -26.996 200 2HG PRO 28 HG1 PRO 28 -20.099 30.581 -27.876 201 1HD PRO 28 HD2 PRO 28 -20.574 27.882 -26.674 202 2HD PRO 28 HD1 PRO 28 -21.635 29.307 -26.702 203 H GLN 29 HN GLN 29 -21.774 27.383 -31.647 204 HA GLN 29 HA GLN 29 -20.304 24.850 -31.507 205 1HB GLN 29 HB2 GLN 29 -22.119 24.234 -33.297 206 2HB GLN 29 HB1 GLN 29 -22.542 24.289 -31.592 207 1HG GLN 29 HG2 GLN 29 -23.150 26.785 -32.173 208 2HG GLN 29 HG1 GLN 29 -23.306 26.121 -33.800 209 1HE2 GLN 29 HE21 GLN 29 -25.413 25.974 -34.157 210 2HE2 GLN 29 HE22 GLN 29 -26.558 25.200 -33.120 211 H GLN 30 HN GLN 30 -18.404 25.201 -32.546 212 HA GLN 30 HA GLN 30 -18.149 26.731 -34.922 213 1HB GLN 30 HB1 GLN 30 -16.330 24.766 -33.536 214 2HB GLN 30 HB2 GLN 30 -15.871 25.579 -35.026 215 1HG GLN 30 HG2 GLN 30 -16.351 27.753 -33.805 216 2HG GLN 30 HG1 GLN 30 -16.399 26.785 -32.333 217 1HE2 GLN 30 HE21 GLN 30 -14.612 27.917 -31.519 218 2HE2 GLN 30 HE22 GLN 30 -13.010 27.601 -32.085 219 H HIS 31 HN HIS 31 -18.652 26.193 -36.927 220 HA HIS 31 HA HIS 31 -18.928 23.339 -37.600 221 1HB HIS 31 HB1 HIS 31 -20.436 25.782 -38.412 222 2HB HIS 31 HB2 HIS 31 -20.263 24.494 -39.602 223 HD2 HIS 31 HD2 HIS 31 -21.641 24.826 -35.918 224 HE1 HIS 31 HE1 HIS 31 -23.729 21.791 -38.004 225 HE2 HIS 31 HE2 HIS 31 -23.565 23.086 -35.829 226 H LEU 32 HN LEU 32 -16.419 24.729 -37.619 227 HA LEU 32 HA LEU 32 -15.845 25.144 -40.454 228 1HB LEU 32 HB1 LEU 32 -14.985 26.450 -38.207 229 2HB LEU 32 HB2 LEU 32 -13.638 25.376 -38.530 230 HG LEU 32 HG LEU 32 -13.319 27.592 -39.540 231 1HD1 LEU 32 HD21 LEU 32 -13.720 25.913 -41.928 232 2HD1 LEU 32 HD22 LEU 32 -12.737 25.214 -40.641 233 3HD1 LEU 32 HD23 LEU 32 -12.281 26.759 -41.358 234 1HD2 LEU 32 HD11 LEU 32 -14.717 28.497 -41.176 235 2HD2 LEU 32 HD12 LEU 32 -15.825 27.893 -39.946 236 3HD2 LEU 32 HD13 LEU 32 -15.565 26.971 -41.426 237 H ASN 33 HN ASN 33 -13.676 23.788 -38.017 238 HA ASN 33 HA ASN 33 -13.044 21.621 -39.876 239 1HB ASN 33 HB2 ASN 33 -11.252 21.315 -37.865 240 2HB ASN 33 HB1 ASN 33 -10.992 22.365 -39.255 241 1HD2 ASN 33 HD22 ASN 33 -12.336 22.359 -35.984 242 2HD2 ASN 33 HD21 ASN 33 -11.885 23.983 -35.608 243 H ALA 34 HN ALA 34 -13.745 19.620 -39.575 244 HA ALA 34 HA ALA 34 -15.173 18.963 -37.126 245 1HB ALA 34 HB1 ALA 34 -14.850 17.252 -39.581 246 2HB ALA 34 HB2 ALA 34 -16.110 18.472 -39.397 247 3HB ALA 34 HB3 ALA 34 -16.054 17.091 -38.302 248 H GLN 35 HN GLN 35 -12.048 18.787 -38.147 249 HA GLN 35 HA GLN 35 -11.489 16.243 -36.801 250 1HB GLN 35 HB2 GLN 35 -10.004 17.928 -38.777 251 2HB GLN 35 HB1 GLN 35 -9.097 16.855 -37.721 252 1HG GLN 35 HG1 GLN 35 -10.830 15.076 -38.554 253 2HG GLN 35 HG2 GLN 35 -11.009 16.199 -39.901 254 1HE2 GLN 35 HE21 GLN 35 -8.725 14.215 -38.128 255 2HE2 GLN 35 HE22 GLN 35 -7.579 14.055 -39.411 256 HA PRO 36 HA PRO 36 -10.268 18.325 -33.078 257 1HB PRO 36 HB2 PRO 36 -8.398 16.035 -32.789 258 2HB PRO 36 HB1 PRO 36 -9.629 16.632 -31.672 259 1HG PRO 36 HG2 PRO 36 -10.020 14.390 -33.058 260 2HG PRO 36 HG1 PRO 36 -11.349 15.529 -32.771 261 1HD PRO 36 HD1 PRO 36 -9.723 15.090 -35.245 262 2HD PRO 36 HD2 PRO 36 -11.461 15.421 -35.080 263 H GLN 37 HN GLN 37 -8.278 19.092 -31.989 264 HA GLN 37 HA GLN 37 -6.337 19.966 -33.979 265 1HB GLN 37 HB2 GLN 37 -7.438 21.053 -31.549 266 2HB GLN 37 HB1 GLN 37 -5.683 21.039 -31.457 267 1HG GLN 37 HG2 GLN 37 -5.807 22.990 -32.523 268 2HG GLN 37 HG1 GLN 37 -6.094 22.014 -33.963 269 1HE2 GLN 37 HE21 GLN 37 -7.305 23.619 -34.947 270 2HE2 GLN 37 HE22 GLN 37 -8.904 24.021 -34.429 271 H VAL 38 HN VAL 38 -4.018 20.005 -33.392 272 HA VAL 38 HA VAL 38 -3.278 17.484 -32.074 273 HB VAL 38 HB VAL 38 -1.567 19.132 -33.933 274 1HG1 VAL 38 HG11 VAL 38 -0.213 17.137 -34.104 275 2HG1 VAL 38 HG12 VAL 38 -1.333 16.252 -33.069 276 3HG1 VAL 38 HG13 VAL 38 -0.389 17.586 -32.408 277 1HG2 VAL 38 HG21 VAL 38 -3.862 17.898 -34.697 278 2HG2 VAL 38 HG22 VAL 38 -2.683 16.606 -34.924 279 3HG2 VAL 38 HG23 VAL 38 -2.465 18.152 -35.744 280 H THR 39 HN THR 39 -1.680 20.630 -32.613 281 HA THR 39 HA THR 39 -0.298 20.373 -30.080 282 HB THR 39 HB THR 39 -0.182 22.705 -31.991 283 HG1 THR 39 HG1 THR 39 0.266 20.597 -32.977 284 1HG2 THR 39 HG21 THR 39 2.322 22.356 -31.068 285 2HG2 THR 39 HG22 THR 39 1.381 21.865 -29.660 286 3HG2 THR 39 HG23 THR 39 1.146 23.466 -30.364 287 H MET 40 HN MET 40 -2.919 22.233 -31.460 288 HA MET 40 HA MET 40 -3.062 24.005 -29.168 289 1HB MET 40 HB1 MET 40 -4.132 23.959 -31.869 290 2HB MET 40 HB2 MET 40 -5.369 24.367 -30.689 291 1HG MET 40 HG1 MET 40 -4.625 26.449 -30.810 292 2HG MET 40 HG2 MET 40 -3.209 25.897 -29.916 293 1HE MET 40 HE1 MET 40 -2.044 28.151 -31.089 294 2HE MET 40 HE2 MET 40 -0.797 27.561 -32.187 295 3HE MET 40 HE3 MET 40 -1.061 26.758 -30.640 296 H GLN 41 HN GLN 41 -3.415 22.303 -27.595 297 HA GLN 41 HA GLN 41 -6.184 21.979 -26.997 298 1HB GLN 41 HB2 GLN 41 -5.368 20.078 -28.707 299 2HB GLN 41 HB1 GLN 41 -4.863 19.326 -27.200 300 1HG GLN 41 HG2 GLN 41 -7.260 19.823 -26.402 301 2HG GLN 41 HG1 GLN 41 -7.617 20.044 -28.116 302 1HE2 GLN 41 HE22 GLN 41 -6.103 17.753 -25.881 303 2HE2 GLN 41 HE21 GLN 41 -6.634 16.331 -26.705 304 H GLN 42 HN GLN 42 -6.352 22.083 -24.858 305 HA GLN 42 HA GLN 42 -4.093 21.122 -23.231 306 1HB GLN 42 HB2 GLN 42 -4.988 23.746 -23.457 307 2HB GLN 42 HB1 GLN 42 -5.700 23.184 -21.951 308 1HG GLN 42 HG2 GLN 42 -3.574 22.675 -21.034 309 2HG GLN 42 HG1 GLN 42 -2.779 22.895 -22.593 310 1HE2 GLN 42 HE21 GLN 42 -5.207 24.903 -20.996 311 2HE2 GLN 42 HE22 GLN 42 -4.225 26.323 -20.898 312 HA PRO 43 HA PRO 43 -7.943 18.858 -21.947 313 1HB PRO 43 HB1 PRO 43 -6.754 16.433 -21.713 314 2HB PRO 43 HB2 PRO 43 -7.398 17.040 -23.242 315 1HG PRO 43 HG2 PRO 43 -4.573 17.018 -22.250 316 2HG PRO 43 HG1 PRO 43 -5.195 16.624 -23.864 317 1HD PRO 43 HD2 PRO 43 -4.068 19.017 -23.274 318 2HD PRO 43 HD1 PRO 43 -5.361 18.839 -24.476 319 H ALA 44 HN ALA 44 -8.013 19.865 -19.941 320 HA ALA 44 HA ALA 44 -6.031 19.298 -17.923 321 1HB ALA 44 HB1 ALA 44 -7.585 20.652 -16.465 322 2HB ALA 44 HB2 ALA 44 -8.587 20.882 -17.897 323 3HB ALA 44 HB3 ALA 44 -6.929 21.485 -17.875 324 H VAL 45 HN VAL 45 -6.022 17.479 -16.794 325 HA VAL 45 HA VAL 45 -8.526 16.002 -16.413 326 HB VAL 45 HB VAL 45 -6.475 14.862 -17.368 327 1HG1 VAL 45 HG11 VAL 45 -5.520 15.260 -14.542 328 2HG1 VAL 45 HG12 VAL 45 -4.727 15.757 -16.036 329 3HG1 VAL 45 HG13 VAL 45 -4.849 14.045 -15.630 330 1HG2 VAL 45 HG21 VAL 45 -7.218 12.871 -16.595 331 2HG2 VAL 45 HG22 VAL 45 -8.504 13.875 -15.927 332 3HG2 VAL 45 HG23 VAL 45 -7.154 13.378 -14.906 333 H HIS 46 HN HIS 46 -9.019 15.090 -14.317 334 HA HIS 46 HA HIS 46 -8.540 16.980 -12.198 335 1HB HIS 46 HB2 HIS 46 -10.024 14.348 -12.064 336 2HB HIS 46 HB1 HIS 46 -10.137 15.684 -10.924 337 HD2 HIS 46 HD2 HIS 46 -11.120 18.141 -12.350 338 HE1 HIS 46 HE1 HIS 46 -13.608 15.689 -14.741 339 HE2 HIS 46 HE2 HIS 46 -13.157 18.058 -13.956 340 H VAL 47 HN VAL 47 -6.932 16.894 -10.790 341 HA VAL 47 HA VAL 47 -5.427 14.395 -10.495 342 HB VAL 47 HB VAL 47 -4.686 17.195 -9.633 343 1HG1 VAL 47 HG21 VAL 47 -3.752 15.139 -8.363 344 2HG1 VAL 47 HG22 VAL 47 -2.635 16.390 -8.910 345 3HG1 VAL 47 HG23 VAL 47 -2.790 14.886 -9.820 346 1HG2 VAL 47 HG11 VAL 47 -4.773 16.861 -12.086 347 2HG2 VAL 47 HG12 VAL 47 -3.606 15.550 -11.919 348 3HG2 VAL 47 HG13 VAL 47 -3.149 17.199 -11.490 349 H GLN 48 HN GLN 48 -5.553 13.216 -8.698 350 HA GLN 48 HA GLN 48 -7.114 14.244 -6.456 351 1HB GLN 48 HB2 GLN 48 -6.285 11.516 -7.373 352 2HB GLN 48 HB1 GLN 48 -6.744 11.758 -5.693 353 1HG GLN 48 HG2 GLN 48 -8.537 12.699 -7.887 354 2HG GLN 48 HG1 GLN 48 -8.516 10.998 -7.419 355 1HE2 GLN 48 HE21 GLN 48 -10.191 13.699 -7.010 356 2HE2 GLN 48 HE22 GLN 48 -10.787 13.476 -5.404 357 H GLY 49 HN GLY 49 -6.002 15.317 -4.957 358 1HA GLY 49 HA2 GLY 49 -3.202 14.722 -4.465 359 2HA GLY 49 HA1 GLY 49 -4.140 16.017 -3.735 360 H GLN 50 HN GLN 50 -4.871 12.555 -3.803 361 HA GLN 50 HA GLN 50 -5.120 12.599 -0.897 362 1HB GLN 50 HB2 GLN 50 -6.398 11.184 -3.042 363 2HB GLN 50 HB1 GLN 50 -5.702 10.022 -1.921 364 1HG GLN 50 HG2 GLN 50 -6.857 11.381 -0.088 365 2HG GLN 50 HG1 GLN 50 -7.779 12.114 -1.400 366 1HE2 GLN 50 HE22 GLN 50 -8.188 10.035 0.902 367 2HE2 GLN 50 HE21 GLN 50 -9.158 8.827 0.137 368 H GLU 51 HN GLU 51 -2.594 12.892 -1.175 369 HA GLU 51 HA GLU 51 -1.224 10.336 -1.427 370 1HB GLU 51 HB2 GLU 51 -0.343 13.193 -1.197 371 2HB GLU 51 HB1 GLU 51 0.795 11.898 -0.849 372 1HG GLU 51 HG2 GLU 51 0.230 10.963 -3.125 373 2HG GLU 51 HG1 GLU 51 -0.613 12.480 -3.436 374 HA PRO 52 HA PRO 52 -1.683 9.995 3.067 375 1HB PRO 52 HB1 PRO 52 -1.064 7.377 3.227 376 2HB PRO 52 HB2 PRO 52 -2.648 7.935 2.676 377 1HG PRO 52 HG1 PRO 52 -0.293 7.019 1.065 378 2HG PRO 52 HG2 PRO 52 -2.010 6.626 0.856 379 1HD PRO 52 HD2 PRO 52 -0.723 8.509 -0.631 380 2HD PRO 52 HD1 PRO 52 -2.453 8.594 -0.247 381 H LEU 53 HN LEU 53 -0.129 8.629 4.667 382 HA LEU 53 HA LEU 53 2.469 9.854 4.334 383 1HB LEU 53 HB2 LEU 53 0.920 9.360 6.515 384 2HB LEU 53 HB1 LEU 53 2.040 8.012 6.596 385 HG LEU 53 HG LEU 53 3.530 10.409 6.122 386 1HD1 LEU 53 HD21 LEU 53 1.202 10.792 7.770 387 2HD1 LEU 53 HD22 LEU 53 2.416 11.962 7.247 388 3HD1 LEU 53 HD23 LEU 53 2.682 11.006 8.706 389 1HD2 LEU 53 HD11 LEU 53 3.327 8.686 8.589 390 2HD2 LEU 53 HD12 LEU 53 4.664 9.749 8.142 391 3HD2 LEU 53 HD13 LEU 53 4.320 8.314 7.176 392 H THR 54 HN THR 54 4.453 8.740 4.426 393 HA THR 54 HA THR 54 4.632 5.909 4.352 394 HB THR 54 HB THR 54 5.765 6.561 1.833 395 HG1 THR 54 HG1 THR 54 4.078 8.288 2.032 396 1HG2 THR 54 HG21 THR 54 3.877 5.053 1.002 397 2HG2 THR 54 HG22 THR 54 3.467 4.861 2.706 398 3HG2 THR 54 HG23 THR 54 5.058 4.371 2.120 399 H ALA 55 HN ALA 55 7.028 5.541 3.099 400 HA ALA 55 HA ALA 55 8.854 6.441 4.979 401 1HB ALA 55 HB1 ALA 55 9.091 4.509 3.367 402 2HB ALA 55 HB2 ALA 55 10.542 5.469 3.661 403 3HB ALA 55 HB3 ALA 55 9.621 5.696 2.173 404 H SER 56 HN SER 56 7.818 7.903 1.972 405 HA SER 56 HA SER 56 9.912 9.798 1.731 406 1HB SER 56 HB1 SER 56 7.521 9.127 0.313 407 2HB SER 56 HB2 SER 56 7.520 10.865 0.612 408 HG SER 56 HG SER 56 8.637 10.047 -1.350 409 H MET 57 HN MET 57 6.609 10.052 3.035 410 HA MET 57 HA MET 57 6.733 12.718 3.872 411 1HB MET 57 HB1 MET 57 5.174 10.330 4.838 412 2HB MET 57 HB2 MET 57 5.020 11.891 5.630 413 1HG MET 57 HG1 MET 57 3.504 11.014 3.553 414 2HG MET 57 HG2 MET 57 3.709 12.698 4.027 415 1HE MET 57 HE1 MET 57 4.272 9.901 1.901 416 2HE MET 57 HE2 MET 57 5.658 10.252 0.868 417 3HE MET 57 HE3 MET 57 4.040 10.746 0.370 418 H LEU 58 HN LEU 58 7.792 9.743 5.356 419 HA LEU 58 HA LEU 58 8.449 10.798 7.908 420 1HB LEU 58 HB1 LEU 58 9.578 8.396 6.471 421 2HB LEU 58 HB2 LEU 58 9.697 8.713 8.190 422 HG LEU 58 HG LEU 58 7.017 8.468 6.869 423 1HD1 LEU 58 HD21 LEU 58 8.929 6.438 6.794 424 2HD1 LEU 58 HD22 LEU 58 7.190 6.282 6.532 425 3HD1 LEU 58 HD23 LEU 58 7.864 6.028 8.141 426 1HD2 LEU 58 HD11 LEU 58 7.623 9.247 9.328 427 2HD2 LEU 58 HD12 LEU 58 7.655 7.501 9.596 428 3HD2 LEU 58 HD13 LEU 58 6.193 8.270 8.974 429 H ALA 59 HN ALA 59 10.242 10.262 4.931 430 HA ALA 59 HA ALA 59 12.798 10.973 5.847 431 1HB ALA 59 HB1 ALA 59 13.244 11.459 3.407 432 2HB ALA 59 HB2 ALA 59 11.554 11.052 3.111 433 3HB ALA 59 HB3 ALA 59 12.647 9.842 3.779 434 H SER 60 HN SER 60 10.028 12.858 5.452 435 HA SER 60 HA SER 60 11.286 15.339 4.755 436 1HB SER 60 HB2 SER 60 8.561 14.760 5.957 437 2HB SER 60 HB1 SER 60 9.090 16.338 5.367 438 HG SER 60 HG SER 60 7.870 15.129 3.815 439 H ALA 61 HN ALA 61 11.094 13.495 7.571 440 HA ALA 61 HA ALA 61 12.137 15.723 9.160 441 1HB ALA 61 HB1 ALA 61 10.718 14.804 11.103 442 2HB ALA 61 HB2 ALA 61 9.753 14.028 9.846 443 3HB ALA 61 HB3 ALA 61 9.913 15.785 9.880 444 HA PRO 62 HA PRO 62 14.424 11.529 9.319 445 1HB PRO 62 HB2 PRO 62 16.668 13.471 9.064 446 2HB PRO 62 HB1 PRO 62 16.472 11.872 8.340 447 1HG PRO 62 HG1 PRO 62 16.109 14.078 6.889 448 2HG PRO 62 HG2 PRO 62 15.071 12.658 6.665 449 1HD PRO 62 HD2 PRO 62 14.487 15.240 8.042 450 2HD PRO 62 HD1 PRO 62 13.410 14.198 7.091 451 HA PRO 63 HA PRO 63 16.362 13.214 13.262 452 1HB PRO 63 HB1 PRO 63 17.076 15.755 13.578 453 2HB PRO 63 HB2 PRO 63 17.973 14.704 12.477 454 1HG PRO 63 HG1 PRO 63 16.021 16.863 11.870 455 2HG PRO 63 HG2 PRO 63 17.429 16.327 10.940 456 1HD PRO 63 HD2 PRO 63 14.708 15.602 10.527 457 2HD PRO 63 HD1 PRO 63 16.133 14.949 9.697 458 H GLN 64 HN GLN 64 13.442 13.858 12.408 459 HA GLN 64 HA GLN 64 12.717 15.117 14.958 460 1HB GLN 64 HB1 GLN 64 12.623 16.687 12.914 461 2HB GLN 64 HB2 GLN 64 11.213 15.754 12.434 462 1HG GLN 64 HG1 GLN 64 10.636 17.812 13.646 463 2HG GLN 64 HG2 GLN 64 10.062 16.354 14.457 464 1HE2 GLN 64 HE21 GLN 64 10.634 16.007 16.506 465 2HE2 GLN 64 HE22 GLN 64 11.765 16.960 17.398 466 H GLU 65 HN GLU 65 10.443 14.353 12.394 467 HA GLU 65 HA GLU 65 9.251 12.369 14.172 468 1HB GLU 65 HB2 GLU 65 7.156 12.969 13.240 469 2HB GLU 65 HB1 GLU 65 8.035 14.473 13.475 470 1HG GLU 65 HG2 GLU 65 8.676 13.691 10.901 471 2HG GLU 65 HG1 GLU 65 6.956 13.368 11.070 472 H GLN 66 HN GLN 66 11.454 11.767 12.317 473 HA GLN 66 HA GLN 66 10.460 10.361 10.063 474 1HB GLN 66 HB1 GLN 66 12.889 11.150 10.638 475 2HB GLN 66 HB2 GLN 66 13.010 9.593 11.444 476 1HG GLN 66 HG2 GLN 66 11.922 9.065 8.919 477 2HG GLN 66 HG1 GLN 66 13.224 10.226 8.658 478 1HE2 GLN 66 HE21 GLN 66 12.465 7.154 10.219 479 2HE2 GLN 66 HE22 GLN 66 14.049 6.482 10.072 480 H LYS 67 HN LYS 67 11.795 9.125 13.128 481 HA LYS 67 HA LYS 67 10.489 6.562 12.675 482 1HB LYS 67 HB2 LYS 67 11.723 5.848 14.704 483 2HB LYS 67 HB1 LYS 67 12.782 6.488 13.454 484 1HG LYS 67 HG2 LYS 67 12.875 8.630 14.650 485 2HG LYS 67 HG1 LYS 67 11.851 7.951 15.917 486 1HD LYS 67 HD2 LYS 67 13.549 6.810 16.843 487 2HD LYS 67 HD1 LYS 67 14.205 6.330 15.277 488 1HE LYS 67 HE2 LYS 67 14.595 8.959 16.694 489 2HE LYS 67 HE1 LYS 67 15.814 7.725 16.374 490 1HZ LYS 67 HZ1 LYS 67 14.493 9.535 14.445 491 2HZ LYS 67 HZ2 LYS 67 15.297 8.135 13.942 492 3HZ LYS 67 HZ3 LYS 67 16.146 9.353 14.753 493 H GLN 68 HN GLN 68 8.926 8.969 13.211 494 HA GLN 68 HA GLN 68 7.598 8.090 15.688 495 1HB GLN 68 HB2 GLN 68 8.683 10.240 16.068 496 2HB GLN 68 HB1 GLN 68 7.899 10.913 14.646 497 1HG GLN 68 HG1 GLN 68 5.976 9.799 16.495 498 2HG GLN 68 HG2 GLN 68 6.992 11.023 17.257 499 1HE2 GLN 68 HE21 GLN 68 6.773 13.135 16.689 500 2HE2 GLN 68 HE22 GLN 68 5.548 13.716 15.618 501 H MET 69 HN MET 69 7.156 9.736 12.571 502 HA MET 69 HA MET 69 4.311 9.535 12.636 503 1HB MET 69 HB1 MET 69 6.165 10.045 10.304 504 2HB MET 69 HB2 MET 69 4.418 10.246 10.286 505 1HG MET 69 HG1 MET 69 4.899 11.860 12.287 506 2HG MET 69 HG2 MET 69 6.516 11.924 11.578 507 1HE MET 69 HE1 MET 69 6.286 11.655 8.723 508 2HE MET 69 HE2 MET 69 7.026 13.193 9.166 509 3HE MET 69 HE3 MET 69 5.746 13.148 7.953 510 H LEU 70 HN LEU 70 6.694 7.246 12.059 511 HA LEU 70 HA LEU 70 5.708 5.807 9.900 512 1HB LEU 70 HB1 LEU 70 6.659 3.833 11.578 513 2HB LEU 70 HB2 LEU 70 7.586 4.713 10.385 514 HG LEU 70 HG LEU 70 8.363 6.273 12.093 515 1HD1 LEU 70 HD21 LEU 70 7.776 6.165 14.357 516 2HD1 LEU 70 HD22 LEU 70 7.004 4.590 14.174 517 3HD1 LEU 70 HD23 LEU 70 6.243 6.030 13.496 518 1HD2 LEU 70 HD11 LEU 70 8.680 3.425 13.015 519 2HD2 LEU 70 HD12 LEU 70 9.790 4.765 13.300 520 3HD2 LEU 70 HD13 LEU 70 9.559 4.144 11.666 521 H GLY 71 HN GLY 71 4.995 5.302 13.357 522 1HA GLY 71 HA2 GLY 71 2.563 3.889 12.491 523 2HA GLY 71 HA1 GLY 71 3.511 3.347 13.864 524 H GLU 72 HN GLU 72 3.111 6.748 13.315 525 HA GLU 72 HA GLU 72 0.973 6.873 15.315 526 1HB GLU 72 HB1 GLU 72 3.524 8.495 15.427 527 2HB GLU 72 HB2 GLU 72 2.141 8.697 16.494 528 1HG GLU 72 HG1 GLU 72 2.894 5.973 16.583 529 2HG GLU 72 HG2 GLU 72 4.356 6.943 16.756 530 H ARG 73 HN ARG 73 1.919 7.691 12.305 531 HA ARG 73 HA ARG 73 0.251 10.114 12.325 532 1HB ARG 73 HB1 ARG 73 2.893 10.110 11.724 533 2HB ARG 73 HB2 ARG 73 2.205 9.808 10.136 534 1HG ARG 73 HG2 ARG 73 2.470 12.145 10.324 535 2HG ARG 73 HG1 ARG 73 0.744 11.827 10.513 536 1HD ARG 73 HD1 ARG 73 0.867 12.110 12.868 537 2HD ARG 73 HD2 ARG 73 2.629 12.128 12.839 538 HE ARG 73 HE ARG 73 2.460 14.284 11.671 539 1HH1 ARG 73 HH11 ARG 73 -0.311 13.129 13.443 540 2HH1 ARG 73 HH12 ARG 73 -0.982 14.708 13.673 541 1HH2 ARG 73 HH22 ARG 73 1.582 16.366 11.969 542 2HH2 ARG 73 HH21 ARG 73 0.093 16.549 12.835 543 H LEU 74 HN LEU 74 1.220 7.167 10.643 544 HA LEU 74 HA LEU 74 -0.377 7.363 8.375 545 1HB LEU 74 HB1 LEU 74 0.854 5.224 10.018 546 2HB LEU 74 HB2 LEU 74 -0.410 4.733 8.916 547 HG LEU 74 HG LEU 74 1.605 4.393 7.812 548 1HD1 LEU 74 HD21 LEU 74 0.435 5.155 6.059 549 2HD1 LEU 74 HD22 LEU 74 1.516 6.546 6.161 550 3HD1 LEU 74 HD23 LEU 74 -0.076 6.609 6.919 551 1HD2 LEU 74 HD11 LEU 74 2.713 7.058 7.804 552 2HD2 LEU 74 HD12 LEU 74 3.490 5.498 8.101 553 3HD2 LEU 74 HD13 LEU 74 2.643 6.332 9.411 554 H PHE 75 HN PHE 75 -1.059 6.281 11.635 555 HA PHE 75 HA PHE 75 -3.186 4.809 11.688 556 1HB PHE 75 HB1 PHE 75 -2.107 6.303 13.553 557 2HB PHE 75 HB2 PHE 75 -3.516 7.317 13.272 558 HD1 PHE 75 HD1 PHE 75 -4.508 7.016 15.403 559 HD2 PHE 75 HD2 PHE 75 -3.533 3.637 13.000 560 HE1 PHE 75 HE1 PHE 75 -5.822 5.577 16.902 561 HE2 PHE 75 HE2 PHE 75 -4.845 2.193 14.502 562 HZ PHE 75 HZ PHE 75 -5.992 3.162 16.452 563 HA PRO 76 HA PRO 76 -6.629 7.984 10.627 564 1HB PRO 76 HB2 PRO 76 -5.278 10.392 9.630 565 2HB PRO 76 HB1 PRO 76 -6.548 10.243 10.848 566 1HG PRO 76 HG1 PRO 76 -4.027 10.906 11.505 567 2HG PRO 76 HG2 PRO 76 -5.044 9.915 12.568 568 1HD PRO 76 HD1 PRO 76 -2.874 9.058 10.685 569 2HD PRO 76 HD2 PRO 76 -3.199 8.516 12.345 570 H LEU 77 HN LEU 77 -3.691 8.143 8.707 571 HA LEU 77 HA LEU 77 -5.093 8.393 6.211 572 1HB LEU 77 HB1 LEU 77 -2.197 7.898 6.885 573 2HB LEU 77 HB2 LEU 77 -2.795 8.073 5.246 574 HG LEU 77 HG LEU 77 -3.053 10.194 7.380 575 1HD1 LEU 77 HD11 LEU 77 -1.130 11.186 6.671 576 2HD1 LEU 77 HD12 LEU 77 -1.229 10.483 5.057 577 3HD1 LEU 77 HD13 LEU 77 -0.696 9.495 6.417 578 1HD2 LEU 77 HD21 LEU 77 -3.295 11.507 5.081 579 2HD2 LEU 77 HD22 LEU 77 -4.675 10.796 5.917 580 3HD2 LEU 77 HD23 LEU 77 -3.928 9.945 4.564 581 H ILE 78 HN ILE 78 -4.201 5.766 8.223 582 HA ILE 78 HA ILE 78 -3.921 3.799 6.153 583 HB ILE 78 HB ILE 78 -4.634 3.308 9.030 584 1HG1 ILE 78 HG12 ILE 78 -2.483 4.618 8.635 585 2HG1 ILE 78 HG11 ILE 78 -2.321 3.116 9.540 586 1HG2 ILE 78 HG21 ILE 78 -4.259 1.611 6.733 587 2HG2 ILE 78 HG22 ILE 78 -4.851 1.207 8.346 588 3HG2 ILE 78 HG23 ILE 78 -3.118 1.206 8.019 589 1HD1 ILE 78 HD11 ILE 78 -1.958 2.903 6.630 590 2HD1 ILE 78 HD12 ILE 78 -1.072 2.143 7.952 591 3HD1 ILE 78 HD13 ILE 78 -0.728 3.813 7.505 592 H GLN 79 HN GLN 79 -6.492 4.868 8.325 593 HA GLN 79 HA GLN 79 -8.511 3.074 7.680 594 1HB GLN 79 HB1 GLN 79 -8.382 5.883 8.624 595 2HB GLN 79 HB2 GLN 79 -9.908 5.386 7.911 596 1HG GLN 79 HG2 GLN 79 -10.036 3.531 9.508 597 2HG GLN 79 HG1 GLN 79 -8.515 4.059 10.228 598 1HE2 GLN 79 HE22 GLN 79 -8.485 6.279 11.089 599 2HE2 GLN 79 HE21 GLN 79 -9.918 6.883 11.844 600 H ALA 80 HN ALA 80 -6.969 5.414 5.770 601 HA ALA 80 HA ALA 80 -9.047 5.753 3.803 602 1HB ALA 80 HB1 ALA 80 -7.444 7.077 2.604 603 2HB ALA 80 HB2 ALA 80 -6.119 6.444 3.587 604 3HB ALA 80 HB3 ALA 80 -7.338 7.492 4.315 605 H MET 81 HN MET 81 -6.065 3.878 4.148 606 HA MET 81 HA MET 81 -6.119 2.801 1.500 607 1HB MET 81 HB1 MET 81 -4.782 1.374 3.765 608 2HB MET 81 HB2 MET 81 -4.236 1.586 2.107 609 1HG MET 81 HG1 MET 81 -4.356 4.155 3.199 610 2HG MET 81 HG2 MET 81 -3.641 3.137 4.441 611 1HE MET 81 HE1 MET 81 -1.610 1.591 4.075 612 2HE MET 81 HE2 MET 81 -1.079 3.198 4.586 613 3HE MET 81 HE3 MET 81 -0.211 2.346 3.307 614 H HIS 82 HN HIS 82 -6.952 1.493 4.686 615 HA HIS 82 HA HIS 82 -8.470 -0.656 3.368 616 1HB HIS 82 HB1 HIS 82 -6.905 -0.470 5.886 617 2HB HIS 82 HB2 HIS 82 -8.364 -1.452 5.938 618 HD2 HIS 82 HD2 HIS 82 -5.473 -1.285 3.240 619 HE1 HIS 82 HE1 HIS 82 -6.198 -5.290 4.389 620 HE2 HIS 82 HE2 HIS 82 -4.833 -3.771 2.881 621 HA PRO 83 HA PRO 83 -12.311 1.015 4.795 622 1HB PRO 83 HB2 PRO 83 -13.617 -1.259 5.612 623 2HB PRO 83 HB1 PRO 83 -13.475 -0.746 3.927 624 1HG PRO 83 HG2 PRO 83 -11.872 -2.771 5.437 625 2HG PRO 83 HG1 PRO 83 -12.489 -2.840 3.776 626 1HD PRO 83 HD2 PRO 83 -9.916 -2.262 4.311 627 2HD PRO 83 HD1 PRO 83 -10.780 -1.513 2.953 628 H THR 84 HN THR 84 -11.136 2.038 6.585 629 HA THR 84 HA THR 84 -10.599 2.441 8.763 630 HB THR 84 HB THR 84 -13.060 2.918 8.569 631 HG1 THR 84 HG1 THR 84 -11.558 2.921 10.637 632 1HG2 THR 84 HG21 THR 84 -13.824 0.555 8.399 633 2HG2 THR 84 HG22 THR 84 -14.676 1.527 9.599 634 3HG2 THR 84 HG23 THR 84 -13.445 0.374 10.113 635 H LEU 85 HN LEU 85 -9.732 -0.152 7.881 636 HA LEU 85 HA LEU 85 -10.175 -1.955 10.112 637 1HB LEU 85 HB1 LEU 85 -9.214 -2.141 7.399 638 2HB LEU 85 HB2 LEU 85 -8.098 -2.928 8.495 639 HG LEU 85 HG LEU 85 -9.905 -4.352 9.341 640 1HD1 LEU 85 HD21 LEU 85 -12.094 -4.355 8.317 641 2HD1 LEU 85 HD22 LEU 85 -11.628 -3.029 7.251 642 3HD1 LEU 85 HD23 LEU 85 -11.752 -2.761 8.989 643 1HD2 LEU 85 HD11 LEU 85 -10.410 -5.512 7.094 644 2HD2 LEU 85 HD12 LEU 85 -8.734 -5.393 7.631 645 3HD2 LEU 85 HD13 LEU 85 -9.349 -4.286 6.402 646 H ALA 86 HN ALA 86 -8.502 0.717 9.937 647 HA ALA 86 HA ALA 86 -5.870 -0.073 10.746 648 1HB ALA 86 HB1 ALA 86 -5.677 2.387 11.346 649 2HB ALA 86 HB2 ALA 86 -7.317 2.562 10.720 650 3HB ALA 86 HB3 ALA 86 -6.023 2.005 9.659 651 H GLY 87 HN GLY 87 -7.765 -1.363 12.387 652 1HA GLY 87 HA1 GLY 87 -8.006 0.009 14.896 653 2HA GLY 87 HA2 GLY 87 -8.344 -1.691 14.600 654 H LYS 88 HN LYS 88 -5.480 -1.577 13.325 655 HA LYS 88 HA LYS 88 -3.620 -1.155 15.368 656 1HB LYS 88 HB1 LYS 88 -4.853 -3.058 16.428 657 2HB LYS 88 HB2 LYS 88 -4.388 -4.065 15.069 658 1HG LYS 88 HG1 LYS 88 -1.970 -3.212 15.777 659 2HG LYS 88 HG2 LYS 88 -2.776 -3.092 17.347 660 1HD LYS 88 HD2 LYS 88 -2.193 -5.263 17.522 661 2HD LYS 88 HD1 LYS 88 -3.626 -5.526 16.524 662 1HE LYS 88 HE2 LYS 88 -2.184 -5.401 14.509 663 2HE LYS 88 HE1 LYS 88 -0.778 -5.272 15.562 664 1HZ LYS 88 HZ1 LYS 88 -0.759 -7.492 15.329 665 2HZ LYS 88 HZ2 LYS 88 -2.395 -7.590 14.911 666 3HZ LYS 88 HZ3 LYS 88 -1.943 -7.464 16.536 667 H ILE 89 HN ILE 89 -3.900 -0.818 12.509 668 HA ILE 89 HA ILE 89 -2.174 -2.762 11.284 669 HB ILE 89 HB ILE 89 -3.127 -0.142 10.151 670 1HG1 ILE 89 HG12 ILE 89 -4.212 -2.929 9.680 671 2HG1 ILE 89 HG11 ILE 89 -4.929 -1.786 10.811 672 1HG2 ILE 89 HG21 ILE 89 -1.823 -0.594 8.412 673 2HG2 ILE 89 HG22 ILE 89 -2.579 -2.178 8.226 674 3HG2 ILE 89 HG23 ILE 89 -1.176 -1.987 9.283 675 1HD1 ILE 89 HD11 ILE 89 -4.579 -1.228 7.883 676 2HD1 ILE 89 HD12 ILE 89 -5.511 -0.298 9.057 677 3HD1 ILE 89 HD13 ILE 89 -6.040 -1.916 8.591 678 H THR 90 HN THR 90 -1.700 0.646 10.701 679 HA THR 90 HA THR 90 1.058 0.607 10.622 680 HB THR 90 HB THR 90 -1.033 2.553 10.591 681 HG1 THR 90 HG1 THR 90 1.422 2.076 9.491 682 1HG2 THR 90 HG21 THR 90 -0.499 3.776 12.406 683 2HG2 THR 90 HG22 THR 90 0.706 4.428 11.294 684 3HG2 THR 90 HG23 THR 90 1.161 3.185 12.458 685 H GLY 91 HN GLY 91 -1.060 1.161 13.412 686 1HA GLY 91 HA2 GLY 91 0.872 1.956 15.276 687 2HA GLY 91 HA1 GLY 91 -0.608 1.085 15.666 688 H MET 92 HN MET 92 0.063 -1.159 13.951 689 HA MET 92 HA MET 92 1.753 -2.598 15.817 690 1HB MET 92 HB2 MET 92 0.323 -4.208 15.215 691 2HB MET 92 HB1 MET 92 -0.248 -3.283 13.834 692 1HG MET 92 HG2 MET 92 1.095 -4.365 12.381 693 2HG MET 92 HG1 MET 92 2.388 -4.575 13.557 694 1HE MET 92 HE1 MET 92 -1.382 -6.029 12.803 695 2HE MET 92 HE2 MET 92 -0.658 -7.525 12.207 696 3HE MET 92 HE3 MET 92 -0.163 -5.974 11.527 697 H LEU 93 HN LEU 93 2.002 -1.093 12.722 698 HA LEU 93 HA LEU 93 4.216 -2.444 11.661 699 1HB LEU 93 HB2 LEU 93 2.999 0.232 11.299 700 2HB LEU 93 HB1 LEU 93 4.608 -0.016 10.661 701 HG LEU 93 HG LEU 93 2.838 -0.364 8.965 702 1HD1 LEU 93 HD11 LEU 93 4.843 -2.364 9.741 703 2HD1 LEU 93 HD12 LEU 93 4.576 -1.560 8.193 704 3HD1 LEU 93 HD13 LEU 93 3.590 -2.951 8.646 705 1HD2 LEU 93 HD21 LEU 93 2.041 -2.930 10.207 706 2HD2 LEU 93 HD22 LEU 93 1.125 -1.827 9.177 707 3HD2 LEU 93 HD23 LEU 93 1.358 -1.454 10.888 708 H LEU 94 HN LEU 94 3.977 -0.717 14.478 709 HA LEU 94 HA LEU 94 6.835 -0.030 14.485 710 1HB LEU 94 HB1 LEU 94 4.448 1.126 15.767 711 2HB LEU 94 HB2 LEU 94 5.840 0.972 16.820 712 HG LEU 94 HG LEU 94 5.544 3.193 15.603 713 1HD1 LEU 94 HD21 LEU 94 8.196 2.384 14.775 714 2HD1 LEU 94 HD22 LEU 94 7.800 1.792 16.388 715 3HD1 LEU 94 HD23 LEU 94 7.701 3.516 16.033 716 1HD2 LEU 94 HD11 LEU 94 6.493 1.516 13.283 717 2HD2 LEU 94 HD12 LEU 94 6.413 3.277 13.308 718 3HD2 LEU 94 HD13 LEU 94 4.933 2.326 13.421 719 H GLU 95 HN GLU 95 5.600 -2.673 14.673 720 HA GLU 95 HA GLU 95 7.083 -3.709 16.863 721 1HB GLU 95 HB2 GLU 95 5.389 -4.424 18.329 722 2HB GLU 95 HB1 GLU 95 4.969 -2.761 17.949 723 1HG GLU 95 HG1 GLU 95 3.241 -3.445 16.471 724 2HG GLU 95 HG2 GLU 95 3.773 -5.125 16.531 725 H ILE 96 HN ILE 96 5.693 -4.006 13.902 726 HA ILE 96 HA ILE 96 4.850 -6.680 13.784 727 HB ILE 96 HB ILE 96 5.231 -6.626 11.402 728 1HG1 ILE 96 HG12 ILE 96 7.440 -5.589 11.385 729 2HG1 ILE 96 HG11 ILE 96 6.342 -4.772 10.282 730 1HG2 ILE 96 HG21 ILE 96 4.117 -4.357 10.880 731 2HG2 ILE 96 HG22 ILE 96 4.035 -4.195 12.634 732 3HG2 ILE 96 HG23 ILE 96 3.246 -5.559 11.838 733 1HD1 ILE 96 HD11 ILE 96 6.858 -2.860 11.229 734 2HD1 ILE 96 HD12 ILE 96 7.873 -3.692 12.407 735 3HD1 ILE 96 HD13 ILE 96 6.160 -3.438 12.743 736 H ASP 97 HN ASP 97 6.513 -7.576 11.580 737 HA ASP 97 HA ASP 97 8.357 -9.210 12.894 738 1HB ASP 97 HB1 ASP 97 7.234 -9.242 10.474 739 2HB ASP 97 HB2 ASP 97 8.769 -8.504 10.022 740 H ASN 98 HN ASN 98 8.527 -5.967 12.454 741 HA ASN 98 HA ASN 98 10.133 -4.455 12.933 742 1HB ASN 98 HB1 ASN 98 11.912 -6.878 13.164 743 2HB ASN 98 HB2 ASN 98 12.492 -5.234 13.406 744 1HD2 ASN 98 HD21 ASN 98 10.491 -4.062 14.776 745 2HD2 ASN 98 HD22 ASN 98 10.273 -4.833 16.307 746 H SER 99 HN SER 99 10.658 -6.826 10.456 747 HA SER 99 HA SER 99 12.556 -5.269 8.972 748 1HB SER 99 HB1 SER 99 10.803 -7.411 7.782 749 2HB SER 99 HB2 SER 99 12.441 -6.943 7.322 750 HG SER 99 HG SER 99 11.840 -8.912 8.845 751 H GLU 100 HN GLU 100 9.117 -5.479 9.234 752 HA GLU 100 HA GLU 100 8.563 -3.975 6.832 753 1HB GLU 100 HB1 GLU 100 6.560 -4.282 9.010 754 2HB GLU 100 HB2 GLU 100 6.339 -4.333 7.269 755 1HG GLU 100 HG1 GLU 100 7.960 -6.509 7.819 756 2HG GLU 100 HG2 GLU 100 6.782 -6.487 9.130 757 H LEU 101 HN LEU 101 9.297 -3.354 10.125 758 HA LEU 101 HA LEU 101 8.247 -0.678 10.203 759 1HB LEU 101 HB1 LEU 101 8.458 -1.712 12.308 760 2HB LEU 101 HB2 LEU 101 10.078 -2.283 11.964 761 HG LEU 101 HG LEU 101 9.860 0.635 11.955 762 1HD1 LEU 101 HD11 LEU 101 8.179 0.092 13.679 763 2HD1 LEU 101 HD12 LEU 101 9.600 0.908 14.335 764 3HD1 LEU 101 HD13 LEU 101 9.406 -0.833 14.546 765 1HD2 LEU 101 HD21 LEU 101 12.033 0.110 12.094 766 2HD2 LEU 101 HD22 LEU 101 11.707 -1.489 12.762 767 3HD2 LEU 101 HD23 LEU 101 11.711 -0.076 13.818 768 H LEU 102 HN LEU 102 11.112 -2.256 9.126 769 HA LEU 102 HA LEU 102 12.690 0.184 9.003 770 1HB LEU 102 HB2 LEU 102 13.173 -2.704 8.720 771 2HB LEU 102 HB1 LEU 102 14.109 -1.702 7.628 772 HG LEU 102 HG LEU 102 14.725 -0.369 9.785 773 1HD1 LEU 102 HD21 LEU 102 14.405 -2.982 11.155 774 2HD1 LEU 102 HD22 LEU 102 12.992 -1.936 11.020 775 3HD1 LEU 102 HD23 LEU 102 14.450 -1.350 11.822 776 1HD2 LEU 102 HD11 LEU 102 15.799 -2.896 8.697 777 2HD2 LEU 102 HD12 LEU 102 16.417 -2.386 10.267 778 3HD2 LEU 102 HD13 LEU 102 16.563 -1.317 8.873 779 H HIS 103 HN HIS 103 11.229 -2.149 6.766 780 HA HIS 103 HA HIS 103 12.111 -0.923 4.398 781 1HB HIS 103 HB1 HIS 103 10.743 -3.210 5.007 782 2HB HIS 103 HB2 HIS 103 9.471 -2.229 4.291 783 HD2 HIS 103 HD2 HIS 103 9.260 -3.225 1.806 784 HE1 HIS 103 HE1 HIS 103 13.387 -3.187 0.868 785 HE2 HIS 103 HE2 HIS 103 11.054 -3.628 -0.024 786 H MET 104 HN MET 104 9.103 -0.555 6.252 787 HA MET 104 HA MET 104 7.729 1.163 4.565 788 1HB MET 104 HB2 MET 104 6.518 1.923 6.574 789 2HB MET 104 HB1 MET 104 6.726 0.168 6.575 790 1HG MET 104 HG1 MET 104 8.034 0.196 8.391 791 2HG MET 104 HG2 MET 104 8.852 1.675 7.901 792 1HE MET 104 HE1 MET 104 4.700 1.395 9.727 793 2HE MET 104 HE2 MET 104 5.398 0.461 8.399 794 3HE MET 104 HE3 MET 104 4.783 2.092 8.108 795 H LEU 105 HN LEU 105 10.363 1.866 6.771 796 HA LEU 105 HA LEU 105 10.069 4.732 6.485 797 1HB LEU 105 HB1 LEU 105 12.307 3.140 7.738 798 2HB LEU 105 HB2 LEU 105 12.043 4.864 7.906 799 HG LEU 105 HG LEU 105 10.170 2.728 8.920 800 1HD1 LEU 105 HD11 LEU 105 10.971 3.545 11.157 801 2HD1 LEU 105 HD12 LEU 105 12.274 4.374 10.305 802 3HD1 LEU 105 HD13 LEU 105 12.146 2.617 10.226 803 1HD2 LEU 105 HD21 LEU 105 10.176 5.726 9.076 804 2HD2 LEU 105 HD22 LEU 105 9.253 4.715 10.191 805 3HD2 LEU 105 HD23 LEU 105 8.915 4.657 8.460 806 H GLU 106 HN GLU 106 11.498 2.235 4.745 807 HA GLU 106 HA GLU 106 13.486 4.038 3.584 808 1HB GLU 106 HB1 GLU 106 14.879 2.250 3.301 809 2HB GLU 106 HB2 GLU 106 13.919 1.624 4.638 810 1HG GLU 106 HG2 GLU 106 12.515 0.401 3.054 811 2HG GLU 106 HG1 GLU 106 13.496 1.009 1.722 812 H SER 107 HN SER 107 10.444 2.829 2.845 813 HA SER 107 HA SER 107 10.855 3.500 0.029 814 1HB SER 107 HB2 SER 107 10.965 0.899 0.698 815 2HB SER 107 HB1 SER 107 9.223 1.075 0.510 816 HG SER 107 HG SER 107 10.280 0.495 -1.453 817 HA PRO 108 HA PRO 108 6.882 5.391 0.659 818 1HB PRO 108 HB1 PRO 108 6.337 6.098 -1.874 819 2HB PRO 108 HB2 PRO 108 7.613 6.892 -0.943 820 1HG PRO 108 HG1 PRO 108 7.835 4.734 -3.010 821 2HG PRO 108 HG2 PRO 108 8.832 6.185 -2.799 822 1HD PRO 108 HD2 PRO 108 9.574 3.703 -1.927 823 2HD PRO 108 HD1 PRO 108 10.117 5.212 -1.168 824 H GLU 109 HN GLU 109 7.386 2.424 -0.632 825 HA GLU 109 HA GLU 109 4.516 1.995 -1.173 826 1HB GLU 109 HB2 GLU 109 6.876 0.552 -2.403 827 2HB GLU 109 HB1 GLU 109 5.183 0.184 -2.708 828 1HG GLU 109 HG1 GLU 109 4.857 2.327 -3.755 829 2HG GLU 109 HG2 GLU 109 6.503 2.811 -3.346 830 H SER 110 HN SER 110 7.341 1.075 0.549 831 HA SER 110 HA SER 110 6.575 -1.521 1.389 832 1HB SER 110 HB2 SER 110 8.099 -0.812 3.429 833 2HB SER 110 HB1 SER 110 8.830 -1.045 1.832 834 HG SER 110 HG SER 110 7.969 1.424 2.936 835 H LEU 111 HN LEU 111 6.456 1.603 3.019 836 HA LEU 111 HA LEU 111 5.141 0.850 5.300 837 1HB LEU 111 HB1 LEU 111 6.129 3.062 4.887 838 2HB LEU 111 HB2 LEU 111 4.816 3.435 3.786 839 HG LEU 111 HG LEU 111 3.987 2.612 6.485 840 1HD1 LEU 111 HD11 LEU 111 6.063 4.544 6.179 841 2HD1 LEU 111 HD12 LEU 111 5.224 4.019 7.649 842 3HD1 LEU 111 HD13 LEU 111 4.580 5.357 6.697 843 1HD2 LEU 111 HD21 LEU 111 3.200 5.088 5.015 844 2HD2 LEU 111 HD22 LEU 111 2.247 4.075 6.099 845 3HD2 LEU 111 HD23 LEU 111 2.628 3.509 4.472 846 H ARG 112 HN ARG 112 3.819 1.295 2.108 847 HA ARG 112 HA ARG 112 1.095 1.227 3.110 848 1HB ARG 112 HB2 ARG 112 0.997 2.601 1.319 849 2HB ARG 112 HB1 ARG 112 2.407 1.881 0.553 850 1HG ARG 112 HG1 ARG 112 1.076 0.073 -0.302 851 2HG ARG 112 HG2 ARG 112 -0.343 0.654 0.573 852 1HD ARG 112 HD2 ARG 112 -0.309 2.717 -0.736 853 2HD ARG 112 HD1 ARG 112 1.106 2.140 -1.615 854 HE ARG 112 HE ARG 112 -0.264 0.824 -2.892 855 1HH1 ARG 112 HH21 ARG 112 -2.015 1.888 -0.074 856 2HH1 ARG 112 HH22 ARG 112 -3.535 1.271 -0.626 857 1HH2 ARG 112 HH11 ARG 112 -2.262 0.007 -3.627 858 2HH2 ARG 112 HH12 ARG 112 -3.676 0.202 -2.645 859 H SER 113 HN SER 113 2.918 -0.685 0.706 860 HA SER 113 HA SER 113 1.115 -2.777 0.480 861 1HB SER 113 HB1 SER 113 4.118 -2.719 0.147 862 2HB SER 113 HB2 SER 113 3.138 -4.132 -0.246 863 HG SER 113 HG SER 113 2.465 -3.174 -1.996 864 H LYS 114 HN LYS 114 3.602 -2.215 2.881 865 HA LYS 114 HA LYS 114 3.339 -4.837 4.054 866 1HB LYS 114 HB1 LYS 114 4.736 -2.385 5.135 867 2HB LYS 114 HB2 LYS 114 4.882 -4.021 5.765 868 1HG LYS 114 HG2 LYS 114 5.614 -4.526 3.276 869 2HG LYS 114 HG1 LYS 114 6.039 -2.814 3.319 870 1HD LYS 114 HD1 LYS 114 7.705 -3.127 4.847 871 2HD LYS 114 HD2 LYS 114 6.902 -4.506 5.600 872 1HE LYS 114 HE1 LYS 114 8.561 -4.419 3.107 873 2HE LYS 114 HE2 LYS 114 8.744 -5.450 4.525 874 1HZ LYS 114 HZ1 LYS 114 6.327 -6.182 3.682 875 2HZ LYS 114 HZ2 LYS 114 7.756 -6.949 3.197 876 3HZ LYS 114 HZ3 LYS 114 7.042 -5.784 2.201 877 H VAL 115 HN VAL 115 2.045 -1.619 4.582 878 HA VAL 115 HA VAL 115 0.930 -2.157 7.152 879 HB VAL 115 HB VAL 115 0.767 0.036 5.216 880 1HG1 VAL 115 HG11 VAL 115 -1.668 -0.777 6.767 881 2HG1 VAL 115 HG12 VAL 115 -1.547 -0.270 5.082 882 3HG1 VAL 115 HG13 VAL 115 -1.354 0.912 6.377 883 1HG2 VAL 115 HG21 VAL 115 0.173 0.715 7.936 884 2HG2 VAL 115 HG22 VAL 115 1.593 1.110 6.964 885 3HG2 VAL 115 HG23 VAL 115 1.536 -0.404 7.870 886 H ASP 116 HN ASP 116 -0.501 -2.075 3.887 887 HA ASP 116 HA ASP 116 -3.019 -3.047 4.548 888 1HB ASP 116 HB1 ASP 116 -3.195 -2.516 2.373 889 2HB ASP 116 HB2 ASP 116 -1.457 -2.648 2.135 890 H GLU 117 HN GLU 117 0.006 -4.723 3.972 891 HA GLU 117 HA GLU 117 -1.153 -7.357 3.990 892 1HB GLU 117 HB1 GLU 117 1.608 -6.221 3.933 893 2HB GLU 117 HB2 GLU 117 1.412 -7.881 4.479 894 1HG GLU 117 HG2 GLU 117 -0.088 -7.459 2.074 895 2HG GLU 117 HG1 GLU 117 1.583 -6.942 1.847 896 H ALA 118 HN ALA 118 0.133 -5.110 6.309 897 HA ALA 118 HA ALA 118 0.369 -6.986 8.458 898 1HB ALA 118 HB1 ALA 118 -0.032 -4.071 8.937 899 2HB ALA 118 HB2 ALA 118 1.470 -4.636 8.204 900 3HB ALA 118 HB3 ALA 118 0.989 -5.225 9.797 901 H VAL 119 HN VAL 119 -2.175 -5.327 6.912 902 HA VAL 119 HA VAL 119 -4.051 -5.261 9.059 903 HB VAL 119 HB VAL 119 -4.711 -5.480 6.139 904 1HG1 VAL 119 HG11 VAL 119 -6.171 -4.307 8.501 905 2HG1 VAL 119 HG12 VAL 119 -6.569 -5.806 7.658 906 3HG1 VAL 119 HG13 VAL 119 -6.727 -4.254 6.829 907 1HG2 VAL 119 HG21 VAL 119 -3.215 -3.674 6.212 908 2HG2 VAL 119 HG22 VAL 119 -3.849 -3.101 7.753 909 3HG2 VAL 119 HG23 VAL 119 -4.818 -2.942 6.288 910 H ALA 120 HN ALA 120 -3.443 -7.438 6.354 911 HA ALA 120 HA ALA 120 -5.405 -9.353 6.936 912 1HB ALA 120 HB1 ALA 120 -3.003 -10.530 5.843 913 2HB ALA 120 HB2 ALA 120 -3.371 -9.000 5.042 914 3HB ALA 120 HB3 ALA 120 -4.576 -10.292 5.080 915 H VAL 121 HN VAL 121 -2.311 -8.648 8.279 916 HA VAL 121 HA VAL 121 -2.085 -11.121 9.761 917 HB VAL 121 HB VAL 121 -0.419 -8.636 9.514 918 1HG1 VAL 121 HG21 VAL 121 -0.605 -10.281 11.858 919 2HG1 VAL 121 HG22 VAL 121 0.355 -8.827 11.576 920 3HG1 VAL 121 HG23 VAL 121 0.999 -10.411 11.137 921 1HG2 VAL 121 HG11 VAL 121 1.173 -10.029 8.539 922 2HG2 VAL 121 HG12 VAL 121 -0.358 -10.644 7.915 923 3HG2 VAL 121 HG13 VAL 121 0.462 -11.486 9.232 924 H LEU 122 HN LEU 122 -3.119 -7.825 10.247 925 HA LEU 122 HA LEU 122 -3.224 -7.901 13.096 926 1HB LEU 122 HB2 LEU 122 -3.496 -5.722 12.760 927 2HB LEU 122 HB1 LEU 122 -3.672 -5.993 11.039 928 HG LEU 122 HG LEU 122 -6.180 -6.607 11.942 929 1HD1 LEU 122 HD11 LEU 122 -5.270 -4.237 13.557 930 2HD1 LEU 122 HD12 LEU 122 -5.489 -5.856 14.222 931 3HD1 LEU 122 HD13 LEU 122 -6.868 -4.986 13.548 932 1HD2 LEU 122 HD21 LEU 122 -4.878 -4.281 10.688 933 2HD2 LEU 122 HD22 LEU 122 -6.486 -4.007 11.357 934 3HD2 LEU 122 HD23 LEU 122 -6.239 -5.259 10.138 935 H GLN 123 HN GLN 123 -5.516 -8.471 10.488 936 HA GLN 123 HA GLN 123 -7.781 -8.920 12.135 937 1HB GLN 123 HB1 GLN 123 -7.158 -9.703 9.282 938 2HB GLN 123 HB2 GLN 123 -8.720 -9.973 10.044 939 1HG GLN 123 HG2 GLN 123 -7.882 -7.242 10.370 940 2HG GLN 123 HG1 GLN 123 -7.861 -7.706 8.670 941 1HE2 GLN 123 HE22 GLN 123 -9.795 -8.445 7.707 942 2HE2 GLN 123 HE21 GLN 123 -11.335 -8.032 8.371 943 H ALA 124 HN ALA 124 -5.130 -10.870 11.037 944 HA ALA 124 HA ALA 124 -6.371 -13.376 11.818 945 1HB ALA 124 HB1 ALA 124 -3.555 -12.791 10.905 946 2HB ALA 124 HB2 ALA 124 -4.890 -13.314 9.875 947 3HB ALA 124 HB3 ALA 124 -4.263 -14.393 11.122 948 H HIS 125 HN HIS 125 -4.675 -10.878 13.324 949 HA HIS 125 HA HIS 125 -3.891 -12.650 15.543 950 1HB HIS 125 HB1 HIS 125 -2.407 -10.650 14.143 951 2HB HIS 125 HB2 HIS 125 -2.636 -10.109 15.802 952 HD2 HIS 125 HD2 HIS 125 -0.907 -13.006 13.837 953 HE1 HIS 125 HE1 HIS 125 0.457 -13.007 17.844 954 HE2 HIS 125 HE2 HIS 125 0.759 -14.030 15.543 955 H GLN 126 HN GLN 126 -6.352 -10.819 14.716 956 HA GLN 126 HA GLN 126 -6.572 -9.064 16.979 957 1HB GLN 126 HB1 GLN 126 -8.150 -9.677 14.572 958 2HB GLN 126 HB2 GLN 126 -9.109 -9.244 15.980 959 1HG GLN 126 HG1 GLN 126 -7.737 -7.184 16.205 960 2HG GLN 126 HG2 GLN 126 -6.943 -7.604 14.686 961 1HE2 GLN 126 HE21 GLN 126 -8.020 -7.333 12.772 962 2HE2 GLN 126 HE22 GLN 126 -9.537 -6.516 12.646 963 H ALA 127 HN ALA 127 -9.445 -10.824 16.305 964 HA ALA 127 HA ALA 127 -9.382 -11.936 19.009 965 1HB ALA 127 HB1 ALA 127 -11.861 -12.447 18.331 966 2HB ALA 127 HB2 ALA 127 -11.548 -11.237 17.086 967 3HB ALA 127 HB3 ALA 127 -11.371 -10.816 18.789 968 H LYS 128 HN LYS 128 -8.014 -13.061 16.526 969 HA LYS 128 HA LYS 128 -9.385 -15.556 16.054 970 1HB LYS 128 HB2 LYS 128 -6.556 -14.908 15.245 971 2HB LYS 128 HB1 LYS 128 -7.675 -16.034 14.487 972 1HG LYS 128 HG2 LYS 128 -8.881 -13.479 14.433 973 2HG LYS 128 HG1 LYS 128 -7.212 -13.300 13.884 974 1HD LYS 128 HD2 LYS 128 -7.640 -14.336 11.951 975 2HD LYS 128 HD1 LYS 128 -8.499 -15.649 12.759 976 1HE LYS 128 HE1 LYS 128 -9.782 -12.966 12.432 977 2HE LYS 128 HE2 LYS 128 -9.779 -14.121 11.101 978 1HZ LYS 128 HZ1 LYS 128 -10.826 -15.739 12.612 979 2HZ LYS 128 HZ2 LYS 128 -11.784 -14.369 12.360 980 3HZ LYS 128 HZ3 LYS 128 -10.925 -14.545 13.807 981 H GLU 129 HN GLU 129 -6.688 -16.947 15.898 982 HA GLU 129 HA GLU 129 -6.794 -18.069 18.552 983 1HB GLU 129 HB2 GLU 129 -5.755 -18.844 15.952 984 2HB GLU 129 HB1 GLU 129 -4.598 -19.175 17.233 985 1HG GLU 129 HG2 GLU 129 -6.198 -20.521 18.408 986 2HG GLU 129 HG1 GLU 129 -7.466 -20.082 17.265 987 H ALA 130 HN ALA 130 -5.547 -15.308 17.627 988 HA ALA 130 HA ALA 130 -2.855 -15.507 18.633 989 1HB ALA 130 HB1 ALA 130 -4.211 -13.732 16.990 990 2HB ALA 130 HB2 ALA 130 -2.558 -13.570 17.581 991 3HB ALA 130 HB3 ALA 130 -3.886 -12.811 18.458 992 H ALA 131 HN ALA 131 -5.926 -15.137 20.010 993 HA ALA 131 HA ALA 131 -5.371 -13.433 22.183 994 1HB ALA 131 HB1 ALA 131 -7.574 -14.909 21.249 995 2HB ALA 131 HB2 ALA 131 -7.541 -13.707 22.540 996 3HB ALA 131 HB3 ALA 131 -7.300 -15.413 22.917 997 H GLN 132 HN GLN 132 -4.310 -16.585 21.508 998 HA GLN 132 HA GLN 132 -3.892 -17.292 24.303 999 1HB GLN 132 HB2 GLN 132 -4.154 -18.738 21.849 1000 2HB GLN 132 HB1 GLN 132 -2.597 -19.130 22.566 1001 1HG GLN 132 HG1 GLN 132 -4.020 -19.434 24.740 1002 2HG GLN 132 HG2 GLN 132 -5.342 -19.642 23.592 1003 1HE2 GLN 132 HE21 GLN 132 -5.683 -21.612 22.869 1004 2HE2 GLN 132 HE22 GLN 132 -4.547 -22.914 22.887 1005 H LYS 133 HN LYS 133 -2.311 -15.999 25.123 1006 HA LYS 133 HA LYS 133 0.125 -15.510 23.641 1007 1HB LYS 133 HB2 LYS 133 -0.835 -14.679 26.376 1008 2HB LYS 133 HB1 LYS 133 0.781 -14.308 25.791 1009 1HG LYS 133 HG2 LYS 133 -1.408 -13.560 23.980 1010 2HG LYS 133 HG1 LYS 133 -1.354 -12.684 25.511 1011 1HD LYS 133 HD1 LYS 133 0.332 -11.437 24.775 1012 2HD LYS 133 HD2 LYS 133 1.293 -12.882 24.451 1013 1HE LYS 133 HE1 LYS 133 1.190 -12.031 22.342 1014 2HE LYS 133 HE2 LYS 133 -0.278 -13.007 22.326 1015 1HZ LYS 133 HZ1 LYS 133 -0.172 -10.402 21.691 1016 2HZ LYS 133 HZ2 LYS 133 -0.638 -10.320 23.316 1017 3HZ LYS 133 HZ3 LYS 133 -1.568 -11.202 22.213 1018 H ALA 134 HN ALA 134 1.628 -17.036 23.537 1019 HA ALA 134 HA ALA 134 1.847 -19.082 25.561 1020 1HB ALA 134 HB1 ALA 134 3.832 -18.774 23.358 1021 2HB ALA 134 HB2 ALA 134 2.187 -19.280 22.979 1022 3HB ALA 134 HB3 ALA 134 3.172 -20.240 24.082 1023 H VAL 135 HN VAL 135 3.528 -19.407 26.977 1024 HA VAL 135 HA VAL 135 5.263 -17.078 27.419 1025 HB VAL 135 HB VAL 135 5.651 -18.296 29.684 1026 1HG1 VAL 135 HG21 VAL 135 3.925 -17.030 30.674 1027 2HG1 VAL 135 HG22 VAL 135 2.916 -17.132 29.232 1028 3HG1 VAL 135 HG23 VAL 135 4.381 -16.153 29.214 1029 1HG2 VAL 135 HG11 VAL 135 3.089 -19.582 28.748 1030 2HG2 VAL 135 HG12 VAL 135 3.667 -19.593 30.415 1031 3HG2 VAL 135 HG13 VAL 135 4.600 -20.396 29.152 1032 H ASN 136 HN ASN 136 7.009 -17.458 26.129 1033 HA ASN 136 HA ASN 136 8.339 -20.052 26.239 1034 1HB ASN 136 HB1 ASN 136 7.944 -18.342 24.166 1035 2HB ASN 136 HB2 ASN 136 9.560 -17.859 24.675 1036 1HD2 ASN 136 HD21 ASN 136 9.889 -18.692 22.406 1037 2HD2 ASN 136 HD22 ASN 136 10.311 -20.360 22.251 1038 H SER 137 HN SER 137 8.389 -17.240 27.974 1039 HA SER 137 HA SER 137 11.269 -17.262 28.471 1040 1HB SER 137 HB1 SER 137 10.768 -15.244 29.878 1041 2HB SER 137 HB2 SER 137 10.308 -15.064 28.185 1042 HG SER 137 HG SER 137 8.428 -14.568 28.969 1043 H ALA 138 HN ALA 138 8.224 -18.053 29.993 1044 HA ALA 138 HA ALA 138 9.446 -18.547 32.574 1045 1HB ALA 138 HB1 ALA 138 7.213 -19.140 33.309 1046 2HB ALA 138 HB2 ALA 138 6.631 -19.096 31.645 1047 3HB ALA 138 HB3 ALA 138 7.180 -17.614 32.428 1048 H THR 139 HN THR 139 8.525 -20.742 33.600 1049 HA THR 139 HA THR 139 9.591 -22.866 31.881 1050 HB THR 139 HB THR 139 9.082 -23.668 34.616 1051 HG1 THR 139 HG1 THR 139 9.392 -21.478 35.091 1052 1HG2 THR 139 HG21 THR 139 11.711 -23.297 33.211 1053 2HG2 THR 139 HG22 THR 139 10.697 -24.734 33.072 1054 3HG2 THR 139 HG23 THR 139 11.382 -24.285 34.634 1055 H GLY 140 HN GLY 140 8.580 -25.122 32.772 1056 1HA GLY 140 HA1 GLY 140 5.862 -25.054 31.839 1057 2HA GLY 140 HA2 GLY 140 6.758 -26.480 32.337 1058 H VAL 141 HN VAL 141 6.272 -27.387 34.240 1059 HA VAL 141 HA VAL 141 4.361 -25.969 35.961 1060 HB VAL 141 HB VAL 141 4.653 -28.636 36.851 1061 1HG1 VAL 141 HG11 VAL 141 2.373 -28.663 36.691 1062 2HG1 VAL 141 HG12 VAL 141 2.359 -27.807 35.150 1063 3HG1 VAL 141 HG13 VAL 141 2.662 -26.924 36.646 1064 1HG2 VAL 141 HG21 VAL 141 3.991 -29.886 34.821 1065 2HG2 VAL 141 HG22 VAL 141 5.633 -29.248 34.733 1066 3HG2 VAL 141 HG23 VAL 141 4.328 -28.448 33.859 1067 HA PRO 142 HA PRO 142 7.415 -25.175 39.071 1068 1HB PRO 142 HB1 PRO 142 5.184 -25.781 40.948 1069 2HB PRO 142 HB2 PRO 142 6.242 -24.369 40.876 1070 1HG PRO 142 HG2 PRO 142 3.729 -24.225 40.011 1071 2HG PRO 142 HG1 PRO 142 5.035 -23.390 39.150 1072 1HD PRO 142 HD2 PRO 142 3.603 -25.914 38.442 1073 2HD PRO 142 HD1 PRO 142 4.212 -24.626 37.382 1074 H THR 143 HN THR 143 8.874 -26.421 40.091 1075 HA THR 143 HA THR 143 8.324 -29.262 40.343 1076 HB THR 143 HB THR 143 10.849 -29.130 41.140 1077 HG1 THR 143 HG1 THR 143 10.391 -26.667 39.830 1078 1HG2 THR 143 HG21 THR 143 11.068 -30.162 39.204 1079 2HG2 THR 143 HG22 THR 143 11.180 -28.582 38.427 1080 3HG2 THR 143 HG23 THR 143 9.617 -29.386 38.567 1081 H VAL 144 HN VAL 144 6.787 -28.986 42.104 1082 HA VAL 144 HA VAL 144 8.155 -28.719 44.702 1083 HB VAL 144 HB VAL 144 5.251 -28.040 44.310 1084 1HG1 VAL 144 HG21 VAL 144 5.569 -26.828 46.419 1085 2HG1 VAL 144 HG22 VAL 144 7.252 -27.355 46.459 1086 3HG1 VAL 144 HG23 VAL 144 5.953 -28.541 46.581 1087 1HG2 VAL 144 HG11 VAL 144 6.213 -26.437 42.930 1088 2HG2 VAL 144 HG12 VAL 144 7.661 -26.305 43.928 1089 3HG2 VAL 144 HG13 VAL 144 6.137 -25.623 44.493 Start of MODEL 8 1 1H GLY 1 HT1 GLY 1 -29.219 -10.376 37.511 2 2H GLY 1 HT2 GLY 1 -30.327 -9.484 36.596 3 3H GLY 1 HT3 GLY 1 -29.641 -10.892 35.956 4 1HA GLY 1 HA1 GLY 1 -30.721 -11.887 38.170 5 2HA GLY 1 HA2 GLY 1 -31.839 -10.576 37.829 6 HA PRO 2 HA PRO 2 -33.402 -14.337 35.579 7 1HB PRO 2 HB2 PRO 2 -35.860 -12.685 35.861 8 2HB PRO 2 HB1 PRO 2 -35.629 -14.415 36.135 9 1HG PRO 2 HG1 PRO 2 -35.869 -12.739 38.188 10 2HG PRO 2 HG2 PRO 2 -34.722 -14.091 38.248 11 1HD PRO 2 HD1 PRO 2 -34.204 -11.183 37.784 12 2HD PRO 2 HD2 PRO 2 -33.250 -12.366 38.701 13 H LEU 3 HN LEU 3 -33.231 -14.405 33.436 14 HA LEU 3 HA LEU 3 -33.517 -11.936 31.902 15 1HB LEU 3 HB2 LEU 3 -32.541 -13.347 30.045 16 2HB LEU 3 HB1 LEU 3 -31.495 -13.042 31.418 17 HG LEU 3 HG LEU 3 -32.979 -15.508 31.759 18 1HD1 LEU 3 HD11 LEU 3 -32.184 -14.984 29.104 19 2HD1 LEU 3 HD12 LEU 3 -32.781 -16.497 29.786 20 3HD1 LEU 3 HD13 LEU 3 -31.049 -16.161 29.765 21 1HD2 LEU 3 HD21 LEU 3 -30.015 -15.143 31.456 22 2HD2 LEU 3 HD22 LEU 3 -30.886 -16.349 32.402 23 3HD2 LEU 3 HD23 LEU 3 -30.876 -14.664 32.918 24 H GLY 4 HN GLY 4 -35.117 -14.942 32.470 25 1HA GLY 4 HA2 GLY 4 -36.852 -14.540 30.128 26 2HA GLY 4 HA1 GLY 4 -36.725 -16.022 31.063 27 H SER 5 HN SER 5 -39.032 -14.240 30.280 28 HA SER 5 HA SER 5 -40.003 -13.167 32.769 29 1HB SER 5 HB1 SER 5 -42.139 -12.855 31.409 30 2HB SER 5 HB2 SER 5 -40.710 -12.006 30.817 31 HG SER 5 HG SER 5 -40.439 -13.640 29.278 32 H ALA 6 HN ALA 6 -39.906 -15.058 34.086 33 HA ALA 6 HA ALA 6 -42.070 -16.989 33.552 34 1HB ALA 6 HB1 ALA 6 -40.318 -18.418 33.567 35 2HB ALA 6 HB2 ALA 6 -40.556 -18.327 35.312 36 3HB ALA 6 HB3 ALA 6 -39.310 -17.348 34.540 37 H ALA 7 HN ALA 7 -42.568 -18.150 35.826 38 HA ALA 7 HA ALA 7 -43.016 -16.005 37.798 39 1HB ALA 7 HB1 ALA 7 -45.005 -18.194 37.590 40 2HB ALA 7 HB2 ALA 7 -45.014 -16.955 36.336 41 3HB ALA 7 HB3 ALA 7 -45.223 -16.499 38.027 42 H ALA 8 HN ALA 8 -41.041 -18.313 37.475 43 HA ALA 8 HA ALA 8 -39.964 -19.822 38.795 44 1HB ALA 8 HB1 ALA 8 -39.728 -18.008 40.328 45 2HB ALA 8 HB2 ALA 8 -40.133 -19.452 41.256 46 3HB ALA 8 HB3 ALA 8 -41.368 -18.236 40.934 47 H ALA 9 HN ALA 9 -42.664 -20.457 37.764 48 HA ALA 9 HA ALA 9 -43.316 -22.610 39.665 49 1HB ALA 9 HB1 ALA 9 -45.631 -22.372 39.264 50 2HB ALA 9 HB2 ALA 9 -45.360 -21.266 37.918 51 3HB ALA 9 HB3 ALA 9 -45.021 -20.745 39.568 52 H THR 10 HN THR 10 -43.966 -21.618 36.298 53 HA THR 10 HA THR 10 -42.958 -24.193 35.372 54 HB THR 10 HB THR 10 -45.185 -24.847 35.454 55 HG1 THR 10 HG1 THR 10 -45.958 -24.154 33.133 56 1HG2 THR 10 HG21 THR 10 -46.276 -22.868 36.172 57 2HG2 THR 10 HG22 THR 10 -47.076 -23.417 34.699 58 3HG2 THR 10 HG23 THR 10 -45.950 -22.060 34.638 59 HA PRO 11 HA PRO 11 -41.243 -21.323 32.413 60 1HB PRO 11 HB1 PRO 11 -39.992 -23.148 30.844 61 2HB PRO 11 HB2 PRO 11 -39.364 -22.644 32.417 62 1HG PRO 11 HG1 PRO 11 -40.933 -25.092 31.698 63 2HG PRO 11 HG2 PRO 11 -39.513 -24.944 32.749 64 1HD PRO 11 HD1 PRO 11 -42.031 -25.125 33.725 65 2HD PRO 11 HD2 PRO 11 -40.758 -24.192 34.538 66 H ALA 12 HN ALA 12 -43.385 -20.781 31.608 67 HA ALA 12 HA ALA 12 -44.455 -22.372 29.431 68 1HB ALA 12 HB1 ALA 12 -45.422 -19.726 30.504 69 2HB ALA 12 HB2 ALA 12 -45.948 -21.306 31.084 70 3HB ALA 12 HB3 ALA 12 -46.299 -20.814 29.428 71 H VAL 13 HN VAL 13 -42.477 -22.080 28.120 72 HA VAL 13 HA VAL 13 -42.305 -19.446 26.834 73 HB VAL 13 HB VAL 13 -40.194 -20.514 25.789 74 1HG1 VAL 13 HG11 VAL 13 -40.563 -19.556 28.588 75 2HG1 VAL 13 HG12 VAL 13 -39.756 -18.777 27.228 76 3HG1 VAL 13 HG13 VAL 13 -38.972 -20.113 28.071 77 1HG2 VAL 13 HG21 VAL 13 -40.653 -22.811 26.436 78 2HG2 VAL 13 HG22 VAL 13 -40.622 -22.354 28.139 79 3HG2 VAL 13 HG23 VAL 13 -39.151 -22.252 27.172 80 H ARG 14 HN ARG 14 -42.730 -19.164 24.706 81 HA ARG 14 HA ARG 14 -43.870 -21.456 23.281 82 1HB ARG 14 HB2 ARG 14 -45.013 -19.105 23.650 83 2HB ARG 14 HB1 ARG 14 -44.046 -18.655 22.252 84 1HG ARG 14 HG2 ARG 14 -45.570 -19.538 20.918 85 2HG ARG 14 HG1 ARG 14 -45.307 -21.118 21.660 86 1HD ARG 14 HD1 ARG 14 -47.652 -20.488 21.792 87 2HD ARG 14 HD2 ARG 14 -46.936 -20.570 23.401 88 HE ARG 14 HE ARG 14 -46.920 -17.936 22.238 89 1HH1 ARG 14 HH11 ARG 14 -48.732 -20.236 24.131 90 2HH1 ARG 14 HH12 ARG 14 -49.702 -19.028 24.905 91 1HH2 ARG 14 HH21 ARG 14 -48.193 -16.340 23.253 92 2HH2 ARG 14 HH22 ARG 14 -49.395 -16.814 24.407 93 H THR 15 HN THR 15 -42.206 -22.506 22.318 94 HA THR 15 HA THR 15 -40.197 -20.985 20.853 95 HB THR 15 HB THR 15 -39.392 -23.471 20.427 96 HG1 THR 15 HG1 THR 15 -41.282 -24.386 21.371 97 1HG2 THR 15 HG21 THR 15 -38.006 -22.055 21.693 98 2HG2 THR 15 HG22 THR 15 -38.279 -23.492 22.676 99 3HG2 THR 15 HG23 THR 15 -39.155 -22.002 23.030 100 H VAL 16 HN VAL 16 -41.990 -20.284 19.366 101 HA VAL 16 HA VAL 16 -42.531 -22.316 17.310 102 HB VAL 16 HB VAL 16 -43.989 -19.709 17.736 103 1HG1 VAL 16 HG11 VAL 16 -45.673 -21.183 16.290 104 2HG1 VAL 16 HG12 VAL 16 -44.154 -21.867 15.713 105 3HG1 VAL 16 HG13 VAL 16 -44.459 -20.137 15.555 106 1HG2 VAL 16 HG21 VAL 16 -45.295 -22.321 18.224 107 2HG2 VAL 16 HG22 VAL 16 -45.540 -20.763 19.014 108 3HG2 VAL 16 HG23 VAL 16 -44.145 -21.756 19.435 109 HA PRO 17 HA PRO 17 -41.181 -18.251 14.870 110 1HB PRO 17 HB2 PRO 17 -39.479 -17.047 16.987 111 2HB PRO 17 HB1 PRO 17 -40.513 -16.260 15.789 112 1HG PRO 17 HG2 PRO 17 -41.253 -16.399 18.343 113 2HG PRO 17 HG1 PRO 17 -42.438 -16.597 17.038 114 1HD PRO 17 HD2 PRO 17 -41.166 -18.670 18.778 115 2HD PRO 17 HD1 PRO 17 -42.834 -18.571 18.176 116 H GLN 18 HN GLN 18 -39.124 -17.925 13.813 117 HA GLN 18 HA GLN 18 -37.391 -20.193 14.102 118 1HB GLN 18 HB2 GLN 18 -37.751 -17.987 12.169 119 2HB GLN 18 HB1 GLN 18 -36.112 -18.613 12.303 120 1HG GLN 18 HG2 GLN 18 -37.699 -20.880 12.162 121 2HG GLN 18 HG1 GLN 18 -38.432 -19.757 11.018 122 1HE2 GLN 18 HE21 GLN 18 -37.654 -19.832 9.045 123 2HE2 GLN 18 HE22 GLN 18 -36.072 -20.354 8.588 124 H TYR 19 HN TYR 19 -34.908 -19.634 13.816 125 HA TYR 19 HA TYR 19 -34.061 -18.540 16.276 126 1HB TYR 19 HB1 TYR 19 -32.903 -20.296 14.760 127 2HB TYR 19 HB2 TYR 19 -32.229 -18.899 13.926 128 HD1 TYR 19 HD1 TYR 19 -32.554 -20.356 17.345 129 HD2 TYR 19 HD2 TYR 19 -30.245 -17.966 14.689 130 HE1 TYR 19 HE1 TYR 19 -30.769 -20.218 19.030 131 HE2 TYR 19 HE2 TYR 19 -28.454 -17.821 16.367 132 HH TYR 19 HH TYR 19 -27.709 -18.577 18.337 133 H LYS 20 HN LYS 20 -32.512 -17.459 13.340 134 HA LYS 20 HA LYS 20 -32.478 -14.744 14.327 135 1HB LYS 20 HB1 LYS 20 -30.734 -16.234 12.816 136 2HB LYS 20 HB2 LYS 20 -31.485 -15.207 11.602 137 1HG LYS 20 HG2 LYS 20 -30.238 -13.489 12.219 138 2HG LYS 20 HG1 LYS 20 -30.796 -13.632 13.888 139 1HD LYS 20 HD2 LYS 20 -29.099 -15.470 14.182 140 2HD LYS 20 HD1 LYS 20 -28.454 -15.021 12.601 141 1HE LYS 20 HE2 LYS 20 -27.279 -13.378 13.517 142 2HE LYS 20 HE1 LYS 20 -28.750 -12.664 14.175 143 1HZ LYS 20 HZ1 LYS 20 -27.737 -14.963 15.617 144 2HZ LYS 20 HZ2 LYS 20 -28.351 -13.500 16.203 145 3HZ LYS 20 HZ3 LYS 20 -26.748 -13.593 15.671 146 H TYR 21 HN TYR 21 -32.637 -13.124 12.219 147 HA TYR 21 HA TYR 21 -35.461 -13.209 11.567 148 1HB TYR 21 HB1 TYR 21 -34.288 -11.121 12.358 149 2HB TYR 21 HB2 TYR 21 -33.438 -11.091 10.816 150 HD1 TYR 21 HD1 TYR 21 -36.837 -11.000 12.315 151 HD2 TYR 21 HD2 TYR 21 -34.415 -10.097 8.936 152 HE1 TYR 21 HE1 TYR 21 -38.710 -9.763 11.311 153 HE2 TYR 21 HE2 TYR 21 -36.282 -8.858 7.922 154 HH TYR 21 HH TYR 21 -38.915 -7.823 9.568 155 H ALA 22 HN ALA 22 -32.485 -13.997 10.099 156 HA ALA 22 HA ALA 22 -33.288 -13.612 7.375 157 1HB ALA 22 HB1 ALA 22 -31.176 -14.189 6.831 158 2HB ALA 22 HB2 ALA 22 -31.140 -15.547 7.956 159 3HB ALA 22 HB3 ALA 22 -30.887 -13.904 8.547 160 H ALA 23 HN ALA 23 -34.669 -14.835 6.291 161 HA ALA 23 HA ALA 23 -35.634 -17.319 7.323 162 1HB ALA 23 HB1 ALA 23 -37.319 -16.287 6.202 163 2HB ALA 23 HB2 ALA 23 -36.707 -17.300 4.894 164 3HB ALA 23 HB3 ALA 23 -36.241 -15.601 4.985 165 H GLY 24 HN GLY 24 -34.955 -19.326 6.916 166 1HA GLY 24 HA1 GLY 24 -32.673 -19.694 5.155 167 2HA GLY 24 HA2 GLY 24 -33.347 -20.886 6.256 168 H VAL 25 HN VAL 25 -34.952 -19.038 3.689 169 HA VAL 25 HA VAL 25 -35.712 -21.602 2.458 170 HB VAL 25 HB VAL 25 -37.571 -20.301 1.394 171 1HG1 VAL 25 HG21 VAL 25 -38.989 -20.383 3.311 172 2HG1 VAL 25 HG22 VAL 25 -37.618 -20.195 4.404 173 3HG1 VAL 25 HG23 VAL 25 -37.804 -21.679 3.470 174 1HG2 VAL 25 HG11 VAL 25 -37.602 -18.173 3.335 175 2HG2 VAL 25 HG12 VAL 25 -37.723 -18.090 1.577 176 3HG2 VAL 25 HG13 VAL 25 -36.139 -18.104 2.352 177 H ARG 26 HN ARG 26 -36.177 -21.387 0.042 178 HA ARG 26 HA ARG 26 -33.778 -20.441 -1.224 179 1HB ARG 26 HB1 ARG 26 -35.681 -22.415 -1.765 180 2HB ARG 26 HB2 ARG 26 -35.874 -21.244 -3.062 181 1HG ARG 26 HG2 ARG 26 -34.279 -22.541 -4.003 182 2HG ARG 26 HG1 ARG 26 -33.227 -21.438 -3.112 183 1HD ARG 26 HD2 ARG 26 -34.213 -23.974 -1.857 184 2HD ARG 26 HD1 ARG 26 -32.813 -23.983 -2.930 185 HE ARG 26 HE ARG 26 -32.911 -23.029 -0.238 186 1HH1 ARG 26 HH11 ARG 26 -31.341 -22.608 -3.321 187 2HH1 ARG 26 HH12 ARG 26 -29.889 -21.957 -2.638 188 1HH2 ARG 26 HH21 ARG 26 -31.003 -22.174 0.669 189 2HH2 ARG 26 HH22 ARG 26 -29.697 -21.711 -0.369 190 H ASN 27 HN ASN 27 -33.507 -18.714 -2.546 191 HA ASN 27 HA ASN 27 -35.391 -16.575 -2.351 192 1HB ASN 27 HB2 ASN 27 -33.184 -16.457 -4.347 193 2HB ASN 27 HB1 ASN 27 -33.730 -15.236 -3.201 194 1HD2 ASN 27 HD21 ASN 27 -33.154 -15.525 -0.958 195 2HD2 ASN 27 HD22 ASN 27 -31.686 -16.343 -0.557 196 HA PRO 28 HA PRO 28 -37.694 -17.507 -6.030 197 1HB PRO 28 HB1 PRO 28 -39.087 -15.226 -6.264 198 2HB PRO 28 HB2 PRO 28 -39.388 -16.364 -4.944 199 1HG PRO 28 HG2 PRO 28 -37.817 -13.816 -4.930 200 2HG PRO 28 HG1 PRO 28 -38.957 -14.433 -3.721 201 1HD PRO 28 HD1 PRO 28 -36.230 -14.642 -3.502 202 2HD PRO 28 HD2 PRO 28 -37.374 -15.760 -2.733 203 H GLN 29 HN GLN 29 -34.990 -15.811 -6.033 204 HA GLN 29 HA GLN 29 -35.381 -14.432 -8.581 205 1HB GLN 29 HB1 GLN 29 -32.671 -14.312 -7.622 206 2HB GLN 29 HB2 GLN 29 -33.821 -13.005 -7.862 207 1HG GLN 29 HG2 GLN 29 -34.772 -13.959 -5.567 208 2HG GLN 29 HG1 GLN 29 -33.093 -14.468 -5.399 209 1HE2 GLN 29 HE21 GLN 29 -34.738 -11.590 -6.674 210 2HE2 GLN 29 HE22 GLN 29 -33.818 -10.450 -5.756 211 H GLN 30 HN GLN 30 -34.076 -14.842 -10.403 212 HA GLN 30 HA GLN 30 -33.441 -17.623 -10.764 213 1HB GLN 30 HB2 GLN 30 -32.874 -15.390 -12.710 214 2HB GLN 30 HB1 GLN 30 -33.125 -17.093 -13.063 215 1HG GLN 30 HG1 GLN 30 -35.480 -16.762 -12.148 216 2HG GLN 30 HG2 GLN 30 -35.149 -15.034 -12.264 217 1HE2 GLN 30 HE21 GLN 30 -33.717 -14.877 -14.572 218 2HE2 GLN 30 HE22 GLN 30 -34.700 -15.353 -15.912 219 H HIS 31 HN HIS 31 -31.281 -17.490 -12.528 220 HA HIS 31 HA HIS 31 -29.100 -17.694 -10.793 221 1HB HIS 31 HB2 HIS 31 -29.464 -18.610 -13.217 222 2HB HIS 31 HB1 HIS 31 -28.716 -17.093 -13.708 223 HD2 HIS 31 HD2 HIS 31 -27.787 -20.370 -11.783 224 HE1 HIS 31 HE1 HIS 31 -24.254 -18.298 -12.852 225 HE2 HIS 31 HE2 HIS 31 -25.193 -20.429 -11.848 226 H LEU 32 HN LEU 32 -30.269 -15.004 -12.723 227 HA LEU 32 HA LEU 32 -27.963 -13.360 -12.130 228 1HB LEU 32 HB2 LEU 32 -29.452 -13.317 -14.254 229 2HB LEU 32 HB1 LEU 32 -30.546 -12.356 -13.280 230 HG LEU 32 HG LEU 32 -28.519 -10.821 -12.864 231 1HD1 LEU 32 HD21 LEU 32 -26.735 -10.880 -14.399 232 2HD1 LEU 32 HD22 LEU 32 -27.540 -12.077 -15.413 233 3HD1 LEU 32 HD23 LEU 32 -26.922 -12.538 -13.827 234 1HD2 LEU 32 HD11 LEU 32 -29.989 -9.695 -14.130 235 2HD2 LEU 32 HD12 LEU 32 -30.280 -11.068 -15.196 236 3HD2 LEU 32 HD13 LEU 32 -28.862 -10.048 -15.440 237 H ASN 33 HN ASN 33 -27.789 -11.850 -10.568 238 HA ASN 33 HA ASN 33 -29.798 -11.823 -8.494 239 1HB ASN 33 HB2 ASN 33 -27.252 -11.834 -8.150 240 2HB ASN 33 HB1 ASN 33 -27.311 -10.123 -8.558 241 1HD2 ASN 33 HD21 ASN 33 -26.789 -9.278 -6.618 242 2HD2 ASN 33 HD22 ASN 33 -27.743 -9.462 -5.190 243 H ALA 34 HN ALA 34 -31.220 -10.242 -8.044 244 HA ALA 34 HA ALA 34 -31.569 -8.132 -9.983 245 1HB ALA 34 HB1 ALA 34 -33.191 -9.264 -7.779 246 2HB ALA 34 HB2 ALA 34 -33.627 -8.941 -9.457 247 3HB ALA 34 HB3 ALA 34 -33.530 -7.613 -8.300 248 H GLN 35 HN GLN 35 -32.137 -7.717 -6.571 249 HA GLN 35 HA GLN 35 -30.701 -5.189 -6.642 250 1HB GLN 35 HB2 GLN 35 -32.775 -6.408 -4.917 251 2HB GLN 35 HB1 GLN 35 -31.641 -5.332 -4.110 252 1HG GLN 35 HG2 GLN 35 -32.305 -3.884 -6.320 253 2HG GLN 35 HG1 GLN 35 -33.812 -4.731 -5.972 254 1HE2 GLN 35 HE21 GLN 35 -34.130 -4.798 -3.409 255 2HE2 GLN 35 HE22 GLN 35 -34.074 -3.233 -2.678 256 HA PRO 36 HA PRO 36 -29.852 -3.760 -5.182 257 1HB PRO 36 HB1 PRO 36 -27.408 -2.658 -5.043 258 2HB PRO 36 HB2 PRO 36 -28.278 -3.172 -3.593 259 1HG PRO 36 HG1 PRO 36 -26.094 -4.573 -5.090 260 2HG PRO 36 HG2 PRO 36 -26.302 -4.379 -3.340 261 1HD PRO 36 HD1 PRO 36 -26.989 -6.648 -4.702 262 2HD PRO 36 HD2 PRO 36 -27.778 -6.131 -3.200 263 H GLN 37 HN GLN 37 -30.144 -2.815 -7.106 264 HA GLN 37 HA GLN 37 -28.945 -3.896 -9.462 265 1HB GLN 37 HB2 GLN 37 -31.173 -2.231 -8.824 266 2HB GLN 37 HB1 GLN 37 -30.194 -1.398 -10.022 267 1HG GLN 37 HG1 GLN 37 -30.931 -4.263 -10.416 268 2HG GLN 37 HG2 GLN 37 -32.085 -2.983 -10.789 269 1HE2 GLN 37 HE21 GLN 37 -30.922 -1.105 -12.045 270 2HE2 GLN 37 HE22 GLN 37 -30.020 -1.629 -13.422 271 H VAL 38 HN VAL 38 -28.252 -2.066 -11.168 272 HA VAL 38 HA VAL 38 -25.779 -1.033 -10.128 273 HB VAL 38 HB VAL 38 -25.696 -1.959 -12.321 274 1HG1 VAL 38 HG11 VAL 38 -28.166 -1.446 -12.761 275 2HG1 VAL 38 HG12 VAL 38 -27.055 -1.389 -14.130 276 3HG1 VAL 38 HG13 VAL 38 -27.597 0.108 -13.371 277 1HG2 VAL 38 HG21 VAL 38 -25.546 1.031 -12.660 278 2HG2 VAL 38 HG22 VAL 38 -24.667 -0.196 -13.573 279 3HG2 VAL 38 HG23 VAL 38 -24.309 0.056 -11.865 280 H THR 39 HN THR 39 -26.412 0.541 -8.632 281 HA THR 39 HA THR 39 -27.676 2.946 -9.766 282 HB THR 39 HB THR 39 -27.482 2.940 -6.873 283 HG1 THR 39 HG1 THR 39 -29.142 0.917 -7.919 284 1HG2 THR 39 HG21 THR 39 -29.646 3.670 -6.910 285 2HG2 THR 39 HG22 THR 39 -30.054 2.732 -8.346 286 3HG2 THR 39 HG23 THR 39 -29.081 4.195 -8.496 287 H MET 40 HN MET 40 -25.411 2.153 -7.125 288 HA MET 40 HA MET 40 -24.017 4.663 -7.555 289 1HB MET 40 HB2 MET 40 -23.679 2.460 -5.514 290 2HB MET 40 HB1 MET 40 -22.657 3.890 -5.575 291 1HG MET 40 HG1 MET 40 -24.114 4.892 -4.252 292 2HG MET 40 HG2 MET 40 -25.256 4.875 -5.593 293 1HE MET 40 HE1 MET 40 -26.436 3.493 -1.760 294 2HE MET 40 HE2 MET 40 -25.897 4.999 -2.503 295 3HE MET 40 HE3 MET 40 -24.712 3.812 -1.960 296 H GLN 41 HN GLN 41 -21.819 4.847 -8.066 297 HA GLN 41 HA GLN 41 -20.539 2.425 -9.134 298 1HB GLN 41 HB2 GLN 41 -19.666 3.811 -11.019 299 2HB GLN 41 HB1 GLN 41 -21.410 3.589 -11.048 300 1HG GLN 41 HG2 GLN 41 -20.256 6.018 -9.760 301 2HG GLN 41 HG1 GLN 41 -20.374 5.925 -11.518 302 1HE2 GLN 41 HE21 GLN 41 -22.535 5.363 -12.380 303 2HE2 GLN 41 HE22 GLN 41 -23.919 6.015 -11.578 304 H GLN 42 HN GLN 42 -18.227 3.796 -10.079 305 HA GLN 42 HA GLN 42 -16.632 3.790 -7.793 306 1HB GLN 42 HB2 GLN 42 -14.916 4.890 -9.250 307 2HB GLN 42 HB1 GLN 42 -15.630 3.439 -9.940 308 1HG GLN 42 HG2 GLN 42 -17.236 5.524 -10.842 309 2HG GLN 42 HG1 GLN 42 -15.585 6.131 -10.958 310 1HE2 GLN 42 HE22 GLN 42 -17.307 3.082 -11.568 311 2HE2 GLN 42 HE21 GLN 42 -16.586 2.788 -13.110 312 HA PRO 43 HA PRO 43 -17.559 7.772 -6.045 313 1HB PRO 43 HB2 PRO 43 -15.520 7.905 -4.266 314 2HB PRO 43 HB1 PRO 43 -16.932 6.869 -4.027 315 1HG PRO 43 HG1 PRO 43 -14.209 6.158 -5.051 316 2HG PRO 43 HG2 PRO 43 -15.231 5.286 -3.894 317 1HD PRO 43 HD1 PRO 43 -15.037 4.573 -6.502 318 2HD PRO 43 HD2 PRO 43 -16.520 4.342 -5.554 319 H ALA 44 HN ALA 44 -17.011 9.844 -6.470 320 HA ALA 44 HA ALA 44 -14.857 10.346 -8.301 321 1HB ALA 44 HB1 ALA 44 -17.142 11.469 -8.301 322 2HB ALA 44 HB2 ALA 44 -15.738 12.509 -8.540 323 3HB ALA 44 HB3 ALA 44 -16.534 12.451 -6.968 324 H VAL 45 HN VAL 45 -12.891 10.085 -7.326 325 HA VAL 45 HA VAL 45 -12.342 11.477 -4.818 326 HB VAL 45 HB VAL 45 -10.445 9.750 -6.406 327 1HG1 VAL 45 HG21 VAL 45 -10.439 10.416 -3.469 328 2HG1 VAL 45 HG22 VAL 45 -9.517 11.310 -4.678 329 3HG1 VAL 45 HG23 VAL 45 -9.176 9.603 -4.395 330 1HG2 VAL 45 HG11 VAL 45 -12.710 9.022 -4.678 331 2HG2 VAL 45 HG12 VAL 45 -11.194 8.197 -4.321 332 3HG2 VAL 45 HG13 VAL 45 -11.895 8.093 -5.936 333 H HIS 46 HN HIS 46 -12.274 13.635 -5.417 334 HA HIS 46 HA HIS 46 -10.222 14.389 -7.385 335 1HB HIS 46 HB2 HIS 46 -12.645 15.875 -6.362 336 2HB HIS 46 HB1 HIS 46 -11.396 16.633 -7.344 337 HD2 HIS 46 HD2 HIS 46 -11.808 16.462 -9.986 338 HE1 HIS 46 HE1 HIS 46 -14.656 13.332 -9.883 339 HE2 HIS 46 HE2 HIS 46 -13.448 14.997 -11.365 340 H VAL 47 HN VAL 47 -9.991 13.683 -4.430 341 HA VAL 47 HA VAL 47 -8.895 16.204 -3.406 342 HB VAL 47 HB VAL 47 -9.017 13.702 -1.771 343 1HG1 VAL 47 HG21 VAL 47 -8.383 16.433 -1.339 344 2HG1 VAL 47 HG22 VAL 47 -8.372 15.105 -0.179 345 3HG1 VAL 47 HG23 VAL 47 -9.837 16.058 -0.415 346 1HG2 VAL 47 HG11 VAL 47 -11.220 13.540 -2.154 347 2HG2 VAL 47 HG12 VAL 47 -11.314 15.152 -2.864 348 3HG2 VAL 47 HG13 VAL 47 -11.345 14.957 -1.111 349 H GLN 48 HN GLN 48 -7.322 15.398 -5.352 350 HA GLN 48 HA GLN 48 -5.233 13.645 -4.346 351 1HB GLN 48 HB2 GLN 48 -6.128 13.803 -6.791 352 2HB GLN 48 HB1 GLN 48 -5.062 15.196 -6.912 353 1HG GLN 48 HG2 GLN 48 -3.394 13.345 -5.838 354 2HG GLN 48 HG1 GLN 48 -4.435 12.337 -6.842 355 1HE2 GLN 48 HE22 GLN 48 -2.622 15.382 -6.980 356 2HE2 GLN 48 HE21 GLN 48 -2.072 15.180 -8.606 357 H GLY 49 HN GLY 49 -5.972 16.637 -3.581 358 1HA GLY 49 HA1 GLY 49 -3.452 17.974 -4.039 359 2HA GLY 49 HA2 GLY 49 -4.815 18.597 -3.121 360 H GLN 50 HN GLN 50 -4.731 15.894 -1.630 361 HA GLN 50 HA GLN 50 -2.747 16.783 0.336 362 1HB GLN 50 HB2 GLN 50 -5.293 15.238 0.488 363 2HB GLN 50 HB1 GLN 50 -4.057 14.908 1.693 364 1HG GLN 50 HG1 GLN 50 -4.157 17.642 1.687 365 2HG GLN 50 HG2 GLN 50 -5.839 17.195 1.409 366 1HE2 GLN 50 HE22 GLN 50 -6.650 17.740 3.363 367 2HE2 GLN 50 HE21 GLN 50 -6.201 16.974 4.845 368 H GLU 51 HN GLU 51 -0.887 15.744 0.526 369 HA GLU 51 HA GLU 51 -0.405 13.308 -0.926 370 1HB GLU 51 HB2 GLU 51 1.419 14.806 0.965 371 2HB GLU 51 HB1 GLU 51 1.901 13.555 -0.171 372 1HG GLU 51 HG1 GLU 51 2.096 15.018 -1.820 373 2HG GLU 51 HG2 GLU 51 0.489 15.674 -1.513 374 HA PRO 52 HA PRO 52 -1.234 10.626 2.515 375 1HB PRO 52 HB2 PRO 52 -0.427 8.307 1.447 376 2HB PRO 52 HB1 PRO 52 -1.861 9.148 0.848 377 1HG PRO 52 HG2 PRO 52 0.908 9.073 -0.287 378 2HG PRO 52 HG1 PRO 52 -0.650 8.966 -1.128 379 1HD PRO 52 HD2 PRO 52 0.851 11.262 -0.941 380 2HD PRO 52 HD1 PRO 52 -0.907 11.238 -1.185 381 H LEU 53 HN LEU 53 -0.155 9.168 3.999 382 HA LEU 53 HA LEU 53 2.546 10.002 4.576 383 1HB LEU 53 HB2 LEU 53 0.347 8.995 6.028 384 2HB LEU 53 HB1 LEU 53 1.627 7.814 6.196 385 HG LEU 53 HG LEU 53 1.364 9.695 7.963 386 1HD1 LEU 53 HD11 LEU 53 3.680 8.331 6.861 387 2HD1 LEU 53 HD12 LEU 53 3.173 8.546 8.538 388 3HD1 LEU 53 HD13 LEU 53 4.092 9.814 7.723 389 1HD2 LEU 53 HD21 LEU 53 1.894 11.786 7.470 390 2HD2 LEU 53 HD22 LEU 53 1.754 11.318 5.775 391 3HD2 LEU 53 HD23 LEU 53 3.329 11.298 6.569 392 H THR 54 HN THR 54 4.383 8.819 4.388 393 HA THR 54 HA THR 54 4.536 6.039 4.125 394 HB THR 54 HB THR 54 5.530 6.809 1.550 395 HG1 THR 54 HG1 THR 54 4.023 8.077 0.877 396 1HG2 THR 54 HG21 THR 54 3.390 4.923 2.469 397 2HG2 THR 54 HG22 THR 54 5.030 4.545 1.940 398 3HG2 THR 54 HG23 THR 54 3.837 5.118 0.775 399 H ALA 55 HN ALA 55 6.838 5.574 2.873 400 HA ALA 55 HA ALA 55 8.784 6.367 4.610 401 1HB ALA 55 HB1 ALA 55 8.992 4.526 2.998 402 2HB ALA 55 HB2 ALA 55 10.415 5.570 3.031 403 3HB ALA 55 HB3 ALA 55 9.250 5.706 1.712 404 H SER 56 HN SER 56 7.906 7.958 1.565 405 HA SER 56 HA SER 56 9.972 9.846 1.499 406 1HB SER 56 HB1 SER 56 7.129 10.139 0.492 407 2HB SER 56 HB2 SER 56 8.498 11.143 0.012 408 HG SER 56 HG SER 56 7.731 8.799 -0.994 409 H MET 57 HN MET 57 6.669 10.154 2.786 410 HA MET 57 HA MET 57 6.886 12.744 3.796 411 1HB MET 57 HB1 MET 57 5.224 10.371 4.620 412 2HB MET 57 HB2 MET 57 5.097 11.910 5.452 413 1HG MET 57 HG1 MET 57 3.590 11.155 3.336 414 2HG MET 57 HG2 MET 57 3.875 12.825 3.828 415 1HE MET 57 HE1 MET 57 3.993 10.177 1.538 416 2HE MET 57 HE2 MET 57 5.658 10.134 0.960 417 3HE MET 57 HE3 MET 57 4.414 10.940 0.005 418 H LEU 58 HN LEU 58 7.700 9.636 5.221 419 HA LEU 58 HA LEU 58 8.267 10.495 7.830 420 1HB LEU 58 HB1 LEU 58 9.552 8.231 6.304 421 2HB LEU 58 HB2 LEU 58 9.483 8.401 8.047 422 HG LEU 58 HG LEU 58 6.975 8.215 6.409 423 1HD1 LEU 58 HD21 LEU 58 7.179 6.028 6.042 424 2HD1 LEU 58 HD22 LEU 58 7.816 5.731 7.658 425 3HD1 LEU 58 HD23 LEU 58 8.901 6.247 6.365 426 1HD2 LEU 58 HD11 LEU 58 7.247 7.062 9.111 427 2HD2 LEU 58 HD12 LEU 58 5.901 7.934 8.374 428 3HD2 LEU 58 HD13 LEU 58 7.299 8.821 8.991 429 H ALA 59 HN ALA 59 10.321 10.154 4.976 430 HA ALA 59 HA ALA 59 12.768 10.811 6.191 431 1HB ALA 59 HB1 ALA 59 13.636 11.088 3.990 432 2HB ALA 59 HB2 ALA 59 12.025 11.361 3.325 433 3HB ALA 59 HB3 ALA 59 12.469 9.766 3.935 434 H SER 60 HN SER 60 10.057 12.730 5.461 435 HA SER 60 HA SER 60 11.406 15.224 5.082 436 1HB SER 60 HB1 SER 60 9.036 14.658 4.332 437 2HB SER 60 HB2 SER 60 8.555 14.871 6.016 438 HG SER 60 HG SER 60 8.911 16.736 4.162 439 H ALA 61 HN ALA 61 11.024 13.281 7.759 440 HA ALA 61 HA ALA 61 11.537 15.556 9.553 441 1HB ALA 61 HB1 ALA 61 10.280 14.077 11.299 442 2HB ALA 61 HB2 ALA 61 9.526 13.370 9.871 443 3HB ALA 61 HB3 ALA 61 9.368 15.098 10.187 444 HA PRO 62 HA PRO 62 14.738 12.036 9.668 445 1HB PRO 62 HB1 PRO 62 16.524 14.409 9.638 446 2HB PRO 62 HB2 PRO 62 16.676 12.868 8.788 447 1HG PRO 62 HG1 PRO 62 15.924 15.080 7.497 448 2HG PRO 62 HG2 PRO 62 15.218 13.502 7.103 449 1HD PRO 62 HD2 PRO 62 14.053 15.768 8.664 450 2HD PRO 62 HD1 PRO 62 13.259 14.642 7.544 451 HA PRO 63 HA PRO 63 16.059 13.861 13.793 452 1HB PRO 63 HB2 PRO 63 16.293 16.471 14.237 453 2HB PRO 63 HB1 PRO 63 17.411 15.648 13.142 454 1HG PRO 63 HG1 PRO 63 15.139 17.460 12.523 455 2HG PRO 63 HG2 PRO 63 16.651 17.209 11.636 456 1HD PRO 63 HD2 PRO 63 14.103 16.037 11.099 457 2HD PRO 63 HD1 PRO 63 15.642 15.703 10.281 458 H GLN 64 HN GLN 64 13.113 14.061 12.772 459 HA GLN 64 HA GLN 64 12.044 15.160 15.283 460 1HB GLN 64 HB2 GLN 64 10.799 15.387 12.538 461 2HB GLN 64 HB1 GLN 64 10.069 15.944 14.038 462 1HG GLN 64 HG2 GLN 64 12.766 16.969 13.373 463 2HG GLN 64 HG1 GLN 64 11.409 17.554 12.412 464 1HE2 GLN 64 HE22 GLN 64 9.464 18.194 13.805 465 2HE2 GLN 64 HE21 GLN 64 9.822 19.162 15.191 466 H GLU 65 HN GLU 65 10.005 13.823 12.797 467 HA GLU 65 HA GLU 65 9.354 11.621 14.625 468 1HB GLU 65 HB1 GLU 65 7.518 12.149 12.392 469 2HB GLU 65 HB2 GLU 65 7.174 11.900 14.098 470 1HG GLU 65 HG2 GLU 65 8.464 14.406 13.841 471 2HG GLU 65 HG1 GLU 65 7.199 14.321 12.617 472 H GLN 66 HN GLN 66 11.599 11.340 12.892 473 HA GLN 66 HA GLN 66 10.896 9.867 10.562 474 1HB GLN 66 HB1 GLN 66 13.267 10.844 11.726 475 2HB GLN 66 HB2 GLN 66 13.472 9.104 11.580 476 1HG GLN 66 HG1 GLN 66 12.567 9.494 9.164 477 2HG GLN 66 HG2 GLN 66 13.082 11.151 9.462 478 1HE2 GLN 66 HE21 GLN 66 14.241 9.808 7.446 479 2HE2 GLN 66 HE22 GLN 66 15.869 9.388 7.842 480 H LYS 67 HN LYS 67 10.987 9.109 13.872 481 HA LYS 67 HA LYS 67 10.555 6.271 13.240 482 1HB LYS 67 HB2 LYS 67 11.843 5.573 15.151 483 2HB LYS 67 HB1 LYS 67 12.845 6.627 14.163 484 1HG LYS 67 HG1 LYS 67 11.482 8.222 16.082 485 2HG LYS 67 HG2 LYS 67 12.229 6.853 16.908 486 1HD LYS 67 HD1 LYS 67 14.372 7.449 16.225 487 2HD LYS 67 HD2 LYS 67 13.773 8.459 14.906 488 1HE LYS 67 HE1 LYS 67 12.778 9.411 17.429 489 2HE LYS 67 HE2 LYS 67 14.535 9.273 17.480 490 1HZ LYS 67 HZ1 LYS 67 13.540 10.467 15.059 491 2HZ LYS 67 HZ2 LYS 67 14.777 10.983 16.090 492 3HZ LYS 67 HZ3 LYS 67 13.168 11.359 16.447 493 H GLN 68 HN GLN 68 8.789 8.630 13.877 494 HA GLN 68 HA GLN 68 7.366 7.359 16.119 495 1HB GLN 68 HB2 GLN 68 8.514 9.427 16.854 496 2HB GLN 68 HB1 GLN 68 7.612 10.334 15.649 497 1HG GLN 68 HG1 GLN 68 5.516 9.469 16.809 498 2HG GLN 68 HG2 GLN 68 6.587 8.984 18.123 499 1HE2 GLN 68 HE21 GLN 68 5.052 11.604 16.502 500 2HE2 GLN 68 HE22 GLN 68 5.526 12.847 17.604 501 H MET 69 HN MET 69 6.944 9.744 13.484 502 HA MET 69 HA MET 69 4.108 9.380 13.457 503 1HB MET 69 HB2 MET 69 4.045 11.024 11.777 504 2HB MET 69 HB1 MET 69 5.372 11.494 12.831 505 1HG MET 69 HG2 MET 69 6.881 11.308 11.204 506 2HG MET 69 HG1 MET 69 6.208 9.785 10.627 507 1HE MET 69 HE1 MET 69 6.861 13.405 9.420 508 2HE MET 69 HE2 MET 69 6.524 12.751 7.817 509 3HE MET 69 HE3 MET 69 7.555 11.857 8.935 510 H LEU 70 HN LEU 70 6.080 7.116 12.716 511 HA LEU 70 HA LEU 70 5.171 6.453 10.028 512 1HB LEU 70 HB1 LEU 70 6.518 4.244 11.045 513 2HB LEU 70 HB2 LEU 70 7.180 5.474 9.985 514 HG LEU 70 HG LEU 70 7.231 5.736 12.982 515 1HD1 LEU 70 HD11 LEU 70 9.267 4.673 13.128 516 2HD1 LEU 70 HD12 LEU 70 9.601 4.845 11.405 517 3HD1 LEU 70 HD13 LEU 70 8.418 3.660 11.960 518 1HD2 LEU 70 HD21 LEU 70 9.265 7.163 12.232 519 2HD2 LEU 70 HD22 LEU 70 7.632 7.815 12.095 520 3HD2 LEU 70 HD23 LEU 70 8.450 7.170 10.669 521 H GLY 71 HN GLY 71 4.556 5.682 13.339 522 1HA GLY 71 HA2 GLY 71 2.380 3.921 12.459 523 2HA GLY 71 HA1 GLY 71 3.428 3.414 13.771 524 H GLU 72 HN GLU 72 2.972 6.766 13.694 525 HA GLU 72 HA GLU 72 0.714 6.607 15.579 526 1HB GLU 72 HB1 GLU 72 3.245 8.226 15.910 527 2HB GLU 72 HB2 GLU 72 1.819 8.394 16.926 528 1HG GLU 72 HG2 GLU 72 2.189 5.785 17.217 529 2HG GLU 72 HG1 GLU 72 3.850 6.242 16.840 530 H ARG 73 HN ARG 73 1.735 7.822 12.706 531 HA ARG 73 HA ARG 73 -0.087 10.127 12.917 532 1HB ARG 73 HB1 ARG 73 2.535 10.488 12.604 533 2HB ARG 73 HB2 ARG 73 2.113 10.209 10.920 534 1HG ARG 73 HG1 ARG 73 0.409 12.128 12.365 535 2HG ARG 73 HG2 ARG 73 2.081 12.624 12.095 536 1HD ARG 73 HD2 ARG 73 1.663 11.857 9.660 537 2HD ARG 73 HD1 ARG 73 -0.044 11.970 10.089 538 HE ARG 73 HE ARG 73 0.289 14.323 10.504 539 1HH1 ARG 73 HH22 ARG 73 2.889 12.678 8.865 540 2HH1 ARG 73 HH21 ARG 73 3.548 14.126 8.183 541 1HH2 ARG 73 HH11 ARG 73 1.152 16.236 9.609 542 2HH2 ARG 73 HH12 ARG 73 2.561 16.147 8.606 543 H LEU 74 HN LEU 74 0.920 7.315 11.235 544 HA LEU 74 HA LEU 74 -0.435 7.864 8.770 545 1HB LEU 74 HB1 LEU 74 1.113 5.680 9.950 546 2HB LEU 74 HB2 LEU 74 -0.205 5.131 8.935 547 HG LEU 74 HG LEU 74 1.429 7.265 7.781 548 1HD1 LEU 74 HD11 LEU 74 2.861 4.869 7.311 549 2HD1 LEU 74 HD12 LEU 74 2.729 5.104 9.053 550 3HD1 LEU 74 HD13 LEU 74 3.428 6.369 8.044 551 1HD2 LEU 74 HD21 LEU 74 1.278 5.720 5.826 552 2HD2 LEU 74 HD22 LEU 74 -0.279 6.234 6.476 553 3HD2 LEU 74 HD23 LEU 74 0.340 4.624 6.840 554 H PHE 75 HN PHE 75 -1.384 6.908 11.849 555 HA PHE 75 HA PHE 75 -3.325 5.068 11.666 556 1HB PHE 75 HB1 PHE 75 -2.619 6.423 13.689 557 2HB PHE 75 HB2 PHE 75 -3.775 7.642 13.171 558 HD1 PHE 75 HD1 PHE 75 -4.381 4.051 12.756 559 HD2 PHE 75 HD2 PHE 75 -5.114 7.496 15.149 560 HE1 PHE 75 HE1 PHE 75 -6.163 2.847 13.948 561 HE2 PHE 75 HE2 PHE 75 -6.899 6.296 16.342 562 HZ PHE 75 HZ PHE 75 -7.425 3.966 15.741 563 HA PRO 76 HA PRO 76 -6.715 8.118 10.094 564 1HB PRO 76 HB1 PRO 76 -5.296 10.463 9.067 565 2HB PRO 76 HB2 PRO 76 -6.653 10.384 10.191 566 1HG PRO 76 HG1 PRO 76 -4.176 11.115 10.970 567 2HG PRO 76 HG2 PRO 76 -5.289 10.237 12.037 568 1HD PRO 76 HD1 PRO 76 -2.971 9.197 10.447 569 2HD PRO 76 HD2 PRO 76 -3.469 8.799 12.105 570 H LEU 77 HN LEU 77 -3.605 7.899 8.560 571 HA LEU 77 HA LEU 77 -4.596 8.188 5.882 572 1HB LEU 77 HB1 LEU 77 -1.952 7.397 7.067 573 2HB LEU 77 HB2 LEU 77 -2.243 7.260 5.349 574 HG LEU 77 HG LEU 77 -1.258 9.313 5.403 575 1HD1 LEU 77 HD21 LEU 77 -4.121 10.023 6.026 576 2HD1 LEU 77 HD22 LEU 77 -3.458 9.664 4.432 577 3HD1 LEU 77 HD23 LEU 77 -2.926 11.102 5.304 578 1HD2 LEU 77 HD11 LEU 77 -0.969 9.247 7.850 579 2HD2 LEU 77 HD12 LEU 77 -2.590 9.918 8.031 580 3HD2 LEU 77 HD13 LEU 77 -1.330 10.861 7.235 581 H ILE 78 HN ILE 78 -3.967 5.496 8.052 582 HA ILE 78 HA ILE 78 -3.985 3.483 6.051 583 HB ILE 78 HB ILE 78 -4.859 2.952 8.860 584 1HG1 ILE 78 HG12 ILE 78 -2.837 4.407 8.924 585 2HG1 ILE 78 HG11 ILE 78 -2.548 2.792 9.563 586 1HG2 ILE 78 HG21 ILE 78 -4.928 0.933 7.870 587 2HG2 ILE 78 HG22 ILE 78 -3.180 0.964 8.114 588 3HG2 ILE 78 HG23 ILE 78 -3.862 1.431 6.554 589 1HD1 ILE 78 HD11 ILE 78 -1.327 2.149 7.673 590 2HD1 ILE 78 HD12 ILE 78 -0.765 3.772 8.073 591 3HD1 ILE 78 HD13 ILE 78 -1.889 3.533 6.735 592 H GLN 79 HN GLN 79 -6.476 4.849 8.156 593 HA GLN 79 HA GLN 79 -8.619 3.192 7.580 594 1HB GLN 79 HB1 GLN 79 -8.279 6.016 8.400 595 2HB GLN 79 HB2 GLN 79 -9.831 5.623 7.678 596 1HG GLN 79 HG1 GLN 79 -10.020 3.757 9.344 597 2HG GLN 79 HG2 GLN 79 -8.586 4.413 10.130 598 1HE2 GLN 79 HE22 GLN 79 -8.847 6.965 10.320 599 2HE2 GLN 79 HE21 GLN 79 -10.308 7.446 11.106 600 H ALA 80 HN ALA 80 -6.900 5.267 5.531 601 HA ALA 80 HA ALA 80 -8.968 5.630 3.545 602 1HB ALA 80 HB1 ALA 80 -6.062 6.092 3.017 603 2HB ALA 80 HB2 ALA 80 -6.947 7.182 4.087 604 3HB ALA 80 HB3 ALA 80 -7.467 6.976 2.414 605 H MET 81 HN MET 81 -6.069 3.657 3.994 606 HA MET 81 HA MET 81 -6.152 2.423 1.423 607 1HB MET 81 HB1 MET 81 -4.910 1.153 3.849 608 2HB MET 81 HB2 MET 81 -4.377 1.075 2.176 609 1HG MET 81 HG2 MET 81 -3.248 3.022 2.303 610 2HG MET 81 HG1 MET 81 -4.389 3.748 3.428 611 1HE MET 81 HE1 MET 81 -0.370 2.619 4.114 612 2HE MET 81 HE2 MET 81 -1.305 2.432 2.629 613 3HE MET 81 HE3 MET 81 -1.043 1.042 3.688 614 H HIS 82 HN HIS 82 -7.261 1.512 4.638 615 HA HIS 82 HA HIS 82 -8.841 -0.667 3.440 616 1HB HIS 82 HB1 HIS 82 -7.237 -0.478 5.943 617 2HB HIS 82 HB2 HIS 82 -8.727 -1.409 6.015 618 HD2 HIS 82 HD2 HIS 82 -5.983 -1.394 3.176 619 HE1 HIS 82 HE1 HIS 82 -6.585 -5.328 4.609 620 HE2 HIS 82 HE2 HIS 82 -5.352 -3.896 2.916 621 HA PRO 83 HA PRO 83 -12.521 1.393 4.807 622 1HB PRO 83 HB1 PRO 83 -14.014 -0.760 5.653 623 2HB PRO 83 HB2 PRO 83 -13.849 -0.263 3.966 624 1HG PRO 83 HG2 PRO 83 -12.404 -2.413 5.461 625 2HG PRO 83 HG1 PRO 83 -13.044 -2.433 3.807 626 1HD PRO 83 HD1 PRO 83 -10.428 -2.078 4.299 627 2HD PRO 83 HD2 PRO 83 -11.244 -1.239 2.963 628 H THR 84 HN THR 84 -11.155 2.264 6.589 629 HA THR 84 HA THR 84 -10.626 2.654 8.762 630 HB THR 84 HB THR 84 -12.493 2.860 10.229 631 HG1 THR 84 HG1 THR 84 -14.200 1.583 10.177 632 1HG2 THR 84 HG21 THR 84 -14.134 4.002 8.984 633 2HG2 THR 84 HG22 THR 84 -13.746 3.105 7.516 634 3HG2 THR 84 HG23 THR 84 -12.596 4.274 8.164 635 H LEU 85 HN LEU 85 -9.863 0.076 7.819 636 HA LEU 85 HA LEU 85 -10.417 -1.788 9.975 637 1HB LEU 85 HB1 LEU 85 -9.527 -1.957 7.249 638 2HB LEU 85 HB2 LEU 85 -8.405 -2.812 8.289 639 HG LEU 85 HG LEU 85 -10.494 -3.976 9.255 640 1HD1 LEU 85 HD21 LEU 85 -12.495 -3.612 8.358 641 2HD1 LEU 85 HD22 LEU 85 -11.867 -3.752 6.716 642 3HD1 LEU 85 HD23 LEU 85 -11.785 -2.207 7.564 643 1HD2 LEU 85 HD11 LEU 85 -8.858 -4.498 6.962 644 2HD2 LEU 85 HD12 LEU 85 -10.475 -5.152 6.706 645 3HD2 LEU 85 HD13 LEU 85 -9.546 -5.631 8.126 646 H ALA 86 HN ALA 86 -8.457 0.762 9.748 647 HA ALA 86 HA ALA 86 -5.904 -0.162 10.488 648 1HB ALA 86 HB1 ALA 86 -5.386 2.064 11.016 649 2HB ALA 86 HB2 ALA 86 -7.065 2.458 11.384 650 3HB ALA 86 HB3 ALA 86 -6.574 2.165 9.715 651 H GLY 87 HN GLY 87 -6.789 1.947 12.944 652 1HA GLY 87 HA2 GLY 87 -7.050 1.712 15.209 653 2HA GLY 87 HA1 GLY 87 -7.919 0.227 14.855 654 H LYS 88 HN LYS 88 -4.976 -0.194 13.465 655 HA LYS 88 HA LYS 88 -3.274 -0.690 15.639 656 1HB LYS 88 HB1 LYS 88 -4.898 -2.388 16.240 657 2HB LYS 88 HB2 LYS 88 -4.845 -3.061 14.619 658 1HG LYS 88 HG2 LYS 88 -3.590 -4.429 16.180 659 2HG LYS 88 HG1 LYS 88 -2.525 -3.723 14.958 660 1HD LYS 88 HD1 LYS 88 -2.623 -1.887 17.090 661 2HD LYS 88 HD2 LYS 88 -2.407 -3.485 17.812 662 1HE LYS 88 HE2 LYS 88 -0.766 -3.315 15.513 663 2HE LYS 88 HE1 LYS 88 -0.486 -1.867 16.471 664 1HZ LYS 88 HZ1 LYS 88 0.354 -4.538 16.968 665 2HZ LYS 88 HZ2 LYS 88 -0.532 -3.942 18.280 666 3HZ LYS 88 HZ3 LYS 88 0.835 -3.108 17.734 667 H ILE 89 HN ILE 89 -4.126 -1.086 12.291 668 HA ILE 89 HA ILE 89 -2.122 -2.634 11.297 669 HB ILE 89 HB ILE 89 -3.168 -0.122 10.002 670 1HG1 ILE 89 HG12 ILE 89 -4.100 -2.982 9.660 671 2HG1 ILE 89 HG11 ILE 89 -4.887 -1.826 10.729 672 1HG2 ILE 89 HG21 ILE 89 -2.590 -1.959 8.035 673 2HG2 ILE 89 HG22 ILE 89 -1.258 -2.157 9.175 674 3HG2 ILE 89 HG23 ILE 89 -1.597 -0.571 8.478 675 1HD1 ILE 89 HD11 ILE 89 -6.042 -2.045 8.587 676 2HD1 ILE 89 HD12 ILE 89 -4.582 -1.511 7.753 677 3HD1 ILE 89 HD13 ILE 89 -5.427 -0.411 8.840 678 H THR 90 HN THR 90 -1.771 0.833 10.701 679 HA THR 90 HA THR 90 1.003 0.801 10.447 680 HB THR 90 HB THR 90 -1.078 2.712 10.392 681 HG1 THR 90 HG1 THR 90 1.482 3.524 9.764 682 1HG2 THR 90 HG21 THR 90 1.029 3.438 12.335 683 2HG2 THR 90 HG22 THR 90 -0.673 3.900 12.274 684 3HG2 THR 90 HG23 THR 90 0.487 4.663 11.185 685 H GLY 91 HN GLY 91 -0.981 1.272 13.344 686 1HA GLY 91 HA2 GLY 91 1.064 2.052 15.115 687 2HA GLY 91 HA1 GLY 91 -0.399 1.184 15.571 688 H MET 92 HN MET 92 0.186 -0.988 13.716 689 HA MET 92 HA MET 92 1.830 -2.616 15.439 690 1HB MET 92 HB1 MET 92 -0.236 -3.220 13.809 691 2HB MET 92 HB2 MET 92 1.101 -3.573 12.724 692 1HG MET 92 HG1 MET 92 1.796 -5.356 13.917 693 2HG MET 92 HG2 MET 92 1.275 -4.678 15.456 694 1HE MET 92 HE1 MET 92 0.071 -5.488 12.085 695 2HE MET 92 HE2 MET 92 -1.667 -5.372 12.363 696 3HE MET 92 HE3 MET 92 -0.888 -6.953 12.296 697 H LEU 93 HN LEU 93 2.079 -1.023 12.364 698 HA LEU 93 HA LEU 93 4.324 -2.220 11.308 699 1HB LEU 93 HB2 LEU 93 3.028 0.421 11.041 700 2HB LEU 93 HB1 LEU 93 4.611 0.221 10.327 701 HG LEU 93 HG LEU 93 2.801 -0.176 8.700 702 1HD1 LEU 93 HD11 LEU 93 4.704 -2.335 9.473 703 2HD1 LEU 93 HD12 LEU 93 4.685 -1.307 8.039 704 3HD1 LEU 93 HD13 LEU 93 3.539 -2.640 8.182 705 1HD2 LEU 93 HD21 LEU 93 0.952 -1.085 9.607 706 2HD2 LEU 93 HD22 LEU 93 1.853 -1.958 10.848 707 3HD2 LEU 93 HD23 LEU 93 1.744 -2.609 9.210 708 H LEU 94 HN LEU 94 4.139 -0.435 14.138 709 HA LEU 94 HA LEU 94 7.011 0.205 14.042 710 1HB LEU 94 HB1 LEU 94 4.695 1.493 15.277 711 2HB LEU 94 HB2 LEU 94 6.043 1.291 16.380 712 HG LEU 94 HG LEU 94 7.505 2.484 14.781 713 1HD1 LEU 94 HD11 LEU 94 4.946 2.830 13.224 714 2HD1 LEU 94 HD12 LEU 94 6.402 1.976 12.707 715 3HD1 LEU 94 HD13 LEU 94 6.437 3.727 12.922 716 1HD2 LEU 94 HD21 LEU 94 5.257 4.362 15.108 717 2HD2 LEU 94 HD22 LEU 94 6.942 4.502 15.612 718 3HD2 LEU 94 HD23 LEU 94 5.811 3.546 16.570 719 H GLU 95 HN GLU 95 5.769 -2.408 14.374 720 HA GLU 95 HA GLU 95 7.320 -3.397 16.521 721 1HB GLU 95 HB2 GLU 95 5.695 -3.980 18.128 722 2HB GLU 95 HB1 GLU 95 5.341 -2.309 17.709 723 1HG GLU 95 HG1 GLU 95 3.463 -2.915 16.429 724 2HG GLU 95 HG2 GLU 95 3.929 -4.615 16.412 725 H ILE 96 HN ILE 96 5.737 -3.790 13.674 726 HA ILE 96 HA ILE 96 4.749 -6.423 13.788 727 HB ILE 96 HB ILE 96 4.909 -6.518 11.399 728 1HG1 ILE 96 HG12 ILE 96 7.220 -5.630 11.246 729 2HG1 ILE 96 HG11 ILE 96 6.117 -4.965 10.049 730 1HG2 ILE 96 HG21 ILE 96 3.700 -4.320 12.755 731 2HG2 ILE 96 HG22 ILE 96 3.142 -5.208 11.336 732 3HG2 ILE 96 HG23 ILE 96 4.216 -3.823 11.139 733 1HD1 ILE 96 HD11 ILE 96 6.528 -2.915 10.718 734 2HD1 ILE 96 HD12 ILE 96 7.788 -3.574 11.763 735 3HD1 ILE 96 HD13 ILE 96 6.160 -3.328 12.396 736 H ASP 97 HN ASP 97 6.230 -7.445 11.482 737 HA ASP 97 HA ASP 97 8.056 -9.180 12.622 738 1HB ASP 97 HB1 ASP 97 6.901 -9.128 10.282 739 2HB ASP 97 HB2 ASP 97 8.304 -8.181 9.793 740 H ASN 98 HN ASN 98 8.328 -5.889 12.134 741 HA ASN 98 HA ASN 98 9.971 -4.424 12.641 742 1HB ASN 98 HB1 ASN 98 11.162 -6.892 13.520 743 2HB ASN 98 HB2 ASN 98 12.380 -5.883 12.745 744 1HD2 ASN 98 HD22 ASN 98 12.268 -3.526 13.439 745 2HD2 ASN 98 HD21 ASN 98 12.084 -3.245 15.134 746 H SER 99 HN SER 99 10.288 -6.824 10.202 747 HA SER 99 HA SER 99 12.312 -5.476 8.679 748 1HB SER 99 HB1 SER 99 10.335 -7.387 7.471 749 2HB SER 99 HB2 SER 99 12.038 -7.147 7.076 750 HG SER 99 HG SER 99 12.525 -8.607 8.497 751 H GLU 100 HN GLU 100 8.850 -5.401 8.952 752 HA GLU 100 HA GLU 100 8.371 -3.850 6.587 753 1HB GLU 100 HB1 GLU 100 6.670 -4.320 9.027 754 2HB GLU 100 HB2 GLU 100 6.135 -3.488 7.584 755 1HG GLU 100 HG2 GLU 100 5.302 -5.588 7.265 756 2HG GLU 100 HG1 GLU 100 6.819 -5.653 6.365 757 H LEU 101 HN LEU 101 9.056 -3.225 9.954 758 HA LEU 101 HA LEU 101 8.442 -0.463 9.957 759 1HB LEU 101 HB1 LEU 101 8.744 -1.891 11.986 760 2HB LEU 101 HB2 LEU 101 10.462 -1.933 11.656 761 HG LEU 101 HG LEU 101 9.478 -0.267 13.422 762 1HD1 LEU 101 HD21 LEU 101 11.431 0.934 13.292 763 2HD1 LEU 101 HD22 LEU 101 11.423 0.967 11.530 764 3HD1 LEU 101 HD23 LEU 101 11.851 -0.516 12.382 765 1HD2 LEU 101 HD11 LEU 101 8.729 1.794 12.686 766 2HD2 LEU 101 HD12 LEU 101 7.918 0.673 11.592 767 3HD2 LEU 101 HD13 LEU 101 9.349 1.552 11.052 768 H LEU 102 HN LEU 102 11.097 -2.311 8.766 769 HA LEU 102 HA LEU 102 12.865 -0.010 8.543 770 1HB LEU 102 HB2 LEU 102 13.117 -2.919 8.373 771 2HB LEU 102 HB1 LEU 102 14.016 -2.080 7.122 772 HG LEU 102 HG LEU 102 14.973 -0.661 9.069 773 1HD1 LEU 102 HD21 LEU 102 13.225 -2.266 10.524 774 2HD1 LEU 102 HD22 LEU 102 14.482 -1.207 11.164 775 3HD1 LEU 102 HD23 LEU 102 14.830 -2.909 10.867 776 1HD2 LEU 102 HD11 LEU 102 16.280 -2.219 7.726 777 2HD2 LEU 102 HD12 LEU 102 15.733 -3.559 8.734 778 3HD2 LEU 102 HD13 LEU 102 16.752 -2.295 9.423 779 H HIS 103 HN HIS 103 11.212 -2.274 6.363 780 HA HIS 103 HA HIS 103 12.084 -0.998 4.006 781 1HB HIS 103 HB1 HIS 103 10.752 -3.335 4.654 782 2HB HIS 103 HB2 HIS 103 9.530 -2.408 3.798 783 HD2 HIS 103 HD2 HIS 103 11.577 -1.093 1.542 784 HE1 HIS 103 HE1 HIS 103 12.287 -5.162 0.615 785 HE2 HIS 103 HE2 HIS 103 12.491 -2.773 -0.213 786 H MET 104 HN MET 104 9.218 -0.605 6.025 787 HA MET 104 HA MET 104 7.699 0.997 4.304 788 1HB MET 104 HB2 MET 104 6.426 1.631 6.223 789 2HB MET 104 HB1 MET 104 6.904 -0.048 6.444 790 1HG MET 104 HG1 MET 104 8.025 0.418 8.301 791 2HG MET 104 HG2 MET 104 8.833 1.790 7.551 792 1HE MET 104 HE1 MET 104 4.706 2.137 7.723 793 2HE MET 104 HE2 MET 104 4.706 1.750 9.446 794 3HE MET 104 HE3 MET 104 5.401 0.614 8.282 795 H LEU 105 HN LEU 105 10.354 1.808 6.466 796 HA LEU 105 HA LEU 105 10.027 4.665 5.994 797 1HB LEU 105 HB1 LEU 105 12.370 3.358 7.354 798 2HB LEU 105 HB2 LEU 105 11.784 4.998 7.543 799 HG LEU 105 HG LEU 105 10.287 2.558 8.493 800 1HD1 LEU 105 HD11 LEU 105 12.633 3.590 9.550 801 2HD1 LEU 105 HD12 LEU 105 11.473 2.549 10.375 802 3HD1 LEU 105 HD13 LEU 105 11.357 4.301 10.538 803 1HD2 LEU 105 HD21 LEU 105 9.800 5.187 9.682 804 2HD2 LEU 105 HD22 LEU 105 8.662 3.937 9.178 805 3HD2 LEU 105 HD23 LEU 105 9.336 5.047 7.987 806 H GLU 106 HN GLU 106 11.457 2.017 4.536 807 HA GLU 106 HA GLU 106 13.564 3.612 3.311 808 1HB GLU 106 HB2 GLU 106 13.107 0.678 3.742 809 2HB GLU 106 HB1 GLU 106 14.235 1.208 2.493 810 1HG GLU 106 HG2 GLU 106 14.346 1.791 5.432 811 2HG GLU 106 HG1 GLU 106 15.420 0.730 4.522 812 H SER 107 HN SER 107 10.467 2.568 2.595 813 HA SER 107 HA SER 107 10.897 3.134 -0.240 814 1HB SER 107 HB2 SER 107 10.894 0.556 0.453 815 2HB SER 107 HB1 SER 107 9.152 0.802 0.353 816 HG SER 107 HG SER 107 9.381 1.431 -1.775 817 HA PRO 108 HA PRO 108 7.133 5.396 0.497 818 1HB PRO 108 HB1 PRO 108 6.635 6.129 -2.065 819 2HB PRO 108 HB2 PRO 108 7.891 6.886 -1.079 820 1HG PRO 108 HG2 PRO 108 8.145 4.747 -3.159 821 2HG PRO 108 HG1 PRO 108 9.163 6.175 -2.894 822 1HD PRO 108 HD1 PRO 108 9.870 3.703 -2.043 823 2HD PRO 108 HD2 PRO 108 10.328 5.181 -1.172 824 H GLU 109 HN GLU 109 7.402 2.419 -0.869 825 HA GLU 109 HA GLU 109 4.490 2.207 -1.289 826 1HB GLU 109 HB2 GLU 109 6.645 0.672 -2.761 827 2HB GLU 109 HB1 GLU 109 4.911 0.493 -2.991 828 1HG GLU 109 HG1 GLU 109 5.014 3.043 -3.542 829 2HG GLU 109 HG2 GLU 109 6.719 2.702 -3.839 830 H SER 110 HN SER 110 7.273 1.112 0.336 831 HA SER 110 HA SER 110 6.367 -1.510 0.991 832 1HB SER 110 HB1 SER 110 8.682 0.078 1.534 833 2HB SER 110 HB2 SER 110 8.057 -0.575 3.050 834 HG SER 110 HG SER 110 7.956 -2.635 1.752 835 H LEU 111 HN LEU 111 6.322 1.597 2.637 836 HA LEU 111 HA LEU 111 5.161 0.798 5.014 837 1HB LEU 111 HB1 LEU 111 6.058 3.050 4.509 838 2HB LEU 111 HB2 LEU 111 4.650 3.359 3.509 839 HG LEU 111 HG LEU 111 4.044 2.508 6.252 840 1HD1 LEU 111 HD11 LEU 111 6.075 4.427 5.870 841 2HD1 LEU 111 HD12 LEU 111 5.246 3.975 7.368 842 3HD1 LEU 111 HD13 LEU 111 4.616 5.289 6.374 843 1HD2 LEU 111 HD21 LEU 111 2.394 3.255 4.548 844 2HD2 LEU 111 HD22 LEU 111 3.116 4.863 4.623 845 3HD2 LEU 111 HD23 LEU 111 2.342 4.174 6.052 846 H ARG 112 HN ARG 112 3.760 1.170 1.863 847 HA ARG 112 HA ARG 112 1.047 1.054 2.878 848 1HB ARG 112 HB2 ARG 112 0.812 2.317 1.043 849 2HB ARG 112 HB1 ARG 112 2.346 1.778 0.369 850 1HG ARG 112 HG1 ARG 112 1.307 -0.186 -0.541 851 2HG ARG 112 HG2 ARG 112 -0.225 0.222 0.238 852 1HD ARG 112 HD2 ARG 112 -0.764 1.745 -1.327 853 2HD ARG 112 HD1 ARG 112 0.890 2.342 -1.458 854 HE ARG 112 HE ARG 112 1.058 -0.043 -2.675 855 1HH1 ARG 112 HH12 ARG 112 -1.193 2.596 -3.025 856 2HH1 ARG 112 HH11 ARG 112 -1.505 2.276 -4.698 857 1HH2 ARG 112 HH21 ARG 112 0.651 -0.470 -4.877 858 2HH2 ARG 112 HH22 ARG 112 -0.457 0.533 -5.751 859 H SER 113 HN SER 113 3.103 -0.951 0.758 860 HA SER 113 HA SER 113 1.256 -3.064 0.506 861 1HB SER 113 HB2 SER 113 3.107 -2.810 -1.061 862 2HB SER 113 HB1 SER 113 4.273 -3.081 0.235 863 HG SER 113 HG SER 113 3.997 -5.009 -0.827 864 H LYS 114 HN LYS 114 3.701 -2.325 2.885 865 HA LYS 114 HA LYS 114 3.529 -4.893 4.182 866 1HB LYS 114 HB1 LYS 114 4.818 -2.323 5.120 867 2HB LYS 114 HB2 LYS 114 4.991 -3.894 5.891 868 1HG LYS 114 HG1 LYS 114 5.853 -3.267 3.078 869 2HG LYS 114 HG2 LYS 114 6.920 -3.263 4.483 870 1HD LYS 114 HD2 LYS 114 7.015 -5.515 4.578 871 2HD LYS 114 HD1 LYS 114 5.319 -5.706 4.127 872 1HE LYS 114 HE2 LYS 114 6.578 -6.626 2.353 873 2HE LYS 114 HE1 LYS 114 5.994 -5.063 1.784 874 1HZ LYS 114 HZ1 LYS 114 8.215 -5.108 1.159 875 2HZ LYS 114 HZ2 LYS 114 8.727 -5.814 2.608 876 3HZ LYS 114 HZ3 LYS 114 8.240 -4.195 2.583 877 H VAL 115 HN VAL 115 2.036 -1.747 4.455 878 HA VAL 115 HA VAL 115 0.914 -2.191 7.056 879 HB VAL 115 HB VAL 115 0.711 -0.090 5.017 880 1HG1 VAL 115 HG11 VAL 115 -1.444 0.735 5.539 881 2HG1 VAL 115 HG12 VAL 115 -1.658 -0.429 6.845 882 3HG1 VAL 115 HG13 VAL 115 -1.670 -0.974 5.168 883 1HG2 VAL 115 HG21 VAL 115 1.594 -0.327 7.596 884 2HG2 VAL 115 HG22 VAL 115 0.071 0.542 7.787 885 3HG2 VAL 115 HG23 VAL 115 1.329 1.188 6.731 886 H ASP 116 HN ASP 116 -0.353 -2.383 3.742 887 HA ASP 116 HA ASP 116 -2.886 -3.388 4.333 888 1HB ASP 116 HB1 ASP 116 -1.836 -2.607 2.070 889 2HB ASP 116 HB2 ASP 116 -1.363 -4.296 1.907 890 H GLU 117 HN GLU 117 0.209 -5.026 3.935 891 HA GLU 117 HA GLU 117 -0.879 -7.670 4.162 892 1HB GLU 117 HB1 GLU 117 1.876 -6.490 4.158 893 2HB GLU 117 HB2 GLU 117 1.653 -8.138 4.728 894 1HG GLU 117 HG2 GLU 117 0.318 -7.614 2.195 895 2HG GLU 117 HG1 GLU 117 2.063 -7.366 2.130 896 H ALA 118 HN ALA 118 0.255 -5.204 6.334 897 HA ALA 118 HA ALA 118 0.512 -6.892 8.625 898 1HB ALA 118 HB1 ALA 118 0.831 -4.935 9.895 899 2HB ALA 118 HB2 ALA 118 0.026 -3.929 8.688 900 3HB ALA 118 HB3 ALA 118 1.606 -4.633 8.338 901 H VAL 119 HN VAL 119 -2.079 -5.384 6.953 902 HA VAL 119 HA VAL 119 -3.994 -5.291 9.044 903 HB VAL 119 HB VAL 119 -4.585 -5.753 6.136 904 1HG1 VAL 119 HG11 VAL 119 -6.132 -4.636 8.462 905 2HG1 VAL 119 HG12 VAL 119 -6.494 -6.079 7.512 906 3HG1 VAL 119 HG13 VAL 119 -6.654 -4.477 6.787 907 1HG2 VAL 119 HG21 VAL 119 -3.849 -3.243 7.599 908 2HG2 VAL 119 HG22 VAL 119 -4.840 -3.208 6.141 909 3HG2 VAL 119 HG23 VAL 119 -3.205 -3.870 6.083 910 H ALA 120 HN ALA 120 -3.220 -7.636 6.533 911 HA ALA 120 HA ALA 120 -5.095 -9.601 7.221 912 1HB ALA 120 HB1 ALA 120 -2.601 -10.724 6.287 913 2HB ALA 120 HB2 ALA 120 -3.036 -9.289 5.353 914 3HB ALA 120 HB3 ALA 120 -4.165 -10.643 5.474 915 H VAL 121 HN VAL 121 -2.085 -8.620 8.587 916 HA VAL 121 HA VAL 121 -1.745 -10.958 10.243 917 HB VAL 121 HB VAL 121 -0.256 -8.375 9.893 918 1HG1 VAL 121 HG21 VAL 121 1.259 -9.924 11.634 919 2HG1 VAL 121 HG22 VAL 121 -0.370 -9.937 12.310 920 3HG1 VAL 121 HG23 VAL 121 0.441 -8.403 11.993 921 1HG2 VAL 121 HG11 VAL 121 0.695 -11.227 9.719 922 2HG2 VAL 121 HG12 VAL 121 1.526 -9.776 9.158 923 3HG2 VAL 121 HG13 VAL 121 0.057 -10.320 8.346 924 H LEU 122 HN LEU 122 -3.068 -7.739 10.500 925 HA LEU 122 HA LEU 122 -3.252 -7.733 13.362 926 1HB LEU 122 HB2 LEU 122 -3.611 -5.563 13.011 927 2HB LEU 122 HB1 LEU 122 -3.588 -5.855 11.284 928 HG LEU 122 HG LEU 122 -6.175 -6.554 12.065 929 1HD1 LEU 122 HD11 LEU 122 -5.038 -4.610 13.902 930 2HD1 LEU 122 HD12 LEU 122 -6.543 -5.524 14.007 931 3HD1 LEU 122 HD13 LEU 122 -6.487 -4.021 13.086 932 1HD2 LEU 122 HD21 LEU 122 -6.764 -4.405 10.919 933 2HD2 LEU 122 HD22 LEU 122 -5.703 -5.474 10.003 934 3HD2 LEU 122 HD23 LEU 122 -5.037 -4.062 10.823 935 H GLN 123 HN GLN 123 -5.372 -8.490 10.666 936 HA GLN 123 HA GLN 123 -7.739 -8.910 12.155 937 1HB GLN 123 HB1 GLN 123 -6.803 -9.884 9.455 938 2HB GLN 123 HB2 GLN 123 -8.387 -10.292 10.103 939 1HG GLN 123 HG2 GLN 123 -7.973 -7.472 10.302 940 2HG GLN 123 HG1 GLN 123 -7.627 -8.005 8.658 941 1HE2 GLN 123 HE22 GLN 123 -9.268 -9.108 7.494 942 2HE2 GLN 123 HE21 GLN 123 -10.934 -8.873 7.884 943 H ALA 124 HN ALA 124 -4.959 -10.869 11.409 944 HA ALA 124 HA ALA 124 -6.107 -13.357 12.313 945 1HB ALA 124 HB1 ALA 124 -4.350 -13.274 10.592 946 2HB ALA 124 HB2 ALA 124 -3.886 -14.265 11.976 947 3HB ALA 124 HB3 ALA 124 -3.223 -12.640 11.792 948 H HIS 125 HN HIS 125 -3.683 -11.081 13.624 949 HA HIS 125 HA HIS 125 -3.323 -12.560 15.997 950 1HB HIS 125 HB1 HIS 125 -1.977 -10.517 14.865 951 2HB HIS 125 HB2 HIS 125 -2.887 -9.612 16.070 952 HD2 HIS 125 HD2 HIS 125 -0.183 -12.447 15.933 953 HE1 HIS 125 HE1 HIS 125 -0.240 -10.699 19.787 954 HE2 HIS 125 HE2 HIS 125 0.943 -12.351 18.268 955 H GLN 126 HN GLN 126 -5.775 -10.348 15.018 956 HA GLN 126 HA GLN 126 -6.635 -9.799 17.737 957 1HB GLN 126 HB1 GLN 126 -7.594 -8.939 15.021 958 2HB GLN 126 HB2 GLN 126 -8.578 -8.667 16.453 959 1HG GLN 126 HG1 GLN 126 -5.827 -7.798 16.799 960 2HG GLN 126 HG2 GLN 126 -6.646 -6.985 15.465 961 1HE2 GLN 126 HE21 GLN 126 -5.820 -5.598 17.681 962 2HE2 GLN 126 HE22 GLN 126 -7.198 -5.065 18.577 963 H ALA 127 HN ALA 127 -7.831 -11.567 14.899 964 HA ALA 127 HA ALA 127 -10.015 -12.670 16.493 965 1HB ALA 127 HB1 ALA 127 -9.993 -13.724 13.852 966 2HB ALA 127 HB2 ALA 127 -9.705 -11.986 13.767 967 3HB ALA 127 HB3 ALA 127 -11.139 -12.604 14.587 968 H LYS 128 HN LYS 128 -7.235 -13.809 14.583 969 HA LYS 128 HA LYS 128 -7.673 -16.511 15.576 970 1HB LYS 128 HB2 LYS 128 -6.625 -17.258 13.715 971 2HB LYS 128 HB1 LYS 128 -6.966 -15.646 13.107 972 1HG LYS 128 HG1 LYS 128 -4.795 -14.985 13.238 973 2HG LYS 128 HG2 LYS 128 -4.420 -16.087 14.564 974 1HD LYS 128 HD2 LYS 128 -3.292 -16.925 12.654 975 2HD LYS 128 HD1 LYS 128 -4.684 -17.979 12.922 976 1HE LYS 128 HE1 LYS 128 -5.777 -16.156 11.267 977 2HE LYS 128 HE2 LYS 128 -4.106 -16.120 10.706 978 1HZ LYS 128 HZ1 LYS 128 -5.184 -17.758 9.442 979 2HZ LYS 128 HZ2 LYS 128 -5.947 -18.437 10.790 980 3HZ LYS 128 HZ3 LYS 128 -4.278 -18.616 10.584 981 H GLU 129 HN GLU 129 -5.410 -17.640 15.787 982 HA GLU 129 HA GLU 129 -4.101 -16.360 18.068 983 1HB GLU 129 HB2 GLU 129 -4.971 -18.911 17.799 984 2HB GLU 129 HB1 GLU 129 -3.311 -19.096 17.251 985 1HG GLU 129 HG1 GLU 129 -2.442 -18.728 19.302 986 2HG GLU 129 HG2 GLU 129 -3.711 -17.590 19.758 987 H ALA 130 HN ALA 130 -3.530 -15.134 15.718 988 HA ALA 130 HA ALA 130 -1.459 -16.138 14.184 989 1HB ALA 130 HB1 ALA 130 -1.145 -13.946 13.352 990 2HB ALA 130 HB2 ALA 130 -1.808 -13.221 14.817 991 3HB ALA 130 HB3 ALA 130 -2.863 -14.106 13.717 992 H ALA 131 HN ALA 131 -1.366 -15.119 17.426 993 HA ALA 131 HA ALA 131 1.262 -14.109 17.596 994 1HB ALA 131 HB1 ALA 131 0.780 -15.241 20.057 995 2HB ALA 131 HB2 ALA 131 -0.838 -14.898 19.445 996 3HB ALA 131 HB3 ALA 131 0.353 -13.602 19.566 997 H GLN 132 HN GLN 132 0.488 -17.025 19.393 998 HA GLN 132 HA GLN 132 3.069 -18.130 18.820 999 1HB GLN 132 HB2 GLN 132 0.695 -19.062 20.415 1000 2HB GLN 132 HB1 GLN 132 2.075 -20.117 20.137 1001 1HG GLN 132 HG1 GLN 132 3.314 -19.078 21.662 1002 2HG GLN 132 HG2 GLN 132 2.846 -17.480 21.081 1003 1HE2 GLN 132 HE21 GLN 132 0.673 -16.733 21.729 1004 2HE2 GLN 132 HE22 GLN 132 0.112 -17.144 23.311 1005 H LYS 133 HN LYS 133 3.621 -19.488 17.252 1006 HA LYS 133 HA LYS 133 1.631 -20.374 15.361 1007 1HB LYS 133 HB1 LYS 133 4.126 -19.584 14.971 1008 2HB LYS 133 HB2 LYS 133 4.472 -21.289 15.236 1009 1HG LYS 133 HG2 LYS 133 2.279 -20.923 13.387 1010 2HG LYS 133 HG1 LYS 133 3.740 -20.090 12.850 1011 1HD LYS 133 HD1 LYS 133 4.885 -22.363 13.518 1012 2HD LYS 133 HD2 LYS 133 3.257 -23.000 13.277 1013 1HE LYS 133 HE1 LYS 133 3.240 -22.468 11.026 1014 2HE LYS 133 HE2 LYS 133 4.493 -21.240 11.203 1015 1HZ LYS 133 HZ1 LYS 133 5.040 -23.535 10.145 1016 2HZ LYS 133 HZ2 LYS 133 5.164 -24.043 11.754 1017 3HZ LYS 133 HZ3 LYS 133 6.151 -22.794 11.182 1018 H ALA 134 HN ALA 134 3.908 -21.913 17.607 1019 HA ALA 134 HA ALA 134 2.937 -24.560 17.017 1020 1HB ALA 134 HB1 ALA 134 5.161 -24.610 17.622 1021 2HB ALA 134 HB2 ALA 134 4.371 -25.072 19.130 1022 3HB ALA 134 HB3 ALA 134 4.949 -23.420 18.907 1023 H VAL 135 HN VAL 135 0.972 -25.148 17.671 1024 HA VAL 135 HA VAL 135 -0.021 -24.170 20.258 1025 HB VAL 135 HB VAL 135 -2.230 -25.198 19.358 1026 1HG1 VAL 135 HG11 VAL 135 -1.043 -22.651 19.198 1027 2HG1 VAL 135 HG12 VAL 135 -2.761 -23.051 19.185 1028 3HG1 VAL 135 HG13 VAL 135 -1.874 -22.920 17.666 1029 1HG2 VAL 135 HG21 VAL 135 -0.795 -26.181 17.381 1030 2HG2 VAL 135 HG22 VAL 135 -1.106 -24.598 16.668 1031 3HG2 VAL 135 HG23 VAL 135 -2.453 -25.640 17.123 1032 H ASN 136 HN ASN 136 -1.217 -25.660 21.622 1033 HA ASN 136 HA ASN 136 0.116 -28.235 21.766 1034 1HB ASN 136 HB2 ASN 136 -1.423 -26.512 23.621 1035 2HB ASN 136 HB1 ASN 136 -1.564 -28.247 23.886 1036 1HD2 ASN 136 HD21 ASN 136 -0.061 -29.188 25.064 1037 2HD2 ASN 136 HD22 ASN 136 1.485 -28.523 25.454 1038 H SER 137 HN SER 137 -1.998 -29.603 23.155 1039 HA SER 137 HA SER 137 -3.439 -30.596 20.856 1040 1HB SER 137 HB1 SER 137 -4.406 -31.891 23.149 1041 2HB SER 137 HB2 SER 137 -3.179 -32.491 22.032 1042 HG SER 137 HG SER 137 -1.608 -31.825 23.368 1043 H ALA 138 HN ALA 138 -4.376 -28.204 20.925 1044 HA ALA 138 HA ALA 138 -6.594 -27.827 22.713 1045 1HB ALA 138 HB1 ALA 138 -5.050 -26.123 21.271 1046 2HB ALA 138 HB2 ALA 138 -6.610 -25.705 21.981 1047 3HB ALA 138 HB3 ALA 138 -6.511 -26.183 20.286 1048 H THR 139 HN THR 139 -8.646 -26.892 21.287 1049 HA THR 139 HA THR 139 -9.536 -29.249 19.770 1050 HB THR 139 HB THR 139 -11.831 -27.905 20.282 1051 HG1 THR 139 HG1 THR 139 -11.334 -26.381 21.647 1052 1HG2 THR 139 HG21 THR 139 -10.622 -30.234 21.248 1053 2HG2 THR 139 HG22 THR 139 -12.319 -29.768 21.352 1054 3HG2 THR 139 HG23 THR 139 -11.210 -29.357 22.660 1055 H GLY 140 HN GLY 140 -9.045 -28.827 17.680 1056 1HA GLY 140 HA2 GLY 140 -9.764 -26.202 16.572 1057 2HA GLY 140 HA1 GLY 140 -8.702 -27.380 15.814 1058 H VAL 141 HN VAL 141 -10.322 -29.661 16.051 1059 HA VAL 141 HA VAL 141 -12.393 -29.002 14.079 1060 HB VAL 141 HB VAL 141 -12.400 -31.552 13.749 1061 1HG1 VAL 141 HG11 VAL 141 -9.781 -30.846 12.810 1062 2HG1 VAL 141 HG12 VAL 141 -10.882 -29.481 12.628 1063 3HG1 VAL 141 HG13 VAL 141 -11.280 -31.038 11.902 1064 1HG2 VAL 141 HG21 VAL 141 -9.626 -31.443 14.855 1065 2HG2 VAL 141 HG22 VAL 141 -10.659 -32.840 14.549 1066 3HG2 VAL 141 HG23 VAL 141 -10.989 -31.782 15.922 1067 HA PRO 142 HA PRO 142 -15.695 -29.707 16.928 1068 1HB PRO 142 HB2 PRO 142 -17.101 -30.982 14.646 1069 2HB PRO 142 HB1 PRO 142 -17.600 -29.624 15.660 1070 1HG PRO 142 HG2 PRO 142 -16.767 -29.231 13.157 1071 2HG PRO 142 HG1 PRO 142 -16.347 -28.093 14.449 1072 1HD PRO 142 HD2 PRO 142 -14.670 -30.213 13.168 1073 2HD PRO 142 HD1 PRO 142 -14.216 -28.577 13.690 1074 H THR 143 HN THR 143 -17.123 -31.463 17.738 1075 HA THR 143 HA THR 143 -15.662 -33.994 17.734 1076 HB THR 143 HB THR 143 -17.933 -33.941 19.514 1077 HG1 THR 143 HG1 THR 143 -17.436 -32.176 20.721 1078 1HG2 THR 143 HG21 THR 143 -15.848 -33.842 21.169 1079 2HG2 THR 143 HG22 THR 143 -15.026 -34.368 19.700 1080 3HG2 THR 143 HG23 THR 143 -16.364 -35.316 20.349 1081 H VAL 144 HN VAL 144 -16.551 -35.933 17.137 1082 HA VAL 144 HA VAL 144 -18.615 -35.884 15.197 1083 HB VAL 144 HB VAL 144 -18.469 -38.383 15.304 1084 1HG1 VAL 144 HG21 VAL 144 -15.998 -36.714 14.931 1085 2HG1 VAL 144 HG22 VAL 144 -17.101 -37.341 13.704 1086 3HG1 VAL 144 HG23 VAL 144 -16.031 -38.441 14.573 1087 1HG2 VAL 144 HG11 VAL 144 -17.920 -38.889 17.512 1088 2HG2 VAL 144 HG12 VAL 144 -16.604 -37.716 17.554 1089 3HG2 VAL 144 HG13 VAL 144 -16.427 -39.206 16.628 Start of MODEL 9 1 1H GLY 1 HT1 GLY 1 -35.630 4.722 27.505 2 2H GLY 1 HT2 GLY 1 -35.251 6.207 26.789 3 3H GLY 1 HT3 GLY 1 -34.355 5.652 28.112 4 1HA GLY 1 HA1 GLY 1 -33.081 4.286 26.892 5 2HA GLY 1 HA2 GLY 1 -34.424 3.853 25.846 6 HA PRO 2 HA PRO 2 -31.467 6.808 23.654 7 1HB PRO 2 HB2 PRO 2 -30.784 5.162 21.611 8 2HB PRO 2 HB1 PRO 2 -29.901 5.202 23.141 9 1HG PRO 2 HG2 PRO 2 -32.009 3.283 22.218 10 2HG PRO 2 HG1 PRO 2 -30.478 2.946 23.047 11 1HD PRO 2 HD2 PRO 2 -32.848 3.010 24.350 12 2HD PRO 2 HD1 PRO 2 -31.329 3.516 25.116 13 H LEU 3 HN LEU 3 -33.883 4.526 22.453 14 HA LEU 3 HA LEU 3 -34.516 6.219 20.183 15 1HB LEU 3 HB1 LEU 3 -35.549 3.566 21.155 16 2HB LEU 3 HB2 LEU 3 -36.310 4.426 19.831 17 HG LEU 3 HG LEU 3 -33.389 4.000 19.599 18 1HD1 LEU 3 HD11 LEU 3 -34.318 1.674 18.534 19 2HD1 LEU 3 HD12 LEU 3 -35.285 1.807 20.003 20 3HD1 LEU 3 HD13 LEU 3 -33.524 1.822 20.102 21 1HD2 LEU 3 HD21 LEU 3 -35.583 3.497 17.608 22 2HD2 LEU 3 HD22 LEU 3 -33.876 3.819 17.303 23 3HD2 LEU 3 HD23 LEU 3 -34.921 5.103 17.909 24 H GLY 4 HN GLY 4 -36.579 7.140 19.805 25 1HA GLY 4 HA2 GLY 4 -37.859 8.064 22.254 26 2HA GLY 4 HA1 GLY 4 -38.116 8.704 20.638 27 H SER 5 HN SER 5 -40.212 8.515 20.196 28 HA SER 5 HA SER 5 -41.599 6.041 20.963 29 1HB SER 5 HB1 SER 5 -42.610 8.111 21.815 30 2HB SER 5 HB2 SER 5 -42.738 8.734 20.171 31 HG SER 5 HG SER 5 -44.536 7.683 20.001 32 H ALA 6 HN ALA 6 -41.354 4.606 19.347 33 HA ALA 6 HA ALA 6 -42.456 5.318 16.741 34 1HB ALA 6 HB1 ALA 6 -40.610 4.850 15.477 35 2HB ALA 6 HB2 ALA 6 -39.905 3.792 16.700 36 3HB ALA 6 HB3 ALA 6 -39.839 5.542 16.904 37 H ALA 7 HN ALA 7 -44.190 3.964 17.354 38 HA ALA 7 HA ALA 7 -43.592 1.127 17.750 39 1HB ALA 7 HB1 ALA 7 -45.268 2.524 19.159 40 2HB ALA 7 HB2 ALA 7 -45.691 0.880 18.678 41 3HB ALA 7 HB3 ALA 7 -46.357 2.256 17.798 42 H ALA 8 HN ALA 8 -46.317 2.656 16.070 43 HA ALA 8 HA ALA 8 -47.324 2.203 14.078 44 1HB ALA 8 HB1 ALA 8 -44.822 1.401 12.746 45 2HB ALA 8 HB2 ALA 8 -44.810 2.986 13.519 46 3HB ALA 8 HB3 ALA 8 -46.017 2.614 12.288 47 H ALA 9 HN ALA 9 -47.154 0.034 15.937 48 HA ALA 9 HA ALA 9 -46.697 -2.322 14.265 49 1HB ALA 9 HB1 ALA 9 -46.998 -3.597 16.353 50 2HB ALA 9 HB2 ALA 9 -47.294 -2.085 17.211 51 3HB ALA 9 HB3 ALA 9 -45.720 -2.388 16.475 52 H THR 10 HN THR 10 -49.023 -0.395 14.042 53 HA THR 10 HA THR 10 -51.263 -2.137 14.716 54 HB THR 10 HB THR 10 -52.440 -0.260 14.953 55 HG1 THR 10 HG1 THR 10 -53.177 0.502 13.162 56 1HG2 THR 10 HG21 THR 10 -51.378 1.934 14.862 57 2HG2 THR 10 HG22 THR 10 -49.962 1.209 14.098 58 3HG2 THR 10 HG23 THR 10 -50.402 0.760 15.745 59 HA PRO 11 HA PRO 11 -51.715 -1.950 9.951 60 1HB PRO 11 HB1 PRO 11 -49.792 -0.854 8.437 61 2HB PRO 11 HB2 PRO 11 -51.051 0.131 9.191 62 1HG PRO 11 HG2 PRO 11 -48.224 -0.326 10.061 63 2HG PRO 11 HG1 PRO 11 -49.156 1.180 10.037 64 1HD PRO 11 HD2 PRO 11 -48.766 -0.342 12.285 65 2HD PRO 11 HD1 PRO 11 -50.157 0.733 12.045 66 H ALA 12 HN ALA 12 -51.111 -4.151 10.818 67 HA ALA 12 HA ALA 12 -48.502 -5.136 9.993 68 1HB ALA 12 HB1 ALA 12 -48.878 -6.271 11.887 69 2HB ALA 12 HB2 ALA 12 -49.851 -7.333 10.868 70 3HB ALA 12 HB3 ALA 12 -50.625 -6.046 11.790 71 H VAL 13 HN VAL 13 -51.401 -4.623 8.502 72 HA VAL 13 HA VAL 13 -51.208 -6.992 6.784 73 HB VAL 13 HB VAL 13 -53.429 -6.404 7.754 74 1HG1 VAL 13 HG11 VAL 13 -53.091 -3.964 6.024 75 2HG1 VAL 13 HG12 VAL 13 -53.385 -4.029 7.761 76 3HG1 VAL 13 HG13 VAL 13 -54.652 -4.513 6.634 77 1HG2 VAL 13 HG21 VAL 13 -52.997 -7.616 5.523 78 2HG2 VAL 13 HG22 VAL 13 -53.567 -6.124 4.776 79 3HG2 VAL 13 HG23 VAL 13 -54.625 -7.028 5.860 80 H ARG 14 HN ARG 14 -51.072 -6.814 4.527 81 HA ARG 14 HA ARG 14 -49.448 -4.674 3.588 82 1HB ARG 14 HB2 ARG 14 -50.158 -7.266 2.709 83 2HB ARG 14 HB1 ARG 14 -50.628 -6.158 1.428 84 1HG ARG 14 HG2 ARG 14 -48.518 -6.336 0.742 85 2HG ARG 14 HG1 ARG 14 -48.131 -5.259 2.086 86 1HD ARG 14 HD1 ARG 14 -48.150 -7.604 3.385 87 2HD ARG 14 HD2 ARG 14 -47.674 -8.163 1.783 88 HE ARG 14 HE ARG 14 -46.205 -6.015 3.158 89 1HH1 ARG 14 HH11 ARG 14 -46.295 -9.089 1.518 90 2HH1 ARG 14 HH12 ARG 14 -44.572 -9.249 1.452 91 1HH2 ARG 14 HH21 ARG 14 -43.936 -6.218 3.076 92 2HH2 ARG 14 HH22 ARG 14 -43.231 -7.617 2.338 93 H THR 15 HN THR 15 -50.048 -2.764 2.824 94 HA THR 15 HA THR 15 -52.877 -2.337 2.181 95 HB THR 15 HB THR 15 -52.058 -0.833 3.859 96 HG1 THR 15 HG1 THR 15 -53.215 -0.007 1.817 97 1HG2 THR 15 HG21 THR 15 -49.874 -0.433 3.932 98 2HG2 THR 15 HG22 THR 15 -50.211 0.845 2.763 99 3HG2 THR 15 HG23 THR 15 -49.664 -0.737 2.207 100 H VAL 16 HN VAL 16 -53.514 -1.229 0.304 101 HA VAL 16 HA VAL 16 -51.620 -1.507 -1.916 102 HB VAL 16 HB VAL 16 -54.576 -1.027 -2.197 103 1HG1 VAL 16 HG11 VAL 16 -52.326 -1.590 -3.994 104 2HG1 VAL 16 HG12 VAL 16 -53.865 -0.791 -4.315 105 3HG1 VAL 16 HG13 VAL 16 -53.772 -2.552 -4.296 106 1HG2 VAL 16 HG21 VAL 16 -53.111 -3.546 -1.579 107 2HG2 VAL 16 HG22 VAL 16 -54.492 -3.610 -2.673 108 3HG2 VAL 16 HG23 VAL 16 -54.695 -2.997 -1.031 109 HA PRO 17 HA PRO 17 -53.601 2.970 -2.510 110 1HB PRO 17 HB2 PRO 17 -54.163 3.541 0.354 111 2HB PRO 17 HB1 PRO 17 -55.067 4.016 -1.088 112 1HG PRO 17 HG2 PRO 17 -55.970 2.082 0.501 113 2HG PRO 17 HG1 PRO 17 -56.125 1.954 -1.262 114 1HD PRO 17 HD2 PRO 17 -54.184 0.611 0.576 115 2HD PRO 17 HD1 PRO 17 -55.014 -0.034 -0.856 116 H GLN 18 HN GLN 18 -51.976 2.163 0.542 117 HA GLN 18 HA GLN 18 -50.244 4.479 0.340 118 1HB GLN 18 HB2 GLN 18 -51.031 2.618 2.409 119 2HB GLN 18 HB1 GLN 18 -49.280 2.777 2.354 120 1HG GLN 18 HG1 GLN 18 -49.960 5.363 2.228 121 2HG GLN 18 HG2 GLN 18 -51.341 4.736 3.127 122 1HE2 GLN 18 HE21 GLN 18 -48.176 5.817 3.317 123 2HE2 GLN 18 HE22 GLN 18 -47.829 5.322 4.935 124 H TYR 19 HN TYR 19 -48.986 4.170 -1.467 125 HA TYR 19 HA TYR 19 -47.598 1.717 -1.973 126 1HB TYR 19 HB1 TYR 19 -48.339 3.704 -3.588 127 2HB TYR 19 HB2 TYR 19 -46.712 4.270 -3.230 128 HD1 TYR 19 HD1 TYR 19 -44.781 3.135 -4.097 129 HD2 TYR 19 HD2 TYR 19 -48.682 1.580 -4.782 130 HE1 TYR 19 HE1 TYR 19 -43.870 1.612 -5.799 131 HE2 TYR 19 HE2 TYR 19 -47.781 0.053 -6.485 132 HH TYR 19 HH TYR 19 -44.613 0.353 -7.730 133 H LYS 20 HN LYS 20 -45.228 1.595 -2.175 134 HA LYS 20 HA LYS 20 -43.974 2.469 0.243 135 1HB LYS 20 HB2 LYS 20 -43.555 0.270 -0.940 136 2HB LYS 20 HB1 LYS 20 -42.641 1.175 -2.139 137 1HG LYS 20 HG1 LYS 20 -40.956 0.498 -0.764 138 2HG LYS 20 HG2 LYS 20 -41.353 2.049 -0.022 139 1HD LYS 20 HD2 LYS 20 -41.211 0.552 1.777 140 2HD LYS 20 HD1 LYS 20 -42.942 0.727 1.479 141 1HE LYS 20 HE2 LYS 20 -42.486 -1.594 1.812 142 2HE LYS 20 HE1 LYS 20 -42.843 -1.350 0.103 143 1HZ LYS 20 HZ1 LYS 20 -40.043 -1.161 0.832 144 2HZ LYS 20 HZ2 LYS 20 -40.768 -1.912 -0.498 145 3HZ LYS 20 HZ3 LYS 20 -40.728 -2.699 0.999 146 H TYR 21 HN TYR 21 -43.152 4.427 0.536 147 HA TYR 21 HA TYR 21 -42.547 6.159 -1.676 148 1HB TYR 21 HB2 TYR 21 -43.046 6.449 1.134 149 2HB TYR 21 HB1 TYR 21 -41.537 7.262 0.733 150 HD1 TYR 21 HD1 TYR 21 -41.779 8.611 -1.651 151 HD2 TYR 21 HD2 TYR 21 -44.895 7.811 1.133 152 HE1 TYR 21 HE1 TYR 21 -43.041 10.535 -2.520 153 HE2 TYR 21 HE2 TYR 21 -46.165 9.733 0.271 154 HH TYR 21 HH TYR 21 -44.781 11.961 -2.048 155 H ALA 22 HN ALA 22 -40.883 3.669 -0.386 156 HA ALA 22 HA ALA 22 -38.250 4.921 -0.465 157 1HB ALA 22 HB1 ALA 22 -39.241 2.953 1.116 158 2HB ALA 22 HB2 ALA 22 -37.525 3.229 0.820 159 3HB ALA 22 HB3 ALA 22 -38.396 2.012 -0.112 160 H ALA 23 HN ALA 23 -39.390 5.095 -2.908 161 HA ALA 23 HA ALA 23 -38.956 2.928 -4.651 162 1HB ALA 23 HB1 ALA 23 -38.627 5.625 -5.783 163 2HB ALA 23 HB2 ALA 23 -40.133 5.341 -4.910 164 3HB ALA 23 HB3 ALA 23 -39.695 4.307 -6.270 165 H GLY 24 HN GLY 24 -37.351 2.976 -6.480 166 1HA GLY 24 HA1 GLY 24 -34.688 3.470 -5.348 167 2HA GLY 24 HA2 GLY 24 -35.054 2.383 -6.679 168 H VAL 25 HN VAL 25 -35.801 5.817 -6.105 169 HA VAL 25 HA VAL 25 -34.850 6.418 -8.803 170 HB VAL 25 HB VAL 25 -35.794 8.745 -8.217 171 1HG1 VAL 25 HG21 VAL 25 -38.130 7.950 -8.689 172 2HG1 VAL 25 HG22 VAL 25 -37.520 6.301 -8.549 173 3HG1 VAL 25 HG23 VAL 25 -36.898 7.367 -9.808 174 1HG2 VAL 25 HG11 VAL 25 -37.461 8.831 -6.484 175 2HG2 VAL 25 HG12 VAL 25 -35.931 8.310 -5.780 176 3HG2 VAL 25 HG13 VAL 25 -37.203 7.130 -6.096 177 H ARG 26 HN ARG 26 -32.643 5.889 -7.749 178 HA ARG 26 HA ARG 26 -31.510 8.066 -6.203 179 1HB ARG 26 HB1 ARG 26 -29.965 5.761 -7.365 180 2HB ARG 26 HB2 ARG 26 -29.603 6.709 -5.930 181 1HG ARG 26 HG2 ARG 26 -30.424 4.922 -4.855 182 2HG ARG 26 HG1 ARG 26 -31.984 5.661 -5.225 183 1HD ARG 26 HD2 ARG 26 -32.552 4.008 -6.609 184 2HD ARG 26 HD1 ARG 26 -30.984 4.042 -7.416 185 HE ARG 26 HE ARG 26 -30.524 2.821 -5.005 186 1HH1 ARG 26 HH11 ARG 26 -32.602 2.249 -7.742 187 2HH1 ARG 26 HH12 ARG 26 -32.617 0.529 -7.534 188 1HH2 ARG 26 HH21 ARG 26 -30.538 0.559 -4.723 189 2HH2 ARG 26 HH22 ARG 26 -31.444 -0.432 -5.818 190 H ASN 27 HN ASN 27 -32.446 8.798 -8.780 191 HA ASN 27 HA ASN 27 -30.099 9.061 -10.465 192 1HB ASN 27 HB2 ASN 27 -32.521 8.666 -11.278 193 2HB ASN 27 HB1 ASN 27 -32.747 10.388 -10.988 194 1HD2 ASN 27 HD21 ASN 27 -32.149 8.246 -13.319 195 2HD2 ASN 27 HD22 ASN 27 -31.232 9.217 -14.415 196 HA PRO 28 HA PRO 28 -30.664 13.664 -9.333 197 1HB PRO 28 HB2 PRO 28 -32.514 14.457 -7.569 198 2HB PRO 28 HB1 PRO 28 -32.933 14.125 -9.254 199 1HG PRO 28 HG1 PRO 28 -33.315 12.414 -6.829 200 2HG PRO 28 HG2 PRO 28 -34.422 12.697 -8.183 201 1HD PRO 28 HD2 PRO 28 -32.805 10.481 -7.933 202 2HD PRO 28 HD1 PRO 28 -33.432 11.094 -9.476 203 H GLN 29 HN GLN 29 -28.662 12.908 -8.311 204 HA GLN 29 HA GLN 29 -28.702 12.692 -5.405 205 1HB GLN 29 HB2 GLN 29 -27.057 11.652 -7.465 206 2HB GLN 29 HB1 GLN 29 -26.047 12.710 -6.488 207 1HG GLN 29 HG1 GLN 29 -27.802 10.700 -5.159 208 2HG GLN 29 HG2 GLN 29 -26.277 10.194 -5.885 209 1HE2 GLN 29 HE21 GLN 29 -24.449 11.864 -5.298 210 2HE2 GLN 29 HE22 GLN 29 -24.315 12.195 -3.609 211 H GLN 30 HN GLN 30 -29.034 14.679 -4.545 212 HA GLN 30 HA GLN 30 -27.440 16.933 -5.504 213 1HB GLN 30 HB1 GLN 30 -29.519 17.057 -3.332 214 2HB GLN 30 HB2 GLN 30 -28.954 18.350 -4.379 215 1HG GLN 30 HG1 GLN 30 -29.994 17.111 -6.298 216 2HG GLN 30 HG2 GLN 30 -30.728 16.038 -5.107 217 1HE2 GLN 30 HE21 GLN 30 -32.805 16.526 -5.050 218 2HE2 GLN 30 HE22 GLN 30 -33.467 18.113 -4.882 219 H HIS 31 HN HIS 31 -28.450 15.848 -2.261 220 HA HIS 31 HA HIS 31 -27.372 15.825 -0.261 221 1HB HIS 31 HB1 HIS 31 -25.844 14.352 -1.975 222 2HB HIS 31 HB2 HIS 31 -24.671 15.539 -1.412 223 HD2 HIS 31 HD2 HIS 31 -26.961 12.725 0.081 224 HE1 HIS 31 HE1 HIS 31 -23.845 13.637 2.797 225 HE2 HIS 31 HE2 HIS 31 -25.805 12.099 2.318 226 H LEU 32 HN LEU 32 -27.722 18.363 -1.565 227 HA LEU 32 HA LEU 32 -25.317 19.858 -0.829 228 1HB LEU 32 HB2 LEU 32 -27.588 20.294 -2.641 229 2HB LEU 32 HB1 LEU 32 -27.107 21.717 -1.737 230 HG LEU 32 HG LEU 32 -24.692 20.815 -2.638 231 1HD1 LEU 32 HD21 LEU 32 -25.037 19.298 -4.237 232 2HD1 LEU 32 HD22 LEU 32 -25.603 20.647 -5.222 233 3HD1 LEU 32 HD23 LEU 32 -26.760 19.659 -4.330 234 1HD2 LEU 32 HD11 LEU 32 -26.503 22.657 -4.183 235 2HD2 LEU 32 HD12 LEU 32 -24.741 22.672 -4.130 236 3HD2 LEU 32 HD13 LEU 32 -25.669 23.113 -2.697 237 H ASN 33 HN ASN 33 -25.716 19.367 1.460 238 HA ASN 33 HA ASN 33 -27.846 21.022 2.635 239 1HB ASN 33 HB1 ASN 33 -26.260 18.831 3.988 240 2HB ASN 33 HB2 ASN 33 -27.698 19.639 4.607 241 1HD2 ASN 33 HD21 ASN 33 -27.191 16.808 4.122 242 2HD2 ASN 33 HD22 ASN 33 -28.427 16.282 3.037 243 H ALA 34 HN ALA 34 -26.977 23.010 2.878 244 HA ALA 34 HA ALA 34 -24.264 23.345 3.847 245 1HB ALA 34 HB1 ALA 34 -24.640 25.720 3.519 246 2HB ALA 34 HB2 ALA 34 -26.352 25.426 3.216 247 3HB ALA 34 HB3 ALA 34 -25.139 24.816 2.089 248 H GLN 35 HN GLN 35 -23.962 25.089 5.595 249 HA GLN 35 HA GLN 35 -25.550 24.259 7.894 250 1HB GLN 35 HB2 GLN 35 -22.970 24.306 7.816 251 2HB GLN 35 HB1 GLN 35 -23.137 26.042 8.032 252 1HG GLN 35 HG2 GLN 35 -23.287 25.733 10.211 253 2HG GLN 35 HG1 GLN 35 -24.782 24.830 9.964 254 1HE2 GLN 35 HE21 GLN 35 -21.414 24.654 10.654 255 2HE2 GLN 35 HE22 GLN 35 -21.346 22.957 10.969 256 HA PRO 36 HA PRO 36 -23.991 26.561 5.560 257 1HB PRO 36 HB1 PRO 36 -23.624 29.038 4.669 258 2HB PRO 36 HB2 PRO 36 -25.120 28.168 4.311 259 1HG PRO 36 HG1 PRO 36 -24.612 30.335 6.294 260 2HG PRO 36 HG2 PRO 36 -26.056 30.023 5.317 261 1HD PRO 36 HD2 PRO 36 -25.659 29.284 8.007 262 2HD PRO 36 HD1 PRO 36 -26.961 28.726 6.940 263 H GLN 37 HN GLN 37 -21.762 27.473 5.130 264 HA GLN 37 HA GLN 37 -20.373 27.760 7.645 265 1HB GLN 37 HB1 GLN 37 -19.709 26.983 4.925 266 2HB GLN 37 HB2 GLN 37 -18.520 28.099 5.584 267 1HG GLN 37 HG1 GLN 37 -18.075 26.651 7.425 268 2HG GLN 37 HG2 GLN 37 -19.416 25.595 6.986 269 1HE2 GLN 37 HE21 GLN 37 -18.788 23.783 6.085 270 2HE2 GLN 37 HE22 GLN 37 -17.411 23.568 5.064 271 H VAL 38 HN VAL 38 -20.111 29.665 8.590 272 HA VAL 38 HA VAL 38 -20.094 32.093 6.943 273 HB VAL 38 HB VAL 38 -20.121 32.259 9.913 274 1HG1 VAL 38 HG11 VAL 38 -21.529 33.750 7.702 275 2HG1 VAL 38 HG12 VAL 38 -20.112 34.289 8.601 276 3HG1 VAL 38 HG13 VAL 38 -21.664 34.120 9.420 277 1HG2 VAL 38 HG21 VAL 38 -22.818 32.080 9.024 278 2HG2 VAL 38 HG22 VAL 38 -21.984 31.097 10.228 279 3HG2 VAL 38 HG23 VAL 38 -21.967 30.616 8.531 280 H THR 39 HN THR 39 -17.911 29.998 8.186 281 HA THR 39 HA THR 39 -15.977 32.006 9.053 282 HB THR 39 HB THR 39 -15.292 29.107 8.862 283 HG1 THR 39 HG1 THR 39 -17.160 28.787 9.868 284 1HG2 THR 39 HG21 THR 39 -13.939 29.466 10.691 285 2HG2 THR 39 HG22 THR 39 -14.839 30.893 11.207 286 3HG2 THR 39 HG23 THR 39 -13.790 30.975 9.792 287 H MET 40 HN MET 40 -14.197 32.583 7.919 288 HA MET 40 HA MET 40 -13.990 31.531 5.186 289 1HB MET 40 HB1 MET 40 -14.128 34.122 6.074 290 2HB MET 40 HB2 MET 40 -12.395 33.901 5.868 291 1HG MET 40 HG1 MET 40 -12.631 33.407 3.575 292 2HG MET 40 HG2 MET 40 -14.376 33.217 3.721 293 1HE MET 40 HE1 MET 40 -14.290 34.541 1.547 294 2HE MET 40 HE2 MET 40 -14.551 36.286 1.552 295 3HE MET 40 HE3 MET 40 -15.710 35.218 2.344 296 H GLN 41 HN GLN 41 -12.399 31.573 8.203 297 HA GLN 41 HA GLN 41 -9.714 31.326 7.380 298 1HB GLN 41 HB1 GLN 41 -11.213 31.125 9.837 299 2HB GLN 41 HB2 GLN 41 -10.020 29.836 9.747 300 1HG GLN 41 HG1 GLN 41 -9.376 32.744 9.322 301 2HG GLN 41 HG2 GLN 41 -9.245 31.922 10.876 302 1HE2 GLN 41 HE21 GLN 41 -8.139 29.573 10.329 303 2HE2 GLN 41 HE22 GLN 41 -6.583 29.760 9.603 304 H GLN 42 HN GLN 42 -8.370 29.402 7.473 305 HA GLN 42 HA GLN 42 -7.798 27.306 6.813 306 1HB GLN 42 HB2 GLN 42 -9.633 26.934 8.763 307 2HB GLN 42 HB1 GLN 42 -10.437 26.120 7.428 308 1HG GLN 42 HG2 GLN 42 -9.084 24.367 7.559 309 2HG GLN 42 HG1 GLN 42 -7.646 25.386 7.605 310 1HE2 GLN 42 HE21 GLN 42 -10.119 23.831 9.511 311 2HE2 GLN 42 HE22 GLN 42 -9.284 23.913 11.022 312 HA PRO 43 HA PRO 43 -9.602 27.621 2.677 313 1HB PRO 43 HB2 PRO 43 -7.639 26.167 1.458 314 2HB PRO 43 HB1 PRO 43 -7.491 27.887 1.831 315 1HG PRO 43 HG1 PRO 43 -6.443 25.521 3.340 316 2HG PRO 43 HG2 PRO 43 -5.638 27.059 2.970 317 1HD PRO 43 HD2 PRO 43 -6.718 26.564 5.386 318 2HD PRO 43 HD1 PRO 43 -6.740 28.186 4.665 319 H ALA 44 HN ALA 44 -10.581 26.150 1.233 320 HA ALA 44 HA ALA 44 -11.339 23.639 2.475 321 1HB ALA 44 HB1 ALA 44 -12.613 25.493 0.779 322 2HB ALA 44 HB2 ALA 44 -13.281 24.015 1.472 323 3HB ALA 44 HB3 ALA 44 -12.503 23.975 -0.111 324 H VAL 45 HN VAL 45 -11.795 21.878 0.589 325 HA VAL 45 HA VAL 45 -9.134 21.313 -0.510 326 HB VAL 45 HB VAL 45 -10.168 18.979 -0.847 327 1HG1 VAL 45 HG11 VAL 45 -8.803 20.178 1.262 328 2HG1 VAL 45 HG12 VAL 45 -8.948 18.451 0.936 329 3HG1 VAL 45 HG13 VAL 45 -10.087 19.243 2.025 330 1HG2 VAL 45 HG21 VAL 45 -12.491 19.552 -0.543 331 2HG2 VAL 45 HG22 VAL 45 -12.162 20.174 1.073 332 3HG2 VAL 45 HG23 VAL 45 -11.992 18.451 0.741 333 H HIS 46 HN HIS 46 -8.769 21.326 -2.633 334 HA HIS 46 HA HIS 46 -11.086 21.555 -4.433 335 1HB HIS 46 HB1 HIS 46 -8.229 22.485 -4.793 336 2HB HIS 46 HB2 HIS 46 -9.477 22.601 -6.029 337 HD2 HIS 46 HD2 HIS 46 -8.112 25.317 -4.897 338 HE1 HIS 46 HE1 HIS 46 -11.797 25.788 -2.866 339 HE2 HIS 46 HE2 HIS 46 -9.695 26.962 -3.663 340 H VAL 47 HN VAL 47 -8.244 19.720 -3.692 341 HA VAL 47 HA VAL 47 -8.555 18.118 -6.133 342 HB VAL 47 HB VAL 47 -6.325 17.958 -4.106 343 1HG1 VAL 47 HG21 VAL 47 -6.549 15.945 -5.410 344 2HG1 VAL 47 HG22 VAL 47 -5.130 16.833 -5.963 345 3HG1 VAL 47 HG23 VAL 47 -6.620 16.877 -6.905 346 1HG2 VAL 47 HG11 VAL 47 -5.004 19.354 -5.495 347 2HG2 VAL 47 HG12 VAL 47 -6.536 20.193 -5.253 348 3HG2 VAL 47 HG13 VAL 47 -6.221 19.352 -6.771 349 H GLN 48 HN GLN 48 -9.314 16.088 -6.077 350 HA GLN 48 HA GLN 48 -10.287 15.059 -3.544 351 1HB GLN 48 HB2 GLN 48 -10.768 14.457 -6.423 352 2HB GLN 48 HB1 GLN 48 -11.062 13.172 -5.258 353 1HG GLN 48 HG2 GLN 48 -12.494 14.868 -4.006 354 2HG GLN 48 HG1 GLN 48 -12.405 15.841 -5.474 355 1HE2 GLN 48 HE22 GLN 48 -13.705 13.008 -3.988 356 2HE2 GLN 48 HE21 GLN 48 -14.795 12.583 -5.259 357 H GLY 49 HN GLY 49 -7.706 14.487 -5.781 358 1HA GLY 49 HA2 GLY 49 -7.103 11.857 -4.696 359 2HA GLY 49 HA1 GLY 49 -6.224 12.685 -5.971 360 H GLN 50 HN GLN 50 -6.610 12.304 -2.522 361 HA GLN 50 HA GLN 50 -4.274 13.997 -2.024 362 1HB GLN 50 HB2 GLN 50 -6.289 12.742 -0.152 363 2HB GLN 50 HB1 GLN 50 -4.900 13.678 0.380 364 1HG GLN 50 HG1 GLN 50 -6.534 15.050 -1.604 365 2HG GLN 50 HG2 GLN 50 -7.398 14.664 -0.117 366 1HE2 GLN 50 HE21 GLN 50 -5.775 15.031 1.866 367 2HE2 GLN 50 HE22 GLN 50 -5.100 16.622 1.900 368 H GLU 51 HN GLU 51 -2.336 13.184 -1.503 369 HA GLU 51 HA GLU 51 -1.995 10.307 -1.538 370 1HB GLU 51 HB2 GLU 51 -0.130 12.659 -1.599 371 2HB GLU 51 HB1 GLU 51 0.488 11.048 -1.261 372 1HG GLU 51 HG1 GLU 51 -1.089 10.691 -3.500 373 2HG GLU 51 HG2 GLU 51 -0.304 12.246 -3.774 374 HA PRO 52 HA PRO 52 -1.815 10.036 2.895 375 1HB PRO 52 HB2 PRO 52 -1.192 7.446 3.125 376 2HB PRO 52 HB1 PRO 52 -2.765 7.958 2.501 377 1HG PRO 52 HG1 PRO 52 -0.345 7.016 1.009 378 2HG PRO 52 HG2 PRO 52 -2.050 6.612 0.743 379 1HD PRO 52 HD2 PRO 52 -0.658 8.495 -0.705 380 2HD PRO 52 HD1 PRO 52 -2.421 8.493 -0.504 381 H LEU 53 HN LEU 53 -0.179 8.481 4.379 382 HA LEU 53 HA LEU 53 2.396 9.804 4.060 383 1HB LEU 53 HB2 LEU 53 0.856 9.274 6.250 384 2HB LEU 53 HB1 LEU 53 2.008 7.954 6.314 385 HG LEU 53 HG LEU 53 3.581 10.208 5.880 386 1HD1 LEU 53 HD21 LEU 53 2.902 11.907 7.292 387 2HD1 LEU 53 HD22 LEU 53 1.773 10.870 8.164 388 3HD1 LEU 53 HD23 LEU 53 1.385 11.421 6.533 389 1HD2 LEU 53 HD11 LEU 53 2.938 8.880 8.509 390 2HD2 LEU 53 HD12 LEU 53 4.410 9.761 8.090 391 3HD2 LEU 53 HD13 LEU 53 4.044 8.229 7.297 392 H THR 54 HN THR 54 4.394 8.649 4.211 393 HA THR 54 HA THR 54 4.586 5.840 4.130 394 HB THR 54 HB THR 54 5.626 6.317 1.576 395 HG1 THR 54 HG1 THR 54 3.504 6.989 0.599 396 1HG2 THR 54 HG21 THR 54 3.383 5.071 0.928 397 2HG2 THR 54 HG22 THR 54 3.338 4.804 2.670 398 3HG2 THR 54 HG23 THR 54 4.724 4.250 1.730 399 H ALA 55 HN ALA 55 6.934 5.461 2.779 400 HA ALA 55 HA ALA 55 8.836 6.400 4.555 401 1HB ALA 55 HB1 ALA 55 9.410 5.597 1.714 402 2HB ALA 55 HB2 ALA 55 9.080 4.456 3.019 403 3HB ALA 55 HB3 ALA 55 10.495 5.506 3.102 404 H SER 56 HN SER 56 7.620 7.866 1.623 405 HA SER 56 HA SER 56 9.684 9.781 1.281 406 1HB SER 56 HB1 SER 56 6.808 9.710 0.354 407 2HB SER 56 HB2 SER 56 7.925 11.003 -0.080 408 HG SER 56 HG SER 56 9.265 9.414 -1.036 409 H MET 57 HN MET 57 6.472 9.966 2.795 410 HA MET 57 HA MET 57 6.621 12.633 3.653 411 1HB MET 57 HB1 MET 57 5.103 10.224 4.614 412 2HB MET 57 HB2 MET 57 5.000 11.745 5.484 413 1HG MET 57 HG1 MET 57 3.363 10.983 3.458 414 2HG MET 57 HG2 MET 57 3.629 12.647 3.975 415 1HE MET 57 HE1 MET 57 4.798 9.825 1.557 416 2HE MET 57 HE2 MET 57 4.782 10.718 0.037 417 3HE MET 57 HE3 MET 57 3.294 10.531 0.966 418 H LEU 58 HN LEU 58 7.669 9.622 5.119 419 HA LEU 58 HA LEU 58 8.406 10.618 7.644 420 1HB LEU 58 HB1 LEU 58 9.617 8.319 6.112 421 2HB LEU 58 HB2 LEU 58 9.708 8.568 7.846 422 HG LEU 58 HG LEU 58 7.056 8.259 6.479 423 1HD1 LEU 58 HD21 LEU 58 7.919 5.805 7.660 424 2HD1 LEU 58 HD22 LEU 58 9.092 6.311 6.441 425 3HD1 LEU 58 HD23 LEU 58 7.392 6.120 6.007 426 1HD2 LEU 58 HD11 LEU 58 7.593 8.973 8.974 427 2HD2 LEU 58 HD12 LEU 58 7.702 7.222 9.179 428 3HD2 LEU 58 HD13 LEU 58 6.215 7.947 8.564 429 H ALA 59 HN ALA 59 10.231 10.154 4.656 430 HA ALA 59 HA ALA 59 12.731 11.025 5.629 431 1HB ALA 59 HB1 ALA 59 13.456 11.019 3.393 432 2HB ALA 59 HB2 ALA 59 11.829 11.309 2.777 433 3HB ALA 59 HB3 ALA 59 12.240 9.746 3.485 434 H SER 60 HN SER 60 9.873 12.721 4.962 435 HA SER 60 HA SER 60 11.044 15.226 4.207 436 1HB SER 60 HB1 SER 60 8.729 14.631 3.580 437 2HB SER 60 HB2 SER 60 8.275 14.632 5.285 438 HG SER 60 HG SER 60 7.844 16.617 4.062 439 H ALA 61 HN ALA 61 10.842 13.545 7.101 440 HA ALA 61 HA ALA 61 11.439 15.981 8.614 441 1HB ALA 61 HB1 ALA 61 9.537 13.767 9.330 442 2HB ALA 61 HB2 ALA 61 9.251 15.508 9.315 443 3HB ALA 61 HB3 ALA 61 10.272 14.793 10.562 444 HA PRO 62 HA PRO 62 15.183 13.668 9.553 445 1HB PRO 62 HB1 PRO 62 15.224 15.573 11.842 446 2HB PRO 62 HB2 PRO 62 16.474 15.236 10.641 447 1HG PRO 62 HG1 PRO 62 15.087 17.496 10.535 448 2HG PRO 62 HG2 PRO 62 15.497 16.619 9.048 449 1HD PRO 62 HD1 PRO 62 12.900 16.718 10.535 450 2HD PRO 62 HD2 PRO 62 13.199 16.764 8.785 451 HA PRO 63 HA PRO 63 14.647 10.947 13.146 452 1HB PRO 63 HB2 PRO 63 15.843 12.947 15.031 453 2HB PRO 63 HB1 PRO 63 16.096 11.200 14.942 454 1HG PRO 63 HG1 PRO 63 17.901 12.877 13.940 455 2HG PRO 63 HG2 PRO 63 17.502 11.366 13.102 456 1HD PRO 63 HD1 PRO 63 16.778 14.161 12.412 457 2HD PRO 63 HD2 PRO 63 17.016 12.760 11.350 458 H GLN 64 HN GLN 64 13.632 14.214 13.219 459 HA GLN 64 HA GLN 64 12.102 14.637 15.402 460 1HB GLN 64 HB1 GLN 64 12.331 16.174 13.468 461 2HB GLN 64 HB2 GLN 64 11.248 15.143 12.531 462 1HG GLN 64 HG1 GLN 64 9.504 16.238 13.341 463 2HG GLN 64 HG2 GLN 64 9.965 15.796 14.985 464 1HE2 GLN 64 HE22 GLN 64 10.708 17.325 16.317 465 2HE2 GLN 64 HE21 GLN 64 11.015 18.965 15.870 466 H GLU 65 HN GLU 65 10.325 13.643 12.517 467 HA GLU 65 HA GLU 65 8.668 11.922 14.228 468 1HB GLU 65 HB1 GLU 65 7.782 12.797 11.513 469 2HB GLU 65 HB2 GLU 65 6.821 12.454 12.945 470 1HG GLU 65 HG2 GLU 65 8.647 14.821 12.851 471 2HG GLU 65 HG1 GLU 65 7.036 14.882 12.139 472 H GLN 66 HN GLN 66 11.136 11.667 12.091 473 HA GLN 66 HA GLN 66 10.381 9.726 10.246 474 1HB GLN 66 HB1 GLN 66 12.788 10.913 11.102 475 2HB GLN 66 HB2 GLN 66 13.027 9.178 11.252 476 1HG GLN 66 HG1 GLN 66 11.748 9.715 8.766 477 2HG GLN 66 HG2 GLN 66 13.148 10.771 8.934 478 1HE2 GLN 66 HE22 GLN 66 14.510 9.819 7.525 479 2HE2 GLN 66 HE21 GLN 66 15.097 8.201 7.678 480 H LYS 67 HN LYS 67 11.245 9.446 13.627 481 HA LYS 67 HA LYS 67 10.604 6.571 13.514 482 1HB LYS 67 HB1 LYS 67 12.014 7.508 15.910 483 2HB LYS 67 HB2 LYS 67 12.319 6.099 14.905 484 1HG LYS 67 HG2 LYS 67 13.056 8.384 13.408 485 2HG LYS 67 HG1 LYS 67 13.751 8.547 15.023 486 1HD LYS 67 HD1 LYS 67 14.139 5.870 14.286 487 2HD LYS 67 HD2 LYS 67 14.546 6.827 12.860 488 1HE LYS 67 HE2 LYS 67 15.949 8.268 14.403 489 2HE LYS 67 HE1 LYS 67 15.723 7.013 15.620 490 1HZ LYS 67 HZ1 LYS 67 16.524 5.695 13.342 491 2HZ LYS 67 HZ2 LYS 67 17.457 5.993 14.720 492 3HZ LYS 67 HZ3 LYS 67 17.511 7.067 13.415 493 H GLN 68 HN GLN 68 8.739 8.812 13.777 494 HA GLN 68 HA GLN 68 7.511 8.000 16.312 495 1HB GLN 68 HB1 GLN 68 7.841 10.843 15.343 496 2HB GLN 68 HB2 GLN 68 6.783 10.371 16.666 497 1HG GLN 68 HG2 GLN 68 9.593 9.493 16.857 498 2HG GLN 68 HG1 GLN 68 9.294 11.225 17.009 499 1HE2 GLN 68 HE22 GLN 68 9.080 11.865 19.016 500 2HE2 GLN 68 HE21 GLN 68 8.400 10.954 20.317 501 H MET 69 HN MET 69 6.898 10.038 13.440 502 HA MET 69 HA MET 69 4.097 9.523 13.504 503 1HB MET 69 HB2 MET 69 3.945 10.877 11.563 504 2HB MET 69 HB1 MET 69 5.197 11.590 12.571 505 1HG MET 69 HG2 MET 69 6.868 11.072 11.115 506 2HG MET 69 HG1 MET 69 6.032 9.651 10.488 507 1HE MET 69 HE1 MET 69 7.098 13.256 9.435 508 2HE MET 69 HE2 MET 69 6.801 12.680 7.794 509 3HE MET 69 HE3 MET 69 7.691 11.672 8.935 510 H LEU 70 HN LEU 70 6.655 7.626 12.456 511 HA LEU 70 HA LEU 70 5.696 6.494 10.092 512 1HB LEU 70 HB1 LEU 70 6.919 4.359 11.263 513 2HB LEU 70 HB2 LEU 70 7.727 5.601 10.336 514 HG LEU 70 HG LEU 70 8.453 6.733 12.324 515 1HD1 LEU 70 HD21 LEU 70 6.498 4.938 13.674 516 2HD1 LEU 70 HD22 LEU 70 6.812 6.655 13.922 517 3HD1 LEU 70 HD23 LEU 70 7.936 5.452 14.555 518 1HD2 LEU 70 HD11 LEU 70 9.840 4.900 11.628 519 2HD2 LEU 70 HD12 LEU 70 8.829 3.752 12.506 520 3HD2 LEU 70 HD13 LEU 70 9.787 4.939 13.391 521 H GLY 71 HN GLY 71 4.972 5.670 13.457 522 1HA GLY 71 HA2 GLY 71 2.721 4.072 12.450 523 2HA GLY 71 HA1 GLY 71 3.780 3.395 13.673 524 H GLU 72 HN GLU 72 2.944 6.786 13.643 525 HA GLU 72 HA GLU 72 0.946 6.382 15.740 526 1HB GLU 72 HB1 GLU 72 3.326 8.223 16.048 527 2HB GLU 72 HB2 GLU 72 2.000 8.060 17.189 528 1HG GLU 72 HG2 GLU 72 2.724 5.541 17.189 529 2HG GLU 72 HG1 GLU 72 4.255 6.208 16.623 530 H ARG 73 HN ARG 73 1.743 7.768 12.898 531 HA ARG 73 HA ARG 73 -0.188 9.948 13.290 532 1HB ARG 73 HB1 ARG 73 2.381 10.544 13.008 533 2HB ARG 73 HB2 ARG 73 2.014 10.296 11.306 534 1HG ARG 73 HG1 ARG 73 0.206 12.048 12.878 535 2HG ARG 73 HG2 ARG 73 1.804 12.663 12.449 536 1HD ARG 73 HD2 ARG 73 1.290 12.843 10.265 537 2HD ARG 73 HD1 ARG 73 0.355 11.349 10.260 538 HE ARG 73 HE ARG 73 -1.552 12.554 10.790 539 1HH1 ARG 73 HH11 ARG 73 1.263 14.607 10.857 540 2HH1 ARG 73 HH12 ARG 73 0.349 16.077 10.903 541 1HH2 ARG 73 HH21 ARG 73 -2.764 14.485 10.849 542 2HH2 ARG 73 HH22 ARG 73 -1.939 16.008 10.897 543 H LEU 74 HN LEU 74 1.025 7.346 11.398 544 HA LEU 74 HA LEU 74 -0.400 7.937 8.986 545 1HB LEU 74 HB1 LEU 74 1.288 5.782 10.023 546 2HB LEU 74 HB2 LEU 74 -0.026 5.203 9.020 547 HG LEU 74 HG LEU 74 1.518 7.458 7.927 548 1HD1 LEU 74 HD11 LEU 74 2.765 4.762 7.709 549 2HD1 LEU 74 HD12 LEU 74 3.108 5.762 9.121 550 3HD1 LEU 74 HD13 LEU 74 3.485 6.359 7.504 551 1HD2 LEU 74 HD21 LEU 74 0.726 4.832 6.695 552 2HD2 LEU 74 HD22 LEU 74 1.146 6.334 5.871 553 3HD2 LEU 74 HD23 LEU 74 -0.356 6.222 6.792 554 H PHE 75 HN PHE 75 -1.156 6.590 12.019 555 HA PHE 75 HA PHE 75 -3.062 4.746 11.739 556 1HB PHE 75 HB1 PHE 75 -2.248 6.133 13.818 557 2HB PHE 75 HB2 PHE 75 -3.728 7.039 13.539 558 HD1 PHE 75 HD1 PHE 75 -3.337 3.415 12.952 559 HD2 PHE 75 HD2 PHE 75 -4.849 6.445 15.530 560 HE1 PHE 75 HE1 PHE 75 -4.583 1.713 14.218 561 HE2 PHE 75 HE2 PHE 75 -6.100 4.748 16.797 562 HZ PHE 75 HZ PHE 75 -5.969 2.378 16.141 563 HA PRO 76 HA PRO 76 -6.669 7.787 10.752 564 1HB PRO 76 HB2 PRO 76 -6.066 10.329 10.015 565 2HB PRO 76 HB1 PRO 76 -6.356 9.859 11.694 566 1HG PRO 76 HG2 PRO 76 -3.757 10.251 10.257 567 2HG PRO 76 HG1 PRO 76 -4.228 10.786 11.880 568 1HD PRO 76 HD2 PRO 76 -2.712 8.587 11.468 569 2HD PRO 76 HD1 PRO 76 -3.868 8.704 12.809 570 H LEU 77 HN LEU 77 -3.662 7.882 9.020 571 HA LEU 77 HA LEU 77 -4.945 8.389 6.472 572 1HB LEU 77 HB1 LEU 77 -2.081 7.895 7.261 573 2HB LEU 77 HB2 LEU 77 -2.592 8.078 5.593 574 HG LEU 77 HG LEU 77 -2.847 10.163 7.765 575 1HD1 LEU 77 HD11 LEU 77 -0.823 9.570 5.720 576 2HD1 LEU 77 HD12 LEU 77 -0.681 10.449 7.243 577 3HD1 LEU 77 HD13 LEU 77 -1.330 11.257 5.816 578 1HD2 LEU 77 HD21 LEU 77 -3.701 10.165 4.880 579 2HD2 LEU 77 HD22 LEU 77 -3.493 11.635 5.832 580 3HD2 LEU 77 HD23 LEU 77 -4.698 10.439 6.309 581 H ILE 78 HN ILE 78 -4.082 5.659 8.370 582 HA ILE 78 HA ILE 78 -3.794 3.806 6.188 583 HB ILE 78 HB ILE 78 -4.550 3.098 9.007 584 1HG1 ILE 78 HG12 ILE 78 -2.500 4.550 8.915 585 2HG1 ILE 78 HG11 ILE 78 -2.218 2.943 9.571 586 1HG2 ILE 78 HG21 ILE 78 -2.950 1.119 8.098 587 2HG2 ILE 78 HG22 ILE 78 -3.737 1.626 6.603 588 3HG2 ILE 78 HG23 ILE 78 -4.709 1.110 7.980 589 1HD1 ILE 78 HD11 ILE 78 -1.710 3.558 6.687 590 2HD1 ILE 78 HD12 ILE 78 -1.074 2.241 7.672 591 3HD1 ILE 78 HD13 ILE 78 -0.510 3.890 7.936 592 H GLN 79 HN GLN 79 -6.370 4.892 8.323 593 HA GLN 79 HA GLN 79 -8.390 3.093 7.640 594 1HB GLN 79 HB1 GLN 79 -8.235 5.830 8.722 595 2HB GLN 79 HB2 GLN 79 -9.737 5.469 7.883 596 1HG GLN 79 HG1 GLN 79 -10.429 4.008 9.462 597 2HG GLN 79 HG2 GLN 79 -8.794 3.455 9.825 598 1HE2 GLN 79 HE21 GLN 79 -10.427 6.606 9.923 599 2HE2 GLN 79 HE22 GLN 79 -10.000 6.967 11.558 600 H ALA 80 HN ALA 80 -6.777 5.379 5.757 601 HA ALA 80 HA ALA 80 -8.844 5.820 3.796 602 1HB ALA 80 HB1 ALA 80 -5.926 6.368 3.368 603 2HB ALA 80 HB2 ALA 80 -6.903 7.399 4.418 604 3HB ALA 80 HB3 ALA 80 -7.326 7.222 2.713 605 H MET 81 HN MET 81 -5.970 3.799 4.155 606 HA MET 81 HA MET 81 -6.029 2.783 1.478 607 1HB MET 81 HB1 MET 81 -4.768 1.303 3.763 608 2HB MET 81 HB2 MET 81 -4.230 1.430 2.095 609 1HG MET 81 HG2 MET 81 -3.107 3.341 2.462 610 2HG MET 81 HG1 MET 81 -4.280 3.944 3.626 611 1HE MET 81 HE1 MET 81 -0.272 2.817 4.298 612 2HE MET 81 HE2 MET 81 -1.166 2.766 2.777 613 3HE MET 81 HE3 MET 81 -0.891 1.279 3.688 614 H HIS 82 HN HIS 82 -7.058 1.554 4.625 615 HA HIS 82 HA HIS 82 -8.540 -0.594 3.263 616 1HB HIS 82 HB1 HIS 82 -7.085 -0.403 5.851 617 2HB HIS 82 HB2 HIS 82 -8.532 -1.403 5.822 618 HD2 HIS 82 HD2 HIS 82 -5.603 -1.178 3.174 619 HE1 HIS 82 HE1 HIS 82 -6.187 -5.188 4.395 620 HE2 HIS 82 HE2 HIS 82 -4.875 -3.649 2.862 621 HA PRO 83 HA PRO 83 -12.422 1.058 4.591 622 1HB PRO 83 HB1 PRO 83 -13.753 -1.159 5.473 623 2HB PRO 83 HB2 PRO 83 -13.515 -0.778 3.765 624 1HG PRO 83 HG1 PRO 83 -11.979 -2.656 5.521 625 2HG PRO 83 HG2 PRO 83 -12.532 -2.884 3.851 626 1HD PRO 83 HD2 PRO 83 -9.986 -2.231 4.430 627 2HD PRO 83 HD1 PRO 83 -10.802 -1.624 2.972 628 H THR 84 HN THR 84 -11.122 2.093 6.380 629 HA THR 84 HA THR 84 -10.703 2.603 8.554 630 HB THR 84 HB THR 84 -12.912 1.974 9.993 631 HG1 THR 84 HG1 THR 84 -14.433 1.279 8.757 632 1HG2 THR 84 HG21 THR 84 -12.771 4.191 9.984 633 2HG2 THR 84 HG22 THR 84 -13.879 4.107 8.614 634 3HG2 THR 84 HG23 THR 84 -12.143 4.244 8.338 635 H LEU 85 HN LEU 85 -9.686 0.092 7.821 636 HA LEU 85 HA LEU 85 -10.250 -1.692 10.059 637 1HB LEU 85 HB1 LEU 85 -9.235 -1.983 7.365 638 2HB LEU 85 HB2 LEU 85 -8.182 -2.775 8.519 639 HG LEU 85 HG LEU 85 -9.798 -4.356 7.648 640 1HD1 LEU 85 HD11 LEU 85 -10.650 -5.230 9.706 641 2HD1 LEU 85 HD12 LEU 85 -10.545 -3.649 10.479 642 3HD1 LEU 85 HD13 LEU 85 -9.073 -4.507 10.023 643 1HD2 LEU 85 HD21 LEU 85 -11.597 -2.976 6.969 644 2HD2 LEU 85 HD22 LEU 85 -11.827 -2.352 8.602 645 3HD2 LEU 85 HD23 LEU 85 -12.226 -4.031 8.235 646 H ALA 86 HN ALA 86 -8.438 0.937 9.716 647 HA ALA 86 HA ALA 86 -5.894 0.061 10.712 648 1HB ALA 86 HB1 ALA 86 -5.697 2.011 9.507 649 2HB ALA 86 HB2 ALA 86 -5.715 2.629 11.160 650 3HB ALA 86 HB3 ALA 86 -7.176 2.705 10.174 651 H GLY 87 HN GLY 87 -7.202 -1.181 12.463 652 1HA GLY 87 HA2 GLY 87 -7.719 0.526 14.801 653 2HA GLY 87 HA1 GLY 87 -8.183 -1.166 14.645 654 H LYS 88 HN LYS 88 -5.317 -1.209 13.323 655 HA LYS 88 HA LYS 88 -3.421 -0.839 15.342 656 1HB LYS 88 HB1 LYS 88 -4.650 -2.663 16.469 657 2HB LYS 88 HB2 LYS 88 -4.395 -3.693 15.071 658 1HG LYS 88 HG2 LYS 88 -2.853 -4.250 16.858 659 2HG LYS 88 HG1 LYS 88 -1.985 -3.631 15.448 660 1HD LYS 88 HD2 LYS 88 -2.524 -1.375 16.974 661 2HD LYS 88 HD1 LYS 88 -2.083 -2.610 18.156 662 1HE LYS 88 HE1 LYS 88 -0.118 -3.097 16.526 663 2HE LYS 88 HE2 LYS 88 -0.470 -1.493 15.895 664 1HZ LYS 88 HZ1 LYS 88 0.118 -2.087 18.744 665 2HZ LYS 88 HZ2 LYS 88 -0.110 -0.555 18.064 666 3HZ LYS 88 HZ3 LYS 88 1.241 -1.479 17.635 667 H ILE 89 HN ILE 89 -3.805 -0.533 12.451 668 HA ILE 89 HA ILE 89 -2.119 -2.516 11.233 669 HB ILE 89 HB ILE 89 -3.121 0.069 10.052 670 1HG1 ILE 89 HG12 ILE 89 -4.168 -2.754 9.708 671 2HG1 ILE 89 HG11 ILE 89 -4.888 -1.566 10.791 672 1HG2 ILE 89 HG21 ILE 89 -2.617 -1.947 8.127 673 2HG2 ILE 89 HG22 ILE 89 -1.199 -1.840 9.172 674 3HG2 ILE 89 HG23 ILE 89 -1.789 -0.404 8.333 675 1HD1 ILE 89 HD11 ILE 89 -5.582 -0.211 9.000 676 2HD1 ILE 89 HD12 ILE 89 -5.991 -1.866 8.548 677 3HD1 ILE 89 HD13 ILE 89 -4.574 -1.085 7.848 678 H THR 90 HN THR 90 -1.625 0.930 10.645 679 HA THR 90 HA THR 90 1.145 0.786 10.439 680 HB THR 90 HB THR 90 -0.852 2.799 10.386 681 HG1 THR 90 HG1 THR 90 1.745 3.482 9.756 682 1HG2 THR 90 HG21 THR 90 -0.325 3.838 12.372 683 2HG2 THR 90 HG22 THR 90 0.674 4.697 11.198 684 3HG2 THR 90 HG23 THR 90 1.392 3.460 12.232 685 H GLY 91 HN GLY 91 -0.848 1.391 13.312 686 1HA GLY 91 HA2 GLY 91 1.193 2.093 15.107 687 2HA GLY 91 HA1 GLY 91 -0.303 1.276 15.548 688 H MET 92 HN MET 92 0.240 -0.924 13.713 689 HA MET 92 HA MET 92 1.808 -2.590 15.470 690 1HB MET 92 HB1 MET 92 -0.261 -3.118 13.809 691 2HB MET 92 HB2 MET 92 1.078 -3.547 12.759 692 1HG MET 92 HG1 MET 92 1.672 -5.336 13.988 693 2HG MET 92 HG2 MET 92 1.134 -4.624 15.508 694 1HE MET 92 HE1 MET 92 -1.635 -5.477 12.233 695 2HE MET 92 HE2 MET 92 -0.862 -7.053 12.404 696 3HE MET 92 HE3 MET 92 0.121 -5.614 12.126 697 H LEU 93 HN LEU 93 2.157 -0.997 12.409 698 HA LEU 93 HA LEU 93 4.406 -2.272 11.412 699 1HB LEU 93 HB2 LEU 93 3.150 0.380 11.044 700 2HB LEU 93 HB1 LEU 93 4.734 0.121 10.355 701 HG LEU 93 HG LEU 93 2.953 -0.283 8.713 702 1HD1 LEU 93 HD11 LEU 93 4.689 -1.555 8.021 703 2HD1 LEU 93 HD12 LEU 93 3.597 -2.875 8.440 704 3HD1 LEU 93 HD13 LEU 93 4.849 -2.373 9.576 705 1HD2 LEU 93 HD21 LEU 93 1.891 -1.938 10.908 706 2HD2 LEU 93 HD22 LEU 93 1.783 -2.647 9.294 707 3HD2 LEU 93 HD23 LEU 93 1.051 -1.075 9.616 708 H LEU 94 HN LEU 94 4.200 -0.589 14.243 709 HA LEU 94 HA LEU 94 7.056 0.112 14.175 710 1HB LEU 94 HB1 LEU 94 4.713 1.401 15.379 711 2HB LEU 94 HB2 LEU 94 6.073 1.239 16.471 712 HG LEU 94 HG LEU 94 5.950 3.417 15.211 713 1HD1 LEU 94 HD21 LEU 94 8.359 3.448 14.674 714 2HD1 LEU 94 HD22 LEU 94 8.395 1.693 14.848 715 3HD1 LEU 94 HD23 LEU 94 8.015 2.709 16.238 716 1HD2 LEU 94 HD11 LEU 94 6.645 1.629 12.882 717 2HD2 LEU 94 HD12 LEU 94 6.757 3.391 12.873 718 3HD2 LEU 94 HD13 LEU 94 5.187 2.607 13.067 719 H GLU 95 HN GLU 95 5.781 -2.486 14.502 720 HA GLU 95 HA GLU 95 7.295 -3.472 16.679 721 1HB GLU 95 HB2 GLU 95 5.631 -4.105 18.231 722 2HB GLU 95 HB1 GLU 95 5.289 -2.425 17.843 723 1HG GLU 95 HG1 GLU 95 3.452 -3.018 16.474 724 2HG GLU 95 HG2 GLU 95 3.902 -4.722 16.494 725 H ILE 96 HN ILE 96 5.816 -3.807 13.795 726 HA ILE 96 HA ILE 96 4.856 -6.449 13.766 727 HB ILE 96 HB ILE 96 5.186 -6.456 11.369 728 1HG1 ILE 96 HG12 ILE 96 7.408 -5.461 11.265 729 2HG1 ILE 96 HG11 ILE 96 6.292 -4.625 10.193 730 1HG2 ILE 96 HG21 ILE 96 4.152 -3.866 12.468 731 2HG2 ILE 96 HG22 ILE 96 3.241 -5.310 12.028 732 3HG2 ILE 96 HG23 ILE 96 4.002 -4.330 10.773 733 1HD1 ILE 96 HD11 ILE 96 6.143 -3.213 12.558 734 2HD1 ILE 96 HD12 ILE 96 7.009 -2.746 11.093 735 3HD1 ILE 96 HD13 ILE 96 7.852 -3.608 12.381 736 H ASP 97 HN ASP 97 6.449 -7.416 11.515 737 HA ASP 97 HA ASP 97 8.263 -9.103 12.810 738 1HB ASP 97 HB1 ASP 97 7.097 -9.148 10.425 739 2HB ASP 97 HB2 ASP 97 8.619 -8.416 9.922 740 H ASN 98 HN ASN 98 8.526 -5.871 12.348 741 HA ASN 98 HA ASN 98 10.188 -4.408 12.775 742 1HB ASN 98 HB1 ASN 98 11.774 -6.932 13.105 743 2HB ASN 98 HB2 ASN 98 12.585 -5.370 13.072 744 1HD2 ASN 98 HD21 ASN 98 11.594 -3.711 14.568 745 2HD2 ASN 98 HD22 ASN 98 11.152 -4.263 16.144 746 H SER 99 HN SER 99 10.575 -6.807 10.301 747 HA SER 99 HA SER 99 12.489 -5.331 8.759 748 1HB SER 99 HB2 SER 99 12.618 -7.268 7.650 749 2HB SER 99 HB1 SER 99 11.292 -7.906 8.625 750 HG SER 99 HG SER 99 10.060 -7.763 6.943 751 H GLU 100 HN GLU 100 9.020 -5.518 8.997 752 HA GLU 100 HA GLU 100 8.472 -3.958 6.648 753 1HB GLU 100 HB1 GLU 100 6.524 -4.154 8.888 754 2HB GLU 100 HB2 GLU 100 6.252 -4.227 7.154 755 1HG GLU 100 HG1 GLU 100 7.769 -6.456 7.616 756 2HG GLU 100 HG2 GLU 100 6.756 -6.364 9.057 757 H LEU 101 HN LEU 101 9.322 -3.348 9.915 758 HA LEU 101 HA LEU 101 8.402 -0.627 10.006 759 1HB LEU 101 HB2 LEU 101 8.614 -1.361 12.149 760 2HB LEU 101 HB1 LEU 101 9.917 -2.463 11.756 761 HG LEU 101 HG LEU 101 11.298 -0.218 11.519 762 1HD1 LEU 101 HD11 LEU 101 8.946 0.909 12.165 763 2HD1 LEU 101 HD12 LEU 101 10.511 1.624 12.555 764 3HD1 LEU 101 HD13 LEU 101 9.636 0.698 13.774 765 1HD2 LEU 101 HD21 LEU 101 11.872 -0.435 13.943 766 2HD2 LEU 101 HD22 LEU 101 11.923 -1.945 13.034 767 3HD2 LEU 101 HD23 LEU 101 10.553 -1.597 14.088 768 H LEU 102 HN LEU 102 11.159 -2.331 8.852 769 HA LEU 102 HA LEU 102 12.837 0.043 8.673 770 1HB LEU 102 HB2 LEU 102 13.210 -2.859 8.509 771 2HB LEU 102 HB1 LEU 102 14.134 -1.969 7.316 772 HG LEU 102 HG LEU 102 14.862 -0.530 9.396 773 1HD1 LEU 102 HD21 LEU 102 13.612 -2.939 10.577 774 2HD1 LEU 102 HD22 LEU 102 13.764 -1.305 11.223 775 3HD1 LEU 102 HD23 LEU 102 15.144 -2.403 11.268 776 1HD2 LEU 102 HD11 LEU 102 16.684 -2.300 9.803 777 2HD2 LEU 102 HD12 LEU 102 16.527 -1.610 8.188 778 3HD2 LEU 102 HD13 LEU 102 15.872 -3.212 8.531 779 H HIS 103 HN HIS 103 11.251 -2.256 6.495 780 HA HIS 103 HA HIS 103 12.176 -1.018 4.133 781 1HB HIS 103 HB1 HIS 103 10.823 -3.339 4.777 782 2HB HIS 103 HB2 HIS 103 9.605 -2.407 3.918 783 HD2 HIS 103 HD2 HIS 103 10.456 -4.920 2.308 784 HE1 HIS 103 HE1 HIS 103 13.202 -2.428 0.267 785 HE2 HIS 103 HE2 HIS 103 11.972 -4.645 0.220 786 H MET 104 HN MET 104 9.295 -0.584 6.119 787 HA MET 104 HA MET 104 7.805 1.022 4.383 788 1HB MET 104 HB2 MET 104 6.601 1.779 6.363 789 2HB MET 104 HB1 MET 104 6.908 0.047 6.468 790 1HG MET 104 HG1 MET 104 8.184 0.269 8.289 791 2HG MET 104 HG2 MET 104 8.974 1.715 7.673 792 1HE MET 104 HE1 MET 104 5.492 0.567 8.225 793 2HE MET 104 HE2 MET 104 4.923 2.189 7.819 794 3HE MET 104 HE3 MET 104 4.799 1.602 9.478 795 H LEU 105 HN LEU 105 10.450 1.829 6.550 796 HA LEU 105 HA LEU 105 10.151 4.684 6.049 797 1HB LEU 105 HB1 LEU 105 12.444 3.359 7.476 798 2HB LEU 105 HB2 LEU 105 11.886 5.013 7.628 799 HG LEU 105 HG LEU 105 10.305 2.621 8.564 800 1HD1 LEU 105 HD11 LEU 105 11.132 2.918 10.716 801 2HD1 LEU 105 HD12 LEU 105 11.774 4.520 10.354 802 3HD1 LEU 105 HD13 LEU 105 12.569 3.085 9.707 803 1HD2 LEU 105 HD21 LEU 105 9.765 5.448 8.296 804 2HD2 LEU 105 HD22 LEU 105 9.581 4.898 9.964 805 3HD2 LEU 105 HD23 LEU 105 8.668 4.118 8.671 806 H GLU 106 HN GLU 106 11.526 2.024 4.600 807 HA GLU 106 HA GLU 106 13.671 3.587 3.383 808 1HB GLU 106 HB2 GLU 106 13.226 0.654 3.858 809 2HB GLU 106 HB1 GLU 106 14.392 1.188 2.645 810 1HG GLU 106 HG2 GLU 106 14.389 1.805 5.581 811 2HG GLU 106 HG1 GLU 106 15.503 0.737 4.726 812 H SER 107 HN SER 107 10.573 2.604 2.666 813 HA SER 107 HA SER 107 11.049 3.063 -0.179 814 1HB SER 107 HB2 SER 107 11.024 0.507 0.560 815 2HB SER 107 HB1 SER 107 9.283 0.757 0.461 816 HG SER 107 HG SER 107 10.054 1.807 -1.702 817 HA PRO 108 HA PRO 108 7.359 5.465 0.466 818 1HB PRO 108 HB2 PRO 108 7.224 5.568 -2.474 819 2HB PRO 108 HB1 PRO 108 7.396 6.884 -1.311 820 1HG PRO 108 HG2 PRO 108 9.433 6.121 -2.879 821 2HG PRO 108 HG1 PRO 108 9.694 6.679 -1.216 822 1HD PRO 108 HD1 PRO 108 9.651 3.883 -2.294 823 2HD PRO 108 HD2 PRO 108 10.742 4.612 -1.097 824 H GLU 109 HN GLU 109 7.520 2.409 -0.789 825 HA GLU 109 HA GLU 109 4.588 2.270 -1.086 826 1HB GLU 109 HB2 GLU 109 6.686 0.758 -2.662 827 2HB GLU 109 HB1 GLU 109 4.960 0.425 -2.728 828 1HG GLU 109 HG1 GLU 109 4.605 2.754 -3.519 829 2HG GLU 109 HG2 GLU 109 6.356 2.946 -3.589 830 H SER 110 HN SER 110 7.453 1.049 0.354 831 HA SER 110 HA SER 110 6.532 -1.515 1.115 832 1HB SER 110 HB1 SER 110 8.806 0.173 1.708 833 2HB SER 110 HB2 SER 110 8.216 -0.636 3.163 834 HG SER 110 HG SER 110 8.714 -2.545 2.319 835 H LEU 111 HN LEU 111 6.500 1.611 2.756 836 HA LEU 111 HA LEU 111 5.326 0.879 5.131 837 1HB LEU 111 HB1 LEU 111 6.138 3.147 4.514 838 2HB LEU 111 HB2 LEU 111 4.695 3.359 3.539 839 HG LEU 111 HG LEU 111 4.116 2.571 6.287 840 1HD1 LEU 111 HD11 LEU 111 5.388 3.982 7.398 841 2HD1 LEU 111 HD12 LEU 111 4.735 5.324 6.458 842 3HD1 LEU 111 HD13 LEU 111 6.176 4.473 5.890 843 1HD2 LEU 111 HD21 LEU 111 2.446 4.258 6.089 844 2HD2 LEU 111 HD22 LEU 111 2.504 3.375 4.558 845 3HD2 LEU 111 HD23 LEU 111 3.252 4.969 4.690 846 H ARG 112 HN ARG 112 3.976 0.923 1.980 847 HA ARG 112 HA ARG 112 1.239 0.743 2.966 848 1HB ARG 112 HB1 ARG 112 2.466 1.019 0.236 849 2HB ARG 112 HB2 ARG 112 0.764 0.598 0.451 850 1HG ARG 112 HG2 ARG 112 0.242 2.623 1.399 851 2HG ARG 112 HG1 ARG 112 1.914 2.931 1.877 852 1HD ARG 112 HD2 ARG 112 1.028 4.321 -0.052 853 2HD ARG 112 HD1 ARG 112 2.554 3.481 -0.329 854 HE ARG 112 HE ARG 112 0.206 2.042 -1.195 855 1HH1 ARG 112 HH21 ARG 112 2.705 4.307 -2.073 856 2HH1 ARG 112 HH22 ARG 112 2.562 4.004 -3.771 857 1HH2 ARG 112 HH11 ARG 112 0.011 1.637 -3.428 858 2HH2 ARG 112 HH12 ARG 112 1.030 2.486 -4.542 859 H SER 113 HN SER 113 3.204 -1.106 0.647 860 HA SER 113 HA SER 113 1.640 -3.384 0.541 861 1HB SER 113 HB2 SER 113 3.728 -2.839 -0.833 862 2HB SER 113 HB1 SER 113 4.660 -3.470 0.525 863 HG SER 113 HG SER 113 2.578 -5.028 -0.503 864 H LYS 114 HN LYS 114 3.750 -2.235 3.022 865 HA LYS 114 HA LYS 114 3.791 -4.746 4.480 866 1HB LYS 114 HB1 LYS 114 4.798 -1.999 5.241 867 2HB LYS 114 HB2 LYS 114 4.978 -3.442 6.231 868 1HG LYS 114 HG1 LYS 114 6.106 -3.095 3.462 869 2HG LYS 114 HG2 LYS 114 7.009 -2.885 4.963 870 1HD LYS 114 HD1 LYS 114 6.545 -5.227 5.553 871 2HD LYS 114 HD2 LYS 114 5.689 -5.429 4.022 872 1HE LYS 114 HE1 LYS 114 7.666 -6.109 3.223 873 2HE LYS 114 HE2 LYS 114 8.078 -4.395 3.203 874 1HZ LYS 114 HZ1 LYS 114 9.599 -6.133 4.401 875 2HZ LYS 114 HZ2 LYS 114 8.514 -5.903 5.678 876 3HZ LYS 114 HZ3 LYS 114 9.375 -4.589 5.052 877 H VAL 115 HN VAL 115 2.264 -1.544 4.714 878 HA VAL 115 HA VAL 115 0.930 -2.058 7.164 879 HB VAL 115 HB VAL 115 0.773 0.038 5.090 880 1HG1 VAL 115 HG11 VAL 115 -1.468 0.157 5.017 881 2HG1 VAL 115 HG12 VAL 115 -1.369 0.724 6.685 882 3HG1 VAL 115 HG13 VAL 115 -1.651 -0.983 6.355 883 1HG2 VAL 115 HG21 VAL 115 0.317 0.511 7.978 884 2HG2 VAL 115 HG22 VAL 115 1.296 1.409 6.817 885 3HG2 VAL 115 HG23 VAL 115 1.896 -0.107 7.489 886 H ASP 116 HN ASP 116 -0.373 -2.033 3.829 887 HA ASP 116 HA ASP 116 -2.870 -3.071 4.343 888 1HB ASP 116 HB1 ASP 116 -2.736 -2.502 2.141 889 2HB ASP 116 HB2 ASP 116 -1.061 -3.026 2.001 890 H GLU 117 HN GLU 117 0.175 -4.815 3.913 891 HA GLU 117 HA GLU 117 -1.005 -7.416 4.076 892 1HB GLU 117 HB1 GLU 117 1.740 -6.298 3.992 893 2HB GLU 117 HB2 GLU 117 1.566 -7.869 4.763 894 1HG GLU 117 HG2 GLU 117 0.363 -8.629 2.687 895 2HG GLU 117 HG1 GLU 117 0.870 -7.114 1.941 896 H ALA 118 HN ALA 118 0.290 -5.104 6.354 897 HA ALA 118 HA ALA 118 0.416 -6.874 8.581 898 1HB ALA 118 HB1 ALA 118 -0.021 -3.952 8.949 899 2HB ALA 118 HB2 ALA 118 1.497 -4.519 8.251 900 3HB ALA 118 HB3 ALA 118 1.006 -5.067 9.855 901 H VAL 119 HN VAL 119 -2.104 -5.197 6.954 902 HA VAL 119 HA VAL 119 -4.017 -5.095 9.048 903 HB VAL 119 HB VAL 119 -4.616 -5.411 6.123 904 1HG1 VAL 119 HG11 VAL 119 -6.527 -5.728 7.539 905 2HG1 VAL 119 HG12 VAL 119 -6.654 -4.143 6.770 906 3HG1 VAL 119 HG13 VAL 119 -6.146 -4.267 8.453 907 1HG2 VAL 119 HG21 VAL 119 -3.784 -3.400 5.719 908 2HG2 VAL 119 HG22 VAL 119 -3.186 -3.324 7.376 909 3HG2 VAL 119 HG23 VAL 119 -4.793 -2.708 6.987 910 H ALA 120 HN ALA 120 -3.321 -7.380 6.460 911 HA ALA 120 HA ALA 120 -5.289 -9.285 7.064 912 1HB ALA 120 HB1 ALA 120 -2.856 -10.494 6.097 913 2HB ALA 120 HB2 ALA 120 -3.193 -8.995 5.224 914 3HB ALA 120 HB3 ALA 120 -4.402 -10.284 5.274 915 H VAL 121 HN VAL 121 -2.229 -8.499 8.454 916 HA VAL 121 HA VAL 121 -1.998 -10.894 10.040 917 HB VAL 121 HB VAL 121 -0.424 -8.339 9.842 918 1HG1 VAL 121 HG21 VAL 121 0.550 -8.609 11.807 919 2HG1 VAL 121 HG22 VAL 121 0.879 -10.310 11.473 920 3HG1 VAL 121 HG23 VAL 121 -0.664 -9.833 12.183 921 1HG2 VAL 121 HG11 VAL 121 1.041 -9.514 8.601 922 2HG2 VAL 121 HG12 VAL 121 -0.340 -10.579 8.335 923 3HG2 VAL 121 HG13 VAL 121 0.855 -10.974 9.572 924 H LEU 122 HN LEU 122 -3.143 -7.612 10.407 925 HA LEU 122 HA LEU 122 -3.338 -7.670 13.255 926 1HB LEU 122 HB2 LEU 122 -3.583 -5.487 12.932 927 2HB LEU 122 HB1 LEU 122 -3.639 -5.748 11.201 928 HG LEU 122 HG LEU 122 -6.225 -6.339 12.055 929 1HD1 LEU 122 HD11 LEU 122 -6.845 -5.025 13.753 930 2HD1 LEU 122 HD12 LEU 122 -5.858 -3.675 13.192 931 3HD1 LEU 122 HD13 LEU 122 -5.126 -4.968 14.143 932 1HD2 LEU 122 HD21 LEU 122 -6.850 -4.498 10.743 933 2HD2 LEU 122 HD22 LEU 122 -5.346 -5.082 10.030 934 3HD2 LEU 122 HD23 LEU 122 -5.337 -3.651 11.061 935 H GLN 123 HN GLN 123 -5.540 -8.248 10.572 936 HA GLN 123 HA GLN 123 -7.896 -8.572 12.068 937 1HB GLN 123 HB1 GLN 123 -6.995 -9.524 9.363 938 2HB GLN 123 HB2 GLN 123 -8.540 -10.045 10.021 939 1HG GLN 123 HG1 GLN 123 -7.719 -7.175 9.622 940 2HG GLN 123 HG2 GLN 123 -8.715 -8.109 8.507 941 1HE2 GLN 123 HE21 GLN 123 -10.837 -8.471 8.969 942 2HE2 GLN 123 HE22 GLN 123 -11.659 -7.752 10.306 943 H ALA 124 HN ALA 124 -5.291 -10.744 11.204 944 HA ALA 124 HA ALA 124 -6.510 -13.123 12.210 945 1HB ALA 124 HB1 ALA 124 -4.038 -13.886 12.227 946 2HB ALA 124 HB2 ALA 124 -3.732 -12.354 11.407 947 3HB ALA 124 HB3 ALA 124 -4.816 -13.543 10.683 948 H HIS 125 HN HIS 125 -3.512 -11.720 13.425 949 HA HIS 125 HA HIS 125 -3.213 -12.766 15.803 950 1HB HIS 125 HB1 HIS 125 -2.182 -10.545 14.662 951 2HB HIS 125 HB2 HIS 125 -3.078 -9.811 15.988 952 HD2 HIS 125 HD2 HIS 125 -0.902 -9.167 17.508 953 HE1 HIS 125 HE1 HIS 125 0.517 -13.132 17.940 954 HE2 HIS 125 HE2 HIS 125 0.793 -10.728 18.701 955 H GLN 126 HN GLN 126 -5.678 -10.306 15.207 956 HA GLN 126 HA GLN 126 -6.491 -9.951 17.869 957 1HB GLN 126 HB1 GLN 126 -7.921 -9.605 15.240 958 2HB GLN 126 HB2 GLN 126 -8.704 -9.260 16.776 959 1HG GLN 126 HG2 GLN 126 -6.121 -7.985 15.910 960 2HG GLN 126 HG1 GLN 126 -7.710 -7.288 15.594 961 1HE2 GLN 126 HE21 GLN 126 -8.438 -5.904 17.033 962 2HE2 GLN 126 HE22 GLN 126 -7.925 -5.779 18.678 963 H ALA 127 HN ALA 127 -8.683 -11.468 15.534 964 HA ALA 127 HA ALA 127 -9.580 -13.263 17.650 965 1HB ALA 127 HB1 ALA 127 -11.003 -11.737 15.975 966 2HB ALA 127 HB2 ALA 127 -11.624 -13.220 16.701 967 3HB ALA 127 HB3 ALA 127 -10.984 -13.244 15.058 968 H LYS 128 HN LYS 128 -7.057 -13.841 16.143 969 HA LYS 128 HA LYS 128 -7.834 -16.247 14.663 970 1HB LYS 128 HB2 LYS 128 -5.621 -16.345 13.808 971 2HB LYS 128 HB1 LYS 128 -6.106 -14.656 13.725 972 1HG LYS 128 HG1 LYS 128 -4.470 -14.018 15.103 973 2HG LYS 128 HG2 LYS 128 -4.751 -15.361 16.210 974 1HD LYS 128 HD2 LYS 128 -3.049 -16.520 15.357 975 2HD LYS 128 HD1 LYS 128 -3.630 -16.277 13.709 976 1HE LYS 128 HE1 LYS 128 -2.668 -13.833 14.173 977 2HE LYS 128 HE2 LYS 128 -1.631 -14.745 15.269 978 1HZ LYS 128 HZ1 LYS 128 -0.441 -14.817 13.328 979 2HZ LYS 128 HZ2 LYS 128 -1.813 -14.886 12.340 980 3HZ LYS 128 HZ3 LYS 128 -1.319 -16.257 13.200 981 H GLU 129 HN GLU 129 -5.485 -17.697 15.063 982 HA GLU 129 HA GLU 129 -6.031 -18.841 17.695 983 1HB GLU 129 HB2 GLU 129 -5.746 -20.158 15.449 984 2HB GLU 129 HB1 GLU 129 -4.028 -19.951 15.757 985 1HG GLU 129 HG2 GLU 129 -4.143 -21.184 17.768 986 2HG GLU 129 HG1 GLU 129 -5.905 -21.150 17.770 987 H ALA 130 HN ALA 130 -4.669 -16.268 17.286 988 HA ALA 130 HA ALA 130 -1.910 -16.434 17.588 989 1HB ALA 130 HB1 ALA 130 -3.334 -14.250 18.995 990 2HB ALA 130 HB2 ALA 130 -3.583 -14.398 17.254 991 3HB ALA 130 HB3 ALA 130 -1.954 -14.185 17.897 992 H ALA 131 HN ALA 131 -4.043 -15.393 20.226 993 HA ALA 131 HA ALA 131 -2.225 -16.618 22.156 994 1HB ALA 131 HB1 ALA 131 -3.269 -15.286 23.812 995 2HB ALA 131 HB2 ALA 131 -4.641 -14.931 22.763 996 3HB ALA 131 HB3 ALA 131 -3.054 -14.252 22.399 997 H GLN 132 HN GLN 132 -3.948 -17.108 24.261 998 HA GLN 132 HA GLN 132 -5.044 -19.648 23.485 999 1HB GLN 132 HB2 GLN 132 -4.990 -18.166 26.117 1000 2HB GLN 132 HB1 GLN 132 -5.706 -19.760 25.921 1001 1HG GLN 132 HG1 GLN 132 -3.438 -20.484 25.019 1002 2HG GLN 132 HG2 GLN 132 -2.828 -18.963 25.671 1003 1HE2 GLN 132 HE22 GLN 132 -1.753 -21.233 26.592 1004 2HE2 GLN 132 HE21 GLN 132 -2.274 -21.553 28.208 1005 H LYS 133 HN LYS 133 -7.259 -20.308 24.115 1006 HA LYS 133 HA LYS 133 -9.169 -18.501 22.996 1007 1HB LYS 133 HB2 LYS 133 -9.002 -21.241 23.296 1008 2HB LYS 133 HB1 LYS 133 -10.263 -20.801 24.440 1009 1HG LYS 133 HG1 LYS 133 -11.683 -20.050 22.798 1010 2HG LYS 133 HG2 LYS 133 -10.371 -19.721 21.665 1011 1HD LYS 133 HD1 LYS 133 -10.657 -22.538 22.452 1012 2HD LYS 133 HD2 LYS 133 -12.011 -21.879 21.532 1013 1HE LYS 133 HE2 LYS 133 -10.758 -22.432 19.749 1014 2HE LYS 133 HE1 LYS 133 -9.921 -20.923 20.108 1015 1HZ LYS 133 HZ1 LYS 133 -8.435 -22.348 21.577 1016 2HZ LYS 133 HZ2 LYS 133 -8.238 -22.497 19.904 1017 3HZ LYS 133 HZ3 LYS 133 -9.088 -23.680 20.762 1018 H ALA 134 HN ALA 134 -9.792 -16.776 24.135 1019 HA ALA 134 HA ALA 134 -10.066 -16.917 27.023 1020 1HB ALA 134 HB1 ALA 134 -9.221 -14.933 25.406 1021 2HB ALA 134 HB2 ALA 134 -9.859 -14.675 27.029 1022 3HB ALA 134 HB3 ALA 134 -10.908 -14.465 25.626 1023 H VAL 135 HN VAL 135 -12.139 -15.117 27.444 1024 HA VAL 135 HA VAL 135 -14.400 -16.849 27.224 1025 HB VAL 135 HB VAL 135 -13.984 -15.323 29.162 1026 1HG1 VAL 135 HG21 VAL 135 -14.534 -13.269 27.062 1027 2HG1 VAL 135 HG22 VAL 135 -13.297 -13.286 28.318 1028 3HG1 VAL 135 HG23 VAL 135 -14.976 -12.954 28.740 1029 1HG2 VAL 135 HG11 VAL 135 -16.450 -15.908 27.837 1030 2HG2 VAL 135 HG12 VAL 135 -16.572 -14.345 28.645 1031 3HG2 VAL 135 HG13 VAL 135 -16.116 -15.779 29.565 1032 H ASN 136 HN ASN 136 -13.081 -14.413 25.239 1033 HA ASN 136 HA ASN 136 -15.578 -13.696 23.966 1034 1HB ASN 136 HB1 ASN 136 -13.387 -12.259 24.291 1035 2HB ASN 136 HB2 ASN 136 -12.911 -13.034 22.782 1036 1HD2 ASN 136 HD22 ASN 136 -13.043 -11.368 21.408 1037 2HD2 ASN 136 HD21 ASN 136 -14.485 -10.476 21.079 1038 H SER 137 HN SER 137 -14.870 -16.495 23.916 1039 HA SER 137 HA SER 137 -14.089 -17.021 21.161 1040 1HB SER 137 HB1 SER 137 -13.207 -18.841 22.135 1041 2HB SER 137 HB2 SER 137 -14.052 -18.502 23.645 1042 HG SER 137 HG SER 137 -14.576 -20.540 22.521 1043 H ALA 138 HN ALA 138 -15.441 -17.612 19.564 1044 HA ALA 138 HA ALA 138 -18.249 -17.234 19.913 1045 1HB ALA 138 HB1 ALA 138 -16.409 -17.645 17.680 1046 2HB ALA 138 HB2 ALA 138 -17.859 -16.646 17.790 1047 3HB ALA 138 HB3 ALA 138 -17.999 -18.369 17.442 1048 H THR 139 HN THR 139 -19.530 -19.082 18.442 1049 HA THR 139 HA THR 139 -19.323 -21.458 20.130 1050 HB THR 139 HB THR 139 -21.519 -20.543 20.084 1051 HG1 THR 139 HG1 THR 139 -22.312 -22.367 18.331 1052 1HG2 THR 139 HG21 THR 139 -22.146 -19.267 18.391 1053 2HG2 THR 139 HG22 THR 139 -22.531 -20.759 17.534 1054 3HG2 THR 139 HG23 THR 139 -20.960 -19.989 17.304 1055 H GLY 140 HN GLY 140 -17.267 -21.804 18.741 1056 1HA GLY 140 HA2 GLY 140 -17.881 -23.074 16.173 1057 2HA GLY 140 HA1 GLY 140 -16.279 -22.672 16.771 1058 H VAL 141 HN VAL 141 -18.641 -25.096 16.451 1059 HA VAL 141 HA VAL 141 -17.558 -26.840 18.487 1060 HB VAL 141 HB VAL 141 -19.127 -28.530 17.527 1061 1HG1 VAL 141 HG21 VAL 141 -20.795 -27.725 18.804 1062 2HG1 VAL 141 HG22 VAL 141 -20.862 -26.192 17.932 1063 3HG1 VAL 141 HG23 VAL 141 -19.640 -26.445 19.179 1064 1HG2 VAL 141 HG11 VAL 141 -20.663 -27.964 15.812 1065 2HG2 VAL 141 HG12 VAL 141 -19.063 -27.526 15.214 1066 3HG2 VAL 141 HG13 VAL 141 -20.152 -26.276 15.815 1067 HA PRO 142 HA PRO 142 -17.188 -28.865 18.971 1068 1HB PRO 142 HB1 PRO 142 -14.994 -30.221 19.705 1069 2HB PRO 142 HB2 PRO 142 -16.192 -30.921 18.609 1070 1HG PRO 142 HG2 PRO 142 -13.553 -29.655 17.978 1071 2HG PRO 142 HG1 PRO 142 -14.275 -31.127 17.305 1072 1HD PRO 142 HD1 PRO 142 -14.326 -28.687 16.053 1073 2HD PRO 142 HD2 PRO 142 -15.538 -29.957 15.793 1074 H THR 143 HN THR 143 -16.883 -27.807 20.863 1075 HA THR 143 HA THR 143 -14.717 -25.834 20.958 1076 HB THR 143 HB THR 143 -17.160 -26.019 22.730 1077 HG1 THR 143 HG1 THR 143 -17.067 -24.024 20.859 1078 1HG2 THR 143 HG21 THR 143 -15.411 -24.661 23.702 1079 2HG2 THR 143 HG22 THR 143 -16.759 -23.658 23.166 1080 3HG2 THR 143 HG23 THR 143 -15.280 -23.733 22.209 1081 H VAL 144 HN VAL 144 -12.944 -26.525 21.959 1082 HA VAL 144 HA VAL 144 -13.066 -28.564 24.004 1083 HB VAL 144 HB VAL 144 -10.582 -28.285 24.081 1084 1HG1 VAL 144 HG11 VAL 144 -10.179 -29.300 21.903 1085 2HG1 VAL 144 HG12 VAL 144 -11.758 -28.746 21.342 1086 3HG1 VAL 144 HG13 VAL 144 -11.651 -29.942 22.633 1087 1HG2 VAL 144 HG21 VAL 144 -10.142 -26.906 21.673 1088 2HG2 VAL 144 HG22 VAL 144 -9.675 -26.415 23.302 1089 3HG2 VAL 144 HG23 VAL 144 -11.224 -25.897 22.634 Start of MODEL 10 1 1H GLY 1 HT1 GLY 1 29.381 4.266 -40.988 2 2H GLY 1 HT2 GLY 1 30.882 3.664 -40.490 3 3H GLY 1 HT3 GLY 1 30.767 4.580 -41.906 4 1HA GLY 1 HA1 GLY 1 31.690 5.952 -40.195 5 2HA GLY 1 HA2 GLY 1 30.078 6.520 -40.604 6 HA PRO 2 HA PRO 2 30.114 6.446 -36.012 7 1HB PRO 2 HB2 PRO 2 27.666 8.040 -36.529 8 2HB PRO 2 HB1 PRO 2 29.024 8.380 -35.452 9 1HG PRO 2 HG2 PRO 2 28.726 9.715 -37.741 10 2HG PRO 2 HG1 PRO 2 30.334 9.240 -37.162 11 1HD PRO 2 HD2 PRO 2 28.649 8.009 -39.307 12 2HD PRO 2 HD1 PRO 2 30.405 8.269 -39.263 13 H LEU 3 HN LEU 3 29.339 4.677 -35.070 14 HA LEU 3 HA LEU 3 26.994 3.338 -36.096 15 1HB LEU 3 HB2 LEU 3 29.116 2.719 -34.103 16 2HB LEU 3 HB1 LEU 3 27.586 1.878 -33.952 17 HG LEU 3 HG LEU 3 28.724 1.860 -36.665 18 1HD1 LEU 3 HD11 LEU 3 30.699 0.904 -36.285 19 2HD1 LEU 3 HD12 LEU 3 30.036 -0.155 -35.040 20 3HD1 LEU 3 HD13 LEU 3 30.541 1.483 -34.626 21 1HD2 LEU 3 HD21 LEU 3 27.525 -0.021 -36.825 22 2HD2 LEU 3 HD22 LEU 3 26.784 0.497 -35.310 23 3HD2 LEU 3 HD23 LEU 3 28.127 -0.646 -35.290 24 H GLY 4 HN GLY 4 27.880 5.268 -33.306 25 1HA GLY 4 HA2 GLY 4 25.272 4.805 -32.064 26 2HA GLY 4 HA1 GLY 4 26.624 5.668 -31.346 27 H SER 5 HN SER 5 25.094 6.143 -34.509 28 HA SER 5 HA SER 5 24.898 8.979 -34.012 29 1HB SER 5 HB1 SER 5 24.022 9.082 -36.325 30 2HB SER 5 HB2 SER 5 25.537 8.184 -36.237 31 HG SER 5 HG SER 5 23.459 7.329 -37.386 32 H ALA 6 HN ALA 6 22.585 6.364 -34.727 33 HA ALA 6 HA ALA 6 20.558 7.840 -33.204 34 1HB ALA 6 HB1 ALA 6 19.200 8.177 -34.931 35 2HB ALA 6 HB2 ALA 6 19.362 6.505 -35.467 36 3HB ALA 6 HB3 ALA 6 20.540 7.714 -35.980 37 H ALA 7 HN ALA 7 20.874 6.328 -31.531 38 HA ALA 7 HA ALA 7 19.515 3.778 -31.998 39 1HB ALA 7 HB1 ALA 7 21.723 3.032 -32.190 40 2HB ALA 7 HB2 ALA 7 21.289 2.683 -30.516 41 3HB ALA 7 HB3 ALA 7 22.287 4.087 -30.894 42 H ALA 8 HN ALA 8 18.842 6.320 -30.657 43 HA ALA 8 HA ALA 8 18.998 6.074 -27.858 44 1HB ALA 8 HB1 ALA 8 17.175 7.728 -27.807 45 2HB ALA 8 HB2 ALA 8 16.961 7.522 -29.546 46 3HB ALA 8 HB3 ALA 8 18.469 8.185 -28.915 47 H ALA 9 HN ALA 9 17.125 5.742 -26.393 48 HA ALA 9 HA ALA 9 16.016 3.181 -26.736 49 1HB ALA 9 HB1 ALA 9 15.326 3.382 -24.600 50 2HB ALA 9 HB2 ALA 9 14.642 4.986 -24.857 51 3HB ALA 9 HB3 ALA 9 16.378 4.797 -24.611 52 H THR 10 HN THR 10 13.594 2.775 -26.484 53 HA THR 10 HA THR 10 11.520 2.789 -27.408 54 HB THR 10 HB THR 10 11.838 5.763 -27.792 55 HG1 THR 10 HG1 THR 10 11.544 6.065 -25.693 56 1HG2 THR 10 HG21 THR 10 9.699 4.157 -28.317 57 2HG2 THR 10 HG22 THR 10 9.629 5.886 -27.977 58 3HG2 THR 10 HG23 THR 10 9.360 4.721 -26.680 59 HA PRO 11 HA PRO 11 10.770 1.426 -28.475 60 1HB PRO 11 HB1 PRO 11 11.183 -0.681 -30.095 61 2HB PRO 11 HB2 PRO 11 9.958 0.545 -30.448 62 1HG PRO 11 HG2 PRO 11 12.722 0.247 -31.569 63 2HG PRO 11 HG1 PRO 11 11.208 0.622 -32.415 64 1HD PRO 11 HD1 PRO 11 13.038 2.517 -31.709 65 2HD PRO 11 HD2 PRO 11 11.300 2.847 -31.846 66 H ALA 12 HN ALA 12 11.454 -0.308 -27.180 67 HA ALA 12 HA ALA 12 14.348 -0.447 -26.813 68 1HB ALA 12 HB1 ALA 12 13.736 -0.307 -24.681 69 2HB ALA 12 HB2 ALA 12 13.152 -1.965 -24.818 70 3HB ALA 12 HB3 ALA 12 12.045 -0.616 -25.078 71 H VAL 13 HN VAL 13 11.585 -2.691 -27.017 72 HA VAL 13 HA VAL 13 13.463 -4.816 -27.802 73 HB VAL 13 HB VAL 13 11.339 -6.276 -27.359 74 1HG1 VAL 13 HG11 VAL 13 13.546 -5.438 -25.781 75 2HG1 VAL 13 HG12 VAL 13 12.663 -6.962 -25.718 76 3HG1 VAL 13 HG13 VAL 13 12.143 -5.600 -24.725 77 1HG2 VAL 13 HG21 VAL 13 9.556 -5.301 -26.466 78 2HG2 VAL 13 HG22 VAL 13 10.336 -3.738 -26.704 79 3HG2 VAL 13 HG23 VAL 13 10.534 -4.599 -25.178 80 H ARG 14 HN ARG 14 12.301 -6.524 -29.249 81 HA ARG 14 HA ARG 14 11.514 -5.132 -31.654 82 1HB ARG 14 HB2 ARG 14 12.415 -7.855 -30.940 83 2HB ARG 14 HB1 ARG 14 11.293 -7.764 -32.290 84 1HG ARG 14 HG2 ARG 14 13.022 -7.306 -33.594 85 2HG ARG 14 HG1 ARG 14 13.162 -5.753 -32.767 86 1HD ARG 14 HD2 ARG 14 14.371 -7.549 -31.040 87 2HD ARG 14 HD1 ARG 14 14.880 -8.084 -32.642 88 HE ARG 14 HE ARG 14 15.177 -5.263 -31.902 89 1HH1 ARG 14 HH11 ARG 14 16.601 -8.337 -32.719 90 2HH1 ARG 14 HH12 ARG 14 18.183 -7.680 -32.975 91 1HH2 ARG 14 HH21 ARG 14 17.255 -4.392 -32.236 92 2HH2 ARG 14 HH22 ARG 14 18.555 -5.438 -32.699 93 H THR 15 HN THR 15 10.082 -7.615 -29.545 94 HA THR 15 HA THR 15 7.513 -7.303 -30.880 95 HB THR 15 HB THR 15 7.634 -9.035 -28.510 96 HG1 THR 15 HG1 THR 15 8.837 -10.447 -30.369 97 1HG2 THR 15 HG21 THR 15 6.102 -10.186 -29.607 98 2HG2 THR 15 HG22 THR 15 7.134 -10.338 -31.029 99 3HG2 THR 15 HG23 THR 15 6.123 -8.907 -30.822 100 H VAL 16 HN VAL 16 5.582 -6.779 -29.760 101 HA VAL 16 HA VAL 16 6.038 -4.933 -27.530 102 HB VAL 16 HB VAL 16 3.561 -5.254 -29.227 103 1HG1 VAL 16 HG11 VAL 16 4.117 -3.800 -26.806 104 2HG1 VAL 16 HG12 VAL 16 2.592 -3.997 -27.671 105 3HG1 VAL 16 HG13 VAL 16 3.695 -2.695 -28.114 106 1HG2 VAL 16 HG21 VAL 16 6.038 -4.135 -29.932 107 2HG2 VAL 16 HG22 VAL 16 4.955 -2.780 -29.616 108 3HG2 VAL 16 HG23 VAL 16 4.509 -4.007 -30.802 109 HA PRO 17 HA PRO 17 4.330 -7.978 -24.742 110 1HB PRO 17 HB2 PRO 17 4.074 -5.718 -22.871 111 2HB PRO 17 HB1 PRO 17 5.024 -7.199 -22.719 112 1HG PRO 17 HG1 PRO 17 6.188 -4.818 -23.143 113 2HG PRO 17 HG2 PRO 17 6.833 -6.313 -23.848 114 1HD PRO 17 HD2 PRO 17 5.177 -4.170 -25.133 115 2HD PRO 17 HD1 PRO 17 6.581 -5.047 -25.778 116 H GLN 18 HN GLN 18 2.571 -6.942 -22.651 117 HA GLN 18 HA GLN 18 0.091 -7.164 -24.032 118 1HB GLN 18 HB2 GLN 18 0.956 -6.841 -21.206 119 2HB GLN 18 HB1 GLN 18 -0.692 -6.365 -21.595 120 1HG GLN 18 HG1 GLN 18 -0.838 -8.687 -22.724 121 2HG GLN 18 HG2 GLN 18 0.579 -9.063 -21.743 122 1HE2 GLN 18 HE21 GLN 18 -0.210 -10.400 -20.248 123 2HE2 GLN 18 HE22 GLN 18 -1.512 -10.032 -19.174 124 H TYR 19 HN TYR 19 -1.580 -5.625 -24.207 125 HA TYR 19 HA TYR 19 -0.782 -3.072 -25.023 126 1HB TYR 19 HB1 TYR 19 -3.420 -4.360 -24.450 127 2HB TYR 19 HB2 TYR 19 -3.362 -2.619 -24.708 128 HD1 TYR 19 HD1 TYR 19 -2.916 -1.699 -26.887 129 HD2 TYR 19 HD2 TYR 19 -2.834 -5.906 -26.264 130 HE1 TYR 19 HE1 TYR 19 -2.929 -2.053 -29.321 131 HE2 TYR 19 HE2 TYR 19 -2.848 -6.273 -28.695 132 HH TYR 19 HH TYR 19 -2.787 -5.323 -30.702 133 H LYS 20 HN LYS 20 -0.781 -1.089 -24.075 134 HA LYS 20 HA LYS 20 -0.790 -1.048 -21.172 135 1HB LYS 20 HB2 LYS 20 -0.239 1.273 -23.018 136 2HB LYS 20 HB1 LYS 20 0.267 1.081 -21.345 137 1HG LYS 20 HG2 LYS 20 1.302 -1.108 -22.812 138 2HG LYS 20 HG1 LYS 20 1.652 0.367 -23.715 139 1HD LYS 20 HD2 LYS 20 2.122 0.511 -20.811 140 2HD LYS 20 HD1 LYS 20 3.189 -0.576 -21.702 141 1HE LYS 20 HE2 LYS 20 2.696 2.316 -22.398 142 2HE LYS 20 HE1 LYS 20 4.089 1.718 -21.498 143 1HZ LYS 20 HZ1 LYS 20 3.956 0.188 -23.789 144 2HZ LYS 20 HZ2 LYS 20 5.078 1.405 -23.440 145 3HZ LYS 20 HZ3 LYS 20 3.667 1.776 -24.299 146 H TYR 21 HN TYR 21 -1.513 1.637 -20.753 147 HA TYR 21 HA TYR 21 -4.338 1.381 -20.574 148 1HB TYR 21 HB1 TYR 21 -2.292 3.207 -19.612 149 2HB TYR 21 HB2 TYR 21 -3.737 4.070 -20.127 150 HD1 TYR 21 HD1 TYR 21 -5.527 4.276 -18.662 151 HD2 TYR 21 HD2 TYR 21 -2.681 1.179 -18.020 152 HE1 TYR 21 HE1 TYR 21 -6.629 3.712 -16.537 153 HE2 TYR 21 HE2 TYR 21 -3.776 0.607 -15.895 154 HH TYR 21 HH TYR 21 -5.303 2.027 -14.166 155 H ALA 22 HN ALA 22 -5.192 1.183 -22.631 156 HA ALA 22 HA ALA 22 -4.714 3.286 -24.584 157 1HB ALA 22 HB1 ALA 22 -6.555 1.731 -25.770 158 2HB ALA 22 HB2 ALA 22 -5.862 0.571 -24.638 159 3HB ALA 22 HB3 ALA 22 -4.825 1.390 -25.805 160 H ALA 23 HN ALA 23 -5.715 5.103 -23.769 161 HA ALA 23 HA ALA 23 -8.388 5.069 -22.754 162 1HB ALA 23 HB1 ALA 23 -7.964 7.164 -22.085 163 2HB ALA 23 HB2 ALA 23 -7.368 7.653 -23.670 164 3HB ALA 23 HB3 ALA 23 -6.300 6.809 -22.548 165 H GLY 24 HN GLY 24 -10.211 5.040 -23.885 166 1HA GLY 24 HA1 GLY 24 -10.166 5.274 -26.753 167 2HA GLY 24 HA2 GLY 24 -11.574 4.944 -25.754 168 H VAL 25 HN VAL 25 -9.443 7.497 -26.929 169 HA VAL 25 HA VAL 25 -11.480 9.500 -26.252 170 HB VAL 25 HB VAL 25 -9.608 11.107 -27.048 171 1HG1 VAL 25 HG11 VAL 25 -10.236 11.125 -24.781 172 2HG1 VAL 25 HG12 VAL 25 -8.487 10.897 -24.776 173 3HG1 VAL 25 HG13 VAL 25 -9.555 9.523 -24.496 174 1HG2 VAL 25 HG21 VAL 25 -8.348 8.713 -27.631 175 2HG2 VAL 25 HG22 VAL 25 -7.574 9.251 -26.141 176 3HG2 VAL 25 HG23 VAL 25 -7.592 10.304 -27.555 177 H ARG 26 HN ARG 26 -10.307 7.671 -28.839 178 HA ARG 26 HA ARG 26 -10.976 9.590 -30.905 179 1HB ARG 26 HB2 ARG 26 -10.476 7.626 -32.431 180 2HB ARG 26 HB1 ARG 26 -9.140 8.188 -31.436 181 1HG ARG 26 HG2 ARG 26 -8.906 6.187 -30.520 182 2HG ARG 26 HG1 ARG 26 -10.607 6.148 -30.050 183 1HD ARG 26 HD2 ARG 26 -10.689 4.404 -31.472 184 2HD ARG 26 HD1 ARG 26 -10.828 5.670 -32.692 185 HE ARG 26 HE ARG 26 -8.735 5.129 -33.447 186 1HH1 ARG 26 HH11 ARG 26 -9.232 3.675 -30.320 187 2HH1 ARG 26 HH12 ARG 26 -7.780 2.735 -30.383 188 1HH2 ARG 26 HH21 ARG 26 -6.820 3.894 -33.538 189 2HH2 ARG 26 HH22 ARG 26 -6.408 2.860 -32.211 190 H ASN 27 HN ASN 27 -12.630 7.362 -29.001 191 HA ASN 27 HA ASN 27 -14.687 6.824 -30.999 192 1HB ASN 27 HB2 ASN 27 -14.351 5.860 -28.151 193 2HB ASN 27 HB1 ASN 27 -15.692 5.407 -29.198 194 1HD2 ASN 27 HD21 ASN 27 -13.597 3.783 -27.939 195 2HD2 ASN 27 HD22 ASN 27 -12.831 2.930 -29.231 196 HA PRO 28 HA PRO 28 -16.987 10.419 -29.660 197 1HB PRO 28 HB1 PRO 28 -19.221 9.043 -31.033 198 2HB PRO 28 HB2 PRO 28 -18.560 10.658 -31.302 199 1HG PRO 28 HG2 PRO 28 -18.113 8.677 -33.039 200 2HG PRO 28 HG1 PRO 28 -16.862 9.879 -32.670 201 1HD PRO 28 HD2 PRO 28 -17.133 7.062 -31.697 202 2HD PRO 28 HD1 PRO 28 -15.675 7.951 -32.183 203 H GLN 29 HN GLN 29 -17.047 9.907 -27.434 204 HA GLN 29 HA GLN 29 -19.153 8.105 -26.513 205 1HB GLN 29 HB1 GLN 29 -16.618 8.535 -25.592 206 2HB GLN 29 HB2 GLN 29 -17.554 9.557 -24.509 207 1HG GLN 29 HG2 GLN 29 -18.811 7.734 -23.708 208 2HG GLN 29 HG1 GLN 29 -18.249 6.681 -25.005 209 1HE2 GLN 29 HE21 GLN 29 -17.626 5.183 -23.375 210 2HE2 GLN 29 HE22 GLN 29 -16.152 5.399 -22.501 211 H GLN 30 HN GLN 30 -20.727 8.774 -24.962 212 HA GLN 30 HA GLN 30 -21.806 11.367 -25.524 213 1HB GLN 30 HB2 GLN 30 -22.702 9.354 -23.453 214 2HB GLN 30 HB1 GLN 30 -23.638 10.712 -24.062 215 1HG GLN 30 HG2 GLN 30 -23.267 9.553 -26.372 216 2HG GLN 30 HG1 GLN 30 -22.970 8.127 -25.379 217 1HE2 GLN 30 HE21 GLN 30 -25.245 10.829 -25.079 218 2HE2 GLN 30 HE22 GLN 30 -26.666 9.850 -25.014 219 H HIS 31 HN HIS 31 -22.818 12.447 -23.358 220 HA HIS 31 HA HIS 31 -20.703 12.709 -21.350 221 1HB HIS 31 HB2 HIS 31 -21.778 14.899 -23.106 222 2HB HIS 31 HB1 HIS 31 -21.180 15.268 -21.492 223 HD2 HIS 31 HD2 HIS 31 -19.794 15.850 -24.655 224 HE1 HIS 31 HE1 HIS 31 -16.612 13.866 -22.693 225 HE2 HIS 31 HE2 HIS 31 -17.255 15.319 -24.670 226 H LEU 32 HN LEU 32 -23.339 11.475 -21.330 227 HA LEU 32 HA LEU 32 -25.164 13.195 -19.971 228 1HB LEU 32 HB1 LEU 32 -26.582 11.346 -19.808 229 2HB LEU 32 HB2 LEU 32 -25.703 11.086 -21.303 230 HG LEU 32 HG LEU 32 -24.541 9.828 -18.891 231 1HD1 LEU 32 HD21 LEU 32 -26.638 8.172 -20.036 232 2HD1 LEU 32 HD22 LEU 32 -27.264 9.596 -19.204 233 3HD1 LEU 32 HD23 LEU 32 -26.218 8.464 -18.348 234 1HD2 LEU 32 HD11 LEU 32 -23.734 9.654 -21.300 235 2HD2 LEU 32 HD12 LEU 32 -25.139 8.624 -21.574 236 3HD2 LEU 32 HD13 LEU 32 -23.912 8.149 -20.400 237 H ASN 33 HN ASN 33 -22.578 11.085 -18.979 238 HA ASN 33 HA ASN 33 -23.313 11.439 -16.159 239 1HB ASN 33 HB2 ASN 33 -21.385 9.541 -17.509 240 2HB ASN 33 HB1 ASN 33 -21.533 9.696 -15.760 241 1HD2 ASN 33 HD21 ASN 33 -24.191 9.904 -15.375 242 2HD2 ASN 33 HD22 ASN 33 -24.992 8.467 -15.899 243 H ALA 34 HN ALA 34 -22.200 13.587 -17.763 244 HA ALA 34 HA ALA 34 -19.455 13.871 -16.848 245 1HB ALA 34 HB1 ALA 34 -19.297 15.031 -18.733 246 2HB ALA 34 HB2 ALA 34 -20.310 16.278 -18.004 247 3HB ALA 34 HB3 ALA 34 -21.046 14.989 -18.955 248 H GLN 35 HN GLN 35 -22.427 14.334 -15.509 249 HA GLN 35 HA GLN 35 -21.983 16.848 -14.194 250 1HB GLN 35 HB1 GLN 35 -24.169 15.108 -14.592 251 2HB GLN 35 HB2 GLN 35 -23.927 15.202 -12.853 252 1HG GLN 35 HG2 GLN 35 -24.015 17.657 -12.999 253 2HG GLN 35 HG1 GLN 35 -24.333 17.521 -14.728 254 1HE2 GLN 35 HE21 GLN 35 -26.266 18.739 -14.194 255 2HE2 GLN 35 HE22 GLN 35 -27.664 17.896 -13.628 256 HA PRO 36 HA PRO 36 -19.321 15.145 -11.031 257 1HB PRO 36 HB1 PRO 36 -19.314 17.343 -9.413 258 2HB PRO 36 HB2 PRO 36 -18.325 17.201 -10.869 259 1HG PRO 36 HG2 PRO 36 -20.945 18.597 -10.485 260 2HG PRO 36 HG1 PRO 36 -19.508 19.139 -11.370 261 1HD PRO 36 HD1 PRO 36 -21.655 18.107 -12.629 262 2HD PRO 36 HD2 PRO 36 -20.002 17.842 -13.219 263 H GLN 37 HN GLN 37 -19.502 14.398 -8.894 264 HA GLN 37 HA GLN 37 -22.253 14.205 -7.941 265 1HB GLN 37 HB1 GLN 37 -19.730 12.702 -7.253 266 2HB GLN 37 HB2 GLN 37 -21.234 12.487 -6.369 267 1HG GLN 37 HG2 GLN 37 -21.385 10.777 -7.866 268 2HG GLN 37 HG1 GLN 37 -22.216 12.052 -8.758 269 1HE2 GLN 37 HE21 GLN 37 -18.920 10.831 -8.253 270 2HE2 GLN 37 HE22 GLN 37 -18.438 10.954 -9.907 271 H VAL 38 HN VAL 38 -22.693 16.085 -6.869 272 HA VAL 38 HA VAL 38 -20.828 17.155 -4.929 273 HB VAL 38 HB VAL 38 -22.157 18.680 -6.330 274 1HG1 VAL 38 HG21 VAL 38 -24.294 16.985 -5.558 275 2HG1 VAL 38 HG22 VAL 38 -24.320 18.343 -6.682 276 3HG1 VAL 38 HG23 VAL 38 -24.649 18.609 -4.971 277 1HG2 VAL 38 HG11 VAL 38 -21.320 19.426 -4.151 278 2HG2 VAL 38 HG12 VAL 38 -22.822 18.891 -3.396 279 3HG2 VAL 38 HG13 VAL 38 -22.844 20.209 -4.567 280 H THR 39 HN THR 39 -23.676 15.169 -4.974 281 HA THR 39 HA THR 39 -24.228 15.452 -2.159 282 HB THR 39 HB THR 39 -25.285 13.242 -3.903 283 HG1 THR 39 HG1 THR 39 -25.447 15.372 -4.939 284 1HG2 THR 39 HG21 THR 39 -25.826 13.908 -1.308 285 2HG2 THR 39 HG22 THR 39 -26.867 12.963 -2.374 286 3HG2 THR 39 HG23 THR 39 -27.128 14.698 -2.197 287 H MET 40 HN MET 40 -21.982 13.748 -3.976 288 HA MET 40 HA MET 40 -21.807 11.490 -2.147 289 1HB MET 40 HB2 MET 40 -21.035 11.994 -4.860 290 2HB MET 40 HB1 MET 40 -19.613 11.514 -3.944 291 1HG MET 40 HG1 MET 40 -21.657 9.757 -3.178 292 2HG MET 40 HG2 MET 40 -21.767 9.909 -4.930 293 1HE MET 40 HE1 MET 40 -19.431 7.024 -2.825 294 2HE MET 40 HE2 MET 40 -20.778 6.793 -3.940 295 3HE MET 40 HE3 MET 40 -20.966 7.840 -2.533 296 H GLN 41 HN GLN 41 -21.066 12.261 -0.217 297 HA GLN 41 HA GLN 41 -18.611 13.856 -0.195 298 1HB GLN 41 HB1 GLN 41 -20.380 13.096 2.135 299 2HB GLN 41 HB2 GLN 41 -19.095 14.296 2.135 300 1HG GLN 41 HG2 GLN 41 -20.544 15.384 0.240 301 2HG GLN 41 HG1 GLN 41 -21.836 14.445 0.990 302 1HE2 GLN 41 HE21 GLN 41 -22.840 15.289 2.677 303 2HE2 GLN 41 HE22 GLN 41 -22.299 16.649 3.596 304 H GLN 42 HN GLN 42 -17.143 12.216 -0.774 305 HA GLN 42 HA GLN 42 -16.323 10.559 1.462 306 1HB GLN 42 HB1 GLN 42 -17.962 9.343 -0.266 307 2HB GLN 42 HB2 GLN 42 -16.453 9.128 -1.143 308 1HG GLN 42 HG1 GLN 42 -15.818 7.485 0.196 309 2HG GLN 42 HG2 GLN 42 -16.128 8.453 1.636 310 1HE2 GLN 42 HE21 GLN 42 -16.676 6.122 2.264 311 2HE2 GLN 42 HE22 GLN 42 -18.336 5.674 2.108 312 HA PRO 43 HA PRO 43 -12.682 12.493 -0.501 313 1HB PRO 43 HB2 PRO 43 -11.450 11.571 2.025 314 2HB PRO 43 HB1 PRO 43 -11.450 13.178 1.295 315 1HG PRO 43 HG2 PRO 43 -12.924 12.640 3.460 316 2HG PRO 43 HG1 PRO 43 -13.511 13.730 2.191 317 1HD PRO 43 HD1 PRO 43 -14.237 10.875 2.724 318 2HD PRO 43 HD2 PRO 43 -15.276 12.231 2.232 319 H ALA 44 HN ALA 44 -12.410 10.890 -2.086 320 HA ALA 44 HA ALA 44 -11.418 8.279 -1.421 321 1HB ALA 44 HB1 ALA 44 -11.056 8.248 -4.002 322 2HB ALA 44 HB2 ALA 44 -12.013 9.728 -3.960 323 3HB ALA 44 HB3 ALA 44 -12.691 8.224 -3.339 324 H VAL 45 HN VAL 45 -9.367 7.425 -1.924 325 HA VAL 45 HA VAL 45 -7.219 9.390 -1.750 326 HB VAL 45 HB VAL 45 -5.775 7.370 -1.362 327 1HG1 VAL 45 HG11 VAL 45 -7.801 8.508 0.362 328 2HG1 VAL 45 HG12 VAL 45 -6.124 8.092 0.715 329 3HG1 VAL 45 HG13 VAL 45 -7.383 6.863 0.839 330 1HG2 VAL 45 HG21 VAL 45 -6.636 5.419 -2.031 331 2HG2 VAL 45 HG22 VAL 45 -8.285 6.045 -2.023 332 3HG2 VAL 45 HG23 VAL 45 -7.558 5.456 -0.528 333 H HIS 46 HN HIS 46 -8.735 8.826 -4.260 334 HA HIS 46 HA HIS 46 -6.605 7.710 -5.940 335 1HB HIS 46 HB2 HIS 46 -9.518 7.728 -6.067 336 2HB HIS 46 HB1 HIS 46 -8.782 8.227 -7.587 337 HD2 HIS 46 HD2 HIS 46 -10.036 5.118 -6.194 338 HE1 HIS 46 HE1 HIS 46 -6.579 3.958 -8.344 339 HE2 HIS 46 HE2 HIS 46 -8.705 3.144 -7.226 340 H VAL 47 HN VAL 47 -8.381 10.631 -5.271 341 HA VAL 47 HA VAL 47 -7.363 12.033 -7.587 342 HB VAL 47 HB VAL 47 -8.455 14.021 -6.588 343 1HG1 VAL 47 HG11 VAL 47 -9.859 11.499 -7.216 344 2HG1 VAL 47 HG12 VAL 47 -9.962 13.080 -7.990 345 3HG1 VAL 47 HG13 VAL 47 -10.825 12.778 -6.481 346 1HG2 VAL 47 HG21 VAL 47 -8.824 12.128 -4.317 347 2HG2 VAL 47 HG22 VAL 47 -10.063 13.343 -4.628 348 3HG2 VAL 47 HG23 VAL 47 -8.404 13.841 -4.301 349 H GLN 48 HN GLN 48 -6.576 14.431 -6.863 350 HA GLN 48 HA GLN 48 -4.103 13.927 -5.391 351 1HB GLN 48 HB1 GLN 48 -3.510 16.246 -6.303 352 2HB GLN 48 HB2 GLN 48 -3.649 14.935 -7.466 353 1HG GLN 48 HG1 GLN 48 -5.487 15.812 -8.449 354 2HG GLN 48 HG2 GLN 48 -6.086 16.525 -6.953 355 1HE2 GLN 48 HE22 GLN 48 -5.869 18.636 -6.697 356 2HE2 GLN 48 HE21 GLN 48 -4.853 19.668 -7.639 357 H GLY 49 HN GLY 49 -6.450 14.074 -3.847 358 1HA GLY 49 HA1 GLY 49 -6.441 16.736 -2.637 359 2HA GLY 49 HA2 GLY 49 -7.566 15.436 -2.276 360 H GLN 50 HN GLN 50 -6.710 13.587 -1.043 361 HA GLN 50 HA GLN 50 -4.817 14.534 0.985 362 1HB GLN 50 HB2 GLN 50 -7.130 12.693 0.977 363 2HB GLN 50 HB1 GLN 50 -5.781 12.209 1.996 364 1HG GLN 50 HG2 GLN 50 -6.398 13.642 3.557 365 2HG GLN 50 HG1 GLN 50 -6.307 14.979 2.410 366 1HE2 GLN 50 HE22 GLN 50 -8.360 12.764 4.063 367 2HE2 GLN 50 HE21 GLN 50 -9.865 13.438 3.549 368 H GLU 51 HN GLU 51 -2.774 13.974 0.629 369 HA GLU 51 HA GLU 51 -2.138 11.548 -0.838 370 1HB GLU 51 HB2 GLU 51 -0.890 14.084 -0.439 371 2HB GLU 51 HB1 GLU 51 0.211 12.836 0.129 372 1HG GLU 51 HG1 GLU 51 0.635 12.093 -1.939 373 2HG GLU 51 HG2 GLU 51 -1.043 12.260 -2.453 374 HA PRO 52 HA PRO 52 -1.882 9.265 3.034 375 1HB PRO 52 HB1 PRO 52 -0.615 7.288 1.214 376 2HB PRO 52 HB2 PRO 52 -1.953 7.079 2.349 377 1HG PRO 52 HG1 PRO 52 -2.406 7.195 -0.271 378 2HG PRO 52 HG2 PRO 52 -3.512 7.971 0.878 379 1HD PRO 52 HD2 PRO 52 -1.417 9.204 -0.867 380 2HD PRO 52 HD1 PRO 52 -3.038 9.802 -0.456 381 H LEU 53 HN LEU 53 -0.181 8.271 4.306 382 HA LEU 53 HA LEU 53 2.343 9.653 3.958 383 1HB LEU 53 HB2 LEU 53 0.870 8.985 6.151 384 2HB LEU 53 HB1 LEU 53 2.065 7.703 6.147 385 HG LEU 53 HG LEU 53 3.491 10.105 5.758 386 1HD1 LEU 53 HD21 LEU 53 2.053 10.470 8.302 387 2HD1 LEU 53 HD22 LEU 53 1.155 10.883 6.841 388 3HD1 LEU 53 HD23 LEU 53 2.699 11.666 7.178 389 1HD2 LEU 53 HD11 LEU 53 4.148 7.991 6.943 390 2HD2 LEU 53 HD12 LEU 53 3.181 8.543 8.313 391 3HD2 LEU 53 HD13 LEU 53 4.576 9.485 7.777 392 H THR 54 HN THR 54 4.383 8.617 3.968 393 HA THR 54 HA THR 54 4.657 5.797 3.736 394 HB THR 54 HB THR 54 5.751 6.744 1.260 395 HG1 THR 54 HG1 THR 54 2.961 6.926 1.212 396 1HG2 THR 54 HG21 THR 54 5.317 4.457 1.446 397 2HG2 THR 54 HG22 THR 54 4.106 5.066 0.318 398 3HG2 THR 54 HG23 THR 54 3.661 4.730 1.991 399 H ALA 55 HN ALA 55 7.048 5.460 2.644 400 HA ALA 55 HA ALA 55 8.848 6.356 4.532 401 1HB ALA 55 HB1 ALA 55 9.503 5.581 1.694 402 2HB ALA 55 HB2 ALA 55 9.246 4.457 3.029 403 3HB ALA 55 HB3 ALA 55 10.610 5.576 3.067 404 H SER 56 HN SER 56 7.858 7.899 1.543 405 HA SER 56 HA SER 56 9.926 9.838 1.442 406 1HB SER 56 HB1 SER 56 7.192 9.631 0.205 407 2HB SER 56 HB2 SER 56 8.151 11.099 0.026 408 HG SER 56 HG SER 56 9.737 9.055 -0.503 409 H MET 57 HN MET 57 6.598 9.942 2.683 410 HA MET 57 HA MET 57 6.613 12.589 3.613 411 1HB MET 57 HB1 MET 57 5.103 10.124 4.448 412 2HB MET 57 HB2 MET 57 4.875 11.651 5.279 413 1HG MET 57 HG1 MET 57 3.371 10.844 3.233 414 2HG MET 57 HG2 MET 57 3.675 12.542 3.597 415 1HE MET 57 HE1 MET 57 5.179 9.482 1.829 416 2HE MET 57 HE2 MET 57 5.473 10.060 0.187 417 3HE MET 57 HE3 MET 57 3.819 9.868 0.771 418 H LEU 58 HN LEU 58 7.695 9.583 5.022 419 HA LEU 58 HA LEU 58 8.153 10.506 7.650 420 1HB LEU 58 HB1 LEU 58 9.477 8.277 6.107 421 2HB LEU 58 HB2 LEU 58 9.594 8.506 7.843 422 HG LEU 58 HG LEU 58 6.922 8.181 6.522 423 1HD1 LEU 58 HD21 LEU 58 7.828 5.723 7.659 424 2HD1 LEU 58 HD22 LEU 58 8.973 6.251 6.423 425 3HD1 LEU 58 HD23 LEU 58 7.267 6.051 6.020 426 1HD2 LEU 58 HD11 LEU 58 6.129 7.882 8.621 427 2HD2 LEU 58 HD12 LEU 58 7.545 8.859 9.022 428 3HD2 LEU 58 HD13 LEU 58 7.605 7.102 9.190 429 H ALA 59 HN ALA 59 10.220 10.249 4.798 430 HA ALA 59 HA ALA 59 12.583 11.214 6.029 431 1HB ALA 59 HB1 ALA 59 12.863 10.025 4.019 432 2HB ALA 59 HB2 ALA 59 13.272 11.697 3.632 433 3HB ALA 59 HB3 ALA 59 11.703 11.041 3.162 434 H SER 60 HN SER 60 9.696 12.735 5.276 435 HA SER 60 HA SER 60 10.695 15.326 4.574 436 1HB SER 60 HB1 SER 60 8.416 14.500 3.955 437 2HB SER 60 HB2 SER 60 7.969 14.586 5.661 438 HG SER 60 HG SER 60 8.962 16.808 4.211 439 H ALA 61 HN ALA 61 10.784 13.624 7.406 440 HA ALA 61 HA ALA 61 10.952 16.101 8.980 441 1HB ALA 61 HB1 ALA 61 8.926 15.069 9.658 442 2HB ALA 61 HB2 ALA 61 10.112 14.735 10.920 443 3HB ALA 61 HB3 ALA 61 9.687 13.482 9.753 444 HA PRO 62 HA PRO 62 15.171 14.494 9.453 445 1HB PRO 62 HB2 PRO 62 15.211 16.836 11.295 446 2HB PRO 62 HB1 PRO 62 16.325 16.414 9.990 447 1HG PRO 62 HG2 PRO 62 14.596 18.393 9.672 448 2HG PRO 62 HG1 PRO 62 14.916 17.260 8.342 449 1HD PRO 62 HD1 PRO 62 12.596 17.352 10.237 450 2HD PRO 62 HD2 PRO 62 12.604 17.076 8.483 451 HA PRO 63 HA PRO 63 15.698 12.620 13.560 452 1HB PRO 63 HB2 PRO 63 16.486 15.199 14.871 453 2HB PRO 63 HB1 PRO 63 17.152 13.576 15.098 454 1HG PRO 63 HG1 PRO 63 18.412 15.353 13.570 455 2HG PRO 63 HG2 PRO 63 18.342 13.645 13.106 456 1HD PRO 63 HD1 PRO 63 16.920 15.976 11.955 457 2HD PRO 63 HD2 PRO 63 17.394 14.448 11.186 458 H GLN 64 HN GLN 64 13.791 15.429 13.143 459 HA GLN 64 HA GLN 64 12.413 15.867 15.460 460 1HB GLN 64 HB2 GLN 64 11.362 15.666 12.620 461 2HB GLN 64 HB1 GLN 64 10.431 16.321 13.966 462 1HG GLN 64 HG1 GLN 64 12.973 17.421 12.801 463 2HG GLN 64 HG2 GLN 64 11.363 18.135 12.732 464 1HE2 GLN 64 HE21 GLN 64 10.556 17.752 15.355 465 2HE2 GLN 64 HE22 GLN 64 11.525 18.737 16.391 466 H GLU 65 HN GLU 65 10.716 13.983 13.022 467 HA GLU 65 HA GLU 65 9.928 12.078 15.117 468 1HB GLU 65 HB1 GLU 65 8.456 12.207 12.540 469 2HB GLU 65 HB2 GLU 65 7.855 11.900 14.163 470 1HG GLU 65 HG2 GLU 65 8.878 14.611 13.737 471 2HG GLU 65 HG1 GLU 65 7.469 14.190 12.765 472 H GLN 66 HN GLN 66 9.830 11.833 11.605 473 HA GLN 66 HA GLN 66 10.574 10.300 10.122 474 1HB GLN 66 HB1 GLN 66 12.793 11.153 11.572 475 2HB GLN 66 HB2 GLN 66 12.923 9.400 11.577 476 1HG GLN 66 HG1 GLN 66 12.405 9.716 9.005 477 2HG GLN 66 HG2 GLN 66 13.083 11.313 9.318 478 1HE2 GLN 66 HE21 GLN 66 15.238 11.525 9.771 479 2HE2 GLN 66 HE22 GLN 66 16.372 10.232 9.598 480 H LYS 67 HN LYS 67 11.782 8.917 13.122 481 HA LYS 67 HA LYS 67 10.542 6.362 12.478 482 1HB LYS 67 HB1 LYS 67 11.972 6.568 15.032 483 2HB LYS 67 HB2 LYS 67 12.155 5.400 13.731 484 1HG LYS 67 HG1 LYS 67 13.190 7.805 12.741 485 2HG LYS 67 HG2 LYS 67 13.789 7.658 14.395 486 1HD LYS 67 HD2 LYS 67 15.321 6.224 13.662 487 2HD LYS 67 HD1 LYS 67 14.020 5.104 13.252 488 1HE LYS 67 HE1 LYS 67 14.329 7.201 11.271 489 2HE LYS 67 HE2 LYS 67 15.811 6.270 11.491 490 1HZ LYS 67 HZ1 LYS 67 13.663 4.482 11.400 491 2HZ LYS 67 HZ2 LYS 67 14.927 4.655 10.289 492 3HZ LYS 67 HZ3 LYS 67 13.500 5.541 10.091 493 H GLN 68 HN GLN 68 9.146 8.904 13.452 494 HA GLN 68 HA GLN 68 7.788 7.691 15.768 495 1HB GLN 68 HB1 GLN 68 8.139 10.603 15.047 496 2HB GLN 68 HB2 GLN 68 7.109 10.028 16.350 497 1HG GLN 68 HG1 GLN 68 9.904 9.093 16.388 498 2HG GLN 68 HG2 GLN 68 9.645 10.810 16.695 499 1HE2 GLN 68 HE22 GLN 68 7.830 11.244 18.296 500 2HE2 GLN 68 HE21 GLN 68 7.807 10.251 19.709 501 H MET 69 HN MET 69 7.334 9.450 12.730 502 HA MET 69 HA MET 69 4.461 9.365 12.923 503 1HB MET 69 HB1 MET 69 6.037 9.951 10.424 504 2HB MET 69 HB2 MET 69 4.415 10.485 10.839 505 1HG MET 69 HG1 MET 69 5.486 11.795 12.725 506 2HG MET 69 HG2 MET 69 7.033 11.456 11.948 507 1HE MET 69 HE1 MET 69 7.762 13.218 9.487 508 2HE MET 69 HE2 MET 69 6.438 12.763 8.415 509 3HE MET 69 HE3 MET 69 7.183 11.553 9.460 510 H LEU 70 HN LEU 70 6.755 7.078 12.114 511 HA LEU 70 HA LEU 70 5.650 5.836 9.863 512 1HB LEU 70 HB1 LEU 70 6.700 3.722 11.226 513 2HB LEU 70 HB2 LEU 70 7.595 4.785 10.168 514 HG LEU 70 HG LEU 70 8.505 6.011 11.995 515 1HD1 LEU 70 HD21 LEU 70 6.190 5.562 13.318 516 2HD1 LEU 70 HD22 LEU 70 7.669 6.145 14.078 517 3HD1 LEU 70 HD23 LEU 70 7.264 4.430 14.141 518 1HD2 LEU 70 HD11 LEU 70 9.627 3.932 11.542 519 2HD2 LEU 70 HD12 LEU 70 8.496 3.056 12.575 520 3HD2 LEU 70 HD13 LEU 70 9.620 4.217 13.283 521 H GLY 71 HN GLY 71 4.822 5.539 13.275 522 1HA GLY 71 HA2 GLY 71 2.456 4.028 12.452 523 2HA GLY 71 HA1 GLY 71 3.485 3.328 13.681 524 H GLU 72 HN GLU 72 2.952 6.779 13.475 525 HA GLU 72 HA GLU 72 1.007 6.652 15.660 526 1HB GLU 72 HB1 GLU 72 3.532 8.319 15.736 527 2HB GLU 72 HB2 GLU 72 2.232 8.390 16.918 528 1HG GLU 72 HG2 GLU 72 2.733 5.812 17.117 529 2HG GLU 72 HG1 GLU 72 4.307 6.310 16.497 530 H ARG 73 HN ARG 73 1.922 7.894 12.733 531 HA ARG 73 HA ARG 73 0.038 10.135 12.992 532 1HB ARG 73 HB1 ARG 73 2.654 10.601 12.687 533 2HB ARG 73 HB2 ARG 73 2.243 10.333 10.999 534 1HG ARG 73 HG1 ARG 73 0.537 12.195 12.553 535 2HG ARG 73 HG2 ARG 73 2.159 12.731 12.107 536 1HD ARG 73 HD2 ARG 73 1.697 12.311 9.772 537 2HD ARG 73 HD1 ARG 73 0.114 11.646 10.175 538 HE ARG 73 HE ARG 73 0.102 14.184 11.206 539 1HH1 ARG 73 HH11 ARG 73 0.603 12.776 8.058 540 2HH1 ARG 73 HH12 ARG 73 -0.023 14.146 7.203 541 1HH2 ARG 73 HH21 ARG 73 -0.725 15.993 10.088 542 2HH2 ARG 73 HH22 ARG 73 -0.778 15.975 8.357 543 H LEU 74 HN LEU 74 1.151 7.373 11.350 544 HA LEU 74 HA LEU 74 -0.203 7.816 8.854 545 1HB LEU 74 HB1 LEU 74 1.466 5.758 10.096 546 2HB LEU 74 HB2 LEU 74 0.183 5.098 9.101 547 HG LEU 74 HG LEU 74 1.771 7.274 7.908 548 1HD1 LEU 74 HD11 LEU 74 3.737 6.157 7.651 549 2HD1 LEU 74 HD12 LEU 74 2.982 4.570 7.812 550 3HD1 LEU 74 HD13 LEU 74 3.265 5.561 9.244 551 1HD2 LEU 74 HD21 LEU 74 -0.100 6.043 6.792 552 2HD2 LEU 74 HD22 LEU 74 0.914 4.599 6.829 553 3HD2 LEU 74 HD23 LEU 74 1.431 6.014 5.913 554 H PHE 75 HN PHE 75 -0.938 6.509 11.939 555 HA PHE 75 HA PHE 75 -2.853 4.669 11.646 556 1HB PHE 75 HB1 PHE 75 -1.981 6.078 13.724 557 2HB PHE 75 HB2 PHE 75 -3.527 6.885 13.516 558 HD1 PHE 75 HD1 PHE 75 -4.484 6.164 15.569 559 HD2 PHE 75 HD2 PHE 75 -2.953 3.313 12.804 560 HE1 PHE 75 HE1 PHE 75 -5.561 4.357 16.845 561 HE2 PHE 75 HE2 PHE 75 -4.026 1.500 14.080 562 HZ PHE 75 HZ PHE 75 -5.332 2.022 16.101 563 HA PRO 76 HA PRO 76 -6.394 7.826 10.770 564 1HB PRO 76 HB2 PRO 76 -5.079 10.303 9.919 565 2HB PRO 76 HB1 PRO 76 -6.341 10.064 11.130 566 1HG PRO 76 HG2 PRO 76 -3.818 10.727 11.804 567 2HG PRO 76 HG1 PRO 76 -4.828 9.688 12.826 568 1HD PRO 76 HD2 PRO 76 -2.645 8.925 10.919 569 2HD PRO 76 HD1 PRO 76 -2.986 8.301 12.547 570 H LEU 77 HN LEU 77 -3.458 7.851 8.875 571 HA LEU 77 HA LEU 77 -4.873 8.376 6.404 572 1HB LEU 77 HB1 LEU 77 -1.983 7.829 7.041 573 2HB LEU 77 HB2 LEU 77 -2.573 8.002 5.398 574 HG LEU 77 HG LEU 77 -2.670 10.115 7.557 575 1HD1 LEU 77 HD11 LEU 77 -0.643 10.677 6.870 576 2HD1 LEU 77 HD12 LEU 77 -1.276 10.939 5.244 577 3HD1 LEU 77 HD13 LEU 77 -0.649 9.356 5.703 578 1HD2 LEU 77 HD21 LEU 77 -3.497 11.598 5.791 579 2HD2 LEU 77 HD22 LEU 77 -4.617 10.273 6.109 580 3HD2 LEU 77 HD23 LEU 77 -3.579 10.227 4.683 581 H ILE 78 HN ILE 78 -3.825 5.618 8.208 582 HA ILE 78 HA ILE 78 -3.737 3.782 6.014 583 HB ILE 78 HB ILE 78 -4.225 3.128 8.904 584 1HG1 ILE 78 HG12 ILE 78 -2.124 4.523 8.330 585 2HG1 ILE 78 HG11 ILE 78 -1.916 3.066 9.293 586 1HG2 ILE 78 HG21 ILE 78 -4.601 1.126 7.950 587 2HG2 ILE 78 HG22 ILE 78 -2.838 1.049 7.899 588 3HG2 ILE 78 HG23 ILE 78 -3.741 1.553 6.469 589 1HD1 ILE 78 HD11 ILE 78 -1.549 3.072 6.320 590 2HD1 ILE 78 HD12 ILE 78 -0.997 1.881 7.499 591 3HD1 ILE 78 HD13 ILE 78 -0.248 3.477 7.439 592 H GLN 79 HN GLN 79 -6.169 4.846 8.328 593 HA GLN 79 HA GLN 79 -8.192 2.992 7.829 594 1HB GLN 79 HB1 GLN 79 -7.992 5.693 8.934 595 2HB GLN 79 HB2 GLN 79 -9.533 5.396 8.142 596 1HG GLN 79 HG2 GLN 79 -10.044 3.605 9.581 597 2HG GLN 79 HG1 GLN 79 -8.391 3.523 10.189 598 1HE2 GLN 79 HE21 GLN 79 -7.784 4.806 11.851 599 2HE2 GLN 79 HE22 GLN 79 -8.848 5.886 12.679 600 H ALA 80 HN ALA 80 -6.788 5.241 5.769 601 HA ALA 80 HA ALA 80 -9.043 5.588 3.989 602 1HB ALA 80 HB1 ALA 80 -6.155 6.325 3.535 603 2HB ALA 80 HB2 ALA 80 -7.326 7.360 4.356 604 3HB ALA 80 HB3 ALA 80 -7.565 6.931 2.662 605 H MET 81 HN MET 81 -6.076 3.701 4.181 606 HA MET 81 HA MET 81 -6.231 2.650 1.527 607 1HB MET 81 HB1 MET 81 -4.792 1.287 3.783 608 2HB MET 81 HB2 MET 81 -4.346 1.372 2.084 609 1HG MET 81 HG1 MET 81 -4.373 4.015 2.975 610 2HG MET 81 HG2 MET 81 -3.611 3.091 4.265 611 1HE MET 81 HE1 MET 81 -1.586 1.293 3.703 612 2HE MET 81 HE2 MET 81 -1.211 2.884 4.369 613 3HE MET 81 HE3 MET 81 -0.231 2.223 3.057 614 H HIS 82 HN HIS 82 -7.355 1.622 4.681 615 HA HIS 82 HA HIS 82 -8.704 -0.671 3.412 616 1HB HIS 82 HB1 HIS 82 -7.178 -0.422 5.955 617 2HB HIS 82 HB2 HIS 82 -8.599 -1.461 5.970 618 HD2 HIS 82 HD2 HIS 82 -5.619 -1.151 3.384 619 HE1 HIS 82 HE1 HIS 82 -6.301 -5.205 4.381 620 HE2 HIS 82 HE2 HIS 82 -4.907 -3.612 2.982 621 HA PRO 83 HA PRO 83 -12.594 0.849 4.864 622 1HB PRO 83 HB1 PRO 83 -13.278 -1.774 6.018 623 2HB PRO 83 HB2 PRO 83 -14.051 -0.894 4.697 624 1HG PRO 83 HG2 PRO 83 -12.589 -3.098 4.249 625 2HG PRO 83 HG1 PRO 83 -12.598 -1.738 3.109 626 1HD PRO 83 HD1 PRO 83 -10.541 -2.481 5.157 627 2HD PRO 83 HD2 PRO 83 -10.316 -1.906 3.492 628 H THR 84 HN THR 84 -11.180 1.977 6.557 629 HA THR 84 HA THR 84 -10.757 2.645 8.684 630 HB THR 84 HB THR 84 -13.306 1.377 9.599 631 HG1 THR 84 HG1 THR 84 -14.080 3.550 8.497 632 1HG2 THR 84 HG21 THR 84 -11.720 3.725 10.276 633 2HG2 THR 84 HG22 THR 84 -12.859 2.796 11.250 634 3HG2 THR 84 HG23 THR 84 -13.451 4.035 10.143 635 H LEU 85 HN LEU 85 -9.986 -0.139 7.901 636 HA LEU 85 HA LEU 85 -10.210 -1.652 10.361 637 1HB LEU 85 HB1 LEU 85 -9.251 -2.160 7.612 638 2HB LEU 85 HB2 LEU 85 -8.434 -3.054 8.881 639 HG LEU 85 HG LEU 85 -11.422 -3.065 8.435 640 1HD1 LEU 85 HD21 LEU 85 -10.707 -4.245 6.608 641 2HD1 LEU 85 HD22 LEU 85 -10.766 -5.531 7.814 642 3HD1 LEU 85 HD23 LEU 85 -9.224 -4.783 7.396 643 1HD2 LEU 85 HD11 LEU 85 -10.467 -3.504 10.765 644 2HD2 LEU 85 HD12 LEU 85 -9.810 -4.990 10.078 645 3HD2 LEU 85 HD13 LEU 85 -11.553 -4.718 10.086 646 H ALA 86 HN ALA 86 -8.456 0.924 9.618 647 HA ALA 86 HA ALA 86 -5.834 0.053 10.489 648 1HB ALA 86 HB1 ALA 86 -6.786 2.174 8.987 649 2HB ALA 86 HB2 ALA 86 -5.137 1.961 9.575 650 3HB ALA 86 HB3 ALA 86 -6.285 2.923 10.504 651 H GLY 87 HN GLY 87 -7.574 -0.658 12.436 652 1HA GLY 87 HA1 GLY 87 -7.478 1.408 14.511 653 2HA GLY 87 HA2 GLY 87 -8.312 -0.137 14.625 654 H LYS 88 HN LYS 88 -5.245 -0.398 13.270 655 HA LYS 88 HA LYS 88 -3.582 -0.491 15.530 656 1HB LYS 88 HB1 LYS 88 -5.042 -2.322 16.226 657 2HB LYS 88 HB2 LYS 88 -4.768 -3.147 14.701 658 1HG LYS 88 HG1 LYS 88 -2.246 -2.982 15.472 659 2HG LYS 88 HG2 LYS 88 -3.000 -2.896 17.067 660 1HD LYS 88 HD1 LYS 88 -3.107 -5.123 17.013 661 2HD LYS 88 HD2 LYS 88 -4.360 -4.943 15.782 662 1HE LYS 88 HE2 LYS 88 -2.722 -5.088 14.021 663 2HE LYS 88 HE1 LYS 88 -1.409 -5.090 15.196 664 1HZ LYS 88 HZ1 LYS 88 -2.089 -7.312 14.240 665 2HZ LYS 88 HZ2 LYS 88 -3.493 -7.189 15.175 666 3HZ LYS 88 HZ3 LYS 88 -1.979 -7.225 15.926 667 H ILE 89 HN ILE 89 -4.183 -1.091 12.202 668 HA ILE 89 HA ILE 89 -2.101 -2.610 11.362 669 HB ILE 89 HB ILE 89 -3.082 -0.137 9.936 670 1HG1 ILE 89 HG11 ILE 89 -4.032 -2.963 9.496 671 2HG1 ILE 89 HG12 ILE 89 -4.790 -1.922 10.697 672 1HG2 ILE 89 HG21 ILE 89 -1.156 -2.206 9.255 673 2HG2 ILE 89 HG22 ILE 89 -1.472 -0.654 8.477 674 3HG2 ILE 89 HG23 ILE 89 -2.449 -2.064 8.064 675 1HD1 ILE 89 HD11 ILE 89 -4.648 -1.483 7.731 676 2HD1 ILE 89 HD12 ILE 89 -5.225 -0.275 8.878 677 3HD1 ILE 89 HD13 ILE 89 -6.078 -1.810 8.709 678 H THR 90 HN THR 90 -1.771 0.873 10.760 679 HA THR 90 HA THR 90 1.007 0.829 10.572 680 HB THR 90 HB THR 90 -1.067 2.780 10.520 681 HG1 THR 90 HG1 THR 90 1.578 3.361 9.836 682 1HG2 THR 90 HG21 THR 90 0.756 4.625 11.269 683 2HG2 THR 90 HG22 THR 90 0.982 3.396 12.517 684 3HG2 THR 90 HG23 THR 90 -0.612 4.104 12.258 685 H GLY 91 HN GLY 91 -1.042 1.285 13.420 686 1HA GLY 91 HA2 GLY 91 1.000 1.998 15.246 687 2HA GLY 91 HA1 GLY 91 -0.518 1.208 15.664 688 H MET 92 HN MET 92 0.012 -0.971 13.793 689 HA MET 92 HA MET 92 1.500 -2.720 15.530 690 1HB MET 92 HB1 MET 92 -0.529 -3.229 13.903 691 2HB MET 92 HB2 MET 92 0.753 -3.454 12.725 692 1HG MET 92 HG1 MET 92 1.682 -4.897 14.801 693 2HG MET 92 HG2 MET 92 -0.046 -5.129 14.970 694 1HE MET 92 HE1 MET 92 -1.131 -6.625 11.663 695 2HE MET 92 HE2 MET 92 -0.505 -5.014 11.307 696 3HE MET 92 HE3 MET 92 -1.436 -5.293 12.779 697 H LEU 93 HN LEU 93 1.902 -1.150 12.459 698 HA LEU 93 HA LEU 93 4.159 -2.387 11.484 699 1HB LEU 93 HB2 LEU 93 2.928 0.277 11.171 700 2HB LEU 93 HB1 LEU 93 4.544 0.058 10.536 701 HG LEU 93 HG LEU 93 2.801 -0.295 8.820 702 1HD1 LEU 93 HD11 LEU 93 4.644 -2.487 9.649 703 2HD1 LEU 93 HD12 LEU 93 4.707 -1.434 8.235 704 3HD1 LEU 93 HD13 LEU 93 3.540 -2.755 8.298 705 1HD2 LEU 93 HD21 LEU 93 1.712 -2.044 10.904 706 2HD2 LEU 93 HD22 LEU 93 1.734 -2.752 9.285 707 3HD2 LEU 93 HD23 LEU 93 0.908 -1.221 9.566 708 H LEU 94 HN LEU 94 3.903 -0.646 14.319 709 HA LEU 94 HA LEU 94 6.774 -0.025 14.361 710 1HB LEU 94 HB1 LEU 94 4.383 1.163 15.627 711 2HB LEU 94 HB2 LEU 94 5.802 1.051 16.650 712 HG LEU 94 HG LEU 94 7.070 2.459 15.198 713 1HD1 LEU 94 HD11 LEU 94 6.348 1.525 13.068 714 2HD1 LEU 94 HD12 LEU 94 6.204 3.283 13.060 715 3HD1 LEU 94 HD13 LEU 94 4.766 2.280 13.259 716 1HD2 LEU 94 HD21 LEU 94 5.714 3.750 16.623 717 2HD2 LEU 94 HD22 LEU 94 4.269 3.437 15.661 718 3HD2 LEU 94 HD23 LEU 94 5.544 4.474 15.025 719 H GLU 95 HN GLU 95 5.525 -2.650 14.573 720 HA GLU 95 HA GLU 95 6.961 -3.690 16.777 721 1HB GLU 95 HB2 GLU 95 5.210 -4.375 18.240 722 2HB GLU 95 HB1 GLU 95 4.970 -2.662 17.935 723 1HG GLU 95 HG1 GLU 95 3.194 -3.125 16.390 724 2HG GLU 95 HG2 GLU 95 3.496 -4.859 16.501 725 H ILE 96 HN ILE 96 5.500 -3.979 13.858 726 HA ILE 96 HA ILE 96 4.538 -6.619 13.802 727 HB ILE 96 HB ILE 96 4.833 -6.596 11.411 728 1HG1 ILE 96 HG12 ILE 96 7.067 -5.672 11.254 729 2HG1 ILE 96 HG11 ILE 96 5.959 -4.755 10.242 730 1HG2 ILE 96 HG21 ILE 96 3.646 -4.291 12.777 731 2HG2 ILE 96 HG22 ILE 96 2.934 -5.443 11.648 732 3HG2 ILE 96 HG23 ILE 96 3.911 -4.105 11.043 733 1HD1 ILE 96 HD11 ILE 96 6.758 -2.932 11.182 734 2HD1 ILE 96 HD12 ILE 96 7.642 -3.870 12.387 735 3HD1 ILE 96 HD13 ILE 96 5.959 -3.426 12.674 736 H ASP 97 HN ASP 97 6.131 -7.542 11.524 737 HA ASP 97 HA ASP 97 7.921 -9.286 12.760 738 1HB ASP 97 HB1 ASP 97 6.793 -9.240 10.375 739 2HB ASP 97 HB2 ASP 97 8.286 -8.427 9.909 740 H ASN 98 HN ASN 98 8.192 -6.023 12.363 741 HA ASN 98 HA ASN 98 9.833 -4.568 12.901 742 1HB ASN 98 HB1 ASN 98 11.070 -7.087 13.618 743 2HB ASN 98 HB2 ASN 98 12.257 -5.959 12.969 744 1HD2 ASN 98 HD21 ASN 98 13.287 -5.561 14.873 745 2HD2 ASN 98 HD22 ASN 98 12.558 -4.717 16.193 746 H SER 99 HN SER 99 10.188 -6.862 10.356 747 HA SER 99 HA SER 99 12.185 -5.364 8.920 748 1HB SER 99 HB2 SER 99 12.389 -7.314 7.852 749 2HB SER 99 HB1 SER 99 10.960 -7.940 8.678 750 HG SER 99 HG SER 99 10.714 -7.949 6.401 751 H GLU 100 HN GLU 100 8.732 -5.508 9.131 752 HA GLU 100 HA GLU 100 8.229 -3.960 6.758 753 1HB GLU 100 HB1 GLU 100 6.296 -4.277 9.022 754 2HB GLU 100 HB2 GLU 100 5.965 -4.085 7.309 755 1HG GLU 100 HG1 GLU 100 7.293 -6.377 7.191 756 2HG GLU 100 HG2 GLU 100 6.681 -6.509 8.840 757 H LEU 101 HN LEU 101 9.016 -3.375 10.047 758 HA LEU 101 HA LEU 101 8.134 -0.643 10.123 759 1HB LEU 101 HB1 LEU 101 8.281 -1.674 12.231 760 2HB LEU 101 HB2 LEU 101 9.856 -2.359 11.886 761 HG LEU 101 HG LEU 101 10.387 0.324 11.766 762 1HD1 LEU 101 HD11 LEU 101 8.507 1.302 12.582 763 2HD1 LEU 101 HD12 LEU 101 9.316 0.954 14.109 764 3HD1 LEU 101 HD13 LEU 101 8.041 -0.115 13.524 765 1HD2 LEU 101 HD21 LEU 101 11.763 -1.293 12.893 766 2HD2 LEU 101 HD22 LEU 101 10.528 -1.544 14.127 767 3HD2 LEU 101 HD23 LEU 101 11.367 0.005 14.019 768 H LEU 102 HN LEU 102 10.917 -2.380 9.069 769 HA LEU 102 HA LEU 102 12.593 -0.003 8.918 770 1HB LEU 102 HB2 LEU 102 12.978 -2.911 8.782 771 2HB LEU 102 HB1 LEU 102 13.942 -2.015 7.621 772 HG LEU 102 HG LEU 102 14.681 -0.587 9.645 773 1HD1 LEU 102 HD21 LEU 102 12.815 -2.008 10.985 774 2HD1 LEU 102 HD22 LEU 102 14.208 -1.238 11.745 775 3HD1 LEU 102 HD23 LEU 102 14.261 -2.955 11.338 776 1HD2 LEU 102 HD11 LEU 102 16.553 -1.938 9.942 777 2HD2 LEU 102 HD12 LEU 102 15.964 -2.393 8.344 778 3HD2 LEU 102 HD13 LEU 102 15.631 -3.427 9.734 779 H HIS 103 HN HIS 103 11.080 -2.355 6.747 780 HA HIS 103 HA HIS 103 12.067 -1.268 4.351 781 1HB HIS 103 HB1 HIS 103 10.584 -3.482 5.096 782 2HB HIS 103 HB2 HIS 103 9.441 -2.539 4.153 783 HD2 HIS 103 HD2 HIS 103 12.863 -2.010 2.693 784 HE1 HIS 103 HE1 HIS 103 11.166 -5.285 0.618 785 HE2 HIS 103 HE2 HIS 103 13.051 -3.589 0.643 786 H MET 104 HN MET 104 9.087 -0.691 6.180 787 HA MET 104 HA MET 104 7.754 0.919 4.333 788 1HB MET 104 HB2 MET 104 6.379 1.609 6.113 789 2HB MET 104 HB1 MET 104 6.911 -0.003 6.580 790 1HG MET 104 HG2 MET 104 8.794 1.257 7.807 791 2HG MET 104 HG1 MET 104 7.738 2.657 7.656 792 1HE MET 104 HE1 MET 104 5.175 1.942 7.701 793 2HE MET 104 HE2 MET 104 4.554 1.690 9.333 794 3HE MET 104 HE3 MET 104 4.758 0.318 8.240 795 H LEU 105 HN LEU 105 10.269 1.704 6.670 796 HA LEU 105 HA LEU 105 10.139 4.536 6.189 797 1HB LEU 105 HB1 LEU 105 12.311 2.941 7.548 798 2HB LEU 105 HB2 LEU 105 12.061 4.672 7.662 799 HG LEU 105 HG LEU 105 10.147 2.586 8.707 800 1HD1 LEU 105 HD11 LEU 105 12.548 3.797 9.836 801 2HD1 LEU 105 HD12 LEU 105 11.633 2.384 10.363 802 3HD1 LEU 105 HD13 LEU 105 11.116 3.999 10.846 803 1HD2 LEU 105 HD21 LEU 105 10.010 5.317 9.718 804 2HD2 LEU 105 HD22 LEU 105 8.722 4.233 9.188 805 3HD2 LEU 105 HD23 LEU 105 9.629 5.173 8.001 806 H GLU 106 HN GLU 106 11.500 1.922 4.563 807 HA GLU 106 HA GLU 106 13.564 3.642 3.381 808 1HB GLU 106 HB1 GLU 106 14.979 1.872 3.304 809 2HB GLU 106 HB2 GLU 106 13.928 1.248 4.568 810 1HG GLU 106 HG1 GLU 106 13.774 -0.564 3.296 811 2HG GLU 106 HG2 GLU 106 12.661 0.387 2.314 812 H SER 107 HN SER 107 10.538 2.462 2.675 813 HA SER 107 HA SER 107 11.037 2.872 -0.183 814 1HB SER 107 HB2 SER 107 11.029 0.351 0.603 815 2HB SER 107 HB1 SER 107 9.281 0.573 0.562 816 HG SER 107 HG SER 107 9.751 -0.045 -1.458 817 HA PRO 108 HA PRO 108 7.229 5.142 0.212 818 1HB PRO 108 HB1 PRO 108 7.160 5.252 -2.701 819 2HB PRO 108 HB2 PRO 108 7.435 6.557 -1.546 820 1HG PRO 108 HG2 PRO 108 9.380 5.612 -3.178 821 2HG PRO 108 HG1 PRO 108 9.713 6.273 -1.566 822 1HD PRO 108 HD1 PRO 108 9.517 3.411 -2.439 823 2HD PRO 108 HD2 PRO 108 10.687 4.176 -1.340 824 H GLU 109 HN GLU 109 7.589 2.073 -0.858 825 HA GLU 109 HA GLU 109 4.706 1.780 -1.409 826 1HB GLU 109 HB2 GLU 109 6.948 0.164 -2.646 827 2HB GLU 109 HB1 GLU 109 5.229 -0.073 -2.928 828 1HG GLU 109 HG1 GLU 109 5.213 2.329 -3.781 829 2HG GLU 109 HG2 GLU 109 6.971 2.198 -3.813 830 H SER 110 HN SER 110 7.385 0.927 0.483 831 HA SER 110 HA SER 110 6.419 -1.650 1.319 832 1HB SER 110 HB1 SER 110 8.721 0.078 1.962 833 2HB SER 110 HB2 SER 110 8.129 -0.906 3.302 834 HG SER 110 HG SER 110 9.320 -1.678 0.907 835 H LEU 111 HN LEU 111 6.530 1.607 2.681 836 HA LEU 111 HA LEU 111 5.247 1.266 5.073 837 1HB LEU 111 HB1 LEU 111 6.152 3.379 3.917 838 2HB LEU 111 HB2 LEU 111 4.587 3.483 3.134 839 HG LEU 111 HG LEU 111 4.446 4.979 4.906 840 1HD1 LEU 111 HD21 LEU 111 2.725 4.197 6.286 841 2HD1 LEU 111 HD22 LEU 111 3.304 2.534 6.209 842 3HD1 LEU 111 HD23 LEU 111 2.574 3.280 4.788 843 1HD2 LEU 111 HD11 LEU 111 5.232 4.645 7.117 844 2HD2 LEU 111 HD12 LEU 111 6.528 4.190 6.007 845 3HD2 LEU 111 HD13 LEU 111 5.561 2.942 6.804 846 H ARG 112 HN ARG 112 3.859 1.449 1.829 847 HA ARG 112 HA ARG 112 1.169 1.170 2.792 848 1HB ARG 112 HB2 ARG 112 1.051 2.347 0.867 849 2HB ARG 112 HB1 ARG 112 2.492 1.597 0.189 850 1HG ARG 112 HG1 ARG 112 1.292 -0.247 -0.598 851 2HG ARG 112 HG2 ARG 112 -0.114 0.129 0.401 852 1HD ARG 112 HD2 ARG 112 -0.883 1.719 -1.020 853 2HD ARG 112 HD1 ARG 112 0.735 2.196 -1.537 854 HE ARG 112 HE ARG 112 0.754 0.289 -3.011 855 1HH1 ARG 112 HH11 ARG 112 -2.330 1.081 -1.595 856 2HH1 ARG 112 HH12 ARG 112 -3.245 0.250 -2.808 857 1HH2 ARG 112 HH22 ARG 112 -0.443 -0.806 -4.611 858 2HH2 ARG 112 HH21 ARG 112 -2.173 -0.822 -4.523 859 H SER 113 HN SER 113 3.042 -0.864 0.527 860 HA SER 113 HA SER 113 1.411 -3.048 0.454 861 1HB SER 113 HB1 SER 113 4.235 -2.543 -0.079 862 2HB SER 113 HB2 SER 113 3.936 -4.201 0.440 863 HG SER 113 HG SER 113 3.728 -3.645 -1.905 864 H LYS 114 HN LYS 114 4.047 -2.523 2.780 865 HA LYS 114 HA LYS 114 3.637 -4.898 4.224 866 1HB LYS 114 HB1 LYS 114 4.833 -2.300 5.201 867 2HB LYS 114 HB2 LYS 114 5.012 -3.872 5.971 868 1HG LYS 114 HG1 LYS 114 6.003 -3.154 3.220 869 2HG LYS 114 HG2 LYS 114 6.992 -3.241 4.680 870 1HD LYS 114 HD2 LYS 114 6.265 -5.641 4.900 871 2HD LYS 114 HD1 LYS 114 5.550 -5.494 3.294 872 1HE LYS 114 HE2 LYS 114 7.546 -6.148 2.532 873 2HE LYS 114 HE1 LYS 114 8.072 -4.506 2.904 874 1HZ LYS 114 HZ1 LYS 114 8.616 -5.397 5.188 875 2HZ LYS 114 HZ2 LYS 114 9.615 -5.921 3.927 876 3HZ LYS 114 HZ3 LYS 114 8.418 -6.948 4.542 877 H VAL 115 HN VAL 115 2.098 -1.744 4.413 878 HA VAL 115 HA VAL 115 0.887 -2.198 6.964 879 HB VAL 115 HB VAL 115 0.681 -0.121 4.877 880 1HG1 VAL 115 HG11 VAL 115 -1.571 -0.408 6.857 881 2HG1 VAL 115 HG12 VAL 115 -1.696 -0.919 5.173 882 3HG1 VAL 115 HG13 VAL 115 -1.408 0.777 5.562 883 1HG2 VAL 115 HG21 VAL 115 1.053 1.326 6.665 884 2HG2 VAL 115 HG22 VAL 115 1.973 -0.115 7.095 885 3HG2 VAL 115 HG23 VAL 115 0.406 0.186 7.845 886 H ASP 116 HN ASP 116 -0.447 -2.228 3.643 887 HA ASP 116 HA ASP 116 -2.950 -3.271 4.255 888 1HB ASP 116 HB1 ASP 116 -2.762 -2.526 2.061 889 2HB ASP 116 HB2 ASP 116 -1.214 -3.328 1.814 890 H GLU 117 HN GLU 117 0.139 -4.875 3.832 891 HA GLU 117 HA GLU 117 -0.945 -7.537 3.913 892 1HB GLU 117 HB1 GLU 117 1.813 -6.357 3.986 893 2HB GLU 117 HB2 GLU 117 1.579 -8.038 4.446 894 1HG GLU 117 HG2 GLU 117 0.270 -8.119 2.160 895 2HG GLU 117 HG1 GLU 117 1.300 -6.737 1.794 896 H ALA 118 HN ALA 118 0.267 -5.196 6.203 897 HA ALA 118 HA ALA 118 0.503 -6.976 8.412 898 1HB ALA 118 HB1 ALA 118 -0.077 -4.056 8.714 899 2HB ALA 118 HB2 ALA 118 1.500 -4.614 8.156 900 3HB ALA 118 HB3 ALA 118 0.897 -5.113 9.738 901 H VAL 119 HN VAL 119 -2.100 -5.240 6.902 902 HA VAL 119 HA VAL 119 -4.003 -5.314 8.971 903 HB VAL 119 HB VAL 119 -4.613 -5.629 6.047 904 1HG1 VAL 119 HG11 VAL 119 -6.474 -6.010 7.562 905 2HG1 VAL 119 HG12 VAL 119 -6.698 -4.499 6.676 906 3HG1 VAL 119 HG13 VAL 119 -6.165 -4.465 8.356 907 1HG2 VAL 119 HG21 VAL 119 -4.836 -2.933 6.983 908 2HG2 VAL 119 HG22 VAL 119 -3.888 -3.571 5.641 909 3HG2 VAL 119 HG23 VAL 119 -3.199 -3.528 7.265 910 H ALA 120 HN ALA 120 -3.280 -7.550 6.336 911 HA ALA 120 HA ALA 120 -5.160 -9.528 6.941 912 1HB ALA 120 HB1 ALA 120 -4.220 -10.518 5.172 913 2HB ALA 120 HB2 ALA 120 -2.669 -10.649 6.004 914 3HB ALA 120 HB3 ALA 120 -3.071 -9.177 5.115 915 H VAL 121 HN VAL 121 -2.180 -8.616 8.402 916 HA VAL 121 HA VAL 121 -1.895 -11.024 9.977 917 HB VAL 121 HB VAL 121 -0.343 -8.469 9.708 918 1HG1 VAL 121 HG21 VAL 121 0.428 -8.572 11.777 919 2HG1 VAL 121 HG22 VAL 121 1.079 -10.174 11.432 920 3HG1 VAL 121 HG23 VAL 121 -0.543 -10.008 12.104 921 1HG2 VAL 121 HG11 VAL 121 0.525 -11.340 9.453 922 2HG2 VAL 121 HG12 VAL 121 1.418 -9.899 8.966 923 3HG2 VAL 121 HG13 VAL 121 -0.054 -10.357 8.107 924 H LEU 122 HN LEU 122 -3.139 -7.782 10.318 925 HA LEU 122 HA LEU 122 -3.316 -7.817 13.170 926 1HB LEU 122 HB2 LEU 122 -3.626 -5.646 12.818 927 2HB LEU 122 HB1 LEU 122 -3.704 -5.931 11.093 928 HG LEU 122 HG LEU 122 -6.250 -6.592 11.930 929 1HD1 LEU 122 HD11 LEU 122 -7.028 -5.001 13.461 930 2HD1 LEU 122 HD12 LEU 122 -5.547 -4.048 13.356 931 3HD1 LEU 122 HD13 LEU 122 -5.535 -5.612 14.173 932 1HD2 LEU 122 HD21 LEU 122 -5.631 -5.308 9.944 933 2HD2 LEU 122 HD22 LEU 122 -5.250 -3.919 10.963 934 3HD2 LEU 122 HD23 LEU 122 -6.909 -4.510 10.863 935 H GLN 123 HN GLN 123 -5.496 -8.502 10.492 936 HA GLN 123 HA GLN 123 -7.816 -8.944 12.049 937 1HB GLN 123 HB1 GLN 123 -6.992 -9.836 9.287 938 2HB GLN 123 HB2 GLN 123 -8.545 -10.274 9.987 939 1HG GLN 123 HG1 GLN 123 -7.595 -7.440 9.645 940 2HG GLN 123 HG2 GLN 123 -8.594 -8.298 8.472 941 1HE2 GLN 123 HE21 GLN 123 -10.732 -8.743 8.952 942 2HE2 GLN 123 HE22 GLN 123 -11.567 -7.978 10.258 943 H ALA 124 HN ALA 124 -5.130 -10.948 11.048 944 HA ALA 124 HA ALA 124 -6.227 -13.425 11.978 945 1HB ALA 124 HB1 ALA 124 -4.407 -13.185 10.256 946 2HB ALA 124 HB2 ALA 124 -4.095 -14.362 11.533 947 3HB ALA 124 HB3 ALA 124 -3.315 -12.781 11.581 948 H HIS 125 HN HIS 125 -3.265 -11.897 13.167 949 HA HIS 125 HA HIS 125 -2.880 -13.021 15.513 950 1HB HIS 125 HB1 HIS 125 -2.046 -10.642 14.400 951 2HB HIS 125 HB2 HIS 125 -2.806 -10.114 15.899 952 HD2 HIS 125 HD2 HIS 125 0.561 -10.442 15.063 953 HE1 HIS 125 HE1 HIS 125 0.363 -12.790 18.580 954 HE2 HIS 125 HE2 HIS 125 1.903 -11.573 16.975 955 H GLN 126 HN GLN 126 -5.496 -10.744 14.945 956 HA GLN 126 HA GLN 126 -6.299 -10.541 17.668 957 1HB GLN 126 HB1 GLN 126 -7.650 -9.915 15.051 958 2HB GLN 126 HB2 GLN 126 -8.488 -9.739 16.586 959 1HG GLN 126 HG2 GLN 126 -5.990 -8.299 15.717 960 2HG GLN 126 HG1 GLN 126 -7.605 -7.614 15.896 961 1HE2 GLN 126 HE21 GLN 126 -4.786 -7.405 17.238 962 2HE2 GLN 126 HE22 GLN 126 -5.186 -7.301 18.915 963 H ALA 127 HN ALA 127 -8.349 -11.874 15.083 964 HA ALA 127 HA ALA 127 -9.382 -13.820 16.998 965 1HB ALA 127 HB1 ALA 127 -10.721 -13.866 14.455 966 2HB ALA 127 HB2 ALA 127 -10.576 -12.214 15.057 967 3HB ALA 127 HB3 ALA 127 -11.348 -13.451 16.050 968 H LYS 128 HN LYS 128 -6.758 -14.343 15.768 969 HA LYS 128 HA LYS 128 -7.359 -16.597 13.991 970 1HB LYS 128 HB2 LYS 128 -5.003 -16.694 13.498 971 2HB LYS 128 HB1 LYS 128 -5.529 -15.022 13.352 972 1HG LYS 128 HG1 LYS 128 -4.094 -14.354 14.916 973 2HG LYS 128 HG2 LYS 128 -4.570 -15.649 16.016 974 1HD LYS 128 HD1 LYS 128 -2.872 -16.993 15.378 975 2HD LYS 128 HD2 LYS 128 -2.964 -16.482 13.691 976 1HE LYS 128 HE1 LYS 128 -1.444 -14.843 13.968 977 2HE LYS 128 HE2 LYS 128 -2.037 -14.425 15.575 978 1HZ LYS 128 HZ1 LYS 128 0.272 -15.747 15.025 979 2HZ LYS 128 HZ2 LYS 128 -0.772 -16.993 15.495 980 3HZ LYS 128 HZ3 LYS 128 -0.494 -15.686 16.531 981 H GLU 129 HN GLU 129 -4.952 -18.011 14.669 982 HA GLU 129 HA GLU 129 -5.911 -19.433 17.032 983 1HB GLU 129 HB2 GLU 129 -5.014 -20.464 14.765 984 2HB GLU 129 HB1 GLU 129 -3.448 -20.229 15.529 985 1HG GLU 129 HG1 GLU 129 -3.731 -21.955 16.907 986 2HG GLU 129 HG2 GLU 129 -5.400 -21.515 17.267 987 H ALA 130 HN ALA 130 -4.656 -16.734 16.988 988 HA ALA 130 HA ALA 130 -2.042 -16.745 17.899 989 1HB ALA 130 HB1 ALA 130 -2.316 -14.523 18.187 990 2HB ALA 130 HB2 ALA 130 -3.831 -14.712 19.069 991 3HB ALA 130 HB3 ALA 130 -3.817 -14.819 17.307 992 H ALA 131 HN ALA 131 -5.005 -17.489 19.557 993 HA ALA 131 HA ALA 131 -3.962 -17.242 22.212 994 1HB ALA 131 HB1 ALA 131 -6.102 -18.826 22.553 995 2HB ALA 131 HB2 ALA 131 -6.490 -18.134 20.980 996 3HB ALA 131 HB3 ALA 131 -6.210 -17.076 22.362 997 H GLN 132 HN GLN 132 -4.540 -19.933 19.981 998 HA GLN 132 HA GLN 132 -3.477 -21.871 21.841 999 1HB GLN 132 HB2 GLN 132 -4.382 -22.093 18.967 1000 2HB GLN 132 HB1 GLN 132 -3.795 -23.454 19.912 1001 1HG GLN 132 HG2 GLN 132 -5.670 -23.558 21.195 1002 2HG GLN 132 HG1 GLN 132 -6.007 -21.834 21.043 1003 1HE2 GLN 132 HE21 GLN 132 -6.731 -24.939 19.932 1004 2HE2 GLN 132 HE22 GLN 132 -7.763 -24.498 18.620 1005 H LYS 133 HN LYS 133 -1.340 -21.484 22.213 1006 HA LYS 133 HA LYS 133 0.472 -21.066 19.977 1007 1HB LYS 133 HB1 LYS 133 0.739 -20.955 22.963 1008 2HB LYS 133 HB2 LYS 133 2.176 -21.066 21.956 1009 1HG LYS 133 HG1 LYS 133 1.634 -19.008 20.852 1010 2HG LYS 133 HG2 LYS 133 0.080 -18.924 21.683 1011 1HD LYS 133 HD1 LYS 133 2.478 -19.148 23.396 1012 2HD LYS 133 HD2 LYS 133 2.273 -17.626 22.524 1013 1HE LYS 133 HE1 LYS 133 -0.237 -18.044 23.484 1014 2HE LYS 133 HE2 LYS 133 0.748 -18.740 24.770 1015 1HZ LYS 133 HZ1 LYS 133 0.259 -16.352 25.072 1016 2HZ LYS 133 HZ2 LYS 133 1.137 -16.012 23.667 1017 3HZ LYS 133 HZ3 LYS 133 1.916 -16.685 25.009 1018 H ALA 134 HN ALA 134 -0.045 -23.431 22.573 1019 HA ALA 134 HA ALA 134 2.032 -25.182 21.728 1020 1HB ALA 134 HB1 ALA 134 0.449 -24.965 23.967 1021 2HB ALA 134 HB2 ALA 134 1.586 -26.268 23.624 1022 3HB ALA 134 HB3 ALA 134 -0.120 -26.456 23.216 1023 H VAL 135 HN VAL 135 1.561 -27.499 21.126 1024 HA VAL 135 HA VAL 135 -0.201 -27.494 18.812 1025 HB VAL 135 HB VAL 135 1.522 -29.802 19.674 1026 1HG1 VAL 135 HG11 VAL 135 1.647 -29.823 17.032 1027 2HG1 VAL 135 HG12 VAL 135 0.129 -28.941 17.195 1028 3HG1 VAL 135 HG13 VAL 135 0.294 -30.549 17.900 1029 1HG2 VAL 135 HG21 VAL 135 3.274 -28.817 18.156 1030 2HG2 VAL 135 HG22 VAL 135 3.047 -27.984 19.694 1031 3HG2 VAL 135 HG23 VAL 135 2.363 -27.307 18.216 1032 H ASN 136 HN ASN 136 -2.275 -27.943 19.218 1033 HA ASN 136 HA ASN 136 -3.177 -29.493 21.411 1034 1HB ASN 136 HB2 ASN 136 -5.327 -29.515 19.793 1035 2HB ASN 136 HB1 ASN 136 -4.876 -28.119 20.768 1036 1HD2 ASN 136 HD21 ASN 136 -4.310 -29.568 17.586 1037 2HD2 ASN 136 HD22 ASN 136 -4.238 -28.070 16.727 1038 H SER 137 HN SER 137 -2.001 -30.327 18.315 1039 HA SER 137 HA SER 137 -3.282 -32.951 18.335 1040 1HB SER 137 HB1 SER 137 -2.155 -31.220 16.304 1041 2HB SER 137 HB2 SER 137 -1.467 -32.840 16.199 1042 HG SER 137 HG SER 137 -4.097 -31.989 15.828 1043 H ALA 138 HN ALA 138 -2.251 -33.886 20.126 1044 HA ALA 138 HA ALA 138 0.637 -34.087 20.175 1045 1HB ALA 138 HB1 ALA 138 -0.160 -35.751 22.140 1046 2HB ALA 138 HB2 ALA 138 -1.570 -34.698 22.024 1047 3HB ALA 138 HB3 ALA 138 0.022 -34.008 22.340 1048 H THR 139 HN THR 139 1.765 -35.626 19.202 1049 HA THR 139 HA THR 139 0.364 -38.058 18.324 1050 HB THR 139 HB THR 139 3.071 -37.357 17.290 1051 HG1 THR 139 HG1 THR 139 1.876 -35.389 17.226 1052 1HG2 THR 139 HG21 THR 139 0.775 -38.102 15.573 1053 2HG2 THR 139 HG22 THR 139 1.487 -39.340 16.607 1054 3HG2 THR 139 HG23 THR 139 2.486 -38.501 15.421 1055 H GLY 140 HN GLY 140 1.072 -40.060 18.894 1056 1HA GLY 140 HA2 GLY 140 2.836 -40.223 21.166 1057 2HA GLY 140 HA1 GLY 140 1.992 -41.561 20.400 1058 H VAL 141 HN VAL 141 3.059 -42.844 18.978 1059 HA VAL 141 HA VAL 141 5.920 -42.617 18.891 1060 HB VAL 141 HB VAL 141 5.818 -44.691 17.524 1061 1HG1 VAL 141 HG11 VAL 141 4.022 -45.271 19.795 1062 2HG1 VAL 141 HG12 VAL 141 5.518 -44.418 20.172 1063 3HG1 VAL 141 HG13 VAL 141 5.575 -45.984 19.364 1064 1HG2 VAL 141 HG21 VAL 141 2.944 -43.999 17.520 1065 2HG2 VAL 141 HG22 VAL 141 3.350 -45.705 17.706 1066 3HG2 VAL 141 HG23 VAL 141 3.918 -44.813 16.296 1067 HA PRO 142 HA PRO 142 6.458 -40.319 15.154 1068 1HB PRO 142 HB2 PRO 142 8.684 -42.190 14.566 1069 2HB PRO 142 HB1 PRO 142 8.699 -40.429 14.699 1070 1HG PRO 142 HG2 PRO 142 9.738 -41.956 16.623 1071 2HG PRO 142 HG1 PRO 142 8.849 -40.473 17.011 1072 1HD PRO 142 HD2 PRO 142 7.961 -43.322 17.201 1073 2HD PRO 142 HD1 PRO 142 7.628 -41.961 18.293 1074 H THR 143 HN THR 143 5.736 -40.434 13.097 1075 HA THR 143 HA THR 143 4.801 -43.029 12.148 1076 HB THR 143 HB THR 143 3.531 -41.721 10.491 1077 HG1 THR 143 HG1 THR 143 5.316 -39.894 10.930 1078 1HG2 THR 143 HG21 THR 143 3.036 -40.218 12.996 1079 2HG2 THR 143 HG22 THR 143 2.817 -41.968 13.005 1080 3HG2 THR 143 HG23 THR 143 1.899 -40.970 11.877 1081 H VAL 144 HN VAL 144 7.493 -41.097 11.780 1082 HA VAL 144 HA VAL 144 8.003 -42.059 9.046 1083 HB VAL 144 HB VAL 144 9.929 -40.390 9.133 1084 1HG1 VAL 144 HG11 VAL 144 8.442 -39.454 7.757 1085 2HG1 VAL 144 HG12 VAL 144 7.954 -38.470 9.136 1086 3HG1 VAL 144 HG13 VAL 144 7.078 -39.953 8.759 1087 1HG2 VAL 144 HG21 VAL 144 9.763 -38.573 10.719 1088 2HG2 VAL 144 HG22 VAL 144 9.911 -40.104 11.584 1089 3HG2 VAL 144 HG23 VAL 144 8.341 -39.311 11.458 Start of MODEL 11 1 1H GLY 1 HT1 GLY 1 3.921 18.220 39.093 2 2H GLY 1 HT2 GLY 1 2.702 18.225 40.265 3 3H GLY 1 HT3 GLY 1 3.120 16.783 39.485 4 1HA GLY 1 HA1 GLY 1 4.412 16.369 41.234 5 2HA GLY 1 HA2 GLY 1 5.490 17.552 40.509 6 HA PRO 2 HA PRO 2 4.332 18.914 44.847 7 1HB PRO 2 HB2 PRO 2 6.887 19.468 45.623 8 2HB PRO 2 HB1 PRO 2 6.129 17.885 45.828 9 1HG PRO 2 HG2 PRO 2 8.005 18.828 43.692 10 2HG PRO 2 HG1 PRO 2 7.994 17.287 44.570 11 1HD PRO 2 HD2 PRO 2 7.004 17.519 42.073 12 2HD PRO 2 HD1 PRO 2 6.295 16.414 43.268 13 H LEU 3 HN LEU 3 6.676 20.217 42.530 14 HA LEU 3 HA LEU 3 6.044 22.937 43.422 15 1HB LEU 3 HB2 LEU 3 8.443 21.916 42.963 16 2HB LEU 3 HB1 LEU 3 8.070 22.364 41.310 17 HG LEU 3 HG LEU 3 7.448 24.633 42.820 18 1HD1 LEU 3 HD11 LEU 3 9.974 24.800 43.732 19 2HD1 LEU 3 HD12 LEU 3 9.650 23.091 44.024 20 3HD1 LEU 3 HD13 LEU 3 8.601 24.321 44.730 21 1HD2 LEU 3 HD21 LEU 3 9.838 23.920 41.132 22 2HD2 LEU 3 HD22 LEU 3 9.474 25.551 41.694 23 3HD2 LEU 3 HD23 LEU 3 8.356 24.721 40.612 24 H GLY 4 HN GLY 4 6.101 24.571 41.487 25 1HA GLY 4 HA2 GLY 4 3.950 23.737 39.708 26 2HA GLY 4 HA1 GLY 4 4.533 25.378 39.943 27 H SER 5 HN SER 5 6.775 22.799 39.327 28 HA SER 5 HA SER 5 7.441 24.046 36.767 29 1HB SER 5 HB2 SER 5 9.469 22.442 36.989 30 2HB SER 5 HB1 SER 5 9.382 23.835 38.065 31 HG SER 5 HG SER 5 8.159 22.110 39.425 32 H ALA 6 HN ALA 6 6.121 21.144 38.116 33 HA ALA 6 HA ALA 6 6.415 19.656 35.632 34 1HB ALA 6 HB1 ALA 6 6.737 18.549 37.828 35 2HB ALA 6 HB2 ALA 6 5.506 17.781 36.825 36 3HB ALA 6 HB3 ALA 6 5.028 18.816 38.172 37 H ALA 7 HN ALA 7 4.340 18.360 35.011 38 HA ALA 7 HA ALA 7 2.352 20.328 34.302 39 1HB ALA 7 HB1 ALA 7 1.531 18.760 32.771 40 2HB ALA 7 HB2 ALA 7 2.197 17.398 33.671 41 3HB ALA 7 HB3 ALA 7 3.272 18.484 32.792 42 H ALA 8 HN ALA 8 0.047 18.778 34.173 43 HA ALA 8 HA ALA 8 -1.815 18.299 35.390 44 1HB ALA 8 HB1 ALA 8 0.154 16.517 36.173 45 2HB ALA 8 HB2 ALA 8 -1.577 16.371 36.473 46 3HB ALA 8 HB3 ALA 8 -0.531 17.100 37.691 47 H ALA 9 HN ALA 9 -1.224 20.851 35.702 48 HA ALA 9 HA ALA 9 -1.957 21.369 38.480 49 1HB ALA 9 HB1 ALA 9 0.645 21.733 37.694 50 2HB ALA 9 HB2 ALA 9 -0.137 22.523 39.063 51 3HB ALA 9 HB3 ALA 9 -0.048 23.344 37.505 52 H THR 10 HN THR 10 -1.003 23.316 35.649 53 HA THR 10 HA THR 10 -3.669 24.150 35.087 54 HB THR 10 HB THR 10 -3.571 25.596 36.926 55 HG1 THR 10 HG1 THR 10 -3.981 27.317 35.824 56 1HG2 THR 10 HG21 THR 10 -1.238 25.324 37.536 57 2HG2 THR 10 HG22 THR 10 -1.695 27.027 37.499 58 3HG2 THR 10 HG23 THR 10 -0.757 26.337 36.175 59 HA PRO 11 HA PRO 11 -1.433 24.859 31.307 60 1HB PRO 11 HB1 PRO 11 -3.485 25.629 29.758 61 2HB PRO 11 HB2 PRO 11 -3.321 23.961 30.320 62 1HG PRO 11 HG2 PRO 11 -5.056 26.160 31.382 63 2HG PRO 11 HG1 PRO 11 -5.454 24.453 31.113 64 1HD PRO 11 HD2 PRO 11 -4.792 25.494 33.558 65 2HD PRO 11 HD1 PRO 11 -4.528 23.799 33.105 66 H ALA 12 HN ALA 12 -2.117 27.136 33.401 67 HA ALA 12 HA ALA 12 -2.428 29.492 31.843 68 1HB ALA 12 HB1 ALA 12 -3.076 29.446 34.176 69 2HB ALA 12 HB2 ALA 12 -1.850 30.685 33.911 70 3HB ALA 12 HB3 ALA 12 -1.405 29.150 34.658 71 H VAL 13 HN VAL 13 0.289 27.536 32.704 72 HA VAL 13 HA VAL 13 2.219 29.614 32.058 73 HB VAL 13 HB VAL 13 3.889 27.728 32.447 74 1HG1 VAL 13 HG11 VAL 13 4.077 28.588 34.490 75 2HG1 VAL 13 HG12 VAL 13 2.550 27.870 35.003 76 3HG1 VAL 13 HG13 VAL 13 2.559 29.436 34.192 77 1HG2 VAL 13 HG21 VAL 13 2.164 25.929 32.101 78 2HG2 VAL 13 HG22 VAL 13 1.522 26.348 33.689 79 3HG2 VAL 13 HG23 VAL 13 3.173 25.747 33.536 80 H ARG 14 HN ARG 14 0.272 28.044 30.161 81 HA ARG 14 HA ARG 14 2.240 27.044 28.243 82 1HB ARG 14 HB1 ARG 14 0.178 25.716 28.794 83 2HB ARG 14 HB2 ARG 14 -0.775 26.986 28.038 84 1HG ARG 14 HG1 ARG 14 -0.514 25.987 26.085 85 2HG ARG 14 HG2 ARG 14 1.226 26.263 26.192 86 1HD ARG 14 HD2 ARG 14 1.574 24.163 27.258 87 2HD ARG 14 HD1 ARG 14 -0.158 23.918 27.475 88 HE ARG 14 HE ARG 14 0.687 24.175 24.729 89 1HH1 ARG 14 HH11 ARG 14 0.101 22.001 27.387 90 2HH1 ARG 14 HH12 ARG 14 -0.120 20.615 26.373 91 1HH2 ARG 14 HH21 ARG 14 0.397 22.357 23.385 92 2HH2 ARG 14 HH22 ARG 14 0.048 20.817 24.097 93 H THR 15 HN THR 15 3.151 28.970 27.511 94 HA THR 15 HA THR 15 1.369 30.928 26.264 95 HB THR 15 HB THR 15 3.186 32.447 26.288 96 HG1 THR 15 HG1 THR 15 5.319 31.704 26.826 97 1HG2 THR 15 HG21 THR 15 2.285 31.877 28.560 98 2HG2 THR 15 HG22 THR 15 3.902 32.580 28.525 99 3HG2 THR 15 HG23 THR 15 3.700 30.845 28.770 100 H VAL 16 HN VAL 16 2.789 31.987 24.272 101 HA VAL 16 HA VAL 16 3.150 29.743 22.396 102 HB VAL 16 HB VAL 16 2.682 31.654 20.664 103 1HG1 VAL 16 HG21 VAL 16 1.250 29.576 21.597 104 2HG1 VAL 16 HG22 VAL 16 0.663 30.689 20.361 105 3HG1 VAL 16 HG23 VAL 16 0.184 30.909 22.044 106 1HG2 VAL 16 HG11 VAL 16 2.098 33.628 21.495 107 2HG2 VAL 16 HG12 VAL 16 2.229 32.998 23.137 108 3HG2 VAL 16 HG13 VAL 16 0.700 32.877 22.266 109 HA PRO 17 HA PRO 17 7.313 31.595 22.470 110 1HB PRO 17 HB2 PRO 17 8.645 29.358 21.790 111 2HB PRO 17 HB1 PRO 17 8.058 29.634 23.434 112 1HG PRO 17 HG1 PRO 17 6.867 27.969 21.248 113 2HG PRO 17 HG2 PRO 17 7.035 27.595 22.974 114 1HD PRO 17 HD2 PRO 17 4.715 28.492 21.844 115 2HD PRO 17 HD1 PRO 17 5.154 28.782 23.538 116 H GLN 18 HN GLN 18 6.060 29.389 19.977 117 HA GLN 18 HA GLN 18 7.686 30.735 17.955 118 1HB GLN 18 HB2 GLN 18 5.904 28.306 17.683 119 2HB GLN 18 HB1 GLN 18 7.022 28.915 16.470 120 1HG GLN 18 HG2 GLN 18 8.906 28.372 17.845 121 2HG GLN 18 HG1 GLN 18 7.853 27.933 19.189 122 1HE2 GLN 18 HE21 GLN 18 5.941 26.445 17.932 123 2HE2 GLN 18 HE22 GLN 18 6.648 25.007 17.287 124 H TYR 19 HN TYR 19 6.274 30.573 15.702 125 HA TYR 19 HA TYR 19 4.376 32.695 15.984 126 1HB TYR 19 HB1 TYR 19 5.891 31.504 13.870 127 2HB TYR 19 HB2 TYR 19 4.198 31.542 13.390 128 HD1 TYR 19 HD1 TYR 19 7.189 33.358 13.424 129 HD2 TYR 19 HD2 TYR 19 2.986 33.857 13.855 130 HE1 TYR 19 HE1 TYR 19 7.416 35.733 12.831 131 HE2 TYR 19 HE2 TYR 19 3.202 36.234 13.263 132 HH TYR 19 HH TYR 19 5.113 37.999 13.399 133 H LYS 20 HN LYS 20 2.425 32.156 14.138 134 HA LYS 20 HA LYS 20 0.715 30.374 15.650 135 1HB LYS 20 HB2 LYS 20 0.340 32.686 14.045 136 2HB LYS 20 HB1 LYS 20 -0.562 31.378 13.292 137 1HG LYS 20 HG1 LYS 20 -2.176 31.627 14.779 138 2HG LYS 20 HG2 LYS 20 -1.043 31.273 16.084 139 1HD LYS 20 HD2 LYS 20 -0.449 33.589 16.280 140 2HD LYS 20 HD1 LYS 20 -1.392 33.998 14.845 141 1HE LYS 20 HE2 LYS 20 -2.480 32.948 17.454 142 2HE LYS 20 HE1 LYS 20 -2.592 34.610 16.872 143 1HZ LYS 20 HZ1 LYS 20 -3.872 32.210 15.689 144 2HZ LYS 20 HZ2 LYS 20 -3.850 33.727 14.939 145 3HZ LYS 20 HZ3 LYS 20 -4.642 33.525 16.420 146 H TYR 21 HN TYR 21 2.982 29.577 13.687 147 HA TYR 21 HA TYR 21 1.509 27.956 11.775 148 1HB TYR 21 HB2 TYR 21 3.922 29.212 11.619 149 2HB TYR 21 HB1 TYR 21 4.426 27.574 12.025 150 HD1 TYR 21 HD1 TYR 21 3.775 25.683 10.523 151 HD2 TYR 21 HD2 TYR 21 3.132 29.749 9.449 152 HE1 TYR 21 HE1 TYR 21 3.514 25.014 8.171 153 HE2 TYR 21 HE2 TYR 21 2.868 29.093 7.094 154 HH TYR 21 HH TYR 21 3.243 27.386 5.605 155 H ALA 22 HN ALA 22 0.443 26.528 13.203 156 HA ALA 22 HA ALA 22 2.048 24.809 14.912 157 1HB ALA 22 HB1 ALA 22 0.131 25.199 16.054 158 2HB ALA 22 HB2 ALA 22 -0.399 23.773 15.161 159 3HB ALA 22 HB3 ALA 22 -0.836 25.384 14.590 160 H ALA 23 HN ALA 23 -0.469 24.172 12.460 161 HA ALA 23 HA ALA 23 0.302 21.487 12.049 162 1HB ALA 23 HB1 ALA 23 -1.941 22.387 11.530 163 2HB ALA 23 HB2 ALA 23 -1.226 21.500 10.185 164 3HB ALA 23 HB3 ALA 23 -1.245 23.263 10.167 165 H GLY 24 HN GLY 24 1.119 20.565 10.022 166 1HA GLY 24 HA1 GLY 24 3.361 22.173 9.028 167 2HA GLY 24 HA2 GLY 24 3.220 20.425 8.919 168 H VAL 25 HN VAL 25 0.269 21.515 8.082 169 HA VAL 25 HA VAL 25 0.774 21.092 5.271 170 HB VAL 25 HB VAL 25 -1.214 20.108 6.288 171 1HG1 VAL 25 HG11 VAL 25 -2.228 21.299 7.882 172 2HG1 VAL 25 HG12 VAL 25 -3.047 22.138 6.565 173 3HG1 VAL 25 HG13 VAL 25 -1.583 22.823 7.271 174 1HG2 VAL 25 HG21 VAL 25 -2.345 20.285 4.371 175 2HG2 VAL 25 HG22 VAL 25 -1.084 21.414 3.872 176 3HG2 VAL 25 HG23 VAL 25 -2.585 22.021 4.573 177 H ARG 26 HN ARG 26 0.610 22.570 3.634 178 HA ARG 26 HA ARG 26 0.915 25.343 4.374 179 1HB ARG 26 HB1 ARG 26 0.703 24.351 1.547 180 2HB ARG 26 HB2 ARG 26 1.617 25.717 2.171 181 1HG ARG 26 HG1 ARG 26 2.806 23.674 3.484 182 2HG ARG 26 HG2 ARG 26 2.349 22.884 1.974 183 1HD ARG 26 HD2 ARG 26 3.505 24.589 0.698 184 2HD ARG 26 HD1 ARG 26 3.893 25.466 2.177 185 HE ARG 26 HE ARG 26 4.870 22.772 2.179 186 1HH1 ARG 26 HH11 ARG 26 5.529 26.034 1.145 187 2HH1 ARG 26 HH12 ARG 26 7.245 25.804 1.083 188 1HH2 ARG 26 HH21 ARG 26 7.127 22.462 2.101 189 2HH2 ARG 26 HH22 ARG 26 8.153 23.775 1.627 190 H ASN 27 HN ASN 27 -0.231 26.863 2.561 191 HA ASN 27 HA ASN 27 -3.062 26.589 3.150 192 1HB ASN 27 HB2 ASN 27 -1.415 28.810 1.937 193 2HB ASN 27 HB1 ASN 27 -3.171 28.882 2.056 194 1HD2 ASN 27 HD21 ASN 27 -0.186 29.152 3.718 195 2HD2 ASN 27 HD22 ASN 27 -0.829 29.609 5.255 196 HA PRO 28 HA PRO 28 -3.544 24.648 -0.903 197 1HB PRO 28 HB1 PRO 28 -6.218 24.155 -0.607 198 2HB PRO 28 HB2 PRO 28 -4.948 23.109 0.039 199 1HG PRO 28 HG2 PRO 28 -6.567 25.206 1.429 200 2HG PRO 28 HG1 PRO 28 -6.093 23.595 2.000 201 1HD PRO 28 HD2 PRO 28 -4.817 25.831 2.801 202 2HD PRO 28 HD1 PRO 28 -3.966 24.289 2.579 203 H GLN 29 HN GLN 29 -6.587 26.239 -0.027 204 HA GLN 29 HA GLN 29 -6.542 27.665 -2.561 205 1HB GLN 29 HB2 GLN 29 -8.592 26.492 -1.873 206 2HB GLN 29 HB1 GLN 29 -8.688 27.499 -0.435 207 1HG GLN 29 HG1 GLN 29 -10.220 28.408 -1.960 208 2HG GLN 29 HG2 GLN 29 -8.824 29.483 -1.989 209 1HE2 GLN 29 HE21 GLN 29 -10.366 26.807 -3.680 210 2HE2 GLN 29 HE22 GLN 29 -9.753 27.203 -5.246 211 H GLN 30 HN GLN 30 -5.648 29.606 -2.679 212 HA GLN 30 HA GLN 30 -5.477 31.263 -0.271 213 1HB GLN 30 HB2 GLN 30 -3.939 32.656 -1.778 214 2HB GLN 30 HB1 GLN 30 -3.359 31.076 -1.269 215 1HG GLN 30 HG1 GLN 30 -3.957 30.131 -3.415 216 2HG GLN 30 HG2 GLN 30 -4.631 31.676 -3.929 217 1HE2 GLN 30 HE21 GLN 30 -2.344 29.924 -4.859 218 2HE2 GLN 30 HE22 GLN 30 -1.010 31.014 -4.996 219 H HIS 31 HN HIS 31 -5.466 33.745 -0.953 220 HA HIS 31 HA HIS 31 -7.897 34.216 -2.550 221 1HB HIS 31 HB1 HIS 31 -7.239 34.998 0.206 222 2HB HIS 31 HB2 HIS 31 -7.833 36.322 -0.791 223 HD2 HIS 31 HD2 HIS 31 -10.442 36.578 -0.317 224 HE1 HIS 31 HE1 HIS 31 -11.385 32.457 -0.105 225 HE2 HIS 31 HE2 HIS 31 -12.319 34.813 -0.011 226 H LEU 32 HN LEU 32 -5.032 34.337 -3.277 227 HA LEU 32 HA LEU 32 -4.540 37.183 -3.638 228 1HB LEU 32 HB1 LEU 32 -2.939 34.797 -3.560 229 2HB LEU 32 HB2 LEU 32 -2.629 35.661 -5.051 230 HG LEU 32 HG LEU 32 -1.043 36.297 -3.301 231 1HD1 LEU 32 HD21 LEU 32 -2.335 37.970 -4.995 232 2HD1 LEU 32 HD22 LEU 32 -0.975 38.436 -3.974 233 3HD1 LEU 32 HD23 LEU 32 -2.626 38.764 -3.447 234 1HD2 LEU 32 HD11 LEU 32 -3.034 37.774 -1.720 235 2HD2 LEU 32 HD12 LEU 32 -1.594 36.897 -1.206 236 3HD2 LEU 32 HD13 LEU 32 -3.082 36.018 -1.554 237 H ASN 33 HN ASN 33 -3.719 37.845 -5.868 238 HA ASN 33 HA ASN 33 -5.692 36.950 -7.838 239 1HB ASN 33 HB1 ASN 33 -4.126 39.466 -7.430 240 2HB ASN 33 HB2 ASN 33 -4.675 39.066 -9.055 241 1HD2 ASN 33 HD21 ASN 33 -6.167 40.651 -9.271 242 2HD2 ASN 33 HD22 ASN 33 -7.603 40.760 -8.317 243 H ALA 34 HN ALA 34 -4.616 35.008 -8.418 244 HA ALA 34 HA ALA 34 -1.984 35.248 -9.654 245 1HB ALA 34 HB1 ALA 34 -2.851 33.339 -8.062 246 2HB ALA 34 HB2 ALA 34 -1.737 32.993 -9.385 247 3HB ALA 34 HB3 ALA 34 -3.460 32.668 -9.576 248 H GLN 35 HN GLN 35 -4.180 36.540 -10.953 249 HA GLN 35 HA GLN 35 -4.937 34.879 -13.192 250 1HB GLN 35 HB1 GLN 35 -5.420 37.817 -12.675 251 2HB GLN 35 HB2 GLN 35 -6.108 36.899 -14.006 252 1HG GLN 35 HG1 GLN 35 -6.571 36.241 -11.109 253 2HG GLN 35 HG2 GLN 35 -7.635 37.269 -12.068 254 1HE2 GLN 35 HE21 GLN 35 -6.668 34.066 -11.335 255 2HE2 GLN 35 HE22 GLN 35 -7.797 33.250 -12.357 256 HA PRO 36 HA PRO 36 -2.055 38.003 -15.527 257 1HB PRO 36 HB1 PRO 36 -0.332 39.117 -13.425 258 2HB PRO 36 HB2 PRO 36 -1.211 39.949 -14.710 259 1HG PRO 36 HG1 PRO 36 -1.954 40.134 -12.132 260 2HG PRO 36 HG2 PRO 36 -3.137 40.135 -13.455 261 1HD PRO 36 HD2 PRO 36 -2.341 37.899 -11.624 262 2HD PRO 36 HD1 PRO 36 -3.958 38.370 -12.190 263 H GLN 37 HN GLN 37 -1.221 35.932 -12.949 264 HA GLN 37 HA GLN 37 1.495 35.470 -13.877 265 1HB GLN 37 HB1 GLN 37 -0.017 34.948 -11.453 266 2HB GLN 37 HB2 GLN 37 0.867 33.521 -11.979 267 1HG GLN 37 HG1 GLN 37 2.846 35.229 -12.211 268 2HG GLN 37 HG2 GLN 37 1.888 36.156 -11.057 269 1HE2 GLN 37 HE21 GLN 37 3.004 35.942 -9.225 270 2HE2 GLN 37 HE22 GLN 37 3.414 34.437 -8.482 271 H VAL 38 HN VAL 38 1.678 34.309 -15.682 272 HA VAL 38 HA VAL 38 -0.137 32.057 -16.146 273 HB VAL 38 HB VAL 38 1.064 32.030 -18.422 274 1HG1 VAL 38 HG21 VAL 38 -0.760 33.065 -19.183 275 2HG1 VAL 38 HG22 VAL 38 -0.333 34.577 -18.382 276 3HG1 VAL 38 HG23 VAL 38 -1.189 33.319 -17.491 277 1HG2 VAL 38 HG11 VAL 38 2.030 34.633 -17.283 278 2HG2 VAL 38 HG12 VAL 38 1.889 34.369 -19.021 279 3HG2 VAL 38 HG13 VAL 38 2.964 33.354 -18.059 280 H THR 39 HN THR 39 0.514 29.989 -16.058 281 HA THR 39 HA THR 39 3.194 29.441 -15.107 282 HB THR 39 HB THR 39 1.404 28.274 -14.009 283 HG1 THR 39 HG1 THR 39 2.938 26.618 -15.711 284 1HG2 THR 39 HG21 THR 39 0.352 26.402 -15.660 285 2HG2 THR 39 HG22 THR 39 0.424 27.810 -16.719 286 3HG2 THR 39 HG23 THR 39 -0.447 27.902 -15.188 287 H MET 40 HN MET 40 4.799 28.435 -16.195 288 HA MET 40 HA MET 40 4.347 27.959 -19.058 289 1HB MET 40 HB1 MET 40 6.883 28.484 -17.499 290 2HB MET 40 HB2 MET 40 6.850 28.086 -19.211 291 1HG MET 40 HG2 MET 40 5.743 30.098 -19.755 292 2HG MET 40 HG1 MET 40 5.381 30.440 -18.064 293 1HE MET 40 HE1 MET 40 8.306 32.279 -20.476 294 2HE MET 40 HE2 MET 40 7.141 31.037 -20.933 295 3HE MET 40 HE3 MET 40 8.824 30.601 -20.636 296 H GLN 41 HN GLN 41 4.277 25.949 -19.785 297 HA GLN 41 HA GLN 41 4.417 23.683 -19.899 298 1HB GLN 41 HB2 GLN 41 6.903 24.476 -19.892 299 2HB GLN 41 HB1 GLN 41 6.937 23.791 -18.274 300 1HG GLN 41 HG1 GLN 41 6.133 21.639 -19.256 301 2HG GLN 41 HG2 GLN 41 6.351 22.359 -20.851 302 1HE2 GLN 41 HE21 GLN 41 7.683 20.157 -19.141 303 2HE2 GLN 41 HE22 GLN 41 9.369 20.453 -19.377 304 H GLN 42 HN GLN 42 2.583 23.427 -18.527 305 HA GLN 42 HA GLN 42 3.212 21.944 -16.113 306 1HB GLN 42 HB2 GLN 42 2.960 24.291 -15.351 307 2HB GLN 42 HB1 GLN 42 1.339 24.318 -16.033 308 1HG GLN 42 HG1 GLN 42 0.616 23.659 -14.047 309 2HG GLN 42 HG2 GLN 42 1.333 22.088 -14.402 310 1HE2 GLN 42 HE21 GLN 42 1.841 25.172 -12.823 311 2HE2 GLN 42 HE22 GLN 42 3.077 24.633 -11.743 312 HA PRO 43 HA PRO 43 -0.049 19.907 -18.670 313 1HB PRO 43 HB1 PRO 43 0.899 17.667 -16.959 314 2HB PRO 43 HB2 PRO 43 0.615 17.710 -18.702 315 1HG PRO 43 HG2 PRO 43 3.093 17.732 -17.731 316 2HG PRO 43 HG1 PRO 43 2.660 18.716 -19.143 317 1HD PRO 43 HD2 PRO 43 3.067 19.551 -16.300 318 2HD PRO 43 HD1 PRO 43 3.520 20.390 -17.798 319 H ALA 44 HN ALA 44 -1.886 20.763 -17.779 320 HA ALA 44 HA ALA 44 -2.595 20.302 -15.024 321 1HB ALA 44 HB1 ALA 44 -3.320 22.371 -15.801 322 2HB ALA 44 HB2 ALA 44 -4.788 21.393 -15.818 323 3HB ALA 44 HB3 ALA 44 -3.916 21.702 -17.320 324 H VAL 45 HN VAL 45 -2.531 17.947 -15.136 325 HA VAL 45 HA VAL 45 -4.687 16.664 -16.618 326 HB VAL 45 HB VAL 45 -3.705 14.551 -15.676 327 1HG1 VAL 45 HG11 VAL 45 -3.128 15.187 -17.898 328 2HG1 VAL 45 HG12 VAL 45 -1.646 14.667 -17.097 329 3HG1 VAL 45 HG13 VAL 45 -1.973 16.386 -17.317 330 1HG2 VAL 45 HG21 VAL 45 -1.278 14.895 -14.868 331 2HG2 VAL 45 HG22 VAL 45 -2.597 15.160 -13.728 332 3HG2 VAL 45 HG23 VAL 45 -1.803 16.537 -14.492 333 H HIS 46 HN HIS 46 -5.882 14.881 -15.391 334 HA HIS 46 HA HIS 46 -7.101 16.099 -13.056 335 1HB HIS 46 HB1 HIS 46 -8.199 14.777 -15.121 336 2HB HIS 46 HB2 HIS 46 -7.983 13.426 -14.013 337 HD2 HIS 46 HD2 HIS 46 -10.992 14.085 -14.552 338 HE1 HIS 46 HE1 HIS 46 -10.884 16.308 -10.951 339 HE2 HIS 46 HE2 HIS 46 -12.386 15.190 -12.661 340 H VAL 47 HN VAL 47 -4.783 15.636 -12.107 341 HA VAL 47 HA VAL 47 -4.585 12.938 -11.011 342 HB VAL 47 HB VAL 47 -2.539 13.930 -11.895 343 1HG1 VAL 47 HG11 VAL 47 -1.501 15.823 -10.546 344 2HG1 VAL 47 HG12 VAL 47 -3.117 16.093 -9.892 345 3HG1 VAL 47 HG13 VAL 47 -2.830 16.245 -11.626 346 1HG2 VAL 47 HG21 VAL 47 -2.651 13.457 -8.931 347 2HG2 VAL 47 HG22 VAL 47 -1.131 13.737 -9.781 348 3HG2 VAL 47 HG23 VAL 47 -2.136 12.351 -10.204 349 H GLN 48 HN GLN 48 -4.726 12.446 -8.849 350 HA GLN 48 HA GLN 48 -6.225 14.303 -7.221 351 1HB GLN 48 HB2 GLN 48 -5.663 11.437 -7.224 352 2HB GLN 48 HB1 GLN 48 -5.598 12.137 -5.612 353 1HG GLN 48 HG2 GLN 48 -7.829 12.874 -5.728 354 2HG GLN 48 HG1 GLN 48 -7.912 12.593 -7.467 355 1HE2 GLN 48 HE21 GLN 48 -9.889 11.442 -6.740 356 2HE2 GLN 48 HE22 GLN 48 -9.734 9.776 -6.305 357 H GLY 49 HN GLY 49 -5.432 15.617 -5.707 358 1HA GLY 49 HA2 GLY 49 -2.564 15.529 -5.163 359 2HA GLY 49 HA1 GLY 49 -3.653 16.852 -4.780 360 H GLN 50 HN GLN 50 -4.445 13.562 -3.951 361 HA GLN 50 HA GLN 50 -4.091 14.260 -1.115 362 1HB GLN 50 HB1 GLN 50 -5.729 12.229 -0.865 363 2HB GLN 50 HB2 GLN 50 -6.347 13.813 -1.307 364 1HG GLN 50 HG1 GLN 50 -6.237 13.091 -3.700 365 2HG GLN 50 HG2 GLN 50 -5.853 11.470 -3.122 366 1HE2 GLN 50 HE21 GLN 50 -8.164 13.976 -2.131 367 2HE2 GLN 50 HE22 GLN 50 -9.556 12.954 -2.182 368 H GLU 51 HN GLU 51 -1.798 13.640 -1.498 369 HA GLU 51 HA GLU 51 -1.253 10.820 -1.850 370 1HB GLU 51 HB1 GLU 51 1.142 11.617 -1.343 371 2HB GLU 51 HB2 GLU 51 0.389 12.167 -2.834 372 1HG GLU 51 HG2 GLU 51 -0.275 14.076 -0.903 373 2HG GLU 51 HG1 GLU 51 1.425 13.694 -0.638 374 HA PRO 52 HA PRO 52 -1.650 10.084 2.547 375 1HB PRO 52 HB1 PRO 52 -1.037 7.450 2.503 376 2HB PRO 52 HB2 PRO 52 -2.602 8.071 1.969 377 1HG PRO 52 HG2 PRO 52 -0.219 7.279 0.335 378 2HG PRO 52 HG1 PRO 52 -1.934 6.927 0.053 379 1HD PRO 52 HD1 PRO 52 -0.608 8.911 -1.241 380 2HD PRO 52 HD2 PRO 52 -2.338 9.005 -0.855 381 H LEU 53 HN LEU 53 -0.226 8.643 4.137 382 HA LEU 53 HA LEU 53 2.393 9.843 4.094 383 1HB LEU 53 HB2 LEU 53 0.655 9.078 6.074 384 2HB LEU 53 HB1 LEU 53 1.852 7.798 6.130 385 HG LEU 53 HG LEU 53 3.258 10.266 6.011 386 1HD1 LEU 53 HD21 LEU 53 1.802 10.503 8.498 387 2HD1 LEU 53 HD22 LEU 53 0.756 10.734 7.097 388 3HD1 LEU 53 HD23 LEU 53 2.195 11.734 7.297 389 1HD2 LEU 53 HD11 LEU 53 3.042 8.983 8.626 390 2HD2 LEU 53 HD12 LEU 53 4.459 9.280 7.617 391 3HD2 LEU 53 HD13 LEU 53 3.440 7.873 7.313 392 H THR 54 HN THR 54 4.380 8.753 4.096 393 HA THR 54 HA THR 54 4.578 5.929 3.825 394 HB THR 54 HB THR 54 5.772 6.853 1.393 395 HG1 THR 54 HG1 THR 54 3.170 7.072 0.825 396 1HG2 THR 54 HG21 THR 54 3.501 4.972 1.958 397 2HG2 THR 54 HG22 THR 54 5.188 4.565 1.644 398 3HG2 THR 54 HG23 THR 54 4.187 5.238 0.356 399 H ALA 55 HN ALA 55 6.975 5.532 2.764 400 HA ALA 55 HA ALA 55 8.782 6.273 4.693 401 1HB ALA 55 HB1 ALA 55 10.549 5.729 2.949 402 2HB ALA 55 HB2 ALA 55 9.207 5.442 1.841 403 3HB ALA 55 HB3 ALA 55 9.361 4.475 3.307 404 H SER 56 HN SER 56 7.843 8.058 1.833 405 HA SER 56 HA SER 56 9.987 9.922 1.870 406 1HB SER 56 HB2 SER 56 8.914 9.972 -0.167 407 2HB SER 56 HB1 SER 56 7.313 9.773 0.548 408 HG SER 56 HG SER 56 8.783 12.126 1.007 409 H MET 57 HN MET 57 6.681 9.994 3.160 410 HA MET 57 HA MET 57 6.739 12.568 4.265 411 1HB MET 57 HB1 MET 57 5.235 10.060 4.980 412 2HB MET 57 HB2 MET 57 5.046 11.531 5.919 413 1HG MET 57 HG1 MET 57 3.513 10.851 3.812 414 2HG MET 57 HG2 MET 57 3.758 12.503 4.373 415 1HE MET 57 HE1 MET 57 3.835 10.301 1.201 416 2HE MET 57 HE2 MET 57 5.189 9.717 2.169 417 3HE MET 57 HE3 MET 57 5.488 10.525 0.630 418 H LEU 58 HN LEU 58 7.832 9.463 5.458 419 HA LEU 58 HA LEU 58 8.480 10.250 8.098 420 1HB LEU 58 HB1 LEU 58 9.428 8.041 6.293 421 2HB LEU 58 HB2 LEU 58 10.086 8.245 7.902 422 HG LEU 58 HG LEU 58 8.420 7.039 8.743 423 1HD1 LEU 58 HD11 LEU 58 7.192 9.227 8.843 424 2HD1 LEU 58 HD12 LEU 58 6.169 7.790 8.810 425 3HD1 LEU 58 HD13 LEU 58 6.379 8.756 7.350 426 1HD2 LEU 58 HD21 LEU 58 8.566 6.031 6.417 427 2HD2 LEU 58 HD22 LEU 58 7.087 6.926 6.056 428 3HD2 LEU 58 HD23 LEU 58 7.090 5.712 7.333 429 H ALA 59 HN ALA 59 10.316 10.103 5.083 430 HA ALA 59 HA ALA 59 12.781 10.969 6.215 431 1HB ALA 59 HB1 ALA 59 11.734 10.549 3.466 432 2HB ALA 59 HB2 ALA 59 13.158 9.868 4.253 433 3HB ALA 59 HB3 ALA 59 13.186 11.531 3.666 434 H SER 60 HN SER 60 9.953 12.596 5.866 435 HA SER 60 HA SER 60 11.055 15.143 5.022 436 1HB SER 60 HB2 SER 60 8.292 14.356 5.973 437 2HB SER 60 HB1 SER 60 8.734 15.981 5.453 438 HG SER 60 HG SER 60 7.879 14.938 3.695 439 H ALA 61 HN ALA 61 10.944 13.400 7.863 440 HA ALA 61 HA ALA 61 11.436 15.834 9.438 441 1HB ALA 61 HB1 ALA 61 9.367 13.809 9.874 442 2HB ALA 61 HB2 ALA 61 9.485 15.463 10.476 443 3HB ALA 61 HB3 ALA 61 10.345 14.163 11.299 444 HA PRO 62 HA PRO 62 14.701 12.303 9.584 445 1HB PRO 62 HB1 PRO 62 16.716 14.294 9.312 446 2HB PRO 62 HB2 PRO 62 16.274 13.029 8.165 447 1HG PRO 62 HG1 PRO 62 15.537 15.878 8.194 448 2HG PRO 62 HG2 PRO 62 15.577 14.738 6.839 449 1HD PRO 62 HD1 PRO 62 13.271 15.659 7.939 450 2HD PRO 62 HD2 PRO 62 13.414 14.061 7.183 451 HA PRO 63 HA PRO 63 16.308 14.527 13.400 452 1HB PRO 63 HB1 PRO 63 16.367 17.168 13.657 453 2HB PRO 63 HB2 PRO 63 17.431 16.364 12.497 454 1HG PRO 63 HG1 PRO 63 14.938 17.920 12.024 455 2HG PRO 63 HG2 PRO 63 16.383 17.779 11.011 456 1HD PRO 63 HD1 PRO 63 13.949 16.338 10.741 457 2HD PRO 63 HD2 PRO 63 15.456 16.076 9.845 458 H GLN 64 HN GLN 64 13.187 14.968 12.430 459 HA GLN 64 HA GLN 64 12.320 15.902 15.083 460 1HB GLN 64 HB2 GLN 64 11.341 16.433 12.354 461 2HB GLN 64 HB1 GLN 64 10.084 16.113 13.540 462 1HG GLN 64 HG1 GLN 64 10.227 18.212 14.202 463 2HG GLN 64 HG2 GLN 64 11.868 17.893 14.762 464 1HE2 GLN 64 HE21 GLN 64 13.090 19.524 14.145 465 2HE2 GLN 64 HE22 GLN 64 13.130 20.223 12.566 466 H GLU 65 HN GLU 65 10.082 14.457 12.854 467 HA GLU 65 HA GLU 65 9.764 12.220 14.725 468 1HB GLU 65 HB1 GLU 65 7.637 12.608 12.765 469 2HB GLU 65 HB2 GLU 65 7.538 12.466 14.515 470 1HG GLU 65 HG2 GLU 65 8.639 14.970 14.109 471 2HG GLU 65 HG1 GLU 65 7.435 14.816 12.831 472 H GLN 66 HN GLN 66 11.824 11.919 12.933 473 HA GLN 66 HA GLN 66 11.148 10.684 10.498 474 1HB GLN 66 HB1 GLN 66 13.470 11.457 11.574 475 2HB GLN 66 HB2 GLN 66 13.555 9.745 11.968 476 1HG GLN 66 HG1 GLN 66 12.878 9.530 9.406 477 2HG GLN 66 HG2 GLN 66 13.675 11.099 9.346 478 1HE2 GLN 66 HE21 GLN 66 15.628 10.806 8.544 479 2HE2 GLN 66 HE22 GLN 66 16.753 9.589 9.031 480 H LYS 67 HN LYS 67 11.327 9.504 13.766 481 HA LYS 67 HA LYS 67 10.441 6.859 12.826 482 1HB LYS 67 HB2 LYS 67 11.558 5.888 14.803 483 2HB LYS 67 HB1 LYS 67 12.688 6.686 13.720 484 1HG LYS 67 HG1 LYS 67 11.622 8.373 15.874 485 2HG LYS 67 HG2 LYS 67 12.640 7.029 16.394 486 1HD LYS 67 HD1 LYS 67 14.389 7.785 14.826 487 2HD LYS 67 HD2 LYS 67 13.375 9.163 14.392 488 1HE LYS 67 HE1 LYS 67 13.400 9.403 17.080 489 2HE LYS 67 HE2 LYS 67 14.984 8.676 16.813 490 1HZ LYS 67 HZ1 LYS 67 15.632 10.762 16.427 491 2HZ LYS 67 HZ2 LYS 67 14.056 11.329 16.195 492 3HZ LYS 67 HZ3 LYS 67 14.887 10.594 14.918 493 H GLN 68 HN GLN 68 8.720 9.040 13.423 494 HA GLN 68 HA GLN 68 7.367 7.974 15.813 495 1HB GLN 68 HB2 GLN 68 8.404 10.175 16.267 496 2HB GLN 68 HB1 GLN 68 7.461 10.873 14.958 497 1HG GLN 68 HG2 GLN 68 5.539 10.884 16.157 498 2HG GLN 68 HG1 GLN 68 5.971 9.441 17.074 499 1HE2 GLN 68 HE22 GLN 68 7.445 12.639 16.611 500 2HE2 GLN 68 HE21 GLN 68 7.610 12.994 18.295 501 H MET 69 HN MET 69 6.855 9.894 12.850 502 HA MET 69 HA MET 69 4.031 9.485 12.868 503 1HB MET 69 HB1 MET 69 5.490 10.224 10.369 504 2HB MET 69 HB2 MET 69 3.944 10.798 10.978 505 1HG MET 69 HG1 MET 69 5.083 12.122 12.665 506 2HG MET 69 HG2 MET 69 6.643 11.525 12.105 507 1HE MET 69 HE1 MET 69 6.796 11.529 9.192 508 2HE MET 69 HE2 MET 69 7.957 12.487 10.111 509 3HE MET 69 HE3 MET 69 7.154 13.186 8.705 510 H LEU 70 HN LEU 70 6.183 7.218 12.548 511 HA LEU 70 HA LEU 70 5.497 5.975 10.062 512 1HB LEU 70 HB2 LEU 70 6.445 4.197 12.152 513 2HB LEU 70 HB1 LEU 70 7.147 4.522 10.591 514 HG LEU 70 HG LEU 70 7.531 6.123 13.119 515 1HD1 LEU 70 HD11 LEU 70 9.788 4.901 11.678 516 2HD1 LEU 70 HD12 LEU 70 8.682 3.786 12.484 517 3HD1 LEU 70 HD13 LEU 70 9.489 5.055 13.409 518 1HD2 LEU 70 HD21 LEU 70 9.166 7.409 11.795 519 2HD2 LEU 70 HD22 LEU 70 7.502 7.621 11.246 520 3HD2 LEU 70 HD23 LEU 70 8.605 6.578 10.344 521 H GLY 71 HN GLY 71 4.955 5.022 13.426 522 1HA GLY 71 HA2 GLY 71 2.521 3.648 12.515 523 2HA GLY 71 HA1 GLY 71 3.513 3.072 13.837 524 H GLU 72 HN GLU 72 3.131 6.485 13.693 525 HA GLU 72 HA GLU 72 0.956 6.317 15.677 526 1HB GLU 72 HB2 GLU 72 2.201 7.257 17.278 527 2HB GLU 72 HB1 GLU 72 3.587 6.928 16.250 528 1HG GLU 72 HG2 GLU 72 4.013 9.097 16.338 529 2HG GLU 72 HG1 GLU 72 2.623 9.323 15.280 530 H ARG 73 HN ARG 73 1.955 7.713 12.783 531 HA ARG 73 HA ARG 73 -0.063 9.845 13.091 532 1HB ARG 73 HB1 ARG 73 2.263 10.706 12.952 533 2HB ARG 73 HB2 ARG 73 2.430 9.933 11.385 534 1HG ARG 73 HG2 ARG 73 1.527 11.679 10.376 535 2HG ARG 73 HG1 ARG 73 0.085 11.566 11.388 536 1HD ARG 73 HD1 ARG 73 1.916 12.636 13.105 537 2HD ARG 73 HD2 ARG 73 2.381 13.369 11.572 538 HE ARG 73 HE ARG 73 -0.023 14.075 11.417 539 1HH1 ARG 73 HH21 ARG 73 1.510 13.492 14.492 540 2HH1 ARG 73 HH22 ARG 73 0.461 14.561 15.361 541 1HH2 ARG 73 HH12 ARG 73 -1.406 15.483 12.553 542 2HH2 ARG 73 HH11 ARG 73 -1.198 15.693 14.259 543 H LEU 74 HN LEU 74 1.051 7.154 11.347 544 HA LEU 74 HA LEU 74 -0.238 7.752 8.864 545 1HB LEU 74 HB1 LEU 74 1.386 5.621 9.981 546 2HB LEU 74 HB2 LEU 74 0.083 5.002 8.982 547 HG LEU 74 HG LEU 74 1.616 7.235 7.834 548 1HD1 LEU 74 HD11 LEU 74 3.561 6.037 7.331 549 2HD1 LEU 74 HD12 LEU 74 2.866 4.513 7.883 550 3HD1 LEU 74 HD13 LEU 74 3.288 5.765 9.053 551 1HD2 LEU 74 HD21 LEU 74 0.556 4.603 6.835 552 2HD2 LEU 74 HD22 LEU 74 1.448 5.751 5.836 553 3HD2 LEU 74 HD23 LEU 74 -0.103 6.211 6.538 554 H PHE 75 HN PHE 75 -1.389 6.760 11.860 555 HA PHE 75 HA PHE 75 -3.297 4.863 11.361 556 1HB PHE 75 HB1 PHE 75 -2.829 5.679 13.604 557 2HB PHE 75 HB2 PHE 75 -3.528 7.245 13.209 558 HD1 PHE 75 HD1 PHE 75 -5.246 7.336 14.806 559 HD2 PHE 75 HD2 PHE 75 -4.901 3.946 12.251 560 HE1 PHE 75 HE1 PHE 75 -7.447 6.545 15.570 561 HE2 PHE 75 HE2 PHE 75 -7.105 3.149 13.016 562 HZ PHE 75 HZ PHE 75 -8.379 4.448 14.674 563 HA PRO 76 HA PRO 76 -6.547 8.206 10.045 564 1HB PRO 76 HB1 PRO 76 -5.583 10.615 9.226 565 2HB PRO 76 HB2 PRO 76 -6.091 10.292 10.886 566 1HG PRO 76 HG2 PRO 76 -3.336 10.297 9.715 567 2HG PRO 76 HG1 PRO 76 -3.899 10.983 11.250 568 1HD PRO 76 HD1 PRO 76 -2.615 8.614 11.125 569 2HD PRO 76 HD2 PRO 76 -3.896 8.929 12.313 570 H LEU 77 HN LEU 77 -3.487 7.635 8.622 571 HA LEU 77 HA LEU 77 -4.328 8.285 5.928 572 1HB LEU 77 HB1 LEU 77 -1.802 7.220 7.144 573 2HB LEU 77 HB2 LEU 77 -2.046 7.158 5.415 574 HG LEU 77 HG LEU 77 -0.820 9.101 5.701 575 1HD1 LEU 77 HD21 LEU 77 -3.057 9.399 4.484 576 2HD1 LEU 77 HD22 LEU 77 -2.187 10.849 4.985 577 3HD1 LEU 77 HD23 LEU 77 -3.567 10.280 5.925 578 1HD2 LEU 77 HD11 LEU 77 -1.206 10.728 7.465 579 2HD2 LEU 77 HD12 LEU 77 -0.920 9.120 8.129 580 3HD2 LEU 77 HD13 LEU 77 -2.558 9.766 8.063 581 H ILE 78 HN ILE 78 -3.645 5.365 7.834 582 HA ILE 78 HA ILE 78 -3.957 3.502 5.758 583 HB ILE 78 HB ILE 78 -4.883 2.840 8.512 584 1HG1 ILE 78 HG12 ILE 78 -2.815 4.206 8.755 585 2HG1 ILE 78 HG11 ILE 78 -2.630 2.544 9.303 586 1HG2 ILE 78 HG21 ILE 78 -4.833 0.801 7.657 587 2HG2 ILE 78 HG22 ILE 78 -3.096 0.955 7.394 588 3HG2 ILE 78 HG23 ILE 78 -4.227 1.440 6.128 589 1HD1 ILE 78 HD11 ILE 78 -1.170 2.016 7.661 590 2HD1 ILE 78 HD12 ILE 78 -0.819 3.737 7.821 591 3HD1 ILE 78 HD13 ILE 78 -1.861 3.167 6.516 592 H GLN 79 HN GLN 79 -6.266 4.978 7.964 593 HA GLN 79 HA GLN 79 -8.518 3.478 7.572 594 1HB GLN 79 HB1 GLN 79 -7.967 6.300 8.244 595 2HB GLN 79 HB2 GLN 79 -9.582 5.989 7.621 596 1HG GLN 79 HG1 GLN 79 -9.900 4.280 9.358 597 2HG GLN 79 HG2 GLN 79 -8.301 4.657 9.998 598 1HE2 GLN 79 HE21 GLN 79 -11.595 5.611 9.794 599 2HE2 GLN 79 HE22 GLN 79 -11.501 6.959 10.871 600 H ALA 80 HN ALA 80 -6.876 5.416 5.289 601 HA ALA 80 HA ALA 80 -9.112 5.710 3.468 602 1HB ALA 80 HB1 ALA 80 -7.599 6.888 2.047 603 2HB ALA 80 HB2 ALA 80 -6.202 6.275 2.932 604 3HB ALA 80 HB3 ALA 80 -7.298 7.423 3.701 605 H MET 81 HN MET 81 -6.134 3.813 3.717 606 HA MET 81 HA MET 81 -6.419 2.469 1.222 607 1HB MET 81 HB1 MET 81 -4.980 1.239 3.545 608 2HB MET 81 HB2 MET 81 -4.533 1.237 1.846 609 1HG MET 81 HG1 MET 81 -4.454 3.907 2.552 610 2HG MET 81 HG2 MET 81 -3.814 3.071 3.962 611 1HE MET 81 HE1 MET 81 -1.854 1.309 3.848 612 2HE MET 81 HE2 MET 81 -1.319 2.962 4.181 613 3HE MET 81 HE3 MET 81 -0.414 1.951 3.054 614 H HIS 82 HN HIS 82 -7.332 1.752 4.532 615 HA HIS 82 HA HIS 82 -8.868 -0.579 3.595 616 1HB HIS 82 HB2 HIS 82 -7.700 -0.258 6.361 617 2HB HIS 82 HB1 HIS 82 -8.285 -1.728 5.600 618 HD2 HIS 82 HD2 HIS 82 -6.505 -1.457 2.831 619 HE1 HIS 82 HE1 HIS 82 -3.296 -1.606 5.567 620 HE2 HIS 82 HE2 HIS 82 -3.965 -1.868 3.134 621 HA PRO 83 HA PRO 83 -12.529 1.214 5.315 622 1HB PRO 83 HB2 PRO 83 -13.211 -1.393 6.524 623 2HB PRO 83 HB1 PRO 83 -14.085 -0.454 5.310 624 1HG PRO 83 HG2 PRO 83 -12.791 -2.707 4.662 625 2HG PRO 83 HG1 PRO 83 -12.846 -1.320 3.558 626 1HD PRO 83 HD1 PRO 83 -10.631 -2.222 5.362 627 2HD PRO 83 HD2 PRO 83 -10.548 -1.608 3.697 628 H THR 84 HN THR 84 -11.057 2.349 6.853 629 HA THR 84 HA THR 84 -10.269 2.920 8.915 630 HB THR 84 HB THR 84 -12.701 3.557 8.900 631 HG1 THR 84 HG1 THR 84 -11.077 3.896 10.694 632 1HG2 THR 84 HG21 THR 84 -14.155 2.348 10.521 633 2HG2 THR 84 HG22 THR 84 -12.994 1.022 10.478 634 3HG2 THR 84 HG23 THR 84 -13.851 1.492 9.010 635 H LEU 85 HN LEU 85 -9.764 0.134 8.214 636 HA LEU 85 HA LEU 85 -10.060 -1.355 10.681 637 1HB LEU 85 HB1 LEU 85 -9.223 -1.917 7.916 638 2HB LEU 85 HB2 LEU 85 -8.366 -2.836 9.139 639 HG LEU 85 HG LEU 85 -11.339 -2.754 9.295 640 1HD1 LEU 85 HD21 LEU 85 -11.165 -4.880 7.768 641 2HD1 LEU 85 HD22 LEU 85 -9.767 -4.029 7.112 642 3HD1 LEU 85 HD23 LEU 85 -11.361 -3.275 7.065 643 1HD2 LEU 85 HD11 LEU 85 -10.825 -4.212 10.889 644 2HD2 LEU 85 HD12 LEU 85 -9.143 -4.292 10.364 645 3HD2 LEU 85 HD13 LEU 85 -10.352 -5.332 9.612 646 H ALA 86 HN ALA 86 -8.198 1.115 9.988 647 HA ALA 86 HA ALA 86 -5.563 0.243 10.535 648 1HB ALA 86 HB1 ALA 86 -6.677 3.003 10.985 649 2HB ALA 86 HB2 ALA 86 -6.191 2.378 9.409 650 3HB ALA 86 HB3 ALA 86 -4.997 2.554 10.695 651 H GLY 87 HN GLY 87 -7.963 -0.244 12.524 652 1HA GLY 87 HA1 GLY 87 -7.506 1.013 14.936 653 2HA GLY 87 HA2 GLY 87 -8.115 -0.626 14.780 654 H LYS 88 HN LYS 88 -5.496 -1.336 13.373 655 HA LYS 88 HA LYS 88 -3.485 -1.015 15.394 656 1HB LYS 88 HB1 LYS 88 -4.896 -2.746 16.434 657 2HB LYS 88 HB2 LYS 88 -4.714 -3.752 15.005 658 1HG LYS 88 HG2 LYS 88 -3.254 -4.519 16.776 659 2HG LYS 88 HG1 LYS 88 -2.302 -3.902 15.419 660 1HD LYS 88 HD1 LYS 88 -2.728 -1.702 17.087 661 2HD LYS 88 HD2 LYS 88 -2.343 -3.043 18.170 662 1HE LYS 88 HE1 LYS 88 -0.427 -3.502 16.458 663 2HE LYS 88 HE2 LYS 88 -0.690 -1.822 15.997 664 1HZ LYS 88 HZ1 LYS 88 0.956 -2.567 17.943 665 2HZ LYS 88 HZ2 LYS 88 -0.454 -2.328 18.848 666 3HZ LYS 88 HZ3 LYS 88 0.177 -1.066 17.914 667 H ILE 89 HN ILE 89 -3.873 -0.702 12.444 668 HA ILE 89 HA ILE 89 -2.170 -2.732 11.307 669 HB ILE 89 HB ILE 89 -3.162 -0.188 10.038 670 1HG1 ILE 89 HG12 ILE 89 -4.168 -3.015 9.652 671 2HG1 ILE 89 HG11 ILE 89 -4.893 -1.898 10.804 672 1HG2 ILE 89 HG21 ILE 89 -1.219 -2.132 9.239 673 2HG2 ILE 89 HG22 ILE 89 -1.750 -0.678 8.390 674 3HG2 ILE 89 HG23 ILE 89 -2.605 -2.201 8.149 675 1HD1 ILE 89 HD11 ILE 89 -5.691 -2.221 8.241 676 2HD1 ILE 89 HD12 ILE 89 -4.617 -0.829 8.099 677 3HD1 ILE 89 HD13 ILE 89 -5.983 -0.780 9.214 678 H THR 90 HN THR 90 -1.723 0.695 10.652 679 HA THR 90 HA THR 90 1.030 0.609 10.459 680 HB THR 90 HB THR 90 -1.029 2.595 10.475 681 HG1 THR 90 HG1 THR 90 1.107 1.941 9.110 682 1HG2 THR 90 HG21 THR 90 1.176 3.205 12.305 683 2HG2 THR 90 HG22 THR 90 -0.438 3.906 12.185 684 3HG2 THR 90 HG23 THR 90 0.834 4.428 11.079 685 H GLY 91 HN GLY 91 -0.943 1.177 13.348 686 1HA GLY 91 HA2 GLY 91 1.125 1.925 15.108 687 2HA GLY 91 HA1 GLY 91 -0.368 1.116 15.577 688 H MET 92 HN MET 92 0.105 -1.123 13.810 689 HA MET 92 HA MET 92 1.707 -2.771 15.546 690 1HB MET 92 HB1 MET 92 -0.382 -3.295 13.893 691 2HB MET 92 HB2 MET 92 0.954 -3.760 12.854 692 1HG MET 92 HG1 MET 92 1.551 -5.523 14.153 693 2HG MET 92 HG2 MET 92 0.920 -4.799 15.631 694 1HE MET 92 HE1 MET 92 -0.785 -7.080 12.315 695 2HE MET 92 HE2 MET 92 -0.130 -5.447 12.166 696 3HE MET 92 HE3 MET 92 -1.871 -5.689 12.308 697 H LEU 93 HN LEU 93 2.012 -1.237 12.444 698 HA LEU 93 HA LEU 93 4.211 -2.545 11.418 699 1HB LEU 93 HB2 LEU 93 2.999 0.120 11.053 700 2HB LEU 93 HB1 LEU 93 4.572 -0.160 10.345 701 HG LEU 93 HG LEU 93 2.755 -0.563 8.735 702 1HD1 LEU 93 HD11 LEU 93 4.611 -2.714 9.598 703 2HD1 LEU 93 HD12 LEU 93 4.544 -1.816 8.081 704 3HD1 LEU 93 HD13 LEU 93 3.389 -3.113 8.388 705 1HD2 LEU 93 HD21 LEU 93 0.885 -1.310 9.790 706 2HD2 LEU 93 HD22 LEU 93 1.787 -2.308 10.934 707 3HD2 LEU 93 HD23 LEU 93 1.542 -2.862 9.275 708 H LEU 94 HN LEU 94 4.152 -0.766 14.230 709 HA LEU 94 HA LEU 94 7.036 -0.233 14.022 710 1HB LEU 94 HB1 LEU 94 4.823 1.251 15.282 711 2HB LEU 94 HB2 LEU 94 6.283 1.124 16.242 712 HG LEU 94 HG LEU 94 7.584 2.191 14.491 713 1HD1 LEU 94 HD11 LEU 94 6.877 2.596 12.359 714 2HD1 LEU 94 HD12 LEU 94 5.179 2.726 12.830 715 3HD1 LEU 94 HD13 LEU 94 5.941 1.141 12.710 716 1HD2 LEU 94 HD21 LEU 94 6.870 4.332 14.835 717 2HD2 LEU 94 HD22 LEU 94 5.992 3.495 16.113 718 3HD2 LEU 94 HD23 LEU 94 5.170 3.920 14.613 719 H GLU 95 HN GLU 95 5.665 -2.714 14.509 720 HA GLU 95 HA GLU 95 7.158 -3.643 16.734 721 1HB GLU 95 HB2 GLU 95 5.457 -4.186 18.279 722 2HB GLU 95 HB1 GLU 95 5.145 -2.520 17.816 723 1HG GLU 95 HG1 GLU 95 3.293 -3.098 16.523 724 2HG GLU 95 HG2 GLU 95 3.761 -4.796 16.449 725 H ILE 96 HN ILE 96 5.634 -4.068 13.841 726 HA ILE 96 HA ILE 96 4.703 -6.724 13.948 727 HB ILE 96 HB ILE 96 4.920 -6.829 11.563 728 1HG1 ILE 96 HG12 ILE 96 7.199 -5.849 11.462 729 2HG1 ILE 96 HG11 ILE 96 6.096 -5.256 10.228 730 1HG2 ILE 96 HG21 ILE 96 4.102 -4.194 11.238 731 2HG2 ILE 96 HG22 ILE 96 3.635 -4.627 12.886 732 3HG2 ILE 96 HG23 ILE 96 3.083 -5.605 11.527 733 1HD1 ILE 96 HD11 ILE 96 6.018 -3.579 12.545 734 2HD1 ILE 96 HD12 ILE 96 6.396 -3.180 10.866 735 3HD1 ILE 96 HD13 ILE 96 7.667 -3.762 11.944 736 H ASP 97 HN ASP 97 6.277 -7.683 11.656 737 HA ASP 97 HA ASP 97 8.180 -9.318 12.873 738 1HB ASP 97 HB1 ASP 97 6.977 -9.410 10.542 739 2HB ASP 97 HB2 ASP 97 8.359 -8.464 9.995 740 H ASN 98 HN ASN 98 8.263 -6.052 12.380 741 HA ASN 98 HA ASN 98 9.835 -4.484 12.773 742 1HB ASN 98 HB2 ASN 98 11.627 -5.026 13.986 743 2HB ASN 98 HB1 ASN 98 11.026 -6.676 13.930 744 1HD2 ASN 98 HD22 ASN 98 12.333 -8.168 13.132 745 2HD2 ASN 98 HD21 ASN 98 13.763 -7.868 12.210 746 H SER 99 HN SER 99 10.399 -6.949 10.423 747 HA SER 99 HA SER 99 12.270 -5.506 8.829 748 1HB SER 99 HB1 SER 99 10.375 -7.557 7.709 749 2HB SER 99 HB2 SER 99 12.036 -7.202 7.230 750 HG SER 99 HG SER 99 12.665 -8.034 9.317 751 H GLU 100 HN GLU 100 8.826 -5.566 9.147 752 HA GLU 100 HA GLU 100 8.247 -4.106 6.745 753 1HB GLU 100 HB1 GLU 100 6.612 -4.631 9.214 754 2HB GLU 100 HB2 GLU 100 6.003 -3.845 7.776 755 1HG GLU 100 HG2 GLU 100 5.289 -5.975 7.450 756 2HG GLU 100 HG1 GLU 100 6.825 -5.991 6.580 757 H LEU 101 HN LEU 101 8.853 -3.373 10.115 758 HA LEU 101 HA LEU 101 8.106 -0.647 10.027 759 1HB LEU 101 HB2 LEU 101 8.555 -0.745 12.209 760 2HB LEU 101 HB1 LEU 101 8.980 -2.427 11.974 761 HG LEU 101 HG LEU 101 11.338 -1.271 11.346 762 1HD1 LEU 101 HD21 LEU 101 10.460 0.983 11.822 763 2HD1 LEU 101 HD22 LEU 101 11.801 0.539 12.877 764 3HD1 LEU 101 HD23 LEU 101 10.146 0.487 13.484 765 1HD2 LEU 101 HD11 LEU 101 11.615 -2.890 12.882 766 2HD2 LEU 101 HD12 LEU 101 10.155 -2.447 13.768 767 3HD2 LEU 101 HD13 LEU 101 11.646 -1.537 14.013 768 H LEU 102 HN LEU 102 10.973 -2.402 9.136 769 HA LEU 102 HA LEU 102 12.612 -0.049 8.848 770 1HB LEU 102 HB2 LEU 102 12.936 -2.961 8.558 771 2HB LEU 102 HB1 LEU 102 13.894 -2.004 7.442 772 HG LEU 102 HG LEU 102 14.785 -0.747 9.446 773 1HD1 LEU 102 HD21 LEU 102 14.260 -1.300 11.571 774 2HD1 LEU 102 HD22 LEU 102 14.046 -3.009 11.189 775 3HD1 LEU 102 HD23 LEU 102 12.765 -1.856 10.818 776 1HD2 LEU 102 HD11 LEU 102 16.374 -2.497 10.043 777 2HD2 LEU 102 HD12 LEU 102 16.071 -2.482 8.306 778 3HD2 LEU 102 HD13 LEU 102 15.319 -3.711 9.322 779 H HIS 103 HN HIS 103 11.037 -2.347 6.639 780 HA HIS 103 HA HIS 103 11.943 -1.158 4.262 781 1HB HIS 103 HB1 HIS 103 10.513 -3.419 4.983 782 2HB HIS 103 HB2 HIS 103 9.345 -2.479 4.067 783 HD2 HIS 103 HD2 HIS 103 11.820 -1.366 1.962 784 HE1 HIS 103 HE1 HIS 103 11.778 -5.471 0.929 785 HE2 HIS 103 HE2 HIS 103 12.509 -3.152 0.209 786 H MET 104 HN MET 104 8.942 -0.739 6.097 787 HA MET 104 HA MET 104 7.541 0.865 4.332 788 1HB MET 104 HB2 MET 104 6.248 1.588 6.252 789 2HB MET 104 HB1 MET 104 6.619 -0.124 6.416 790 1HG MET 104 HG1 MET 104 7.849 0.190 8.258 791 2HG MET 104 HG2 MET 104 8.579 1.665 7.632 792 1HE MET 104 HE1 MET 104 4.369 1.453 9.397 793 2HE MET 104 HE2 MET 104 5.152 0.300 8.308 794 3HE MET 104 HE3 MET 104 4.535 1.829 7.680 795 H LEU 105 HN LEU 105 10.117 1.722 6.564 796 HA LEU 105 HA LEU 105 9.738 4.565 6.119 797 1HB LEU 105 HB1 LEU 105 12.051 3.250 7.525 798 2HB LEU 105 HB2 LEU 105 11.490 4.901 7.693 799 HG LEU 105 HG LEU 105 9.938 2.475 8.597 800 1HD1 LEU 105 HD11 LEU 105 11.185 4.415 10.475 801 2HD1 LEU 105 HD12 LEU 105 12.196 3.161 9.759 802 3HD1 LEU 105 HD13 LEU 105 10.779 2.715 10.709 803 1HD2 LEU 105 HD21 LEU 105 9.165 5.142 8.132 804 2HD2 LEU 105 HD22 LEU 105 9.237 4.921 9.881 805 3HD2 LEU 105 HD23 LEU 105 8.235 3.854 8.898 806 H GLU 106 HN GLU 106 11.312 2.017 4.589 807 HA GLU 106 HA GLU 106 13.313 3.812 3.434 808 1HB GLU 106 HB1 GLU 106 14.725 2.035 3.230 809 2HB GLU 106 HB2 GLU 106 13.720 1.405 4.528 810 1HG GLU 106 HG1 GLU 106 13.529 -0.396 3.236 811 2HG GLU 106 HG2 GLU 106 12.353 0.562 2.339 812 H SER 107 HN SER 107 10.298 2.573 2.643 813 HA SER 107 HA SER 107 10.816 3.155 -0.183 814 1HB SER 107 HB2 SER 107 10.816 0.586 0.541 815 2HB SER 107 HB1 SER 107 9.076 0.807 0.366 816 HG SER 107 HG SER 107 9.425 0.571 -1.685 817 HA PRO 108 HA PRO 108 6.918 5.253 0.228 818 1HB PRO 108 HB2 PRO 108 6.504 5.869 -2.356 819 2HB PRO 108 HB1 PRO 108 7.767 6.658 -1.403 820 1HG PRO 108 HG2 PRO 108 7.999 4.410 -3.368 821 2HG PRO 108 HG1 PRO 108 9.040 5.832 -3.169 822 1HD PRO 108 HD2 PRO 108 9.652 3.365 -2.170 823 2HD PRO 108 HD1 PRO 108 10.214 4.883 -1.442 824 H GLU 109 HN GLU 109 7.376 2.228 -0.944 825 HA GLU 109 HA GLU 109 4.501 1.847 -1.476 826 1HB GLU 109 HB2 GLU 109 6.816 0.401 -2.790 827 2HB GLU 109 HB1 GLU 109 5.115 0.020 -3.029 828 1HG GLU 109 HG1 GLU 109 4.793 1.734 -4.442 829 2HG GLU 109 HG2 GLU 109 5.857 2.814 -3.544 830 H SER 110 HN SER 110 7.200 1.084 0.396 831 HA SER 110 HA SER 110 6.331 -1.545 1.195 832 1HB SER 110 HB1 SER 110 8.632 0.177 1.728 833 2HB SER 110 HB2 SER 110 8.063 -0.686 3.159 834 HG SER 110 HG SER 110 8.384 -2.065 0.732 835 H LEU 111 HN LEU 111 6.357 1.701 2.546 836 HA LEU 111 HA LEU 111 5.167 1.296 4.989 837 1HB LEU 111 HB1 LEU 111 6.001 3.432 3.862 838 2HB LEU 111 HB2 LEU 111 4.434 3.516 3.081 839 HG LEU 111 HG LEU 111 4.287 4.992 4.880 840 1HD1 LEU 111 HD21 LEU 111 2.545 4.181 6.205 841 2HD1 LEU 111 HD22 LEU 111 3.148 2.526 6.142 842 3HD1 LEU 111 HD23 LEU 111 2.431 3.260 4.708 843 1HD2 LEU 111 HD11 LEU 111 5.120 4.669 7.045 844 2HD2 LEU 111 HD12 LEU 111 6.381 4.084 5.957 845 3HD2 LEU 111 HD13 LEU 111 5.329 2.937 6.793 846 H ARG 112 HN ARG 112 3.701 1.480 1.781 847 HA ARG 112 HA ARG 112 1.038 1.132 2.773 848 1HB ARG 112 HB2 ARG 112 0.843 2.237 0.813 849 2HB ARG 112 HB1 ARG 112 2.327 1.555 0.159 850 1HG ARG 112 HG1 ARG 112 1.235 -0.384 -0.575 851 2HG ARG 112 HG2 ARG 112 -0.204 -0.041 0.388 852 1HD ARG 112 HD2 ARG 112 -0.888 1.690 -1.026 853 2HD ARG 112 HD1 ARG 112 0.701 1.823 -1.779 854 HE ARG 112 HE ARG 112 0.243 -0.160 -3.011 855 1HH1 ARG 112 HH22 ARG 112 -2.466 1.023 -1.162 856 2HH1 ARG 112 HH21 ARG 112 -3.641 0.137 -2.078 857 1HH2 ARG 112 HH12 ARG 112 -1.297 -1.327 -4.218 858 2HH2 ARG 112 HH11 ARG 112 -2.976 -1.198 -3.813 859 H SER 113 HN SER 113 3.050 -0.916 0.645 860 HA SER 113 HA SER 113 1.461 -3.154 0.598 861 1HB SER 113 HB2 SER 113 3.390 -3.032 -0.826 862 2HB SER 113 HB1 SER 113 4.478 -2.951 0.561 863 HG SER 113 HG SER 113 3.055 -5.143 -0.464 864 H LYS 114 HN LYS 114 4.121 -2.537 2.876 865 HA LYS 114 HA LYS 114 3.782 -4.829 4.424 866 1HB LYS 114 HB1 LYS 114 4.826 -2.142 5.331 867 2HB LYS 114 HB2 LYS 114 5.092 -3.680 6.138 868 1HG LYS 114 HG1 LYS 114 6.009 -3.074 3.338 869 2HG LYS 114 HG2 LYS 114 7.013 -2.870 4.775 870 1HD LYS 114 HD1 LYS 114 7.565 -5.021 4.700 871 2HD LYS 114 HD2 LYS 114 5.866 -5.468 4.863 872 1HE LYS 114 HE1 LYS 114 6.510 -6.495 2.877 873 2HE LYS 114 HE2 LYS 114 5.718 -5.014 2.339 874 1HZ LYS 114 HZ1 LYS 114 7.567 -4.659 1.179 875 2HZ LYS 114 HZ2 LYS 114 8.439 -5.846 2.011 876 3HZ LYS 114 HZ3 LYS 114 8.318 -4.283 2.648 877 H VAL 115 HN VAL 115 2.042 -1.779 4.472 878 HA VAL 115 HA VAL 115 0.846 -2.232 7.044 879 HB VAL 115 HB VAL 115 0.504 -0.214 4.894 880 1HG1 VAL 115 HG11 VAL 115 -1.729 -1.204 6.560 881 2HG1 VAL 115 HG12 VAL 115 -1.758 -0.381 4.999 882 3HG1 VAL 115 HG13 VAL 115 -1.531 0.545 6.483 883 1HG2 VAL 115 HG21 VAL 115 1.666 0.873 6.448 884 2HG2 VAL 115 HG22 VAL 115 1.360 -0.382 7.649 885 3HG2 VAL 115 HG23 VAL 115 0.189 0.914 7.411 886 H ASP 116 HN ASP 116 -0.580 -2.219 3.753 887 HA ASP 116 HA ASP 116 -2.971 -3.428 4.322 888 1HB ASP 116 HB1 ASP 116 -2.047 -2.546 2.072 889 2HB ASP 116 HB2 ASP 116 -1.431 -4.181 1.849 890 H GLU 117 HN GLU 117 0.182 -4.923 3.967 891 HA GLU 117 HA GLU 117 -0.773 -7.622 4.015 892 1HB GLU 117 HB1 GLU 117 1.808 -6.258 3.875 893 2HB GLU 117 HB2 GLU 117 1.860 -7.700 4.880 894 1HG GLU 117 HG2 GLU 117 0.458 -8.488 2.622 895 2HG GLU 117 HG1 GLU 117 1.745 -7.451 2.007 896 H ALA 118 HN ALA 118 0.581 -5.386 6.412 897 HA ALA 118 HA ALA 118 0.604 -7.188 8.583 898 1HB ALA 118 HB1 ALA 118 1.689 -4.862 8.403 899 2HB ALA 118 HB2 ALA 118 1.028 -5.371 9.959 900 3HB ALA 118 HB3 ALA 118 0.119 -4.257 8.934 901 H VAL 119 HN VAL 119 -1.894 -5.530 6.943 902 HA VAL 119 HA VAL 119 -3.868 -5.466 8.968 903 HB VAL 119 HB VAL 119 -4.198 -5.655 5.983 904 1HG1 VAL 119 HG11 VAL 119 -6.407 -4.681 6.379 905 2HG1 VAL 119 HG12 VAL 119 -6.132 -4.764 8.120 906 3HG1 VAL 119 HG13 VAL 119 -6.245 -6.250 7.176 907 1HG2 VAL 119 HG21 VAL 119 -3.193 -3.621 7.694 908 2HG2 VAL 119 HG22 VAL 119 -4.731 -3.090 7.011 909 3HG2 VAL 119 HG23 VAL 119 -3.418 -3.591 5.945 910 H ALA 120 HN ALA 120 -3.023 -7.742 6.415 911 HA ALA 120 HA ALA 120 -4.989 -9.691 6.915 912 1HB ALA 120 HB1 ALA 120 -3.985 -10.688 5.185 913 2HB ALA 120 HB2 ALA 120 -2.471 -10.834 6.081 914 3HB ALA 120 HB3 ALA 120 -2.822 -9.358 5.176 915 H VAL 121 HN VAL 121 -2.034 -8.820 8.465 916 HA VAL 121 HA VAL 121 -1.827 -11.206 10.070 917 HB VAL 121 HB VAL 121 -0.314 -8.609 9.956 918 1HG1 VAL 121 HG21 VAL 121 0.348 -8.812 12.051 919 2HG1 VAL 121 HG22 VAL 121 1.057 -10.377 11.651 920 3HG1 VAL 121 HG23 VAL 121 -0.601 -10.288 12.244 921 1HG2 VAL 121 HG11 VAL 121 1.362 -9.799 8.953 922 2HG2 VAL 121 HG12 VAL 121 -0.040 -10.708 8.387 923 3HG2 VAL 121 HG13 VAL 121 0.914 -11.309 9.744 924 H LEU 122 HN LEU 122 -3.065 -7.948 10.352 925 HA LEU 122 HA LEU 122 -3.464 -7.994 13.176 926 1HB LEU 122 HB2 LEU 122 -3.711 -5.824 12.774 927 2HB LEU 122 HB1 LEU 122 -3.750 -6.124 11.050 928 HG LEU 122 HG LEU 122 -6.324 -6.758 11.873 929 1HD1 LEU 122 HD11 LEU 122 -5.124 -4.773 13.679 930 2HD1 LEU 122 HD12 LEU 122 -6.527 -5.818 13.906 931 3HD1 LEU 122 HD13 LEU 122 -6.680 -4.324 12.982 932 1HD2 LEU 122 HD21 LEU 122 -6.902 -4.598 10.778 933 2HD2 LEU 122 HD22 LEU 122 -5.823 -5.622 9.832 934 3HD2 LEU 122 HD23 LEU 122 -5.177 -4.232 10.705 935 H GLN 123 HN GLN 123 -5.402 -8.744 10.354 936 HA GLN 123 HA GLN 123 -7.852 -9.183 11.713 937 1HB GLN 123 HB1 GLN 123 -6.788 -10.057 9.026 938 2HB GLN 123 HB2 GLN 123 -8.395 -10.497 9.587 939 1HG GLN 123 HG2 GLN 123 -8.042 -7.691 9.919 940 2HG GLN 123 HG1 GLN 123 -7.569 -8.139 8.282 941 1HE2 GLN 123 HE22 GLN 123 -9.178 -7.765 6.950 942 2HE2 GLN 123 HE21 GLN 123 -10.843 -8.135 7.230 943 H ALA 124 HN ALA 124 -5.004 -11.069 11.110 944 HA ALA 124 HA ALA 124 -6.241 -13.559 11.973 945 1HB ALA 124 HB1 ALA 124 -4.656 -13.706 10.167 946 2HB ALA 124 HB2 ALA 124 -3.982 -14.510 11.584 947 3HB ALA 124 HB3 ALA 124 -3.420 -12.899 11.134 948 H HIS 125 HN HIS 125 -4.858 -10.878 13.438 949 HA HIS 125 HA HIS 125 -4.155 -12.468 15.814 950 1HB HIS 125 HB1 HIS 125 -2.612 -10.512 14.372 951 2HB HIS 125 HB2 HIS 125 -2.893 -9.952 16.018 952 HD2 HIS 125 HD2 HIS 125 -1.058 -10.838 17.737 953 HE1 HIS 125 HE1 HIS 125 0.107 -14.291 15.583 954 HE2 HIS 125 HE2 HIS 125 0.535 -12.884 17.651 955 H GLN 126 HN GLN 126 -6.575 -10.715 14.728 956 HA GLN 126 HA GLN 126 -6.905 -8.770 16.803 957 1HB GLN 126 HB1 GLN 126 -8.476 -9.731 14.490 958 2HB GLN 126 HB2 GLN 126 -9.414 -9.089 15.833 959 1HG GLN 126 HG2 GLN 126 -7.108 -7.562 14.688 960 2HG GLN 126 HG1 GLN 126 -8.709 -7.498 13.950 961 1HE2 GLN 126 HE21 GLN 126 -9.010 -5.339 14.404 962 2HE2 GLN 126 HE22 GLN 126 -9.278 -4.749 16.005 963 H ALA 127 HN ALA 127 -9.775 -10.544 16.396 964 HA ALA 127 HA ALA 127 -9.574 -11.518 19.147 965 1HB ALA 127 HB1 ALA 127 -12.100 -11.741 17.604 966 2HB ALA 127 HB2 ALA 127 -11.549 -10.129 18.062 967 3HB ALA 127 HB3 ALA 127 -11.840 -11.348 19.304 968 H LYS 128 HN LYS 128 -8.150 -12.867 17.029 969 HA LYS 128 HA LYS 128 -9.666 -15.332 16.622 970 1HB LYS 128 HB2 LYS 128 -6.923 -15.214 15.574 971 2HB LYS 128 HB1 LYS 128 -8.417 -15.677 14.772 972 1HG LYS 128 HG1 LYS 128 -7.566 -12.839 15.303 973 2HG LYS 128 HG2 LYS 128 -7.340 -13.696 13.777 974 1HD LYS 128 HD1 LYS 128 -10.049 -13.410 15.040 975 2HD LYS 128 HD2 LYS 128 -9.374 -12.159 13.993 976 1HE LYS 128 HE1 LYS 128 -9.771 -13.345 12.140 977 2HE LYS 128 HE2 LYS 128 -9.151 -14.832 12.859 978 1HZ LYS 128 HZ1 LYS 128 -11.198 -15.465 13.547 979 2HZ LYS 128 HZ2 LYS 128 -11.681 -14.529 12.224 980 3HZ LYS 128 HZ3 LYS 128 -11.752 -13.885 13.786 981 H GLU 129 HN GLU 129 -6.952 -16.715 16.348 982 HA GLU 129 HA GLU 129 -6.875 -17.667 19.081 983 1HB GLU 129 HB1 GLU 129 -5.273 -19.346 18.158 984 2HB GLU 129 HB2 GLU 129 -6.835 -19.334 17.351 985 1HG GLU 129 HG2 GLU 129 -5.802 -19.105 15.415 986 2HG GLU 129 HG1 GLU 129 -5.194 -17.538 15.944 987 H ALA 130 HN ALA 130 -5.715 -14.990 18.035 988 HA ALA 130 HA ALA 130 -2.920 -15.068 18.342 989 1HB ALA 130 HB1 ALA 130 -3.015 -12.871 17.922 990 2HB ALA 130 HB2 ALA 130 -4.197 -12.579 19.197 991 3HB ALA 130 HB3 ALA 130 -4.728 -13.159 17.618 992 H ALA 131 HN ALA 131 -5.542 -14.644 20.654 993 HA ALA 131 HA ALA 131 -3.834 -14.020 22.863 994 1HB ALA 131 HB1 ALA 131 -5.865 -14.323 24.224 995 2HB ALA 131 HB2 ALA 131 -6.714 -14.908 22.793 996 3HB ALA 131 HB3 ALA 131 -6.123 -13.247 22.851 997 H GLN 132 HN GLN 132 -2.732 -15.365 24.132 998 HA GLN 132 HA GLN 132 -2.777 -18.189 23.629 999 1HB GLN 132 HB2 GLN 132 -1.130 -16.308 25.209 1000 2HB GLN 132 HB1 GLN 132 -1.219 -17.950 25.834 1001 1HG GLN 132 HG1 GLN 132 0.026 -18.793 24.170 1002 2HG GLN 132 HG2 GLN 132 -0.694 -17.739 22.954 1003 1HE2 GLN 132 HE22 GLN 132 2.033 -18.381 24.765 1004 2HE2 GLN 132 HE21 GLN 132 2.889 -16.905 24.489 1005 H LYS 133 HN LYS 133 -4.715 -19.052 24.257 1006 HA LYS 133 HA LYS 133 -5.807 -18.515 26.876 1007 1HB LYS 133 HB1 LYS 133 -6.658 -20.447 24.709 1008 2HB LYS 133 HB2 LYS 133 -7.549 -20.161 26.199 1009 1HG LYS 133 HG1 LYS 133 -6.907 -17.782 24.573 1010 2HG LYS 133 HG2 LYS 133 -8.087 -18.910 23.901 1011 1HD LYS 133 HD1 LYS 133 -9.662 -18.270 25.347 1012 2HD LYS 133 HD2 LYS 133 -8.553 -18.379 26.717 1013 1HE LYS 133 HE1 LYS 133 -8.088 -16.179 26.679 1014 2HE LYS 133 HE2 LYS 133 -8.072 -16.111 24.918 1015 1HZ LYS 133 HZ1 LYS 133 -10.553 -16.273 26.534 1016 2HZ LYS 133 HZ2 LYS 133 -10.432 -15.982 24.873 1017 3HZ LYS 133 HZ3 LYS 133 -9.888 -14.821 25.977 1018 H ALA 134 HN ALA 134 -3.516 -20.626 25.581 1019 HA ALA 134 HA ALA 134 -3.978 -22.897 27.242 1020 1HB ALA 134 HB1 ALA 134 -1.226 -22.598 26.401 1021 2HB ALA 134 HB2 ALA 134 -2.353 -22.326 25.071 1022 3HB ALA 134 HB3 ALA 134 -2.408 -23.838 25.979 1023 H VAL 135 HN VAL 135 -2.579 -23.637 28.964 1024 HA VAL 135 HA VAL 135 -2.020 -21.536 30.850 1025 HB VAL 135 HB VAL 135 -1.359 -23.399 32.367 1026 1HG1 VAL 135 HG21 VAL 135 -3.940 -22.841 31.253 1027 2HG1 VAL 135 HG22 VAL 135 -3.509 -23.276 32.907 1028 3HG1 VAL 135 HG23 VAL 135 -3.844 -24.539 31.722 1029 1HG2 VAL 135 HG11 VAL 135 -0.479 -25.018 30.884 1030 2HG2 VAL 135 HG12 VAL 135 -1.960 -25.054 29.927 1031 3HG2 VAL 135 HG13 VAL 135 -1.948 -25.719 31.561 1032 H ASN 136 HN ASN 136 0.136 -22.383 32.264 1033 HA ASN 136 HA ASN 136 2.303 -21.387 30.729 1034 1HB ASN 136 HB2 ASN 136 1.834 -21.448 33.355 1035 2HB ASN 136 HB1 ASN 136 2.827 -22.898 33.244 1036 1HD2 ASN 136 HD21 ASN 136 4.602 -22.140 34.273 1037 2HD2 ASN 136 HD22 ASN 136 5.590 -20.855 33.673 1038 H SER 137 HN SER 137 2.602 -22.726 28.949 1039 HA SER 137 HA SER 137 3.411 -25.496 29.493 1040 1HB SER 137 HB1 SER 137 2.878 -24.288 26.776 1041 2HB SER 137 HB2 SER 137 2.921 -25.995 27.216 1042 HG SER 137 HG SER 137 0.780 -25.196 27.007 1043 H ALA 138 HN ALA 138 5.517 -25.177 30.181 1044 HA ALA 138 HA ALA 138 7.382 -23.589 28.687 1045 1HB ALA 138 HB1 ALA 138 7.721 -25.514 30.974 1046 2HB ALA 138 HB2 ALA 138 7.757 -23.751 31.024 1047 3HB ALA 138 HB3 ALA 138 9.063 -24.638 30.236 1048 H THR 139 HN THR 139 7.145 -24.542 26.584 1049 HA THR 139 HA THR 139 8.041 -27.284 26.234 1050 HB THR 139 HB THR 139 7.642 -25.636 23.831 1051 HG1 THR 139 HG1 THR 139 5.343 -26.240 25.336 1052 1HG2 THR 139 HG21 THR 139 5.898 -27.929 24.395 1053 2HG2 THR 139 HG22 THR 139 7.624 -28.278 24.286 1054 3HG2 THR 139 HG23 THR 139 6.794 -27.504 22.936 1055 H GLY 140 HN GLY 140 10.209 -27.275 26.761 1056 1HA GLY 140 HA2 GLY 140 11.977 -25.414 25.354 1057 2HA GLY 140 HA1 GLY 140 12.436 -26.483 26.671 1058 H VAL 141 HN VAL 141 12.041 -28.915 26.028 1059 HA VAL 141 HA VAL 141 13.554 -29.306 23.562 1060 HB VAL 141 HB VAL 141 12.933 -31.388 25.648 1061 1HG1 VAL 141 HG11 VAL 141 14.919 -31.236 23.390 1062 2HG1 VAL 141 HG12 VAL 141 13.589 -32.378 23.581 1063 3HG1 VAL 141 HG13 VAL 141 14.978 -32.452 24.665 1064 1HG2 VAL 141 HG21 VAL 141 14.127 -29.767 26.847 1065 2HG2 VAL 141 HG22 VAL 141 15.172 -29.397 25.475 1066 3HG2 VAL 141 HG23 VAL 141 15.353 -30.927 26.333 1067 HA PRO 142 HA PRO 142 10.812 -29.678 25.924 1068 1HB PRO 142 HB1 PRO 142 8.516 -30.845 26.617 1069 2HB PRO 142 HB2 PRO 142 8.544 -29.479 25.496 1070 1HG PRO 142 HG2 PRO 142 8.191 -32.385 24.940 1071 2HG PRO 142 HG1 PRO 142 7.444 -30.990 24.144 1072 1HD PRO 142 HD1 PRO 142 9.656 -32.442 23.212 1073 2HD PRO 142 HD2 PRO 142 9.124 -30.854 22.627 1074 H THR 143 HN THR 143 10.021 -33.085 25.185 1075 HA THR 143 HA THR 143 11.288 -33.872 27.712 1076 HB THR 143 HB THR 143 10.196 -36.112 27.197 1077 HG1 THR 143 HG1 THR 143 9.614 -34.802 24.931 1078 1HG2 THR 143 HG21 THR 143 8.936 -35.137 28.788 1079 2HG2 THR 143 HG22 THR 143 7.779 -35.037 27.460 1080 3HG2 THR 143 HG23 THR 143 8.757 -33.633 27.885 1081 H VAL 144 HN VAL 144 12.470 -36.018 27.619 1082 HA VAL 144 HA VAL 144 14.187 -36.061 25.224 1083 HB VAL 144 HB VAL 144 14.945 -37.023 27.982 1084 1HG1 VAL 144 HG11 VAL 144 16.197 -37.110 25.362 1085 2HG1 VAL 144 HG12 VAL 144 16.610 -37.976 26.842 1086 3HG1 VAL 144 HG13 VAL 144 17.221 -36.343 26.575 1087 1HG2 VAL 144 HG21 VAL 144 16.390 -34.903 27.929 1088 2HG2 VAL 144 HG22 VAL 144 14.674 -34.724 28.295 1089 3HG2 VAL 144 HG23 VAL 144 15.277 -34.339 26.683 Start of MODEL 12 1 1H GLY 1 HT1 GLY 1 -42.012 9.754 -29.523 2 2H GLY 1 HT2 GLY 1 -41.171 8.290 -29.425 3 3H GLY 1 HT3 GLY 1 -42.574 8.399 -30.365 4 1HA GLY 1 HA1 GLY 1 -41.509 9.223 -32.123 5 2HA GLY 1 HA2 GLY 1 -40.589 10.328 -31.114 6 HA PRO 2 HA PRO 2 -37.393 7.533 -32.848 7 1HB PRO 2 HB2 PRO 2 -35.718 9.645 -31.594 8 2HB PRO 2 HB1 PRO 2 -35.619 8.940 -33.211 9 1HG PRO 2 HG2 PRO 2 -36.600 11.390 -32.852 10 2HG PRO 2 HG1 PRO 2 -37.313 10.289 -34.045 11 1HD PRO 2 HD2 PRO 2 -38.304 11.042 -31.325 12 2HD PRO 2 HD1 PRO 2 -39.218 10.762 -32.822 13 H LEU 3 HN LEU 3 -37.703 8.954 -29.650 14 HA LEU 3 HA LEU 3 -35.947 6.910 -28.509 15 1HB LEU 3 HB2 LEU 3 -36.035 9.495 -27.931 16 2HB LEU 3 HB1 LEU 3 -37.306 8.974 -26.842 17 HG LEU 3 HG LEU 3 -35.613 7.294 -25.919 18 1HD1 LEU 3 HD11 LEU 3 -33.544 9.148 -27.021 19 2HD1 LEU 3 HD12 LEU 3 -34.085 7.758 -27.962 20 3HD1 LEU 3 HD13 LEU 3 -33.360 7.518 -26.373 21 1HD2 LEU 3 HD21 LEU 3 -35.642 10.235 -25.543 22 2HD2 LEU 3 HD22 LEU 3 -34.352 9.321 -24.764 23 3HD2 LEU 3 HD23 LEU 3 -36.038 8.942 -24.411 24 H GLY 4 HN GLY 4 -36.725 5.135 -27.574 25 1HA GLY 4 HA2 GLY 4 -39.602 4.820 -27.322 26 2HA GLY 4 HA1 GLY 4 -38.393 3.559 -27.134 27 H SER 5 HN SER 5 -40.674 4.128 -25.435 28 HA SER 5 HA SER 5 -39.423 5.121 -22.980 29 1HB SER 5 HB2 SER 5 -42.297 4.550 -23.719 30 2HB SER 5 HB1 SER 5 -41.792 4.943 -22.076 31 HG SER 5 HG SER 5 -42.513 6.719 -23.563 32 H ALA 6 HN ALA 6 -38.222 3.527 -22.108 33 HA ALA 6 HA ALA 6 -37.657 1.561 -21.110 34 1HB ALA 6 HB1 ALA 6 -40.037 2.336 -20.027 35 2HB ALA 6 HB2 ALA 6 -39.045 0.998 -19.448 36 3HB ALA 6 HB3 ALA 6 -40.391 0.688 -20.545 37 H ALA 7 HN ALA 7 -37.060 0.815 -23.285 38 HA ALA 7 HA ALA 7 -38.887 -0.961 -24.650 39 1HB ALA 7 HB1 ALA 7 -37.646 -0.122 -26.312 40 2HB ALA 7 HB2 ALA 7 -36.462 -1.344 -25.849 41 3HB ALA 7 HB3 ALA 7 -36.318 0.303 -25.233 42 H ALA 8 HN ALA 8 -39.286 -2.806 -23.558 43 HA ALA 8 HA ALA 8 -38.969 -4.840 -22.589 44 1HB ALA 8 HB1 ALA 8 -37.755 -6.193 -23.881 45 2HB ALA 8 HB2 ALA 8 -36.267 -5.305 -23.561 46 3HB ALA 8 HB3 ALA 8 -37.370 -4.752 -24.821 47 H ALA 9 HN ALA 9 -36.610 -6.116 -21.695 48 HA ALA 9 HA ALA 9 -35.444 -4.273 -19.747 49 1HB ALA 9 HB1 ALA 9 -36.004 -6.665 -18.338 50 2HB ALA 9 HB2 ALA 9 -37.498 -6.126 -19.105 51 3HB ALA 9 HB3 ALA 9 -36.616 -5.039 -18.032 52 H THR 10 HN THR 10 -33.992 -5.067 -21.793 53 HA THR 10 HA THR 10 -32.074 -6.895 -20.583 54 HB THR 10 HB THR 10 -32.932 -7.279 -23.452 55 HG1 THR 10 HG1 THR 10 -33.897 -8.440 -21.086 56 1HG2 THR 10 HG21 THR 10 -30.892 -8.472 -21.758 57 2HG2 THR 10 HG22 THR 10 -31.064 -8.478 -23.512 58 3HG2 THR 10 HG23 THR 10 -31.947 -9.651 -22.536 59 HA PRO 11 HA PRO 11 -30.075 -7.351 -20.535 60 1HB PRO 11 HB2 PRO 11 -27.953 -6.188 -19.342 61 2HB PRO 11 HB1 PRO 11 -27.841 -6.954 -20.931 62 1HG PRO 11 HG2 PRO 11 -28.115 -4.052 -20.238 63 2HG PRO 11 HG1 PRO 11 -27.066 -4.818 -21.445 64 1HD PRO 11 HD1 PRO 11 -29.421 -3.609 -22.074 65 2HD PRO 11 HD2 PRO 11 -28.753 -4.970 -22.998 66 H ALA 12 HN ALA 12 -29.472 -7.207 -18.054 67 HA ALA 12 HA ALA 12 -31.661 -5.824 -16.805 68 1HB ALA 12 HB1 ALA 12 -29.725 -7.897 -16.035 69 2HB ALA 12 HB2 ALA 12 -31.448 -7.761 -15.684 70 3HB ALA 12 HB3 ALA 12 -30.278 -6.852 -14.726 71 H VAL 13 HN VAL 13 -28.365 -5.143 -17.403 72 HA VAL 13 HA VAL 13 -28.172 -3.212 -15.225 73 HB VAL 13 HB VAL 13 -26.211 -4.601 -15.679 74 1HG1 VAL 13 HG11 VAL 13 -26.707 -3.715 -18.420 75 2HG1 VAL 13 HG12 VAL 13 -25.877 -5.152 -17.823 76 3HG1 VAL 13 HG13 VAL 13 -25.016 -3.616 -17.929 77 1HG2 VAL 13 HG21 VAL 13 -24.672 -2.944 -15.325 78 2HG2 VAL 13 HG22 VAL 13 -26.164 -2.062 -14.997 79 3HG2 VAL 13 HG23 VAL 13 -25.362 -1.887 -16.558 80 H ARG 14 HN ARG 14 -28.216 -1.036 -15.470 81 HA ARG 14 HA ARG 14 -28.999 -0.030 -18.111 82 1HB ARG 14 HB1 ARG 14 -29.111 1.816 -15.819 83 2HB ARG 14 HB2 ARG 14 -30.306 1.497 -17.068 84 1HG ARG 14 HG2 ARG 14 -31.467 0.167 -15.727 85 2HG ARG 14 HG1 ARG 14 -30.031 -0.762 -15.295 86 1HD ARG 14 HD2 ARG 14 -29.576 1.505 -13.906 87 2HD ARG 14 HD1 ARG 14 -31.339 1.475 -13.890 88 HE ARG 14 HE ARG 14 -31.182 -0.737 -12.858 89 1HH1 ARG 14 HH11 ARG 14 -28.345 1.289 -12.816 90 2HH1 ARG 14 HH12 ARG 14 -27.644 0.498 -11.444 91 1HH2 ARG 14 HH21 ARG 14 -30.266 -1.783 -11.053 92 2HH2 ARG 14 HH22 ARG 14 -28.736 -1.248 -10.441 93 H THR 15 HN THR 15 -26.507 0.149 -15.713 94 HA THR 15 HA THR 15 -25.197 2.332 -17.181 95 HB THR 15 HB THR 15 -25.382 2.916 -14.895 96 HG1 THR 15 HG1 THR 15 -23.104 2.631 -14.167 97 1HG2 THR 15 HG21 THR 15 -24.878 0.075 -14.390 98 2HG2 THR 15 HG22 THR 15 -25.844 1.243 -13.489 99 3HG2 THR 15 HG23 THR 15 -24.094 1.193 -13.274 100 H VAL 16 HN VAL 16 -24.768 0.584 -18.815 101 HA VAL 16 HA VAL 16 -22.529 -1.157 -18.077 102 HB VAL 16 HB VAL 16 -24.302 -2.313 -19.217 103 1HG1 VAL 16 HG21 VAL 16 -24.729 -1.626 -21.677 104 2HG1 VAL 16 HG22 VAL 16 -24.089 -0.061 -21.176 105 3HG1 VAL 16 HG23 VAL 16 -25.519 -0.723 -20.384 106 1HG2 VAL 16 HG11 VAL 16 -22.444 -3.400 -19.915 107 2HG2 VAL 16 HG12 VAL 16 -21.705 -1.944 -20.580 108 3HG2 VAL 16 HG13 VAL 16 -22.965 -2.785 -21.483 109 HA PRO 17 HA PRO 17 -19.697 1.734 -19.940 110 1HB PRO 17 HB2 PRO 17 -17.564 0.050 -20.179 111 2HB PRO 17 HB1 PRO 17 -18.035 0.818 -18.660 112 1HG PRO 17 HG2 PRO 17 -18.613 -1.951 -19.644 113 2HG PRO 17 HG1 PRO 17 -18.116 -1.419 -18.026 114 1HD PRO 17 HD2 PRO 17 -20.679 -2.012 -18.608 115 2HD PRO 17 HD1 PRO 17 -20.250 -0.726 -17.460 116 H GLN 18 HN GLN 18 -20.171 2.267 -21.989 117 HA GLN 18 HA GLN 18 -20.302 0.274 -24.076 118 1HB GLN 18 HB2 GLN 18 -21.014 3.128 -23.784 119 2HB GLN 18 HB1 GLN 18 -20.510 2.634 -25.395 120 1HG GLN 18 HG2 GLN 18 -22.261 0.651 -24.677 121 2HG GLN 18 HG1 GLN 18 -22.978 2.089 -23.953 122 1HE2 GLN 18 HE21 GLN 18 -22.932 0.234 -26.642 123 2HE2 GLN 18 HE22 GLN 18 -23.465 1.390 -27.811 124 H TYR 19 HN TYR 19 -18.698 -0.302 -25.377 125 HA TYR 19 HA TYR 19 -16.094 0.826 -25.084 126 1HB TYR 19 HB1 TYR 19 -17.061 -1.111 -27.198 127 2HB TYR 19 HB2 TYR 19 -15.393 -0.833 -26.706 128 HD1 TYR 19 HD1 TYR 19 -18.289 -2.819 -26.201 129 HD2 TYR 19 HD2 TYR 19 -14.816 -1.349 -24.232 130 HE1 TYR 19 HE1 TYR 19 -18.489 -4.608 -24.527 131 HE2 TYR 19 HE2 TYR 19 -15.006 -3.134 -22.552 132 HH TYR 19 HH TYR 19 -17.191 -5.780 -22.921 133 H LYS 20 HN LYS 20 -14.900 1.021 -27.431 134 HA LYS 20 HA LYS 20 -16.100 3.408 -28.580 135 1HB LYS 20 HB1 LYS 20 -13.429 2.132 -29.199 136 2HB LYS 20 HB2 LYS 20 -13.951 3.749 -29.655 137 1HG LYS 20 HG1 LYS 20 -13.612 4.600 -27.575 138 2HG LYS 20 HG2 LYS 20 -13.957 3.067 -26.770 139 1HD LYS 20 HD2 LYS 20 -11.687 2.513 -28.227 140 2HD LYS 20 HD1 LYS 20 -11.419 4.169 -27.679 141 1HE LYS 20 HE2 LYS 20 -12.341 2.027 -25.793 142 2HE LYS 20 HE1 LYS 20 -10.632 2.247 -26.167 143 1HZ LYS 20 HZ1 LYS 20 -11.449 3.443 -24.149 144 2HZ LYS 20 HZ2 LYS 20 -12.364 4.435 -25.168 145 3HZ LYS 20 HZ3 LYS 20 -10.676 4.426 -25.288 146 H TYR 21 HN TYR 21 -17.125 0.636 -29.104 147 HA TYR 21 HA TYR 21 -16.572 0.255 -31.928 148 1HB TYR 21 HB1 TYR 21 -17.637 -1.355 -29.762 149 2HB TYR 21 HB2 TYR 21 -18.650 -1.462 -31.198 150 HD1 TYR 21 HD1 TYR 21 -18.030 -2.834 -32.988 151 HD2 TYR 21 HD2 TYR 21 -15.141 -1.833 -30.029 152 HE1 TYR 21 HE1 TYR 21 -16.466 -4.453 -33.976 153 HE2 TYR 21 HE2 TYR 21 -13.569 -3.450 -31.010 154 HH TYR 21 HH TYR 21 -13.976 -5.723 -32.534 155 H ALA 22 HN ALA 22 -19.068 1.507 -29.866 156 HA ALA 22 HA ALA 22 -20.897 1.844 -32.127 157 1HB ALA 22 HB1 ALA 22 -22.251 2.880 -30.037 158 2HB ALA 22 HB2 ALA 22 -21.199 1.737 -29.201 159 3HB ALA 22 HB3 ALA 22 -22.276 1.173 -30.479 160 H ALA 23 HN ALA 23 -18.326 3.419 -31.370 161 HA ALA 23 HA ALA 23 -19.033 6.045 -30.705 162 1HB ALA 23 HB1 ALA 23 -16.754 5.611 -32.555 163 2HB ALA 23 HB2 ALA 23 -16.697 4.826 -30.977 164 3HB ALA 23 HB3 ALA 23 -16.853 6.579 -31.084 165 H GLY 24 HN GLY 24 -20.490 7.227 -31.767 166 1HA GLY 24 HA1 GLY 24 -20.676 7.002 -34.685 167 2HA GLY 24 HA2 GLY 24 -21.869 7.742 -33.628 168 H VAL 25 HN VAL 25 -18.507 8.491 -33.223 169 HA VAL 25 HA VAL 25 -19.043 11.199 -34.236 170 HB VAL 25 HB VAL 25 -16.961 11.789 -32.873 171 1HG1 VAL 25 HG11 VAL 25 -18.250 12.014 -30.818 172 2HG1 VAL 25 HG12 VAL 25 -19.425 10.842 -31.414 173 3HG1 VAL 25 HG13 VAL 25 -19.243 12.398 -32.224 174 1HG2 VAL 25 HG21 VAL 25 -17.519 9.019 -31.845 175 2HG2 VAL 25 HG22 VAL 25 -16.643 10.226 -30.904 176 3HG2 VAL 25 HG23 VAL 25 -15.998 9.676 -32.451 177 H ARG 26 HN ARG 26 -18.581 9.651 -36.284 178 HA ARG 26 HA ARG 26 -15.794 9.316 -36.897 179 1HB ARG 26 HB2 ARG 26 -17.938 8.038 -37.788 180 2HB ARG 26 HB1 ARG 26 -17.898 9.296 -39.017 181 1HG ARG 26 HG2 ARG 26 -16.491 7.988 -40.126 182 2HG ARG 26 HG1 ARG 26 -15.285 8.416 -38.910 183 1HD ARG 26 HD2 ARG 26 -15.167 6.252 -38.408 184 2HD ARG 26 HD1 ARG 26 -16.784 6.403 -37.721 185 HE ARG 26 HE ARG 26 -16.859 5.956 -40.536 186 1HH1 ARG 26 HH11 ARG 26 -16.450 4.372 -37.460 187 2HH1 ARG 26 HH12 ARG 26 -17.014 2.837 -38.031 188 1HH2 ARG 26 HH21 ARG 26 -17.601 3.940 -41.296 189 2HH2 ARG 26 HH22 ARG 26 -17.668 2.591 -40.211 190 H ASN 27 HN ASN 27 -18.296 11.671 -37.603 191 HA ASN 27 HA ASN 27 -16.691 13.121 -39.504 192 1HB ASN 27 HB2 ASN 27 -19.068 14.371 -38.205 193 2HB ASN 27 HB1 ASN 27 -18.566 14.399 -39.893 194 1HD2 ASN 27 HD21 ASN 27 -20.747 13.155 -37.737 195 2HD2 ASN 27 HD22 ASN 27 -21.337 11.828 -38.674 196 HA PRO 28 HA PRO 28 -16.703 15.362 -40.170 197 1HB PRO 28 HB1 PRO 28 -14.208 16.847 -40.185 198 2HB PRO 28 HB2 PRO 28 -15.850 17.439 -40.448 199 1HG PRO 28 HG2 PRO 28 -14.373 18.071 -38.250 200 2HG PRO 28 HG1 PRO 28 -16.144 17.988 -38.242 201 1HD PRO 28 HD2 PRO 28 -14.148 15.966 -37.289 202 2HD PRO 28 HD1 PRO 28 -15.675 16.480 -36.539 203 H GLN 29 HN GLN 29 -13.214 15.486 -39.595 204 HA GLN 29 HA GLN 29 -12.866 13.314 -41.518 205 1HB GLN 29 HB1 GLN 29 -10.887 15.258 -40.315 206 2HB GLN 29 HB2 GLN 29 -10.463 13.997 -41.465 207 1HG GLN 29 HG2 GLN 29 -11.753 15.018 -43.182 208 2HG GLN 29 HG1 GLN 29 -12.465 16.163 -42.045 209 1HE2 GLN 29 HE21 GLN 29 -9.110 15.127 -42.476 210 2HE2 GLN 29 HE22 GLN 29 -8.482 16.701 -42.811 211 H GLN 30 HN GLN 30 -10.267 13.762 -39.344 212 HA GLN 30 HA GLN 30 -10.829 11.147 -38.145 213 1HB GLN 30 HB1 GLN 30 -8.370 12.626 -38.871 214 2HB GLN 30 HB2 GLN 30 -8.287 11.679 -37.391 215 1HG GLN 30 HG1 GLN 30 -9.021 10.649 -40.123 216 2HG GLN 30 HG2 GLN 30 -7.489 10.400 -39.287 217 1HE2 GLN 30 HE21 GLN 30 -10.742 9.388 -39.636 218 2HE2 GLN 30 HE22 GLN 30 -10.690 8.074 -38.516 219 H HIS 31 HN HIS 31 -10.222 10.829 -35.865 220 HA HIS 31 HA HIS 31 -11.205 13.042 -34.262 221 1HB HIS 31 HB2 HIS 31 -11.502 10.296 -34.102 222 2HB HIS 31 HB1 HIS 31 -10.361 10.650 -32.809 223 HD2 HIS 31 HD2 HIS 31 -14.083 10.764 -33.509 224 HE1 HIS 31 HE1 HIS 31 -13.402 12.994 -29.976 225 HE2 HIS 31 HE2 HIS 31 -15.164 11.928 -31.456 226 H LEU 32 HN LEU 32 -8.334 12.526 -35.496 227 HA LEU 32 HA LEU 32 -6.642 12.633 -33.176 228 1HB LEU 32 HB1 LEU 32 -6.242 12.757 -36.128 229 2HB LEU 32 HB2 LEU 32 -4.964 13.364 -35.091 230 HG LEU 32 HG LEU 32 -5.724 10.826 -34.080 231 1HD1 LEU 32 HD11 LEU 32 -4.854 9.693 -36.355 232 2HD1 LEU 32 HD12 LEU 32 -5.806 11.021 -37.019 233 3HD1 LEU 32 HD13 LEU 32 -6.558 9.853 -35.934 234 1HD2 LEU 32 HD21 LEU 32 -3.295 10.698 -35.545 235 2HD2 LEU 32 HD22 LEU 32 -3.527 10.836 -33.803 236 3HD2 LEU 32 HD23 LEU 32 -3.407 12.289 -34.794 237 H ASN 33 HN ASN 33 -5.548 14.382 -32.343 238 HA ASN 33 HA ASN 33 -6.718 16.982 -32.964 239 1HB ASN 33 HB1 ASN 33 -5.670 15.710 -30.593 240 2HB ASN 33 HB2 ASN 33 -4.874 17.258 -30.857 241 1HD2 ASN 33 HD21 ASN 33 -6.460 16.843 -28.669 242 2HD2 ASN 33 HD22 ASN 33 -7.897 17.794 -28.805 243 H ALA 34 HN ALA 34 -5.641 18.626 -33.891 244 HA ALA 34 HA ALA 34 -2.978 18.083 -34.931 245 1HB ALA 34 HB1 ALA 34 -3.403 20.319 -36.113 246 2HB ALA 34 HB2 ALA 34 -5.056 20.162 -35.520 247 3HB ALA 34 HB3 ALA 34 -4.382 18.933 -36.589 248 H GLN 35 HN GLN 35 -3.407 18.641 -32.069 249 HA GLN 35 HA GLN 35 -2.087 21.234 -31.745 250 1HB GLN 35 HB2 GLN 35 -4.039 20.830 -30.338 251 2HB GLN 35 HB1 GLN 35 -3.309 19.360 -29.709 252 1HG GLN 35 HG1 GLN 35 -2.505 20.578 -28.048 253 2HG GLN 35 HG2 GLN 35 -1.424 21.337 -29.215 254 1HE2 GLN 35 HE21 GLN 35 -1.496 23.203 -27.865 255 2HE2 GLN 35 HE22 GLN 35 -2.832 24.295 -27.954 256 HA PRO 36 HA PRO 36 1.648 18.684 -31.385 257 1HB PRO 36 HB2 PRO 36 3.405 20.671 -31.856 258 2HB PRO 36 HB1 PRO 36 2.492 19.897 -33.156 259 1HG PRO 36 HG1 PRO 36 1.978 22.500 -31.766 260 2HG PRO 36 HG2 PRO 36 1.889 22.120 -33.495 261 1HD PRO 36 HD2 PRO 36 -0.302 22.254 -31.878 262 2HD PRO 36 HD1 PRO 36 -0.214 21.216 -33.315 263 H GLN 37 HN GLN 37 0.639 21.495 -29.644 264 HA GLN 37 HA GLN 37 2.806 21.511 -27.766 265 1HB GLN 37 HB1 GLN 37 0.850 23.306 -28.461 266 2HB GLN 37 HB2 GLN 37 0.276 22.729 -26.902 267 1HG GLN 37 HG2 GLN 37 1.582 24.643 -26.476 268 2HG GLN 37 HG1 GLN 37 2.552 23.256 -25.984 269 1HE2 GLN 37 HE21 GLN 37 4.430 24.524 -26.163 270 2HE2 GLN 37 HE22 GLN 37 5.123 24.890 -27.702 271 H VAL 38 HN VAL 38 2.202 21.395 -25.343 272 HA VAL 38 HA VAL 38 0.853 18.823 -24.931 273 HB VAL 38 HB VAL 38 1.983 19.071 -22.598 274 1HG1 VAL 38 HG21 VAL 38 2.546 17.560 -24.644 275 2HG1 VAL 38 HG22 VAL 38 3.708 17.724 -23.328 276 3HG1 VAL 38 HG23 VAL 38 3.930 18.638 -24.820 277 1HG2 VAL 38 HG11 VAL 38 4.284 20.376 -23.563 278 2HG2 VAL 38 HG12 VAL 38 3.205 20.896 -22.267 279 3HG2 VAL 38 HG13 VAL 38 2.916 21.429 -23.924 280 H THR 39 HN THR 39 -1.286 19.382 -24.749 281 HA THR 39 HA THR 39 -2.017 21.384 -22.733 282 HB THR 39 HB THR 39 -4.036 20.055 -24.491 283 HG1 THR 39 HG1 THR 39 -3.341 20.989 -26.243 284 1HG2 THR 39 HG21 THR 39 -3.733 22.924 -23.650 285 2HG2 THR 39 HG22 THR 39 -4.740 21.730 -22.831 286 3HG2 THR 39 HG23 THR 39 -5.103 22.199 -24.492 287 H MET 40 HN MET 40 -1.508 19.996 -20.949 288 HA MET 40 HA MET 40 -2.955 17.525 -20.611 289 1HB MET 40 HB1 MET 40 -0.609 18.440 -19.610 290 2HB MET 40 HB2 MET 40 -1.681 18.790 -18.261 291 1HG MET 40 HG2 MET 40 -1.911 16.634 -17.716 292 2HG MET 40 HG1 MET 40 -1.999 16.112 -19.397 293 1HE MET 40 HE1 MET 40 1.699 16.559 -16.764 294 2HE MET 40 HE2 MET 40 0.066 17.150 -16.454 295 3HE MET 40 HE3 MET 40 1.142 18.052 -17.521 296 H GLN 41 HN GLN 41 -5.130 17.979 -20.590 297 HA GLN 41 HA GLN 41 -6.167 19.994 -18.773 298 1HB GLN 41 HB1 GLN 41 -7.013 19.033 -21.214 299 2HB GLN 41 HB2 GLN 41 -8.113 18.246 -20.090 300 1HG GLN 41 HG1 GLN 41 -9.242 20.123 -19.729 301 2HG GLN 41 HG2 GLN 41 -7.768 21.061 -19.494 302 1HE2 GLN 41 HE21 GLN 41 -6.602 21.687 -21.475 303 2HE2 GLN 41 HE22 GLN 41 -7.532 22.100 -22.871 304 H GLN 42 HN GLN 42 -6.977 19.609 -16.814 305 HA GLN 42 HA GLN 42 -8.043 17.023 -16.097 306 1HB GLN 42 HB1 GLN 42 -5.388 17.249 -15.706 307 2HB GLN 42 HB2 GLN 42 -5.962 17.949 -14.199 308 1HG GLN 42 HG2 GLN 42 -7.479 15.770 -14.217 309 2HG GLN 42 HG1 GLN 42 -6.138 15.168 -15.191 310 1HE2 GLN 42 HE21 GLN 42 -7.157 16.237 -12.064 311 2HE2 GLN 42 HE22 GLN 42 -5.740 15.750 -11.205 312 HA PRO 43 HA PRO 43 -10.425 20.394 -14.141 313 1HB PRO 43 HB1 PRO 43 -12.303 18.138 -13.745 314 2HB PRO 43 HB2 PRO 43 -12.587 19.730 -14.457 315 1HG PRO 43 HG1 PRO 43 -12.468 17.539 -15.981 316 2HG PRO 43 HG2 PRO 43 -11.800 19.084 -16.538 317 1HD PRO 43 HD2 PRO 43 -10.380 16.688 -15.443 318 2HD PRO 43 HD1 PRO 43 -9.918 17.756 -16.785 319 H ALA 44 HN ALA 44 -9.086 20.579 -12.320 320 HA ALA 44 HA ALA 44 -9.276 18.580 -10.215 321 1HB ALA 44 HB1 ALA 44 -7.804 20.637 -9.169 322 2HB ALA 44 HB2 ALA 44 -7.450 20.756 -10.892 323 3HB ALA 44 HB3 ALA 44 -7.149 19.246 -10.033 324 H VAL 45 HN VAL 45 -11.729 19.354 -10.407 325 HA VAL 45 HA VAL 45 -12.332 21.723 -8.878 326 HB VAL 45 HB VAL 45 -14.257 19.555 -9.709 327 1HG1 VAL 45 HG21 VAL 45 -14.551 21.913 -8.190 328 2HG1 VAL 45 HG22 VAL 45 -15.813 20.828 -8.771 329 3HG1 VAL 45 HG23 VAL 45 -15.314 22.206 -9.752 330 1HG2 VAL 45 HG11 VAL 45 -14.724 21.064 -11.665 331 2HG2 VAL 45 HG12 VAL 45 -13.172 20.228 -11.713 332 3HG2 VAL 45 HG13 VAL 45 -13.242 21.930 -11.256 333 H HIS 46 HN HIS 46 -12.985 18.242 -8.421 334 HA HIS 46 HA HIS 46 -13.428 18.744 -5.571 335 1HB HIS 46 HB1 HIS 46 -13.759 15.980 -6.425 336 2HB HIS 46 HB2 HIS 46 -14.905 17.052 -5.628 337 HD2 HIS 46 HD2 HIS 46 -16.554 18.553 -7.359 338 HE1 HIS 46 HE1 HIS 46 -15.611 16.188 -10.740 339 HE2 HIS 46 HE2 HIS 46 -17.171 17.957 -9.808 340 H VAL 47 HN VAL 47 -12.622 16.927 -4.094 341 HA VAL 47 HA VAL 47 -9.757 16.683 -4.516 342 HB VAL 47 HB VAL 47 -11.350 15.760 -2.124 343 1HG1 VAL 47 HG21 VAL 47 -9.321 15.648 -0.971 344 2HG1 VAL 47 HG22 VAL 47 -8.476 16.617 -2.180 345 3HG1 VAL 47 HG23 VAL 47 -8.950 14.960 -2.553 346 1HG2 VAL 47 HG11 VAL 47 -10.925 17.868 -1.080 347 2HG2 VAL 47 HG12 VAL 47 -11.688 18.182 -2.639 348 3HG2 VAL 47 HG13 VAL 47 -9.949 18.408 -2.447 349 H GLN 48 HN GLN 48 -9.225 15.044 -5.850 350 HA GLN 48 HA GLN 48 -10.630 12.499 -5.657 351 1HB GLN 48 HB1 GLN 48 -9.479 13.909 -7.768 352 2HB GLN 48 HB2 GLN 48 -8.390 12.555 -7.506 353 1HG GLN 48 HG1 GLN 48 -9.980 11.888 -9.128 354 2HG GLN 48 HG2 GLN 48 -10.368 11.040 -7.631 355 1HE2 GLN 48 HE21 GLN 48 -11.067 14.356 -8.641 356 2HE2 GLN 48 HE22 GLN 48 -12.786 14.217 -8.520 357 H GLY 49 HN GLY 49 -7.196 12.874 -6.374 358 1HA GLY 49 HA2 GLY 49 -6.625 10.806 -4.382 359 2HA GLY 49 HA1 GLY 49 -5.556 11.319 -5.679 360 H GLN 50 HN GLN 50 -5.898 11.313 -2.441 361 HA GLN 50 HA GLN 50 -4.738 13.955 -1.989 362 1HB GLN 50 HB1 GLN 50 -4.879 13.188 0.458 363 2HB GLN 50 HB2 GLN 50 -6.388 13.504 -0.386 364 1HG GLN 50 HG2 GLN 50 -5.758 10.784 -0.798 365 2HG GLN 50 HG1 GLN 50 -5.525 11.126 0.916 366 1HE2 GLN 50 HE21 GLN 50 -7.827 11.688 -1.716 367 2HE2 GLN 50 HE22 GLN 50 -9.246 11.515 -0.746 368 H GLU 51 HN GLU 51 -2.939 13.946 -0.243 369 HA GLU 51 HA GLU 51 -0.815 12.242 -1.275 370 1HB GLU 51 HB1 GLU 51 0.592 13.752 0.285 371 2HB GLU 51 HB2 GLU 51 -0.092 14.455 -1.175 372 1HG GLU 51 HG2 GLU 51 -1.694 15.653 0.000 373 2HG GLU 51 HG1 GLU 51 -1.552 14.630 1.428 374 HA PRO 52 HA PRO 52 -1.463 9.757 2.451 375 1HB PRO 52 HB2 PRO 52 -0.395 7.485 1.514 376 2HB PRO 52 HB1 PRO 52 -1.995 8.033 1.000 377 1HG PRO 52 HG1 PRO 52 0.632 8.243 -0.417 378 2HG PRO 52 HG2 PRO 52 -0.964 7.837 -1.073 379 1HD PRO 52 HD2 PRO 52 0.199 10.331 -1.233 380 2HD PRO 52 HD1 PRO 52 -1.547 10.031 -1.317 381 H LEU 53 HN LEU 53 0.052 8.431 3.815 382 HA LEU 53 HA LEU 53 2.665 9.748 3.881 383 1HB LEU 53 HB2 LEU 53 0.865 9.317 5.863 384 2HB LEU 53 HB1 LEU 53 1.901 7.914 6.062 385 HG LEU 53 HG LEU 53 3.631 10.123 5.795 386 1HD1 LEU 53 HD21 LEU 53 2.644 11.902 6.667 387 2HD1 LEU 53 HD22 LEU 53 2.252 10.990 8.124 388 3HD1 LEU 53 HD23 LEU 53 1.128 11.008 6.766 389 1HD2 LEU 53 HD11 LEU 53 4.263 9.577 8.063 390 2HD2 LEU 53 HD12 LEU 53 3.982 8.098 7.145 391 3HD2 LEU 53 HD13 LEU 53 2.767 8.669 8.290 392 H THR 54 HN THR 54 4.594 8.595 4.095 393 HA THR 54 HA THR 54 4.735 5.770 4.124 394 HB THR 54 HB THR 54 5.975 6.192 1.644 395 HG1 THR 54 HG1 THR 54 3.552 6.815 0.832 396 1HG2 THR 54 HG21 THR 54 4.087 4.809 0.754 397 2HG2 THR 54 HG22 THR 54 3.387 4.865 2.372 398 3HG2 THR 54 HG23 THR 54 4.964 4.116 2.117 399 H ALA 55 HN ALA 55 7.176 5.423 2.795 400 HA ALA 55 HA ALA 55 8.984 6.218 4.745 401 1HB ALA 55 HB1 ALA 55 10.685 5.306 3.388 402 2HB ALA 55 HB2 ALA 55 9.752 5.568 1.914 403 3HB ALA 55 HB3 ALA 55 9.235 4.350 3.082 404 H SER 56 HN SER 56 8.217 7.722 1.634 405 HA SER 56 HA SER 56 10.262 9.634 1.589 406 1HB SER 56 HB1 SER 56 7.457 9.717 0.458 407 2HB SER 56 HB2 SER 56 8.680 10.944 0.128 408 HG SER 56 HG SER 56 8.537 9.227 -1.458 409 H MET 57 HN MET 57 6.999 9.775 2.968 410 HA MET 57 HA MET 57 7.100 12.430 3.889 411 1HB MET 57 HB1 MET 57 5.531 9.998 4.702 412 2HB MET 57 HB2 MET 57 5.402 11.488 5.625 413 1HG MET 57 HG1 MET 57 3.816 10.844 3.553 414 2HG MET 57 HG2 MET 57 4.148 12.496 4.067 415 1HE MET 57 HE1 MET 57 5.681 10.353 0.332 416 2HE MET 57 HE2 MET 57 4.042 10.223 0.970 417 3HE MET 57 HE3 MET 57 5.403 9.589 1.897 418 H LEU 58 HN LEU 58 8.026 9.369 5.370 419 HA LEU 58 HA LEU 58 8.665 10.278 7.936 420 1HB LEU 58 HB1 LEU 58 9.670 8.011 6.238 421 2HB LEU 58 HB2 LEU 58 10.334 8.297 7.832 422 HG LEU 58 HG LEU 58 8.651 7.205 8.800 423 1HD1 LEU 58 HD11 LEU 58 7.263 9.215 8.690 424 2HD1 LEU 58 HD12 LEU 58 6.298 7.751 8.493 425 3HD1 LEU 58 HD13 LEU 58 6.699 8.738 7.088 426 1HD2 LEU 58 HD21 LEU 58 7.636 5.560 7.557 427 2HD2 LEU 58 HD22 LEU 58 8.977 6.017 6.504 428 3HD2 LEU 58 HD23 LEU 58 7.351 6.624 6.180 429 H ALA 59 HN ALA 59 10.676 9.958 5.042 430 HA ALA 59 HA ALA 59 13.063 10.923 6.217 431 1HB ALA 59 HB1 ALA 59 12.146 10.567 3.385 432 2HB ALA 59 HB2 ALA 59 13.351 9.647 4.287 433 3HB ALA 59 HB3 ALA 59 13.709 11.293 3.762 434 H SER 60 HN SER 60 10.225 12.517 5.404 435 HA SER 60 HA SER 60 11.427 15.029 4.633 436 1HB SER 60 HB1 SER 60 9.239 14.381 3.719 437 2HB SER 60 HB2 SER 60 8.560 14.364 5.347 438 HG SER 60 HG SER 60 9.277 16.522 3.734 439 H ALA 61 HN ALA 61 11.018 13.431 7.522 440 HA ALA 61 HA ALA 61 11.272 15.953 9.011 441 1HB ALA 61 HB1 ALA 61 9.877 13.810 10.450 442 2HB ALA 61 HB2 ALA 61 8.985 14.500 9.094 443 3HB ALA 61 HB3 ALA 61 9.554 15.543 10.398 444 HA PRO 62 HA PRO 62 14.579 12.600 9.870 445 1HB PRO 62 HB1 PRO 62 16.293 14.985 9.401 446 2HB PRO 62 HB2 PRO 62 16.537 13.305 8.911 447 1HG PRO 62 HG1 PRO 62 15.773 15.141 7.137 448 2HG PRO 62 HG2 PRO 62 15.115 13.494 7.087 449 1HD PRO 62 HD1 PRO 62 13.850 16.014 8.078 450 2HD PRO 62 HD2 PRO 62 13.121 14.655 7.199 451 HA PRO 63 HA PRO 63 15.825 15.380 13.503 452 1HB PRO 63 HB2 PRO 63 15.442 18.013 13.532 453 2HB PRO 63 HB1 PRO 63 16.735 17.301 12.558 454 1HG PRO 63 HG1 PRO 63 14.051 18.307 11.708 455 2HG PRO 63 HG2 PRO 63 15.618 18.477 10.899 456 1HD PRO 63 HD1 PRO 63 13.679 16.580 10.275 457 2HD PRO 63 HD2 PRO 63 15.394 16.481 9.830 458 H GLN 64 HN GLN 64 12.718 15.617 12.164 459 HA GLN 64 HA GLN 64 11.490 16.547 14.646 460 1HB GLN 64 HB1 GLN 64 10.731 17.445 12.443 461 2HB GLN 64 HB2 GLN 64 10.165 15.833 12.024 462 1HG GLN 64 HG1 GLN 64 8.245 16.879 12.755 463 2HG GLN 64 HG2 GLN 64 8.778 15.999 14.188 464 1HE2 GLN 64 HE22 GLN 64 7.637 18.878 13.111 465 2HE2 GLN 64 HE21 GLN 64 8.188 19.906 14.385 466 H GLU 65 HN GLU 65 10.191 14.119 12.429 467 HA GLU 65 HA GLU 65 9.806 12.345 14.739 468 1HB GLU 65 HB1 GLU 65 8.422 11.766 12.185 469 2HB GLU 65 HB2 GLU 65 7.831 11.653 13.837 470 1HG GLU 65 HG2 GLU 65 8.298 14.394 13.200 471 2HG GLU 65 HG1 GLU 65 7.317 13.659 11.932 472 H GLN 66 HN GLN 66 9.700 11.390 11.367 473 HA GLN 66 HA GLN 66 10.933 9.953 10.107 474 1HB GLN 66 HB2 GLN 66 12.881 11.057 11.861 475 2HB GLN 66 HB1 GLN 66 13.169 9.325 11.763 476 1HG GLN 66 HG1 GLN 66 12.986 9.660 9.217 477 2HG GLN 66 HG2 GLN 66 13.222 11.369 9.582 478 1HE2 GLN 66 HE22 GLN 66 15.001 9.978 8.019 479 2HE2 GLN 66 HE21 GLN 66 16.501 9.815 8.861 480 H LYS 67 HN LYS 67 11.556 9.068 13.501 481 HA LYS 67 HA LYS 67 10.467 6.404 12.907 482 1HB LYS 67 HB2 LYS 67 11.766 5.722 14.987 483 2HB LYS 67 HB1 LYS 67 12.710 6.129 13.563 484 1HG LYS 67 HG2 LYS 67 12.999 8.427 14.535 485 2HG LYS 67 HG1 LYS 67 12.278 7.803 16.019 486 1HD LYS 67 HD2 LYS 67 14.181 6.810 16.629 487 2HD LYS 67 HD1 LYS 67 14.386 6.074 15.037 488 1HE LYS 67 HE2 LYS 67 14.904 8.827 14.737 489 2HE LYS 67 HE1 LYS 67 15.761 8.304 16.187 490 1HZ LYS 67 HZ1 LYS 67 15.967 6.619 13.808 491 2HZ LYS 67 HZ2 LYS 67 17.114 6.938 15.010 492 3HZ LYS 67 HZ3 LYS 67 16.814 8.083 13.801 493 H GLN 68 HN GLN 68 9.057 8.926 13.733 494 HA GLN 68 HA GLN 68 7.834 7.887 16.204 495 1HB GLN 68 HB1 GLN 68 7.855 10.762 15.278 496 2HB GLN 68 HB2 GLN 68 7.268 10.153 16.818 497 1HG GLN 68 HG2 GLN 68 9.926 9.292 16.610 498 2HG GLN 68 HG1 GLN 68 9.906 10.972 16.074 499 1HE2 GLN 68 HE22 GLN 68 9.789 8.858 18.723 500 2HE2 GLN 68 HE21 GLN 68 9.540 10.037 19.961 501 H MET 69 HN MET 69 7.080 9.858 13.324 502 HA MET 69 HA MET 69 4.268 9.345 13.601 503 1HB MET 69 HB2 MET 69 4.008 10.727 11.626 504 2HB MET 69 HB1 MET 69 5.117 11.494 12.754 505 1HG MET 69 HG2 MET 69 6.943 11.160 11.405 506 2HG MET 69 HG1 MET 69 6.211 9.790 10.571 507 1HE MET 69 HE1 MET 69 7.466 11.424 8.363 508 2HE MET 69 HE2 MET 69 7.787 12.549 9.683 509 3HE MET 69 HE3 MET 69 6.963 13.110 8.228 510 H LEU 70 HN LEU 70 6.597 7.322 12.597 511 HA LEU 70 HA LEU 70 5.625 6.386 10.111 512 1HB LEU 70 HB1 LEU 70 6.739 4.146 11.254 513 2HB LEU 70 HB2 LEU 70 7.569 5.317 10.262 514 HG LEU 70 HG LEU 70 8.486 6.430 12.171 515 1HD1 LEU 70 HD21 LEU 70 7.232 6.546 14.010 516 2HD1 LEU 70 HD22 LEU 70 7.867 4.949 14.404 517 3HD1 LEU 70 HD23 LEU 70 6.316 5.102 13.580 518 1HD2 LEU 70 HD11 LEU 70 8.752 3.528 11.849 519 2HD2 LEU 70 HD12 LEU 70 9.336 4.162 13.388 520 3HD2 LEU 70 HD13 LEU 70 9.987 4.788 11.873 521 H GLY 71 HN GLY 71 4.924 5.434 13.452 522 1HA GLY 71 HA2 GLY 71 2.586 3.989 12.402 523 2HA GLY 71 HA1 GLY 71 3.600 3.253 13.625 524 H GLU 72 HN GLU 72 2.732 6.663 13.514 525 HA GLU 72 HA GLU 72 0.771 6.301 15.645 526 1HB GLU 72 HB2 GLU 72 1.942 7.301 17.300 527 2HB GLU 72 HB1 GLU 72 3.332 6.801 16.348 528 1HG GLU 72 HG1 GLU 72 3.653 8.945 15.470 529 2HG GLU 72 HG2 GLU 72 2.049 9.481 15.969 530 H ARG 73 HN ARG 73 1.645 7.707 12.818 531 HA ARG 73 HA ARG 73 -0.297 9.882 13.164 532 1HB ARG 73 HB1 ARG 73 2.316 10.416 12.893 533 2HB ARG 73 HB2 ARG 73 1.898 10.247 11.194 534 1HG ARG 73 HG1 ARG 73 0.073 11.935 12.755 535 2HG ARG 73 HG2 ARG 73 1.721 12.549 12.601 536 1HD ARG 73 HD2 ARG 73 1.498 12.104 10.113 537 2HD ARG 73 HD1 ARG 73 -0.225 11.871 10.412 538 HE ARG 73 HE ARG 73 1.199 14.360 10.349 539 1HH1 ARG 73 HH22 ARG 73 -1.595 12.707 11.615 540 2HH1 ARG 73 HH21 ARG 73 -2.515 14.159 11.833 541 1HH2 ARG 73 HH12 ARG 73 -0.004 16.276 10.632 542 2HH2 ARG 73 HH11 ARG 73 -1.610 16.186 11.274 543 H LEU 74 HN LEU 74 0.948 7.254 11.354 544 HA LEU 74 HA LEU 74 -0.467 7.807 8.909 545 1HB LEU 74 HB1 LEU 74 1.317 5.739 9.952 546 2HB LEU 74 HB2 LEU 74 0.023 5.088 8.965 547 HG LEU 74 HG LEU 74 1.475 7.398 7.845 548 1HD1 LEU 74 HD11 LEU 74 3.465 6.341 7.402 549 2HD1 LEU 74 HD12 LEU 74 2.785 4.731 7.635 550 3HD1 LEU 74 HD13 LEU 74 3.118 5.757 9.030 551 1HD2 LEU 74 HD21 LEU 74 0.996 6.381 5.814 552 2HD2 LEU 74 HD22 LEU 74 -0.400 5.961 6.807 553 3HD2 LEU 74 HD23 LEU 74 0.879 4.776 6.535 554 H PHE 75 HN PHE 75 -1.211 6.511 11.953 555 HA PHE 75 HA PHE 75 -3.051 4.561 11.587 556 1HB PHE 75 HB1 PHE 75 -2.221 5.949 13.712 557 2HB PHE 75 HB2 PHE 75 -3.801 6.692 13.525 558 HD1 PHE 75 HD1 PHE 75 -3.214 3.185 12.634 559 HD2 PHE 75 HD2 PHE 75 -4.583 5.864 15.644 560 HE1 PHE 75 HE1 PHE 75 -4.207 1.296 13.858 561 HE2 PHE 75 HE2 PHE 75 -5.580 3.980 16.872 562 HZ PHE 75 HZ PHE 75 -5.394 1.693 15.979 563 HA PRO 76 HA PRO 76 -6.677 7.626 10.767 564 1HB PRO 76 HB1 PRO 76 -6.120 10.219 10.239 565 2HB PRO 76 HB2 PRO 76 -6.368 9.619 11.882 566 1HG PRO 76 HG1 PRO 76 -3.804 10.157 10.429 567 2HG PRO 76 HG2 PRO 76 -4.251 10.568 12.096 568 1HD PRO 76 HD1 PRO 76 -2.717 8.420 11.481 569 2HD PRO 76 HD2 PRO 76 -3.825 8.440 12.869 570 H LEU 77 HN LEU 77 -3.732 7.500 9.089 571 HA LEU 77 HA LEU 77 -4.922 8.324 6.557 572 1HB LEU 77 HB1 LEU 77 -2.086 7.658 7.329 573 2HB LEU 77 HB2 LEU 77 -2.583 8.030 5.688 574 HG LEU 77 HG LEU 77 -2.750 9.888 8.065 575 1HD1 LEU 77 HD11 LEU 77 -1.085 10.160 5.577 576 2HD1 LEU 77 HD12 LEU 77 -0.482 9.443 7.072 577 3HD1 LEU 77 HD13 LEU 77 -1.008 11.126 7.051 578 1HD2 LEU 77 HD21 LEU 77 -3.831 10.055 5.295 579 2HD2 LEU 77 HD22 LEU 77 -3.236 11.521 6.076 580 3HD2 LEU 77 HD23 LEU 77 -4.539 10.591 6.819 581 H ILE 78 HN ILE 78 -4.025 5.450 8.284 582 HA ILE 78 HA ILE 78 -3.852 3.719 6.008 583 HB ILE 78 HB ILE 78 -4.654 2.884 8.779 584 1HG1 ILE 78 HG12 ILE 78 -2.514 4.245 8.718 585 2HG1 ILE 78 HG11 ILE 78 -2.362 2.620 9.375 586 1HG2 ILE 78 HG21 ILE 78 -3.017 0.996 7.459 587 2HG2 ILE 78 HG22 ILE 78 -4.266 1.506 6.320 588 3HG2 ILE 78 HG23 ILE 78 -4.719 0.855 7.896 589 1HD1 ILE 78 HD11 ILE 78 -0.791 2.144 7.907 590 2HD1 ILE 78 HD12 ILE 78 -0.880 3.801 7.307 591 3HD1 ILE 78 HD13 ILE 78 -1.870 2.541 6.571 592 H GLN 79 HN GLN 79 -6.360 4.831 8.186 593 HA GLN 79 HA GLN 79 -8.486 3.171 7.520 594 1HB GLN 79 HB1 GLN 79 -8.159 5.937 8.525 595 2HB GLN 79 HB2 GLN 79 -9.703 5.604 7.760 596 1HG GLN 79 HG1 GLN 79 -10.285 4.011 9.351 597 2HG GLN 79 HG2 GLN 79 -8.616 3.789 9.875 598 1HE2 GLN 79 HE22 GLN 79 -11.533 5.262 10.546 599 2HE2 GLN 79 HE21 GLN 79 -10.993 6.395 11.733 600 H ALA 80 HN ALA 80 -6.770 5.311 5.570 601 HA ALA 80 HA ALA 80 -8.852 5.852 3.639 602 1HB ALA 80 HB1 ALA 80 -5.930 6.245 3.122 603 2HB ALA 80 HB2 ALA 80 -6.799 7.323 4.217 604 3HB ALA 80 HB3 ALA 80 -7.306 7.183 2.534 605 H MET 81 HN MET 81 -5.994 3.787 3.933 606 HA MET 81 HA MET 81 -6.225 2.638 1.314 607 1HB MET 81 HB1 MET 81 -4.873 1.235 3.596 608 2HB MET 81 HB2 MET 81 -4.403 1.292 1.906 609 1HG MET 81 HG2 MET 81 -3.179 3.143 2.185 610 2HG MET 81 HG1 MET 81 -4.334 3.877 3.291 611 1HE MET 81 HE1 MET 81 -0.922 1.140 3.772 612 2HE MET 81 HE2 MET 81 -0.417 2.829 3.917 613 3HE MET 81 HE3 MET 81 -1.341 2.299 2.508 614 H HIS 82 HN HIS 82 -7.425 1.938 4.485 615 HA HIS 82 HA HIS 82 -8.772 -0.478 3.495 616 1HB HIS 82 HB1 HIS 82 -7.863 0.147 6.308 617 2HB HIS 82 HB2 HIS 82 -8.436 -1.395 5.709 618 HD2 HIS 82 HD2 HIS 82 -6.504 -1.513 3.037 619 HE1 HIS 82 HE1 HIS 82 -3.425 -1.231 5.903 620 HE2 HIS 82 HE2 HIS 82 -3.979 -1.843 3.506 621 HA PRO 83 HA PRO 83 -12.654 1.230 4.867 622 1HB PRO 83 HB1 PRO 83 -13.467 -1.387 5.895 623 2HB PRO 83 HB2 PRO 83 -14.118 -0.477 4.530 624 1HG PRO 83 HG1 PRO 83 -12.692 -2.748 4.205 625 2HG PRO 83 HG2 PRO 83 -12.651 -1.421 3.031 626 1HD PRO 83 HD2 PRO 83 -10.663 -2.132 5.157 627 2HD PRO 83 HD1 PRO 83 -10.382 -1.602 3.485 628 H THR 84 HN THR 84 -11.242 2.251 6.577 629 HA THR 84 HA THR 84 -10.602 2.705 8.704 630 HB THR 84 HB THR 84 -13.065 3.263 8.637 631 HG1 THR 84 HG1 THR 84 -13.124 3.626 10.842 632 1HG2 THR 84 HG21 THR 84 -14.410 1.460 8.712 633 2HG2 THR 84 HG22 THR 84 -14.276 1.745 10.447 634 3HG2 THR 84 HG23 THR 84 -13.279 0.512 9.676 635 H LEU 85 HN LEU 85 -9.885 0.081 7.820 636 HA LEU 85 HA LEU 85 -10.295 -1.717 10.044 637 1HB LEU 85 HB1 LEU 85 -9.389 -1.904 7.319 638 2HB LEU 85 HB2 LEU 85 -8.246 -2.698 8.385 639 HG LEU 85 HG LEU 85 -11.026 -3.403 8.958 640 1HD1 LEU 85 HD21 LEU 85 -10.415 -3.160 6.256 641 2HD1 LEU 85 HD22 LEU 85 -11.753 -4.062 6.966 642 3HD1 LEU 85 HD23 LEU 85 -10.231 -4.878 6.609 643 1HD2 LEU 85 HD11 LEU 85 -8.595 -4.428 9.525 644 2HD2 LEU 85 HD12 LEU 85 -9.050 -5.423 8.141 645 3HD2 LEU 85 HD13 LEU 85 -10.092 -5.358 9.562 646 H ALA 86 HN ALA 86 -8.439 0.910 9.737 647 HA ALA 86 HA ALA 86 -5.907 -0.062 10.691 648 1HB ALA 86 HB1 ALA 86 -6.758 2.792 10.948 649 2HB ALA 86 HB2 ALA 86 -6.457 2.108 9.350 650 3HB ALA 86 HB3 ALA 86 -5.175 2.118 10.561 651 H GLY 87 HN GLY 87 -7.314 -1.270 12.420 652 1HA GLY 87 HA2 GLY 87 -7.777 0.408 14.780 653 2HA GLY 87 HA1 GLY 87 -8.238 -1.283 14.607 654 H LYS 88 HN LYS 88 -5.366 -1.342 13.304 655 HA LYS 88 HA LYS 88 -3.494 -0.974 15.353 656 1HB LYS 88 HB1 LYS 88 -4.781 -2.832 16.408 657 2HB LYS 88 HB2 LYS 88 -4.391 -3.847 15.029 658 1HG LYS 88 HG1 LYS 88 -1.918 -3.112 15.720 659 2HG LYS 88 HG2 LYS 88 -2.705 -3.003 17.300 660 1HD LYS 88 HD1 LYS 88 -2.293 -5.202 17.446 661 2HD LYS 88 HD2 LYS 88 -3.657 -5.383 16.339 662 1HE LYS 88 HE2 LYS 88 -2.144 -5.364 14.438 663 2HE LYS 88 HE1 LYS 88 -0.770 -5.107 15.511 664 1HZ LYS 88 HZ1 LYS 88 -0.907 -7.414 14.910 665 2HZ LYS 88 HZ2 LYS 88 -2.513 -7.509 15.432 666 3HZ LYS 88 HZ3 LYS 88 -1.273 -7.257 16.555 667 H ILE 89 HN ILE 89 -3.838 -0.680 12.433 668 HA ILE 89 HA ILE 89 -2.087 -2.645 11.281 669 HB ILE 89 HB ILE 89 -3.168 -0.122 10.055 670 1HG1 ILE 89 HG11 ILE 89 -3.972 -2.984 9.508 671 2HG1 ILE 89 HG12 ILE 89 -4.759 -2.027 10.757 672 1HG2 ILE 89 HG21 ILE 89 -1.093 -1.928 9.245 673 2HG2 ILE 89 HG22 ILE 89 -1.676 -0.468 8.441 674 3HG2 ILE 89 HG23 ILE 89 -2.445 -2.021 8.111 675 1HD1 ILE 89 HD11 ILE 89 -5.468 -0.413 9.087 676 2HD1 ILE 89 HD12 ILE 89 -6.034 -2.036 8.691 677 3HD1 ILE 89 HD13 ILE 89 -4.656 -1.349 7.834 678 H THR 90 HN THR 90 -1.657 0.762 10.587 679 HA THR 90 HA THR 90 1.098 0.741 10.451 680 HB THR 90 HB THR 90 -1.003 2.686 10.460 681 HG1 THR 90 HG1 THR 90 1.008 2.045 9.011 682 1HG2 THR 90 HG21 THR 90 1.269 3.345 12.221 683 2HG2 THR 90 HG22 THR 90 -0.399 3.924 12.242 684 3HG2 THR 90 HG23 THR 90 0.746 4.575 11.068 685 H GLY 91 HN GLY 91 -0.950 1.408 13.272 686 1HA GLY 91 HA2 GLY 91 1.025 2.230 15.064 687 2HA GLY 91 HA1 GLY 91 -0.453 1.386 15.515 688 H MET 92 HN MET 92 0.141 -0.956 13.913 689 HA MET 92 HA MET 92 1.883 -2.281 15.797 690 1HB MET 92 HB2 MET 92 0.325 -3.828 15.401 691 2HB MET 92 HB1 MET 92 -0.243 -2.996 13.958 692 1HG MET 92 HG1 MET 92 2.278 -4.349 13.543 693 2HG MET 92 HG2 MET 92 0.994 -5.420 14.075 694 1HE MET 92 HE1 MET 92 -0.006 -6.817 11.961 695 2HE MET 92 HE2 MET 92 -1.316 -5.853 11.281 696 3HE MET 92 HE3 MET 92 -1.072 -5.897 13.027 697 H LEU 93 HN LEU 93 2.049 -0.921 12.657 698 HA LEU 93 HA LEU 93 4.144 -2.433 11.541 699 1HB LEU 93 HB2 LEU 93 2.954 0.226 11.093 700 2HB LEU 93 HB1 LEU 93 4.575 -0.004 10.477 701 HG LEU 93 HG LEU 93 2.814 -0.426 8.782 702 1HD1 LEU 93 HD11 LEU 93 4.610 -1.564 8.046 703 2HD1 LEU 93 HD12 LEU 93 3.649 -2.979 8.477 704 3HD1 LEU 93 HD13 LEU 93 4.869 -2.367 9.594 705 1HD2 LEU 93 HD21 LEU 93 1.620 -1.861 10.900 706 2HD2 LEU 93 HD22 LEU 93 1.995 -3.016 9.617 707 3HD2 LEU 93 HD23 LEU 93 1.008 -1.599 9.265 708 H LEU 94 HN LEU 94 4.070 -0.629 14.297 709 HA LEU 94 HA LEU 94 6.937 0.019 14.184 710 1HB LEU 94 HB1 LEU 94 4.604 1.224 15.506 711 2HB LEU 94 HB2 LEU 94 5.996 1.037 16.556 712 HG LEU 94 HG LEU 94 7.336 2.451 15.180 713 1HD1 LEU 94 HD11 LEU 94 6.523 1.569 13.006 714 2HD1 LEU 94 HD12 LEU 94 6.655 3.328 13.049 715 3HD1 LEU 94 HD13 LEU 94 5.074 2.556 13.191 716 1HD2 LEU 94 HD21 LEU 94 5.039 4.157 14.883 717 2HD2 LEU 94 HD22 LEU 94 6.396 4.281 16.002 718 3HD2 LEU 94 HD23 LEU 94 4.993 3.297 16.422 719 H GLU 95 HN GLU 95 5.610 -2.614 14.509 720 HA GLU 95 HA GLU 95 7.184 -3.613 16.666 721 1HB GLU 95 HB2 GLU 95 5.516 -4.294 18.186 722 2HB GLU 95 HB1 GLU 95 5.122 -2.625 17.798 723 1HG GLU 95 HG1 GLU 95 3.304 -3.243 16.461 724 2HG GLU 95 HG2 GLU 95 3.845 -4.918 16.354 725 H ILE 96 HN ILE 96 5.648 -3.972 13.764 726 HA ILE 96 HA ILE 96 4.823 -6.646 13.737 727 HB ILE 96 HB ILE 96 5.114 -6.650 11.340 728 1HG1 ILE 96 HG12 ILE 96 7.311 -5.625 11.193 729 2HG1 ILE 96 HG11 ILE 96 6.169 -4.802 10.140 730 1HG2 ILE 96 HG21 ILE 96 3.149 -5.573 11.793 731 2HG2 ILE 96 HG22 ILE 96 3.996 -4.367 10.821 732 3HG2 ILE 96 HG23 ILE 96 3.949 -4.211 12.578 733 1HD1 ILE 96 HD11 ILE 96 5.970 -2.994 11.725 734 2HD1 ILE 96 HD12 ILE 96 7.656 -3.252 11.273 735 3HD1 ILE 96 HD13 ILE 96 7.062 -3.826 12.832 736 H ASP 97 HN ASP 97 6.351 -7.621 11.504 737 HA ASP 97 HA ASP 97 8.259 -9.227 12.754 738 1HB ASP 97 HB1 ASP 97 6.998 -9.386 10.444 739 2HB ASP 97 HB2 ASP 97 8.432 -8.563 9.833 740 H ASN 98 HN ASN 98 8.430 -5.991 12.177 741 HA ASN 98 HA ASN 98 10.089 -4.486 12.520 742 1HB ASN 98 HB2 ASN 98 11.842 -5.166 13.711 743 2HB ASN 98 HB1 ASN 98 11.289 -6.819 13.486 744 1HD2 ASN 98 HD22 ASN 98 13.559 -4.398 12.542 745 2HD2 ASN 98 HD21 ASN 98 14.581 -5.421 11.596 746 H SER 99 HN SER 99 10.543 -6.991 10.157 747 HA SER 99 HA SER 99 12.325 -5.558 8.469 748 1HB SER 99 HB1 SER 99 10.382 -7.603 7.427 749 2HB SER 99 HB2 SER 99 12.035 -7.268 6.905 750 HG SER 99 HG SER 99 11.128 -8.696 9.148 751 H GLU 100 HN GLU 100 8.921 -5.526 8.998 752 HA GLU 100 HA GLU 100 8.318 -3.999 6.606 753 1HB GLU 100 HB1 GLU 100 6.395 -4.234 8.862 754 2HB GLU 100 HB2 GLU 100 6.106 -4.272 7.132 755 1HG GLU 100 HG1 GLU 100 7.605 -6.526 7.539 756 2HG GLU 100 HG2 GLU 100 6.597 -6.451 8.985 757 H LEU 101 HN LEU 101 9.195 -3.509 9.890 758 HA LEU 101 HA LEU 101 8.342 -0.768 10.064 759 1HB LEU 101 HB1 LEU 101 8.652 -2.207 12.062 760 2HB LEU 101 HB2 LEU 101 10.365 -2.291 11.717 761 HG LEU 101 HG LEU 101 9.448 -0.645 13.535 762 1HD1 LEU 101 HD21 LEU 101 11.418 0.552 13.389 763 2HD1 LEU 101 HD22 LEU 101 11.414 0.546 11.626 764 3HD1 LEU 101 HD23 LEU 101 11.801 -0.930 12.513 765 1HD2 LEU 101 HD11 LEU 101 9.252 1.138 11.122 766 2HD2 LEU 101 HD12 LEU 101 8.880 1.529 12.800 767 3HD2 LEU 101 HD13 LEU 101 7.848 0.414 11.906 768 H LEU 102 HN LEU 102 11.064 -2.531 8.903 769 HA LEU 102 HA LEU 102 12.790 -0.200 8.762 770 1HB LEU 102 HB2 LEU 102 13.077 -3.112 8.434 771 2HB LEU 102 HB1 LEU 102 14.062 -2.156 7.343 772 HG LEU 102 HG LEU 102 14.903 -0.921 9.409 773 1HD1 LEU 102 HD21 LEU 102 14.767 -2.296 11.504 774 2HD1 LEU 102 HD22 LEU 102 13.500 -3.238 10.720 775 3HD1 LEU 102 HD23 LEU 102 13.261 -1.517 11.020 776 1HD2 LEU 102 HD11 LEU 102 15.718 -3.745 9.686 777 2HD2 LEU 102 HD12 LEU 102 16.696 -2.294 9.464 778 3HD2 LEU 102 HD13 LEU 102 15.883 -3.029 8.083 779 H HIS 103 HN HIS 103 11.167 -2.413 6.509 780 HA HIS 103 HA HIS 103 12.124 -1.156 4.173 781 1HB HIS 103 HB1 HIS 103 10.753 -3.471 4.764 782 2HB HIS 103 HB2 HIS 103 9.547 -2.518 3.911 783 HD2 HIS 103 HD2 HIS 103 11.364 -5.225 2.782 784 HE1 HIS 103 HE1 HIS 103 12.473 -2.319 -0.089 785 HE2 HIS 103 HE2 HIS 103 12.399 -4.798 0.441 786 H MET 104 HN MET 104 9.228 -0.660 6.130 787 HA MET 104 HA MET 104 7.787 0.949 4.332 788 1HB MET 104 HB2 MET 104 6.528 1.707 6.251 789 2HB MET 104 HB1 MET 104 6.875 -0.013 6.455 790 1HG MET 104 HG2 MET 104 8.881 0.744 7.806 791 2HG MET 104 HG1 MET 104 8.135 2.338 7.822 792 1HE MET 104 HE1 MET 104 5.368 2.050 7.840 793 2HE MET 104 HE2 MET 104 4.633 1.464 9.334 794 3HE MET 104 HE3 MET 104 4.883 0.359 7.981 795 H LEU 105 HN LEU 105 10.395 1.682 6.564 796 HA LEU 105 HA LEU 105 10.132 4.542 6.195 797 1HB LEU 105 HB1 LEU 105 12.408 3.069 7.508 798 2HB LEU 105 HB2 LEU 105 11.959 4.749 7.723 799 HG LEU 105 HG LEU 105 10.295 2.397 8.626 800 1HD1 LEU 105 HD11 LEU 105 11.821 2.258 10.257 801 2HD1 LEU 105 HD12 LEU 105 11.087 3.742 10.864 802 3HD1 LEU 105 HD13 LEU 105 12.531 3.822 9.856 803 1HD2 LEU 105 HD21 LEU 105 9.131 4.186 9.942 804 2HD2 LEU 105 HD22 LEU 105 8.882 4.256 8.197 805 3HD2 LEU 105 HD23 LEU 105 10.007 5.371 8.972 806 H GLU 106 HN GLU 106 11.617 1.966 4.593 807 HA GLU 106 HA GLU 106 13.617 3.733 3.394 808 1HB GLU 106 HB1 GLU 106 14.987 1.926 3.126 809 2HB GLU 106 HB2 GLU 106 14.026 1.318 4.468 810 1HG GLU 106 HG1 GLU 106 13.565 -0.457 3.241 811 2HG GLU 106 HG2 GLU 106 12.614 0.583 2.183 812 H SER 107 HN SER 107 10.586 2.406 2.731 813 HA SER 107 HA SER 107 10.956 3.040 -0.116 814 1HB SER 107 HB2 SER 107 11.006 0.479 0.546 815 2HB SER 107 HB1 SER 107 9.255 0.681 0.567 816 HG SER 107 HG SER 107 10.973 0.576 -1.551 817 HA PRO 108 HA PRO 108 7.163 5.256 0.612 818 1HB PRO 108 HB2 PRO 108 7.013 5.656 -2.269 819 2HB PRO 108 HB1 PRO 108 7.336 6.839 -1.000 820 1HG PRO 108 HG2 PRO 108 9.220 6.043 -2.783 821 2HG PRO 108 HG1 PRO 108 9.609 6.557 -1.131 822 1HD PRO 108 HD1 PRO 108 9.380 3.787 -2.250 823 2HD PRO 108 HD2 PRO 108 10.580 4.449 -1.120 824 H GLU 109 HN GLU 109 7.461 2.291 -0.626 825 HA GLU 109 HA GLU 109 4.587 2.057 -1.236 826 1HB GLU 109 HB1 GLU 109 5.325 1.556 -3.328 827 2HB GLU 109 HB2 GLU 109 6.948 1.181 -2.777 828 1HG GLU 109 HG2 GLU 109 6.280 -1.019 -2.115 829 2HG GLU 109 HG1 GLU 109 4.589 -0.655 -2.460 830 H SER 110 HN SER 110 7.435 0.788 0.310 831 HA SER 110 HA SER 110 6.400 -1.718 1.059 832 1HB SER 110 HB1 SER 110 8.722 -0.095 1.740 833 2HB SER 110 HB2 SER 110 8.089 -0.982 3.132 834 HG SER 110 HG SER 110 8.060 -2.685 1.163 835 H LEU 111 HN LEU 111 6.521 1.385 2.765 836 HA LEU 111 HA LEU 111 5.264 0.686 5.096 837 1HB LEU 111 HB1 LEU 111 6.197 2.921 4.564 838 2HB LEU 111 HB2 LEU 111 4.798 3.233 3.552 839 HG LEU 111 HG LEU 111 4.150 2.420 6.297 840 1HD1 LEU 111 HD11 LEU 111 6.201 4.355 5.897 841 2HD1 LEU 111 HD12 LEU 111 5.437 3.824 7.403 842 3HD1 LEU 111 HD13 LEU 111 4.747 5.166 6.492 843 1HD2 LEU 111 HD21 LEU 111 2.547 4.240 6.082 844 2HD2 LEU 111 HD22 LEU 111 2.477 3.165 4.685 845 3HD2 LEU 111 HD23 LEU 111 3.289 4.725 4.557 846 H ARG 112 HN ARG 112 3.832 1.195 1.939 847 HA ARG 112 HA ARG 112 1.147 1.086 2.990 848 1HB ARG 112 HB2 ARG 112 0.995 2.424 1.189 849 2HB ARG 112 HB1 ARG 112 2.426 1.738 0.430 850 1HG ARG 112 HG1 ARG 112 1.185 -0.034 -0.513 851 2HG ARG 112 HG2 ARG 112 -0.239 0.348 0.460 852 1HD ARG 112 HD1 ARG 112 0.743 1.578 -2.026 853 2HD ARG 112 HD2 ARG 112 -0.904 1.398 -1.421 854 HE ARG 112 HE ARG 112 0.972 3.520 -0.611 855 1HH1 ARG 112 HH22 ARG 112 -2.264 2.283 -1.000 856 2HH1 ARG 112 HH21 ARG 112 -3.025 3.776 -0.560 857 1HH2 ARG 112 HH11 ARG 112 -0.022 5.487 -0.031 858 2HH2 ARG 112 HH12 ARG 112 -1.750 5.597 -0.009 859 H SER 113 HN SER 113 2.942 -0.892 0.614 860 HA SER 113 HA SER 113 1.096 -2.959 0.439 861 1HB SER 113 HB2 SER 113 2.891 -2.764 -1.172 862 2HB SER 113 HB1 SER 113 4.101 -3.021 0.084 863 HG SER 113 HG SER 113 2.165 -4.892 -0.814 864 H LYS 114 HN LYS 114 3.620 -2.385 2.792 865 HA LYS 114 HA LYS 114 3.373 -4.985 4.014 866 1HB LYS 114 HB1 LYS 114 4.773 -2.490 4.992 867 2HB LYS 114 HB2 LYS 114 4.881 -4.075 5.746 868 1HG LYS 114 HG1 LYS 114 5.646 -3.656 2.884 869 2HG LYS 114 HG2 LYS 114 6.779 -3.333 4.199 870 1HD LYS 114 HD2 LYS 114 6.824 -5.571 4.871 871 2HD LYS 114 HD1 LYS 114 5.332 -5.954 4.008 872 1HE LYS 114 HE1 LYS 114 6.396 -6.287 2.050 873 2HE LYS 114 HE2 LYS 114 7.533 -4.970 2.327 874 1HZ LYS 114 HZ1 LYS 114 8.938 -6.330 3.543 875 2HZ LYS 114 HZ2 LYS 114 8.416 -7.356 2.304 876 3HZ LYS 114 HZ3 LYS 114 7.743 -7.487 3.850 877 H VAL 115 HN VAL 115 1.987 -1.815 4.385 878 HA VAL 115 HA VAL 115 0.910 -2.273 7.000 879 HB VAL 115 HB VAL 115 0.787 -0.106 5.039 880 1HG1 VAL 115 HG11 VAL 115 -1.334 0.793 5.533 881 2HG1 VAL 115 HG12 VAL 115 -1.603 -0.356 6.846 882 3HG1 VAL 115 HG13 VAL 115 -1.641 -0.906 5.171 883 1HG2 VAL 115 HG21 VAL 115 1.818 -0.351 7.448 884 2HG2 VAL 115 HG22 VAL 115 0.220 0.215 7.937 885 3HG2 VAL 115 HG23 VAL 115 1.212 1.197 6.858 886 H ASP 116 HN ASP 116 -0.519 -2.253 3.729 887 HA ASP 116 HA ASP 116 -3.031 -3.221 4.390 888 1HB ASP 116 HB1 ASP 116 -2.452 -2.330 2.171 889 2HB ASP 116 HB2 ASP 116 -1.448 -3.744 1.866 890 H GLU 117 HN GLU 117 -0.015 -4.948 3.878 891 HA GLU 117 HA GLU 117 -1.231 -7.559 3.951 892 1HB GLU 117 HB1 GLU 117 1.562 -6.491 3.874 893 2HB GLU 117 HB2 GLU 117 1.318 -8.142 4.428 894 1HG GLU 117 HG1 GLU 117 1.688 -7.400 1.846 895 2HG GLU 117 HG2 GLU 117 0.926 -8.901 2.368 896 H ALA 118 HN ALA 118 0.265 -5.343 6.209 897 HA ALA 118 HA ALA 118 0.471 -7.120 8.404 898 1HB ALA 118 HB1 ALA 118 0.883 -5.243 9.737 899 2HB ALA 118 HB2 ALA 118 -0.029 -4.171 8.669 900 3HB ALA 118 HB3 ALA 118 1.535 -4.810 8.155 901 H VAL 119 HN VAL 119 -2.104 -5.285 6.974 902 HA VAL 119 HA VAL 119 -4.007 -5.255 9.014 903 HB VAL 119 HB VAL 119 -4.568 -5.749 6.095 904 1HG1 VAL 119 HG11 VAL 119 -6.352 -5.844 8.053 905 2HG1 VAL 119 HG12 VAL 119 -6.719 -5.117 6.485 906 3HG1 VAL 119 HG13 VAL 119 -6.284 -4.088 7.849 907 1HG2 VAL 119 HG21 VAL 119 -4.679 -3.030 7.167 908 2HG2 VAL 119 HG22 VAL 119 -4.118 -3.618 5.606 909 3HG2 VAL 119 HG23 VAL 119 -3.067 -3.726 7.017 910 H ALA 120 HN ALA 120 -3.585 -7.556 6.371 911 HA ALA 120 HA ALA 120 -5.425 -9.474 7.125 912 1HB ALA 120 HB1 ALA 120 -3.368 -9.189 5.225 913 2HB ALA 120 HB2 ALA 120 -4.649 -10.409 5.272 914 3HB ALA 120 HB3 ALA 120 -3.095 -10.731 6.047 915 H VAL 121 HN VAL 121 -2.365 -8.677 8.468 916 HA VAL 121 HA VAL 121 -2.103 -11.128 9.989 917 HB VAL 121 HB VAL 121 -0.461 -8.634 9.695 918 1HG1 VAL 121 HG21 VAL 121 0.333 -8.798 11.749 919 2HG1 VAL 121 HG22 VAL 121 0.978 -10.385 11.325 920 3HG1 VAL 121 HG23 VAL 121 -0.622 -10.251 12.056 921 1HG2 VAL 121 HG11 VAL 121 0.435 -11.481 9.435 922 2HG2 VAL 121 HG12 VAL 121 1.129 -10.027 8.717 923 3HG2 VAL 121 HG13 VAL 121 -0.407 -10.661 8.119 924 H LEU 122 HN LEU 122 -3.164 -7.831 10.414 925 HA LEU 122 HA LEU 122 -3.269 -7.874 13.267 926 1HB LEU 122 HB2 LEU 122 -3.570 -5.691 12.955 927 2HB LEU 122 HB1 LEU 122 -3.599 -5.965 11.225 928 HG LEU 122 HG LEU 122 -6.192 -6.571 12.086 929 1HD1 LEU 122 HD11 LEU 122 -5.123 -4.104 13.442 930 2HD1 LEU 122 HD12 LEU 122 -5.827 -5.526 14.211 931 3HD1 LEU 122 HD13 LEU 122 -6.836 -4.465 13.229 932 1HD2 LEU 122 HD21 LEU 122 -5.003 -4.151 10.752 933 2HD2 LEU 122 HD22 LEU 122 -6.736 -4.449 10.887 934 3HD2 LEU 122 HD23 LEU 122 -5.718 -5.567 9.981 935 H GLN 123 HN GLN 123 -5.578 -8.397 10.659 936 HA GLN 123 HA GLN 123 -7.849 -8.806 12.304 937 1HB GLN 123 HB2 GLN 123 -8.688 -10.023 10.173 938 2HB GLN 123 HB1 GLN 123 -8.359 -8.304 10.085 939 1HG GLN 123 HG1 GLN 123 -6.996 -8.617 8.409 940 2HG GLN 123 HG2 GLN 123 -5.973 -9.631 9.423 941 1HE2 GLN 123 HE22 GLN 123 -7.159 -11.886 9.799 942 2HE2 GLN 123 HE21 GLN 123 -7.618 -12.671 8.331 943 H ALA 124 HN ALA 124 -5.280 -10.813 11.127 944 HA ALA 124 HA ALA 124 -6.481 -13.305 11.960 945 1HB ALA 124 HB1 ALA 124 -4.251 -14.249 11.363 946 2HB ALA 124 HB2 ALA 124 -3.713 -12.612 10.981 947 3HB ALA 124 HB3 ALA 124 -5.024 -13.351 10.057 948 H HIS 125 HN HIS 125 -4.830 -10.802 13.518 949 HA HIS 125 HA HIS 125 -4.085 -12.605 15.728 950 1HB HIS 125 HB1 HIS 125 -2.503 -10.710 14.323 951 2HB HIS 125 HB2 HIS 125 -2.748 -10.085 15.951 952 HD2 HIS 125 HD2 HIS 125 -0.826 -10.902 17.597 953 HE1 HIS 125 HE1 HIS 125 0.013 -14.596 15.706 954 HE2 HIS 125 HE2 HIS 125 0.637 -13.045 17.614 955 H GLN 126 HN GLN 126 -6.472 -10.669 14.900 956 HA GLN 126 HA GLN 126 -6.605 -8.986 17.247 957 1HB GLN 126 HB1 GLN 126 -8.123 -9.277 14.738 958 2HB GLN 126 HB2 GLN 126 -9.088 -8.822 16.135 959 1HG GLN 126 HG2 GLN 126 -6.626 -7.369 15.190 960 2HG GLN 126 HG1 GLN 126 -8.288 -6.891 14.842 961 1HE2 GLN 126 HE22 GLN 126 -5.765 -6.972 17.182 962 2HE2 GLN 126 HE21 GLN 126 -6.562 -6.032 18.394 963 H ALA 127 HN ALA 127 -9.541 -10.529 16.234 964 HA ALA 127 HA ALA 127 -9.803 -11.698 18.899 965 1HB ALA 127 HB1 ALA 127 -11.586 -10.397 17.117 966 2HB ALA 127 HB2 ALA 127 -11.892 -10.975 18.756 967 3HB ALA 127 HB3 ALA 127 -12.172 -12.040 17.378 968 H LYS 128 HN LYS 128 -8.197 -12.897 16.645 969 HA LYS 128 HA LYS 128 -9.671 -15.305 15.983 970 1HB LYS 128 HB2 LYS 128 -6.774 -14.678 15.406 971 2HB LYS 128 HB1 LYS 128 -7.775 -15.896 14.626 972 1HG LYS 128 HG2 LYS 128 -9.053 -13.380 14.339 973 2HG LYS 128 HG1 LYS 128 -7.359 -13.207 13.874 974 1HD LYS 128 HD2 LYS 128 -7.736 -14.264 11.956 975 2HD LYS 128 HD1 LYS 128 -8.398 -15.657 12.814 976 1HE LYS 128 HE1 LYS 128 -10.368 -13.668 12.936 977 2HE LYS 128 HE2 LYS 128 -9.758 -13.641 11.282 978 1HZ LYS 128 HZ1 LYS 128 -10.605 -15.662 10.845 979 2HZ LYS 128 HZ2 LYS 128 -11.648 -15.309 12.129 980 3HZ LYS 128 HZ3 LYS 128 -10.282 -16.272 12.389 981 H GLU 129 HN GLU 129 -7.173 -16.920 15.996 982 HA GLU 129 HA GLU 129 -7.470 -17.981 18.657 983 1HB GLU 129 HB2 GLU 129 -5.464 -18.860 16.583 984 2HB GLU 129 HB1 GLU 129 -6.121 -19.798 17.916 985 1HG GLU 129 HG2 GLU 129 -7.923 -20.414 16.754 986 2HG GLU 129 HG1 GLU 129 -8.147 -18.806 16.066 987 H ALA 130 HN ALA 130 -5.715 -15.493 17.417 988 HA ALA 130 HA ALA 130 -3.161 -15.834 18.551 989 1HB ALA 130 HB1 ALA 130 -4.000 -13.071 18.511 990 2HB ALA 130 HB2 ALA 130 -4.439 -13.900 17.016 991 3HB ALA 130 HB3 ALA 130 -2.759 -13.885 17.558 992 H ALA 131 HN ALA 131 -6.135 -14.384 19.806 993 HA ALA 131 HA ALA 131 -4.887 -13.748 22.345 994 1HB ALA 131 HB1 ALA 131 -6.407 -12.116 22.021 995 2HB ALA 131 HB2 ALA 131 -7.499 -13.273 22.782 996 3HB ALA 131 HB3 ALA 131 -7.448 -13.135 21.025 997 H GLN 132 HN GLN 132 -6.401 -16.413 20.926 998 HA GLN 132 HA GLN 132 -7.393 -17.503 23.441 999 1HB GLN 132 HB2 GLN 132 -7.979 -17.898 20.660 1000 2HB GLN 132 HB1 GLN 132 -7.532 -19.439 21.379 1001 1HG GLN 132 HG1 GLN 132 -9.362 -19.511 22.717 1002 2HG GLN 132 HG2 GLN 132 -9.457 -17.756 22.867 1003 1HE2 GLN 132 HE21 GLN 132 -11.386 -17.173 22.164 1004 2HE2 GLN 132 HE22 GLN 132 -12.115 -17.671 20.680 1005 H LYS 133 HN LYS 133 -6.910 -20.211 23.024 1006 HA LYS 133 HA LYS 133 -4.308 -20.476 24.097 1007 1HB LYS 133 HB2 LYS 133 -4.724 -22.918 23.910 1008 2HB LYS 133 HB1 LYS 133 -6.039 -22.054 24.694 1009 1HG LYS 133 HG1 LYS 133 -7.163 -22.022 22.407 1010 2HG LYS 133 HG2 LYS 133 -5.956 -23.219 21.932 1011 1HD LYS 133 HD2 LYS 133 -7.046 -24.854 22.986 1012 2HD LYS 133 HD1 LYS 133 -7.180 -23.898 24.463 1013 1HE LYS 133 HE1 LYS 133 -8.972 -23.541 22.069 1014 2HE LYS 133 HE2 LYS 133 -9.365 -24.579 23.440 1015 1HZ LYS 133 HZ1 LYS 133 -8.732 -22.261 24.646 1016 2HZ LYS 133 HZ2 LYS 133 -10.307 -22.740 24.255 1017 3HZ LYS 133 HZ3 LYS 133 -9.456 -21.704 23.223 1018 H ALA 134 HN ALA 134 -2.579 -21.835 23.214 1019 HA ALA 134 HA ALA 134 -2.004 -21.089 20.483 1020 1HB ALA 134 HB1 ALA 134 -0.304 -20.995 22.299 1021 2HB ALA 134 HB2 ALA 134 0.204 -21.923 20.889 1022 3HB ALA 134 HB3 ALA 134 -0.328 -22.757 22.349 1023 H VAL 135 HN VAL 135 -2.175 -24.162 22.283 1024 HA VAL 135 HA VAL 135 -2.321 -25.630 19.763 1025 HB VAL 135 HB VAL 135 -2.302 -27.654 21.306 1026 1HG1 VAL 135 HG11 VAL 135 -0.333 -26.672 20.068 1027 2HG1 VAL 135 HG12 VAL 135 0.057 -27.635 21.493 1028 3HG1 VAL 135 HG13 VAL 135 0.108 -25.874 21.578 1029 1HG2 VAL 135 HG21 VAL 135 -2.769 -25.774 23.263 1030 2HG2 VAL 135 HG22 VAL 135 -1.058 -26.150 23.463 1031 3HG2 VAL 135 HG23 VAL 135 -2.257 -27.440 23.528 1032 H ASN 136 HN ASN 136 -4.160 -26.406 18.946 1033 HA ASN 136 HA ASN 136 -6.625 -26.026 20.459 1034 1HB ASN 136 HB2 ASN 136 -6.798 -27.115 17.724 1035 2HB ASN 136 HB1 ASN 136 -7.678 -25.781 18.465 1036 1HD2 ASN 136 HD21 ASN 136 -4.785 -26.724 16.779 1037 2HD2 ASN 136 HD22 ASN 136 -4.287 -25.131 16.332 1038 H SER 137 HN SER 137 -4.410 -28.436 20.026 1039 HA SER 137 HA SER 137 -6.201 -30.670 19.760 1040 1HB SER 137 HB1 SER 137 -4.284 -32.030 19.819 1041 2HB SER 137 HB2 SER 137 -3.711 -30.544 19.062 1042 HG SER 137 HG SER 137 -3.274 -30.028 21.478 1043 H ALA 138 HN ALA 138 -6.505 -32.318 21.376 1044 HA ALA 138 HA ALA 138 -7.236 -31.273 23.897 1045 1HB ALA 138 HB1 ALA 138 -8.518 -33.081 23.213 1046 2HB ALA 138 HB2 ALA 138 -7.481 -33.781 24.457 1047 3HB ALA 138 HB3 ALA 138 -7.108 -34.034 22.751 1048 H THR 139 HN THR 139 -5.573 -30.427 25.066 1049 HA THR 139 HA THR 139 -3.138 -31.959 25.469 1050 HB THR 139 HB THR 139 -3.778 -29.379 26.866 1051 HG1 THR 139 HG1 THR 139 -2.512 -29.204 24.422 1052 1HG2 THR 139 HG21 THR 139 -1.666 -29.531 27.477 1053 2HG2 THR 139 HG22 THR 139 -1.209 -29.359 25.782 1054 3HG2 THR 139 HG23 THR 139 -1.427 -30.965 26.479 1055 H GLY 140 HN GLY 140 -2.324 -32.494 27.574 1056 1HA GLY 140 HA2 GLY 140 -4.497 -33.140 29.452 1057 2HA GLY 140 HA1 GLY 140 -2.966 -33.994 29.340 1058 H VAL 141 HN VAL 141 -4.420 -30.903 30.258 1059 HA VAL 141 HA VAL 141 -2.071 -30.150 31.787 1060 HB VAL 141 HB VAL 141 -3.432 -28.133 32.391 1061 1HG1 VAL 141 HG21 VAL 141 -2.395 -27.251 30.640 1062 2HG1 VAL 141 HG22 VAL 141 -3.668 -27.849 29.577 1063 3HG1 VAL 141 HG23 VAL 141 -2.256 -28.850 29.910 1064 1HG2 VAL 141 HG11 VAL 141 -5.503 -27.711 31.184 1065 2HG2 VAL 141 HG12 VAL 141 -5.647 -29.161 32.178 1066 3HG2 VAL 141 HG13 VAL 141 -5.408 -29.306 30.437 1067 HA PRO 142 HA PRO 142 -3.320 -31.734 35.712 1068 1HB PRO 142 HB1 PRO 142 -2.587 -29.682 37.380 1069 2HB PRO 142 HB2 PRO 142 -1.456 -30.854 36.696 1070 1HG PRO 142 HG2 PRO 142 -2.097 -28.079 35.777 1071 2HG PRO 142 HG1 PRO 142 -0.521 -28.882 35.896 1072 1HD PRO 142 HD2 PRO 142 -1.792 -28.620 33.545 1073 2HD PRO 142 HD1 PRO 142 -0.836 -30.068 33.929 1074 H THR 143 HN THR 143 -4.588 -31.109 37.729 1075 HA THR 143 HA THR 143 -7.071 -29.906 36.877 1076 HB THR 143 HB THR 143 -7.841 -30.572 39.176 1077 HG1 THR 143 HG1 THR 143 -5.137 -31.294 39.358 1078 1HG2 THR 143 HG21 THR 143 -6.561 -33.023 38.172 1079 2HG2 THR 143 HG22 THR 143 -7.604 -32.158 37.043 1080 3HG2 THR 143 HG23 THR 143 -8.243 -32.702 38.593 1081 H VAL 144 HN VAL 144 -7.364 -27.786 36.957 1082 HA VAL 144 HA VAL 144 -6.137 -26.278 39.174 1083 HB VAL 144 HB VAL 144 -6.942 -25.093 36.524 1084 1HG1 VAL 144 HG11 VAL 144 -6.579 -23.734 38.707 1085 2HG1 VAL 144 HG12 VAL 144 -5.851 -23.171 37.204 1086 3HG1 VAL 144 HG13 VAL 144 -4.869 -24.024 38.394 1087 1HG2 VAL 144 HG21 VAL 144 -5.048 -25.742 35.536 1088 2HG2 VAL 144 HG22 VAL 144 -4.921 -26.938 36.826 1089 3HG2 VAL 144 HG23 VAL 144 -4.082 -25.393 36.969 Start of MODEL 13 1 1H GLY 1 HT1 GLY 1 27.089 -2.642 13.301 2 2H GLY 1 HT2 GLY 1 27.683 -3.852 14.323 3 3H GLY 1 HT3 GLY 1 26.044 -3.439 14.367 4 1HA GLY 1 HA2 GLY 1 27.457 -4.689 12.074 5 2HA GLY 1 HA1 GLY 1 26.382 -5.524 13.184 6 HA PRO 2 HA PRO 2 22.978 -4.636 10.527 7 1HB PRO 2 HB2 PRO 2 20.952 -4.231 12.310 8 2HB PRO 2 HB1 PRO 2 21.599 -5.827 11.914 9 1HG PRO 2 HG2 PRO 2 22.201 -4.063 14.257 10 2HG PRO 2 HG1 PRO 2 21.928 -5.814 14.217 11 1HD PRO 2 HD1 PRO 2 24.403 -4.754 14.366 12 2HD PRO 2 HD2 PRO 2 24.074 -6.257 13.478 13 H LEU 3 HN LEU 3 23.846 -2.365 13.013 14 HA LEU 3 HA LEU 3 22.238 -0.248 11.801 15 1HB LEU 3 HB2 LEU 3 23.230 1.107 13.731 16 2HB LEU 3 HB1 LEU 3 22.075 -0.150 14.125 17 HG LEU 3 HG LEU 3 24.622 -1.359 14.230 18 1HD1 LEU 3 HD21 LEU 3 25.931 0.470 14.540 19 2HD1 LEU 3 HD22 LEU 3 25.392 0.242 16.205 20 3HD1 LEU 3 HD23 LEU 3 24.609 1.447 15.181 21 1HD2 LEU 3 HD11 LEU 3 23.703 -2.203 16.069 22 2HD2 LEU 3 HD12 LEU 3 22.287 -1.208 15.725 23 3HD2 LEU 3 HD13 LEU 3 23.547 -0.608 16.804 24 H GLY 4 HN GLY 4 23.091 0.789 10.130 25 1HA GLY 4 HA1 GLY 4 26.004 0.997 9.895 26 2HA GLY 4 HA2 GLY 4 24.840 1.294 8.614 27 H SER 5 HN SER 5 23.453 2.853 11.030 28 HA SER 5 HA SER 5 24.808 5.378 10.377 29 1HB SER 5 HB1 SER 5 22.548 5.569 9.748 30 2HB SER 5 HB2 SER 5 21.983 4.719 11.185 31 HG SER 5 HG SER 5 21.917 7.204 10.980 32 H ALA 6 HN ALA 6 25.859 6.482 11.901 33 HA ALA 6 HA ALA 6 25.521 5.634 14.704 34 1HB ALA 6 HB1 ALA 6 27.789 5.406 13.316 35 2HB ALA 6 HB2 ALA 6 27.758 5.735 15.049 36 3HB ALA 6 HB3 ALA 6 27.987 7.057 13.903 37 H ALA 7 HN ALA 7 23.931 7.110 15.265 38 HA ALA 7 HA ALA 7 24.563 9.960 14.953 39 1HB ALA 7 HB1 ALA 7 21.947 8.998 16.011 40 2HB ALA 7 HB2 ALA 7 22.295 8.842 14.289 41 3HB ALA 7 HB3 ALA 7 22.317 10.431 15.053 42 H ALA 8 HN ALA 8 23.775 11.344 16.851 43 HA ALA 8 HA ALA 8 25.190 10.488 19.194 44 1HB ALA 8 HB1 ALA 8 23.501 12.958 18.845 45 2HB ALA 8 HB2 ALA 8 25.191 12.829 18.358 46 3HB ALA 8 HB3 ALA 8 24.751 12.680 20.059 47 H ALA 9 HN ALA 9 24.276 10.506 21.362 48 HA ALA 9 HA ALA 9 21.930 8.918 21.535 49 1HB ALA 9 HB1 ALA 9 22.238 9.067 23.952 50 2HB ALA 9 HB2 ALA 9 23.441 10.337 23.723 51 3HB ALA 9 HB3 ALA 9 23.759 8.706 23.133 52 H THR 10 HN THR 10 20.144 9.518 23.131 53 HA THR 10 HA THR 10 18.808 11.824 22.132 54 HB THR 10 HB THR 10 17.014 11.194 23.688 55 HG1 THR 10 HG1 THR 10 17.506 10.166 25.430 56 1HG2 THR 10 HG21 THR 10 16.326 9.429 22.512 57 2HG2 THR 10 HG22 THR 10 17.789 8.505 22.850 58 3HG2 THR 10 HG23 THR 10 17.786 9.711 21.563 59 HA PRO 11 HA PRO 11 17.406 13.344 22.512 60 1HB PRO 11 HB1 PRO 11 17.431 16.017 22.309 61 2HB PRO 11 HB2 PRO 11 16.638 15.202 23.662 62 1HG PRO 11 HG1 PRO 11 19.329 16.511 23.549 63 2HG PRO 11 HG2 PRO 11 18.098 16.598 24.820 64 1HD PRO 11 HD1 PRO 11 20.290 14.954 24.926 65 2HD PRO 11 HD2 PRO 11 18.763 14.620 25.764 66 H ALA 12 HN ALA 12 17.493 13.856 20.297 67 HA ALA 12 HA ALA 12 20.193 14.007 19.216 68 1HB ALA 12 HB1 ALA 12 19.074 13.497 17.050 69 2HB ALA 12 HB2 ALA 12 17.537 13.438 17.913 70 3HB ALA 12 HB3 ALA 12 18.810 12.280 18.301 71 H VAL 13 HN VAL 13 19.156 16.372 20.436 72 HA VAL 13 HA VAL 13 18.313 18.162 18.337 73 HB VAL 13 HB VAL 13 17.534 18.432 20.675 74 1HG1 VAL 13 HG21 VAL 13 18.968 19.262 22.394 75 2HG1 VAL 13 HG22 VAL 13 20.320 19.408 21.271 76 3HG1 VAL 13 HG23 VAL 13 19.716 17.813 21.722 77 1HG2 VAL 13 HG11 VAL 13 18.515 20.986 20.701 78 2HG2 VAL 13 HG12 VAL 13 17.117 20.437 19.776 79 3HG2 VAL 13 HG13 VAL 13 18.703 20.525 19.009 80 H ARG 14 HN ARG 14 21.293 17.122 19.713 81 HA ARG 14 HA ARG 14 22.760 19.406 18.642 82 1HB ARG 14 HB1 ARG 14 23.125 17.913 20.901 83 2HB ARG 14 HB2 ARG 14 24.288 17.177 19.807 84 1HG ARG 14 HG1 ARG 14 24.171 20.144 20.207 85 2HG ARG 14 HG2 ARG 14 25.085 19.094 21.290 86 1HD ARG 14 HD1 ARG 14 25.855 18.250 18.782 87 2HD ARG 14 HD2 ARG 14 25.708 19.998 18.595 88 HE ARG 14 HE ARG 14 27.538 20.271 19.952 89 1HH1 ARG 14 HH11 ARG 14 26.399 16.985 20.197 90 2HH1 ARG 14 HH12 ARG 14 27.773 16.443 21.102 91 1HH2 ARG 14 HH22 ARG 14 29.348 19.563 21.142 92 2HH2 ARG 14 HH21 ARG 14 29.448 17.907 21.638 93 H THR 15 HN THR 15 23.411 19.364 16.606 94 HA THR 15 HA THR 15 24.028 16.763 15.369 95 HB THR 15 HB THR 15 23.667 18.034 13.191 96 HG1 THR 15 HG1 THR 15 22.311 19.915 13.476 97 1HG2 THR 15 HG21 THR 15 21.074 18.274 13.721 98 2HG2 THR 15 HG22 THR 15 21.553 17.299 15.111 99 3HG2 THR 15 HG23 THR 15 21.863 16.716 13.475 100 H VAL 16 HN VAL 16 26.024 16.390 14.625 101 HA VAL 16 HA VAL 16 28.000 18.535 14.902 102 HB VAL 16 HB VAL 16 28.592 16.554 16.109 103 1HG1 VAL 16 HG21 VAL 16 27.737 15.192 13.625 104 2HG1 VAL 16 HG22 VAL 16 27.516 14.724 15.311 105 3HG1 VAL 16 HG23 VAL 16 29.071 14.467 14.521 106 1HG2 VAL 16 HG11 VAL 16 30.318 16.307 13.684 107 2HG2 VAL 16 HG12 VAL 16 30.768 16.294 15.389 108 3HG2 VAL 16 HG13 VAL 16 30.312 17.808 14.610 109 HA PRO 17 HA PRO 17 28.125 19.121 10.490 110 1HB PRO 17 HB1 PRO 17 30.877 20.086 11.025 111 2HB PRO 17 HB2 PRO 17 29.531 20.908 10.229 112 1HG PRO 17 HG1 PRO 17 30.292 21.594 12.693 113 2HG PRO 17 HG2 PRO 17 28.577 21.571 12.236 114 1HD PRO 17 HD2 PRO 17 30.145 19.577 13.828 115 2HD PRO 17 HD1 PRO 17 28.489 20.169 14.078 116 H GLN 18 HN GLN 18 29.787 18.713 8.682 117 HA GLN 18 HA GLN 18 30.765 15.995 9.017 118 1HB GLN 18 HB1 GLN 18 29.577 17.383 6.913 119 2HB GLN 18 HB2 GLN 18 31.252 17.193 6.413 120 1HG GLN 18 HG1 GLN 18 31.082 14.779 6.776 121 2HG GLN 18 HG2 GLN 18 29.398 14.977 7.259 122 1HE2 GLN 18 HE22 GLN 18 28.248 16.511 5.515 123 2HE2 GLN 18 HE21 GLN 18 28.395 15.918 3.898 124 H TYR 19 HN TYR 19 32.860 15.384 9.034 125 HA TYR 19 HA TYR 19 34.858 17.370 9.514 126 1HB TYR 19 HB1 TYR 19 34.920 14.367 9.285 127 2HB TYR 19 HB2 TYR 19 36.394 15.307 9.488 128 HD1 TYR 19 HD1 TYR 19 36.378 16.987 11.511 129 HD2 TYR 19 HD2 TYR 19 33.811 13.612 11.170 130 HE1 TYR 19 HE1 TYR 19 36.036 17.009 13.945 131 HE2 TYR 19 HE2 TYR 19 33.462 13.624 13.603 132 HH TYR 19 HH TYR 19 34.419 16.229 15.586 133 H LYS 20 HN LYS 20 33.587 16.004 6.711 134 HA LYS 20 HA LYS 20 36.000 16.125 5.130 135 1HB LYS 20 HB2 LYS 20 33.103 15.604 4.480 136 2HB LYS 20 HB1 LYS 20 34.321 15.769 3.222 137 1HG LYS 20 HG1 LYS 20 35.532 13.873 4.077 138 2HG LYS 20 HG2 LYS 20 34.436 13.750 5.454 139 1HD LYS 20 HD1 LYS 20 32.947 12.585 4.272 140 2HD LYS 20 HD2 LYS 20 32.999 13.743 2.940 141 1HE LYS 20 HE1 LYS 20 34.757 11.353 3.409 142 2HE LYS 20 HE2 LYS 20 33.716 11.695 2.027 143 1HZ LYS 20 HZ1 LYS 20 35.833 12.179 1.260 144 2HZ LYS 20 HZ2 LYS 20 36.321 12.897 2.710 145 3HZ LYS 20 HZ3 LYS 20 35.240 13.703 1.689 146 H TYR 21 HN TYR 21 35.749 17.360 2.940 147 HA TYR 21 HA TYR 21 35.700 20.125 3.563 148 1HB TYR 21 HB1 TYR 21 36.662 18.518 1.466 149 2HB TYR 21 HB2 TYR 21 35.510 19.622 0.723 150 HD1 TYR 21 HD1 TYR 21 36.306 21.651 -0.021 151 HD2 TYR 21 HD2 TYR 21 38.330 19.711 3.179 152 HE1 TYR 21 HE1 TYR 21 38.003 23.432 -0.023 153 HE2 TYR 21 HE2 TYR 21 40.032 21.485 3.186 154 HH TYR 21 HH TYR 21 39.709 24.349 1.995 155 H ALA 22 HN ALA 22 33.264 17.927 2.669 156 HA ALA 22 HA ALA 22 31.511 19.958 1.540 157 1HB ALA 22 HB1 ALA 22 31.671 17.553 0.704 158 2HB ALA 22 HB2 ALA 22 30.056 18.220 0.946 159 3HB ALA 22 HB3 ALA 22 30.744 17.120 2.141 160 H ALA 23 HN ALA 23 31.415 21.270 3.470 161 HA ALA 23 HA ALA 23 30.384 20.290 5.924 162 1HB ALA 23 HB1 ALA 23 29.910 22.813 6.280 163 2HB ALA 23 HB2 ALA 23 30.796 23.018 4.770 164 3HB ALA 23 HB3 ALA 23 31.578 22.258 6.156 165 H GLY 24 HN GLY 24 28.428 19.361 5.995 166 1HA GLY 24 HA1 GLY 24 26.244 20.394 4.368 167 2HA GLY 24 HA2 GLY 24 26.214 18.938 5.350 168 H VAL 25 HN VAL 25 27.248 22.079 6.523 169 HA VAL 25 HA VAL 25 25.207 21.968 8.583 170 HB VAL 25 HB VAL 25 27.633 22.608 9.007 171 1HG1 VAL 25 HG11 VAL 25 26.687 25.095 7.611 172 2HG1 VAL 25 HG12 VAL 25 28.116 24.120 7.268 173 3HG1 VAL 25 HG13 VAL 25 28.047 25.098 8.734 174 1HG2 VAL 25 HG21 VAL 25 26.424 23.012 10.873 175 2HG2 VAL 25 HG22 VAL 25 25.207 23.957 10.015 176 3HG2 VAL 25 HG23 VAL 25 26.753 24.690 10.444 177 H ARG 26 HN ARG 26 25.146 22.956 5.509 178 HA ARG 26 HA ARG 26 23.845 25.518 5.859 179 1HB ARG 26 HB2 ARG 26 23.948 23.907 3.314 180 2HB ARG 26 HB1 ARG 26 23.770 25.647 3.491 181 1HG ARG 26 HG2 ARG 26 26.247 24.146 4.298 182 2HG ARG 26 HG1 ARG 26 26.014 24.868 2.705 183 1HD ARG 26 HD2 ARG 26 25.977 26.329 5.343 184 2HD ARG 26 HD1 ARG 26 27.288 26.349 4.164 185 HE ARG 26 HE ARG 26 25.811 27.538 2.660 186 1HH1 ARG 26 HH12 ARG 26 24.783 27.307 5.982 187 2HH1 ARG 26 HH11 ARG 26 23.730 28.679 5.885 188 1HH2 ARG 26 HH22 ARG 26 24.427 29.343 2.524 189 2HH2 ARG 26 HH21 ARG 26 23.528 29.835 3.920 190 H ASN 27 HN ASN 27 22.504 23.608 7.300 191 HA ASN 27 HA ASN 27 20.328 22.462 5.860 192 1HB ASN 27 HB2 ASN 27 21.226 22.608 8.647 193 2HB ASN 27 HB1 ASN 27 19.473 22.622 8.477 194 1HD2 ASN 27 HD21 ASN 27 19.255 20.590 9.382 195 2HD2 ASN 27 HD22 ASN 27 19.711 19.150 8.543 196 HA PRO 28 HA PRO 28 17.751 26.071 5.683 197 1HB PRO 28 HB2 PRO 28 15.460 24.940 4.877 198 2HB PRO 28 HB1 PRO 28 16.873 25.017 3.819 199 1HG PRO 28 HG2 PRO 28 15.851 22.729 5.457 200 2HG PRO 28 HG1 PRO 28 16.475 22.725 3.798 201 1HD PRO 28 HD1 PRO 28 17.951 21.998 5.995 202 2HD PRO 28 HD2 PRO 28 18.654 22.627 4.492 203 H GLN 29 HN GLN 29 17.974 24.439 8.275 204 HA GLN 29 HA GLN 29 15.304 24.667 9.385 205 1HB GLN 29 HB2 GLN 29 17.536 23.077 9.941 206 2HB GLN 29 HB1 GLN 29 17.400 24.154 11.324 207 1HG GLN 29 HG2 GLN 29 15.202 22.399 10.250 208 2HG GLN 29 HG1 GLN 29 16.200 22.053 11.662 209 1HE2 GLN 29 HE21 GLN 29 15.873 23.196 13.555 210 2HE2 GLN 29 HE22 GLN 29 14.461 24.156 13.827 211 H GLN 30 HN GLN 30 16.608 27.094 8.485 212 HA GLN 30 HA GLN 30 17.519 28.532 10.795 213 1HB GLN 30 HB1 GLN 30 17.740 28.896 8.075 214 2HB GLN 30 HB2 GLN 30 16.579 30.136 8.529 215 1HG GLN 30 HG1 GLN 30 18.125 31.082 10.104 216 2HG GLN 30 HG2 GLN 30 19.268 29.768 9.828 217 1HE2 GLN 30 HE22 GLN 30 20.015 29.534 7.546 218 2HE2 GLN 30 HE21 GLN 30 20.334 30.984 6.662 219 H HIS 31 HN HIS 31 14.860 29.461 8.631 220 HA HIS 31 HA HIS 31 13.227 30.024 11.019 221 1HB HIS 31 HB2 HIS 31 13.988 31.753 8.777 222 2HB HIS 31 HB1 HIS 31 12.256 31.740 9.098 223 HD2 HIS 31 HD2 HIS 31 15.392 32.050 11.498 224 HE1 HIS 31 HE1 HIS 31 12.461 34.934 12.502 225 HE2 HIS 31 HE2 HIS 31 14.747 34.001 13.082 226 H LEU 32 HN LEU 32 13.458 28.509 7.968 227 HA LEU 32 HA LEU 32 10.565 28.130 7.760 228 1HB LEU 32 HB1 LEU 32 12.842 27.997 5.911 229 2HB LEU 32 HB2 LEU 32 11.666 26.716 5.689 230 HG LEU 32 HG LEU 32 10.367 29.294 5.939 231 1HD1 LEU 32 HD21 LEU 32 12.001 29.069 3.454 232 2HD1 LEU 32 HD22 LEU 32 12.700 29.808 4.895 233 3HD1 LEU 32 HD23 LEU 32 11.240 30.486 4.176 234 1HD2 LEU 32 HD11 LEU 32 9.172 27.465 5.055 235 2HD2 LEU 32 HD12 LEU 32 10.449 27.090 3.898 236 3HD2 LEU 32 HD13 LEU 32 9.474 28.546 3.695 237 H ASN 33 HN ASN 33 9.626 26.387 8.584 238 HA ASN 33 HA ASN 33 11.231 24.216 9.613 239 1HB ASN 33 HB1 ASN 33 9.080 23.360 10.491 240 2HB ASN 33 HB2 ASN 33 9.365 25.037 10.946 241 1HD2 ASN 33 HD22 ASN 33 8.291 26.689 9.665 242 2HD2 ASN 33 HD21 ASN 33 6.740 26.344 8.988 243 H ALA 34 HN ALA 34 11.208 22.092 8.945 244 HA ALA 34 HA ALA 34 10.542 21.671 6.165 245 1HB ALA 34 HB1 ALA 34 11.405 19.248 7.081 246 2HB ALA 34 HB2 ALA 34 12.221 20.367 8.172 247 3HB ALA 34 HB3 ALA 34 12.440 20.517 6.428 248 H GLN 35 HN GLN 35 8.717 21.603 8.848 249 HA GLN 35 HA GLN 35 7.293 19.126 8.371 250 1HB GLN 35 HB2 GLN 35 6.170 21.243 10.137 251 2HB GLN 35 HB1 GLN 35 6.222 19.501 10.368 252 1HG GLN 35 HG1 GLN 35 8.888 20.417 10.397 253 2HG GLN 35 HG2 GLN 35 7.950 21.507 11.416 254 1HE2 GLN 35 HE22 GLN 35 6.460 20.394 12.973 255 2HE2 GLN 35 HE21 GLN 35 7.070 18.992 13.776 256 HA PRO 36 HA PRO 36 4.731 21.247 5.329 257 1HB PRO 36 HB1 PRO 36 3.364 19.061 4.510 258 2HB PRO 36 HB2 PRO 36 5.016 19.404 3.986 259 1HG PRO 36 HG2 PRO 36 4.053 17.544 6.128 260 2HG PRO 36 HG1 PRO 36 5.303 17.280 4.897 261 1HD PRO 36 HD2 PRO 36 5.884 17.942 7.464 262 2HD PRO 36 HD1 PRO 36 6.898 18.435 6.093 263 H GLN 37 HN GLN 37 2.513 21.763 5.110 264 HA GLN 37 HA GLN 37 1.055 21.675 7.592 265 1HB GLN 37 HB2 GLN 37 0.556 22.950 4.911 266 2HB GLN 37 HB1 GLN 37 -0.672 22.953 6.171 267 1HG GLN 37 HG1 GLN 37 1.715 23.829 7.370 268 2HG GLN 37 HG2 GLN 37 1.573 24.679 5.832 269 1HE2 GLN 37 HE21 GLN 37 0.079 24.080 8.926 270 2HE2 GLN 37 HE22 GLN 37 -0.994 25.432 8.892 271 H VAL 38 HN VAL 38 -1.405 21.280 7.404 272 HA VAL 38 HA VAL 38 -1.740 18.568 6.431 273 HB VAL 38 HB VAL 38 -2.568 19.055 8.651 274 1HG1 VAL 38 HG11 VAL 38 -4.332 20.631 9.092 275 2HG1 VAL 38 HG12 VAL 38 -4.468 21.018 7.376 276 3HG1 VAL 38 HG13 VAL 38 -3.012 21.462 8.267 277 1HG2 VAL 38 HG21 VAL 38 -4.369 17.730 8.450 278 2HG2 VAL 38 HG22 VAL 38 -3.936 17.691 6.741 279 3HG2 VAL 38 HG23 VAL 38 -5.168 18.816 7.313 280 H THR 39 HN THR 39 -2.977 17.940 4.743 281 HA THR 39 HA THR 39 -4.142 20.071 3.095 282 HB THR 39 HB THR 39 -4.108 17.543 1.753 283 HG1 THR 39 HG1 THR 39 -2.208 16.765 2.185 284 1HG2 THR 39 HG21 THR 39 -2.646 20.126 1.386 285 2HG2 THR 39 HG22 THR 39 -3.958 19.446 0.422 286 3HG2 THR 39 HG23 THR 39 -2.348 18.728 0.354 287 H MET 40 HN MET 40 -5.642 19.380 5.283 288 HA MET 40 HA MET 40 -7.671 17.481 4.408 289 1HB MET 40 HB2 MET 40 -6.689 18.332 6.914 290 2HB MET 40 HB1 MET 40 -8.358 18.878 6.829 291 1HG MET 40 HG2 MET 40 -9.080 16.841 7.275 292 2HG MET 40 HG1 MET 40 -8.222 16.199 5.875 293 1HE MET 40 HE1 MET 40 -6.897 14.594 5.896 294 2HE MET 40 HE2 MET 40 -6.117 13.776 7.249 295 3HE MET 40 HE3 MET 40 -5.287 15.091 6.417 296 H GLN 41 HN GLN 41 -9.952 18.523 5.490 297 HA GLN 41 HA GLN 41 -11.737 19.831 4.986 298 1HB GLN 41 HB1 GLN 41 -9.648 21.565 5.691 299 2HB GLN 41 HB2 GLN 41 -10.371 22.271 4.252 300 1HG GLN 41 HG2 GLN 41 -11.577 23.243 5.956 301 2HG GLN 41 HG1 GLN 41 -12.612 21.900 5.473 302 1HE2 GLN 41 HE22 GLN 41 -12.540 19.962 6.766 303 2HE2 GLN 41 HE21 GLN 41 -12.179 20.073 8.452 304 H GLN 42 HN GLN 42 -12.430 18.846 3.126 305 HA GLN 42 HA GLN 42 -12.932 18.588 0.925 306 1HB GLN 42 HB2 GLN 42 -12.505 21.503 1.274 307 2HB GLN 42 HB1 GLN 42 -12.544 20.910 -0.381 308 1HG GLN 42 HG2 GLN 42 -14.749 20.944 -0.314 309 2HG GLN 42 HG1 GLN 42 -14.713 19.715 0.949 310 1HE2 GLN 42 HE21 GLN 42 -16.351 20.408 2.199 311 2HE2 GLN 42 HE22 GLN 42 -16.387 21.935 3.006 312 HA PRO 43 HA PRO 43 -8.507 17.836 -0.204 313 1HB PRO 43 HB1 PRO 43 -9.759 15.435 -1.390 314 2HB PRO 43 HB2 PRO 43 -8.362 15.561 -0.318 315 1HG PRO 43 HG2 PRO 43 -10.705 14.614 0.561 316 2HG PRO 43 HG1 PRO 43 -9.667 15.616 1.592 317 1HD PRO 43 HD1 PRO 43 -12.140 16.372 0.085 318 2HD PRO 43 HD2 PRO 43 -11.621 16.854 1.714 319 H ALA 44 HN ALA 44 -7.777 18.812 -1.980 320 HA ALA 44 HA ALA 44 -9.399 19.547 -4.157 321 1HB ALA 44 HB1 ALA 44 -6.600 19.827 -3.399 322 2HB ALA 44 HB2 ALA 44 -7.667 20.954 -4.238 323 3HB ALA 44 HB3 ALA 44 -6.839 19.684 -5.141 324 H VAL 45 HN VAL 45 -9.841 18.607 -6.072 325 HA VAL 45 HA VAL 45 -8.847 15.884 -6.477 326 HB VAL 45 HB VAL 45 -11.243 16.048 -6.483 327 1HG1 VAL 45 HG11 VAL 45 -12.523 17.465 -7.855 328 2HG1 VAL 45 HG12 VAL 45 -11.132 17.896 -8.848 329 3HG1 VAL 45 HG13 VAL 45 -11.249 18.487 -7.191 330 1HG2 VAL 45 HG21 VAL 45 -9.798 14.792 -8.396 331 2HG2 VAL 45 HG22 VAL 45 -10.893 15.759 -9.386 332 3HG2 VAL 45 HG23 VAL 45 -11.542 14.628 -8.198 333 H HIS 46 HN HIS 46 -6.760 16.670 -7.190 334 HA HIS 46 HA HIS 46 -6.783 17.756 -9.926 335 1HB HIS 46 HB1 HIS 46 -5.582 19.108 -8.203 336 2HB HIS 46 HB2 HIS 46 -4.490 17.751 -7.952 337 HD2 HIS 46 HD2 HIS 46 -5.179 20.583 -10.511 338 HE1 HIS 46 HE1 HIS 46 -1.677 18.505 -11.667 339 HE2 HIS 46 HE2 HIS 46 -3.142 20.526 -12.118 340 H VAL 47 HN VAL 47 -4.897 15.543 -7.861 341 HA VAL 47 HA VAL 47 -4.257 13.968 -10.261 342 HB VAL 47 HB VAL 47 -2.332 14.809 -8.928 343 1HG1 VAL 47 HG11 VAL 47 -3.593 13.110 -6.799 344 2HG1 VAL 47 HG12 VAL 47 -3.090 14.797 -6.708 345 3HG1 VAL 47 HG13 VAL 47 -1.878 13.518 -6.781 346 1HG2 VAL 47 HG21 VAL 47 -1.374 13.075 -9.935 347 2HG2 VAL 47 HG22 VAL 47 -2.836 12.102 -9.782 348 3HG2 VAL 47 HG23 VAL 47 -1.664 12.145 -8.466 349 H GLN 48 HN GLN 48 -4.584 11.743 -10.294 350 HA GLN 48 HA GLN 48 -6.795 10.824 -8.712 351 1HB GLN 48 HB1 GLN 48 -6.492 8.709 -10.029 352 2HB GLN 48 HB2 GLN 48 -6.731 10.151 -11.006 353 1HG GLN 48 HG1 GLN 48 -4.810 9.841 -12.056 354 2HG GLN 48 HG2 GLN 48 -3.932 9.716 -10.533 355 1HE2 GLN 48 HE21 GLN 48 -6.460 7.672 -11.930 356 2HE2 GLN 48 HE22 GLN 48 -5.523 6.220 -11.945 357 H GLY 49 HN GLY 49 -3.334 10.408 -8.676 358 1HA GLY 49 HA2 GLY 49 -3.560 8.302 -6.641 359 2HA GLY 49 HA1 GLY 49 -2.098 8.725 -7.518 360 H GLN 50 HN GLN 50 -4.105 9.412 -4.784 361 HA GLN 50 HA GLN 50 -2.411 11.630 -3.940 362 1HB GLN 50 HB2 GLN 50 -4.755 10.475 -2.438 363 2HB GLN 50 HB1 GLN 50 -4.052 12.078 -2.285 364 1HG GLN 50 HG2 GLN 50 -5.324 12.903 -3.906 365 2HG GLN 50 HG1 GLN 50 -4.984 11.543 -4.975 366 1HE2 GLN 50 HE22 GLN 50 -6.361 9.782 -4.994 367 2HE2 GLN 50 HE21 GLN 50 -7.929 9.821 -4.269 368 H GLU 51 HN GLU 51 -0.486 10.749 -3.300 369 HA GLU 51 HA GLU 51 -0.475 8.509 -1.438 370 1HB GLU 51 HB2 GLU 51 1.251 9.333 -3.458 371 2HB GLU 51 HB1 GLU 51 2.111 9.728 -1.976 372 1HG GLU 51 HG1 GLU 51 2.718 7.522 -2.743 373 2HG GLU 51 HG2 GLU 51 1.849 7.420 -1.212 374 HA PRO 52 HA PRO 52 -0.228 11.675 1.787 375 1HB PRO 52 HB2 PRO 52 -1.234 10.195 3.777 376 2HB PRO 52 HB1 PRO 52 -2.269 10.842 2.499 377 1HG PRO 52 HG2 PRO 52 -1.156 8.082 2.826 378 2HG PRO 52 HG1 PRO 52 -2.782 8.580 2.326 379 1HD PRO 52 HD1 PRO 52 -0.792 7.814 0.587 380 2HD PRO 52 HD2 PRO 52 -2.150 8.867 0.150 381 H LEU 53 HN LEU 53 0.025 9.503 4.220 382 HA LEU 53 HA LEU 53 2.757 10.052 4.732 383 1HB LEU 53 HB2 LEU 53 0.530 8.894 6.085 384 2HB LEU 53 HB1 LEU 53 1.889 7.804 6.234 385 HG LEU 53 HG LEU 53 1.420 9.651 8.039 386 1HD1 LEU 53 HD11 LEU 53 3.702 8.198 7.171 387 2HD1 LEU 53 HD12 LEU 53 3.269 8.724 8.799 388 3HD1 LEU 53 HD13 LEU 53 4.221 9.782 7.751 389 1HD2 LEU 53 HD21 LEU 53 2.050 11.754 7.657 390 2HD2 LEU 53 HD22 LEU 53 1.813 11.339 5.959 391 3HD2 LEU 53 HD23 LEU 53 3.428 11.273 6.665 392 H THR 54 HN THR 54 4.557 8.874 4.379 393 HA THR 54 HA THR 54 4.632 6.104 3.925 394 HB THR 54 HB THR 54 5.631 7.120 1.417 395 HG1 THR 54 HG1 THR 54 3.920 8.058 0.588 396 1HG2 THR 54 HG21 THR 54 5.186 4.798 1.653 397 2HG2 THR 54 HG22 THR 54 4.042 5.447 0.477 398 3HG2 THR 54 HG23 THR 54 3.516 5.109 2.125 399 H ALA 55 HN ALA 55 6.921 5.633 2.725 400 HA ALA 55 HA ALA 55 8.875 6.333 4.510 401 1HB ALA 55 HB1 ALA 55 9.017 4.506 2.853 402 2HB ALA 55 HB2 ALA 55 10.486 5.478 2.955 403 3HB ALA 55 HB3 ALA 55 9.370 5.705 1.608 404 H SER 56 HN SER 56 7.888 8.084 1.621 405 HA SER 56 HA SER 56 10.092 9.871 1.552 406 1HB SER 56 HB1 SER 56 7.614 10.992 0.502 407 2HB SER 56 HB2 SER 56 9.118 10.608 -0.337 408 HG SER 56 HG SER 56 6.795 9.185 -0.185 409 H MET 57 HN MET 57 6.801 10.169 2.857 410 HA MET 57 HA MET 57 6.992 12.787 3.823 411 1HB MET 57 HB1 MET 57 5.376 10.397 4.676 412 2HB MET 57 HB2 MET 57 5.255 11.921 5.536 413 1HG MET 57 HG1 MET 57 3.657 11.226 3.508 414 2HG MET 57 HG2 MET 57 4.050 12.897 3.910 415 1HE MET 57 HE1 MET 57 5.007 9.816 2.088 416 2HE MET 57 HE2 MET 57 5.894 10.319 0.648 417 3HE MET 57 HE3 MET 57 4.133 10.418 0.679 418 H LEU 58 HN LEU 58 7.847 9.699 5.258 419 HA LEU 58 HA LEU 58 8.542 10.629 7.826 420 1HB LEU 58 HB1 LEU 58 9.711 8.275 6.351 421 2HB LEU 58 HB2 LEU 58 9.633 8.498 8.088 422 HG LEU 58 HG LEU 58 7.100 8.416 6.503 423 1HD1 LEU 58 HD21 LEU 58 7.331 6.307 5.876 424 2HD1 LEU 58 HD22 LEU 58 7.715 5.825 7.528 425 3HD1 LEU 58 HD23 LEU 58 9.003 6.341 6.438 426 1HD2 LEU 58 HD11 LEU 58 7.466 8.913 9.060 427 2HD2 LEU 58 HD12 LEU 58 7.526 7.152 9.159 428 3HD2 LEU 58 HD13 LEU 58 6.097 7.949 8.498 429 H ALA 59 HN ALA 59 10.420 10.085 4.888 430 HA ALA 59 HA ALA 59 12.944 10.755 5.930 431 1HB ALA 59 HB1 ALA 59 13.376 9.844 3.937 432 2HB ALA 59 HB2 ALA 59 13.101 11.459 3.283 433 3HB ALA 59 HB3 ALA 59 11.791 10.278 3.296 434 H SER 60 HN SER 60 10.242 12.683 5.453 435 HA SER 60 HA SER 60 11.663 15.125 4.823 436 1HB SER 60 HB2 SER 60 8.770 14.610 5.553 437 2HB SER 60 HB1 SER 60 9.419 16.191 5.115 438 HG SER 60 HG SER 60 10.153 14.425 3.260 439 H ALA 61 HN ALA 61 11.148 13.315 7.586 440 HA ALA 61 HA ALA 61 11.766 15.638 9.279 441 1HB ALA 61 HB1 ALA 61 10.356 14.533 11.082 442 2HB ALA 61 HB2 ALA 61 9.692 13.520 9.798 443 3HB ALA 61 HB3 ALA 61 9.480 15.270 9.739 444 HA PRO 62 HA PRO 62 14.508 12.048 10.367 445 1HB PRO 62 HB1 PRO 62 16.452 12.072 8.554 446 2HB PRO 62 HB2 PRO 62 14.859 11.426 8.145 447 1HG PRO 62 HG1 PRO 62 16.128 13.985 7.339 448 2HG PRO 62 HG2 PRO 62 14.918 13.013 6.487 449 1HD PRO 62 HD2 PRO 62 14.486 15.317 8.151 450 2HD PRO 62 HD1 PRO 62 13.272 14.336 7.305 451 HA PRO 63 HA PRO 63 15.134 11.541 11.867 452 1HB PRO 63 HB1 PRO 63 16.272 11.363 14.272 453 2HB PRO 63 HB2 PRO 63 17.204 11.024 12.810 454 1HG PRO 63 HG1 PRO 63 17.314 13.366 14.617 455 2HG PRO 63 HG2 PRO 63 18.573 12.695 13.569 456 1HD PRO 63 HD1 PRO 63 16.817 14.914 13.043 457 2HD PRO 63 HD2 PRO 63 18.092 14.253 11.999 458 H GLN 64 HN GLN 64 14.022 14.310 12.062 459 HA GLN 64 HA GLN 64 13.156 14.993 14.598 460 1HB GLN 64 HB1 GLN 64 12.854 16.117 12.202 461 2HB GLN 64 HB2 GLN 64 11.266 15.374 12.327 462 1HG GLN 64 HG2 GLN 64 12.405 17.143 14.469 463 2HG GLN 64 HG1 GLN 64 11.463 17.762 13.113 464 1HE2 GLN 64 HE21 GLN 64 11.253 16.937 16.235 465 2HE2 GLN 64 HE22 GLN 64 9.588 16.483 16.328 466 H GLU 65 HN GLU 65 10.630 13.925 12.385 467 HA GLU 65 HA GLU 65 9.610 12.212 14.538 468 1HB GLU 65 HB2 GLU 65 7.428 12.740 13.885 469 2HB GLU 65 HB1 GLU 65 8.295 14.258 13.698 470 1HG GLU 65 HG2 GLU 65 8.578 13.200 11.229 471 2HG GLU 65 HG1 GLU 65 6.997 12.585 11.694 472 H GLN 66 HN GLN 66 11.556 11.653 12.282 473 HA GLN 66 HA GLN 66 10.479 10.038 10.317 474 1HB GLN 66 HB2 GLN 66 12.961 10.784 10.869 475 2HB GLN 66 HB1 GLN 66 13.033 9.196 11.617 476 1HG GLN 66 HG2 GLN 66 11.846 8.956 9.033 477 2HG GLN 66 HG1 GLN 66 13.353 9.863 8.902 478 1HE2 GLN 66 HE21 GLN 66 14.417 8.219 7.833 479 2HE2 GLN 66 HE22 GLN 66 14.901 6.758 8.616 480 H LYS 67 HN LYS 67 11.685 9.012 13.513 481 HA LYS 67 HA LYS 67 10.341 6.438 13.142 482 1HB LYS 67 HB2 LYS 67 11.604 5.907 15.333 483 2HB LYS 67 HB1 LYS 67 12.524 6.033 13.841 484 1HG LYS 67 HG2 LYS 67 12.563 8.607 14.811 485 2HG LYS 67 HG1 LYS 67 12.680 7.619 16.269 486 1HD LYS 67 HD2 LYS 67 14.392 7.006 13.892 487 2HD LYS 67 HD1 LYS 67 14.847 8.298 15.005 488 1HE LYS 67 HE1 LYS 67 14.317 5.430 15.775 489 2HE LYS 67 HE2 LYS 67 15.911 6.157 15.577 490 1HZ LYS 67 HZ1 LYS 67 14.039 7.448 17.417 491 2HZ LYS 67 HZ2 LYS 67 15.723 7.324 17.502 492 3HZ LYS 67 HZ3 LYS 67 14.755 5.999 17.914 493 H GLN 68 HN GLN 68 8.782 8.798 13.635 494 HA GLN 68 HA GLN 68 7.541 7.977 16.170 495 1HB GLN 68 HB1 GLN 68 8.075 10.795 15.233 496 2HB GLN 68 HB2 GLN 68 6.943 10.405 16.520 497 1HG GLN 68 HG1 GLN 68 9.749 9.417 16.684 498 2HG GLN 68 HG2 GLN 68 9.386 11.096 17.079 499 1HE2 GLN 68 HE21 GLN 68 10.213 8.639 18.659 500 2HE2 GLN 68 HE22 GLN 68 9.106 8.607 19.985 501 H MET 69 HN MET 69 7.060 9.876 13.200 502 HA MET 69 HA MET 69 4.208 9.658 13.354 503 1HB MET 69 HB2 MET 69 4.196 10.871 11.251 504 2HB MET 69 HB1 MET 69 5.328 11.622 12.368 505 1HG MET 69 HG2 MET 69 7.058 11.298 11.005 506 2HG MET 69 HG1 MET 69 6.594 9.621 10.690 507 1HE MET 69 HE1 MET 69 6.631 13.237 9.508 508 2HE MET 69 HE2 MET 69 6.443 12.946 7.779 509 3HE MET 69 HE3 MET 69 7.760 12.177 8.664 510 H LEU 70 HN LEU 70 6.572 7.515 12.359 511 HA LEU 70 HA LEU 70 5.478 6.415 10.025 512 1HB LEU 70 HB1 LEU 70 6.598 4.234 11.250 513 2HB LEU 70 HB2 LEU 70 7.431 5.360 10.211 514 HG LEU 70 HG LEU 70 8.383 6.525 12.058 515 1HD1 LEU 70 HD21 LEU 70 7.106 6.776 13.872 516 2HD1 LEU 70 HD22 LEU 70 7.748 5.213 14.376 517 3HD1 LEU 70 HD23 LEU 70 6.194 5.302 13.548 518 1HD2 LEU 70 HD11 LEU 70 8.476 3.539 12.271 519 2HD2 LEU 70 HD12 LEU 70 9.455 4.572 13.314 520 3HD2 LEU 70 HD13 LEU 70 9.663 4.637 11.563 521 H GLY 71 HN GLY 71 4.688 5.883 13.408 522 1HA GLY 71 HA2 GLY 71 2.398 4.291 12.499 523 2HA GLY 71 HA1 GLY 71 3.419 3.644 13.764 524 H GLU 72 HN GLU 72 2.710 7.065 13.511 525 HA GLU 72 HA GLU 72 0.727 6.847 15.655 526 1HB GLU 72 HB2 GLU 72 1.889 8.028 17.195 527 2HB GLU 72 HB1 GLU 72 3.282 7.457 16.291 528 1HG GLU 72 HG2 GLU 72 3.802 9.505 15.545 529 2HG GLU 72 HG1 GLU 72 2.117 9.960 15.297 530 H ARG 73 HN ARG 73 1.648 8.120 12.729 531 HA ARG 73 HA ARG 73 -0.410 10.221 12.902 532 1HB ARG 73 HB1 ARG 73 2.213 10.755 12.546 533 2HB ARG 73 HB2 ARG 73 1.732 10.501 10.874 534 1HG ARG 73 HG1 ARG 73 -0.068 12.239 12.395 535 2HG ARG 73 HG2 ARG 73 1.573 12.862 12.206 536 1HD ARG 73 HD2 ARG 73 1.337 12.324 9.739 537 2HD ARG 73 HD1 ARG 73 -0.381 12.089 10.058 538 HE ARG 73 HE ARG 73 1.086 14.622 10.257 539 1HH1 ARG 73 HH12 ARG 73 -1.917 12.854 10.268 540 2HH1 ARG 73 HH11 ARG 73 -2.901 14.272 10.130 541 1HH2 ARG 73 HH22 ARG 73 -0.202 16.494 10.075 542 2HH2 ARG 73 HH21 ARG 73 -1.926 16.343 10.021 543 H LEU 74 HN LEU 74 0.875 7.484 11.338 544 HA LEU 74 HA LEU 74 -0.504 7.778 8.841 545 1HB LEU 74 HB1 LEU 74 1.309 5.889 10.126 546 2HB LEU 74 HB2 LEU 74 0.071 5.098 9.168 547 HG LEU 74 HG LEU 74 1.515 7.353 7.920 548 1HD1 LEU 74 HD11 LEU 74 3.488 6.225 7.529 549 2HD1 LEU 74 HD12 LEU 74 2.790 4.657 7.935 550 3HD1 LEU 74 HD13 LEU 74 3.141 5.822 9.212 551 1HD2 LEU 74 HD21 LEU 74 0.707 4.649 6.872 552 2HD2 LEU 74 HD22 LEU 74 1.183 6.066 5.936 553 3HD2 LEU 74 HD23 LEU 74 -0.332 6.076 6.840 554 H PHE 75 HN PHE 75 -1.144 6.315 11.925 555 HA PHE 75 HA PHE 75 -2.954 4.382 11.483 556 1HB PHE 75 HB2 PHE 75 -2.163 5.844 13.658 557 2HB PHE 75 HB1 PHE 75 -3.865 6.249 13.550 558 HD1 PHE 75 HD1 PHE 75 -2.947 2.977 12.333 559 HD2 PHE 75 HD2 PHE 75 -4.052 5.193 15.795 560 HE1 PHE 75 HE1 PHE 75 -3.494 0.880 13.497 561 HE2 PHE 75 HE2 PHE 75 -4.602 3.100 16.964 562 HZ PHE 75 HZ PHE 75 -4.324 0.940 15.816 563 HA PRO 76 HA PRO 76 -6.665 7.438 10.938 564 1HB PRO 76 HB1 PRO 76 -6.078 10.011 10.280 565 2HB PRO 76 HB2 PRO 76 -6.323 9.468 11.943 566 1HG PRO 76 HG2 PRO 76 -3.766 9.931 10.457 567 2HG PRO 76 HG1 PRO 76 -4.188 10.369 12.123 568 1HD PRO 76 HD2 PRO 76 -2.684 8.202 11.534 569 2HD PRO 76 HD1 PRO 76 -3.797 8.238 12.917 570 H LEU 77 HN LEU 77 -3.742 7.646 9.070 571 HA LEU 77 HA LEU 77 -5.144 8.224 6.600 572 1HB LEU 77 HB1 LEU 77 -2.236 7.663 7.183 573 2HB LEU 77 HB2 LEU 77 -2.866 8.071 5.598 574 HG LEU 77 HG LEU 77 -3.068 9.868 8.017 575 1HD1 LEU 77 HD11 LEU 77 -0.775 9.761 7.538 576 2HD1 LEU 77 HD12 LEU 77 -1.349 11.214 6.719 577 3HD1 LEU 77 HD13 LEU 77 -1.054 9.739 5.796 578 1HD2 LEU 77 HD21 LEU 77 -3.715 11.573 6.434 579 2HD2 LEU 77 HD22 LEU 77 -4.804 10.193 6.301 580 3HD2 LEU 77 HD23 LEU 77 -3.540 10.438 5.096 581 H ILE 78 HN ILE 78 -4.139 5.461 8.369 582 HA ILE 78 HA ILE 78 -3.880 3.653 6.162 583 HB ILE 78 HB ILE 78 -4.545 2.983 9.021 584 1HG1 ILE 78 HG12 ILE 78 -2.443 4.328 8.735 585 2HG1 ILE 78 HG11 ILE 78 -2.189 2.725 9.416 586 1HG2 ILE 78 HG21 ILE 78 -3.277 1.288 6.880 587 2HG2 ILE 78 HG22 ILE 78 -4.975 1.213 7.349 588 3HG2 ILE 78 HG23 ILE 78 -3.719 0.784 8.511 589 1HD1 ILE 78 HD11 ILE 78 -1.811 3.375 6.509 590 2HD1 ILE 78 HD12 ILE 78 -1.344 1.902 7.358 591 3HD1 ILE 78 HD13 ILE 78 -0.519 3.420 7.709 592 H GLN 79 HN GLN 79 -6.471 4.723 8.278 593 HA GLN 79 HA GLN 79 -8.466 2.870 7.659 594 1HB GLN 79 HB1 GLN 79 -8.361 5.658 8.631 595 2HB GLN 79 HB2 GLN 79 -9.863 5.213 7.837 596 1HG GLN 79 HG1 GLN 79 -10.552 4.161 9.656 597 2HG GLN 79 HG2 GLN 79 -9.116 3.139 9.649 598 1HE2 GLN 79 HE21 GLN 79 -9.887 6.537 10.343 599 2HE2 GLN 79 HE22 GLN 79 -9.014 6.608 11.832 600 H ALA 80 HN ALA 80 -6.900 5.131 5.711 601 HA ALA 80 HA ALA 80 -8.970 5.446 3.723 602 1HB ALA 80 HB1 ALA 80 -7.348 6.727 2.500 603 2HB ALA 80 HB2 ALA 80 -6.039 6.125 3.520 604 3HB ALA 80 HB3 ALA 80 -7.265 7.199 4.198 605 H MET 81 HN MET 81 -6.032 3.552 4.189 606 HA MET 81 HA MET 81 -5.988 2.413 1.571 607 1HB MET 81 HB1 MET 81 -4.820 0.979 3.921 608 2HB MET 81 HB2 MET 81 -4.179 1.158 2.295 609 1HG MET 81 HG2 MET 81 -4.344 3.699 3.645 610 2HG MET 81 HG1 MET 81 -3.408 2.539 4.567 611 1HE MET 81 HE1 MET 81 -1.192 1.237 3.450 612 2HE MET 81 HE2 MET 81 -1.156 2.663 4.488 613 3HE MET 81 HE3 MET 81 -0.118 2.584 3.063 614 H HIS 82 HN HIS 82 -7.232 1.390 4.699 615 HA HIS 82 HA HIS 82 -8.668 -0.810 3.365 616 1HB HIS 82 HB1 HIS 82 -7.122 -0.668 5.906 617 2HB HIS 82 HB2 HIS 82 -8.562 -1.676 5.900 618 HD2 HIS 82 HD2 HIS 82 -5.731 -1.372 3.157 619 HE1 HIS 82 HE1 HIS 82 -6.210 -5.407 4.340 620 HE2 HIS 82 HE2 HIS 82 -4.976 -3.825 2.784 621 HA PRO 83 HA PRO 83 -12.510 0.892 4.767 622 1HB PRO 83 HB1 PRO 83 -13.771 -1.403 5.659 623 2HB PRO 83 HB2 PRO 83 -13.721 -0.868 3.977 624 1HG PRO 83 HG2 PRO 83 -12.037 -2.903 5.372 625 2HG PRO 83 HG1 PRO 83 -12.713 -2.938 3.734 626 1HD PRO 83 HD2 PRO 83 -10.129 -2.365 4.176 627 2HD PRO 83 HD1 PRO 83 -11.049 -1.565 2.884 628 H THR 84 HN THR 84 -11.363 1.967 6.513 629 HA THR 84 HA THR 84 -10.758 2.397 8.668 630 HB THR 84 HB THR 84 -13.195 2.899 8.568 631 HG1 THR 84 HG1 THR 84 -13.047 2.033 11.131 632 1HG2 THR 84 HG21 THR 84 -14.496 1.069 8.374 633 2HG2 THR 84 HG22 THR 84 -14.514 1.222 10.130 634 3HG2 THR 84 HG23 THR 84 -13.431 0.064 9.357 635 H LEU 85 HN LEU 85 -9.785 -0.114 7.843 636 HA LEU 85 HA LEU 85 -10.206 -1.930 10.081 637 1HB LEU 85 HB1 LEU 85 -9.093 -2.114 7.364 638 2HB LEU 85 HB2 LEU 85 -8.241 -3.067 8.562 639 HG LEU 85 HG LEU 85 -11.207 -3.307 8.466 640 1HD1 LEU 85 HD11 LEU 85 -9.893 -5.194 6.699 641 2HD1 LEU 85 HD12 LEU 85 -9.777 -3.534 6.115 642 3HD1 LEU 85 HD13 LEU 85 -11.357 -4.242 6.452 643 1HD2 LEU 85 HD21 LEU 85 -9.830 -4.475 10.150 644 2HD2 LEU 85 HD22 LEU 85 -9.000 -5.324 8.846 645 3HD2 LEU 85 HD23 LEU 85 -10.724 -5.581 9.107 646 H ALA 86 HN ALA 86 -8.518 0.759 9.811 647 HA ALA 86 HA ALA 86 -5.899 -0.085 10.644 648 1HB ALA 86 HB1 ALA 86 -5.340 2.207 10.706 649 2HB ALA 86 HB2 ALA 86 -7.027 2.696 10.863 650 3HB ALA 86 HB3 ALA 86 -6.443 2.017 9.343 651 H GLY 87 HN GLY 87 -7.734 -1.241 12.353 652 1HA GLY 87 HA1 GLY 87 -7.995 0.308 14.768 653 2HA GLY 87 HA2 GLY 87 -8.358 -1.403 14.578 654 H LYS 88 HN LYS 88 -5.484 -1.382 13.296 655 HA LYS 88 HA LYS 88 -3.649 -0.886 15.357 656 1HB LYS 88 HB1 LYS 88 -4.869 -2.765 16.444 657 2HB LYS 88 HB2 LYS 88 -4.434 -3.796 15.093 658 1HG LYS 88 HG2 LYS 88 -2.993 -4.169 17.028 659 2HG LYS 88 HG1 LYS 88 -2.083 -3.569 15.636 660 1HD LYS 88 HD1 LYS 88 -2.846 -1.272 16.987 661 2HD LYS 88 HD2 LYS 88 -2.421 -2.406 18.271 662 1HE LYS 88 HE1 LYS 88 -0.332 -2.869 16.773 663 2HE LYS 88 HE2 LYS 88 -0.721 -1.305 16.070 664 1HZ LYS 88 HZ1 LYS 88 -0.830 -0.657 18.618 665 2HZ LYS 88 HZ2 LYS 88 0.619 -0.627 17.747 666 3HZ LYS 88 HZ3 LYS 88 0.259 -1.945 18.744 667 H ILE 89 HN ILE 89 -3.917 -0.619 12.465 668 HA ILE 89 HA ILE 89 -2.092 -2.543 11.336 669 HB ILE 89 HB ILE 89 -3.219 -0.041 10.089 670 1HG1 ILE 89 HG12 ILE 89 -3.997 -2.931 9.629 671 2HG1 ILE 89 HG11 ILE 89 -4.838 -1.889 10.771 672 1HG2 ILE 89 HG21 ILE 89 -2.499 -1.884 8.126 673 2HG2 ILE 89 HG22 ILE 89 -1.156 -1.888 9.271 674 3HG2 ILE 89 HG23 ILE 89 -1.672 -0.377 8.524 675 1HD1 ILE 89 HD11 ILE 89 -5.517 -0.420 8.991 676 2HD1 ILE 89 HD12 ILE 89 -5.982 -2.079 8.611 677 3HD1 ILE 89 HD13 ILE 89 -4.580 -1.355 7.825 678 H THR 90 HN THR 90 -1.784 0.896 10.692 679 HA THR 90 HA THR 90 0.966 0.979 10.601 680 HB THR 90 HB THR 90 -1.200 2.854 10.633 681 HG1 THR 90 HG1 THR 90 0.988 2.327 9.282 682 1HG2 THR 90 HG21 THR 90 0.873 3.493 12.566 683 2HG2 THR 90 HG22 THR 90 -0.701 4.248 12.285 684 3HG2 THR 90 HG23 THR 90 0.691 4.709 11.299 685 H GLY 91 HN GLY 91 -1.124 1.479 13.428 686 1HA GLY 91 HA2 GLY 91 0.836 2.301 15.251 687 2HA GLY 91 HA1 GLY 91 -0.627 1.419 15.674 688 H MET 92 HN MET 92 0.038 -0.835 13.961 689 HA MET 92 HA MET 92 1.778 -2.227 15.819 690 1HB MET 92 HB2 MET 92 0.238 -3.781 15.326 691 2HB MET 92 HB1 MET 92 -0.245 -2.970 13.846 692 1HG MET 92 HG2 MET 92 1.167 -4.188 12.554 693 2HG MET 92 HG1 MET 92 2.331 -4.429 13.854 694 1HE MET 92 HE1 MET 92 -0.596 -7.235 12.227 695 2HE MET 92 HE2 MET 92 -0.158 -5.608 11.704 696 3HE MET 92 HE3 MET 92 -1.507 -5.843 12.820 697 H LEU 93 HN LEU 93 1.940 -0.768 12.720 698 HA LEU 93 HA LEU 93 4.124 -2.129 11.618 699 1HB LEU 93 HB2 LEU 93 2.878 0.526 11.254 700 2HB LEU 93 HB1 LEU 93 4.482 0.298 10.594 701 HG LEU 93 HG LEU 93 2.680 -0.105 8.935 702 1HD1 LEU 93 HD11 LEU 93 4.520 -2.336 9.733 703 2HD1 LEU 93 HD12 LEU 93 4.690 -1.176 8.415 704 3HD1 LEU 93 HD13 LEU 93 3.484 -2.459 8.310 705 1HD2 LEU 93 HD21 LEU 93 1.833 -2.679 9.702 706 2HD2 LEU 93 HD22 LEU 93 0.863 -1.216 9.528 707 3HD2 LEU 93 HD23 LEU 93 1.580 -1.617 11.093 708 H LEU 94 HN LEU 94 3.937 -0.335 14.406 709 HA LEU 94 HA LEU 94 6.803 0.319 14.361 710 1HB LEU 94 HB1 LEU 94 4.435 1.507 15.659 711 2HB LEU 94 HB2 LEU 94 5.856 1.388 16.678 712 HG LEU 94 HG LEU 94 7.127 2.788 15.212 713 1HD1 LEU 94 HD11 LEU 94 6.275 1.839 13.093 714 2HD1 LEU 94 HD12 LEU 94 6.319 3.602 13.086 715 3HD1 LEU 94 HD13 LEU 94 4.785 2.757 13.310 716 1HD2 LEU 94 HD21 LEU 94 5.241 3.741 16.725 717 2HD2 LEU 94 HD22 LEU 94 4.471 4.145 15.191 718 3HD2 LEU 94 HD23 LEU 94 6.063 4.796 15.576 719 H GLU 95 HN GLU 95 5.527 -2.313 14.646 720 HA GLU 95 HA GLU 95 7.037 -3.301 16.846 721 1HB GLU 95 HB2 GLU 95 5.382 -3.918 18.373 722 2HB GLU 95 HB1 GLU 95 4.896 -2.300 17.887 723 1HG GLU 95 HG1 GLU 95 3.136 -3.099 16.567 724 2HG GLU 95 HG2 GLU 95 3.778 -4.742 16.554 725 H ILE 96 HN ILE 96 5.587 -3.634 13.927 726 HA ILE 96 HA ILE 96 4.738 -6.303 13.838 727 HB ILE 96 HB ILE 96 5.064 -6.247 11.448 728 1HG1 ILE 96 HG12 ILE 96 7.238 -5.279 11.241 729 2HG1 ILE 96 HG11 ILE 96 6.109 -4.277 10.343 730 1HG2 ILE 96 HG21 ILE 96 4.130 -3.664 11.233 731 2HG2 ILE 96 HG22 ILE 96 3.682 -4.146 12.872 732 3HG2 ILE 96 HG23 ILE 96 3.165 -5.117 11.492 733 1HD1 ILE 96 HD11 ILE 96 6.105 -3.019 12.725 734 2HD1 ILE 96 HD12 ILE 96 7.158 -2.605 11.372 735 3HD1 ILE 96 HD13 ILE 96 7.755 -3.640 12.670 736 H ASP 97 HN ASP 97 6.306 -7.248 11.629 737 HA ASP 97 HA ASP 97 8.201 -8.859 12.898 738 1HB ASP 97 HB1 ASP 97 6.961 -8.965 10.551 739 2HB ASP 97 HB2 ASP 97 8.452 -8.212 9.989 740 H ASN 98 HN ASN 98 8.372 -5.623 12.365 741 HA ASN 98 HA ASN 98 10.024 -4.112 12.710 742 1HB ASN 98 HB2 ASN 98 11.813 -4.761 13.870 743 2HB ASN 98 HB1 ASN 98 11.205 -6.404 13.733 744 1HD2 ASN 98 HD22 ASN 98 13.370 -4.027 12.348 745 2HD2 ASN 98 HD21 ASN 98 14.412 -5.155 11.557 746 H SER 99 HN SER 99 10.504 -6.617 10.348 747 HA SER 99 HA SER 99 12.275 -5.165 8.662 748 1HB SER 99 HB1 SER 99 10.376 -7.241 7.613 749 2HB SER 99 HB2 SER 99 12.034 -6.894 7.118 750 HG SER 99 HG SER 99 11.127 -8.593 9.024 751 H GLU 100 HN GLU 100 8.878 -5.161 9.198 752 HA GLU 100 HA GLU 100 8.260 -3.690 6.774 753 1HB GLU 100 HB1 GLU 100 6.333 -3.927 9.028 754 2HB GLU 100 HB2 GLU 100 6.047 -3.972 7.297 755 1HG GLU 100 HG1 GLU 100 7.454 -6.210 7.518 756 2HG GLU 100 HG2 GLU 100 6.789 -6.147 9.149 757 H LEU 101 HN LEU 101 9.131 -3.125 10.046 758 HA LEU 101 HA LEU 101 8.218 -0.401 10.167 759 1HB LEU 101 HB1 LEU 101 8.466 -1.496 12.257 760 2HB LEU 101 HB2 LEU 101 10.076 -2.062 11.857 761 HG LEU 101 HG LEU 101 10.448 0.629 11.753 762 1HD1 LEU 101 HD11 LEU 101 8.287 0.078 13.767 763 2HD1 LEU 101 HD12 LEU 101 8.306 1.289 12.485 764 3HD1 LEU 101 HD13 LEU 101 9.369 1.466 13.882 765 1HD2 LEU 101 HD21 LEU 101 11.609 -1.314 13.039 766 2HD2 LEU 101 HD22 LEU 101 10.622 -0.756 14.391 767 3HD2 LEU 101 HD23 LEU 101 11.766 0.344 13.621 768 H LEU 102 HN LEU 102 10.979 -2.141 9.060 769 HA LEU 102 HA LEU 102 12.655 0.221 8.805 770 1HB LEU 102 HB2 LEU 102 13.000 -2.702 8.575 771 2HB LEU 102 HB1 LEU 102 13.976 -1.749 7.475 772 HG LEU 102 HG LEU 102 14.836 -0.477 9.466 773 1HD1 LEU 102 HD21 LEU 102 14.601 -1.830 11.640 774 2HD1 LEU 102 HD22 LEU 102 13.176 -2.534 10.877 775 3HD1 LEU 102 HD23 LEU 102 13.261 -0.793 11.150 776 1HD2 LEU 102 HD11 LEU 102 15.531 -3.291 10.003 777 2HD2 LEU 102 HD12 LEU 102 16.568 -1.909 9.653 778 3HD2 LEU 102 HD13 LEU 102 15.737 -2.741 8.340 779 H HIS 103 HN HIS 103 11.113 -2.145 6.659 780 HA HIS 103 HA HIS 103 11.976 -0.973 4.269 781 1HB HIS 103 HB1 HIS 103 10.558 -3.231 5.010 782 2HB HIS 103 HB2 HIS 103 9.375 -2.294 4.113 783 HD2 HIS 103 HD2 HIS 103 10.102 -4.870 2.580 784 HE1 HIS 103 HE1 HIS 103 12.994 -2.592 0.490 785 HE2 HIS 103 HE2 HIS 103 11.644 -4.739 0.497 786 H MET 104 HN MET 104 9.035 -0.454 6.198 787 HA MET 104 HA MET 104 7.614 1.106 4.386 788 1HB MET 104 HB2 MET 104 6.316 1.863 6.231 789 2HB MET 104 HB1 MET 104 6.799 0.214 6.617 790 1HG MET 104 HG2 MET 104 8.758 1.333 7.837 791 2HG MET 104 HG1 MET 104 7.786 2.796 7.751 792 1HE MET 104 HE1 MET 104 4.742 0.570 8.258 793 2HE MET 104 HE2 MET 104 5.161 2.239 7.880 794 3HE MET 104 HE3 MET 104 4.545 1.829 9.481 795 H LEU 105 HN LEU 105 10.181 2.030 6.637 796 HA LEU 105 HA LEU 105 9.954 4.841 5.923 797 1HB LEU 105 HB1 LEU 105 12.268 3.727 7.451 798 2HB LEU 105 HB2 LEU 105 11.486 5.287 7.607 799 HG LEU 105 HG LEU 105 10.170 2.720 8.462 800 1HD1 LEU 105 HD11 LEU 105 11.861 4.621 10.078 801 2HD1 LEU 105 HD12 LEU 105 12.207 2.927 9.735 802 3HD1 LEU 105 HD13 LEU 105 10.836 3.357 10.758 803 1HD2 LEU 105 HD21 LEU 105 8.637 4.526 8.106 804 2HD2 LEU 105 HD22 LEU 105 9.652 5.628 9.036 805 3HD2 LEU 105 HD23 LEU 105 8.836 4.287 9.842 806 H GLU 106 HN GLU 106 11.319 2.115 4.638 807 HA GLU 106 HA GLU 106 13.548 3.582 3.439 808 1HB GLU 106 HB2 GLU 106 13.048 0.670 4.000 809 2HB GLU 106 HB1 GLU 106 14.270 1.161 2.827 810 1HG GLU 106 HG2 GLU 106 14.148 1.845 5.745 811 2HG GLU 106 HG1 GLU 106 15.297 0.766 4.953 812 H SER 107 HN SER 107 10.456 2.568 2.699 813 HA SER 107 HA SER 107 11.005 2.909 -0.152 814 1HB SER 107 HB2 SER 107 10.927 0.387 0.682 815 2HB SER 107 HB1 SER 107 9.189 0.655 0.562 816 HG SER 107 HG SER 107 11.131 0.605 -1.445 817 HA PRO 108 HA PRO 108 7.299 5.347 0.293 818 1HB PRO 108 HB1 PRO 108 7.265 5.390 -2.644 819 2HB PRO 108 HB2 PRO 108 7.447 6.727 -1.507 820 1HG PRO 108 HG2 PRO 108 9.495 5.867 -3.020 821 2HG PRO 108 HG1 PRO 108 9.737 6.478 -1.373 822 1HD PRO 108 HD1 PRO 108 9.642 3.645 -2.347 823 2HD PRO 108 HD2 PRO 108 10.739 4.394 -1.167 824 H GLU 109 HN GLU 109 7.544 2.265 -0.841 825 HA GLU 109 HA GLU 109 4.639 2.077 -1.316 826 1HB GLU 109 HB2 GLU 109 6.812 0.427 -2.625 827 2HB GLU 109 HB1 GLU 109 5.083 0.225 -2.873 828 1HG GLU 109 HG1 GLU 109 4.919 2.043 -4.222 829 2HG GLU 109 HG2 GLU 109 6.232 2.899 -3.415 830 H SER 110 HN SER 110 7.276 1.182 0.564 831 HA SER 110 HA SER 110 6.287 -1.406 1.344 832 1HB SER 110 HB1 SER 110 8.615 0.273 2.033 833 2HB SER 110 HB2 SER 110 8.014 -0.759 3.333 834 HG SER 110 HG SER 110 9.526 -1.451 1.284 835 H LEU 111 HN LEU 111 6.413 1.834 2.727 836 HA LEU 111 HA LEU 111 5.143 1.481 5.124 837 1HB LEU 111 HB1 LEU 111 6.013 3.601 3.949 838 2HB LEU 111 HB2 LEU 111 4.436 3.685 3.191 839 HG LEU 111 HG LEU 111 4.296 5.174 4.966 840 1HD1 LEU 111 HD21 LEU 111 2.521 4.426 6.181 841 2HD1 LEU 111 HD22 LEU 111 3.236 2.840 6.464 842 3HD1 LEU 111 HD23 LEU 111 2.541 3.227 4.891 843 1HD2 LEU 111 HD11 LEU 111 5.185 4.903 7.120 844 2HD2 LEU 111 HD12 LEU 111 6.433 4.331 6.006 845 3HD2 LEU 111 HD13 LEU 111 5.426 3.173 6.888 846 H ARG 112 HN ARG 112 3.743 1.672 1.884 847 HA ARG 112 HA ARG 112 1.058 1.335 2.818 848 1HB ARG 112 HB2 ARG 112 0.882 2.425 0.856 849 2HB ARG 112 HB1 ARG 112 2.404 1.786 0.247 850 1HG ARG 112 HG1 ARG 112 1.376 -0.186 -0.528 851 2HG ARG 112 HG2 ARG 112 -0.112 0.148 0.363 852 1HD ARG 112 HD2 ARG 112 -0.247 2.278 -1.067 853 2HD ARG 112 HD1 ARG 112 0.940 1.488 -2.106 854 HE ARG 112 HE ARG 112 -0.893 -0.406 -1.990 855 1HH1 ARG 112 HH21 ARG 112 -1.309 3.034 -2.369 856 2HH1 ARG 112 HH22 ARG 112 -2.771 2.885 -3.286 857 1HH2 ARG 112 HH12 ARG 112 -2.818 -0.608 -3.196 858 2HH2 ARG 112 HH11 ARG 112 -3.628 0.816 -3.755 859 H SER 113 HN SER 113 3.081 -0.722 0.710 860 HA SER 113 HA SER 113 1.488 -2.949 0.645 861 1HB SER 113 HB2 SER 113 3.419 -2.869 -0.759 862 2HB SER 113 HB1 SER 113 4.502 -2.736 0.626 863 HG SER 113 HG SER 113 3.370 -4.958 -0.511 864 H LYS 114 HN LYS 114 4.140 -2.383 2.948 865 HA LYS 114 HA LYS 114 3.752 -4.665 4.494 866 1HB LYS 114 HB1 LYS 114 4.800 -1.981 5.411 867 2HB LYS 114 HB2 LYS 114 5.040 -3.519 6.231 868 1HG LYS 114 HG1 LYS 114 6.013 -2.937 3.445 869 2HG LYS 114 HG2 LYS 114 6.991 -2.726 4.900 870 1HD LYS 114 HD1 LYS 114 7.506 -4.889 4.908 871 2HD LYS 114 HD2 LYS 114 5.795 -5.323 4.936 872 1HE LYS 114 HE1 LYS 114 5.764 -4.992 2.453 873 2HE LYS 114 HE2 LYS 114 7.516 -4.806 2.517 874 1HZ LYS 114 HZ1 LYS 114 6.997 -7.120 3.891 875 2HZ LYS 114 HZ2 LYS 114 7.621 -6.999 2.325 876 3HZ LYS 114 HZ3 LYS 114 5.956 -7.187 2.560 877 H VAL 115 HN VAL 115 2.049 -1.595 4.519 878 HA VAL 115 HA VAL 115 0.805 -2.036 7.069 879 HB VAL 115 HB VAL 115 0.606 0.021 4.957 880 1HG1 VAL 115 HG11 VAL 115 -1.650 -0.107 6.924 881 2HG1 VAL 115 HG12 VAL 115 -1.784 -0.919 5.365 882 3HG1 VAL 115 HG13 VAL 115 -1.527 0.826 5.430 883 1HG2 VAL 115 HG21 VAL 115 0.110 0.728 7.742 884 2HG2 VAL 115 HG22 VAL 115 1.322 1.338 6.613 885 3HG2 VAL 115 HG23 VAL 115 1.614 -0.160 7.498 886 H ASP 116 HN ASP 116 -0.414 -2.152 3.713 887 HA ASP 116 HA ASP 116 -2.928 -3.202 4.253 888 1HB ASP 116 HB1 ASP 116 -2.793 -2.586 2.054 889 2HB ASP 116 HB2 ASP 116 -1.124 -3.125 1.901 890 H GLU 117 HN GLU 117 0.189 -4.763 4.064 891 HA GLU 117 HA GLU 117 -0.872 -7.443 4.085 892 1HB GLU 117 HB2 GLU 117 1.195 -7.758 3.260 893 2HB GLU 117 HB1 GLU 117 1.716 -6.167 3.796 894 1HG GLU 117 HG1 GLU 117 2.573 -6.947 5.763 895 2HG GLU 117 HG2 GLU 117 1.520 -8.361 5.793 896 H ALA 118 HN ALA 118 0.458 -5.132 6.375 897 HA ALA 118 HA ALA 118 0.529 -6.814 8.632 898 1HB ALA 118 HB1 ALA 118 0.847 -4.907 9.924 899 2HB ALA 118 HB2 ALA 118 -0.073 -3.887 8.817 900 3HB ALA 118 HB3 ALA 118 1.528 -4.466 8.355 901 H VAL 119 HN VAL 119 -2.048 -5.283 6.923 902 HA VAL 119 HA VAL 119 -4.002 -5.326 8.986 903 HB VAL 119 HB VAL 119 -4.569 -5.598 6.053 904 1HG1 VAL 119 HG11 VAL 119 -6.453 -5.998 7.500 905 2HG1 VAL 119 HG12 VAL 119 -6.649 -4.428 6.719 906 3HG1 VAL 119 HG13 VAL 119 -6.123 -4.515 8.398 907 1HG2 VAL 119 HG21 VAL 119 -3.279 -3.438 7.427 908 2HG2 VAL 119 HG22 VAL 119 -4.861 -2.922 6.839 909 3HG2 VAL 119 HG23 VAL 119 -3.679 -3.593 5.717 910 H ALA 120 HN ALA 120 -3.246 -7.499 6.295 911 HA ALA 120 HA ALA 120 -5.120 -9.497 6.884 912 1HB ALA 120 HB1 ALA 120 -2.602 -10.533 5.862 913 2HB ALA 120 HB2 ALA 120 -3.138 -9.096 4.987 914 3HB ALA 120 HB3 ALA 120 -4.197 -10.505 5.107 915 H VAL 121 HN VAL 121 -2.138 -8.590 8.322 916 HA VAL 121 HA VAL 121 -1.772 -11.042 9.808 917 HB VAL 121 HB VAL 121 -0.302 -8.431 9.627 918 1HG1 VAL 121 HG21 VAL 121 0.547 -8.584 11.657 919 2HG1 VAL 121 HG22 VAL 121 1.133 -10.211 11.303 920 3HG1 VAL 121 HG23 VAL 121 -0.478 -9.984 11.985 921 1HG2 VAL 121 HG11 VAL 121 0.808 -11.201 9.350 922 2HG2 VAL 121 HG12 VAL 121 1.428 -9.685 8.694 923 3HG2 VAL 121 HG13 VAL 121 -0.031 -10.409 8.015 924 H LEU 122 HN LEU 122 -3.066 -7.830 10.283 925 HA LEU 122 HA LEU 122 -3.274 -8.037 13.135 926 1HB LEU 122 HB2 LEU 122 -3.547 -5.841 12.934 927 2HB LEU 122 HB1 LEU 122 -3.558 -6.003 11.190 928 HG LEU 122 HG LEU 122 -6.158 -6.676 11.988 929 1HD1 LEU 122 HD11 LEU 122 -6.706 -4.470 13.193 930 2HD1 LEU 122 HD12 LEU 122 -4.999 -4.461 13.634 931 3HD1 LEU 122 HD13 LEU 122 -6.032 -5.798 14.138 932 1HD2 LEU 122 HD21 LEU 122 -5.822 -5.547 9.974 933 2HD2 LEU 122 HD22 LEU 122 -4.892 -4.261 10.743 934 3HD2 LEU 122 HD23 LEU 122 -6.634 -4.365 11.001 935 H GLN 123 HN GLN 123 -5.343 -8.625 10.374 936 HA GLN 123 HA GLN 123 -7.764 -9.030 11.768 937 1HB GLN 123 HB1 GLN 123 -6.731 -9.919 9.083 938 2HB GLN 123 HB2 GLN 123 -8.303 -10.447 9.670 939 1HG GLN 123 HG2 GLN 123 -8.142 -7.638 10.003 940 2HG GLN 123 HG1 GLN 123 -7.606 -8.027 8.370 941 1HE2 GLN 123 HE21 GLN 123 -9.085 -8.485 6.872 942 2HE2 GLN 123 HE22 GLN 123 -10.774 -8.693 7.171 943 H ALA 124 HN ALA 124 -5.089 -11.125 10.870 944 HA ALA 124 HA ALA 124 -6.216 -13.575 11.751 945 1HB ALA 124 HB1 ALA 124 -4.321 -13.597 10.273 946 2HB ALA 124 HB2 ALA 124 -3.856 -14.359 11.795 947 3HB ALA 124 HB3 ALA 124 -3.344 -12.708 11.443 948 H HIS 125 HN HIS 125 -3.398 -12.093 13.272 949 HA HIS 125 HA HIS 125 -3.354 -13.205 15.664 950 1HB HIS 125 HB1 HIS 125 -2.227 -10.933 14.633 951 2HB HIS 125 HB2 HIS 125 -3.182 -10.277 15.959 952 HD2 HIS 125 HD2 HIS 125 -1.574 -9.996 18.063 953 HE1 HIS 125 HE1 HIS 125 0.658 -13.556 17.551 954 HE2 HIS 125 HE2 HIS 125 0.310 -11.510 19.010 955 H GLN 126 HN GLN 126 -5.780 -10.856 14.723 956 HA GLN 126 HA GLN 126 -6.898 -10.560 17.339 957 1HB GLN 126 HB1 GLN 126 -7.699 -9.758 14.572 958 2HB GLN 126 HB2 GLN 126 -8.900 -9.707 15.855 959 1HG GLN 126 HG1 GLN 126 -7.154 -8.333 17.147 960 2HG GLN 126 HG2 GLN 126 -6.377 -8.126 15.577 961 1HE2 GLN 126 HE22 GLN 126 -8.439 -7.826 13.882 962 2HE2 GLN 126 HE21 GLN 126 -9.355 -6.415 14.275 963 H ALA 127 HN ALA 127 -8.607 -11.787 14.466 964 HA ALA 127 HA ALA 127 -10.092 -13.597 16.204 965 1HB ALA 127 HB1 ALA 127 -10.656 -12.135 13.770 966 2HB ALA 127 HB2 ALA 127 -11.758 -12.777 14.987 967 3HB ALA 127 HB3 ALA 127 -11.185 -13.815 13.681 968 H LYS 128 HN LYS 128 -7.332 -14.321 15.428 969 HA LYS 128 HA LYS 128 -7.798 -16.605 13.645 970 1HB LYS 128 HB2 LYS 128 -5.400 -16.867 13.541 971 2HB LYS 128 HB1 LYS 128 -5.795 -15.181 13.235 972 1HG LYS 128 HG1 LYS 128 -4.558 -14.509 14.952 973 2HG LYS 128 HG2 LYS 128 -5.308 -15.677 16.041 974 1HD LYS 128 HD1 LYS 128 -3.612 -17.133 15.837 975 2HD LYS 128 HD2 LYS 128 -3.470 -16.865 14.098 976 1HE LYS 128 HE2 LYS 128 -1.787 -15.425 14.360 977 2HE LYS 128 HE1 LYS 128 -2.627 -14.558 15.644 978 1HZ LYS 128 HZ1 LYS 128 -0.713 -15.435 16.630 979 2HZ LYS 128 HZ2 LYS 128 -0.893 -16.942 15.883 980 3HZ LYS 128 HZ3 LYS 128 -1.951 -16.479 17.120 981 H GLU 129 HN GLU 129 -5.610 -18.121 14.740 982 HA GLU 129 HA GLU 129 -7.013 -19.398 16.956 983 1HB GLU 129 HB2 GLU 129 -4.409 -20.354 15.806 984 2HB GLU 129 HB1 GLU 129 -5.692 -21.285 16.560 985 1HG GLU 129 HG1 GLU 129 -6.522 -21.763 14.575 986 2HG GLU 129 HG2 GLU 129 -6.776 -20.046 14.263 987 H ALA 130 HN ALA 130 -5.552 -16.780 17.002 988 HA ALA 130 HA ALA 130 -3.134 -16.942 18.342 989 1HB ALA 130 HB1 ALA 130 -3.243 -14.707 18.378 990 2HB ALA 130 HB2 ALA 130 -4.822 -14.697 19.163 991 3HB ALA 130 HB3 ALA 130 -4.707 -14.920 17.415 992 H ALA 131 HN ALA 131 -6.402 -16.549 19.710 993 HA ALA 131 HA ALA 131 -5.406 -16.955 22.402 994 1HB ALA 131 HB1 ALA 131 -7.307 -15.362 21.645 995 2HB ALA 131 HB2 ALA 131 -7.476 -16.255 23.158 996 3HB ALA 131 HB3 ALA 131 -8.308 -16.812 21.706 997 H GLN 132 HN GLN 132 -7.583 -18.337 23.512 998 HA GLN 132 HA GLN 132 -6.777 -21.020 23.070 999 1HB GLN 132 HB2 GLN 132 -8.982 -19.746 24.671 1000 2HB GLN 132 HB1 GLN 132 -8.847 -21.494 24.543 1001 1HG GLN 132 HG1 GLN 132 -6.291 -20.505 25.214 1002 2HG GLN 132 HG2 GLN 132 -7.460 -19.713 26.268 1003 1HE2 GLN 132 HE21 GLN 132 -5.503 -22.314 25.987 1004 2HE2 GLN 132 HE22 GLN 132 -6.307 -23.408 27.056 1005 H LYS 133 HN LYS 133 -10.160 -19.966 22.973 1006 HA LYS 133 HA LYS 133 -10.668 -21.876 20.841 1007 1HB LYS 133 HB1 LYS 133 -12.559 -20.118 22.417 1008 2HB LYS 133 HB2 LYS 133 -13.049 -21.336 21.247 1009 1HG LYS 133 HG2 LYS 133 -11.271 -22.312 23.365 1010 2HG LYS 133 HG1 LYS 133 -12.852 -21.750 23.912 1011 1HD LYS 133 HD2 LYS 133 -13.971 -23.412 22.833 1012 2HD LYS 133 HD1 LYS 133 -12.793 -23.500 21.521 1013 1HE LYS 133 HE1 LYS 133 -12.452 -24.578 24.317 1014 2HE LYS 133 HE2 LYS 133 -12.723 -25.525 22.855 1015 1HZ LYS 133 HZ1 LYS 133 -10.497 -23.822 22.505 1016 2HZ LYS 133 HZ2 LYS 133 -10.562 -25.512 22.443 1017 3HZ LYS 133 HZ3 LYS 133 -10.295 -24.728 23.918 1018 H ALA 134 HN ALA 134 -12.434 -21.053 19.211 1019 HA ALA 134 HA ALA 134 -11.177 -19.063 17.616 1020 1HB ALA 134 HB1 ALA 134 -13.698 -19.401 16.547 1021 2HB ALA 134 HB2 ALA 134 -13.372 -20.945 17.335 1022 3HB ALA 134 HB3 ALA 134 -12.253 -20.321 16.123 1023 H VAL 135 HN VAL 135 -13.763 -19.034 19.940 1024 HA VAL 135 HA VAL 135 -14.838 -16.491 19.156 1025 HB VAL 135 HB VAL 135 -15.205 -17.773 21.854 1026 1HG1 VAL 135 HG11 VAL 135 -16.662 -15.750 20.213 1027 2HG1 VAL 135 HG12 VAL 135 -16.226 -15.709 21.921 1028 3HG1 VAL 135 HG13 VAL 135 -17.551 -16.736 21.373 1029 1HG2 VAL 135 HG21 VAL 135 -15.574 -19.420 19.995 1030 2HG2 VAL 135 HG22 VAL 135 -16.869 -18.370 19.418 1031 3HG2 VAL 135 HG23 VAL 135 -16.980 -19.112 21.014 1032 H ASN 136 HN ASN 136 -14.608 -14.507 20.200 1033 HA ASN 136 HA ASN 136 -12.027 -14.086 21.421 1034 1HB ASN 136 HB1 ASN 136 -14.220 -12.326 20.404 1035 2HB ASN 136 HB2 ASN 136 -13.039 -11.648 21.520 1036 1HD2 ASN 136 HD21 ASN 136 -13.749 -12.152 18.345 1037 2HD2 ASN 136 HD22 ASN 136 -12.167 -11.986 17.670 1038 H SER 137 HN SER 137 -11.639 -13.220 23.471 1039 HA SER 137 HA SER 137 -13.755 -13.792 25.417 1040 1HB SER 137 HB1 SER 137 -11.772 -14.978 25.958 1041 2HB SER 137 HB2 SER 137 -10.754 -13.569 25.652 1042 HG SER 137 HG SER 137 -11.612 -14.304 27.951 1043 H ALA 138 HN ALA 138 -13.943 -12.340 27.300 1044 HA ALA 138 HA ALA 138 -14.270 -9.640 26.458 1045 1HB ALA 138 HB1 ALA 138 -14.343 -10.158 29.346 1046 2HB ALA 138 HB2 ALA 138 -15.419 -11.166 28.379 1047 3HB ALA 138 HB3 ALA 138 -15.543 -9.409 28.293 1048 H THR 139 HN THR 139 -13.556 -8.121 28.642 1049 HA THR 139 HA THR 139 -10.693 -7.891 28.225 1050 HB THR 139 HB THR 139 -11.107 -5.825 29.775 1051 HG1 THR 139 HG1 THR 139 -13.536 -6.914 29.704 1052 1HG2 THR 139 HG21 THR 139 -10.656 -5.592 27.401 1053 2HG2 THR 139 HG22 THR 139 -11.906 -4.466 27.930 1054 3HG2 THR 139 HG23 THR 139 -12.351 -5.922 27.040 1055 H GLY 140 HN GLY 140 -12.638 -7.496 31.184 1056 1HA GLY 140 HA1 GLY 140 -10.436 -8.593 32.746 1057 2HA GLY 140 HA2 GLY 140 -11.879 -7.818 33.381 1058 H VAL 141 HN VAL 141 -10.811 -10.758 31.695 1059 HA VAL 141 HA VAL 141 -13.087 -12.217 32.808 1060 HB VAL 141 HB VAL 141 -11.972 -14.130 31.408 1061 1HG1 VAL 141 HG21 VAL 141 -14.115 -13.367 30.821 1062 2HG1 VAL 141 HG22 VAL 141 -13.152 -13.211 29.351 1063 3HG1 VAL 141 HG23 VAL 141 -13.509 -11.786 30.329 1064 1HG2 VAL 141 HG11 VAL 141 -9.915 -12.770 30.978 1065 2HG2 VAL 141 HG12 VAL 141 -10.897 -11.723 29.952 1066 3HG2 VAL 141 HG13 VAL 141 -10.683 -13.422 29.531 1067 HA PRO 142 HA PRO 142 -10.093 -13.566 35.929 1068 1HB PRO 142 HB2 PRO 142 -11.876 -14.220 37.822 1069 2HB PRO 142 HB1 PRO 142 -11.479 -12.534 37.467 1070 1HG PRO 142 HG2 PRO 142 -13.842 -14.152 36.592 1071 2HG PRO 142 HG1 PRO 142 -13.786 -12.478 37.173 1072 1HD PRO 142 HD2 PRO 142 -13.912 -13.177 34.523 1073 2HD PRO 142 HD1 PRO 142 -13.215 -11.657 35.114 1074 H THR 143 HN THR 143 -9.216 -15.539 36.089 1075 HA THR 143 HA THR 143 -10.810 -17.844 35.226 1076 HB THR 143 HB THR 143 -8.638 -17.349 34.075 1077 HG1 THR 143 HG1 THR 143 -8.224 -19.443 33.868 1078 1HG2 THR 143 HG21 THR 143 -6.912 -18.584 35.978 1079 2HG2 THR 143 HG22 THR 143 -7.624 -17.129 36.678 1080 3HG2 THR 143 HG23 THR 143 -6.742 -17.036 35.152 1081 H VAL 144 HN VAL 144 -9.517 -16.379 37.994 1082 HA VAL 144 HA VAL 144 -9.888 -18.864 39.537 1083 HB VAL 144 HB VAL 144 -7.562 -18.241 39.625 1084 1HG1 VAL 144 HG11 VAL 144 -8.639 -15.564 39.759 1085 2HG1 VAL 144 HG12 VAL 144 -7.016 -16.106 39.333 1086 3HG1 VAL 144 HG13 VAL 144 -7.442 -15.843 41.023 1087 1HG2 VAL 144 HG21 VAL 144 -8.548 -17.269 42.264 1088 2HG2 VAL 144 HG22 VAL 144 -7.261 -18.417 41.894 1089 3HG2 VAL 144 HG23 VAL 144 -8.949 -18.906 41.746 Start of MODEL 14 1 1H GLY 1 HT1 GLY 1 39.338 21.097 16.164 2 2H GLY 1 HT2 GLY 1 40.818 21.764 16.640 3 3H GLY 1 HT3 GLY 1 39.372 22.377 17.269 4 1HA GLY 1 HA1 GLY 1 39.574 19.581 17.743 5 2HA GLY 1 HA2 GLY 1 40.969 20.433 18.387 6 HA PRO 2 HA PRO 2 37.056 22.194 20.643 7 1HB PRO 2 HB2 PRO 2 34.811 20.688 20.514 8 2HB PRO 2 HB1 PRO 2 35.175 21.959 19.341 9 1HG PRO 2 HG2 PRO 2 35.562 18.997 19.109 10 2HG PRO 2 HG1 PRO 2 34.917 20.137 17.913 11 1HD PRO 2 HD2 PRO 2 37.471 19.229 17.841 12 2HD PRO 2 HD1 PRO 2 37.013 20.848 17.275 13 H LEU 3 HN LEU 3 36.982 21.838 22.790 14 HA LEU 3 HA LEU 3 37.676 19.159 23.746 15 1HB LEU 3 HB2 LEU 3 38.558 21.706 24.443 16 2HB LEU 3 HB1 LEU 3 37.523 21.230 25.776 17 HG LEU 3 HG LEU 3 39.244 19.039 25.125 18 1HD1 LEU 3 HD11 LEU 3 40.459 21.567 24.654 19 2HD1 LEU 3 HD12 LEU 3 41.188 19.963 24.605 20 3HD1 LEU 3 HD13 LEU 3 41.156 20.871 26.117 21 1HD2 LEU 3 HD21 LEU 3 40.023 19.501 27.483 22 2HD2 LEU 3 HD22 LEU 3 38.292 19.232 27.276 23 3HD2 LEU 3 HD23 LEU 3 38.911 20.870 27.486 24 H GLY 4 HN GLY 4 35.076 21.420 23.669 25 1HA GLY 4 HA2 GLY 4 33.642 20.261 25.893 26 2HA GLY 4 HA1 GLY 4 33.043 21.489 24.789 27 H SER 5 HN SER 5 33.775 18.025 25.010 28 HA SER 5 HA SER 5 32.050 17.441 22.756 29 1HB SER 5 HB1 SER 5 33.587 15.608 24.616 30 2HB SER 5 HB2 SER 5 32.697 15.082 23.187 31 HG SER 5 HG SER 5 34.832 15.355 22.614 32 H ALA 6 HN ALA 6 30.085 18.276 23.682 33 HA ALA 6 HA ALA 6 28.825 16.353 25.521 34 1HB ALA 6 HB1 ALA 6 29.188 18.253 26.869 35 2HB ALA 6 HB2 ALA 6 27.489 18.315 26.400 36 3HB ALA 6 HB3 ALA 6 28.665 19.353 25.594 37 H ALA 7 HN ALA 7 26.302 16.905 25.502 38 HA ALA 7 HA ALA 7 25.509 16.592 22.715 39 1HB ALA 7 HB1 ALA 7 23.702 16.341 25.100 40 2HB ALA 7 HB2 ALA 7 24.772 15.035 24.587 41 3HB ALA 7 HB3 ALA 7 23.518 15.627 23.497 42 H ALA 8 HN ALA 8 25.649 18.717 21.955 43 HA ALA 8 HA ALA 8 23.311 20.305 22.390 44 1HB ALA 8 HB1 ALA 8 25.319 22.218 22.874 45 2HB ALA 8 HB2 ALA 8 25.611 20.881 23.987 46 3HB ALA 8 HB3 ALA 8 24.041 21.683 23.966 47 H ALA 9 HN ALA 9 22.874 20.535 20.281 48 HA ALA 9 HA ALA 9 24.700 22.097 18.657 49 1HB ALA 9 HB1 ALA 9 25.585 20.295 17.672 50 2HB ALA 9 HB2 ALA 9 24.043 20.180 16.823 51 3HB ALA 9 HB3 ALA 9 24.322 19.226 18.281 52 H THR 10 HN THR 10 21.593 20.849 19.395 53 HA THR 10 HA THR 10 20.350 22.910 17.806 54 HB THR 10 HB THR 10 18.986 20.381 17.284 55 HG1 THR 10 HG1 THR 10 21.475 20.787 16.006 56 1HG2 THR 10 HG21 THR 10 19.828 22.761 15.707 57 2HG2 THR 10 HG22 THR 10 18.216 22.095 15.971 58 3HG2 THR 10 HG23 THR 10 19.341 21.280 14.885 59 HA PRO 11 HA PRO 11 17.046 20.839 20.703 60 1HB PRO 11 HB1 PRO 11 17.984 19.017 22.501 61 2HB PRO 11 HB2 PRO 11 17.318 18.573 20.925 62 1HG PRO 11 HG2 PRO 11 20.179 18.872 21.761 63 2HG PRO 11 HG1 PRO 11 19.429 17.604 20.771 64 1HD PRO 11 HD2 PRO 11 20.823 19.630 19.674 65 2HD PRO 11 HD1 PRO 11 19.402 18.928 18.874 66 H ALA 12 HN ALA 12 20.340 21.057 21.995 67 HA ALA 12 HA ALA 12 19.404 22.362 24.414 68 1HB ALA 12 HB1 ALA 12 22.290 22.321 23.921 69 2HB ALA 12 HB2 ALA 12 21.526 20.731 23.910 70 3HB ALA 12 HB3 ALA 12 21.367 21.777 25.322 71 H VAL 13 HN VAL 13 18.463 24.113 22.978 72 HA VAL 13 HA VAL 13 20.345 25.999 21.859 73 HB VAL 13 HB VAL 13 18.117 25.604 20.832 74 1HG1 VAL 13 HG11 VAL 13 16.224 25.729 21.988 75 2HG1 VAL 13 HG12 VAL 13 16.610 27.357 22.545 76 3HG1 VAL 13 HG13 VAL 13 17.191 25.956 23.445 77 1HG2 VAL 13 HG21 VAL 13 18.995 27.557 20.037 78 2HG2 VAL 13 HG22 VAL 13 19.085 28.298 21.635 79 3HG2 VAL 13 HG23 VAL 13 17.533 28.177 20.805 80 H ARG 14 HN ARG 14 20.728 28.101 22.598 81 HA ARG 14 HA ARG 14 20.478 28.400 25.482 82 1HB ARG 14 HB1 ARG 14 22.069 30.233 25.240 83 2HB ARG 14 HB2 ARG 14 22.662 28.793 24.425 84 1HG ARG 14 HG2 ARG 14 21.769 29.769 22.285 85 2HG ARG 14 HG1 ARG 14 21.489 31.264 23.181 86 1HD ARG 14 HD2 ARG 14 23.917 31.209 23.825 87 2HD ARG 14 HD1 ARG 14 24.116 29.880 22.684 88 HE ARG 14 HE ARG 14 23.527 32.670 22.022 89 1HH1 ARG 14 HH11 ARG 14 24.218 29.413 20.989 90 2HH1 ARG 14 HH12 ARG 14 24.581 29.871 19.358 91 1HH2 ARG 14 HH21 ARG 14 24.004 33.280 19.878 92 2HH2 ARG 14 HH22 ARG 14 24.460 32.068 18.727 93 H THR 15 HN THR 15 18.456 29.017 23.086 94 HA THR 15 HA THR 15 17.669 31.690 24.012 95 HB THR 15 HB THR 15 16.422 31.923 21.997 96 HG1 THR 15 HG1 THR 15 15.451 29.965 21.763 97 1HG2 THR 15 HG21 THR 15 19.165 31.278 21.866 98 2HG2 THR 15 HG22 THR 15 18.217 32.293 20.779 99 3HG2 THR 15 HG23 THR 15 18.374 30.566 20.460 100 H VAL 16 HN VAL 16 15.365 32.108 24.341 101 HA VAL 16 HA VAL 16 14.110 29.848 25.712 102 HB VAL 16 HB VAL 16 13.210 32.716 25.858 103 1HG1 VAL 16 HG11 VAL 16 12.311 31.962 28.044 104 2HG1 VAL 16 HG12 VAL 16 12.816 30.320 27.644 105 3HG1 VAL 16 HG13 VAL 16 11.594 31.129 26.664 106 1HG2 VAL 16 HG21 VAL 16 15.204 31.329 27.647 107 2HG2 VAL 16 HG22 VAL 16 14.551 32.951 27.878 108 3HG2 VAL 16 HG23 VAL 16 15.576 32.602 26.486 109 HA PRO 17 HA PRO 17 10.511 31.400 22.903 110 1HB PRO 17 HB2 PRO 17 11.069 33.118 20.892 111 2HB PRO 17 HB1 PRO 17 10.660 33.667 22.521 112 1HG PRO 17 HG2 PRO 17 13.351 33.388 21.234 113 2HG PRO 17 HG1 PRO 17 12.722 34.710 22.236 114 1HD PRO 17 HD2 PRO 17 14.361 32.778 23.209 115 2HD PRO 17 HD1 PRO 17 13.127 33.581 24.200 116 H GLN 18 HN GLN 18 9.914 29.890 21.481 117 HA GLN 18 HA GLN 18 11.914 28.563 19.868 118 1HB GLN 18 HB2 GLN 18 8.957 28.060 20.239 119 2HB GLN 18 HB1 GLN 18 10.008 27.060 19.246 120 1HG GLN 18 HG1 GLN 18 11.363 27.091 21.600 121 2HG GLN 18 HG2 GLN 18 9.690 27.159 22.151 122 1HE2 GLN 18 HE21 GLN 18 10.704 25.017 22.984 123 2HE2 GLN 18 HE22 GLN 18 10.368 23.629 22.011 124 H TYR 19 HN TYR 19 11.486 28.058 17.567 125 HA TYR 19 HA TYR 19 10.961 30.464 16.116 126 1HB TYR 19 HB1 TYR 19 12.191 27.908 15.595 127 2HB TYR 19 HB2 TYR 19 11.086 28.332 14.290 128 HD1 TYR 19 HD1 TYR 19 14.353 28.746 15.566 129 HD2 TYR 19 HD2 TYR 19 11.337 30.750 13.332 130 HE1 TYR 19 HE1 TYR 19 16.060 30.239 14.613 131 HE2 TYR 19 HE2 TYR 19 13.035 32.249 12.373 132 HH TYR 19 HH TYR 19 16.423 31.687 12.780 133 H LYS 20 HN LYS 20 9.733 27.412 14.955 134 HA LYS 20 HA LYS 20 7.255 28.587 14.170 135 1HB LYS 20 HB2 LYS 20 6.673 26.138 13.639 136 2HB LYS 20 HB1 LYS 20 7.997 26.877 12.750 137 1HG LYS 20 HG2 LYS 20 9.387 25.821 14.773 138 2HG LYS 20 HG1 LYS 20 8.028 24.694 14.737 139 1HD LYS 20 HD2 LYS 20 9.205 25.364 12.118 140 2HD LYS 20 HD1 LYS 20 10.238 24.438 13.208 141 1HE LYS 20 HE2 LYS 20 8.165 22.935 13.530 142 2HE LYS 20 HE1 LYS 20 7.571 23.703 12.059 143 1HZ LYS 20 HZ1 LYS 20 10.189 22.936 11.560 144 2HZ LYS 20 HZ2 LYS 20 8.777 22.263 10.915 145 3HZ LYS 20 HZ3 LYS 20 9.454 21.620 12.326 146 H TYR 21 HN TYR 21 5.516 28.888 15.380 147 HA TYR 21 HA TYR 21 5.342 27.751 18.020 148 1HB TYR 21 HB2 TYR 21 3.054 29.235 16.810 149 2HB TYR 21 HB1 TYR 21 3.707 29.319 18.442 150 HD1 TYR 21 HD1 TYR 21 3.698 30.797 15.169 151 HD2 TYR 21 HD2 TYR 21 5.882 30.556 18.812 152 HE1 TYR 21 HE1 TYR 21 4.904 32.855 14.574 153 HE2 TYR 21 HE2 TYR 21 7.095 32.613 18.227 154 HH TYR 21 HH TYR 21 6.275 34.472 15.340 155 H ALA 22 HN ALA 22 3.308 26.735 18.793 156 HA ALA 22 HA ALA 22 2.604 24.549 17.040 157 1HB ALA 22 HB1 ALA 22 2.214 23.428 18.924 158 2HB ALA 22 HB2 ALA 22 1.114 24.669 19.523 159 3HB ALA 22 HB3 ALA 22 2.851 24.832 19.779 160 H ALA 23 HN ALA 23 0.757 26.994 18.866 161 HA ALA 23 HA ALA 23 -1.659 26.428 17.415 162 1HB ALA 23 HB1 ALA 23 -2.375 27.191 19.393 163 2HB ALA 23 HB2 ALA 23 -2.132 28.792 18.696 164 3HB ALA 23 HB3 ALA 23 -0.878 28.070 19.705 165 H GLY 24 HN GLY 24 -2.247 27.259 15.522 166 1HA GLY 24 HA2 GLY 24 -0.608 29.259 14.241 167 2HA GLY 24 HA1 GLY 24 -1.996 28.440 13.541 168 H VAL 25 HN VAL 25 -3.548 29.251 16.041 169 HA VAL 25 HA VAL 25 -4.192 31.961 15.097 170 HB VAL 25 HB VAL 25 -5.933 30.119 16.738 171 1HG1 VAL 25 HG21 VAL 25 -7.313 31.844 16.961 172 2HG1 VAL 25 HG22 VAL 25 -7.334 32.095 15.215 173 3HG1 VAL 25 HG23 VAL 25 -6.100 32.877 16.203 174 1HG2 VAL 25 HG11 VAL 25 -6.743 29.162 14.879 175 2HG2 VAL 25 HG12 VAL 25 -5.239 29.703 14.135 176 3HG2 VAL 25 HG13 VAL 25 -6.703 30.671 13.967 177 H ARG 26 HN ARG 26 -4.106 33.678 16.435 178 HA ARG 26 HA ARG 26 -3.016 33.232 19.110 179 1HB ARG 26 HB2 ARG 26 -2.371 35.040 17.130 180 2HB ARG 26 HB1 ARG 26 -3.335 36.008 18.237 181 1HG ARG 26 HG2 ARG 26 -1.705 36.086 19.753 182 2HG ARG 26 HG1 ARG 26 -1.365 34.361 19.601 183 1HD ARG 26 HD2 ARG 26 0.600 35.457 18.905 184 2HD ARG 26 HD1 ARG 26 -0.198 34.923 17.426 185 HE ARG 26 HE ARG 26 -0.941 37.582 18.115 186 1HH1 ARG 26 HH11 ARG 26 1.609 35.681 16.688 187 2HH1 ARG 26 HH12 ARG 26 2.211 36.985 15.719 188 1HH2 ARG 26 HH21 ARG 26 -0.154 39.300 16.844 189 2HH2 ARG 26 HH22 ARG 26 1.209 39.042 15.807 190 H ASN 27 HN ASN 27 -3.813 34.568 20.904 191 HA ASN 27 HA ASN 27 -6.637 34.354 21.151 192 1HB ASN 27 HB2 ASN 27 -4.715 35.821 22.972 193 2HB ASN 27 HB1 ASN 27 -6.329 35.249 23.385 194 1HD2 ASN 27 HD21 ASN 27 -6.557 33.258 24.168 195 2HD2 ASN 27 HD22 ASN 27 -5.303 32.074 24.256 196 HA PRO 28 HA PRO 28 -7.933 38.279 19.586 197 1HB PRO 28 HB1 PRO 28 -10.214 38.630 21.033 198 2HB PRO 28 HB2 PRO 28 -10.091 37.509 19.672 199 1HG PRO 28 HG2 PRO 28 -9.910 36.953 22.610 200 2HG PRO 28 HG1 PRO 28 -10.772 36.048 21.353 201 1HD PRO 28 HD2 PRO 28 -8.382 35.248 22.305 202 2HD PRO 28 HD1 PRO 28 -8.850 35.002 20.611 203 H GLN 29 HN GLN 29 -6.215 39.547 20.427 204 HA GLN 29 HA GLN 29 -6.647 40.756 23.061 205 1HB GLN 29 HB2 GLN 29 -4.265 40.607 21.226 206 2HB GLN 29 HB1 GLN 29 -4.316 41.734 22.574 207 1HG GLN 29 HG1 GLN 29 -4.973 38.935 23.212 208 2HG GLN 29 HG2 GLN 29 -3.308 39.252 22.729 209 1HE2 GLN 29 HE21 GLN 29 -2.669 38.673 24.852 210 2HE2 GLN 29 HE22 GLN 29 -2.830 39.791 26.159 211 H GLN 30 HN GLN 30 -8.165 41.398 20.556 212 HA GLN 30 HA GLN 30 -7.326 44.102 19.928 213 1HB GLN 30 HB1 GLN 30 -9.700 42.480 18.992 214 2HB GLN 30 HB2 GLN 30 -9.299 44.089 18.410 215 1HG GLN 30 HG2 GLN 30 -7.500 43.360 17.202 216 2HG GLN 30 HG1 GLN 30 -7.235 41.957 18.239 217 1HE2 GLN 30 HE21 GLN 30 -7.947 40.053 17.562 218 2HE2 GLN 30 HE22 GLN 30 -9.031 39.795 16.241 219 H HIS 31 HN HIS 31 -10.705 43.256 20.299 220 HA HIS 31 HA HIS 31 -11.091 44.457 22.838 221 1HB HIS 31 HB1 HIS 31 -12.405 46.443 21.987 222 2HB HIS 31 HB2 HIS 31 -10.661 46.551 21.779 223 HD2 HIS 31 HD2 HIS 31 -9.744 46.485 19.151 224 HE1 HIS 31 HE1 HIS 31 -13.607 46.721 17.436 225 HE2 HIS 31 HE2 HIS 31 -11.116 46.852 16.979 226 H LEU 32 HN LEU 32 -12.414 43.482 19.739 227 HA LEU 32 HA LEU 32 -15.123 43.314 20.581 228 1HB LEU 32 HB2 LEU 32 -15.382 41.874 18.538 229 2HB LEU 32 HB1 LEU 32 -14.721 43.472 18.253 230 HG LEU 32 HG LEU 32 -12.433 42.051 18.530 231 1HD1 LEU 32 HD11 LEU 32 -13.376 39.904 18.768 232 2HD1 LEU 32 HD12 LEU 32 -12.804 39.994 17.102 233 3HD1 LEU 32 HD13 LEU 32 -14.522 40.178 17.455 234 1HD2 LEU 32 HD21 LEU 32 -12.095 42.631 16.379 235 2HD2 LEU 32 HD22 LEU 32 -13.605 43.513 16.597 236 3HD2 LEU 32 HD23 LEU 32 -13.616 41.922 15.836 237 H ASN 33 HN ASN 33 -16.373 41.379 20.898 238 HA ASN 33 HA ASN 33 -14.858 39.340 22.355 239 1HB ASN 33 HB2 ASN 33 -17.288 40.677 22.866 240 2HB ASN 33 HB1 ASN 33 -17.716 39.003 22.522 241 1HD2 ASN 33 HD21 ASN 33 -18.385 38.901 24.733 242 2HD2 ASN 33 HD22 ASN 33 -17.216 38.633 25.977 243 H ALA 34 HN ALA 34 -14.091 38.173 20.556 244 HA ALA 34 HA ALA 34 -16.063 36.938 18.796 245 1HB ALA 34 HB1 ALA 34 -13.529 35.960 18.147 246 2HB ALA 34 HB2 ALA 34 -13.288 37.656 18.569 247 3HB ALA 34 HB3 ALA 34 -14.440 37.216 17.308 248 H GLN 35 HN GLN 35 -17.077 35.459 20.154 249 HA GLN 35 HA GLN 35 -15.523 33.538 21.640 250 1HB GLN 35 HB2 GLN 35 -18.495 33.795 21.171 251 2HB GLN 35 HB1 GLN 35 -17.766 32.550 22.177 252 1HG GLN 35 HG1 GLN 35 -17.461 35.507 22.643 253 2HG GLN 35 HG2 GLN 35 -18.655 34.485 23.441 254 1HE2 GLN 35 HE21 GLN 35 -17.307 32.261 24.064 255 2HE2 GLN 35 HE22 GLN 35 -16.003 32.608 25.143 256 HA PRO 36 HA PRO 36 -17.156 30.524 18.304 257 1HB PRO 36 HB1 PRO 36 -18.480 31.423 16.155 258 2HB PRO 36 HB2 PRO 36 -19.298 31.158 17.699 259 1HG PRO 36 HG1 PRO 36 -18.319 33.712 16.483 260 2HG PRO 36 HG2 PRO 36 -19.843 33.389 17.329 261 1HD PRO 36 HD1 PRO 36 -17.660 34.577 18.495 262 2HD PRO 36 HD2 PRO 36 -18.893 33.670 19.392 263 H GLN 37 HN GLN 37 -14.706 31.183 18.261 264 HA GLN 37 HA GLN 37 -13.892 32.213 15.655 265 1HB GLN 37 HB2 GLN 37 -12.548 31.769 18.275 266 2HB GLN 37 HB1 GLN 37 -11.552 31.683 16.828 267 1HG GLN 37 HG1 GLN 37 -13.036 33.977 16.457 268 2HG GLN 37 HG2 GLN 37 -12.675 33.985 18.182 269 1HE2 GLN 37 HE21 GLN 37 -10.445 33.828 18.823 270 2HE2 GLN 37 HE22 GLN 37 -9.207 34.436 17.783 271 H VAL 38 HN VAL 38 -15.182 29.548 16.086 272 HA VAL 38 HA VAL 38 -13.118 27.608 15.547 273 HB VAL 38 HB VAL 38 -15.083 26.071 15.131 274 1HG1 VAL 38 HG21 VAL 38 -13.971 27.037 17.497 275 2HG1 VAL 38 HG22 VAL 38 -14.880 25.541 17.281 276 3HG1 VAL 38 HG23 VAL 38 -15.711 27.014 17.782 277 1HG2 VAL 38 HG11 VAL 38 -16.713 28.339 16.249 278 2HG2 VAL 38 HG12 VAL 38 -17.285 26.775 15.670 279 3HG2 VAL 38 HG13 VAL 38 -16.638 27.955 14.529 280 H THR 39 HN THR 39 -15.021 29.773 13.718 281 HA THR 39 HA THR 39 -14.950 28.252 11.266 282 HB THR 39 HB THR 39 -15.490 31.031 10.815 283 HG1 THR 39 HG1 THR 39 -16.565 31.586 12.510 284 1HG2 THR 39 HG21 THR 39 -17.892 30.016 10.596 285 2HG2 THR 39 HG22 THR 39 -17.011 28.489 10.646 286 3HG2 THR 39 HG23 THR 39 -16.644 29.677 9.396 287 H MET 40 HN MET 40 -13.211 28.086 10.035 288 HA MET 40 HA MET 40 -11.131 30.148 10.214 289 1HB MET 40 HB2 MET 40 -11.081 27.291 10.044 290 2HB MET 40 HB1 MET 40 -10.266 27.952 8.635 291 1HG MET 40 HG2 MET 40 -9.405 29.383 10.937 292 2HG MET 40 HG1 MET 40 -9.279 27.655 11.260 293 1HE MET 40 HE1 MET 40 -7.965 26.008 9.999 294 2HE MET 40 HE2 MET 40 -6.762 26.810 11.009 295 3HE MET 40 HE3 MET 40 -6.390 26.434 9.327 296 H GLN 41 HN GLN 41 -9.808 30.098 7.961 297 HA GLN 41 HA GLN 41 -11.484 30.029 5.629 298 1HB GLN 41 HB2 GLN 41 -11.317 32.453 7.135 299 2HB GLN 41 HB1 GLN 41 -10.480 32.688 5.607 300 1HG GLN 41 HG2 GLN 41 -12.936 31.334 5.110 301 2HG GLN 41 HG1 GLN 41 -13.251 32.748 6.116 302 1HE2 GLN 41 HE21 GLN 41 -13.685 32.004 3.191 303 2HE2 GLN 41 HE22 GLN 41 -13.092 33.380 2.329 304 H GLN 42 HN GLN 42 -10.285 29.641 3.873 305 HA GLN 42 HA GLN 42 -8.469 29.179 2.586 306 1HB GLN 42 HB1 GLN 42 -8.264 31.888 3.429 307 2HB GLN 42 HB2 GLN 42 -6.644 31.207 3.433 308 1HG GLN 42 HG1 GLN 42 -7.114 30.387 1.095 309 2HG GLN 42 HG2 GLN 42 -8.565 31.387 1.134 310 1HE2 GLN 42 HE21 GLN 42 -8.403 33.533 0.809 311 2HE2 GLN 42 HE22 GLN 42 -6.919 34.363 0.502 312 HA PRO 43 HA PRO 43 -6.183 27.276 6.175 313 1HB PRO 43 HB1 PRO 43 -6.624 24.697 5.517 314 2HB PRO 43 HB2 PRO 43 -7.786 25.644 6.453 315 1HG PRO 43 HG2 PRO 43 -7.789 24.993 3.529 316 2HG PRO 43 HG1 PRO 43 -9.137 24.961 4.682 317 1HD PRO 43 HD2 PRO 43 -8.712 27.020 2.958 318 2HD PRO 43 HD1 PRO 43 -9.464 27.233 4.553 319 H ALA 44 HN ALA 44 -4.372 28.226 4.971 320 HA ALA 44 HA ALA 44 -3.218 26.946 2.721 321 1HB ALA 44 HB1 ALA 44 -2.758 29.284 3.308 322 2HB ALA 44 HB2 ALA 44 -1.276 28.343 3.144 323 3HB ALA 44 HB3 ALA 44 -1.891 28.744 4.746 324 H VAL 45 HN VAL 45 -2.548 24.899 2.788 325 HA VAL 45 HA VAL 45 -1.362 23.820 5.222 326 HB VAL 45 HB VAL 45 -1.349 21.661 3.851 327 1HG1 VAL 45 HG11 VAL 45 -3.177 21.223 5.033 328 2HG1 VAL 45 HG12 VAL 45 -4.160 22.212 3.952 329 3HG1 VAL 45 HG13 VAL 45 -3.353 22.950 5.337 330 1HG2 VAL 45 HG21 VAL 45 -1.906 23.341 1.762 331 2HG2 VAL 45 HG22 VAL 45 -3.490 22.667 2.142 332 3HG2 VAL 45 HG23 VAL 45 -2.144 21.594 1.761 333 H HIS 46 HN HIS 46 0.745 23.358 5.473 334 HA HIS 46 HA HIS 46 2.570 24.127 3.331 335 1HB HIS 46 HB1 HIS 46 2.945 23.560 6.270 336 2HB HIS 46 HB2 HIS 46 4.310 23.763 5.176 337 HD2 HIS 46 HD2 HIS 46 1.100 25.956 5.941 338 HE1 HIS 46 HE1 HIS 46 4.534 28.408 5.612 339 HE2 HIS 46 HE2 HIS 46 2.035 28.374 6.043 340 H VAL 47 HN VAL 47 1.022 21.670 3.145 341 HA VAL 47 HA VAL 47 2.950 19.535 3.572 342 HB VAL 47 HB VAL 47 0.585 19.119 4.084 343 1HG1 VAL 47 HG11 VAL 47 0.122 19.442 1.121 344 2HG1 VAL 47 HG12 VAL 47 -0.386 20.582 2.367 345 3HG1 VAL 47 HG13 VAL 47 -1.078 18.961 2.322 346 1HG2 VAL 47 HG21 VAL 47 1.730 17.146 3.638 347 2HG2 VAL 47 HG22 VAL 47 1.907 17.520 1.924 348 3HG2 VAL 47 HG23 VAL 47 0.333 17.050 2.565 349 H GLN 48 HN GLN 48 3.811 18.239 1.933 350 HA GLN 48 HA GLN 48 4.434 19.597 -0.497 351 1HB GLN 48 HB1 GLN 48 5.151 17.011 0.770 352 2HB GLN 48 HB2 GLN 48 5.309 17.098 -0.978 353 1HG GLN 48 HG2 GLN 48 6.520 19.407 -0.210 354 2HG GLN 48 HG1 GLN 48 6.924 18.329 1.126 355 1HE2 GLN 48 HE22 GLN 48 7.627 19.243 -2.051 356 2HE2 GLN 48 HE21 GLN 48 8.777 18.006 -2.414 357 H GLY 49 HN GLY 49 4.426 17.591 -2.414 358 1HA GLY 49 HA1 GLY 49 1.710 17.730 -3.309 359 2HA GLY 49 HA2 GLY 49 3.040 16.940 -4.140 360 H GLN 50 HN GLN 50 3.528 15.413 -1.527 361 HA GLN 50 HA GLN 50 1.726 13.228 -2.187 362 1HB GLN 50 HB2 GLN 50 4.148 13.401 -0.391 363 2HB GLN 50 HB1 GLN 50 3.182 11.944 -0.579 364 1HG GLN 50 HG1 GLN 50 3.951 13.003 -3.144 365 2HG GLN 50 HG2 GLN 50 5.360 12.744 -2.117 366 1HE2 GLN 50 HE22 GLN 50 5.552 10.609 -1.107 367 2HE2 GLN 50 HE21 GLN 50 5.001 9.228 -1.986 368 H GLU 51 HN GLU 51 -0.173 13.126 -1.198 369 HA GLU 51 HA GLU 51 -0.613 14.428 1.338 370 1HB GLU 51 HB2 GLU 51 -2.267 14.368 -0.597 371 2HB GLU 51 HB1 GLU 51 -2.582 12.697 -0.150 372 1HG GLU 51 HG1 GLU 51 -4.207 13.601 1.095 373 2HG GLU 51 HG2 GLU 51 -2.900 13.899 2.239 374 HA PRO 52 HA PRO 52 -1.449 9.844 2.718 375 1HB PRO 52 HB1 PRO 52 -0.225 7.905 1.241 376 2HB PRO 52 HB2 PRO 52 -1.891 8.427 0.975 377 1HG PRO 52 HG2 PRO 52 0.600 9.222 -0.482 378 2HG PRO 52 HG1 PRO 52 -1.000 8.822 -1.135 379 1HD PRO 52 HD2 PRO 52 -0.166 11.369 -0.858 380 2HD PRO 52 HD1 PRO 52 -1.865 10.906 -0.631 381 H LEU 53 HN LEU 53 -0.178 8.818 4.230 382 HA LEU 53 HA LEU 53 2.481 9.840 4.583 383 1HB LEU 53 HB2 LEU 53 0.476 8.671 6.208 384 2HB LEU 53 HB1 LEU 53 1.893 7.653 6.343 385 HG LEU 53 HG LEU 53 1.421 9.743 7.954 386 1HD1 LEU 53 HD11 LEU 53 4.076 9.846 8.028 387 2HD1 LEU 53 HD12 LEU 53 3.886 8.390 7.051 388 3HD1 LEU 53 HD13 LEU 53 3.154 8.478 8.654 389 1HD2 LEU 53 HD21 LEU 53 3.298 10.933 5.945 390 2HD2 LEU 53 HD22 LEU 53 2.572 11.694 7.359 391 3HD2 LEU 53 HD23 LEU 53 1.570 11.293 5.964 392 H THR 54 HN THR 54 4.407 8.798 4.338 393 HA THR 54 HA THR 54 4.635 5.997 3.975 394 HB THR 54 HB THR 54 5.684 6.928 1.502 395 HG1 THR 54 HG1 THR 54 2.914 7.431 1.680 396 1HG2 THR 54 HG21 THR 54 3.340 5.156 2.125 397 2HG2 THR 54 HG22 THR 54 5.001 4.655 1.808 398 3HG2 THR 54 HG23 THR 54 4.036 5.377 0.520 399 H ALA 55 HN ALA 55 6.943 5.553 2.941 400 HA ALA 55 HA ALA 55 8.833 6.360 4.734 401 1HB ALA 55 HB1 ALA 55 9.164 5.478 1.879 402 2HB ALA 55 HB2 ALA 55 9.289 4.506 3.346 403 3HB ALA 55 HB3 ALA 55 10.523 5.712 2.979 404 H SER 56 HN SER 56 8.007 7.924 1.669 405 HA SER 56 HA SER 56 10.093 9.789 1.579 406 1HB SER 56 HB1 SER 56 7.248 10.041 0.570 407 2HB SER 56 HB2 SER 56 8.572 11.122 0.132 408 HG SER 56 HG SER 56 9.364 8.614 -0.267 409 H MET 57 HN MET 57 6.849 10.042 3.003 410 HA MET 57 HA MET 57 7.044 12.662 3.957 411 1HB MET 57 HB1 MET 57 5.466 10.258 4.834 412 2HB MET 57 HB2 MET 57 5.383 11.759 5.741 413 1HG MET 57 HG1 MET 57 3.710 11.125 3.755 414 2HG MET 57 HG2 MET 57 4.120 12.782 4.195 415 1HE MET 57 HE1 MET 57 4.898 9.771 2.235 416 2HE MET 57 HE2 MET 57 5.828 10.280 0.825 417 3HE MET 57 HE3 MET 57 4.073 10.454 0.833 418 H LEU 58 HN LEU 58 7.949 9.583 5.425 419 HA LEU 58 HA LEU 58 8.708 10.521 7.951 420 1HB LEU 58 HB1 LEU 58 9.573 8.175 6.280 421 2HB LEU 58 HB2 LEU 58 10.266 8.465 7.863 422 HG LEU 58 HG LEU 58 8.597 7.310 8.769 423 1HD1 LEU 58 HD11 LEU 58 6.530 9.068 7.487 424 2HD1 LEU 58 HD12 LEU 58 7.527 9.624 8.831 425 3HD1 LEU 58 HD13 LEU 58 6.462 8.233 9.040 426 1HD2 LEU 58 HD21 LEU 58 7.124 6.049 7.459 427 2HD2 LEU 58 HD22 LEU 58 8.540 6.296 6.434 428 3HD2 LEU 58 HD23 LEU 58 7.084 7.262 6.180 429 H ALA 59 HN ALA 59 10.583 10.108 4.977 430 HA ALA 59 HA ALA 59 13.073 10.894 6.026 431 1HB ALA 59 HB1 ALA 59 13.488 9.944 4.039 432 2HB ALA 59 HB2 ALA 59 13.275 11.577 3.408 433 3HB ALA 59 HB3 ALA 59 11.933 10.432 3.365 434 H SER 60 HN SER 60 10.289 12.716 5.448 435 HA SER 60 HA SER 60 11.555 15.191 4.752 436 1HB SER 60 HB2 SER 60 8.787 14.814 5.913 437 2HB SER 60 HB1 SER 60 9.373 16.177 4.958 438 HG SER 60 HG SER 60 8.683 15.093 3.306 439 H ALA 61 HN ALA 61 11.301 13.464 7.633 440 HA ALA 61 HA ALA 61 12.125 15.833 9.150 441 1HB ALA 61 HB1 ALA 61 10.200 15.898 10.260 442 2HB ALA 61 HB2 ALA 61 10.635 14.348 10.985 443 3HB ALA 61 HB3 ALA 61 9.652 14.393 9.520 444 HA PRO 62 HA PRO 62 14.679 12.147 10.289 445 1HB PRO 62 HB1 PRO 62 16.691 12.238 8.545 446 2HB PRO 62 HB2 PRO 62 15.114 11.603 8.066 447 1HG PRO 62 HG2 PRO 62 16.402 14.182 7.376 448 2HG PRO 62 HG1 PRO 62 15.208 13.242 6.467 449 1HD PRO 62 HD2 PRO 62 14.747 15.498 8.186 450 2HD PRO 62 HD1 PRO 62 13.549 14.546 7.285 451 HA PRO 63 HA PRO 63 15.379 11.476 11.709 452 1HB PRO 63 HB2 PRO 63 16.493 11.124 14.102 453 2HB PRO 63 HB1 PRO 63 17.458 10.955 12.631 454 1HG PRO 63 HG2 PRO 63 17.433 13.139 14.637 455 2HG PRO 63 HG1 PRO 63 18.750 12.592 13.586 456 1HD PRO 63 HD1 PRO 63 16.966 14.800 13.171 457 2HD PRO 63 HD2 PRO 63 18.261 14.229 12.101 458 H GLN 64 HN GLN 64 14.208 14.211 12.153 459 HA GLN 64 HA GLN 64 13.257 14.628 14.709 460 1HB GLN 64 HB2 GLN 64 11.551 15.119 12.279 461 2HB GLN 64 HB1 GLN 64 11.631 16.053 13.767 462 1HG GLN 64 HG2 GLN 64 13.902 15.836 11.811 463 2HG GLN 64 HG1 GLN 64 12.697 17.122 11.779 464 1HE2 GLN 64 HE21 GLN 64 15.684 16.935 12.366 465 2HE2 GLN 64 HE22 GLN 64 15.868 17.839 13.827 466 H GLU 65 HN GLU 65 10.863 13.602 12.313 467 HA GLU 65 HA GLU 65 9.768 11.783 14.333 468 1HB GLU 65 HB2 GLU 65 7.626 12.152 13.321 469 2HB GLU 65 HB1 GLU 65 8.401 13.720 13.524 470 1HG GLU 65 HG2 GLU 65 9.180 13.390 11.097 471 2HG GLU 65 HG1 GLU 65 7.880 12.208 11.021 472 H GLN 66 HN GLN 66 11.961 11.179 12.483 473 HA GLN 66 HA GLN 66 11.063 9.537 10.360 474 1HB GLN 66 HB2 GLN 66 13.572 10.316 11.556 475 2HB GLN 66 HB1 GLN 66 13.574 8.596 11.192 476 1HG GLN 66 HG1 GLN 66 12.598 9.458 8.894 477 2HG GLN 66 HG2 GLN 66 13.452 10.925 9.370 478 1HE2 GLN 66 HE21 GLN 66 14.149 9.481 7.119 479 2HE2 GLN 66 HE22 GLN 66 15.704 8.770 7.360 480 H LYS 67 HN LYS 67 11.220 9.061 13.724 481 HA LYS 67 HA LYS 67 10.604 6.208 13.355 482 1HB LYS 67 HB1 LYS 67 12.200 7.205 15.711 483 2HB LYS 67 HB2 LYS 67 11.966 5.545 15.176 484 1HG LYS 67 HG2 LYS 67 13.959 5.725 14.214 485 2HG LYS 67 HG1 LYS 67 13.166 6.740 13.005 486 1HD LYS 67 HD1 LYS 67 14.910 8.093 13.676 487 2HD LYS 67 HD2 LYS 67 13.604 8.650 14.724 488 1HE LYS 67 HE1 LYS 67 15.652 8.362 15.996 489 2HE LYS 67 HE2 LYS 67 14.431 7.201 16.517 490 1HZ LYS 67 HZ1 LYS 67 15.850 5.951 14.512 491 2HZ LYS 67 HZ2 LYS 67 15.933 5.630 16.171 492 3HZ LYS 67 HZ3 LYS 67 17.018 6.719 15.465 493 H GLN 68 HN GLN 68 8.935 8.602 13.744 494 HA GLN 68 HA GLN 68 7.580 7.720 16.203 495 1HB GLN 68 HB2 GLN 68 8.734 9.817 16.668 496 2HB GLN 68 HB1 GLN 68 7.962 10.573 15.281 497 1HG GLN 68 HG1 GLN 68 5.876 10.621 16.311 498 2HG GLN 68 HG2 GLN 68 6.339 9.416 17.513 499 1HE2 GLN 68 HE21 GLN 68 6.084 12.708 16.797 500 2HE2 GLN 68 HE22 GLN 68 6.846 13.329 18.218 501 H MET 69 HN MET 69 7.041 9.844 13.374 502 HA MET 69 HA MET 69 4.218 9.346 13.462 503 1HB MET 69 HB2 MET 69 4.032 10.918 11.702 504 2HB MET 69 HB1 MET 69 5.288 11.517 12.778 505 1HG MET 69 HG2 MET 69 6.878 11.383 11.207 506 2HG MET 69 HG1 MET 69 6.283 9.829 10.610 507 1HE MET 69 HE1 MET 69 6.904 13.286 8.912 508 2HE MET 69 HE2 MET 69 6.592 12.192 7.565 509 3HE MET 69 HE3 MET 69 7.583 11.659 8.922 510 H LEU 70 HN LEU 70 6.067 7.058 12.844 511 HA LEU 70 HA LEU 70 5.320 6.368 10.112 512 1HB LEU 70 HB1 LEU 70 6.432 4.129 11.455 513 2HB LEU 70 HB2 LEU 70 7.167 5.115 10.211 514 HG LEU 70 HG LEU 70 7.293 5.790 13.145 515 1HD1 LEU 70 HD11 LEU 70 8.419 3.578 12.189 516 2HD1 LEU 70 HD12 LEU 70 9.201 4.592 13.402 517 3HD1 LEU 70 HD13 LEU 70 9.657 4.738 11.704 518 1HD2 LEU 70 HD21 LEU 70 9.304 7.098 12.244 519 2HD2 LEU 70 HD22 LEU 70 7.688 7.733 11.930 520 3HD2 LEU 70 HD23 LEU 70 8.564 6.877 10.660 521 H GLY 71 HN GLY 71 4.692 5.372 13.423 522 1HA GLY 71 HA2 GLY 71 2.354 3.876 12.436 523 2HA GLY 71 HA1 GLY 71 3.281 3.353 13.834 524 H GLU 72 HN GLU 72 3.062 6.715 13.581 525 HA GLU 72 HA GLU 72 0.758 6.788 15.417 526 1HB GLU 72 HB1 GLU 72 3.237 8.512 15.583 527 2HB GLU 72 HB2 GLU 72 1.862 8.559 16.679 528 1HG GLU 72 HG2 GLU 72 2.610 5.930 16.789 529 2HG GLU 72 HG1 GLU 72 4.154 6.763 16.618 530 H ARG 73 HN ARG 73 1.719 7.637 12.425 531 HA ARG 73 HA ARG 73 0.034 10.052 12.445 532 1HB ARG 73 HB1 ARG 73 2.652 10.168 11.927 533 2HB ARG 73 HB2 ARG 73 2.085 9.743 10.318 534 1HG ARG 73 HG1 ARG 73 0.771 11.986 11.769 535 2HG ARG 73 HG2 ARG 73 2.351 12.243 11.027 536 1HD ARG 73 HD2 ARG 73 1.535 12.111 8.923 537 2HD ARG 73 HD1 ARG 73 0.337 10.890 9.350 538 HE ARG 73 HE ARG 73 -1.187 12.560 9.673 539 1HH1 ARG 73 HH12 ARG 73 2.012 13.942 9.682 540 2HH1 ARG 73 HH11 ARG 73 1.443 15.578 9.720 541 1HH2 ARG 73 HH22 ARG 73 -1.944 14.709 9.724 542 2HH2 ARG 73 HH21 ARG 73 -0.804 16.014 9.744 543 H LEU 74 HN LEU 74 0.993 7.113 10.756 544 HA LEU 74 HA LEU 74 -0.443 7.358 8.407 545 1HB LEU 74 HB1 LEU 74 0.601 5.216 10.132 546 2HB LEU 74 HB2 LEU 74 -0.703 4.733 9.070 547 HG LEU 74 HG LEU 74 1.359 4.235 8.045 548 1HD1 LEU 74 HD21 LEU 74 -0.312 6.380 6.898 549 2HD1 LEU 74 HD22 LEU 74 0.015 4.755 6.295 550 3HD1 LEU 74 HD23 LEU 74 1.212 6.032 6.082 551 1HD2 LEU 74 HD11 LEU 74 2.310 6.989 7.791 552 2HD2 LEU 74 HD12 LEU 74 3.207 5.480 7.991 553 3HD2 LEU 74 HD13 LEU 74 2.447 6.251 9.389 554 H PHE 75 HN PHE 75 -1.493 6.532 11.632 555 HA PHE 75 HA PHE 75 -3.670 5.088 11.446 556 1HB PHE 75 HB1 PHE 75 -2.825 6.202 13.516 557 2HB PHE 75 HB2 PHE 75 -3.753 7.627 13.063 558 HD1 PHE 75 HD1 PHE 75 -4.860 4.153 12.530 559 HD2 PHE 75 HD2 PHE 75 -5.225 7.664 14.916 560 HE1 PHE 75 HE1 PHE 75 -6.853 3.206 13.626 561 HE2 PHE 75 HE2 PHE 75 -7.214 6.721 16.012 562 HZ PHE 75 HZ PHE 75 -8.031 4.489 15.367 563 HA PRO 76 HA PRO 76 -6.890 8.464 10.224 564 1HB PRO 76 HB1 PRO 76 -5.258 10.706 9.216 565 2HB PRO 76 HB2 PRO 76 -6.660 10.731 10.288 566 1HG PRO 76 HG2 PRO 76 -4.199 11.232 11.210 567 2HG PRO 76 HG1 PRO 76 -5.387 10.341 12.182 568 1HD PRO 76 HD2 PRO 76 -3.078 9.295 10.583 569 2HD PRO 76 HD1 PRO 76 -3.636 8.814 12.198 570 H LEU 77 HN LEU 77 -3.939 7.928 8.533 571 HA LEU 77 HA LEU 77 -5.200 8.250 5.929 572 1HB LEU 77 HB1 LEU 77 -2.339 7.747 6.740 573 2HB LEU 77 HB2 LEU 77 -2.874 7.898 5.079 574 HG LEU 77 HG LEU 77 -3.107 10.056 7.181 575 1HD1 LEU 77 HD11 LEU 77 -1.450 10.821 5.033 576 2HD1 LEU 77 HD12 LEU 77 -0.900 9.236 5.575 577 3HD1 LEU 77 HD13 LEU 77 -1.003 10.572 6.722 578 1HD2 LEU 77 HD21 LEU 77 -4.814 9.929 5.265 579 2HD2 LEU 77 HD22 LEU 77 -3.468 10.405 4.229 580 3HD2 LEU 77 HD23 LEU 77 -3.982 11.458 5.548 581 H ILE 78 HN ILE 78 -4.385 5.717 8.113 582 HA ILE 78 HA ILE 78 -4.038 3.642 6.165 583 HB ILE 78 HB ILE 78 -4.898 3.301 9.024 584 1HG1 ILE 78 HG12 ILE 78 -2.722 4.593 8.644 585 2HG1 ILE 78 HG11 ILE 78 -2.629 3.170 9.675 586 1HG2 ILE 78 HG21 ILE 78 -3.331 1.153 8.197 587 2HG2 ILE 78 HG22 ILE 78 -4.417 1.484 6.846 588 3HG2 ILE 78 HG23 ILE 78 -5.077 1.165 8.452 589 1HD1 ILE 78 HD11 ILE 78 -0.743 3.307 8.151 590 2HD1 ILE 78 HD12 ILE 78 -1.846 3.286 6.774 591 3HD1 ILE 78 HD13 ILE 78 -1.726 1.879 7.831 592 H GLN 79 HN GLN 79 -6.712 4.727 8.219 593 HA GLN 79 HA GLN 79 -8.652 2.862 7.538 594 1HB GLN 79 HB1 GLN 79 -8.597 5.599 8.610 595 2HB GLN 79 HB2 GLN 79 -10.087 5.188 7.772 596 1HG GLN 79 HG1 GLN 79 -10.780 3.869 9.428 597 2HG GLN 79 HG2 GLN 79 -9.199 3.107 9.601 598 1HE2 GLN 79 HE22 GLN 79 -10.951 6.089 10.335 599 2HE2 GLN 79 HE21 GLN 79 -10.140 6.407 11.827 600 H ALA 80 HN ALA 80 -7.149 5.216 5.653 601 HA ALA 80 HA ALA 80 -9.221 5.563 3.681 602 1HB ALA 80 HB1 ALA 80 -7.603 6.877 2.489 603 2HB ALA 80 HB2 ALA 80 -6.286 6.231 3.473 604 3HB ALA 80 HB3 ALA 80 -7.497 7.293 4.200 605 H MET 81 HN MET 81 -6.302 3.646 4.101 606 HA MET 81 HA MET 81 -6.292 2.584 1.438 607 1HB MET 81 HB1 MET 81 -4.950 1.168 3.697 608 2HB MET 81 HB2 MET 81 -4.370 1.463 2.063 609 1HG MET 81 HG1 MET 81 -4.657 3.976 3.307 610 2HG MET 81 HG2 MET 81 -3.844 2.918 4.453 611 1HE MET 81 HE1 MET 81 -0.903 1.579 2.839 612 2HE MET 81 HE2 MET 81 -2.016 1.695 4.206 613 3HE MET 81 HE3 MET 81 -0.725 2.885 4.017 614 H HIS 82 HN HIS 82 -7.180 1.293 4.618 615 HA HIS 82 HA HIS 82 -8.578 -0.925 3.284 616 1HB HIS 82 HB1 HIS 82 -7.129 -0.638 5.855 617 2HB HIS 82 HB2 HIS 82 -8.578 -1.636 5.893 618 HD2 HIS 82 HD2 HIS 82 -5.549 -1.515 3.346 619 HE1 HIS 82 HE1 HIS 82 -6.370 -5.505 4.495 620 HE2 HIS 82 HE2 HIS 82 -4.907 -4.013 3.060 621 HA PRO 83 HA PRO 83 -12.540 0.594 4.529 622 1HB PRO 83 HB1 PRO 83 -13.303 -2.061 5.546 623 2HB PRO 83 HB2 PRO 83 -13.979 -1.138 4.201 624 1HG PRO 83 HG1 PRO 83 -12.492 -3.339 3.800 625 2HG PRO 83 HG2 PRO 83 -12.437 -1.955 2.692 626 1HD PRO 83 HD1 PRO 83 -10.502 -2.746 4.837 627 2HD PRO 83 HD2 PRO 83 -10.182 -2.122 3.204 628 H THR 84 HN THR 84 -11.218 1.652 6.342 629 HA THR 84 HA THR 84 -10.888 2.209 8.520 630 HB THR 84 HB THR 84 -13.575 1.001 9.121 631 HG1 THR 84 HG1 THR 84 -13.747 2.041 7.088 632 1HG2 THR 84 HG21 THR 84 -13.442 2.258 10.924 633 2HG2 THR 84 HG22 THR 84 -13.386 3.693 9.900 634 3HG2 THR 84 HG23 THR 84 -11.889 2.903 10.394 635 H LEU 85 HN LEU 85 -9.787 -0.285 7.843 636 HA LEU 85 HA LEU 85 -10.391 -2.055 10.086 637 1HB LEU 85 HB1 LEU 85 -8.958 -2.351 7.489 638 2HB LEU 85 HB2 LEU 85 -8.528 -3.428 8.804 639 HG LEU 85 HG LEU 85 -11.361 -3.099 7.831 640 1HD1 LEU 85 HD11 LEU 85 -10.619 -5.523 6.911 641 2HD1 LEU 85 HD12 LEU 85 -9.121 -4.619 6.683 642 3HD1 LEU 85 HD13 LEU 85 -10.615 -4.053 5.936 643 1HD2 LEU 85 HD21 LEU 85 -10.094 -5.387 9.315 644 2HD2 LEU 85 HD22 LEU 85 -11.809 -5.081 9.041 645 3HD2 LEU 85 HD23 LEU 85 -10.889 -4.036 10.123 646 H ALA 86 HN ALA 86 -8.666 0.588 9.886 647 HA ALA 86 HA ALA 86 -6.054 -0.174 10.741 648 1HB ALA 86 HB1 ALA 86 -5.616 2.003 10.539 649 2HB ALA 86 HB2 ALA 86 -6.928 2.457 11.628 650 3HB ALA 86 HB3 ALA 86 -7.260 2.165 9.920 651 H GLY 87 HN GLY 87 -6.256 1.916 13.004 652 1HA GLY 87 HA2 GLY 87 -6.764 1.960 15.271 653 2HA GLY 87 HA1 GLY 87 -7.783 0.545 15.041 654 H LYS 88 HN LYS 88 -5.233 -0.524 13.577 655 HA LYS 88 HA LYS 88 -3.440 -1.009 15.780 656 1HB LYS 88 HB1 LYS 88 -5.095 -2.663 16.313 657 2HB LYS 88 HB2 LYS 88 -5.167 -3.210 14.645 658 1HG LYS 88 HG2 LYS 88 -3.937 -4.824 15.867 659 2HG LYS 88 HG1 LYS 88 -2.780 -3.933 14.873 660 1HD LYS 88 HD2 LYS 88 -2.943 -2.525 17.288 661 2HD LYS 88 HD1 LYS 88 -2.882 -4.232 17.736 662 1HE LYS 88 HE1 LYS 88 -0.950 -4.324 15.983 663 2HE LYS 88 HE2 LYS 88 -0.876 -2.585 16.255 664 1HZ LYS 88 HZ1 LYS 88 -0.657 -4.658 18.372 665 2HZ LYS 88 HZ2 LYS 88 -0.540 -2.987 18.604 666 3HZ LYS 88 HZ3 LYS 88 0.639 -3.802 17.705 667 H ILE 89 HN ILE 89 -4.280 -1.275 12.410 668 HA ILE 89 HA ILE 89 -2.291 -2.825 11.384 669 HB ILE 89 HB ILE 89 -3.297 -0.266 10.155 670 1HG1 ILE 89 HG11 ILE 89 -4.264 -3.077 9.631 671 2HG1 ILE 89 HG12 ILE 89 -5.004 -2.046 10.851 672 1HG2 ILE 89 HG21 ILE 89 -1.697 -0.703 8.651 673 2HG2 ILE 89 HG22 ILE 89 -2.736 -2.031 8.132 674 3HG2 ILE 89 HG23 ILE 89 -1.429 -2.330 9.280 675 1HD1 ILE 89 HD11 ILE 89 -4.837 -1.480 7.904 676 2HD1 ILE 89 HD12 ILE 89 -5.528 -0.399 9.113 677 3HD1 ILE 89 HD13 ILE 89 -6.271 -1.968 8.806 678 H THR 90 HN THR 90 -1.916 0.653 10.888 679 HA THR 90 HA THR 90 0.870 0.589 10.674 680 HB THR 90 HB THR 90 -1.203 2.526 10.607 681 HG1 THR 90 HG1 THR 90 1.242 2.034 9.560 682 1HG2 THR 90 HG21 THR 90 0.878 3.167 12.586 683 2HG2 THR 90 HG22 THR 90 -0.771 3.772 12.425 684 3HG2 THR 90 HG23 THR 90 0.511 4.410 11.390 685 H GLY 91 HN GLY 91 -1.205 1.016 13.501 686 1HA GLY 91 HA2 GLY 91 0.760 1.802 15.360 687 2HA GLY 91 HA1 GLY 91 -0.710 0.911 15.747 688 H MET 92 HN MET 92 -0.016 -1.215 13.870 689 HA MET 92 HA MET 92 1.590 -2.856 15.620 690 1HB MET 92 HB1 MET 92 -0.413 -3.473 13.928 691 2HB MET 92 HB2 MET 92 0.951 -3.743 12.855 692 1HG MET 92 HG1 MET 92 1.689 -5.540 13.989 693 2HG MET 92 HG2 MET 92 1.122 -4.944 15.546 694 1HE MET 92 HE1 MET 92 -0.025 -5.632 12.126 695 2HE MET 92 HE2 MET 92 -1.762 -5.514 12.420 696 3HE MET 92 HE3 MET 92 -1.001 -7.097 12.250 697 H LEU 93 HN LEU 93 1.895 -1.196 12.576 698 HA LEU 93 HA LEU 93 4.251 -2.296 11.619 699 1HB LEU 93 HB2 LEU 93 2.827 0.277 11.259 700 2HB LEU 93 HB1 LEU 93 4.448 0.139 10.618 701 HG LEU 93 HG LEU 93 2.758 -0.345 8.902 702 1HD1 LEU 93 HD11 LEU 93 3.620 -3.000 8.872 703 2HD1 LEU 93 HD12 LEU 93 4.892 -2.109 9.709 704 3HD1 LEU 93 HD13 LEU 93 4.390 -1.619 8.089 705 1HD2 LEU 93 HD21 LEU 93 1.716 -2.093 11.025 706 2HD2 LEU 93 HD22 LEU 93 1.719 -2.785 9.400 707 3HD2 LEU 93 HD23 LEU 93 0.880 -1.265 9.709 708 H LEU 94 HN LEU 94 3.861 -0.628 14.458 709 HA LEU 94 HA LEU 94 6.667 0.257 14.460 710 1HB LEU 94 HB1 LEU 94 4.225 1.381 15.612 711 2HB LEU 94 HB2 LEU 94 5.534 1.252 16.769 712 HG LEU 94 HG LEU 94 5.328 3.462 15.537 713 1HD1 LEU 94 HD21 LEU 94 7.886 3.414 14.980 714 2HD1 LEU 94 HD22 LEU 94 7.808 1.826 15.745 715 3HD1 LEU 94 HD23 LEU 94 7.324 3.264 16.645 716 1HD2 LEU 94 HD11 LEU 94 6.354 3.543 13.289 717 2HD2 LEU 94 HD12 LEU 94 4.834 2.645 13.320 718 3HD2 LEU 94 HD13 LEU 94 6.371 1.779 13.262 719 H GLU 95 HN GLU 95 5.566 -2.427 14.714 720 HA GLU 95 HA GLU 95 7.097 -3.355 16.910 721 1HB GLU 95 HB2 GLU 95 5.441 -4.117 18.414 722 2HB GLU 95 HB1 GLU 95 5.003 -2.456 18.043 723 1HG GLU 95 HG1 GLU 95 3.243 -3.142 16.613 724 2HG GLU 95 HG2 GLU 95 3.790 -4.818 16.638 725 H ILE 96 HN ILE 96 5.701 -3.750 13.991 726 HA ILE 96 HA ILE 96 4.906 -6.444 13.917 727 HB ILE 96 HB ILE 96 5.280 -6.405 11.526 728 1HG1 ILE 96 HG12 ILE 96 7.429 -5.276 11.450 729 2HG1 ILE 96 HG11 ILE 96 6.275 -4.474 10.395 730 1HG2 ILE 96 HG21 ILE 96 3.270 -5.438 11.772 731 2HG2 ILE 96 HG22 ILE 96 4.125 -4.044 11.109 732 3HG2 ILE 96 HG23 ILE 96 3.878 -4.184 12.850 733 1HD1 ILE 96 HD11 ILE 96 6.033 -3.121 12.780 734 2HD1 ILE 96 HD12 ILE 96 6.909 -2.589 11.345 735 3HD1 ILE 96 HD13 ILE 96 7.761 -3.441 12.634 736 H ASP 97 HN ASP 97 6.580 -7.299 11.689 737 HA ASP 97 HA ASP 97 8.471 -8.891 12.991 738 1HB ASP 97 HB1 ASP 97 7.338 -8.991 10.597 739 2HB ASP 97 HB2 ASP 97 8.809 -8.150 10.111 740 H ASN 98 HN ASN 98 8.559 -5.646 12.569 741 HA ASN 98 HA ASN 98 10.132 -4.094 13.029 742 1HB ASN 98 HB1 ASN 98 11.878 -6.521 13.331 743 2HB ASN 98 HB2 ASN 98 12.559 -4.899 13.388 744 1HD2 ASN 98 HD22 ASN 98 12.994 -6.221 15.555 745 2HD2 ASN 98 HD21 ASN 98 11.933 -5.779 16.845 746 H SER 99 HN SER 99 10.628 -6.429 10.528 747 HA SER 99 HA SER 99 12.502 -4.845 9.032 748 1HB SER 99 HB2 SER 99 12.775 -6.780 7.948 749 2HB SER 99 HB1 SER 99 11.443 -7.485 8.867 750 HG SER 99 HG SER 99 11.230 -6.029 6.440 751 H GLU 100 HN GLU 100 9.052 -5.206 9.245 752 HA GLU 100 HA GLU 100 8.451 -3.680 6.881 753 1HB GLU 100 HB1 GLU 100 6.473 -3.979 9.081 754 2HB GLU 100 HB2 GLU 100 6.242 -4.078 7.343 755 1HG GLU 100 HG1 GLU 100 7.809 -6.231 7.748 756 2HG GLU 100 HG2 GLU 100 6.928 -6.173 9.276 757 H LEU 101 HN LEU 101 9.220 -3.053 10.163 758 HA LEU 101 HA LEU 101 8.164 -0.385 10.264 759 1HB LEU 101 HB1 LEU 101 8.422 -1.462 12.356 760 2HB LEU 101 HB2 LEU 101 10.059 -1.964 11.986 761 HG LEU 101 HG LEU 101 9.786 0.932 11.987 762 1HD1 LEU 101 HD11 LEU 101 8.886 1.372 13.984 763 2HD1 LEU 101 HD12 LEU 101 9.665 -0.014 14.746 764 3HD1 LEU 101 HD13 LEU 101 8.161 -0.230 13.850 765 1HD2 LEU 101 HD21 LEU 101 11.807 -0.785 12.214 766 2HD2 LEU 101 HD22 LEU 101 11.470 -0.538 13.928 767 3HD2 LEU 101 HD23 LEU 101 11.861 0.840 12.898 768 H LEU 102 HN LEU 102 11.000 -1.935 9.101 769 HA LEU 102 HA LEU 102 12.539 0.534 8.959 770 1HB LEU 102 HB2 LEU 102 13.088 -2.339 8.805 771 2HB LEU 102 HB1 LEU 102 13.964 -1.403 7.609 772 HG LEU 102 HG LEU 102 14.684 0.080 9.602 773 1HD1 LEU 102 HD21 LEU 102 13.041 -1.795 10.947 774 2HD1 LEU 102 HD22 LEU 102 13.979 -0.467 11.630 775 3HD1 LEU 102 HD23 LEU 102 14.704 -2.066 11.465 776 1HD2 LEU 102 HD11 LEU 102 16.642 -0.955 9.378 777 2HD2 LEU 102 HD12 LEU 102 15.806 -2.110 8.340 778 3HD2 LEU 102 HD13 LEU 102 16.013 -2.456 10.056 779 H HIS 103 HN HIS 103 11.049 -1.838 6.795 780 HA HIS 103 HA HIS 103 11.961 -0.663 4.395 781 1HB HIS 103 HB1 HIS 103 10.635 -2.983 5.108 782 2HB HIS 103 HB2 HIS 103 9.418 -2.091 4.206 783 HD2 HIS 103 HD2 HIS 103 11.440 -4.800 3.299 784 HE1 HIS 103 HE1 HIS 103 12.232 -2.078 0.156 785 HE2 HIS 103 HE2 HIS 103 12.392 -4.496 0.904 786 H MET 104 HN MET 104 9.017 -0.254 6.315 787 HA MET 104 HA MET 104 7.521 1.252 4.496 788 1HB MET 104 HB2 MET 104 6.212 1.974 6.368 789 2HB MET 104 HB1 MET 104 6.723 0.319 6.708 790 1HG MET 104 HG2 MET 104 8.685 1.442 7.932 791 2HG MET 104 HG1 MET 104 7.676 2.884 7.903 792 1HE MET 104 HE1 MET 104 4.417 1.502 9.584 793 2HE MET 104 HE2 MET 104 4.811 0.495 8.189 794 3HE MET 104 HE3 MET 104 5.009 2.244 8.098 795 H LEU 105 HN LEU 105 10.146 2.163 6.627 796 HA LEU 105 HA LEU 105 9.777 5.000 6.128 797 1HB LEU 105 HB1 LEU 105 12.147 3.770 7.500 798 2HB LEU 105 HB2 LEU 105 11.477 5.376 7.710 799 HG LEU 105 HG LEU 105 10.118 2.836 8.606 800 1HD1 LEU 105 HD11 LEU 105 12.112 3.124 9.903 801 2HD1 LEU 105 HD12 LEU 105 10.734 3.623 10.884 802 3HD1 LEU 105 HD13 LEU 105 11.770 4.839 10.134 803 1HD2 LEU 105 HD21 LEU 105 8.590 4.672 8.110 804 2HD2 LEU 105 HD22 LEU 105 9.517 5.733 9.171 805 3HD2 LEU 105 HD23 LEU 105 8.662 4.345 9.842 806 H GLU 106 HN GLU 106 11.280 2.405 4.619 807 HA GLU 106 HA GLU 106 13.263 4.170 3.372 808 1HB GLU 106 HB1 GLU 106 14.716 2.410 3.222 809 2HB GLU 106 HB2 GLU 106 13.783 1.874 4.613 810 1HG GLU 106 HG1 GLU 106 13.576 -0.035 3.491 811 2HG GLU 106 HG2 GLU 106 12.345 0.821 2.562 812 H SER 107 HN SER 107 10.289 2.753 2.734 813 HA SER 107 HA SER 107 10.720 3.173 -0.141 814 1HB SER 107 HB2 SER 107 10.750 0.660 0.749 815 2HB SER 107 HB1 SER 107 9.004 0.865 0.623 816 HG SER 107 HG SER 107 9.711 1.786 -1.587 817 HA PRO 108 HA PRO 108 6.896 5.404 0.343 818 1HB PRO 108 HB2 PRO 108 6.435 5.938 -2.265 819 2HB PRO 108 HB1 PRO 108 7.689 6.770 -1.337 820 1HG PRO 108 HG1 PRO 108 7.948 4.464 -3.234 821 2HG PRO 108 HG2 PRO 108 8.963 5.911 -3.090 822 1HD PRO 108 HD2 PRO 108 9.660 3.515 -2.025 823 2HD PRO 108 HD1 PRO 108 10.136 5.062 -1.298 824 H GLU 109 HN GLU 109 7.254 2.337 -0.705 825 HA GLU 109 HA GLU 109 4.364 2.009 -1.181 826 1HB GLU 109 HB2 GLU 109 6.600 0.436 -2.478 827 2HB GLU 109 HB1 GLU 109 4.880 0.153 -2.708 828 1HG GLU 109 HG1 GLU 109 4.613 2.246 -3.825 829 2HG GLU 109 HG2 GLU 109 6.264 2.723 -3.430 830 H SER 110 HN SER 110 7.087 1.223 0.661 831 HA SER 110 HA SER 110 6.183 -1.374 1.513 832 1HB SER 110 HB1 SER 110 8.482 0.383 2.111 833 2HB SER 110 HB2 SER 110 7.944 -0.644 3.441 834 HG SER 110 HG SER 110 8.143 -1.889 0.983 835 H LEU 111 HN LEU 111 6.290 1.890 2.863 836 HA LEU 111 HA LEU 111 5.068 1.532 5.289 837 1HB LEU 111 HB1 LEU 111 5.903 3.662 4.093 838 2HB LEU 111 HB2 LEU 111 4.307 3.736 3.377 839 HG LEU 111 HG LEU 111 4.239 5.231 5.167 840 1HD1 LEU 111 HD21 LEU 111 3.129 2.914 6.649 841 2HD1 LEU 111 HD22 LEU 111 2.445 3.315 5.073 842 3HD1 LEU 111 HD23 LEU 111 2.447 4.513 6.364 843 1HD2 LEU 111 HD11 LEU 111 5.169 4.969 7.274 844 2HD2 LEU 111 HD12 LEU 111 6.364 4.245 6.191 845 3HD2 LEU 111 HD13 LEU 111 5.261 3.214 7.123 846 H ARG 112 HN ARG 112 3.601 1.702 2.076 847 HA ARG 112 HA ARG 112 0.946 1.350 3.110 848 1HB ARG 112 HB2 ARG 112 0.793 2.605 1.230 849 2HB ARG 112 HB1 ARG 112 2.191 1.850 0.475 850 1HG ARG 112 HG1 ARG 112 0.928 0.032 -0.285 851 2HG ARG 112 HG2 ARG 112 -0.439 0.435 0.760 852 1HD ARG 112 HD1 ARG 112 0.387 1.611 -1.829 853 2HD ARG 112 HD2 ARG 112 -1.227 1.280 -1.195 854 HE ARG 112 HE ARG 112 -0.582 3.279 0.360 855 1HH1 ARG 112 HH12 ARG 112 0.089 2.923 -3.042 856 2HH1 ARG 112 HH11 ARG 112 0.068 4.626 -3.353 857 1HH2 ARG 112 HH22 ARG 112 -0.610 5.521 -0.043 858 2HH2 ARG 112 HH21 ARG 112 -0.329 6.103 -1.651 859 H SER 113 HN SER 113 2.777 -0.575 0.714 860 HA SER 113 HA SER 113 1.193 -2.790 0.643 861 1HB SER 113 HB1 SER 113 4.149 -2.435 0.304 862 2HB SER 113 HB2 SER 113 3.463 -4.059 0.272 863 HG SER 113 HG SER 113 2.361 -3.580 -1.530 864 H LYS 114 HN LYS 114 3.858 -2.230 2.930 865 HA LYS 114 HA LYS 114 3.565 -4.670 4.309 866 1HB LYS 114 HB1 LYS 114 4.690 -2.055 5.326 867 2HB LYS 114 HB2 LYS 114 4.908 -3.627 6.083 868 1HG LYS 114 HG1 LYS 114 5.809 -3.021 3.283 869 2HG LYS 114 HG2 LYS 114 6.834 -2.791 4.701 870 1HD LYS 114 HD1 LYS 114 7.101 -5.024 5.044 871 2HD LYS 114 HD2 LYS 114 5.501 -5.421 4.412 872 1HE LYS 114 HE1 LYS 114 6.793 -4.440 2.201 873 2HE LYS 114 HE2 LYS 114 8.082 -5.293 3.050 874 1HZ LYS 114 HZ1 LYS 114 5.952 -6.364 1.540 875 2HZ LYS 114 HZ2 LYS 114 5.859 -6.943 3.126 876 3HZ LYS 114 HZ3 LYS 114 7.274 -7.164 2.226 877 H VAL 115 HN VAL 115 1.976 -1.543 4.649 878 HA VAL 115 HA VAL 115 0.767 -2.125 7.171 879 HB VAL 115 HB VAL 115 0.544 0.028 5.172 880 1HG1 VAL 115 HG11 VAL 115 -1.821 -0.846 5.366 881 2HG1 VAL 115 HG12 VAL 115 -1.584 0.844 5.810 882 3HG1 VAL 115 HG13 VAL 115 -1.756 -0.379 7.066 883 1HG2 VAL 115 HG21 VAL 115 1.289 -0.336 7.889 884 2HG2 VAL 115 HG22 VAL 115 -0.020 0.846 7.825 885 3HG2 VAL 115 HG23 VAL 115 1.451 1.105 6.885 886 H ASP 116 HN ASP 116 -0.533 -2.098 3.842 887 HA ASP 116 HA ASP 116 -3.029 -3.192 4.356 888 1HB ASP 116 HB1 ASP 116 -2.528 -2.297 2.179 889 2HB ASP 116 HB2 ASP 116 -1.221 -3.452 1.944 890 H GLU 117 HN GLU 117 0.083 -4.771 3.926 891 HA GLU 117 HA GLU 117 -0.996 -7.433 3.986 892 1HB GLU 117 HB1 GLU 117 1.723 -6.212 3.938 893 2HB GLU 117 HB2 GLU 117 1.582 -7.854 4.551 894 1HG GLU 117 HG2 GLU 117 0.848 -8.688 2.513 895 2HG GLU 117 HG1 GLU 117 0.373 -7.096 1.924 896 H ALA 118 HN ALA 118 0.210 -5.114 6.293 897 HA ALA 118 HA ALA 118 0.463 -6.943 8.471 898 1HB ALA 118 HB1 ALA 118 0.986 -5.140 9.798 899 2HB ALA 118 HB2 ALA 118 -0.052 -4.036 8.893 900 3HB ALA 118 HB3 ALA 118 1.484 -4.568 8.205 901 H VAL 119 HN VAL 119 -2.143 -5.370 6.906 902 HA VAL 119 HA VAL 119 -4.015 -5.382 9.056 903 HB VAL 119 HB VAL 119 -4.672 -5.606 6.135 904 1HG1 VAL 119 HG11 VAL 119 -6.198 -4.478 8.479 905 2HG1 VAL 119 HG12 VAL 119 -6.477 -6.054 7.736 906 3HG1 VAL 119 HG13 VAL 119 -6.768 -4.578 6.814 907 1HG2 VAL 119 HG21 VAL 119 -4.955 -2.949 7.008 908 2HG2 VAL 119 HG22 VAL 119 -3.827 -3.584 5.811 909 3HG2 VAL 119 HG23 VAL 119 -3.347 -3.478 7.506 910 H ALA 120 HN ALA 120 -3.310 -7.533 6.347 911 HA ALA 120 HA ALA 120 -5.175 -9.543 6.965 912 1HB ALA 120 HB1 ALA 120 -3.139 -9.120 5.060 913 2HB ALA 120 HB2 ALA 120 -4.336 -10.419 5.087 914 3HB ALA 120 HB3 ALA 120 -2.766 -10.650 5.858 915 H VAL 121 HN VAL 121 -2.212 -8.557 8.347 916 HA VAL 121 HA VAL 121 -1.737 -11.002 9.818 917 HB VAL 121 HB VAL 121 -0.361 -8.321 9.748 918 1HG1 VAL 121 HG21 VAL 121 0.725 -10.644 11.271 919 2HG1 VAL 121 HG22 VAL 121 -0.418 -9.537 12.030 920 3HG1 VAL 121 HG23 VAL 121 1.115 -8.928 11.406 921 1HG2 VAL 121 HG11 VAL 121 -0.150 -10.222 7.943 922 2HG2 VAL 121 HG12 VAL 121 0.949 -10.921 9.133 923 3HG2 VAL 121 HG13 VAL 121 1.265 -9.315 8.479 924 H LEU 122 HN LEU 122 -3.075 -7.801 10.306 925 HA LEU 122 HA LEU 122 -3.244 -7.962 13.151 926 1HB LEU 122 HB2 LEU 122 -3.636 -5.788 12.874 927 2HB LEU 122 HB1 LEU 122 -3.743 -6.018 11.140 928 HG LEU 122 HG LEU 122 -6.241 -6.813 12.046 929 1HD1 LEU 122 HD11 LEU 122 -6.963 -5.516 13.758 930 2HD1 LEU 122 HD12 LEU 122 -5.861 -4.195 13.367 931 3HD1 LEU 122 HD13 LEU 122 -5.264 -5.617 14.221 932 1HD2 LEU 122 HD21 LEU 122 -6.458 -4.117 11.361 933 2HD2 LEU 122 HD22 LEU 122 -6.621 -5.509 10.290 934 3HD2 LEU 122 HD23 LEU 122 -5.057 -4.715 10.473 935 H GLN 123 HN GLN 123 -5.355 -8.689 10.452 936 HA GLN 123 HA GLN 123 -7.657 -9.338 11.993 937 1HB GLN 123 HB1 GLN 123 -6.821 -10.030 9.170 938 2HB GLN 123 HB2 GLN 123 -8.376 -10.488 9.854 939 1HG GLN 123 HG2 GLN 123 -7.988 -7.710 10.289 940 2HG GLN 123 HG1 GLN 123 -7.633 -8.066 8.600 941 1HE2 GLN 123 HE22 GLN 123 -9.452 -6.982 7.877 942 2HE2 GLN 123 HE21 GLN 123 -11.047 -7.616 8.075 943 H ALA 124 HN ALA 124 -4.787 -11.006 10.985 944 HA ALA 124 HA ALA 124 -5.793 -13.620 11.769 945 1HB ALA 124 HB1 ALA 124 -3.688 -14.477 10.981 946 2HB ALA 124 HB2 ALA 124 -3.017 -12.848 10.873 947 3HB ALA 124 HB3 ALA 124 -4.318 -13.341 9.789 948 H HIS 125 HN HIS 125 -4.514 -10.971 13.318 949 HA HIS 125 HA HIS 125 -3.337 -12.632 15.449 950 1HB HIS 125 HB1 HIS 125 -2.075 -10.653 14.089 951 2HB HIS 125 HB2 HIS 125 -2.763 -9.724 15.416 952 HD2 HIS 125 HD2 HIS 125 0.034 -12.289 14.723 953 HE1 HIS 125 HE1 HIS 125 0.150 -11.233 18.821 954 HE2 HIS 125 HE2 HIS 125 1.351 -12.459 16.954 955 H GLN 126 HN GLN 126 -6.020 -10.858 14.655 956 HA GLN 126 HA GLN 126 -6.514 -9.466 17.077 957 1HB GLN 126 HB1 GLN 126 -8.090 -10.193 14.664 958 2HB GLN 126 HB2 GLN 126 -8.993 -9.780 16.114 959 1HG GLN 126 HG2 GLN 126 -6.842 -8.012 14.988 960 2HG GLN 126 HG1 GLN 126 -8.531 -7.903 14.490 961 1HE2 GLN 126 HE22 GLN 126 -9.892 -6.740 15.682 962 2HE2 GLN 126 HE21 GLN 126 -9.525 -6.045 17.222 963 H ALA 127 HN ALA 127 -9.136 -11.524 16.255 964 HA ALA 127 HA ALA 127 -8.901 -12.836 18.858 965 1HB ALA 127 HB1 ALA 127 -11.320 -13.549 17.577 966 2HB ALA 127 HB2 ALA 127 -11.073 -11.819 17.330 967 3HB ALA 127 HB3 ALA 127 -11.086 -12.484 18.963 968 H LYS 128 HN LYS 128 -7.227 -13.653 16.612 969 HA LYS 128 HA LYS 128 -8.326 -16.240 15.835 970 1HB LYS 128 HB2 LYS 128 -5.666 -15.033 15.066 971 2HB LYS 128 HB1 LYS 128 -6.473 -16.395 14.303 972 1HG LYS 128 HG2 LYS 128 -8.244 -14.179 14.251 973 2HG LYS 128 HG1 LYS 128 -6.664 -13.648 13.670 974 1HD LYS 128 HD2 LYS 128 -6.764 -14.939 11.814 975 2HD LYS 128 HD1 LYS 128 -7.619 -16.244 12.641 976 1HE LYS 128 HE1 LYS 128 -8.792 -13.656 11.634 977 2HE LYS 128 HE2 LYS 128 -9.070 -15.270 10.982 978 1HZ LYS 128 HZ1 LYS 128 -10.120 -15.885 13.080 979 2HZ LYS 128 HZ2 LYS 128 -10.910 -14.572 12.364 980 3HZ LYS 128 HZ3 LYS 128 -9.875 -14.322 13.679 981 H GLU 129 HN GLU 129 -5.762 -17.512 15.541 982 HA GLU 129 HA GLU 129 -5.455 -18.464 18.272 983 1HB GLU 129 HB1 GLU 129 -3.981 -20.194 17.172 984 2HB GLU 129 HB2 GLU 129 -5.658 -20.193 16.644 985 1HG GLU 129 HG1 GLU 129 -3.953 -18.485 15.020 986 2HG GLU 129 HG2 GLU 129 -3.453 -20.176 15.017 987 H ALA 130 HN ALA 130 -4.429 -15.823 17.318 988 HA ALA 130 HA ALA 130 -1.549 -16.117 17.401 989 1HB ALA 130 HB1 ALA 130 -2.658 -13.415 17.612 990 2HB ALA 130 HB2 ALA 130 -3.183 -14.316 16.190 991 3HB ALA 130 HB3 ALA 130 -1.463 -14.071 16.493 992 H ALA 131 HN ALA 131 -2.910 -17.026 19.734 993 HA ALA 131 HA ALA 131 -2.858 -15.108 21.816 994 1HB ALA 131 HB1 ALA 131 -2.922 -18.095 21.725 995 2HB ALA 131 HB2 ALA 131 -4.137 -16.966 22.322 996 3HB ALA 131 HB3 ALA 131 -2.672 -17.259 23.258 997 H GLN 132 HN GLN 132 -0.384 -16.545 20.067 998 HA GLN 132 HA GLN 132 1.572 -16.518 22.216 999 1HB GLN 132 HB2 GLN 132 1.635 -17.299 19.316 1000 2HB GLN 132 HB1 GLN 132 3.130 -17.079 20.215 1001 1HG GLN 132 HG1 GLN 132 1.674 -18.696 21.875 1002 2HG GLN 132 HG2 GLN 132 1.207 -19.266 20.273 1003 1HE2 GLN 132 HE21 GLN 132 2.625 -20.823 22.083 1004 2HE2 GLN 132 HE22 GLN 132 4.208 -21.110 21.453 1005 H LYS 133 HN LYS 133 3.669 -15.373 21.841 1006 HA LYS 133 HA LYS 133 3.111 -12.627 21.054 1007 1HB LYS 133 HB1 LYS 133 5.129 -13.984 22.755 1008 2HB LYS 133 HB2 LYS 133 5.641 -12.510 21.948 1009 1HG LYS 133 HG1 LYS 133 4.765 -11.421 23.671 1010 2HG LYS 133 HG2 LYS 133 3.185 -11.836 23.000 1011 1HD LYS 133 HD2 LYS 133 2.736 -13.096 24.772 1012 2HD LYS 133 HD1 LYS 133 4.176 -14.071 24.471 1013 1HE LYS 133 HE2 LYS 133 4.987 -11.584 25.593 1014 2HE LYS 133 HE1 LYS 133 3.688 -12.245 26.585 1015 1HZ LYS 133 HZ1 LYS 133 6.382 -13.047 26.459 1016 2HZ LYS 133 HZ2 LYS 133 5.408 -14.343 25.977 1017 3HZ LYS 133 HZ3 LYS 133 5.159 -13.612 27.483 1018 H ALA 134 HN ALA 134 4.770 -15.407 19.892 1019 HA ALA 134 HA ALA 134 6.525 -13.961 18.113 1020 1HB ALA 134 HB1 ALA 134 5.887 -16.899 18.323 1021 2HB ALA 134 HB2 ALA 134 7.283 -16.066 19.007 1022 3HB ALA 134 HB3 ALA 134 7.109 -16.205 17.256 1023 H VAL 135 HN VAL 135 6.195 -13.477 16.017 1024 HA VAL 135 HA VAL 135 3.573 -14.165 14.880 1025 HB VAL 135 HB VAL 135 4.145 -12.302 13.229 1026 1HG1 VAL 135 HG21 VAL 135 2.610 -11.318 14.499 1027 2HG1 VAL 135 HG22 VAL 135 3.912 -10.691 15.509 1028 3HG1 VAL 135 HG23 VAL 135 3.137 -12.221 15.918 1029 1HG2 VAL 135 HG11 VAL 135 5.743 -10.613 14.079 1030 2HG2 VAL 135 HG12 VAL 135 6.516 -12.135 13.635 1031 3HG2 VAL 135 HG13 VAL 135 6.234 -11.752 15.333 1032 H ASN 136 HN ASN 136 3.395 -15.335 13.058 1033 HA ASN 136 HA ASN 136 5.841 -16.450 11.931 1034 1HB ASN 136 HB1 ASN 136 2.927 -17.189 11.617 1035 2HB ASN 136 HB2 ASN 136 4.227 -17.979 10.728 1036 1HD2 ASN 136 HD21 ASN 136 3.052 -19.774 11.962 1037 2HD2 ASN 136 HD22 ASN 136 3.735 -20.201 13.490 1038 H SER 137 HN SER 137 6.061 -16.680 9.587 1039 HA SER 137 HA SER 137 5.173 -14.241 8.230 1040 1HB SER 137 HB2 SER 137 7.491 -14.360 8.025 1041 2HB SER 137 HB1 SER 137 7.487 -16.115 7.851 1042 HG SER 137 HG SER 137 7.355 -15.859 5.779 1043 H ALA 138 HN ALA 138 5.967 -17.485 7.002 1044 HA ALA 138 HA ALA 138 3.901 -17.296 5.009 1045 1HB ALA 138 HB1 ALA 138 4.980 -19.938 5.218 1046 2HB ALA 138 HB2 ALA 138 6.284 -18.755 5.317 1047 3HB ALA 138 HB3 ALA 138 5.189 -18.747 3.935 1048 H THR 139 HN THR 139 2.174 -18.813 4.740 1049 HA THR 139 HA THR 139 1.054 -19.665 7.306 1050 HB THR 139 HB THR 139 -0.415 -18.257 6.040 1051 HG1 THR 139 HG1 THR 139 -1.257 -20.945 5.717 1052 1HG2 THR 139 HG21 THR 139 -1.208 -19.597 3.785 1053 2HG2 THR 139 HG22 THR 139 0.548 -19.767 3.760 1054 3HG2 THR 139 HG23 THR 139 -0.182 -18.164 3.839 1055 H GLY 140 HN GLY 140 1.987 -20.901 4.150 1056 1HA GLY 140 HA2 GLY 140 1.083 -23.588 4.838 1057 2HA GLY 140 HA1 GLY 140 1.756 -23.080 3.297 1058 H VAL 141 HN VAL 141 2.868 -23.105 6.688 1059 HA VAL 141 HA VAL 141 5.483 -24.026 5.764 1060 HB VAL 141 HB VAL 141 4.810 -23.300 8.603 1061 1HG1 VAL 141 HG21 VAL 141 7.017 -24.449 7.668 1062 2HG1 VAL 141 HG22 VAL 141 7.054 -23.263 8.973 1063 3HG1 VAL 141 HG23 VAL 141 7.432 -22.769 7.324 1064 1HG2 VAL 141 HG11 VAL 141 5.658 -21.434 6.390 1065 2HG2 VAL 141 HG12 VAL 141 5.593 -21.020 8.102 1066 3HG2 VAL 141 HG13 VAL 141 4.111 -21.422 7.235 1067 HA PRO 142 HA PRO 142 4.324 -27.398 9.081 1068 1HB PRO 142 HB2 PRO 142 1.387 -27.196 9.217 1069 2HB PRO 142 HB1 PRO 142 2.563 -27.355 10.525 1070 1HG PRO 142 HG1 PRO 142 1.258 -25.055 10.095 1071 2HG PRO 142 HG2 PRO 142 2.947 -25.078 10.635 1072 1HD PRO 142 HD1 PRO 142 1.842 -24.610 7.889 1073 2HD PRO 142 HD2 PRO 142 3.162 -23.768 8.731 1074 H THR 143 HN THR 143 2.811 -29.465 8.925 1075 HA THR 143 HA THR 143 2.811 -30.194 6.127 1076 HB THR 143 HB THR 143 2.142 -32.462 7.070 1077 HG1 THR 143 HG1 THR 143 1.519 -32.443 9.058 1078 1HG2 THR 143 HG21 THR 143 4.681 -31.169 8.013 1079 2HG2 THR 143 HG22 THR 143 4.437 -32.157 6.572 1080 3HG2 THR 143 HG23 THR 143 4.336 -32.891 8.173 1081 H VAL 144 HN VAL 144 1.032 -28.552 5.773 1082 HA VAL 144 HA VAL 144 -1.603 -29.764 6.294 1083 HB VAL 144 HB VAL 144 -1.332 -27.545 7.318 1084 1HG1 VAL 144 HG11 VAL 144 0.205 -26.399 5.993 1085 2HG1 VAL 144 HG12 VAL 144 -1.321 -25.581 5.659 1086 3HG1 VAL 144 HG13 VAL 144 -0.674 -26.746 4.504 1087 1HG2 VAL 144 HG21 VAL 144 -3.226 -27.279 5.003 1088 2HG2 VAL 144 HG22 VAL 144 -3.405 -26.672 6.648 1089 3HG2 VAL 144 HG23 VAL 144 -3.520 -28.402 6.330 Start of MODEL 15 1 1H GLY 1 HT1 GLY 1 -30.689 -31.858 22.712 2 2H GLY 1 HT2 GLY 1 -29.207 -31.463 22.000 3 3H GLY 1 HT3 GLY 1 -30.626 -31.419 21.080 4 1HA GLY 1 HA1 GLY 1 -31.410 -29.695 22.815 5 2HA GLY 1 HA2 GLY 1 -29.691 -29.541 23.144 6 HA PRO 2 HA PRO 2 -31.032 -27.824 18.710 7 1HB PRO 2 HB1 PRO 2 -32.947 -25.910 19.903 8 2HB PRO 2 HB2 PRO 2 -33.076 -26.849 18.413 9 1HG PRO 2 HG2 PRO 2 -34.517 -27.481 20.573 10 2HG PRO 2 HG1 PRO 2 -33.847 -28.736 19.513 11 1HD PRO 2 HD1 PRO 2 -32.872 -27.784 22.179 12 2HD PRO 2 HD2 PRO 2 -32.950 -29.436 21.533 13 H LEU 3 HN LEU 3 -30.387 -25.717 17.911 14 HA LEU 3 HA LEU 3 -28.736 -24.288 19.866 15 1HB LEU 3 HB2 LEU 3 -28.624 -23.887 16.894 16 2HB LEU 3 HB1 LEU 3 -27.378 -23.581 18.088 17 HG LEU 3 HG LEU 3 -28.271 -26.396 17.729 18 1HD1 LEU 3 HD11 LEU 3 -26.450 -24.980 15.787 19 2HD1 LEU 3 HD12 LEU 3 -28.065 -25.591 15.430 20 3HD1 LEU 3 HD13 LEU 3 -26.768 -26.713 15.839 21 1HD2 LEU 3 HD21 LEU 3 -26.590 -25.690 19.416 22 2HD2 LEU 3 HD22 LEU 3 -25.543 -25.170 18.094 23 3HD2 LEU 3 HD23 LEU 3 -25.982 -26.871 18.255 24 H GLY 4 HN GLY 4 -28.805 -22.049 20.089 25 1HA GLY 4 HA1 GLY 4 -31.352 -20.853 19.262 26 2HA GLY 4 HA2 GLY 4 -30.301 -20.262 20.540 27 H SER 5 HN SER 5 -31.529 -19.133 17.942 28 HA SER 5 HA SER 5 -29.139 -18.303 16.511 29 1HB SER 5 HB1 SER 5 -31.327 -16.862 15.517 30 2HB SER 5 HB2 SER 5 -30.613 -18.314 14.816 31 HG SER 5 HG SER 5 -32.780 -18.703 15.157 32 H ALA 6 HN ALA 6 -28.424 -16.173 16.326 33 HA ALA 6 HA ALA 6 -27.857 -14.113 17.107 34 1HB ALA 6 HB1 ALA 6 -30.825 -14.055 17.590 35 2HB ALA 6 HB2 ALA 6 -29.930 -13.380 16.228 36 3HB ALA 6 HB3 ALA 6 -29.779 -12.655 17.829 37 H ALA 7 HN ALA 7 -26.896 -15.752 18.813 38 HA ALA 7 HA ALA 7 -27.988 -15.335 21.480 39 1HB ALA 7 HB1 ALA 7 -25.426 -16.780 21.001 40 2HB ALA 7 HB2 ALA 7 -26.940 -17.527 20.494 41 3HB ALA 7 HB3 ALA 7 -26.695 -17.093 22.186 42 H ALA 8 HN ALA 8 -26.416 -13.358 19.608 43 HA ALA 8 HA ALA 8 -25.088 -12.008 21.788 44 1HB ALA 8 HB1 ALA 8 -22.979 -11.771 20.276 45 2HB ALA 8 HB2 ALA 8 -23.557 -13.277 19.560 46 3HB ALA 8 HB3 ALA 8 -23.185 -13.205 21.283 47 H ALA 9 HN ALA 9 -27.334 -11.353 20.262 48 HA ALA 9 HA ALA 9 -28.280 -9.613 19.145 49 1HB ALA 9 HB1 ALA 9 -26.523 -7.582 18.907 50 2HB ALA 9 HB2 ALA 9 -25.783 -8.490 20.226 51 3HB ALA 9 HB3 ALA 9 -27.445 -7.920 20.372 52 H THR 10 HN THR 10 -27.765 -7.976 17.220 53 HA THR 10 HA THR 10 -26.115 -9.349 15.219 54 HB THR 10 HB THR 10 -27.962 -8.858 13.543 55 HG1 THR 10 HG1 THR 10 -29.036 -7.640 15.562 56 1HG2 THR 10 HG21 THR 10 -28.178 -11.051 13.765 57 2HG2 THR 10 HG22 THR 10 -29.506 -10.697 14.870 58 3HG2 THR 10 HG23 THR 10 -27.885 -10.989 15.503 59 HA PRO 11 HA PRO 11 -25.285 -9.028 13.204 60 1HB PRO 11 HB1 PRO 11 -22.684 -7.698 12.999 61 2HB PRO 11 HB2 PRO 11 -23.745 -8.280 11.715 62 1HG PRO 11 HG1 PRO 11 -23.355 -5.651 12.177 63 2HG PRO 11 HG2 PRO 11 -24.898 -6.291 11.584 64 1HD PRO 11 HD1 PRO 11 -24.128 -5.475 14.363 65 2HD PRO 11 HD2 PRO 11 -25.638 -5.172 13.479 66 H ALA 12 HN ALA 12 -24.231 -10.781 13.993 67 HA ALA 12 HA ALA 12 -23.202 -10.645 16.676 68 1HB ALA 12 HB1 ALA 12 -23.395 -12.980 14.777 69 2HB ALA 12 HB2 ALA 12 -24.594 -12.518 15.986 70 3HB ALA 12 HB3 ALA 12 -23.001 -13.078 16.494 71 H VAL 13 HN VAL 13 -21.876 -10.578 13.509 72 HA VAL 13 HA VAL 13 -19.191 -11.200 14.532 73 HB VAL 13 HB VAL 13 -18.865 -10.866 11.831 74 1HG1 VAL 13 HG11 VAL 13 -19.007 -13.087 13.724 75 2HG1 VAL 13 HG12 VAL 13 -17.805 -12.725 12.484 76 3HG1 VAL 13 HG13 VAL 13 -19.300 -13.554 12.049 77 1HG2 VAL 13 HG21 VAL 13 -20.643 -12.228 10.774 78 2HG2 VAL 13 HG22 VAL 13 -21.225 -10.680 11.387 79 3HG2 VAL 13 HG23 VAL 13 -21.548 -12.163 12.286 80 H ARG 14 HN ARG 14 -17.642 -9.685 14.644 81 HA ARG 14 HA ARG 14 -18.397 -6.935 14.115 82 1HB ARG 14 HB1 ARG 14 -15.911 -8.123 15.361 83 2HB ARG 14 HB2 ARG 14 -16.236 -6.401 15.227 84 1HG ARG 14 HG2 ARG 14 -17.988 -6.491 16.769 85 2HG ARG 14 HG1 ARG 14 -18.134 -8.245 16.633 86 1HD ARG 14 HD2 ARG 14 -17.005 -8.136 18.605 87 2HD ARG 14 HD1 ARG 14 -15.632 -8.145 17.499 88 HE ARG 14 HE ARG 14 -16.741 -5.634 18.566 89 1HH1 ARG 14 HH11 ARG 14 -14.061 -7.777 17.954 90 2HH1 ARG 14 HH12 ARG 14 -12.867 -6.645 18.495 91 1HH2 ARG 14 HH22 ARG 14 -15.175 -4.138 19.279 92 2HH2 ARG 14 HH21 ARG 14 -13.500 -4.578 19.247 93 H THR 15 HN THR 15 -15.541 -8.935 13.344 94 HA THR 15 HA THR 15 -15.024 -7.203 11.038 95 HB THR 15 HB THR 15 -13.060 -9.294 11.502 96 HG1 THR 15 HG1 THR 15 -13.818 -7.635 13.653 97 1HG2 THR 15 HG21 THR 15 -12.893 -6.295 11.597 98 2HG2 THR 15 HG22 THR 15 -12.509 -7.336 10.225 99 3HG2 THR 15 HG23 THR 15 -11.516 -7.394 11.681 100 H VAL 16 HN VAL 16 -15.451 -7.843 9.035 101 HA VAL 16 HA VAL 16 -15.966 -10.707 8.564 102 HB VAL 16 HB VAL 16 -17.114 -8.496 6.881 103 1HG1 VAL 16 HG11 VAL 16 -16.978 -11.118 6.373 104 2HG1 VAL 16 HG12 VAL 16 -18.328 -10.109 5.851 105 3HG1 VAL 16 HG13 VAL 16 -18.470 -11.089 7.312 106 1HG2 VAL 16 HG21 VAL 16 -17.799 -8.184 9.247 107 2HG2 VAL 16 HG22 VAL 16 -18.479 -9.811 9.224 108 3HG2 VAL 16 HG23 VAL 16 -19.142 -8.564 8.169 109 HA PRO 17 HA PRO 17 -12.248 -10.378 6.049 110 1HB PRO 17 HB2 PRO 17 -13.278 -12.990 5.070 111 2HB PRO 17 HB1 PRO 17 -11.674 -12.568 5.680 112 1HG PRO 17 HG1 PRO 17 -13.370 -13.975 7.175 113 2HG PRO 17 HG2 PRO 17 -12.332 -12.733 7.899 114 1HD PRO 17 HD2 PRO 17 -15.246 -12.625 7.242 115 2HD PRO 17 HD1 PRO 17 -14.376 -11.945 8.633 116 H GLN 18 HN GLN 18 -12.419 -8.989 4.395 117 HA GLN 18 HA GLN 18 -14.533 -9.232 2.433 118 1HB GLN 18 HB2 GLN 18 -13.001 -7.122 3.443 119 2HB GLN 18 HB1 GLN 18 -12.467 -7.304 1.778 120 1HG GLN 18 HG1 GLN 18 -15.283 -7.458 1.770 121 2HG GLN 18 HG2 GLN 18 -14.833 -6.086 2.780 122 1HE2 GLN 18 HE22 GLN 18 -12.868 -4.853 1.720 123 2HE2 GLN 18 HE21 GLN 18 -13.124 -4.417 0.068 124 H TYR 19 HN TYR 19 -13.221 -8.334 0.137 125 HA TYR 19 HA TYR 19 -12.362 -10.742 -1.009 126 1HB TYR 19 HB2 TYR 19 -13.211 -8.440 -2.049 127 2HB TYR 19 HB1 TYR 19 -11.481 -8.163 -2.217 128 HD1 TYR 19 HD1 TYR 19 -10.227 -9.242 -3.912 129 HD2 TYR 19 HD2 TYR 19 -14.244 -10.429 -3.171 130 HE1 TYR 19 HE1 TYR 19 -10.208 -10.577 -5.977 131 HE2 TYR 19 HE2 TYR 19 -14.236 -11.768 -5.234 132 HH TYR 19 HH TYR 19 -12.336 -12.928 -6.669 133 H LYS 20 HN LYS 20 -10.486 -11.775 -0.911 134 HA LYS 20 HA LYS 20 -8.190 -10.463 0.299 135 1HB LYS 20 HB2 LYS 20 -9.201 -13.114 0.231 136 2HB LYS 20 HB1 LYS 20 -7.619 -13.143 -0.535 137 1HG LYS 20 HG2 LYS 20 -6.691 -13.180 1.470 138 2HG LYS 20 HG1 LYS 20 -7.347 -11.570 1.775 139 1HD LYS 20 HD1 LYS 20 -9.536 -13.025 2.272 140 2HD LYS 20 HD2 LYS 20 -8.302 -14.218 2.688 141 1HE LYS 20 HE1 LYS 20 -7.833 -13.180 4.598 142 2HE LYS 20 HE2 LYS 20 -7.654 -11.628 3.780 143 1HZ LYS 20 HZ1 LYS 20 -9.434 -11.154 5.070 144 2HZ LYS 20 HZ2 LYS 20 -9.975 -12.755 5.142 145 3HZ LYS 20 HZ3 LYS 20 -10.277 -11.820 3.765 146 H TYR 21 HN TYR 21 -5.999 -11.384 -0.728 147 HA TYR 21 HA TYR 21 -5.964 -10.305 -3.429 148 1HB TYR 21 HB1 TYR 21 -3.878 -10.898 -1.358 149 2HB TYR 21 HB2 TYR 21 -3.401 -10.719 -3.044 150 HD1 TYR 21 HD1 TYR 21 -4.379 -8.545 -4.222 151 HD2 TYR 21 HD2 TYR 21 -3.862 -9.016 -0.025 152 HE1 TYR 21 HE1 TYR 21 -4.342 -6.100 -3.958 153 HE2 TYR 21 HE2 TYR 21 -3.824 -6.573 0.251 154 HH TYR 21 HH TYR 21 -3.299 -4.459 -2.146 155 H ALA 22 HN ALA 22 -7.292 -12.528 -3.701 156 HA ALA 22 HA ALA 22 -5.516 -14.767 -4.234 157 1HB ALA 22 HB1 ALA 22 -8.396 -14.397 -3.891 158 2HB ALA 22 HB2 ALA 22 -7.374 -15.785 -3.515 159 3HB ALA 22 HB3 ALA 22 -7.962 -15.542 -5.160 160 H ALA 23 HN ALA 23 -4.266 -13.874 -5.931 161 HA ALA 23 HA ALA 23 -5.595 -13.088 -8.388 162 1HB ALA 23 HB1 ALA 23 -2.755 -13.387 -8.674 163 2HB ALA 23 HB2 ALA 23 -3.129 -12.493 -7.200 164 3HB ALA 23 HB3 ALA 23 -3.741 -11.927 -8.754 165 H GLY 24 HN GLY 24 -5.299 -15.959 -7.109 166 1HA GLY 24 HA2 GLY 24 -3.987 -17.432 -9.213 167 2HA GLY 24 HA1 GLY 24 -4.869 -18.113 -7.853 168 H VAL 25 HN VAL 25 -7.327 -17.655 -7.986 169 HA VAL 25 HA VAL 25 -8.176 -18.363 -10.711 170 HB VAL 25 HB VAL 25 -8.723 -20.087 -9.130 171 1HG1 VAL 25 HG11 VAL 25 -9.099 -19.618 -6.997 172 2HG1 VAL 25 HG12 VAL 25 -10.644 -18.893 -7.439 173 3HG1 VAL 25 HG13 VAL 25 -9.191 -17.897 -7.369 174 1HG2 VAL 25 HG21 VAL 25 -10.840 -18.509 -10.407 175 2HG2 VAL 25 HG22 VAL 25 -11.395 -19.610 -9.147 176 3HG2 VAL 25 HG23 VAL 25 -10.480 -20.231 -10.521 177 H ARG 26 HN ARG 26 -9.389 -16.994 -11.836 178 HA ARG 26 HA ARG 26 -10.437 -14.618 -10.482 179 1HB ARG 26 HB2 ARG 26 -9.170 -15.077 -12.997 180 2HB ARG 26 HB1 ARG 26 -10.794 -14.476 -13.306 181 1HG ARG 26 HG2 ARG 26 -9.793 -12.858 -11.267 182 2HG ARG 26 HG1 ARG 26 -8.460 -13.063 -12.405 183 1HD ARG 26 HD2 ARG 26 -11.094 -12.531 -13.609 184 2HD ARG 26 HD1 ARG 26 -10.407 -11.208 -12.668 185 HE ARG 26 HE ARG 26 -8.538 -12.344 -14.514 186 1HH1 ARG 26 HH21 ARG 26 -11.172 -10.083 -14.183 187 2HH1 ARG 26 HH22 ARG 26 -10.679 -9.115 -15.532 188 1HH2 ARG 26 HH12 ARG 26 -7.884 -11.074 -16.290 189 2HH2 ARG 26 HH11 ARG 26 -8.810 -9.678 -16.729 190 H ASN 27 HN ASN 27 -12.398 -15.124 -9.658 191 HA ASN 27 HA ASN 27 -14.336 -16.502 -11.372 192 1HB ASN 27 HB2 ASN 27 -13.743 -16.852 -8.719 193 2HB ASN 27 HB1 ASN 27 -15.160 -15.809 -8.636 194 1HD2 ASN 27 HD22 ASN 27 -17.016 -16.514 -10.018 195 2HD2 ASN 27 HD21 ASN 27 -17.352 -18.208 -10.079 196 HA PRO 28 HA PRO 28 -15.862 -12.324 -12.234 197 1HB PRO 28 HB1 PRO 28 -17.783 -13.849 -13.883 198 2HB PRO 28 HB2 PRO 28 -16.698 -12.535 -14.346 199 1HG PRO 28 HG2 PRO 28 -16.222 -15.059 -15.095 200 2HG PRO 28 HG1 PRO 28 -14.900 -13.955 -14.672 201 1HD PRO 28 HD1 PRO 28 -16.128 -16.154 -13.054 202 2HD PRO 28 HD2 PRO 28 -14.421 -15.687 -13.210 203 H GLN 29 HN GLN 29 -18.443 -14.760 -12.432 204 HA GLN 29 HA GLN 29 -20.115 -13.120 -10.711 205 1HB GLN 29 HB2 GLN 29 -20.541 -15.101 -12.778 206 2HB GLN 29 HB1 GLN 29 -21.487 -15.482 -11.345 207 1HG GLN 29 HG2 GLN 29 -22.518 -13.302 -11.399 208 2HG GLN 29 HG1 GLN 29 -21.508 -12.829 -12.764 209 1HE2 GLN 29 HE21 GLN 29 -24.504 -13.781 -11.957 210 2HE2 GLN 29 HE22 GLN 29 -25.005 -14.515 -13.438 211 H GLN 30 HN GLN 30 -18.398 -13.688 -8.978 212 HA GLN 30 HA GLN 30 -18.594 -16.290 -7.786 213 1HB GLN 30 HB1 GLN 30 -16.573 -14.790 -7.661 214 2HB GLN 30 HB2 GLN 30 -17.477 -13.769 -6.551 215 1HG GLN 30 HG2 GLN 30 -17.603 -15.521 -4.934 216 2HG GLN 30 HG1 GLN 30 -16.918 -16.684 -6.068 217 1HE2 GLN 30 HE21 GLN 30 -15.318 -17.128 -4.479 218 2HE2 GLN 30 HE22 GLN 30 -13.964 -16.074 -4.279 219 H HIS 31 HN HIS 31 -19.234 -13.135 -6.268 220 HA HIS 31 HA HIS 31 -21.873 -13.943 -5.435 221 1HB HIS 31 HB1 HIS 31 -19.741 -14.614 -3.761 222 2HB HIS 31 HB2 HIS 31 -20.413 -13.149 -3.052 223 HD2 HIS 31 HD2 HIS 31 -22.831 -13.419 -1.799 224 HE1 HIS 31 HE1 HIS 31 -23.284 -17.545 -2.626 225 HE2 HIS 31 HE2 HIS 31 -24.208 -15.568 -1.335 226 H LEU 32 HN LEU 32 -19.626 -11.670 -6.270 227 HA LEU 32 HA LEU 32 -20.559 -9.419 -4.789 228 1HB LEU 32 HB2 LEU 32 -18.373 -9.918 -6.336 229 2HB LEU 32 HB1 LEU 32 -19.330 -8.927 -7.420 230 HG LEU 32 HG LEU 32 -19.476 -7.232 -5.527 231 1HD1 LEU 32 HD11 LEU 32 -18.218 -7.422 -3.637 232 2HD1 LEU 32 HD12 LEU 32 -17.021 -8.466 -4.402 233 3HD1 LEU 32 HD13 LEU 32 -18.583 -9.124 -3.916 234 1HD2 LEU 32 HD21 LEU 32 -17.756 -6.130 -6.459 235 2HD2 LEU 32 HD22 LEU 32 -17.704 -7.513 -7.553 236 3HD2 LEU 32 HD23 LEU 32 -16.619 -7.445 -6.165 237 H ASN 33 HN ASN 33 -22.515 -8.577 -5.000 238 HA ASN 33 HA ASN 33 -23.893 -8.766 -7.579 239 1HB ASN 33 HB1 ASN 33 -25.239 -7.709 -5.132 240 2HB ASN 33 HB2 ASN 33 -25.898 -8.686 -6.441 241 1HD2 ASN 33 HD22 ASN 33 -25.105 -10.941 -6.550 242 2HD2 ASN 33 HD21 ASN 33 -24.843 -11.775 -5.059 243 H ALA 34 HN ALA 34 -22.378 -6.521 -5.457 244 HA ALA 34 HA ALA 34 -23.669 -4.191 -6.589 245 1HB ALA 34 HB1 ALA 34 -22.222 -2.910 -5.115 246 2HB ALA 34 HB2 ALA 34 -21.316 -4.367 -4.712 247 3HB ALA 34 HB3 ALA 34 -23.006 -4.218 -4.230 248 H GLN 35 HN GLN 35 -23.146 -3.579 -8.582 249 HA GLN 35 HA GLN 35 -20.506 -4.118 -9.662 250 1HB GLN 35 HB2 GLN 35 -23.155 -3.465 -10.738 251 2HB GLN 35 HB1 GLN 35 -21.836 -2.658 -11.574 252 1HG GLN 35 HG1 GLN 35 -21.964 -4.572 -12.790 253 2HG GLN 35 HG2 GLN 35 -20.790 -5.066 -11.571 254 1HE2 GLN 35 HE22 GLN 35 -24.297 -4.977 -12.092 255 2HE2 GLN 35 HE21 GLN 35 -24.616 -6.520 -11.383 256 HA PRO 36 HA PRO 36 -19.106 -0.038 -8.458 257 1HB PRO 36 HB2 PRO 36 -16.655 -0.179 -9.604 258 2HB PRO 36 HB1 PRO 36 -17.050 -0.998 -8.090 259 1HG PRO 36 HG1 PRO 36 -16.930 -2.104 -10.870 260 2HG PRO 36 HG2 PRO 36 -16.323 -2.807 -9.361 261 1HD PRO 36 HD1 PRO 36 -18.665 -3.570 -10.492 262 2HD PRO 36 HD2 PRO 36 -18.403 -3.578 -8.737 263 H GLN 37 HN GLN 37 -17.250 1.309 -10.148 264 HA GLN 37 HA GLN 37 -19.089 2.417 -12.066 265 1HB GLN 37 HB2 GLN 37 -16.216 3.087 -11.404 266 2HB GLN 37 HB1 GLN 37 -17.198 3.984 -12.556 267 1HG GLN 37 HG2 GLN 37 -18.560 4.865 -10.911 268 2HG GLN 37 HG1 GLN 37 -18.147 3.602 -9.751 269 1HE2 GLN 37 HE21 GLN 37 -17.359 4.736 -8.093 270 2HE2 GLN 37 HE22 GLN 37 -16.015 5.819 -8.183 271 H VAL 38 HN VAL 38 -19.364 1.612 -14.028 272 HA VAL 38 HA VAL 38 -17.460 -0.199 -15.202 273 HB VAL 38 HB VAL 38 -19.064 -0.192 -17.142 274 1HG1 VAL 38 HG21 VAL 38 -19.508 -1.147 -14.428 275 2HG1 VAL 38 HG22 VAL 38 -19.671 -1.993 -15.968 276 3HG1 VAL 38 HG23 VAL 38 -20.998 -1.001 -15.361 277 1HG2 VAL 38 HG11 VAL 38 -20.244 1.949 -15.504 278 2HG2 VAL 38 HG12 VAL 38 -21.385 0.784 -16.175 279 3HG2 VAL 38 HG13 VAL 38 -20.309 1.683 -17.246 280 H THR 39 HN THR 39 -17.895 3.153 -15.189 281 HA THR 39 HA THR 39 -16.794 3.635 -17.821 282 HB THR 39 HB THR 39 -16.977 5.773 -15.742 283 HG1 THR 39 HG1 THR 39 -19.298 5.147 -17.140 284 1HG2 THR 39 HG21 THR 39 -16.288 6.552 -17.856 285 2HG2 THR 39 HG22 THR 39 -17.979 7.018 -17.671 286 3HG2 THR 39 HG23 THR 39 -17.549 5.638 -18.683 287 H MET 40 HN MET 40 -14.705 3.813 -18.300 288 HA MET 40 HA MET 40 -12.737 3.540 -16.203 289 1HB MET 40 HB1 MET 40 -11.119 3.395 -18.065 290 2HB MET 40 HB2 MET 40 -12.449 2.260 -18.246 291 1HG MET 40 HG1 MET 40 -13.186 4.649 -19.565 292 2HG MET 40 HG2 MET 40 -11.541 4.251 -20.054 293 1HE MET 40 HE1 MET 40 -15.081 3.388 -21.833 294 2HE MET 40 HE2 MET 40 -15.018 3.852 -20.132 295 3HE MET 40 HE3 MET 40 -15.436 2.199 -20.579 296 H GLN 41 HN GLN 41 -11.234 5.026 -15.568 297 HA GLN 41 HA GLN 41 -11.678 7.779 -16.504 298 1HB GLN 41 HB1 GLN 41 -10.419 8.327 -14.314 299 2HB GLN 41 HB2 GLN 41 -12.085 7.778 -14.207 300 1HG GLN 41 HG2 GLN 41 -10.937 5.421 -13.972 301 2HG GLN 41 HG1 GLN 41 -9.577 6.399 -13.423 302 1HE2 GLN 41 HE21 GLN 41 -9.489 6.444 -11.304 303 2HE2 GLN 41 HE22 GLN 41 -10.834 6.573 -10.228 304 H GLN 42 HN GLN 42 -10.144 8.751 -17.644 305 HA GLN 42 HA GLN 42 -7.775 7.432 -18.402 306 1HB GLN 42 HB1 GLN 42 -9.008 10.064 -18.907 307 2HB GLN 42 HB2 GLN 42 -7.258 10.013 -19.073 308 1HG GLN 42 HG2 GLN 42 -7.593 9.287 -21.137 309 2HG GLN 42 HG1 GLN 42 -8.109 7.759 -20.421 310 1HE2 GLN 42 HE21 GLN 42 -9.107 10.683 -21.964 311 2HE2 GLN 42 HE22 GLN 42 -10.761 10.243 -22.203 312 HA PRO 43 HA PRO 43 -5.454 10.568 -15.502 313 1HB PRO 43 HB2 PRO 43 -7.513 11.346 -13.549 314 2HB PRO 43 HB1 PRO 43 -6.353 12.354 -14.417 315 1HG PRO 43 HG1 PRO 43 -8.972 12.400 -15.002 316 2HG PRO 43 HG2 PRO 43 -7.731 12.590 -16.255 317 1HD PRO 43 HD1 PRO 43 -9.353 10.173 -15.543 318 2HD PRO 43 HD2 PRO 43 -8.914 10.804 -17.146 319 H ALA 44 HN ALA 44 -5.242 10.621 -12.855 320 HA ALA 44 HA ALA 44 -4.853 7.904 -12.143 321 1HB ALA 44 HB1 ALA 44 -4.016 8.726 -10.058 322 2HB ALA 44 HB2 ALA 44 -4.805 10.285 -10.299 323 3HB ALA 44 HB3 ALA 44 -3.462 9.805 -11.337 324 H VAL 45 HN VAL 45 -5.626 7.195 -9.838 325 HA VAL 45 HA VAL 45 -8.553 7.396 -9.868 326 HB VAL 45 HB VAL 45 -7.618 5.131 -10.036 327 1HG1 VAL 45 HG11 VAL 45 -5.646 4.939 -8.934 328 2HG1 VAL 45 HG12 VAL 45 -6.705 4.332 -7.660 329 3HG1 VAL 45 HG13 VAL 45 -6.148 6.006 -7.622 330 1HG2 VAL 45 HG21 VAL 45 -9.779 5.770 -8.751 331 2HG2 VAL 45 HG22 VAL 45 -8.859 5.300 -7.322 332 3HG2 VAL 45 HG23 VAL 45 -9.141 4.132 -8.612 333 H HIS 46 HN HIS 46 -5.741 7.984 -7.888 334 HA HIS 46 HA HIS 46 -7.438 8.742 -5.620 335 1HB HIS 46 HB2 HIS 46 -5.145 8.960 -4.462 336 2HB HIS 46 HB1 HIS 46 -5.716 7.342 -4.854 337 HD2 HIS 46 HD2 HIS 46 -3.380 9.965 -6.686 338 HE1 HIS 46 HE1 HIS 46 -1.889 6.036 -7.193 339 HE2 HIS 46 HE2 HIS 46 -1.499 8.491 -7.696 340 H VAL 47 HN VAL 47 -6.034 10.626 -4.346 341 HA VAL 47 HA VAL 47 -6.261 12.906 -6.156 342 HB VAL 47 HB VAL 47 -5.755 13.118 -3.203 343 1HG1 VAL 47 HG21 VAL 47 -5.836 15.031 -5.059 344 2HG1 VAL 47 HG22 VAL 47 -6.413 15.280 -3.411 345 3HG1 VAL 47 HG23 VAL 47 -7.560 14.924 -4.702 346 1HG2 VAL 47 HG11 VAL 47 -8.134 12.053 -4.527 347 2HG2 VAL 47 HG12 VAL 47 -8.464 13.403 -3.441 348 3HG2 VAL 47 HG13 VAL 47 -7.640 11.966 -2.836 349 H GLN 48 HN GLN 48 -4.638 14.430 -6.455 350 HA GLN 48 HA GLN 48 -1.943 13.411 -6.110 351 1HB GLN 48 HB2 GLN 48 -3.280 15.212 -7.925 352 2HB GLN 48 HB1 GLN 48 -1.847 15.981 -7.256 353 1HG GLN 48 HG1 GLN 48 -1.009 13.422 -7.916 354 2HG GLN 48 HG2 GLN 48 -2.074 13.895 -9.240 355 1HE2 GLN 48 HE22 GLN 48 0.330 15.539 -7.205 356 2HE2 GLN 48 HE21 GLN 48 1.209 16.239 -8.517 357 H GLY 49 HN GLY 49 -4.032 15.815 -4.734 358 1HA GLY 49 HA1 GLY 49 -1.811 17.120 -3.349 359 2HA GLY 49 HA2 GLY 49 -3.485 17.654 -3.358 360 H GLN 50 HN GLN 50 -4.169 14.699 -2.779 361 HA GLN 50 HA GLN 50 -3.864 14.960 0.127 362 1HB GLN 50 HB2 GLN 50 -5.917 13.741 -1.653 363 2HB GLN 50 HB1 GLN 50 -5.662 12.999 -0.079 364 1HG GLN 50 HG1 GLN 50 -5.880 15.485 0.752 365 2HG GLN 50 HG2 GLN 50 -6.757 15.673 -0.765 366 1HE2 GLN 50 HE22 GLN 50 -8.465 16.200 0.862 367 2HE2 GLN 50 HE21 GLN 50 -9.438 14.894 1.438 368 H GLU 51 HN GLU 51 -1.564 14.152 -0.887 369 HA GLU 51 HA GLU 51 -1.323 11.340 -1.260 370 1HB GLU 51 HB2 GLU 51 0.686 13.510 -0.656 371 2HB GLU 51 HB1 GLU 51 1.146 11.825 -0.861 372 1HG GLU 51 HG1 GLU 51 -0.449 13.202 -2.973 373 2HG GLU 51 HG2 GLU 51 1.292 13.461 -2.864 374 HA PRO 52 HA PRO 52 -1.600 10.214 3.045 375 1HB PRO 52 HB1 PRO 52 -0.907 7.607 2.782 376 2HB PRO 52 HB2 PRO 52 -2.497 8.227 2.322 377 1HG PRO 52 HG2 PRO 52 -0.120 7.636 0.599 378 2HG PRO 52 HG1 PRO 52 -1.831 7.268 0.309 379 1HD PRO 52 HD1 PRO 52 -0.575 9.380 -0.834 380 2HD PRO 52 HD2 PRO 52 -2.298 9.406 -0.410 381 H LEU 53 HN LEU 53 -0.127 8.678 4.510 382 HA LEU 53 HA LEU 53 2.524 9.879 4.409 383 1HB LEU 53 HB2 LEU 53 0.820 9.433 6.469 384 2HB LEU 53 HB1 LEU 53 1.837 8.009 6.585 385 HG LEU 53 HG LEU 53 3.576 10.222 6.290 386 1HD1 LEU 53 HD21 LEU 53 1.176 11.120 7.374 387 2HD1 LEU 53 HD22 LEU 53 2.741 11.930 7.440 388 3HD1 LEU 53 HD23 LEU 53 2.239 10.875 8.760 389 1HD2 LEU 53 HD11 LEU 53 4.023 8.127 7.489 390 2HD2 LEU 53 HD12 LEU 53 2.869 8.605 8.736 391 3HD2 LEU 53 HD13 LEU 53 4.343 9.545 8.489 392 H THR 54 HN THR 54 4.451 8.701 4.483 393 HA THR 54 HA THR 54 4.571 5.873 4.452 394 HB THR 54 HB THR 54 5.662 6.465 1.886 395 HG1 THR 54 HG1 THR 54 3.811 7.136 0.799 396 1HG2 THR 54 HG21 THR 54 3.653 4.946 1.197 397 2HG2 THR 54 HG22 THR 54 3.518 4.702 2.938 398 3HG2 THR 54 HG23 THR 54 5.016 4.287 2.103 399 H ALA 55 HN ALA 55 6.934 5.491 3.039 400 HA ALA 55 HA ALA 55 8.861 6.284 4.866 401 1HB ALA 55 HB1 ALA 55 10.508 5.484 3.296 402 2HB ALA 55 HB2 ALA 55 9.337 5.568 1.979 403 3HB ALA 55 HB3 ALA 55 9.109 4.410 3.289 404 H SER 56 HN SER 56 7.851 7.825 1.858 405 HA SER 56 HA SER 56 9.904 9.725 1.663 406 1HB SER 56 HB1 SER 56 7.039 10.192 0.825 407 2HB SER 56 HB2 SER 56 8.501 10.890 0.125 408 HG SER 56 HG SER 56 8.288 8.113 0.147 409 H MET 57 HN MET 57 6.730 9.891 3.239 410 HA MET 57 HA MET 57 6.893 12.523 4.179 411 1HB MET 57 HB1 MET 57 5.426 10.072 5.109 412 2HB MET 57 HB2 MET 57 5.360 11.552 6.051 413 1HG MET 57 HG1 MET 57 3.710 10.840 3.949 414 2HG MET 57 HG2 MET 57 3.834 12.426 4.708 415 1HE MET 57 HE1 MET 57 4.865 10.059 2.015 416 2HE MET 57 HE2 MET 57 5.334 11.070 0.647 417 3HE MET 57 HE3 MET 57 3.648 11.006 1.160 418 H LEU 58 HN LEU 58 7.932 9.466 5.601 419 HA LEU 58 HA LEU 58 8.792 10.385 8.091 420 1HB LEU 58 HB1 LEU 58 9.652 8.117 6.317 421 2HB LEU 58 HB2 LEU 58 10.452 8.405 7.849 422 HG LEU 58 HG LEU 58 8.874 7.271 8.932 423 1HD1 LEU 58 HD11 LEU 58 6.731 8.836 7.502 424 2HD1 LEU 58 HD12 LEU 58 7.543 9.359 8.978 425 3HD1 LEU 58 HD13 LEU 58 6.554 7.899 8.986 426 1HD2 LEU 58 HD21 LEU 58 7.322 6.827 6.414 427 2HD2 LEU 58 HD22 LEU 58 7.622 5.719 7.752 428 3HD2 LEU 58 HD23 LEU 58 8.923 6.115 6.628 429 H ALA 59 HN ALA 59 10.578 10.026 5.052 430 HA ALA 59 HA ALA 59 13.020 11.082 6.063 431 1HB ALA 59 HB1 ALA 59 12.200 10.955 3.171 432 2HB ALA 59 HB2 ALA 59 12.772 9.556 4.080 433 3HB ALA 59 HB3 ALA 59 13.832 10.944 3.840 434 H SER 60 HN SER 60 10.143 12.595 5.489 435 HA SER 60 HA SER 60 11.237 15.049 4.390 436 1HB SER 60 HB1 SER 60 9.007 14.288 3.671 437 2HB SER 60 HB2 SER 60 8.432 14.413 5.335 438 HG SER 60 HG SER 60 8.335 16.523 5.156 439 H ALA 61 HN ALA 61 11.027 13.668 7.415 440 HA ALA 61 HA ALA 61 11.344 16.300 8.685 441 1HB ALA 61 HB1 ALA 61 9.403 14.164 9.390 442 2HB ALA 61 HB2 ALA 61 9.230 15.919 9.452 443 3HB ALA 61 HB3 ALA 61 10.147 15.078 10.701 444 HA PRO 62 HA PRO 62 14.509 13.311 10.294 445 1HB PRO 62 HB2 PRO 62 16.416 13.239 8.431 446 2HB PRO 62 HB1 PRO 62 14.919 12.325 8.226 447 1HG PRO 62 HG1 PRO 62 15.829 14.784 6.856 448 2HG PRO 62 HG2 PRO 62 14.683 13.550 6.308 449 1HD PRO 62 HD1 PRO 62 14.117 16.096 7.547 450 2HD PRO 62 HD2 PRO 62 12.970 14.894 6.926 451 HA PRO 63 HA PRO 63 14.985 13.318 11.921 452 1HB PRO 63 HB2 PRO 63 16.059 13.800 14.318 453 2HB PRO 63 HB1 PRO 63 17.046 13.165 12.999 454 1HG PRO 63 HG2 PRO 63 17.006 15.872 14.187 455 2HG PRO 63 HG1 PRO 63 18.310 15.044 13.321 456 1HD PRO 63 HD1 PRO 63 16.417 16.967 12.293 457 2HD PRO 63 HD2 PRO 63 17.769 16.188 11.444 458 H GLN 64 HN GLN 64 12.978 13.332 12.792 459 HA GLN 64 HA GLN 64 12.131 15.069 14.838 460 1HB GLN 64 HB1 GLN 64 12.156 16.474 12.568 461 2HB GLN 64 HB2 GLN 64 10.584 15.709 12.375 462 1HG GLN 64 HG1 GLN 64 9.849 17.489 13.511 463 2HG GLN 64 HG2 GLN 64 10.397 16.584 14.922 464 1HE2 GLN 64 HE21 GLN 64 10.581 19.475 13.304 465 2HE2 GLN 64 HE22 GLN 64 11.994 20.123 14.059 466 H GLU 65 HN GLU 65 10.075 14.211 12.104 467 HA GLU 65 HA GLU 65 8.538 12.482 13.876 468 1HB GLU 65 HB1 GLU 65 7.883 13.382 11.067 469 2HB GLU 65 HB2 GLU 65 6.787 12.622 12.213 470 1HG GLU 65 HG2 GLU 65 8.112 15.241 12.807 471 2HG GLU 65 HG1 GLU 65 6.615 15.140 11.880 472 H GLN 66 HN GLN 66 11.083 12.094 11.861 473 HA GLN 66 HA GLN 66 10.487 9.962 10.187 474 1HB GLN 66 HB2 GLN 66 12.736 11.328 10.716 475 2HB GLN 66 HB1 GLN 66 13.080 9.870 11.637 476 1HG GLN 66 HG2 GLN 66 12.083 9.364 8.938 477 2HG GLN 66 HG1 GLN 66 13.615 10.234 8.993 478 1HE2 GLN 66 HE21 GLN 66 14.262 8.177 7.907 479 2HE2 GLN 66 HE22 GLN 66 14.787 6.878 8.917 480 H LYS 67 HN LYS 67 11.595 9.893 13.558 481 HA LYS 67 HA LYS 67 10.762 7.082 13.726 482 1HB LYS 67 HB2 LYS 67 12.075 7.195 15.932 483 2HB LYS 67 HB1 LYS 67 12.992 7.227 14.434 484 1HG LYS 67 HG1 LYS 67 14.039 8.942 15.437 485 2HG LYS 67 HG2 LYS 67 12.667 9.863 14.818 486 1HD LYS 67 HD1 LYS 67 11.722 10.101 16.873 487 2HD LYS 67 HD2 LYS 67 12.333 8.548 17.452 488 1HE LYS 67 HE2 LYS 67 14.651 9.871 17.166 489 2HE LYS 67 HE1 LYS 67 13.579 11.226 17.516 490 1HZ LYS 67 HZ1 LYS 67 14.254 10.567 19.600 491 2HZ LYS 67 HZ2 LYS 67 14.262 8.920 19.213 492 3HZ LYS 67 HZ3 LYS 67 12.794 9.727 19.446 493 H GLN 68 HN GLN 68 8.841 9.172 13.704 494 HA GLN 68 HA GLN 68 7.668 8.750 16.357 495 1HB GLN 68 HB2 GLN 68 8.540 11.001 16.426 496 2HB GLN 68 HB1 GLN 68 7.803 11.380 14.875 497 1HG GLN 68 HG1 GLN 68 6.335 12.370 16.320 498 2HG GLN 68 HG2 GLN 68 5.584 10.790 16.104 499 1HE2 GLN 68 HE21 GLN 68 5.674 12.861 18.327 500 2HE2 GLN 68 HE22 GLN 68 6.044 11.934 19.738 501 H MET 69 HN MET 69 6.832 10.315 13.259 502 HA MET 69 HA MET 69 4.125 9.364 13.427 503 1HB MET 69 HB2 MET 69 3.736 10.644 11.432 504 2HB MET 69 HB1 MET 69 4.745 11.596 12.513 505 1HG MET 69 HG2 MET 69 6.618 11.377 11.181 506 2HG MET 69 HG1 MET 69 6.007 9.923 10.388 507 1HE MET 69 HE1 MET 69 6.484 13.673 8.601 508 2HE MET 69 HE2 MET 69 6.927 12.124 7.881 509 3HE MET 69 HE3 MET 69 7.414 12.500 9.534 510 H LEU 70 HN LEU 70 6.415 7.395 13.026 511 HA LEU 70 HA LEU 70 5.945 6.350 10.384 512 1HB LEU 70 HB1 LEU 70 7.386 4.466 11.062 513 2HB LEU 70 HB2 LEU 70 8.142 6.020 11.261 514 HG LEU 70 HG LEU 70 6.947 4.447 13.526 515 1HD1 LEU 70 HD11 LEU 70 9.674 4.470 13.855 516 2HD1 LEU 70 HD12 LEU 70 9.487 4.202 12.122 517 3HD1 LEU 70 HD13 LEU 70 8.718 3.108 13.270 518 1HD2 LEU 70 HD21 LEU 70 8.741 6.033 14.670 519 2HD2 LEU 70 HD22 LEU 70 7.066 6.522 14.417 520 3HD2 LEU 70 HD23 LEU 70 8.318 7.054 13.296 521 H GLY 71 HN GLY 71 5.044 5.423 13.680 522 1HA GLY 71 HA2 GLY 71 2.850 3.864 12.507 523 2HA GLY 71 HA1 GLY 71 3.897 3.073 13.673 524 H GLU 72 HN GLU 72 2.967 6.448 13.860 525 HA GLU 72 HA GLU 72 1.022 5.848 15.962 526 1HB GLU 72 HB1 GLU 72 3.364 7.735 16.288 527 2HB GLU 72 HB2 GLU 72 2.032 7.583 17.424 528 1HG GLU 72 HG2 GLU 72 2.918 4.992 17.138 529 2HG GLU 72 HG1 GLU 72 4.403 5.944 17.098 530 H ARG 73 HN ARG 73 1.886 7.574 13.236 531 HA ARG 73 HA ARG 73 -0.266 9.521 13.726 532 1HB ARG 73 HB1 ARG 73 2.252 10.330 13.613 533 2HB ARG 73 HB2 ARG 73 1.973 10.216 11.882 534 1HG ARG 73 HG1 ARG 73 -0.095 11.644 13.414 535 2HG ARG 73 HG2 ARG 73 1.489 12.419 13.341 536 1HD ARG 73 HD2 ARG 73 1.454 12.452 10.963 537 2HD ARG 73 HD1 ARG 73 0.034 11.409 10.908 538 HE ARG 73 HE ARG 73 -1.275 13.255 11.725 539 1HH1 ARG 73 HH12 ARG 73 1.972 14.037 10.728 540 2HH1 ARG 73 HH11 ARG 73 1.633 15.720 10.499 541 1HH2 ARG 73 HH21 ARG 73 -1.728 15.468 11.427 542 2HH2 ARG 73 HH22 ARG 73 -0.470 16.534 10.896 543 H LEU 74 HN LEU 74 1.004 7.066 11.763 544 HA LEU 74 HA LEU 74 -0.207 7.851 9.291 545 1HB LEU 74 HB1 LEU 74 1.401 5.656 10.292 546 2HB LEU 74 HB2 LEU 74 0.108 5.082 9.259 547 HG LEU 74 HG LEU 74 1.659 7.364 8.229 548 1HD1 LEU 74 HD11 LEU 74 3.635 6.281 7.840 549 2HD1 LEU 74 HD12 LEU 74 2.911 4.678 7.975 550 3HD1 LEU 74 HD13 LEU 74 3.216 5.635 9.427 551 1HD2 LEU 74 HD21 LEU 74 0.758 4.757 7.013 552 2HD2 LEU 74 HD22 LEU 74 1.405 6.151 6.147 553 3HD2 LEU 74 HD23 LEU 74 -0.149 6.269 6.973 554 H PHE 75 HN PHE 75 -1.365 6.493 12.172 555 HA PHE 75 HA PHE 75 -3.263 4.676 11.451 556 1HB PHE 75 HB1 PHE 75 -2.974 5.036 13.754 557 2HB PHE 75 HB2 PHE 75 -3.288 6.763 13.616 558 HD1 PHE 75 HD1 PHE 75 -5.219 3.831 12.369 559 HD2 PHE 75 HD2 PHE 75 -5.111 7.222 14.940 560 HE1 PHE 75 HE1 PHE 75 -7.580 3.454 12.967 561 HE2 PHE 75 HE2 PHE 75 -7.469 6.851 15.540 562 HZ PHE 75 HZ PHE 75 -8.705 4.964 14.553 563 HA PRO 76 HA PRO 76 -6.590 8.161 10.652 564 1HB PRO 76 HB2 PRO 76 -4.842 10.453 9.974 565 2HB PRO 76 HB1 PRO 76 -6.337 10.417 10.913 566 1HG PRO 76 HG1 PRO 76 -3.974 10.752 12.107 567 2HG PRO 76 HG2 PRO 76 -5.253 9.780 12.859 568 1HD PRO 76 HD2 PRO 76 -2.803 8.882 11.392 569 2HD PRO 76 HD1 PRO 76 -3.543 8.215 12.861 570 H LEU 77 HN LEU 77 -3.656 7.536 9.026 571 HA LEU 77 HA LEU 77 -4.752 8.279 6.421 572 1HB LEU 77 HB1 LEU 77 -1.998 7.405 7.283 573 2HB LEU 77 HB2 LEU 77 -2.442 7.661 5.612 574 HG LEU 77 HG LEU 77 -1.440 9.662 6.102 575 1HD1 LEU 77 HD21 LEU 77 -3.050 11.309 6.025 576 2HD1 LEU 77 HD22 LEU 77 -4.107 10.477 7.166 577 3HD1 LEU 77 HD23 LEU 77 -3.963 9.889 5.509 578 1HD2 LEU 77 HD11 LEU 77 -1.011 10.442 8.158 579 2HD2 LEU 77 HD12 LEU 77 -1.551 8.841 8.662 580 3HD2 LEU 77 HD13 LEU 77 -2.669 10.204 8.710 581 H ILE 78 HN ILE 78 -3.946 5.455 8.328 582 HA ILE 78 HA ILE 78 -3.882 3.583 6.216 583 HB ILE 78 HB ILE 78 -4.837 2.865 8.958 584 1HG1 ILE 78 HG12 ILE 78 -2.845 4.338 9.180 585 2HG1 ILE 78 HG11 ILE 78 -2.536 2.690 9.712 586 1HG2 ILE 78 HG21 ILE 78 -4.833 0.894 7.903 587 2HG2 ILE 78 HG22 ILE 78 -3.085 0.960 8.131 588 3HG2 ILE 78 HG23 ILE 78 -3.796 1.481 6.603 589 1HD1 ILE 78 HD11 ILE 78 -0.772 3.887 8.289 590 2HD1 ILE 78 HD12 ILE 78 -1.847 3.545 6.934 591 3HD1 ILE 78 HD13 ILE 78 -1.187 2.220 7.893 592 H GLN 79 HN GLN 79 -6.493 4.847 8.197 593 HA GLN 79 HA GLN 79 -8.564 3.130 7.544 594 1HB GLN 79 HB1 GLN 79 -8.333 5.964 8.372 595 2HB GLN 79 HB2 GLN 79 -9.849 5.518 7.603 596 1HG GLN 79 HG1 GLN 79 -10.143 3.732 9.260 597 2HG GLN 79 HG2 GLN 79 -8.642 4.226 10.039 598 1HE2 GLN 79 HE21 GLN 79 -8.972 5.357 11.798 599 2HE2 GLN 79 HE22 GLN 79 -10.253 6.484 12.068 600 H ALA 80 HN ALA 80 -6.825 5.246 5.553 601 HA ALA 80 HA ALA 80 -8.854 5.570 3.518 602 1HB ALA 80 HB1 ALA 80 -6.902 7.185 4.148 603 2HB ALA 80 HB2 ALA 80 -7.395 7.008 2.464 604 3HB ALA 80 HB3 ALA 80 -5.964 6.162 3.057 605 H MET 81 HN MET 81 -5.977 3.605 4.073 606 HA MET 81 HA MET 81 -5.966 2.464 1.436 607 1HB MET 81 HB1 MET 81 -4.659 1.118 3.768 608 2HB MET 81 HB2 MET 81 -4.106 1.249 2.105 609 1HG MET 81 HG2 MET 81 -3.045 3.184 2.472 610 2HG MET 81 HG1 MET 81 -4.288 3.792 3.560 611 1HE MET 81 HE1 MET 81 -1.186 2.425 2.830 612 2HE MET 81 HE2 MET 81 -0.710 1.285 4.089 613 3HE MET 81 HE3 MET 81 -0.332 3.003 4.262 614 H HIS 82 HN HIS 82 -7.242 1.598 4.572 615 HA HIS 82 HA HIS 82 -8.615 -0.699 3.342 616 1HB HIS 82 HB1 HIS 82 -7.014 -0.493 5.830 617 2HB HIS 82 HB2 HIS 82 -8.495 -1.435 5.941 618 HD2 HIS 82 HD2 HIS 82 -5.702 -1.401 3.143 619 HE1 HIS 82 HE1 HIS 82 -6.452 -5.358 4.437 620 HE2 HIS 82 HE2 HIS 82 -5.122 -3.911 2.832 621 HA PRO 83 HA PRO 83 -12.438 1.013 4.750 622 1HB PRO 83 HB1 PRO 83 -13.241 -1.649 5.745 623 2HB PRO 83 HB2 PRO 83 -13.986 -0.644 4.500 624 1HG PRO 83 HG1 PRO 83 -12.630 -2.866 3.870 625 2HG PRO 83 HG2 PRO 83 -12.576 -1.422 2.841 626 1HD PRO 83 HD1 PRO 83 -10.550 -2.431 4.802 627 2HD PRO 83 HD2 PRO 83 -10.303 -1.719 3.194 628 H THR 84 HN THR 84 -11.048 2.016 6.502 629 HA THR 84 HA THR 84 -10.571 2.526 8.663 630 HB THR 84 HB THR 84 -12.453 2.764 10.064 631 HG1 THR 84 HG1 THR 84 -14.309 1.467 9.828 632 1HG2 THR 84 HG21 THR 84 -12.673 3.610 7.517 633 2HG2 THR 84 HG22 THR 84 -13.853 3.947 8.785 634 3HG2 THR 84 HG23 THR 84 -14.123 2.615 7.660 635 H LEU 85 HN LEU 85 -9.780 -0.129 7.790 636 HA LEU 85 HA LEU 85 -10.234 -1.902 10.026 637 1HB LEU 85 HB1 LEU 85 -9.128 -2.090 7.340 638 2HB LEU 85 HB2 LEU 85 -8.172 -2.973 8.513 639 HG LEU 85 HG LEU 85 -11.141 -3.368 8.418 640 1HD1 LEU 85 HD21 LEU 85 -9.619 -5.329 6.903 641 2HD1 LEU 85 HD22 LEU 85 -9.600 -3.727 6.166 642 3HD1 LEU 85 HD23 LEU 85 -11.137 -4.521 6.510 643 1HD2 LEU 85 HD11 LEU 85 -9.433 -4.278 10.181 644 2HD2 LEU 85 HD12 LEU 85 -9.088 -5.468 8.926 645 3HD2 LEU 85 HD13 LEU 85 -10.724 -5.311 9.566 646 H ALA 86 HN ALA 86 -8.451 0.753 9.809 647 HA ALA 86 HA ALA 86 -5.870 -0.054 10.691 648 1HB ALA 86 HB1 ALA 86 -5.416 2.220 10.982 649 2HB ALA 86 HB2 ALA 86 -7.107 2.616 11.292 650 3HB ALA 86 HB3 ALA 86 -6.586 2.181 9.664 651 H GLY 87 HN GLY 87 -6.108 2.081 12.942 652 1HA GLY 87 HA2 GLY 87 -6.662 2.135 15.203 653 2HA GLY 87 HA1 GLY 87 -7.592 0.658 14.983 654 H LYS 88 HN LYS 88 -5.064 -0.381 13.553 655 HA LYS 88 HA LYS 88 -3.188 -0.663 15.730 656 1HB LYS 88 HB1 LYS 88 -4.880 -2.347 16.288 657 2HB LYS 88 HB2 LYS 88 -4.716 -3.054 14.688 658 1HG LYS 88 HG1 LYS 88 -2.169 -3.196 15.461 659 2HG LYS 88 HG2 LYS 88 -2.947 -3.258 17.047 660 1HD LYS 88 HD1 LYS 88 -3.426 -5.402 16.728 661 2HD LYS 88 HD2 LYS 88 -4.379 -4.979 15.303 662 1HE LYS 88 HE2 LYS 88 -2.587 -5.318 13.852 663 2HE LYS 88 HE1 LYS 88 -1.397 -5.193 15.146 664 1HZ LYS 88 HZ1 LYS 88 -3.321 -7.429 14.796 665 2HZ LYS 88 HZ2 LYS 88 -2.156 -7.310 16.016 666 3HZ LYS 88 HZ3 LYS 88 -1.677 -7.479 14.402 667 H ILE 89 HN ILE 89 -4.046 -1.051 12.384 668 HA ILE 89 HA ILE 89 -2.066 -2.644 11.408 669 HB ILE 89 HB ILE 89 -3.116 -0.126 10.111 670 1HG1 ILE 89 HG11 ILE 89 -4.010 -2.968 9.625 671 2HG1 ILE 89 HG12 ILE 89 -4.761 -1.955 10.854 672 1HG2 ILE 89 HG21 ILE 89 -1.110 -2.011 9.286 673 2HG2 ILE 89 HG22 ILE 89 -1.648 -0.530 8.492 674 3HG2 ILE 89 HG23 ILE 89 -2.484 -2.052 8.181 675 1HD1 ILE 89 HD11 ILE 89 -6.089 -1.886 8.871 676 2HD1 ILE 89 HD12 ILE 89 -4.688 -1.451 7.892 677 3HD1 ILE 89 HD13 ILE 89 -5.317 -0.315 9.084 678 H THR 90 HN THR 90 -1.672 0.860 10.893 679 HA THR 90 HA THR 90 1.104 0.747 10.604 680 HB THR 90 HB THR 90 -0.921 2.764 10.706 681 HG1 THR 90 HG1 THR 90 1.777 2.991 9.887 682 1HG2 THR 90 HG21 THR 90 1.412 3.308 12.463 683 2HG2 THR 90 HG22 THR 90 -0.276 3.793 12.641 684 3HG2 THR 90 HG23 THR 90 0.754 4.601 11.458 685 H GLY 91 HN GLY 91 -0.856 1.222 13.520 686 1HA GLY 91 HA2 GLY 91 1.236 1.815 15.314 687 2HA GLY 91 HA1 GLY 91 -0.288 1.044 15.745 688 H MET 92 HN MET 92 0.183 -1.091 13.792 689 HA MET 92 HA MET 92 1.672 -2.911 15.461 690 1HB MET 92 HB1 MET 92 -0.410 -3.331 13.854 691 2HB MET 92 HB2 MET 92 0.857 -3.592 12.667 692 1HG MET 92 HG1 MET 92 1.747 -5.080 14.725 693 2HG MET 92 HG2 MET 92 0.013 -5.246 14.910 694 1HE MET 92 HE1 MET 92 -0.301 -5.052 11.157 695 2HE MET 92 HE2 MET 92 -1.310 -5.166 12.602 696 3HE MET 92 HE3 MET 92 -1.136 -6.562 11.533 697 H LEU 93 HN LEU 93 2.018 -1.272 12.412 698 HA LEU 93 HA LEU 93 4.286 -2.502 11.413 699 1HB LEU 93 HB2 LEU 93 3.020 0.146 11.071 700 2HB LEU 93 HB1 LEU 93 4.623 -0.086 10.410 701 HG LEU 93 HG LEU 93 2.882 -0.477 8.723 702 1HD1 LEU 93 HD11 LEU 93 3.564 -2.880 8.160 703 2HD1 LEU 93 HD12 LEU 93 4.560 -2.798 9.614 704 3HD1 LEU 93 HD13 LEU 93 4.842 -1.672 8.286 705 1HD2 LEU 93 HD21 LEU 93 0.972 -1.282 9.619 706 2HD2 LEU 93 HD22 LEU 93 1.809 -2.221 10.855 707 3HD2 LEU 93 HD23 LEU 93 1.697 -2.834 9.201 708 H LEU 94 HN LEU 94 4.027 -0.859 14.256 709 HA LEU 94 HA LEU 94 6.874 -0.125 14.261 710 1HB LEU 94 HB1 LEU 94 4.478 1.095 15.448 711 2HB LEU 94 HB2 LEU 94 5.827 0.944 16.556 712 HG LEU 94 HG LEU 94 5.568 3.130 15.207 713 1HD1 LEU 94 HD21 LEU 94 7.648 1.988 16.452 714 2HD1 LEU 94 HD22 LEU 94 7.741 3.552 15.642 715 3HD1 LEU 94 HD23 LEU 94 8.304 2.098 14.819 716 1HD2 LEU 94 HD11 LEU 94 6.681 3.113 13.008 717 2HD2 LEU 94 HD12 LEU 94 5.209 2.136 13.018 718 3HD2 LEU 94 HD13 LEU 94 6.787 1.352 13.093 719 H GLU 95 HN GLU 95 5.624 -2.746 14.507 720 HA GLU 95 HA GLU 95 7.085 -3.759 16.711 721 1HB GLU 95 HB2 GLU 95 5.357 -4.460 18.176 722 2HB GLU 95 HB1 GLU 95 5.037 -2.766 17.831 723 1HG GLU 95 HG1 GLU 95 3.217 -3.264 16.457 724 2HG GLU 95 HG2 GLU 95 3.704 -4.948 16.271 725 H ILE 96 HN ILE 96 5.650 -4.064 13.774 726 HA ILE 96 HA ILE 96 4.767 -6.730 13.691 727 HB ILE 96 HB ILE 96 5.114 -6.693 11.296 728 1HG1 ILE 96 HG12 ILE 96 7.301 -5.645 11.205 729 2HG1 ILE 96 HG11 ILE 96 6.167 -4.802 10.158 730 1HG2 ILE 96 HG21 ILE 96 3.962 -4.433 10.793 731 2HG2 ILE 96 HG22 ILE 96 3.909 -4.273 12.548 732 3HG2 ILE 96 HG23 ILE 96 3.122 -5.645 11.765 733 1HD1 ILE 96 HD11 ILE 96 7.731 -3.807 12.344 734 2HD1 ILE 96 HD12 ILE 96 6.018 -3.462 12.575 735 3HD1 ILE 96 HD13 ILE 96 6.833 -2.932 11.104 736 H ASP 97 HN ASP 97 6.367 -7.644 11.452 737 HA ASP 97 HA ASP 97 8.243 -9.283 12.722 738 1HB ASP 97 HB1 ASP 97 7.046 -9.370 10.361 739 2HB ASP 97 HB2 ASP 97 8.522 -8.568 9.828 740 H ASN 98 HN ASN 98 8.408 -6.037 12.251 741 HA ASN 98 HA ASN 98 10.041 -4.526 12.660 742 1HB ASN 98 HB2 ASN 98 11.815 -5.183 13.840 743 2HB ASN 98 HB1 ASN 98 11.212 -6.825 13.669 744 1HD2 ASN 98 HD22 ASN 98 12.473 -8.258 12.692 745 2HD2 ASN 98 HD21 ASN 98 13.900 -7.891 11.790 746 H SER 99 HN SER 99 10.576 -6.967 10.249 747 HA SER 99 HA SER 99 12.379 -5.466 8.639 748 1HB SER 99 HB2 SER 99 12.525 -7.445 7.616 749 2HB SER 99 HB1 SER 99 11.135 -8.042 8.528 750 HG SER 99 HG SER 99 11.181 -7.736 6.004 751 H GLU 100 HN GLU 100 8.944 -5.586 9.022 752 HA GLU 100 HA GLU 100 8.367 -4.047 6.646 753 1HB GLU 100 HB1 GLU 100 6.421 -4.319 8.883 754 2HB GLU 100 HB2 GLU 100 6.144 -4.325 7.150 755 1HG GLU 100 HG1 GLU 100 7.651 -6.567 7.481 756 2HG GLU 100 HG2 GLU 100 6.698 -6.536 8.966 757 H LEU 101 HN LEU 101 9.130 -3.503 9.963 758 HA LEU 101 HA LEU 101 8.223 -0.774 10.062 759 1HB LEU 101 HB1 LEU 101 8.356 -1.729 12.176 760 2HB LEU 101 HB2 LEU 101 9.858 -2.556 11.823 761 HG LEU 101 HG LEU 101 10.568 0.113 11.690 762 1HD1 LEU 101 HD11 LEU 101 9.725 0.881 13.989 763 2HD1 LEU 101 HD12 LEU 101 8.439 -0.303 13.755 764 3HD1 LEU 101 HD13 LEU 101 8.636 1.024 12.610 765 1HD2 LEU 101 HD21 LEU 101 12.041 -0.466 13.310 766 2HD2 LEU 101 HD22 LEU 101 11.482 -2.085 12.894 767 3HD2 LEU 101 HD23 LEU 101 10.814 -1.256 14.300 768 H LEU 102 HN LEU 102 11.037 -2.503 9.056 769 HA LEU 102 HA LEU 102 12.742 -0.158 8.952 770 1HB LEU 102 HB2 LEU 102 13.053 -3.062 8.642 771 2HB LEU 102 HB1 LEU 102 14.030 -2.119 7.533 772 HG LEU 102 HG LEU 102 15.039 -0.928 9.445 773 1HD1 LEU 102 HD21 LEU 102 12.833 -1.821 10.843 774 2HD1 LEU 102 HD22 LEU 102 14.256 -1.038 11.526 775 3HD1 LEU 102 HD23 LEU 102 14.157 -2.798 11.481 776 1HD2 LEU 102 HD11 LEU 102 15.225 -3.858 9.080 777 2HD2 LEU 102 HD12 LEU 102 16.004 -3.174 10.507 778 3HD2 LEU 102 HD13 LEU 102 16.457 -2.609 8.900 779 H HIS 103 HN HIS 103 11.203 -2.373 6.649 780 HA HIS 103 HA HIS 103 12.183 -1.085 4.340 781 1HB HIS 103 HB1 HIS 103 10.790 -3.407 4.914 782 2HB HIS 103 HB2 HIS 103 9.624 -2.451 4.011 783 HD2 HIS 103 HD2 HIS 103 11.443 -5.180 2.964 784 HE1 HIS 103 HE1 HIS 103 12.721 -2.302 0.134 785 HE2 HIS 103 HE2 HIS 103 12.584 -4.779 0.668 786 H MET 104 HN MET 104 9.197 -0.738 6.199 787 HA MET 104 HA MET 104 7.758 0.905 4.478 788 1HB MET 104 HB2 MET 104 6.486 1.590 6.417 789 2HB MET 104 HB1 MET 104 6.871 -0.122 6.567 790 1HG MET 104 HG1 MET 104 8.075 0.198 8.418 791 2HG MET 104 HG2 MET 104 8.844 1.644 7.771 792 1HE MET 104 HE1 MET 104 4.678 1.406 9.553 793 2HE MET 104 HE2 MET 104 5.393 0.430 8.266 794 3HE MET 104 HE3 MET 104 4.737 2.029 7.904 795 H LEU 105 HN LEU 105 10.370 1.702 6.681 796 HA LEU 105 HA LEU 105 10.003 4.557 6.309 797 1HB LEU 105 HB1 LEU 105 12.326 3.172 7.637 798 2HB LEU 105 HB2 LEU 105 11.815 4.836 7.839 799 HG LEU 105 HG LEU 105 10.200 2.451 8.738 800 1HD1 LEU 105 HD11 LEU 105 12.241 4.133 10.139 801 2HD1 LEU 105 HD12 LEU 105 12.043 2.380 10.143 802 3HD1 LEU 105 HD13 LEU 105 10.910 3.397 11.034 803 1HD2 LEU 105 HD21 LEU 105 8.586 3.995 8.771 804 2HD2 LEU 105 HD22 LEU 105 9.727 5.329 8.602 805 3HD2 LEU 105 HD23 LEU 105 9.422 4.626 10.191 806 H GLU 106 HN GLU 106 11.546 2.004 4.740 807 HA GLU 106 HA GLU 106 13.496 3.805 3.507 808 1HB GLU 106 HB1 GLU 106 14.916 2.032 3.275 809 2HB GLU 106 HB2 GLU 106 13.975 1.442 4.641 810 1HG GLU 106 HG1 GLU 106 13.624 -0.394 3.459 811 2HG GLU 106 HG2 GLU 106 12.556 0.568 2.438 812 H SER 107 HN SER 107 10.456 2.668 2.828 813 HA SER 107 HA SER 107 10.846 3.215 -0.008 814 1HB SER 107 HB2 SER 107 11.009 0.646 0.650 815 2HB SER 107 HB1 SER 107 9.252 0.777 0.614 816 HG SER 107 HG SER 107 10.880 0.495 -1.434 817 HA PRO 108 HA PRO 108 6.959 5.284 0.689 818 1HB PRO 108 HB2 PRO 108 6.763 5.427 -2.238 819 2HB PRO 108 HB1 PRO 108 6.902 6.734 -1.059 820 1HG PRO 108 HG2 PRO 108 8.924 6.091 -2.712 821 2HG PRO 108 HG1 PRO 108 9.208 6.667 -1.058 822 1HD PRO 108 HD1 PRO 108 9.283 3.869 -2.129 823 2HD PRO 108 HD2 PRO 108 10.383 4.666 -0.984 824 H GLU 109 HN GLU 109 7.405 2.293 -0.663 825 HA GLU 109 HA GLU 109 4.508 1.864 -1.041 826 1HB GLU 109 HB1 GLU 109 4.949 0.869 -2.989 827 2HB GLU 109 HB2 GLU 109 6.648 1.296 -2.794 828 1HG GLU 109 HG2 GLU 109 7.190 -0.783 -1.929 829 2HG GLU 109 HG1 GLU 109 5.516 -1.126 -1.493 830 H SER 110 HN SER 110 7.475 0.805 0.422 831 HA SER 110 HA SER 110 6.591 -1.662 1.376 832 1HB SER 110 HB1 SER 110 8.817 0.149 1.936 833 2HB SER 110 HB2 SER 110 8.318 -0.803 3.336 834 HG SER 110 HG SER 110 8.339 -2.554 1.508 835 H LEU 111 HN LEU 111 6.391 1.563 2.792 836 HA LEU 111 HA LEU 111 5.293 0.795 5.239 837 1HB LEU 111 HB1 LEU 111 6.130 3.063 4.661 838 2HB LEU 111 HB2 LEU 111 4.671 3.314 3.720 839 HG LEU 111 HG LEU 111 4.175 2.452 6.473 840 1HD1 LEU 111 HD11 LEU 111 6.215 4.305 6.122 841 2HD1 LEU 111 HD12 LEU 111 5.315 3.961 7.604 842 3HD1 LEU 111 HD13 LEU 111 4.784 5.256 6.530 843 1HD2 LEU 111 HD21 LEU 111 2.454 3.204 4.865 844 2HD2 LEU 111 HD22 LEU 111 3.184 4.810 4.883 845 3HD2 LEU 111 HD23 LEU 111 2.477 4.148 6.358 846 H ARG 112 HN ARG 112 3.882 0.965 2.101 847 HA ARG 112 HA ARG 112 1.169 0.739 3.169 848 1HB ARG 112 HB1 ARG 112 2.251 1.078 0.369 849 2HB ARG 112 HB2 ARG 112 0.538 0.859 0.734 850 1HG ARG 112 HG2 ARG 112 0.401 2.879 1.863 851 2HG ARG 112 HG1 ARG 112 2.153 2.991 2.045 852 1HD ARG 112 HD2 ARG 112 1.487 4.567 0.369 853 2HD ARG 112 HD1 ARG 112 2.321 3.237 -0.435 854 HE ARG 112 HE ARG 112 -0.619 3.452 -0.359 855 1HH1 ARG 112 HH21 ARG 112 2.369 2.877 -2.059 856 2HH1 ARG 112 HH22 ARG 112 1.591 2.476 -3.553 857 1HH2 ARG 112 HH12 ARG 112 -1.651 2.926 -2.324 858 2HH2 ARG 112 HH11 ARG 112 -0.693 2.504 -3.704 859 H SER 113 HN SER 113 2.972 -0.884 0.586 860 HA SER 113 HA SER 113 1.519 -3.160 0.298 861 1HB SER 113 HB1 SER 113 4.527 -3.272 0.379 862 2HB SER 113 HB2 SER 113 3.426 -4.089 -0.728 863 HG SER 113 HG SER 113 4.299 -2.414 -1.847 864 H LYS 114 HN LYS 114 3.694 -2.292 2.914 865 HA LYS 114 HA LYS 114 3.515 -4.920 4.146 866 1HB LYS 114 HB1 LYS 114 4.763 -2.367 5.165 867 2HB LYS 114 HB2 LYS 114 4.797 -3.909 6.010 868 1HG LYS 114 HG1 LYS 114 5.976 -3.392 3.292 869 2HG LYS 114 HG2 LYS 114 6.883 -3.442 4.805 870 1HD LYS 114 HD2 LYS 114 6.626 -5.725 5.040 871 2HD LYS 114 HD1 LYS 114 5.176 -5.769 4.033 872 1HE LYS 114 HE2 LYS 114 6.774 -5.047 2.129 873 2HE LYS 114 HE1 LYS 114 8.050 -5.612 3.206 874 1HZ LYS 114 HZ1 LYS 114 6.708 -7.747 3.334 875 2HZ LYS 114 HZ2 LYS 114 7.523 -7.442 1.884 876 3HZ LYS 114 HZ3 LYS 114 5.856 -7.175 1.990 877 H VAL 115 HN VAL 115 2.223 -1.634 4.691 878 HA VAL 115 HA VAL 115 0.897 -2.232 7.115 879 HB VAL 115 HB VAL 115 0.782 -0.024 5.174 880 1HG1 VAL 115 HG11 VAL 115 -1.678 -0.915 6.636 881 2HG1 VAL 115 HG12 VAL 115 -1.519 -0.273 4.997 882 3HG1 VAL 115 HG13 VAL 115 -1.371 0.804 6.386 883 1HG2 VAL 115 HG21 VAL 115 1.598 -0.439 7.786 884 2HG2 VAL 115 HG22 VAL 115 0.151 0.557 7.939 885 3HG2 VAL 115 HG23 VAL 115 1.501 1.107 6.946 886 H ASP 116 HN ASP 116 -0.470 -2.017 3.817 887 HA ASP 116 HA ASP 116 -2.981 -3.024 4.303 888 1HB ASP 116 HB1 ASP 116 -1.299 -2.590 2.029 889 2HB ASP 116 HB2 ASP 116 -2.119 -4.134 1.839 890 H GLU 117 HN GLU 117 0.008 -4.836 3.756 891 HA GLU 117 HA GLU 117 -1.275 -7.402 3.830 892 1HB GLU 117 HB1 GLU 117 1.535 -6.405 3.756 893 2HB GLU 117 HB2 GLU 117 1.266 -8.041 4.341 894 1HG GLU 117 HG2 GLU 117 -0.247 -7.811 1.998 895 2HG GLU 117 HG1 GLU 117 1.305 -7.049 1.654 896 H ALA 118 HN ALA 118 0.139 -5.219 6.139 897 HA ALA 118 HA ALA 118 0.344 -7.068 8.293 898 1HB ALA 118 HB1 ALA 118 -0.093 -4.188 8.849 899 2HB ALA 118 HB2 ALA 118 1.370 -4.649 7.977 900 3HB ALA 118 HB3 ALA 118 1.046 -5.325 9.575 901 H VAL 119 HN VAL 119 -2.183 -5.183 6.880 902 HA VAL 119 HA VAL 119 -4.043 -5.179 8.986 903 HB VAL 119 HB VAL 119 -4.727 -5.454 6.077 904 1HG1 VAL 119 HG11 VAL 119 -6.808 -4.510 6.683 905 2HG1 VAL 119 HG12 VAL 119 -6.216 -4.036 8.273 906 3HG1 VAL 119 HG13 VAL 119 -6.470 -5.743 7.897 907 1HG2 VAL 119 HG21 VAL 119 -3.911 -3.039 7.656 908 2HG2 VAL 119 HG22 VAL 119 -4.832 -2.936 6.155 909 3HG2 VAL 119 HG23 VAL 119 -3.217 -3.650 6.154 910 H ALA 120 HN ALA 120 -3.598 -7.373 6.259 911 HA ALA 120 HA ALA 120 -5.497 -9.287 6.925 912 1HB ALA 120 HB1 ALA 120 -3.142 -10.511 5.833 913 2HB ALA 120 HB2 ALA 120 -3.459 -8.970 5.028 914 3HB ALA 120 HB3 ALA 120 -4.709 -10.219 5.072 915 H VAL 121 HN VAL 121 -2.456 -8.528 8.319 916 HA VAL 121 HA VAL 121 -2.192 -11.017 9.774 917 HB VAL 121 HB VAL 121 -0.580 -8.491 9.588 918 1HG1 VAL 121 HG21 VAL 121 0.860 -10.292 11.172 919 2HG1 VAL 121 HG22 VAL 121 -0.749 -10.191 11.888 920 3HG1 VAL 121 HG23 VAL 121 0.201 -8.724 11.643 921 1HG2 VAL 121 HG11 VAL 121 0.382 -11.303 9.237 922 2HG2 VAL 121 HG12 VAL 121 1.031 -9.809 8.561 923 3HG2 VAL 121 HG13 VAL 121 -0.485 -10.470 7.945 924 H LEU 122 HN LEU 122 -3.318 -7.753 10.277 925 HA LEU 122 HA LEU 122 -3.478 -7.918 13.130 926 1HB LEU 122 HB2 LEU 122 -3.741 -5.716 12.914 927 2HB LEU 122 HB1 LEU 122 -3.730 -5.909 11.172 928 HG LEU 122 HG LEU 122 -6.344 -6.522 11.884 929 1HD1 LEU 122 HD11 LEU 122 -7.049 -4.595 13.241 930 2HD1 LEU 122 HD12 LEU 122 -5.352 -4.194 13.515 931 3HD1 LEU 122 HD13 LEU 122 -6.012 -5.710 14.131 932 1HD2 LEU 122 HD21 LEU 122 -6.707 -4.105 11.024 933 2HD2 LEU 122 HD22 LEU 122 -6.022 -5.320 9.946 934 3HD2 LEU 122 HD23 LEU 122 -4.970 -4.141 10.727 935 H GLN 123 HN GLN 123 -5.709 -8.358 10.440 936 HA GLN 123 HA GLN 123 -8.027 -8.779 12.042 937 1HB GLN 123 HB2 GLN 123 -8.881 -9.835 9.848 938 2HB GLN 123 HB1 GLN 123 -8.467 -8.131 9.835 939 1HG GLN 123 HG1 GLN 123 -7.082 -8.437 8.173 940 2HG GLN 123 HG2 GLN 123 -6.143 -9.563 9.149 941 1HE2 GLN 123 HE21 GLN 123 -8.093 -9.198 6.445 942 2HE2 GLN 123 HE22 GLN 123 -8.331 -10.868 6.070 943 H ALA 124 HN ALA 124 -5.443 -10.724 10.854 944 HA ALA 124 HA ALA 124 -6.653 -13.273 11.352 945 1HB ALA 124 HB1 ALA 124 -4.991 -13.285 9.710 946 2HB ALA 124 HB2 ALA 124 -4.220 -14.041 11.103 947 3HB ALA 124 HB3 ALA 124 -3.870 -12.358 10.708 948 H HIS 125 HN HIS 125 -4.578 -11.090 13.176 949 HA HIS 125 HA HIS 125 -4.183 -13.068 15.260 950 1HB HIS 125 HB1 HIS 125 -2.651 -10.972 14.354 951 2HB HIS 125 HB2 HIS 125 -3.336 -10.313 15.835 952 HD2 HIS 125 HD2 HIS 125 -0.169 -11.687 15.070 953 HE1 HIS 125 HE1 HIS 125 -1.213 -13.778 18.599 954 HE2 HIS 125 HE2 HIS 125 0.682 -13.155 17.033 955 H GLN 126 HN GLN 126 -5.759 -9.890 14.944 956 HA GLN 126 HA GLN 126 -6.752 -9.726 17.565 957 1HB GLN 126 HB1 GLN 126 -7.875 -8.645 14.974 958 2HB GLN 126 HB2 GLN 126 -8.518 -8.242 16.560 959 1HG GLN 126 HG1 GLN 126 -5.641 -7.830 16.337 960 2HG GLN 126 HG2 GLN 126 -6.586 -6.853 15.214 961 1HE2 GLN 126 HE22 GLN 126 -6.463 -4.891 16.111 962 2HE2 GLN 126 HE21 GLN 126 -6.992 -4.498 17.708 963 H ALA 127 HN ALA 127 -8.450 -10.734 14.611 964 HA ALA 127 HA ALA 127 -10.311 -12.318 16.229 965 1HB ALA 127 HB1 ALA 127 -11.841 -11.721 14.733 966 2HB ALA 127 HB2 ALA 127 -10.897 -12.467 13.443 967 3HB ALA 127 HB3 ALA 127 -10.621 -10.780 13.876 968 H LYS 128 HN LYS 128 -8.260 -13.651 16.629 969 HA LYS 128 HA LYS 128 -7.054 -15.131 14.630 970 1HB LYS 128 HB1 LYS 128 -7.263 -15.360 17.580 971 2HB LYS 128 HB2 LYS 128 -6.736 -16.796 16.709 972 1HG LYS 128 HG1 LYS 128 -5.384 -14.389 15.829 973 2HG LYS 128 HG2 LYS 128 -5.137 -14.725 17.543 974 1HD LYS 128 HD2 LYS 128 -4.873 -16.976 15.619 975 2HD LYS 128 HD1 LYS 128 -3.577 -15.778 15.678 976 1HE LYS 128 HE1 LYS 128 -4.408 -16.590 18.329 977 2HE LYS 128 HE2 LYS 128 -3.901 -17.971 17.355 978 1HZ LYS 128 HZ1 LYS 128 -2.338 -15.630 18.207 979 2HZ LYS 128 HZ2 LYS 128 -1.903 -16.449 16.792 980 3HZ LYS 128 HZ3 LYS 128 -1.931 -17.272 18.270 981 H GLU 129 HN GLU 129 -8.173 -16.258 13.221 982 HA GLU 129 HA GLU 129 -10.299 -18.067 14.086 983 1HB GLU 129 HB2 GLU 129 -9.752 -16.663 11.689 984 2HB GLU 129 HB1 GLU 129 -9.585 -18.374 11.316 985 1HG GLU 129 HG2 GLU 129 -11.901 -18.287 12.792 986 2HG GLU 129 HG1 GLU 129 -11.968 -16.800 11.848 987 H ALA 130 HN ALA 130 -7.162 -18.096 14.333 988 HA ALA 130 HA ALA 130 -6.515 -20.659 13.166 989 1HB ALA 130 HB1 ALA 130 -5.070 -18.371 14.029 990 2HB ALA 130 HB2 ALA 130 -4.477 -19.786 13.156 991 3HB ALA 130 HB3 ALA 130 -4.473 -19.773 14.920 992 H ALA 131 HN ALA 131 -8.061 -19.684 15.930 993 HA ALA 131 HA ALA 131 -6.926 -21.365 17.899 994 1HB ALA 131 HB1 ALA 131 -8.327 -20.224 19.181 995 2HB ALA 131 HB2 ALA 131 -9.702 -21.011 18.405 996 3HB ALA 131 HB3 ALA 131 -9.056 -19.510 17.742 997 H GLN 132 HN GLN 132 -6.645 -23.459 17.267 998 HA GLN 132 HA GLN 132 -8.950 -24.928 16.218 999 1HB GLN 132 HB2 GLN 132 -6.091 -25.870 16.481 1000 2HB GLN 132 HB1 GLN 132 -7.382 -26.651 15.577 1001 1HG GLN 132 HG2 GLN 132 -6.809 -23.870 14.816 1002 2HG GLN 132 HG1 GLN 132 -5.526 -25.034 14.486 1003 1HE2 GLN 132 HE21 GLN 132 -8.872 -24.216 13.868 1004 2HE2 GLN 132 HE22 GLN 132 -9.029 -25.137 12.416 1005 H LYS 133 HN LYS 133 -6.293 -25.770 18.445 1006 HA LYS 133 HA LYS 133 -8.061 -27.538 19.907 1007 1HB LYS 133 HB1 LYS 133 -5.179 -26.865 20.514 1008 2HB LYS 133 HB2 LYS 133 -6.092 -28.252 21.095 1009 1HG LYS 133 HG2 LYS 133 -6.034 -29.316 19.031 1010 2HG LYS 133 HG1 LYS 133 -5.655 -27.826 18.166 1011 1HD LYS 133 HD1 LYS 133 -3.581 -28.757 18.167 1012 2HD LYS 133 HD2 LYS 133 -3.502 -27.937 19.727 1013 1HE LYS 133 HE1 LYS 133 -2.795 -30.022 20.340 1014 2HE LYS 133 HE2 LYS 133 -4.531 -30.201 20.591 1015 1HZ LYS 133 HZ1 LYS 133 -4.081 -30.851 17.950 1016 2HZ LYS 133 HZ2 LYS 133 -4.442 -31.917 19.214 1017 3HZ LYS 133 HZ3 LYS 133 -2.830 -31.603 18.806 1018 H ALA 134 HN ALA 134 -9.119 -25.122 20.200 1019 HA ALA 134 HA ALA 134 -8.119 -23.837 22.600 1020 1HB ALA 134 HB1 ALA 134 -10.340 -23.237 20.681 1021 2HB ALA 134 HB2 ALA 134 -8.905 -22.283 21.057 1022 3HB ALA 134 HB3 ALA 134 -10.219 -22.400 22.229 1023 H VAL 135 HN VAL 135 -8.607 -26.259 23.437 1024 HA VAL 135 HA VAL 135 -11.331 -26.376 24.514 1025 HB VAL 135 HB VAL 135 -10.360 -28.400 23.409 1026 1HG1 VAL 135 HG21 VAL 135 -8.075 -27.857 24.662 1027 2HG1 VAL 135 HG22 VAL 135 -8.513 -29.489 24.155 1028 3HG1 VAL 135 HG23 VAL 135 -8.757 -28.990 25.829 1029 1HG2 VAL 135 HG11 VAL 135 -10.740 -29.616 25.935 1030 2HG2 VAL 135 HG12 VAL 135 -11.900 -29.442 24.619 1031 3HG2 VAL 135 HG13 VAL 135 -11.786 -28.199 25.864 1032 H ASN 136 HN ASN 136 -8.126 -25.587 25.395 1033 HA ASN 136 HA ASN 136 -8.505 -26.049 28.229 1034 1HB ASN 136 HB1 ASN 136 -6.241 -25.139 28.467 1035 2HB ASN 136 HB2 ASN 136 -6.286 -26.381 27.219 1036 1HD2 ASN 136 HD21 ASN 136 -4.230 -24.584 27.354 1037 2HD2 ASN 136 HD22 ASN 136 -4.304 -23.514 25.999 1038 H SER 137 HN SER 137 -9.871 -23.915 26.320 1039 HA SER 137 HA SER 137 -9.282 -21.462 27.726 1040 1HB SER 137 HB1 SER 137 -11.636 -21.788 25.894 1041 2HB SER 137 HB2 SER 137 -10.593 -20.387 26.131 1042 HG SER 137 HG SER 137 -8.988 -21.405 24.967 1043 H ALA 138 HN ALA 138 -9.852 -21.967 29.866 1044 HA ALA 138 HA ALA 138 -12.395 -22.965 30.622 1045 1HB ALA 138 HB1 ALA 138 -11.238 -21.382 32.706 1046 2HB ALA 138 HB2 ALA 138 -9.980 -22.331 31.915 1047 3HB ALA 138 HB3 ALA 138 -11.394 -23.136 32.594 1048 H THR 139 HN THR 139 -11.049 -19.703 30.375 1049 HA THR 139 HA THR 139 -13.661 -18.566 31.049 1050 HB THR 139 HB THR 139 -12.348 -16.381 30.998 1051 HG1 THR 139 HG1 THR 139 -10.056 -16.710 31.233 1052 1HG2 THR 139 HG21 THR 139 -11.622 -16.552 33.171 1053 2HG2 THR 139 HG22 THR 139 -11.100 -18.226 32.976 1054 3HG2 THR 139 HG23 THR 139 -12.818 -17.845 33.075 1055 H GLY 140 HN GLY 140 -14.947 -17.617 29.584 1056 1HA GLY 140 HA1 GLY 140 -14.069 -17.666 26.793 1057 2HA GLY 140 HA2 GLY 140 -15.726 -17.501 27.356 1058 H VAL 141 HN VAL 141 -16.326 -15.430 28.346 1059 HA VAL 141 HA VAL 141 -15.202 -13.241 26.815 1060 HB VAL 141 HB VAL 141 -17.431 -13.036 28.829 1061 1HG1 VAL 141 HG21 VAL 141 -16.918 -11.459 26.314 1062 2HG1 VAL 141 HG22 VAL 141 -16.373 -10.962 27.917 1063 3HG1 VAL 141 HG23 VAL 141 -18.097 -11.113 27.579 1064 1HG2 VAL 141 HG11 VAL 141 -18.859 -14.127 27.511 1065 2HG2 VAL 141 HG12 VAL 141 -17.458 -14.711 26.612 1066 3HG2 VAL 141 HG13 VAL 141 -18.305 -13.257 26.080 1067 HA PRO 142 HA PRO 142 -12.388 -12.279 30.214 1068 1HB PRO 142 HB1 PRO 142 -11.959 -9.874 28.529 1069 2HB PRO 142 HB2 PRO 142 -10.780 -11.005 29.197 1070 1HG PRO 142 HG1 PRO 142 -11.395 -11.039 26.602 1071 2HG PRO 142 HG2 PRO 142 -11.092 -12.542 27.493 1072 1HD PRO 142 HD1 PRO 142 -13.689 -11.339 26.624 1073 2HD PRO 142 HD2 PRO 142 -13.191 -13.043 26.661 1074 H THR 143 HN THR 143 -14.792 -10.142 28.792 1075 HA THR 143 HA THR 143 -14.714 -8.311 31.035 1076 HB THR 143 HB THR 143 -16.665 -7.245 29.810 1077 HG1 THR 143 HG1 THR 143 -16.362 -8.190 27.443 1078 1HG2 THR 143 HG21 THR 143 -14.760 -6.107 29.306 1079 2HG2 THR 143 HG22 THR 143 -15.199 -6.714 27.709 1080 3HG2 THR 143 HG23 THR 143 -13.949 -7.528 28.649 1081 H VAL 144 HN VAL 144 -15.245 -10.835 31.928 1082 HA VAL 144 HA VAL 144 -16.784 -12.236 32.903 1083 HB VAL 144 HB VAL 144 -16.273 -10.769 34.703 1084 1HG1 VAL 144 HG21 VAL 144 -17.565 -8.716 35.156 1085 2HG1 VAL 144 HG22 VAL 144 -18.370 -8.906 33.598 1086 3HG1 VAL 144 HG23 VAL 144 -16.630 -8.623 33.663 1087 1HG2 VAL 144 HG11 VAL 144 -18.358 -10.832 36.012 1088 2HG2 VAL 144 HG12 VAL 144 -18.048 -12.341 35.153 1089 3HG2 VAL 144 HG13 VAL 144 -19.251 -11.206 34.537 Start of MODEL 16 1 1H GLY 1 HT1 GLY 1 -10.079 69.325 1.461 2 2H GLY 1 HT2 GLY 1 -9.238 69.500 0.003 3 3H GLY 1 HT3 GLY 1 -8.388 69.340 1.457 4 1HA GLY 1 HA1 GLY 1 -8.557 67.302 -0.053 5 2HA GLY 1 HA2 GLY 1 -8.845 67.101 1.668 6 HA PRO 2 HA PRO 2 -12.854 66.562 -1.178 7 1HB PRO 2 HB2 PRO 2 -11.658 64.141 -2.399 8 2HB PRO 2 HB1 PRO 2 -12.673 65.387 -3.131 9 1HG PRO 2 HG2 PRO 2 -10.061 65.259 -3.660 10 2HG PRO 2 HG1 PRO 2 -10.887 66.819 -3.488 11 1HD PRO 2 HD2 PRO 2 -9.123 65.382 -1.544 12 2HD PRO 2 HD1 PRO 2 -9.214 67.116 -1.915 13 H LEU 3 HN LEU 3 -10.905 63.645 -0.512 14 HA LEU 3 HA LEU 3 -13.131 62.566 1.048 15 1HB LEU 3 HB2 LEU 3 -10.590 61.251 0.081 16 2HB LEU 3 HB1 LEU 3 -11.883 60.439 0.943 17 HG LEU 3 HG LEU 3 -13.001 61.737 -1.343 18 1HD1 LEU 3 HD11 LEU 3 -10.448 61.362 -1.960 19 2HD1 LEU 3 HD12 LEU 3 -11.745 61.100 -3.126 20 3HD1 LEU 3 HD13 LEU 3 -11.033 59.728 -2.277 21 1HD2 LEU 3 HD21 LEU 3 -13.408 59.274 -1.944 22 2HD2 LEU 3 HD22 LEU 3 -14.118 59.899 -0.454 23 3HD2 LEU 3 HD23 LEU 3 -12.653 58.919 -0.390 24 H GLY 4 HN GLY 4 -10.922 64.629 1.813 25 1HA GLY 4 HA2 GLY 4 -9.528 63.338 3.975 26 2HA GLY 4 HA1 GLY 4 -9.527 65.057 3.611 27 H SER 5 HN SER 5 -10.547 62.722 5.760 28 HA SER 5 HA SER 5 -12.841 64.255 6.721 29 1HB SER 5 HB2 SER 5 -13.321 61.944 6.694 30 2HB SER 5 HB1 SER 5 -11.747 61.522 7.369 31 HG SER 5 HG SER 5 -13.829 61.639 8.749 32 H ALA 6 HN ALA 6 -9.808 62.901 8.013 33 HA ALA 6 HA ALA 6 -9.502 65.245 9.711 34 1HB ALA 6 HB1 ALA 6 -10.486 62.757 10.722 35 2HB ALA 6 HB2 ALA 6 -10.194 64.272 11.579 36 3HB ALA 6 HB3 ALA 6 -8.897 63.088 11.415 37 H ALA 7 HN ALA 7 -7.442 65.868 9.764 38 HA ALA 7 HA ALA 7 -5.197 65.919 9.396 39 1HB ALA 7 HB1 ALA 7 -5.418 64.271 11.337 40 2HB ALA 7 HB2 ALA 7 -3.904 64.270 10.433 41 3HB ALA 7 HB3 ALA 7 -5.107 63.014 10.140 42 H ALA 8 HN ALA 8 -6.706 65.525 7.109 43 HA ALA 8 HA ALA 8 -4.751 64.218 5.412 44 1HB ALA 8 HB1 ALA 8 -5.891 62.310 5.252 45 2HB ALA 8 HB2 ALA 8 -7.075 63.221 4.314 46 3HB ALA 8 HB3 ALA 8 -7.308 62.994 6.047 47 H ALA 9 HN ALA 9 -5.812 66.932 5.906 48 HA ALA 9 HA ALA 9 -7.103 67.529 3.341 49 1HB ALA 9 HB1 ALA 9 -7.460 68.536 5.953 50 2HB ALA 9 HB2 ALA 9 -8.290 69.019 4.473 51 3HB ALA 9 HB3 ALA 9 -6.816 69.851 4.969 52 H THR 10 HN THR 10 -5.439 67.515 1.889 53 HA THR 10 HA THR 10 -3.519 68.124 0.819 54 HB THR 10 HB THR 10 -3.205 70.546 0.607 55 HG1 THR 10 HG1 THR 10 -5.110 71.588 1.993 56 1HG2 THR 10 HG21 THR 10 -4.927 70.591 -0.761 57 2HG2 THR 10 HG22 THR 10 -6.015 70.836 0.604 58 3HG2 THR 10 HG23 THR 10 -5.630 69.201 0.065 59 HA PRO 11 HA PRO 11 -0.946 67.931 4.726 60 1HB PRO 11 HB1 PRO 11 0.360 65.786 3.169 61 2HB PRO 11 HB2 PRO 11 -0.208 65.775 4.841 62 1HG PRO 11 HG2 PRO 11 -1.503 64.429 2.925 63 2HG PRO 11 HG1 PRO 11 -2.377 65.237 4.239 64 1HD PRO 11 HD2 PRO 11 -1.981 66.115 1.403 65 2HD PRO 11 HD1 PRO 11 -3.431 66.221 2.424 66 H ALA 12 HN ALA 12 0.416 69.613 4.634 67 HA ALA 12 HA ALA 12 1.994 70.162 2.277 68 1HB ALA 12 HB1 ALA 12 2.462 71.652 4.796 69 2HB ALA 12 HB2 ALA 12 0.879 71.809 4.035 70 3HB ALA 12 HB3 ALA 12 2.336 72.237 3.138 71 H VAL 13 HN VAL 13 2.404 68.490 5.246 72 HA VAL 13 HA VAL 13 5.307 68.648 5.181 73 HB VAL 13 HB VAL 13 3.630 66.943 7.017 74 1HG1 VAL 13 HG21 VAL 13 6.471 67.910 7.027 75 2HG1 VAL 13 HG22 VAL 13 5.863 66.261 7.164 76 3HG1 VAL 13 HG23 VAL 13 5.667 67.388 8.507 77 1HG2 VAL 13 HG11 VAL 13 3.283 69.596 6.888 78 2HG2 VAL 13 HG12 VAL 13 4.677 69.539 7.968 79 3HG2 VAL 13 HG13 VAL 13 3.194 68.687 8.396 80 H ARG 14 HN ARG 14 6.333 67.420 3.743 81 HA ARG 14 HA ARG 14 5.191 64.950 2.774 82 1HB ARG 14 HB2 ARG 14 7.295 64.855 1.403 83 2HB ARG 14 HB1 ARG 14 6.321 66.297 1.156 84 1HG ARG 14 HG1 ARG 14 8.188 66.823 3.234 85 2HG ARG 14 HG2 ARG 14 9.049 66.117 1.864 86 1HD ARG 14 HD2 ARG 14 7.056 68.167 1.177 87 2HD ARG 14 HD1 ARG 14 8.442 68.746 2.100 88 HE ARG 14 HE ARG 14 9.405 67.159 0.021 89 1HH1 ARG 14 HH11 ARG 14 7.722 70.180 0.456 90 2HH1 ARG 14 HH12 ARG 14 8.358 70.889 -0.990 91 1HH2 ARG 14 HH21 ARG 14 10.246 68.086 -1.883 92 2HH2 ARG 14 HH22 ARG 14 9.792 69.700 -2.319 93 H THR 15 HN THR 15 6.671 62.995 2.606 94 HA THR 15 HA THR 15 7.653 62.399 5.283 95 HB THR 15 HB THR 15 7.905 60.050 4.085 96 HG1 THR 15 HG1 THR 15 7.267 60.170 2.098 97 1HG2 THR 15 HG21 THR 15 5.164 60.086 4.270 98 2HG2 THR 15 HG22 THR 15 5.675 61.345 5.392 99 3HG2 THR 15 HG23 THR 15 6.297 59.705 5.566 100 H VAL 16 HN VAL 16 9.674 61.178 5.547 101 HA VAL 16 HA VAL 16 11.740 62.220 3.737 102 HB VAL 16 HB VAL 16 12.426 60.966 6.356 103 1HG1 VAL 16 HG11 VAL 16 14.342 61.597 5.260 104 2HG1 VAL 16 HG12 VAL 16 14.014 63.048 6.207 105 3HG1 VAL 16 HG13 VAL 16 13.578 62.992 4.499 106 1HG2 VAL 16 HG21 VAL 16 12.159 63.246 7.406 107 2HG2 VAL 16 HG22 VAL 16 10.663 62.373 7.078 108 3HG2 VAL 16 HG23 VAL 16 11.173 63.681 6.009 109 HA PRO 17 HA PRO 17 11.969 57.932 2.329 110 1HB PRO 17 HB1 PRO 17 13.789 58.404 0.361 111 2HB PRO 17 HB2 PRO 17 12.060 58.720 0.177 112 1HG PRO 17 HG1 PRO 17 14.277 60.626 0.827 113 2HG PRO 17 HG2 PRO 17 12.912 60.834 -0.286 114 1HD PRO 17 HD2 PRO 17 12.932 61.912 2.190 115 2HD PRO 17 HD1 PRO 17 11.439 61.340 1.419 116 H GLN 18 HN GLN 18 14.362 59.962 3.679 117 HA GLN 18 HA GLN 18 16.565 58.147 3.538 118 1HB GLN 18 HB2 GLN 18 16.006 60.643 5.122 119 2HB GLN 18 HB1 GLN 18 17.448 59.682 5.420 120 1HG GLN 18 HG2 GLN 18 17.684 59.934 2.787 121 2HG GLN 18 HG1 GLN 18 16.743 61.389 3.108 122 1HE2 GLN 18 HE21 GLN 18 17.656 63.065 4.241 123 2HE2 GLN 18 HE22 GLN 18 19.343 63.146 4.605 124 H TYR 19 HN TYR 19 16.459 56.222 4.499 125 HA TYR 19 HA TYR 19 14.872 55.750 6.841 126 1HB TYR 19 HB1 TYR 19 16.944 53.863 5.730 127 2HB TYR 19 HB2 TYR 19 15.472 53.472 6.613 128 HD1 TYR 19 HD1 TYR 19 16.929 53.439 3.470 129 HD2 TYR 19 HD2 TYR 19 13.256 54.404 5.384 130 HE1 TYR 19 HE1 TYR 19 15.743 53.121 1.340 131 HE2 TYR 19 HE2 TYR 19 12.058 54.089 3.260 132 HH TYR 19 HH TYR 19 12.376 53.960 0.969 133 H LYS 20 HN LYS 20 15.460 56.000 8.886 134 HA LYS 20 HA LYS 20 18.295 56.440 9.490 135 1HB LYS 20 HB2 LYS 20 15.849 57.631 10.395 136 2HB LYS 20 HB1 LYS 20 16.686 56.928 11.773 137 1HG LYS 20 HG2 LYS 20 18.243 58.520 11.770 138 2HG LYS 20 HG1 LYS 20 18.462 58.424 10.022 139 1HD LYS 20 HD2 LYS 20 17.308 60.301 9.750 140 2HD LYS 20 HD1 LYS 20 15.916 59.585 10.564 141 1HE LYS 20 HE2 LYS 20 18.177 60.581 12.222 142 2HE LYS 20 HE1 LYS 20 17.088 61.760 11.492 143 1HZ LYS 20 HZ1 LYS 20 16.576 59.819 13.607 144 2HZ LYS 20 HZ2 LYS 20 15.314 60.105 12.517 145 3HZ LYS 20 HZ3 LYS 20 15.971 61.385 13.406 146 H TYR 21 HN TYR 21 19.261 54.542 9.902 147 HA TYR 21 HA TYR 21 17.997 52.306 11.082 148 1HB TYR 21 HB2 TYR 21 20.430 52.806 9.823 149 2HB TYR 21 HB1 TYR 21 20.881 52.358 11.465 150 HD1 TYR 21 HD1 TYR 21 19.239 51.211 8.383 151 HD2 TYR 21 HD2 TYR 21 20.567 50.117 12.273 152 HE1 TYR 21 HE1 TYR 21 18.940 48.838 7.811 153 HE2 TYR 21 HE2 TYR 21 20.273 47.741 11.712 154 HH TYR 21 HH TYR 21 18.954 46.743 8.576 155 H ALA 22 HN ALA 22 17.493 51.935 13.131 156 HA ALA 22 HA ALA 22 18.103 53.759 15.206 157 1HB ALA 22 HB1 ALA 22 16.069 52.514 15.321 158 2HB ALA 22 HB2 ALA 22 17.072 52.033 16.688 159 3HB ALA 22 HB3 ALA 22 16.941 50.981 15.279 160 H ALA 23 HN ALA 23 19.266 50.468 14.516 161 HA ALA 23 HA ALA 23 21.130 50.483 16.694 162 1HB ALA 23 HB1 ALA 23 21.783 48.518 14.718 163 2HB ALA 23 HB2 ALA 23 20.038 48.550 14.973 164 3HB ALA 23 HB3 ALA 23 21.124 48.293 16.338 165 H GLY 24 HN GLY 24 23.446 50.344 16.483 166 1HA GLY 24 HA1 GLY 24 24.425 52.061 14.312 167 2HA GLY 24 HA2 GLY 24 25.236 51.785 15.845 168 H VAL 25 HN VAL 25 23.954 49.001 14.332 169 HA VAL 25 HA VAL 25 26.673 48.182 13.572 170 HB VAL 25 HB VAL 25 25.692 45.848 13.610 171 1HG1 VAL 25 HG11 VAL 25 25.448 46.047 16.268 172 2HG1 VAL 25 HG12 VAL 25 26.187 47.612 15.928 173 3HG1 VAL 25 HG13 VAL 25 27.001 46.125 15.435 174 1HG2 VAL 25 HG21 VAL 25 23.617 45.429 14.630 175 2HG2 VAL 25 HG22 VAL 25 23.310 46.745 13.497 176 3HG2 VAL 25 HG23 VAL 25 23.478 47.085 15.220 177 H ARG 26 HN ARG 26 27.089 47.251 11.576 178 HA ARG 26 HA ARG 26 25.383 48.105 9.436 179 1HB ARG 26 HB2 ARG 26 28.084 47.552 9.699 180 2HB ARG 26 HB1 ARG 26 27.496 46.230 8.699 181 1HG ARG 26 HG2 ARG 26 27.288 47.543 6.917 182 2HG ARG 26 HG1 ARG 26 26.461 48.800 7.840 183 1HD ARG 26 HD1 ARG 26 28.297 50.038 7.659 184 2HD ARG 26 HD2 ARG 26 29.111 48.878 8.709 185 HE ARG 26 HE ARG 26 29.167 47.916 6.074 186 1HH1 ARG 26 HH11 ARG 26 30.520 50.475 8.015 187 2HH1 ARG 26 HH12 ARG 26 31.966 50.600 7.070 188 1HH2 ARG 26 HH21 ARG 26 31.067 48.076 4.825 189 2HH2 ARG 26 HH22 ARG 26 32.277 49.238 5.257 190 H ASN 27 HN ASN 27 25.882 45.899 7.639 191 HA ASN 27 HA ASN 27 23.576 44.343 8.197 192 1HB ASN 27 HB2 ASN 27 25.675 43.573 6.181 193 2HB ASN 27 HB1 ASN 27 23.932 43.323 6.105 194 1HD2 ASN 27 HD21 ASN 27 22.611 44.963 5.417 195 2HD2 ASN 27 HD22 ASN 27 23.211 46.412 4.691 196 HA PRO 28 HA PRO 28 25.711 41.464 10.911 197 1HB PRO 28 HB2 PRO 28 23.534 39.888 11.390 198 2HB PRO 28 HB1 PRO 28 23.837 41.415 12.225 199 1HG PRO 28 HG2 PRO 28 22.040 40.849 9.898 200 2HG PRO 28 HG1 PRO 28 21.742 41.861 11.325 201 1HD PRO 28 HD2 PRO 28 22.428 42.912 8.939 202 2HD PRO 28 HD1 PRO 28 22.948 43.637 10.474 203 H GLN 29 HN GLN 29 23.256 40.070 8.719 204 HA GLN 29 HA GLN 29 24.977 37.776 8.248 205 1HB GLN 29 HB2 GLN 29 22.161 38.269 8.206 206 2HB GLN 29 HB1 GLN 29 22.646 37.674 6.624 207 1HG GLN 29 HG1 GLN 29 23.912 35.864 8.013 208 2HG GLN 29 HG2 GLN 29 22.773 36.326 9.276 209 1HE2 GLN 29 HE21 GLN 29 22.929 33.784 8.038 210 2HE2 GLN 29 HE22 GLN 29 21.437 33.509 7.211 211 H GLN 30 HN GLN 30 26.474 37.891 6.723 212 HA GLN 30 HA GLN 30 26.100 39.684 4.447 213 1HB GLN 30 HB1 GLN 30 28.489 38.211 5.549 214 2HB GLN 30 HB2 GLN 30 28.527 39.009 3.982 215 1HG GLN 30 HG2 GLN 30 27.585 40.611 6.281 216 2HG GLN 30 HG1 GLN 30 29.298 40.195 6.234 217 1HE2 GLN 30 HE21 GLN 30 30.045 42.229 5.834 218 2HE2 GLN 30 HE22 GLN 30 29.756 43.080 4.359 219 H HIS 31 HN HIS 31 25.974 39.015 2.352 220 HA HIS 31 HA HIS 31 25.270 36.239 1.930 221 1HB HIS 31 HB2 HIS 31 24.585 38.716 0.728 222 2HB HIS 31 HB1 HIS 31 25.349 37.730 -0.515 223 HD2 HIS 31 HD2 HIS 31 22.122 37.834 1.636 224 HE1 HIS 31 HE1 HIS 31 21.811 34.676 -1.167 225 HE2 HIS 31 HE2 HIS 31 20.576 36.034 0.584 226 H LEU 32 HN LEU 32 28.100 37.995 1.866 227 HA LEU 32 HA LEU 32 29.322 36.595 -0.360 228 1HB LEU 32 HB2 LEU 32 29.782 39.030 0.579 229 2HB LEU 32 HB1 LEU 32 30.914 38.171 1.606 230 HG LEU 32 HG LEU 32 31.764 37.159 -0.659 231 1HD1 LEU 32 HD11 LEU 32 30.491 37.901 -2.364 232 2HD1 LEU 32 HD12 LEU 32 31.561 39.300 -2.272 233 3HD1 LEU 32 HD13 LEU 32 29.978 39.349 -1.496 234 1HD2 LEU 32 HD21 LEU 32 32.403 39.568 0.830 235 2HD2 LEU 32 HD22 LEU 32 32.917 39.654 -0.855 236 3HD2 LEU 32 HD23 LEU 32 33.469 38.329 0.168 237 H ASN 33 HN ASN 33 28.749 34.497 0.744 238 HA ASN 33 HA ASN 33 30.704 33.765 2.810 239 1HB ASN 33 HB1 ASN 33 29.003 31.589 2.438 240 2HB ASN 33 HB2 ASN 33 28.916 32.775 3.737 241 1HD2 ASN 33 HD21 ASN 33 27.448 34.492 3.571 242 2HD2 ASN 33 HD22 ASN 33 26.088 34.416 2.508 243 H ALA 34 HN ALA 34 32.323 32.386 2.402 244 HA ALA 34 HA ALA 34 32.618 31.406 -0.329 245 1HB ALA 34 HB1 ALA 34 34.876 30.704 1.191 246 2HB ALA 34 HB2 ALA 34 34.406 32.324 1.708 247 3HB ALA 34 HB3 ALA 34 34.728 32.001 0.005 248 H GLN 35 HN GLN 35 31.352 30.262 2.501 249 HA GLN 35 HA GLN 35 32.333 27.538 2.260 250 1HB GLN 35 HB2 GLN 35 31.004 27.076 4.236 251 2HB GLN 35 HB1 GLN 35 31.949 28.536 4.488 252 1HG GLN 35 HG2 GLN 35 29.942 29.875 3.930 253 2HG GLN 35 HG1 GLN 35 29.018 28.376 3.833 254 1HE2 GLN 35 HE21 GLN 35 28.173 27.561 5.635 255 2HE2 GLN 35 HE22 GLN 35 28.488 28.135 7.233 256 HA PRO 36 HA PRO 36 29.252 25.807 -0.365 257 1HB PRO 36 HB1 PRO 36 28.798 23.779 1.771 258 2HB PRO 36 HB2 PRO 36 29.157 23.547 0.056 259 1HG PRO 36 HG1 PRO 36 31.037 23.154 1.897 260 2HG PRO 36 HG2 PRO 36 31.429 23.923 0.347 261 1HD PRO 36 HD2 PRO 36 31.098 25.154 3.046 262 2HD PRO 36 HD1 PRO 36 32.224 25.579 1.741 263 H GLN 37 HN GLN 37 27.005 25.606 -0.625 264 HA GLN 37 HA GLN 37 25.445 26.899 1.491 265 1HB GLN 37 HB2 GLN 37 25.313 27.992 -0.659 266 2HB GLN 37 HB1 GLN 37 24.889 26.480 -1.450 267 1HG GLN 37 HG1 GLN 37 23.034 27.067 0.667 268 2HG GLN 37 HG2 GLN 37 23.156 28.422 -0.454 269 1HE2 GLN 37 HE21 GLN 37 22.433 25.010 -0.162 270 2HE2 GLN 37 HE22 GLN 37 21.517 24.882 -1.621 271 H VAL 38 HN VAL 38 23.736 25.943 2.470 272 HA VAL 38 HA VAL 38 23.317 23.098 1.882 273 HB VAL 38 HB VAL 38 23.995 23.754 4.200 274 1HG1 VAL 38 HG21 VAL 38 22.965 25.398 5.277 275 2HG1 VAL 38 HG22 VAL 38 21.429 24.538 5.166 276 3HG1 VAL 38 HG23 VAL 38 21.918 25.642 3.879 277 1HG2 VAL 38 HG11 VAL 38 21.252 22.541 4.246 278 2HG2 VAL 38 HG12 VAL 38 22.658 22.145 5.235 279 3HG2 VAL 38 HG13 VAL 38 22.622 21.692 3.531 280 H THR 39 HN THR 39 21.222 22.230 1.715 281 HA THR 39 HA THR 39 19.245 24.149 0.742 282 HB THR 39 HB THR 39 18.333 21.472 0.448 283 HG1 THR 39 HG1 THR 39 20.550 20.904 0.747 284 1HG2 THR 39 HG21 THR 39 18.534 23.735 -1.123 285 2HG2 THR 39 HG22 THR 39 17.860 22.175 -1.592 286 3HG2 THR 39 HG23 THR 39 19.550 22.543 -1.934 287 H MET 40 HN MET 40 16.880 23.360 1.159 288 HA MET 40 HA MET 40 16.546 23.347 4.036 289 1HB MET 40 HB2 MET 40 14.623 23.624 1.728 290 2HB MET 40 HB1 MET 40 14.083 23.524 3.398 291 1HG MET 40 HG2 MET 40 16.156 25.536 2.781 292 2HG MET 40 HG1 MET 40 14.535 25.830 2.152 293 1HE MET 40 HE1 MET 40 12.894 27.333 3.631 294 2HE MET 40 HE2 MET 40 14.505 28.006 3.379 295 3HE MET 40 HE3 MET 40 13.747 28.107 4.968 296 H GLN 41 HN GLN 41 14.200 22.031 4.432 297 HA GLN 41 HA GLN 41 14.876 19.242 3.756 298 1HB GLN 41 HB2 GLN 41 13.180 19.616 6.112 299 2HB GLN 41 HB1 GLN 41 14.609 18.616 5.903 300 1HG GLN 41 HG1 GLN 41 15.962 20.743 6.115 301 2HG GLN 41 HG2 GLN 41 14.471 21.519 6.646 302 1HE2 GLN 41 HE21 GLN 41 17.173 20.574 7.871 303 2HE2 GLN 41 HE22 GLN 41 16.678 19.872 9.370 304 H GLN 42 HN GLN 42 13.435 20.299 1.873 305 HA GLN 42 HA GLN 42 11.491 20.220 0.698 306 1HB GLN 42 HB2 GLN 42 10.961 17.994 2.671 307 2HB GLN 42 HB1 GLN 42 9.937 18.331 1.282 308 1HG GLN 42 HG1 GLN 42 11.909 17.969 -0.184 309 2HG GLN 42 HG2 GLN 42 12.823 17.482 1.243 310 1HE2 GLN 42 HE21 GLN 42 9.524 16.797 0.130 311 2HE2 GLN 42 HE22 GLN 42 9.681 15.077 0.179 312 HA PRO 43 HA PRO 43 9.324 22.926 3.766 313 1HB PRO 43 HB1 PRO 43 8.722 24.849 1.920 314 2HB PRO 43 HB2 PRO 43 10.227 24.815 2.845 315 1HG PRO 43 HG2 PRO 43 9.694 23.882 0.050 316 2HG PRO 43 HG1 PRO 43 11.082 24.787 0.683 317 1HD PRO 43 HD1 PRO 43 11.201 22.137 0.215 318 2HD PRO 43 HD2 PRO 43 12.076 22.893 1.564 319 H ALA 44 HN ALA 44 7.102 24.064 3.393 320 HA ALA 44 HA ALA 44 5.224 22.052 2.765 321 1HB ALA 44 HB1 ALA 44 4.990 24.034 4.376 322 2HB ALA 44 HB2 ALA 44 3.574 23.558 3.438 323 3HB ALA 44 HB3 ALA 44 4.526 24.961 2.950 324 H VAL 45 HN VAL 45 5.135 21.337 0.704 325 HA VAL 45 HA VAL 45 5.091 23.246 -1.500 326 HB VAL 45 HB VAL 45 4.994 21.128 -2.908 327 1HG1 VAL 45 HG11 VAL 45 7.233 22.108 -1.255 328 2HG1 VAL 45 HG12 VAL 45 7.086 21.978 -3.007 329 3HG1 VAL 45 HG13 VAL 45 7.470 20.550 -2.047 330 1HG2 VAL 45 HG21 VAL 45 4.774 19.138 -1.951 331 2HG2 VAL 45 HG22 VAL 45 4.548 19.951 -0.403 332 3HG2 VAL 45 HG23 VAL 45 6.160 19.442 -0.904 333 H HIS 46 HN HIS 46 3.369 23.547 -2.873 334 HA HIS 46 HA HIS 46 0.771 22.845 -1.798 335 1HB HIS 46 HB1 HIS 46 1.205 24.345 -4.367 336 2HB HIS 46 HB2 HIS 46 -0.120 24.485 -3.216 337 HD2 HIS 46 HD2 HIS 46 0.837 25.635 -0.645 338 HE1 HIS 46 HE1 HIS 46 3.690 27.954 -2.743 339 HE2 HIS 46 HE2 HIS 46 2.467 27.652 -0.542 340 H VAL 47 HN VAL 47 0.319 20.732 -2.184 341 HA VAL 47 HA VAL 47 0.687 19.658 -4.877 342 HB VAL 47 HB VAL 47 -0.356 18.161 -2.478 343 1HG1 VAL 47 HG21 VAL 47 0.430 17.480 -5.231 344 2HG1 VAL 47 HG22 VAL 47 -0.708 16.685 -4.143 345 3HG1 VAL 47 HG23 VAL 47 1.022 16.387 -3.979 346 1HG2 VAL 47 HG11 VAL 47 1.645 18.443 -1.533 347 2HG2 VAL 47 HG12 VAL 47 2.323 19.159 -2.996 348 3HG2 VAL 47 HG13 VAL 47 2.277 17.406 -2.811 349 H GLN 48 HN GLN 48 -0.985 18.889 -6.144 350 HA GLN 48 HA GLN 48 -3.486 20.215 -5.853 351 1HB GLN 48 HB1 GLN 48 -2.304 19.543 -8.022 352 2HB GLN 48 HB2 GLN 48 -2.933 17.926 -7.733 353 1HG GLN 48 HG1 GLN 48 -5.187 19.383 -7.467 354 2HG GLN 48 HG2 GLN 48 -4.304 20.360 -8.640 355 1HE2 GLN 48 HE22 GLN 48 -6.046 17.466 -8.078 356 2HE2 GLN 48 HE21 GLN 48 -5.988 16.850 -9.691 357 H GLY 49 HN GLY 49 -2.595 16.758 -5.777 358 1HA GLY 49 HA2 GLY 49 -5.227 16.106 -4.705 359 2HA GLY 49 HA1 GLY 49 -3.996 14.959 -5.209 360 H GLN 50 HN GLN 50 -5.152 14.287 -2.977 361 HA GLN 50 HA GLN 50 -3.522 15.316 -0.761 362 1HB GLN 50 HB2 GLN 50 -6.249 14.247 -0.988 363 2HB GLN 50 HB1 GLN 50 -5.346 13.613 0.381 364 1HG GLN 50 HG1 GLN 50 -5.030 16.471 0.155 365 2HG GLN 50 HG2 GLN 50 -6.731 16.015 0.246 366 1HE2 GLN 50 HE21 GLN 50 -4.635 17.242 2.129 367 2HE2 GLN 50 HE22 GLN 50 -4.869 16.368 3.602 368 H GLU 51 HN GLU 51 -1.618 14.196 -1.041 369 HA GLU 51 HA GLU 51 -1.624 11.332 -1.405 370 1HB GLU 51 HB1 GLU 51 0.886 11.625 -1.154 371 2HB GLU 51 HB2 GLU 51 0.141 12.464 -2.507 372 1HG GLU 51 HG1 GLU 51 0.306 14.553 -1.437 373 2HG GLU 51 HG2 GLU 51 0.679 13.812 0.119 374 HA PRO 52 HA PRO 52 -1.708 10.449 2.955 375 1HB PRO 52 HB2 PRO 52 -1.189 7.802 2.825 376 2HB PRO 52 HB1 PRO 52 -2.748 8.484 2.349 377 1HG PRO 52 HG2 PRO 52 -0.437 7.653 0.634 378 2HG PRO 52 HG1 PRO 52 -2.170 7.366 0.391 379 1HD PRO 52 HD2 PRO 52 -0.799 9.339 -0.885 380 2HD PRO 52 HD1 PRO 52 -2.521 9.468 -0.477 381 H LEU 53 HN LEU 53 -0.258 8.925 4.448 382 HA LEU 53 HA LEU 53 2.404 10.032 4.271 383 1HB LEU 53 HB2 LEU 53 0.746 9.357 6.352 384 2HB LEU 53 HB1 LEU 53 1.895 8.034 6.355 385 HG LEU 53 HG LEU 53 3.524 10.254 6.155 386 1HD1 LEU 53 HD21 LEU 53 2.121 11.191 8.446 387 2HD1 LEU 53 HD22 LEU 53 1.015 11.178 7.071 388 3HD1 LEU 53 HD23 LEU 53 2.538 12.062 6.971 389 1HD2 LEU 53 HD11 LEU 53 2.770 9.229 8.847 390 2HD2 LEU 53 HD12 LEU 53 4.365 9.559 8.168 391 3HD2 LEU 53 HD13 LEU 53 3.477 8.117 7.674 392 H THR 54 HN THR 54 4.339 8.842 4.225 393 HA THR 54 HA THR 54 4.414 6.021 3.964 394 HB THR 54 HB THR 54 5.480 6.833 1.444 395 HG1 THR 54 HG1 THR 54 3.619 7.606 0.453 396 1HG2 THR 54 HG21 THR 54 4.801 4.612 1.658 397 2HG2 THR 54 HG22 THR 54 3.614 5.347 0.578 398 3HG2 THR 54 HG23 THR 54 3.211 5.068 2.272 399 H ALA 55 HN ALA 55 6.728 5.523 2.772 400 HA ALA 55 HA ALA 55 8.674 6.256 4.563 401 1HB ALA 55 HB1 ALA 55 8.965 5.435 1.683 402 2HB ALA 55 HB2 ALA 55 9.044 4.409 3.116 403 3HB ALA 55 HB3 ALA 55 10.320 5.586 2.801 404 H SER 56 HN SER 56 7.648 7.945 1.660 405 HA SER 56 HA SER 56 9.794 9.770 1.490 406 1HB SER 56 HB1 SER 56 6.927 10.195 0.615 407 2HB SER 56 HB2 SER 56 8.340 11.081 0.042 408 HG SER 56 HG SER 56 7.885 9.493 -1.446 409 H MET 57 HN MET 57 6.645 9.939 3.109 410 HA MET 57 HA MET 57 6.875 12.568 4.083 411 1HB MET 57 HB1 MET 57 5.318 10.155 4.989 412 2HB MET 57 HB2 MET 57 5.275 11.654 5.903 413 1HG MET 57 HG1 MET 57 3.535 11.019 3.957 414 2HG MET 57 HG2 MET 57 3.934 12.671 4.427 415 1HE MET 57 HE1 MET 57 3.705 10.093 1.834 416 2HE MET 57 HE2 MET 57 5.444 9.814 1.923 417 3HE MET 57 HE3 MET 57 4.747 10.582 0.496 418 H LEU 58 HN LEU 58 7.835 9.450 5.413 419 HA LEU 58 HA LEU 58 8.696 10.326 7.938 420 1HB LEU 58 HB1 LEU 58 9.473 7.993 6.200 421 2HB LEU 58 HB2 LEU 58 10.167 8.232 7.791 422 HG LEU 58 HG LEU 58 8.466 7.109 8.679 423 1HD1 LEU 58 HD11 LEU 58 6.126 7.984 8.514 424 2HD1 LEU 58 HD12 LEU 58 6.736 9.229 7.423 425 3HD1 LEU 58 HD13 LEU 58 7.317 9.152 9.087 426 1HD2 LEU 58 HD21 LEU 58 6.860 5.979 7.297 427 2HD2 LEU 58 HD22 LEU 58 8.424 5.984 6.477 428 3HD2 LEU 58 HD23 LEU 58 7.157 7.101 5.969 429 H ALA 59 HN ALA 59 10.413 9.938 4.873 430 HA ALA 59 HA ALA 59 12.969 10.655 5.842 431 1HB ALA 59 HB1 ALA 59 11.917 10.866 3.025 432 2HB ALA 59 HB2 ALA 59 12.604 9.413 3.752 433 3HB ALA 59 HB3 ALA 59 13.611 10.841 3.516 434 H SER 60 HN SER 60 10.200 12.513 5.328 435 HA SER 60 HA SER 60 11.495 14.962 4.567 436 1HB SER 60 HB2 SER 60 8.718 14.476 5.678 437 2HB SER 60 HB1 SER 60 9.291 15.994 4.988 438 HG SER 60 HG SER 60 8.346 15.027 3.305 439 H ALA 61 HN ALA 61 11.064 13.249 7.467 440 HA ALA 61 HA ALA 61 12.050 15.557 8.995 441 1HB ALA 61 HB1 ALA 61 9.686 13.843 9.607 442 2HB ALA 61 HB2 ALA 61 9.879 15.590 9.756 443 3HB ALA 61 HB3 ALA 61 10.638 14.516 10.930 444 HA PRO 62 HA PRO 62 14.572 11.525 9.321 445 1HB PRO 62 HB1 PRO 62 16.711 13.581 9.083 446 2HB PRO 62 HB2 PRO 62 16.614 11.966 8.374 447 1HG PRO 62 HG2 PRO 62 16.173 14.134 6.889 448 2HG PRO 62 HG1 PRO 62 15.216 12.660 6.658 449 1HD PRO 62 HD2 PRO 62 14.465 15.220 7.998 450 2HD PRO 62 HD1 PRO 62 13.471 14.122 7.021 451 HA PRO 63 HA PRO 63 16.327 13.395 13.267 452 1HB PRO 63 HB1 PRO 63 16.901 15.977 13.541 453 2HB PRO 63 HB2 PRO 63 17.871 14.952 12.478 454 1HG PRO 63 HG1 PRO 63 15.823 16.993 11.790 455 2HG PRO 63 HG2 PRO 63 17.272 16.509 10.896 456 1HD PRO 63 HD1 PRO 63 14.598 15.635 10.458 457 2HD PRO 63 HD2 PRO 63 16.069 15.043 9.662 458 H GLN 64 HN GLN 64 13.401 13.909 12.312 459 HA GLN 64 HA GLN 64 12.548 15.265 14.784 460 1HB GLN 64 HB2 GLN 64 11.523 15.588 11.977 461 2HB GLN 64 HB1 GLN 64 10.508 15.966 13.362 462 1HG GLN 64 HG2 GLN 64 13.190 17.203 12.789 463 2HG GLN 64 HG1 GLN 64 11.628 17.935 12.430 464 1HE2 GLN 64 HE22 GLN 64 10.178 18.275 14.279 465 2HE2 GLN 64 HE21 GLN 64 10.872 18.704 15.802 466 H GLU 65 HN GLU 65 10.319 14.018 12.414 467 HA GLU 65 HA GLU 65 9.448 12.022 14.382 468 1HB GLU 65 HB1 GLU 65 7.736 12.663 12.049 469 2HB GLU 65 HB2 GLU 65 7.292 12.386 13.728 470 1HG GLU 65 HG2 GLU 65 8.822 14.822 13.399 471 2HG GLU 65 HG1 GLU 65 7.364 14.810 12.409 472 H GLN 66 HN GLN 66 11.651 11.605 12.430 473 HA GLN 66 HA GLN 66 10.831 10.007 10.284 474 1HB GLN 66 HB2 GLN 66 13.224 10.921 11.119 475 2HB GLN 66 HB1 GLN 66 13.349 9.249 11.650 476 1HG GLN 66 HG1 GLN 66 12.354 9.090 9.062 477 2HG GLN 66 HG2 GLN 66 13.570 10.365 9.001 478 1HE2 GLN 66 HE22 GLN 66 13.049 7.060 10.143 479 2HE2 GLN 66 HE21 GLN 66 14.668 6.522 9.872 480 H LYS 67 HN LYS 67 11.609 9.159 13.630 481 HA LYS 67 HA LYS 67 10.438 6.501 13.145 482 1HB LYS 67 HB2 LYS 67 11.818 5.724 15.072 483 2HB LYS 67 HB1 LYS 67 12.768 6.263 13.695 484 1HG LYS 67 HG2 LYS 67 13.072 8.450 14.838 485 2HG LYS 67 HG1 LYS 67 12.267 7.765 16.252 486 1HD LYS 67 HD1 LYS 67 14.142 5.866 15.731 487 2HD LYS 67 HD2 LYS 67 14.987 7.334 15.231 488 1HE LYS 67 HE2 LYS 67 15.199 8.072 17.336 489 2HE LYS 67 HE1 LYS 67 13.561 7.589 17.771 490 1HZ LYS 67 HZ1 LYS 67 14.486 5.950 18.919 491 2HZ LYS 67 HZ2 LYS 67 16.021 6.254 18.274 492 3HZ LYS 67 HZ3 LYS 67 14.945 5.240 17.454 493 H GLN 68 HN GLN 68 8.816 8.696 13.695 494 HA GLN 68 HA GLN 68 7.776 7.940 16.332 495 1HB GLN 68 HB1 GLN 68 8.169 10.755 15.314 496 2HB GLN 68 HB2 GLN 68 7.172 10.352 16.705 497 1HG GLN 68 HG2 GLN 68 9.548 9.104 17.278 498 2HG GLN 68 HG1 GLN 68 10.061 10.589 16.479 499 1HE2 GLN 68 HE21 GLN 68 8.130 12.347 17.277 500 2HE2 GLN 68 HE22 GLN 68 8.218 12.576 18.987 501 H MET 69 HN MET 69 7.029 9.907 13.445 502 HA MET 69 HA MET 69 4.205 9.484 13.781 503 1HB MET 69 HB2 MET 69 3.953 10.841 11.785 504 2HB MET 69 HB1 MET 69 5.111 11.592 12.875 505 1HG MET 69 HG2 MET 69 6.859 11.278 11.468 506 2HG MET 69 HG1 MET 69 6.191 9.795 10.789 507 1HE MET 69 HE1 MET 69 7.505 11.519 8.624 508 2HE MET 69 HE2 MET 69 7.470 12.848 9.783 509 3HE MET 69 HE3 MET 69 6.716 13.037 8.199 510 H LEU 70 HN LEU 70 6.564 7.500 12.638 511 HA LEU 70 HA LEU 70 5.509 6.500 10.238 512 1HB LEU 70 HB1 LEU 70 6.680 4.288 11.336 513 2HB LEU 70 HB2 LEU 70 7.495 5.503 10.382 514 HG LEU 70 HG LEU 70 8.338 6.601 12.348 515 1HD1 LEU 70 HD21 LEU 70 7.882 5.226 14.570 516 2HD1 LEU 70 HD22 LEU 70 6.362 4.884 13.743 517 3HD1 LEU 70 HD23 LEU 70 6.839 6.553 14.058 518 1HD2 LEU 70 HD11 LEU 70 8.844 3.840 11.722 519 2HD2 LEU 70 HD12 LEU 70 9.155 4.164 13.427 520 3HD2 LEU 70 HD13 LEU 70 9.974 5.112 12.185 521 H GLY 71 HN GLY 71 4.903 5.534 13.598 522 1HA GLY 71 HA2 GLY 71 2.589 4.018 12.595 523 2HA GLY 71 HA1 GLY 71 3.641 3.334 13.818 524 H GLU 72 HN GLU 72 2.825 6.733 13.777 525 HA GLU 72 HA GLU 72 0.832 6.340 15.882 526 1HB GLU 72 HB1 GLU 72 3.200 8.203 16.164 527 2HB GLU 72 HB2 GLU 72 1.892 8.009 17.324 528 1HG GLU 72 HG2 GLU 72 2.666 5.497 17.275 529 2HG GLU 72 HG1 GLU 72 4.179 6.213 16.722 530 H ARG 73 HN ARG 73 1.694 7.770 13.049 531 HA ARG 73 HA ARG 73 -0.252 9.951 13.431 532 1HB ARG 73 HB1 ARG 73 2.073 10.806 13.265 533 2HB ARG 73 HB2 ARG 73 2.221 10.035 11.693 534 1HG ARG 73 HG2 ARG 73 1.263 11.757 10.683 535 2HG ARG 73 HG1 ARG 73 -0.116 11.713 11.785 536 1HD ARG 73 HD1 ARG 73 1.661 12.787 13.433 537 2HD ARG 73 HD2 ARG 73 2.375 13.321 11.913 538 HE ARG 73 HE ARG 73 0.319 14.490 11.438 539 1HH1 ARG 73 HH12 ARG 73 0.684 13.303 14.695 540 2HH1 ARG 73 HH11 ARG 73 -0.470 14.408 15.362 541 1HH2 ARG 73 HH21 ARG 73 -1.201 15.947 12.310 542 2HH2 ARG 73 HH22 ARG 73 -1.542 15.910 14.007 543 H LEU 74 HN LEU 74 0.933 7.345 11.537 544 HA LEU 74 HA LEU 74 -0.444 7.954 9.121 545 1HB LEU 74 HB1 LEU 74 1.253 5.843 10.168 546 2HB LEU 74 HB2 LEU 74 -0.050 5.204 9.184 547 HG LEU 74 HG LEU 74 1.429 7.486 8.047 548 1HD1 LEU 74 HD11 LEU 74 3.121 5.964 9.207 549 2HD1 LEU 74 HD12 LEU 74 3.377 6.329 7.499 550 3HD1 LEU 74 HD13 LEU 74 2.695 4.774 7.977 551 1HD2 LEU 74 HD21 LEU 74 1.003 6.390 6.012 552 2HD2 LEU 74 HD22 LEU 74 -0.452 6.152 6.981 553 3HD2 LEU 74 HD23 LEU 74 0.720 4.844 6.812 554 H PHE 75 HN PHE 75 -1.364 6.485 12.093 555 HA PHE 75 HA PHE 75 -3.275 4.675 11.459 556 1HB PHE 75 HB1 PHE 75 -2.824 4.997 13.746 557 2HB PHE 75 HB2 PHE 75 -3.216 6.711 13.672 558 HD1 PHE 75 HD1 PHE 75 -5.146 3.773 12.447 559 HD2 PHE 75 HD2 PHE 75 -4.923 7.021 15.189 560 HE1 PHE 75 HE1 PHE 75 -7.437 3.286 13.210 561 HE2 PHE 75 HE2 PHE 75 -7.211 6.541 15.955 562 HZ PHE 75 HZ PHE 75 -8.471 4.671 14.964 563 HA PRO 76 HA PRO 76 -6.743 8.069 10.980 564 1HB PRO 76 HB2 PRO 76 -5.137 10.448 10.262 565 2HB PRO 76 HB1 PRO 76 -6.548 10.319 11.315 566 1HG PRO 76 HG2 PRO 76 -4.104 10.707 12.323 567 2HG PRO 76 HG1 PRO 76 -5.288 9.676 13.147 568 1HD PRO 76 HD2 PRO 76 -2.935 8.897 11.469 569 2HD PRO 76 HD1 PRO 76 -3.540 8.166 12.969 570 H LEU 77 HN LEU 77 -3.868 7.711 9.129 571 HA LEU 77 HA LEU 77 -5.221 8.442 6.648 572 1HB LEU 77 HB1 LEU 77 -2.340 7.763 7.221 573 2HB LEU 77 HB2 LEU 77 -2.964 8.156 5.631 574 HG LEU 77 HG LEU 77 -2.897 9.996 8.027 575 1HD1 LEU 77 HD11 LEU 77 -1.540 11.093 5.846 576 2HD1 LEU 77 HD12 LEU 77 -1.011 9.413 5.941 577 3HD1 LEU 77 HD13 LEU 77 -0.844 10.471 7.342 578 1HD2 LEU 77 HD21 LEU 77 -3.439 11.442 5.700 579 2HD2 LEU 77 HD22 LEU 77 -4.534 11.129 7.046 580 3HD2 LEU 77 HD23 LEU 77 -4.520 10.049 5.652 581 H ILE 78 HN ILE 78 -4.150 5.620 8.393 582 HA ILE 78 HA ILE 78 -4.017 3.828 6.205 583 HB ILE 78 HB ILE 78 -4.890 2.977 8.938 584 1HG1 ILE 78 HG12 ILE 78 -2.897 4.523 9.068 585 2HG1 ILE 78 HG11 ILE 78 -2.616 2.897 9.680 586 1HG2 ILE 78 HG21 ILE 78 -3.065 1.185 7.907 587 2HG2 ILE 78 HG22 ILE 78 -3.983 1.708 6.492 588 3HG2 ILE 78 HG23 ILE 78 -4.821 1.018 7.884 589 1HD1 ILE 78 HD11 ILE 78 -1.287 2.312 7.878 590 2HD1 ILE 78 HD12 ILE 78 -0.826 3.983 8.213 591 3HD1 ILE 78 HD13 ILE 78 -1.910 3.620 6.869 592 H GLN 79 HN GLN 79 -6.619 4.882 8.309 593 HA GLN 79 HA GLN 79 -8.625 3.092 7.628 594 1HB GLN 79 HB1 GLN 79 -8.440 5.765 8.776 595 2HB GLN 79 HB2 GLN 79 -9.919 5.533 7.856 596 1HG GLN 79 HG2 GLN 79 -10.372 3.494 9.190 597 2HG GLN 79 HG1 GLN 79 -8.953 3.865 10.167 598 1HE2 GLN 79 HE22 GLN 79 -8.956 5.889 11.341 599 2HE2 GLN 79 HE21 GLN 79 -10.453 6.544 11.899 600 H ALA 80 HN ALA 80 -7.014 5.244 5.651 601 HA ALA 80 HA ALA 80 -9.199 5.695 3.775 602 1HB ALA 80 HB1 ALA 80 -7.576 7.504 4.332 603 2HB ALA 80 HB2 ALA 80 -7.700 7.148 2.608 604 3HB ALA 80 HB3 ALA 80 -6.321 6.552 3.535 605 H MET 81 HN MET 81 -6.313 3.760 4.144 606 HA MET 81 HA MET 81 -6.172 3.014 1.380 607 1HB MET 81 HB1 MET 81 -4.726 1.535 3.542 608 2HB MET 81 HB2 MET 81 -4.175 1.947 1.925 609 1HG MET 81 HG1 MET 81 -4.530 4.402 3.093 610 2HG MET 81 HG2 MET 81 -3.939 3.411 4.420 611 1HE MET 81 HE1 MET 81 -1.378 3.058 4.824 612 2HE MET 81 HE2 MET 81 -0.442 2.385 3.489 613 3HE MET 81 HE3 MET 81 -1.974 1.639 3.955 614 H HIS 82 HN HIS 82 -7.030 1.245 4.350 615 HA HIS 82 HA HIS 82 -7.299 -1.171 2.873 616 1HB HIS 82 HB1 HIS 82 -6.777 -0.582 5.485 617 2HB HIS 82 HB2 HIS 82 -8.397 -1.265 5.577 618 HD2 HIS 82 HD2 HIS 82 -5.058 -2.311 3.735 619 HE1 HIS 82 HE1 HIS 82 -7.006 -5.739 5.261 620 HE2 HIS 82 HE2 HIS 82 -4.983 -4.889 3.997 621 HA PRO 83 HA PRO 83 -8.798 1.810 4.046 622 1HB PRO 83 HB1 PRO 83 -11.085 3.248 4.390 623 2HB PRO 83 HB2 PRO 83 -10.317 3.007 2.820 624 1HG PRO 83 HG2 PRO 83 -12.833 1.947 3.808 625 2HG PRO 83 HG1 PRO 83 -12.178 1.907 2.164 626 1HD PRO 83 HD1 PRO 83 -12.157 -0.175 4.217 627 2HD PRO 83 HD2 PRO 83 -11.830 -0.307 2.478 628 H THR 84 HN THR 84 -11.961 1.670 5.634 629 HA THR 84 HA THR 84 -10.886 2.315 8.166 630 HB THR 84 HB THR 84 -13.604 1.098 7.697 631 HG1 THR 84 HG1 THR 84 -13.421 3.832 7.633 632 1HG2 THR 84 HG21 THR 84 -13.533 3.386 9.413 633 2HG2 THR 84 HG22 THR 84 -12.403 2.157 9.980 634 3HG2 THR 84 HG23 THR 84 -14.102 1.750 9.743 635 H LEU 85 HN LEU 85 -9.262 0.593 8.283 636 HA LEU 85 HA LEU 85 -10.315 -1.687 9.779 637 1HB LEU 85 HB1 LEU 85 -9.167 -1.822 7.132 638 2HB LEU 85 HB2 LEU 85 -8.189 -2.725 8.269 639 HG LEU 85 HG LEU 85 -9.707 -4.277 7.329 640 1HD1 LEU 85 HD11 LEU 85 -9.470 -4.648 9.666 641 2HD1 LEU 85 HD12 LEU 85 -11.170 -4.889 9.266 642 3HD1 LEU 85 HD13 LEU 85 -10.652 -3.396 10.047 643 1HD2 LEU 85 HD21 LEU 85 -11.896 -3.921 6.810 644 2HD2 LEU 85 HD22 LEU 85 -11.289 -2.271 6.672 645 3HD2 LEU 85 HD23 LEU 85 -12.142 -2.779 8.130 646 H ALA 86 HN ALA 86 -8.507 0.883 9.850 647 HA ALA 86 HA ALA 86 -5.962 -0.063 10.719 648 1HB ALA 86 HB1 ALA 86 -6.536 2.176 9.644 649 2HB ALA 86 HB2 ALA 86 -5.373 2.177 10.971 650 3HB ALA 86 HB3 ALA 86 -7.039 2.679 11.258 651 H GLY 87 HN GLY 87 -7.913 -1.355 12.264 652 1HA GLY 87 HA1 GLY 87 -8.276 -0.111 14.796 653 2HA GLY 87 HA2 GLY 87 -8.458 -1.825 14.451 654 H LYS 88 HN LYS 88 -5.554 -1.440 13.313 655 HA LYS 88 HA LYS 88 -3.782 -0.889 15.368 656 1HB LYS 88 HB1 LYS 88 -4.913 -2.785 16.528 657 2HB LYS 88 HB2 LYS 88 -4.424 -3.842 15.216 658 1HG LYS 88 HG1 LYS 88 -2.030 -2.879 15.859 659 2HG LYS 88 HG2 LYS 88 -2.829 -2.700 17.427 660 1HD LYS 88 HD2 LYS 88 -2.143 -4.837 17.699 661 2HD LYS 88 HD1 LYS 88 -3.610 -5.194 16.783 662 1HE LYS 88 HE2 LYS 88 -2.216 -5.099 14.697 663 2HE LYS 88 HE1 LYS 88 -0.792 -4.992 15.730 664 1HZ LYS 88 HZ1 LYS 88 -2.612 -7.258 15.307 665 2HZ LYS 88 HZ2 LYS 88 -1.811 -7.122 16.790 666 3HZ LYS 88 HZ3 LYS 88 -0.922 -7.232 15.356 667 H ILE 89 HN ILE 89 -3.995 -0.650 12.541 668 HA ILE 89 HA ILE 89 -2.240 -2.595 11.361 669 HB ILE 89 HB ILE 89 -3.213 0.012 10.198 670 1HG1 ILE 89 HG12 ILE 89 -4.255 -2.802 9.773 671 2HG1 ILE 89 HG11 ILE 89 -5.024 -1.609 10.814 672 1HG2 ILE 89 HG21 ILE 89 -1.228 -1.807 9.355 673 2HG2 ILE 89 HG22 ILE 89 -1.877 -0.417 8.483 674 3HG2 ILE 89 HG23 ILE 89 -2.613 -2.008 8.279 675 1HD1 ILE 89 HD11 ILE 89 -5.691 -2.040 8.239 676 2HD1 ILE 89 HD12 ILE 89 -4.533 -0.722 8.060 677 3HD1 ILE 89 HD13 ILE 89 -5.949 -0.517 9.087 678 H THR 90 HN THR 90 -1.781 0.825 10.758 679 HA THR 90 HA THR 90 0.967 0.764 10.646 680 HB THR 90 HB THR 90 -1.098 2.758 10.676 681 HG1 THR 90 HG1 THR 90 1.382 2.309 9.518 682 1HG2 THR 90 HG21 THR 90 1.265 3.376 12.348 683 2HG2 THR 90 HG22 THR 90 -0.399 3.948 12.474 684 3HG2 THR 90 HG23 THR 90 0.673 4.613 11.239 685 H GLY 91 HN GLY 91 -1.088 1.316 13.474 686 1HA GLY 91 HA2 GLY 91 0.890 2.139 15.285 687 2HA GLY 91 HA1 GLY 91 -0.576 1.265 15.716 688 H MET 92 HN MET 92 0.039 -0.985 14.011 689 HA MET 92 HA MET 92 1.782 -2.412 15.835 690 1HB MET 92 HB2 MET 92 0.307 -4.005 15.292 691 2HB MET 92 HB1 MET 92 -0.274 -3.096 13.904 692 1HG MET 92 HG2 MET 92 1.042 -4.208 12.448 693 2HG MET 92 HG1 MET 92 2.339 -4.436 13.616 694 1HE MET 92 HE1 MET 92 -1.428 -5.691 12.862 695 2HE MET 92 HE2 MET 92 -0.877 -7.304 12.406 696 3HE MET 92 HE3 MET 92 -0.220 -5.883 11.589 697 H LEU 93 HN LEU 93 1.942 -0.952 12.712 698 HA LEU 93 HA LEU 93 4.088 -2.351 11.588 699 1HB LEU 93 HB2 LEU 93 2.886 0.326 11.239 700 2HB LEU 93 HB1 LEU 93 4.480 0.077 10.563 701 HG LEU 93 HG LEU 93 2.678 -0.288 8.910 702 1HD1 LEU 93 HD11 LEU 93 3.397 -2.846 8.535 703 2HD1 LEU 93 HD12 LEU 93 4.643 -2.352 9.682 704 3HD1 LEU 93 HD13 LEU 93 4.448 -1.479 8.162 705 1HD2 LEU 93 HD21 LEU 93 1.002 -1.827 9.138 706 2HD2 LEU 93 HD22 LEU 93 1.179 -1.285 10.810 707 3HD2 LEU 93 HD23 LEU 93 1.906 -2.807 10.295 708 H LEU 94 HN LEU 94 4.013 -0.575 14.396 709 HA LEU 94 HA LEU 94 6.889 0.026 14.242 710 1HB LEU 94 HB1 LEU 94 4.610 1.324 15.569 711 2HB LEU 94 HB2 LEU 94 6.024 1.140 16.586 712 HG LEU 94 HG LEU 94 5.814 3.333 15.323 713 1HD1 LEU 94 HD21 LEU 94 8.154 1.564 15.519 714 2HD1 LEU 94 HD22 LEU 94 7.913 3.205 16.117 715 3HD1 LEU 94 HD23 LEU 94 8.326 2.936 14.423 716 1HD2 LEU 94 HD11 LEU 94 5.046 2.489 13.190 717 2HD2 LEU 94 HD12 LEU 94 6.523 1.543 13.000 718 3HD2 LEU 94 HD13 LEU 94 6.596 3.306 12.978 719 H GLU 95 HN GLU 95 5.580 -2.556 14.575 720 HA GLU 95 HA GLU 95 7.126 -3.559 16.746 721 1HB GLU 95 HB2 GLU 95 5.458 -4.237 18.260 722 2HB GLU 95 HB1 GLU 95 5.050 -2.574 17.863 723 1HG GLU 95 HG1 GLU 95 3.282 -3.261 16.433 724 2HG GLU 95 HG2 GLU 95 3.791 -4.947 16.516 725 H ILE 96 HN ILE 96 5.649 -3.896 13.830 726 HA ILE 96 HA ILE 96 4.811 -6.573 13.758 727 HB ILE 96 HB ILE 96 5.131 -6.535 11.368 728 1HG1 ILE 96 HG12 ILE 96 7.328 -5.530 11.229 729 2HG1 ILE 96 HG11 ILE 96 6.197 -4.643 10.217 730 1HG2 ILE 96 HG21 ILE 96 4.004 -4.054 12.581 731 2HG2 ILE 96 HG22 ILE 96 3.162 -5.445 11.893 732 3HG2 ILE 96 HG23 ILE 96 3.993 -4.301 10.835 733 1HD1 ILE 96 HD11 ILE 96 6.952 -2.808 11.177 734 2HD1 ILE 96 HD12 ILE 96 7.817 -3.727 12.409 735 3HD1 ILE 96 HD13 ILE 96 6.116 -3.324 12.643 736 H ASP 97 HN ASP 97 6.436 -7.470 11.510 737 HA ASP 97 HA ASP 97 8.302 -9.110 12.786 738 1HB ASP 97 HB1 ASP 97 7.147 -9.118 10.376 739 2HB ASP 97 HB2 ASP 97 8.684 -8.389 9.916 740 H ASN 98 HN ASN 98 8.463 -5.861 12.336 741 HA ASN 98 HA ASN 98 10.072 -4.351 12.809 742 1HB ASN 98 HB1 ASN 98 11.476 -6.848 13.419 743 2HB ASN 98 HB2 ASN 98 12.545 -5.553 12.889 744 1HD2 ASN 98 HD21 ASN 98 9.896 -6.234 15.130 745 2HD2 ASN 98 HD22 ASN 98 10.453 -5.181 16.382 746 H SER 99 HN SER 99 10.539 -6.694 10.301 747 HA SER 99 HA SER 99 12.429 -5.122 8.809 748 1HB SER 99 HB2 SER 99 12.666 -7.026 7.661 749 2HB SER 99 HB1 SER 99 11.395 -7.753 8.645 750 HG SER 99 HG SER 99 11.119 -7.664 6.244 751 H GLU 100 HN GLU 100 8.978 -5.487 9.003 752 HA GLU 100 HA GLU 100 8.373 -3.954 6.657 753 1HB GLU 100 HB1 GLU 100 6.459 -4.313 8.924 754 2HB GLU 100 HB2 GLU 100 6.142 -4.261 7.197 755 1HG GLU 100 HG1 GLU 100 7.734 -6.457 7.406 756 2HG GLU 100 HG2 GLU 100 6.816 -6.521 8.911 757 H LEU 101 HN LEU 101 9.172 -3.291 9.928 758 HA LEU 101 HA LEU 101 8.101 -0.627 10.011 759 1HB LEU 101 HB1 LEU 101 8.358 -1.432 12.146 760 2HB LEU 101 HB2 LEU 101 9.814 -2.322 11.753 761 HG LEU 101 HG LEU 101 10.903 0.043 11.575 762 1HD1 LEU 101 HD11 LEU 101 9.185 1.554 11.763 763 2HD1 LEU 101 HD12 LEU 101 9.751 1.472 13.431 764 3HD1 LEU 101 HD13 LEU 101 8.310 0.578 12.943 765 1HD2 LEU 101 HD21 LEU 101 10.144 -1.320 14.146 766 2HD2 LEU 101 HD22 LEU 101 11.311 -0.002 14.049 767 3HD2 LEU 101 HD23 LEU 101 11.624 -1.520 13.208 768 H LEU 102 HN LEU 102 10.968 -2.173 8.886 769 HA LEU 102 HA LEU 102 12.499 0.289 8.704 770 1HB LEU 102 HB2 LEU 102 13.032 -2.579 8.516 771 2HB LEU 102 HB1 LEU 102 13.856 -1.651 7.274 772 HG LEU 102 HG LEU 102 14.732 -0.177 9.167 773 1HD1 LEU 102 HD21 LEU 102 14.573 -2.324 11.098 774 2HD1 LEU 102 HD22 LEU 102 12.978 -1.698 10.682 775 3HD1 LEU 102 HD23 LEU 102 14.222 -0.605 11.288 776 1HD2 LEU 102 HD11 LEU 102 16.455 -1.922 9.812 777 2HD2 LEU 102 HD12 LEU 102 16.253 -1.611 8.087 778 3HD2 LEU 102 HD13 LEU 102 15.537 -3.049 8.813 779 H HIS 103 HN HIS 103 11.070 -2.096 6.494 780 HA HIS 103 HA HIS 103 11.893 -0.845 4.120 781 1HB HIS 103 HB1 HIS 103 10.603 -3.183 4.788 782 2HB HIS 103 HB2 HIS 103 9.340 -2.273 3.969 783 HD2 HIS 103 HD2 HIS 103 10.914 -4.957 2.696 784 HE1 HIS 103 HE1 HIS 103 12.303 -2.056 -0.056 785 HE2 HIS 103 HE2 HIS 103 11.990 -4.536 0.371 786 H MET 104 HN MET 104 8.954 -0.518 6.064 787 HA MET 104 HA MET 104 7.437 1.051 4.356 788 1HB MET 104 HB2 MET 104 6.255 1.795 6.371 789 2HB MET 104 HB1 MET 104 6.589 0.068 6.460 790 1HG MET 104 HG1 MET 104 7.981 0.300 8.212 791 2HG MET 104 HG2 MET 104 8.621 1.834 7.630 792 1HE MET 104 HE1 MET 104 5.238 0.361 8.382 793 2HE MET 104 HE2 MET 104 4.624 1.920 7.830 794 3HE MET 104 HE3 MET 104 4.476 1.466 9.528 795 H LEU 105 HN LEU 105 10.096 1.943 6.464 796 HA LEU 105 HA LEU 105 9.671 4.781 6.026 797 1HB LEU 105 HB1 LEU 105 12.073 3.544 7.341 798 2HB LEU 105 HB2 LEU 105 11.418 5.153 7.568 799 HG LEU 105 HG LEU 105 10.062 2.614 8.472 800 1HD1 LEU 105 HD11 LEU 105 10.760 4.116 10.690 801 2HD1 LEU 105 HD12 LEU 105 12.187 4.187 9.655 802 3HD1 LEU 105 HD13 LEU 105 11.529 2.626 10.146 803 1HD2 LEU 105 HD21 LEU 105 9.457 5.505 9.066 804 2HD2 LEU 105 HD22 LEU 105 8.595 4.102 9.701 805 3HD2 LEU 105 HD23 LEU 105 8.539 4.465 7.976 806 H GLU 106 HN GLU 106 11.155 2.261 4.396 807 HA GLU 106 HA GLU 106 13.103 4.078 3.178 808 1HB GLU 106 HB1 GLU 106 14.565 2.343 2.970 809 2HB GLU 106 HB2 GLU 106 13.627 1.729 4.328 810 1HG GLU 106 HG2 GLU 106 12.309 0.357 2.830 811 2HG GLU 106 HG1 GLU 106 13.175 1.007 1.440 812 H SER 107 HN SER 107 10.119 2.678 2.493 813 HA SER 107 HA SER 107 10.541 3.215 -0.363 814 1HB SER 107 HB2 SER 107 10.576 0.665 0.458 815 2HB SER 107 HB1 SER 107 8.834 0.876 0.285 816 HG SER 107 HG SER 107 9.347 0.367 -1.719 817 HA PRO 108 HA PRO 108 6.741 5.463 0.217 818 1HB PRO 108 HB2 PRO 108 6.562 5.484 -2.715 819 2HB PRO 108 HB1 PRO 108 6.741 6.834 -1.594 820 1HG PRO 108 HG1 PRO 108 8.747 6.047 -3.205 821 2HG PRO 108 HG2 PRO 108 9.043 6.692 -1.579 822 1HD PRO 108 HD2 PRO 108 9.041 3.848 -2.518 823 2HD PRO 108 HD1 PRO 108 10.148 4.662 -1.393 824 H GLU 109 HN GLU 109 7.074 2.391 -0.917 825 HA GLU 109 HA GLU 109 4.157 2.054 -1.204 826 1HB GLU 109 HB2 GLU 109 6.314 0.541 -2.701 827 2HB GLU 109 HB1 GLU 109 4.584 0.251 -2.824 828 1HG GLU 109 HG1 GLU 109 4.417 2.684 -3.585 829 2HG GLU 109 HG2 GLU 109 6.166 2.599 -3.799 830 H SER 110 HN SER 110 6.977 1.269 0.448 831 HA SER 110 HA SER 110 6.212 -1.378 1.272 832 1HB SER 110 HB1 SER 110 8.439 0.464 1.815 833 2HB SER 110 HB2 SER 110 7.968 -0.537 3.189 834 HG SER 110 HG SER 110 9.193 -1.238 0.829 835 H LEU 111 HN LEU 111 6.169 1.861 2.654 836 HA LEU 111 HA LEU 111 5.060 1.415 5.123 837 1HB LEU 111 HB1 LEU 111 5.789 3.570 3.936 838 2HB LEU 111 HB2 LEU 111 4.171 3.617 3.265 839 HG LEU 111 HG LEU 111 4.141 5.101 5.073 840 1HD1 LEU 111 HD21 LEU 111 3.086 2.829 6.628 841 2HD1 LEU 111 HD22 LEU 111 2.397 3.088 5.025 842 3HD1 LEU 111 HD23 LEU 111 2.347 4.379 6.224 843 1HD2 LEU 111 HD11 LEU 111 6.297 4.149 6.026 844 2HD2 LEU 111 HD12 LEU 111 5.257 3.063 6.956 845 3HD2 LEU 111 HD13 LEU 111 5.118 4.808 7.163 846 H ARG 112 HN ARG 112 3.582 1.216 1.961 847 HA ARG 112 HA ARG 112 0.933 0.820 3.095 848 1HB ARG 112 HB1 ARG 112 1.964 1.072 0.273 849 2HB ARG 112 HB2 ARG 112 0.279 0.697 0.656 850 1HG ARG 112 HG2 ARG 112 -0.056 2.754 1.700 851 2HG ARG 112 HG1 ARG 112 1.680 3.050 1.827 852 1HD ARG 112 HD1 ARG 112 1.559 2.942 -0.796 853 2HD ARG 112 HD2 ARG 112 -0.144 3.307 -0.521 854 HE ARG 112 HE ARG 112 1.129 5.185 0.946 855 1HH1 ARG 112 HH22 ARG 112 1.394 4.156 -2.372 856 2HH1 ARG 112 HH21 ARG 112 1.868 5.718 -2.953 857 1HH2 ARG 112 HH12 ARG 112 1.755 7.245 0.190 858 2HH2 ARG 112 HH11 ARG 112 2.075 7.472 -1.498 859 H SER 113 HN SER 113 2.854 -0.925 0.651 860 HA SER 113 HA SER 113 1.427 -3.263 0.567 861 1HB SER 113 HB2 SER 113 3.386 -2.745 -0.880 862 2HB SER 113 HB1 SER 113 4.449 -3.065 0.491 863 HG SER 113 HG SER 113 3.000 -5.169 0.395 864 H LYS 114 HN LYS 114 3.566 -2.093 3.038 865 HA LYS 114 HA LYS 114 3.639 -4.616 4.469 866 1HB LYS 114 HB1 LYS 114 4.620 -1.872 5.268 867 2HB LYS 114 HB2 LYS 114 4.836 -3.337 6.217 868 1HG LYS 114 HG1 LYS 114 5.892 -2.951 3.428 869 2HG LYS 114 HG2 LYS 114 6.830 -2.681 4.898 870 1HD LYS 114 HD2 LYS 114 7.079 -4.892 5.305 871 2HD LYS 114 HD1 LYS 114 5.470 -5.291 4.699 872 1HE LYS 114 HE2 LYS 114 7.790 -4.532 2.933 873 2HE LYS 114 HE1 LYS 114 7.369 -6.197 3.336 874 1HZ LYS 114 HZ1 LYS 114 5.912 -4.271 1.661 875 2HZ LYS 114 HZ2 LYS 114 5.050 -5.490 2.457 876 3HZ LYS 114 HZ3 LYS 114 6.273 -5.897 1.361 877 H VAL 115 HN VAL 115 2.022 -1.461 4.718 878 HA VAL 115 HA VAL 115 0.766 -1.989 7.208 879 HB VAL 115 HB VAL 115 0.455 0.044 5.084 880 1HG1 VAL 115 HG11 VAL 115 -1.800 -0.095 5.104 881 2HG1 VAL 115 HG12 VAL 115 -1.622 0.796 6.617 882 3HG1 VAL 115 HG13 VAL 115 -1.839 -0.954 6.645 883 1HG2 VAL 115 HG21 VAL 115 1.786 0.766 6.816 884 2HG2 VAL 115 HG22 VAL 115 0.836 -0.078 8.039 885 3HG2 VAL 115 HG23 VAL 115 0.218 1.404 7.308 886 H ASP 116 HN ASP 116 -0.725 -1.938 3.947 887 HA ASP 116 HA ASP 116 -3.118 -3.119 4.551 888 1HB ASP 116 HB1 ASP 116 -2.461 -2.221 2.318 889 2HB ASP 116 HB2 ASP 116 -1.495 -3.669 2.054 890 H GLU 117 HN GLU 117 -0.024 -4.745 3.970 891 HA GLU 117 HA GLU 117 -1.129 -7.386 4.109 892 1HB GLU 117 HB1 GLU 117 1.612 -6.211 4.010 893 2HB GLU 117 HB2 GLU 117 1.445 -7.855 4.609 894 1HG GLU 117 HG1 GLU 117 1.793 -7.201 2.019 895 2HG GLU 117 HG2 GLU 117 1.037 -8.692 2.576 896 H ALA 118 HN ALA 118 0.303 -5.134 6.388 897 HA ALA 118 HA ALA 118 0.587 -6.949 8.543 898 1HB ALA 118 HB1 ALA 118 1.066 -5.127 9.888 899 2HB ALA 118 HB2 ALA 118 0.034 -4.039 8.956 900 3HB ALA 118 HB3 ALA 118 1.575 -4.579 8.289 901 H VAL 119 HN VAL 119 -2.077 -5.249 7.154 902 HA VAL 119 HA VAL 119 -3.874 -5.344 9.334 903 HB VAL 119 HB VAL 119 -4.667 -5.557 6.453 904 1HG1 VAL 119 HG11 VAL 119 -6.423 -5.917 8.081 905 2HG1 VAL 119 HG12 VAL 119 -6.659 -4.360 7.281 906 3HG1 VAL 119 HG13 VAL 119 -5.992 -4.419 8.911 907 1HG2 VAL 119 HG21 VAL 119 -3.376 -3.357 7.890 908 2HG2 VAL 119 HG22 VAL 119 -4.847 -2.916 7.022 909 3HG2 VAL 119 HG23 VAL 119 -3.504 -3.666 6.158 910 H ALA 120 HN ALA 120 -3.271 -7.491 6.604 911 HA ALA 120 HA ALA 120 -5.186 -9.434 7.180 912 1HB ALA 120 HB1 ALA 120 -3.233 -9.074 5.278 913 2HB ALA 120 HB2 ALA 120 -4.257 -10.507 5.434 914 3HB ALA 120 HB3 ALA 120 -2.651 -10.486 6.169 915 H VAL 121 HN VAL 121 -2.193 -8.619 8.630 916 HA VAL 121 HA VAL 121 -1.965 -11.055 10.188 917 HB VAL 121 HB VAL 121 -0.320 -8.573 9.858 918 1HG1 VAL 121 HG21 VAL 121 -0.600 -9.974 12.330 919 2HG1 VAL 121 HG22 VAL 121 0.415 -8.584 11.941 920 3HG1 VAL 121 HG23 VAL 121 1.025 -10.221 11.692 921 1HG2 VAL 121 HG11 VAL 121 -0.164 -10.699 8.433 922 2HG2 VAL 121 HG12 VAL 121 0.609 -11.421 9.847 923 3HG2 VAL 121 HG13 VAL 121 1.332 -10.012 9.070 924 H LEU 122 HN LEU 122 -2.985 -7.726 10.514 925 HA LEU 122 HA LEU 122 -3.230 -7.660 13.340 926 1HB LEU 122 HB2 LEU 122 -3.453 -5.517 12.788 927 2HB LEU 122 HB1 LEU 122 -3.775 -5.923 11.117 928 HG LEU 122 HG LEU 122 -6.195 -6.459 12.158 929 1HD1 LEU 122 HD11 LEU 122 -4.940 -5.412 14.345 930 2HD1 LEU 122 HD12 LEU 122 -6.685 -5.443 14.086 931 3HD1 LEU 122 HD13 LEU 122 -5.755 -4.003 13.668 932 1HD2 LEU 122 HD21 LEU 122 -5.020 -4.445 10.594 933 2HD2 LEU 122 HD22 LEU 122 -6.063 -3.632 11.760 934 3HD2 LEU 122 HD23 LEU 122 -6.726 -4.877 10.702 935 H GLN 123 HN GLN 123 -5.235 -8.701 10.701 936 HA GLN 123 HA GLN 123 -7.573 -9.169 12.319 937 1HB GLN 123 HB1 GLN 123 -6.860 -9.909 9.474 938 2HB GLN 123 HB2 GLN 123 -8.410 -10.287 10.218 939 1HG GLN 123 HG2 GLN 123 -7.839 -7.515 10.584 940 2HG GLN 123 HG1 GLN 123 -7.629 -7.932 8.885 941 1HE2 GLN 123 HE21 GLN 123 -9.440 -9.362 8.015 942 2HE2 GLN 123 HE22 GLN 123 -11.046 -8.889 8.441 943 H ALA 124 HN ALA 124 -4.722 -10.833 11.350 944 HA ALA 124 HA ALA 124 -5.719 -13.470 12.111 945 1HB ALA 124 HB1 ALA 124 -2.856 -13.235 11.658 946 2HB ALA 124 HB2 ALA 124 -3.813 -12.621 10.311 947 3HB ALA 124 HB3 ALA 124 -4.046 -14.276 10.875 948 H HIS 125 HN HIS 125 -4.915 -10.889 13.823 949 HA HIS 125 HA HIS 125 -3.739 -12.543 15.944 950 1HB HIS 125 HB1 HIS 125 -2.310 -10.581 14.750 951 2HB HIS 125 HB2 HIS 125 -3.127 -9.633 15.989 952 HD2 HIS 125 HD2 HIS 125 -2.902 -11.708 18.479 953 HE1 HIS 125 HE1 HIS 125 1.243 -11.552 17.639 954 HE2 HIS 125 HE2 HIS 125 -0.507 -12.160 19.371 955 H GLN 126 HN GLN 126 -5.948 -10.090 14.940 956 HA GLN 126 HA GLN 126 -6.896 -9.571 17.647 957 1HB GLN 126 HB1 GLN 126 -7.325 -8.364 14.974 958 2HB GLN 126 HB2 GLN 126 -8.692 -8.304 16.079 959 1HG GLN 126 HG1 GLN 126 -6.355 -7.528 17.498 960 2HG GLN 126 HG2 GLN 126 -6.425 -6.622 15.986 961 1HE2 GLN 126 HE22 GLN 126 -8.993 -7.816 18.109 962 2HE2 GLN 126 HE21 GLN 126 -9.702 -6.270 18.412 963 H ALA 127 HN ALA 127 -7.898 -11.191 14.688 964 HA ALA 127 HA ALA 127 -10.357 -12.123 15.964 965 1HB ALA 127 HB1 ALA 127 -9.499 -11.684 13.225 966 2HB ALA 127 HB2 ALA 127 -11.124 -11.763 13.904 967 3HB ALA 127 HB3 ALA 127 -10.285 -13.246 13.449 968 H LYS 128 HN LYS 128 -7.534 -13.504 14.252 969 HA LYS 128 HA LYS 128 -8.161 -16.099 15.413 970 1HB LYS 128 HB2 LYS 128 -7.116 -17.058 13.649 971 2HB LYS 128 HB1 LYS 128 -7.384 -15.494 12.895 972 1HG LYS 128 HG1 LYS 128 -5.196 -14.940 12.964 973 2HG LYS 128 HG2 LYS 128 -4.889 -15.861 14.435 974 1HD LYS 128 HD2 LYS 128 -3.783 -17.136 12.881 975 2HD LYS 128 HD1 LYS 128 -5.364 -17.919 12.896 976 1HE LYS 128 HE2 LYS 128 -5.736 -17.403 10.760 977 2HE LYS 128 HE1 LYS 128 -5.276 -15.721 11.016 978 1HZ LYS 128 HZ1 LYS 128 -3.834 -16.804 9.408 979 2HZ LYS 128 HZ2 LYS 128 -3.393 -17.970 10.551 980 3HZ LYS 128 HZ3 LYS 128 -2.958 -16.352 10.783 981 H GLU 129 HN GLU 129 -6.234 -17.379 16.022 982 HA GLU 129 HA GLU 129 -4.674 -15.898 17.997 983 1HB GLU 129 HB2 GLU 129 -5.674 -18.638 17.767 984 2HB GLU 129 HB1 GLU 129 -3.985 -18.566 18.250 985 1HG GLU 129 HG2 GLU 129 -4.450 -17.564 20.247 986 2HG GLU 129 HG1 GLU 129 -5.930 -16.813 19.651 987 H ALA 130 HN ALA 130 -3.251 -14.879 16.521 988 HA ALA 130 HA ALA 130 -1.888 -16.129 14.466 989 1HB ALA 130 HB1 ALA 130 -1.859 -13.761 14.560 990 2HB ALA 130 HB2 ALA 130 -0.186 -14.280 14.759 991 3HB ALA 130 HB3 ALA 130 -1.121 -13.759 16.161 992 H ALA 131 HN ALA 131 -0.509 -15.316 17.663 993 HA ALA 131 HA ALA 131 1.647 -17.213 17.257 994 1HB ALA 131 HB1 ALA 131 1.080 -15.010 19.136 995 2HB ALA 131 HB2 ALA 131 2.584 -15.465 18.336 996 3HB ALA 131 HB3 ALA 131 2.044 -16.344 19.766 997 H GLN 132 HN GLN 132 2.087 -18.986 18.607 998 HA GLN 132 HA GLN 132 -0.311 -20.155 19.813 999 1HB GLN 132 HB2 GLN 132 2.288 -21.595 19.332 1000 2HB GLN 132 HB1 GLN 132 0.675 -22.276 19.499 1001 1HG GLN 132 HG2 GLN 132 0.359 -20.685 17.322 1002 2HG GLN 132 HG1 GLN 132 2.036 -21.200 17.143 1003 1HE2 GLN 132 HE22 GLN 132 2.068 -23.711 18.030 1004 2HE2 GLN 132 HE21 GLN 132 1.025 -24.720 17.092 1005 H LYS 133 HN LYS 133 0.574 -18.237 21.416 1006 HA LYS 133 HA LYS 133 2.580 -19.010 23.265 1007 1HB LYS 133 HB2 LYS 133 1.834 -16.666 22.915 1008 2HB LYS 133 HB1 LYS 133 0.297 -17.068 23.669 1009 1HG LYS 133 HG1 LYS 133 1.161 -16.570 25.641 1010 2HG LYS 133 HG2 LYS 133 2.318 -17.889 25.453 1011 1HD LYS 133 HD2 LYS 133 4.011 -16.484 25.054 1012 2HD LYS 133 HD1 LYS 133 3.051 -15.516 23.933 1013 1HE LYS 133 HE1 LYS 133 3.492 -14.012 25.633 1014 2HE LYS 133 HE2 LYS 133 1.898 -14.623 26.070 1015 1HZ LYS 133 HZ1 LYS 133 3.820 -14.494 27.819 1016 2HZ LYS 133 HZ2 LYS 133 4.252 -15.988 27.154 1017 3HZ LYS 133 HZ3 LYS 133 2.719 -15.778 27.836 1018 H ALA 134 HN ALA 134 -0.977 -19.065 23.444 1019 HA ALA 134 HA ALA 134 -0.857 -20.635 25.893 1020 1HB ALA 134 HB1 ALA 134 -3.522 -20.417 25.089 1021 2HB ALA 134 HB2 ALA 134 -2.774 -18.876 24.668 1022 3HB ALA 134 HB3 ALA 134 -2.696 -19.471 26.327 1023 H VAL 135 HN VAL 135 0.177 -22.456 24.759 1024 HA VAL 135 HA VAL 135 -1.598 -23.998 23.022 1025 HB VAL 135 HB VAL 135 0.757 -23.729 22.337 1026 1HG1 VAL 135 HG21 VAL 135 1.633 -23.740 24.707 1027 2HG1 VAL 135 HG22 VAL 135 2.566 -24.668 23.533 1028 3HG1 VAL 135 HG23 VAL 135 1.489 -25.498 24.657 1029 1HG2 VAL 135 HG11 VAL 135 -0.371 -25.628 21.469 1030 2HG2 VAL 135 HG12 VAL 135 -0.181 -26.515 22.982 1031 3HG2 VAL 135 HG13 VAL 135 1.227 -26.173 21.976 1032 H ASN 136 HN ASN 136 -2.279 -26.088 23.498 1033 HA ASN 136 HA ASN 136 -2.902 -26.631 26.187 1034 1HB ASN 136 HB1 ASN 136 -2.854 -28.815 24.137 1035 2HB ASN 136 HB2 ASN 136 -4.038 -28.500 25.402 1036 1HD2 ASN 136 HD21 ASN 136 -5.157 -26.302 25.119 1037 2HD2 ASN 136 HD22 ASN 136 -5.720 -25.957 23.523 1038 H SER 137 HN SER 137 -2.080 -28.094 27.658 1039 HA SER 137 HA SER 137 0.712 -28.813 27.245 1040 1HB SER 137 HB2 SER 137 -0.842 -29.289 29.780 1041 2HB SER 137 HB1 SER 137 0.888 -29.008 29.582 1042 HG SER 137 HG SER 137 0.507 -26.965 29.805 1043 H ALA 138 HN ALA 138 -0.334 -30.390 25.578 1044 HA ALA 138 HA ALA 138 -1.521 -32.777 26.595 1045 1HB ALA 138 HB1 ALA 138 -0.314 -32.078 23.930 1046 2HB ALA 138 HB2 ALA 138 -2.021 -32.198 24.355 1047 3HB ALA 138 HB3 ALA 138 -1.026 -33.652 24.282 1048 H THR 139 HN THR 139 -0.559 -34.934 26.374 1049 HA THR 139 HA THR 139 2.237 -34.901 27.252 1050 HB THR 139 HB THR 139 0.721 -36.004 28.780 1051 HG1 THR 139 HG1 THR 139 1.742 -37.998 28.881 1052 1HG2 THR 139 HG21 THR 139 -0.704 -37.770 28.285 1053 2HG2 THR 139 HG22 THR 139 0.031 -38.043 26.706 1054 3HG2 THR 139 HG23 THR 139 -0.970 -36.616 26.977 1055 H GLY 140 HN GLY 140 0.220 -35.835 24.631 1056 1HA GLY 140 HA2 GLY 140 2.100 -37.753 23.538 1057 2HA GLY 140 HA1 GLY 140 0.601 -37.218 22.794 1058 H VAL 141 HN VAL 141 2.623 -37.467 21.118 1059 HA VAL 141 HA VAL 141 4.235 -35.111 20.893 1060 HB VAL 141 HB VAL 141 5.105 -37.167 20.001 1061 1HG1 VAL 141 HG21 VAL 141 3.720 -38.654 19.104 1062 2HG1 VAL 141 HG22 VAL 141 3.663 -37.649 17.655 1063 3HG1 VAL 141 HG23 VAL 141 2.453 -37.441 18.922 1064 1HG2 VAL 141 HG11 VAL 141 5.043 -34.762 18.620 1065 2HG2 VAL 141 HG12 VAL 141 4.707 -35.982 17.392 1066 3HG2 VAL 141 HG13 VAL 141 6.170 -36.095 18.369 1067 HA PRO 142 HA PRO 142 1.040 -32.703 18.895 1068 1HB PRO 142 HB2 PRO 142 2.467 -30.451 18.526 1069 2HB PRO 142 HB1 PRO 142 1.888 -30.941 20.122 1070 1HG PRO 142 HG2 PRO 142 4.609 -31.261 18.910 1071 2HG PRO 142 HG1 PRO 142 4.169 -30.752 20.550 1072 1HD PRO 142 HD2 PRO 142 4.961 -33.288 19.926 1073 2HD PRO 142 HD1 PRO 142 3.864 -32.912 21.270 1074 H THR 143 HN THR 143 0.443 -32.321 16.819 1075 HA THR 143 HA THR 143 2.250 -33.193 14.729 1076 HB THR 143 HB THR 143 -0.145 -32.255 13.581 1077 HG1 THR 143 HG1 THR 143 -1.709 -33.237 14.861 1078 1HG2 THR 143 HG21 THR 143 -0.708 -34.719 13.468 1079 2HG2 THR 143 HG22 THR 143 0.825 -34.996 14.295 1080 3HG2 THR 143 HG23 THR 143 0.804 -34.208 12.718 1081 H VAL 144 HN VAL 144 1.280 -30.254 16.139 1082 HA VAL 144 HA VAL 144 2.946 -28.731 14.396 1083 HB VAL 144 HB VAL 144 0.942 -28.892 12.967 1084 1HG1 VAL 144 HG11 VAL 144 -0.602 -28.961 15.039 1085 2HG1 VAL 144 HG12 VAL 144 -1.167 -28.143 13.582 1086 3HG1 VAL 144 HG13 VAL 144 -0.547 -27.201 14.937 1087 1HG2 VAL 144 HG21 VAL 144 1.964 -26.977 12.352 1088 2HG2 VAL 144 HG22 VAL 144 2.025 -26.353 14.001 1089 3HG2 VAL 144 HG23 VAL 144 0.534 -26.232 13.066 Start of MODEL 17 1 1H GLY 1 HT1 GLY 1 -29.312 13.135 19.159 2 2H GLY 1 HT2 GLY 1 -28.779 14.705 18.819 3 3H GLY 1 HT3 GLY 1 -29.374 14.327 20.357 4 1HA GLY 1 HA1 GLY 1 -27.051 14.398 20.594 5 2HA GLY 1 HA2 GLY 1 -27.507 12.701 20.593 6 HA PRO 2 HA PRO 2 -24.354 13.876 17.155 7 1HB PRO 2 HB2 PRO 2 -22.103 12.847 18.313 8 2HB PRO 2 HB1 PRO 2 -22.578 14.545 18.432 9 1HG PRO 2 HG2 PRO 2 -22.961 12.325 20.402 10 2HG PRO 2 HG1 PRO 2 -22.469 14.005 20.689 11 1HD PRO 2 HD1 PRO 2 -24.989 13.151 21.133 12 2HD PRO 2 HD2 PRO 2 -24.636 14.794 20.561 13 H LEU 3 HN LEU 3 -23.187 11.152 19.085 14 HA LEU 3 HA LEU 3 -23.726 9.387 16.809 15 1HB LEU 3 HB2 LEU 3 -21.563 9.661 18.644 16 2HB LEU 3 HB1 LEU 3 -22.262 8.070 18.869 17 HG LEU 3 HG LEU 3 -20.407 8.015 17.278 18 1HD1 LEU 3 HD11 LEU 3 -22.263 6.429 17.029 19 2HD1 LEU 3 HD12 LEU 3 -21.518 6.829 15.481 20 3HD1 LEU 3 HD13 LEU 3 -23.062 7.553 15.929 21 1HD2 LEU 3 HD21 LEU 3 -20.847 10.391 16.475 22 2HD2 LEU 3 HD22 LEU 3 -22.056 9.682 15.405 23 3HD2 LEU 3 HD23 LEU 3 -20.364 9.207 15.261 24 H GLY 4 HN GLY 4 -25.213 10.284 19.587 25 1HA GLY 4 HA2 GLY 4 -26.138 7.611 20.332 26 2HA GLY 4 HA1 GLY 4 -26.468 9.101 21.203 27 H SER 5 HN SER 5 -28.400 7.132 20.543 28 HA SER 5 HA SER 5 -29.931 8.231 18.325 29 1HB SER 5 HB2 SER 5 -31.557 6.333 19.355 30 2HB SER 5 HB1 SER 5 -30.267 5.978 18.206 31 HG SER 5 HG SER 5 -28.913 5.584 20.065 32 H ALA 6 HN ALA 6 -32.239 8.732 18.623 33 HA ALA 6 HA ALA 6 -32.614 10.287 21.074 34 1HB ALA 6 HB1 ALA 6 -32.927 11.591 19.127 35 2HB ALA 6 HB2 ALA 6 -34.536 11.292 19.786 36 3HB ALA 6 HB3 ALA 6 -33.969 10.374 18.391 37 H ALA 7 HN ALA 7 -33.095 8.444 22.403 38 HA ALA 7 HA ALA 7 -35.906 7.878 22.504 39 1HB ALA 7 HB1 ALA 7 -35.778 6.074 21.162 40 2HB ALA 7 HB2 ALA 7 -35.157 5.289 22.613 41 3HB ALA 7 HB3 ALA 7 -34.039 5.895 21.392 42 H ALA 8 HN ALA 8 -32.766 6.621 23.633 43 HA ALA 8 HA ALA 8 -33.767 6.083 26.267 44 1HB ALA 8 HB1 ALA 8 -31.742 5.102 26.696 45 2HB ALA 8 HB2 ALA 8 -30.849 6.254 25.703 46 3HB ALA 8 HB3 ALA 8 -31.792 4.975 24.938 47 H ALA 9 HN ALA 9 -31.836 8.617 24.755 48 HA ALA 9 HA ALA 9 -32.533 10.485 26.812 49 1HB ALA 9 HB1 ALA 9 -29.586 10.155 26.589 50 2HB ALA 9 HB2 ALA 9 -30.483 9.031 27.611 51 3HB ALA 9 HB3 ALA 9 -30.558 10.764 27.928 52 H THR 10 HN THR 10 -31.377 12.629 26.426 53 HA THR 10 HA THR 10 -31.036 14.395 25.037 54 HB THR 10 HB THR 10 -29.642 12.432 23.216 55 HG1 THR 10 HG1 THR 10 -28.123 13.765 25.068 56 1HG2 THR 10 HG21 THR 10 -29.692 14.567 22.214 57 2HG2 THR 10 HG22 THR 10 -28.082 14.363 22.906 58 3HG2 THR 10 HG23 THR 10 -29.276 15.364 23.731 59 HA PRO 11 HA PRO 11 -34.690 13.414 22.428 60 1HB PRO 11 HB1 PRO 11 -35.629 15.991 22.516 61 2HB PRO 11 HB2 PRO 11 -36.020 14.753 23.713 62 1HG PRO 11 HG2 PRO 11 -33.972 16.932 23.838 63 2HG PRO 11 HG1 PRO 11 -35.081 16.364 25.100 64 1HD PRO 11 HD2 PRO 11 -32.496 15.638 25.066 65 2HD PRO 11 HD1 PRO 11 -33.768 14.520 25.597 66 H ALA 12 HN ALA 12 -35.212 14.023 20.300 67 HA ALA 12 HA ALA 12 -32.994 15.186 18.832 68 1HB ALA 12 HB1 ALA 12 -34.049 14.344 16.863 69 2HB ALA 12 HB2 ALA 12 -35.560 14.063 17.727 70 3HB ALA 12 HB3 ALA 12 -34.137 13.090 18.101 71 H VAL 13 HN VAL 13 -34.520 16.965 20.505 72 HA VAL 13 HA VAL 13 -35.990 18.607 18.571 73 HB VAL 13 HB VAL 13 -35.777 19.151 21.524 74 1HG1 VAL 13 HG21 VAL 13 -36.804 20.999 20.745 75 2HG1 VAL 13 HG22 VAL 13 -38.230 19.962 20.742 76 3HG1 VAL 13 HG23 VAL 13 -37.318 20.212 19.253 77 1HG2 VAL 13 HG11 VAL 13 -37.383 17.649 22.063 78 2HG2 VAL 13 HG12 VAL 13 -36.725 16.796 20.667 79 3HG2 VAL 13 HG13 VAL 13 -38.181 17.775 20.496 80 H ARG 14 HN ARG 14 -35.474 20.770 18.205 81 HA ARG 14 HA ARG 14 -32.677 21.436 18.739 82 1HB ARG 14 HB1 ARG 14 -34.683 22.238 16.684 83 2HB ARG 14 HB2 ARG 14 -33.413 23.387 17.082 84 1HG ARG 14 HG2 ARG 14 -31.753 21.564 16.617 85 2HG ARG 14 HG1 ARG 14 -33.095 20.603 15.993 86 1HD ARG 14 HD1 ARG 14 -33.471 22.067 14.212 87 2HD ARG 14 HD2 ARG 14 -32.560 23.370 14.973 88 HE ARG 14 HE ARG 14 -31.470 21.089 13.520 89 1HH1 ARG 14 HH11 ARG 14 -30.902 23.951 15.429 90 2HH1 ARG 14 HH12 ARG 14 -29.241 24.091 14.956 91 1HH2 ARG 14 HH21 ARG 14 -29.285 21.269 12.895 92 2HH2 ARG 14 HH22 ARG 14 -28.323 22.568 13.516 93 H THR 15 HN THR 15 -32.265 22.633 20.464 94 HA THR 15 HA THR 15 -34.311 24.442 21.502 95 HB THR 15 HB THR 15 -31.726 24.164 22.920 96 HG1 THR 15 HG1 THR 15 -32.144 22.102 23.603 97 1HG2 THR 15 HG21 THR 15 -33.685 23.477 24.665 98 2HG2 THR 15 HG22 THR 15 -34.536 24.581 23.585 99 3HG2 THR 15 HG23 THR 15 -33.073 25.112 24.416 100 H VAL 16 HN VAL 16 -34.050 26.630 21.688 101 HA VAL 16 HA VAL 16 -31.962 27.803 20.028 102 HB VAL 16 HB VAL 16 -33.245 29.952 20.477 103 1HG1 VAL 16 HG21 VAL 16 -35.120 29.278 18.943 104 2HG1 VAL 16 HG22 VAL 16 -34.534 27.620 19.075 105 3HG1 VAL 16 HG23 VAL 16 -33.500 28.868 18.379 106 1HG2 VAL 16 HG11 VAL 16 -35.636 28.398 21.193 107 2HG2 VAL 16 HG12 VAL 16 -35.119 29.999 21.723 108 3HG2 VAL 16 HG13 VAL 16 -34.431 28.557 22.471 109 HA PRO 17 HA PRO 17 -29.336 28.962 23.399 110 1HB PRO 17 HB2 PRO 17 -28.733 31.382 21.797 111 2HB PRO 17 HB1 PRO 17 -27.640 30.142 22.420 112 1HG PRO 17 HG1 PRO 17 -28.245 30.260 19.823 113 2HG PRO 17 HG2 PRO 17 -28.050 28.704 20.651 114 1HD PRO 17 HD1 PRO 17 -30.559 30.126 19.850 115 2HD PRO 17 HD2 PRO 17 -30.175 28.393 19.785 116 H GLN 18 HN GLN 18 -30.811 31.843 21.887 117 HA GLN 18 HA GLN 18 -31.180 33.041 24.510 118 1HB GLN 18 HB2 GLN 18 -31.462 34.020 21.685 119 2HB GLN 18 HB1 GLN 18 -32.156 34.935 23.016 120 1HG GLN 18 HG1 GLN 18 -29.473 34.253 23.676 121 2HG GLN 18 HG2 GLN 18 -29.504 34.961 22.062 122 1HE2 GLN 18 HE21 GLN 18 -29.601 35.557 25.382 123 2HE2 GLN 18 HE22 GLN 18 -29.943 37.250 25.320 124 H TYR 19 HN TYR 19 -33.202 33.790 25.286 125 HA TYR 19 HA TYR 19 -35.358 31.979 24.768 126 1HB TYR 19 HB2 TYR 19 -36.579 33.544 26.409 127 2HB TYR 19 HB1 TYR 19 -35.194 32.642 27.015 128 HD1 TYR 19 HD1 TYR 19 -36.384 35.967 25.970 129 HD2 TYR 19 HD2 TYR 19 -33.206 33.760 27.738 130 HE1 TYR 19 HE1 TYR 19 -35.350 38.068 26.718 131 HE2 TYR 19 HE2 TYR 19 -32.162 35.854 28.490 132 HH TYR 19 HH TYR 19 -33.776 38.825 28.473 133 H LYS 20 HN LYS 20 -34.387 34.966 23.465 134 HA LYS 20 HA LYS 20 -36.976 35.928 22.710 135 1HB LYS 20 HB1 LYS 20 -34.983 37.399 22.987 136 2HB LYS 20 HB2 LYS 20 -34.275 36.656 21.560 137 1HG LYS 20 HG1 LYS 20 -36.813 37.479 20.759 138 2HG LYS 20 HG2 LYS 20 -36.188 38.795 21.755 139 1HD LYS 20 HD1 LYS 20 -34.300 37.631 19.809 140 2HD LYS 20 HD2 LYS 20 -35.657 38.532 19.130 141 1HE LYS 20 HE2 LYS 20 -33.647 39.530 21.142 142 2HE LYS 20 HE1 LYS 20 -33.781 40.016 19.453 143 1HZ LYS 20 HZ1 LYS 20 -35.274 41.535 20.004 144 2HZ LYS 20 HZ2 LYS 20 -35.033 41.165 21.637 145 3HZ LYS 20 HZ3 LYS 20 -36.255 40.387 20.764 146 H TYR 21 HN TYR 21 -38.210 35.163 21.137 147 HA TYR 21 HA TYR 21 -37.339 33.119 19.372 148 1HB TYR 21 HB1 TYR 21 -39.855 34.684 19.747 149 2HB TYR 21 HB2 TYR 21 -39.646 33.785 18.248 150 HD1 TYR 21 HD1 TYR 21 -40.030 31.471 18.171 151 HD2 TYR 21 HD2 TYR 21 -39.693 33.413 21.941 152 HE1 TYR 21 HE1 TYR 21 -40.779 29.414 19.290 153 HE2 TYR 21 HE2 TYR 21 -40.441 31.360 23.071 154 HH TYR 21 HH TYR 21 -40.500 28.930 22.626 155 H ALA 22 HN ALA 22 -36.393 33.257 17.448 156 HA ALA 22 HA ALA 22 -35.777 35.823 16.316 157 1HB ALA 22 HB1 ALA 22 -34.012 34.656 15.649 158 2HB ALA 22 HB2 ALA 22 -35.050 33.837 14.483 159 3HB ALA 22 HB3 ALA 22 -34.794 33.136 16.081 160 H ALA 23 HN ALA 23 -35.818 35.230 13.571 161 HA ALA 23 HA ALA 23 -38.396 36.066 12.855 162 1HB ALA 23 HB1 ALA 23 -37.019 34.738 10.684 163 2HB ALA 23 HB2 ALA 23 -35.949 35.817 11.578 164 3HB ALA 23 HB3 ALA 23 -37.444 36.439 10.879 165 H GLY 24 HN GLY 24 -40.079 34.782 13.435 166 1HA GLY 24 HA1 GLY 24 -39.988 31.920 12.971 167 2HA GLY 24 HA2 GLY 24 -41.307 32.818 13.706 168 H VAL 25 HN VAL 25 -40.353 34.322 10.877 169 HA VAL 25 HA VAL 25 -42.704 33.300 9.488 170 HB VAL 25 HB VAL 25 -40.865 35.539 8.637 171 1HG1 VAL 25 HG21 VAL 25 -43.529 35.853 7.729 172 2HG1 VAL 25 HG22 VAL 25 -43.023 34.206 7.349 173 3HG1 VAL 25 HG23 VAL 25 -42.071 35.575 6.776 174 1HG2 VAL 25 HG11 VAL 25 -43.533 35.879 9.975 175 2HG2 VAL 25 HG12 VAL 25 -42.277 37.086 9.694 176 3HG2 VAL 25 HG13 VAL 25 -42.027 35.815 10.892 177 H ARG 26 HN ARG 26 -39.206 33.589 9.028 178 HA ARG 26 HA ARG 26 -39.185 32.395 6.443 179 1HB ARG 26 HB2 ARG 26 -36.928 32.624 8.444 180 2HB ARG 26 HB1 ARG 26 -36.761 32.289 6.726 181 1HG ARG 26 HG2 ARG 26 -37.500 34.475 6.147 182 2HG ARG 26 HG1 ARG 26 -37.966 34.820 7.814 183 1HD ARG 26 HD2 ARG 26 -35.443 34.288 8.294 184 2HD ARG 26 HD1 ARG 26 -35.253 34.684 6.587 185 HE ARG 26 HE ARG 26 -36.641 36.597 8.307 186 1HH1 ARG 26 HH11 ARG 26 -33.808 35.715 6.477 187 2HH1 ARG 26 HH12 ARG 26 -33.159 37.321 6.465 188 1HH2 ARG 26 HH21 ARG 26 -35.793 38.714 8.295 189 2HH2 ARG 26 HH22 ARG 26 -34.287 39.026 7.498 190 H ASN 27 HN ASN 27 -40.036 30.399 6.264 191 HA ASN 27 HA ASN 27 -39.687 28.391 8.277 192 1HB ASN 27 HB2 ASN 27 -40.874 28.309 5.501 193 2HB ASN 27 HB1 ASN 27 -40.799 26.899 6.557 194 1HD2 ASN 27 HD21 ASN 27 -42.762 29.259 5.517 195 2HD2 ASN 27 HD22 ASN 27 -43.839 29.381 6.861 196 HA PRO 28 HA PRO 28 -36.724 26.380 5.090 197 1HB PRO 28 HB2 PRO 28 -35.923 27.750 2.921 198 2HB PRO 28 HB1 PRO 28 -37.438 26.840 2.943 199 1HG PRO 28 HG2 PRO 28 -36.985 29.779 3.292 200 2HG PRO 28 HG1 PRO 28 -38.240 28.943 2.359 201 1HD PRO 28 HD1 PRO 28 -38.647 29.986 4.855 202 2HD PRO 28 HD2 PRO 28 -39.561 28.615 4.202 203 H GLN 29 HN GLN 29 -35.174 26.567 6.674 204 HA GLN 29 HA GLN 29 -33.562 28.984 6.836 205 1HB GLN 29 HB2 GLN 29 -34.222 26.798 8.613 206 2HB GLN 29 HB1 GLN 29 -32.483 27.043 8.547 207 1HG GLN 29 HG2 GLN 29 -33.333 29.593 8.812 208 2HG GLN 29 HG1 GLN 29 -34.589 28.731 9.698 209 1HE2 GLN 29 HE21 GLN 29 -31.058 28.785 9.362 210 2HE2 GLN 29 HE22 GLN 29 -30.723 28.574 11.044 211 H GLN 30 HN GLN 30 -32.590 25.565 6.960 212 HA GLN 30 HA GLN 30 -30.268 26.233 5.301 213 1HB GLN 30 HB1 GLN 30 -30.335 24.888 7.629 214 2HB GLN 30 HB2 GLN 30 -30.539 23.539 6.520 215 1HG GLN 30 HG2 GLN 30 -28.457 23.850 5.554 216 2HG GLN 30 HG1 GLN 30 -28.339 25.519 6.110 217 1HE2 GLN 30 HE21 GLN 30 -27.077 22.579 6.537 218 2HE2 GLN 30 HE22 GLN 30 -26.585 22.680 8.190 219 H HIS 31 HN HIS 31 -33.276 24.634 5.196 220 HA HIS 31 HA HIS 31 -34.342 23.363 3.642 221 1HB HIS 31 HB1 HIS 31 -33.202 25.426 2.306 222 2HB HIS 31 HB2 HIS 31 -32.461 24.067 1.468 223 HD2 HIS 31 HD2 HIS 31 -36.221 24.570 2.591 224 HE1 HIS 31 HE1 HIS 31 -36.022 23.588 -1.521 225 HE2 HIS 31 HE2 HIS 31 -37.569 24.086 0.427 226 H LEU 32 HN LEU 32 -32.394 22.014 5.143 227 HA LEU 32 HA LEU 32 -30.875 20.341 3.333 228 1HB LEU 32 HB1 LEU 32 -30.568 21.109 5.971 229 2HB LEU 32 HB2 LEU 32 -31.080 19.438 6.102 230 HG LEU 32 HG LEU 32 -28.652 19.601 6.105 231 1HD1 LEU 32 HD11 LEU 32 -29.646 17.614 5.128 232 2HD1 LEU 32 HD12 LEU 32 -28.163 18.043 4.276 233 3HD1 LEU 32 HD13 LEU 32 -29.731 18.408 3.556 234 1HD2 LEU 32 HD21 LEU 32 -27.379 20.560 4.396 235 2HD2 LEU 32 HD22 LEU 32 -28.674 21.722 4.682 236 3HD2 LEU 32 HD23 LEU 32 -28.753 20.638 3.293 237 H ASN 33 HN ASN 33 -32.384 19.236 2.114 238 HA ASN 33 HA ASN 33 -34.406 17.642 3.477 239 1HB ASN 33 HB1 ASN 33 -33.838 17.972 0.521 240 2HB ASN 33 HB2 ASN 33 -35.221 17.128 1.213 241 1HD2 ASN 33 HD22 ASN 33 -36.417 18.552 2.892 242 2HD2 ASN 33 HD21 ASN 33 -36.776 20.156 2.359 243 H ALA 34 HN ALA 34 -34.696 15.397 2.154 244 HA ALA 34 HA ALA 34 -32.422 13.836 2.944 245 1HB ALA 34 HB1 ALA 34 -33.814 11.931 2.025 246 2HB ALA 34 HB2 ALA 34 -35.062 13.132 1.693 247 3HB ALA 34 HB3 ALA 34 -34.526 12.853 3.350 248 H GLN 35 HN GLN 35 -32.988 15.635 0.259 249 HA GLN 35 HA GLN 35 -31.983 13.816 -1.738 250 1HB GLN 35 HB1 GLN 35 -32.849 16.673 -1.683 251 2HB GLN 35 HB2 GLN 35 -31.820 16.138 -3.004 252 1HG GLN 35 HG1 GLN 35 -33.419 14.578 -3.751 253 2HG GLN 35 HG2 GLN 35 -34.365 14.728 -2.272 254 1HE2 GLN 35 HE21 GLN 35 -35.999 16.116 -2.244 255 2HE2 GLN 35 HE22 GLN 35 -36.317 17.317 -3.445 256 HA PRO 36 HA PRO 36 -27.691 14.713 -1.167 257 1HB PRO 36 HB1 PRO 36 -26.688 13.998 -3.546 258 2HB PRO 36 HB2 PRO 36 -27.406 12.808 -2.455 259 1HG PRO 36 HG2 PRO 36 -28.595 14.135 -4.863 260 2HG PRO 36 HG1 PRO 36 -28.681 12.435 -4.368 261 1HD PRO 36 HD1 PRO 36 -30.678 14.262 -3.924 262 2HD PRO 36 HD2 PRO 36 -30.417 12.819 -2.926 263 H GLN 37 HN GLN 37 -29.042 17.094 -1.552 264 HA GLN 37 HA GLN 37 -27.815 18.517 -3.760 265 1HB GLN 37 HB2 GLN 37 -29.047 20.491 -2.710 266 2HB GLN 37 HB1 GLN 37 -30.037 19.188 -3.351 267 1HG GLN 37 HG1 GLN 37 -30.271 18.285 -1.071 268 2HG GLN 37 HG2 GLN 37 -29.353 19.661 -0.459 269 1HE2 GLN 37 HE22 GLN 37 -32.380 18.550 -1.674 270 2HE2 GLN 37 HE21 GLN 37 -33.272 20.002 -1.390 271 H VAL 38 HN VAL 38 -25.802 17.578 -2.276 272 HA VAL 38 HA VAL 38 -24.966 19.451 -0.256 273 HB VAL 38 HB VAL 38 -23.287 17.345 -1.622 274 1HG1 VAL 38 HG11 VAL 38 -21.640 18.010 -0.292 275 2HG1 VAL 38 HG12 VAL 38 -22.667 17.830 1.131 276 3HG1 VAL 38 HG13 VAL 38 -22.650 19.353 0.242 277 1HG2 VAL 38 HG21 VAL 38 -25.575 16.884 -0.148 278 2HG2 VAL 38 HG22 VAL 38 -24.278 16.701 1.033 279 3HG2 VAL 38 HG23 VAL 38 -24.273 15.730 -0.439 280 H THR 39 HN THR 39 -23.982 21.321 -0.597 281 HA THR 39 HA THR 39 -22.891 21.886 -3.256 282 HB THR 39 HB THR 39 -24.541 23.476 -2.458 283 HG1 THR 39 HG1 THR 39 -22.102 24.122 -3.191 284 1HG2 THR 39 HG21 THR 39 -23.818 24.986 -0.510 285 2HG2 THR 39 HG22 THR 39 -22.819 23.616 -0.025 286 3HG2 THR 39 HG23 THR 39 -24.569 23.430 -0.152 287 H MET 40 HN MET 40 -21.880 21.056 -0.152 288 HA MET 40 HA MET 40 -19.270 22.352 -0.469 289 1HB MET 40 HB1 MET 40 -20.562 22.531 1.700 290 2HB MET 40 HB2 MET 40 -20.275 20.811 1.924 291 1HG MET 40 HG2 MET 40 -17.868 21.203 1.909 292 2HG MET 40 HG1 MET 40 -18.151 22.928 1.679 293 1HE MET 40 HE1 MET 40 -17.325 23.735 5.191 294 2HE MET 40 HE2 MET 40 -17.259 24.120 3.472 295 3HE MET 40 HE3 MET 40 -16.339 22.755 4.106 296 H GLN 41 HN GLN 41 -18.307 21.055 -2.009 297 HA GLN 41 HA GLN 41 -17.340 18.498 -1.021 298 1HB GLN 41 HB1 GLN 41 -19.089 18.823 -3.427 299 2HB GLN 41 HB2 GLN 41 -17.818 17.608 -3.457 300 1HG GLN 41 HG2 GLN 41 -18.776 16.388 -1.716 301 2HG GLN 41 HG1 GLN 41 -19.792 17.738 -1.210 302 1HE2 GLN 41 HE21 GLN 41 -20.616 15.055 -1.790 303 2HE2 GLN 41 HE22 GLN 41 -21.735 15.141 -3.102 304 H GLN 42 HN GLN 42 -15.291 18.056 -1.672 305 HA GLN 42 HA GLN 42 -13.713 20.110 -2.726 306 1HB GLN 42 HB2 GLN 42 -13.262 17.603 -1.563 307 2HB GLN 42 HB1 GLN 42 -12.490 17.526 -3.140 308 1HG GLN 42 HG1 GLN 42 -11.677 19.965 -2.244 309 2HG GLN 42 HG2 GLN 42 -11.746 19.030 -0.751 310 1HE2 GLN 42 HE21 GLN 42 -10.910 16.624 -1.314 311 2HE2 GLN 42 HE22 GLN 42 -9.323 16.619 -1.999 312 HA PRO 43 HA PRO 43 -15.491 16.992 -3.296 313 1HB PRO 43 HB2 PRO 43 -16.204 15.017 -4.927 314 2HB PRO 43 HB1 PRO 43 -17.020 16.583 -5.002 315 1HG PRO 43 HG2 PRO 43 -14.952 15.429 -6.815 316 2HG PRO 43 HG1 PRO 43 -16.346 16.450 -7.207 317 1HD PRO 43 HD2 PRO 43 -13.689 17.311 -6.887 318 2HD PRO 43 HD1 PRO 43 -15.128 18.346 -6.948 319 H ALA 44 HN ALA 44 -15.261 14.520 -2.882 320 HA ALA 44 HA ALA 44 -12.575 13.975 -2.275 321 1HB ALA 44 HB1 ALA 44 -14.373 13.011 -0.982 322 2HB ALA 44 HB2 ALA 44 -13.376 11.724 -1.658 323 3HB ALA 44 HB3 ALA 44 -14.937 12.104 -2.385 324 H VAL 45 HN VAL 45 -10.983 12.958 -3.337 325 HA VAL 45 HA VAL 45 -11.370 12.311 -6.121 326 HB VAL 45 HB VAL 45 -8.904 11.704 -6.003 327 1HG1 VAL 45 HG11 VAL 45 -10.146 14.074 -6.380 328 2HG1 VAL 45 HG12 VAL 45 -8.407 13.833 -6.540 329 3HG1 VAL 45 HG13 VAL 45 -9.072 14.477 -5.040 330 1HG2 VAL 45 HG21 VAL 45 -9.121 12.975 -3.277 331 2HG2 VAL 45 HG22 VAL 45 -7.647 12.421 -4.073 332 3HG2 VAL 45 HG23 VAL 45 -8.870 11.254 -3.571 333 H HIS 46 HN HIS 46 -11.526 10.341 -7.027 334 HA HIS 46 HA HIS 46 -11.622 8.039 -5.220 335 1HB HIS 46 HB1 HIS 46 -12.739 6.908 -7.177 336 2HB HIS 46 HB2 HIS 46 -13.616 8.288 -6.521 337 HD2 HIS 46 HD2 HIS 46 -14.120 10.309 -8.262 338 HE1 HIS 46 HE1 HIS 46 -11.882 8.718 -11.484 339 HE2 HIS 46 HE2 HIS 46 -13.498 10.538 -10.771 340 H VAL 47 HN VAL 47 -9.486 9.502 -7.294 341 HA VAL 47 HA VAL 47 -8.310 7.083 -8.378 342 HB VAL 47 HB VAL 47 -6.661 8.550 -9.415 343 1HG1 VAL 47 HG11 VAL 47 -8.946 10.193 -10.071 344 2HG1 VAL 47 HG12 VAL 47 -9.388 8.489 -9.955 345 3HG1 VAL 47 HG13 VAL 47 -8.102 8.994 -11.051 346 1HG2 VAL 47 HG21 VAL 47 -7.537 10.378 -7.357 347 2HG2 VAL 47 HG22 VAL 47 -7.597 11.128 -8.952 348 3HG2 VAL 47 HG23 VAL 47 -6.090 10.427 -8.364 349 H GLN 48 HN GLN 48 -5.903 6.774 -8.120 350 HA GLN 48 HA GLN 48 -5.255 6.950 -5.271 351 1HB GLN 48 HB2 GLN 48 -3.930 5.322 -7.449 352 2HB GLN 48 HB1 GLN 48 -3.591 5.217 -5.727 353 1HG GLN 48 HG1 GLN 48 -5.028 3.508 -5.785 354 2HG GLN 48 HG2 GLN 48 -6.256 4.773 -5.740 355 1HE2 GLN 48 HE21 GLN 48 -7.809 4.479 -7.153 356 2HE2 GLN 48 HE22 GLN 48 -7.651 3.760 -8.716 357 H GLY 49 HN GLY 49 -4.852 9.322 -5.745 358 1HA GLY 49 HA1 GLY 49 -2.397 9.935 -7.153 359 2HA GLY 49 HA2 GLY 49 -3.436 11.079 -6.316 360 H GLN 50 HN GLN 50 -3.405 10.888 -3.880 361 HA GLN 50 HA GLN 50 -0.629 10.823 -3.025 362 1HB GLN 50 HB1 GLN 50 -1.480 11.864 -0.966 363 2HB GLN 50 HB2 GLN 50 -2.001 12.742 -2.397 364 1HG GLN 50 HG2 GLN 50 -4.168 11.449 -2.232 365 2HG GLN 50 HG1 GLN 50 -3.622 10.929 -0.638 366 1HE2 GLN 50 HE21 GLN 50 -3.766 13.952 -2.500 367 2HE2 GLN 50 HE22 GLN 50 -4.427 14.906 -1.220 368 H GLU 51 HN GLU 51 0.016 9.751 -1.039 369 HA GLU 51 HA GLU 51 -1.033 7.080 -0.908 370 1HB GLU 51 HB2 GLU 51 1.429 8.279 -0.336 371 2HB GLU 51 HB1 GLU 51 0.832 7.699 1.214 372 1HG GLU 51 HG2 GLU 51 0.996 5.992 -1.254 373 2HG GLU 51 HG1 GLU 51 2.269 6.090 -0.039 374 HA PRO 52 HA PRO 52 -0.328 10.349 0.482 375 1HB PRO 52 HB1 PRO 52 -0.558 12.107 2.475 376 2HB PRO 52 HB2 PRO 52 -1.892 11.821 1.351 377 1HG PRO 52 HG1 PRO 52 -1.552 10.919 4.162 378 2HG PRO 52 HG2 PRO 52 -3.034 11.326 3.282 379 1HD PRO 52 HD1 PRO 52 -1.987 8.736 3.757 380 2HD PRO 52 HD2 PRO 52 -3.351 9.161 2.707 381 H LEU 53 HN LEU 53 -0.162 9.280 3.883 382 HA LEU 53 HA LEU 53 2.560 10.088 4.208 383 1HB LEU 53 HB2 LEU 53 0.483 9.296 5.893 384 2HB LEU 53 HB1 LEU 53 1.690 8.034 6.062 385 HG LEU 53 HG LEU 53 2.934 10.642 6.193 386 1HD1 LEU 53 HD21 LEU 53 0.357 10.607 7.298 387 2HD1 LEU 53 HD22 LEU 53 1.615 11.821 7.526 388 3HD1 LEU 53 HD23 LEU 53 1.479 10.471 8.653 389 1HD2 LEU 53 HD11 LEU 53 3.587 8.261 7.075 390 2HD2 LEU 53 HD12 LEU 53 2.691 8.778 8.506 391 3HD2 LEU 53 HD13 LEU 53 4.082 9.712 7.947 392 H THR 54 HN THR 54 4.409 8.887 4.175 393 HA THR 54 HA THR 54 4.488 6.071 3.956 394 HB THR 54 HB THR 54 5.689 6.815 1.478 395 HG1 THR 54 HG1 THR 54 3.482 7.298 0.515 396 1HG2 THR 54 HG21 THR 54 3.688 5.370 0.620 397 2HG2 THR 54 HG22 THR 54 3.495 5.010 2.335 398 3HG2 THR 54 HG23 THR 54 5.015 4.638 1.522 399 H ALA 55 HN ALA 55 6.885 5.675 2.695 400 HA ALA 55 HA ALA 55 8.750 6.353 4.622 401 1HB ALA 55 HB1 ALA 55 8.998 4.534 2.972 402 2HB ALA 55 HB2 ALA 55 10.438 5.543 3.119 403 3HB ALA 55 HB3 ALA 55 9.359 5.742 1.738 404 H SER 56 HN SER 56 7.955 8.042 1.621 405 HA SER 56 HA SER 56 10.071 9.887 1.645 406 1HB SER 56 HB1 SER 56 7.341 10.653 0.656 407 2HB SER 56 HB2 SER 56 8.922 11.034 -0.027 408 HG SER 56 HG SER 56 7.824 8.422 0.056 409 H MET 57 HN MET 57 6.815 10.052 3.037 410 HA MET 57 HA MET 57 6.953 12.646 4.082 411 1HB MET 57 HB1 MET 57 5.423 10.179 4.868 412 2HB MET 57 HB2 MET 57 5.302 11.650 5.817 413 1HG MET 57 HG1 MET 57 3.644 11.045 3.818 414 2HG MET 57 HG2 MET 57 4.034 12.699 4.286 415 1HE MET 57 HE1 MET 57 5.413 9.750 2.177 416 2HE MET 57 HE2 MET 57 5.485 10.452 0.560 417 3HE MET 57 HE3 MET 57 3.925 10.198 1.342 418 H LEU 58 HN LEU 58 7.892 9.526 5.422 419 HA LEU 58 HA LEU 58 8.617 10.335 7.998 420 1HB LEU 58 HB1 LEU 58 9.537 8.121 6.186 421 2HB LEU 58 HB2 LEU 58 10.246 8.333 7.773 422 HG LEU 58 HG LEU 58 8.578 7.204 8.722 423 1HD1 LEU 58 HD11 LEU 58 6.513 8.761 7.179 424 2HD1 LEU 58 HD12 LEU 58 7.276 9.347 8.659 425 3HD1 LEU 58 HD13 LEU 58 6.299 7.878 8.692 426 1HD2 LEU 58 HD21 LEU 58 7.206 6.842 6.090 427 2HD2 LEU 58 HD22 LEU 58 7.413 5.693 7.412 428 3HD2 LEU 58 HD23 LEU 58 8.788 6.117 6.390 429 H ALA 59 HN ALA 59 10.545 10.059 5.042 430 HA ALA 59 HA ALA 59 12.954 11.019 6.210 431 1HB ALA 59 HB1 ALA 59 12.416 9.685 3.952 432 2HB ALA 59 HB2 ALA 59 13.905 10.597 4.203 433 3HB ALA 59 HB3 ALA 59 12.573 11.315 3.296 434 H SER 60 HN SER 60 10.140 12.620 5.598 435 HA SER 60 HA SER 60 11.326 15.098 4.657 436 1HB SER 60 HB1 SER 60 9.094 14.372 3.847 437 2HB SER 60 HB2 SER 60 8.473 14.525 5.492 438 HG SER 60 HG SER 60 9.104 16.483 3.637 439 H ALA 61 HN ALA 61 10.979 13.596 7.615 440 HA ALA 61 HA ALA 61 11.237 16.177 9.004 441 1HB ALA 61 HB1 ALA 61 10.020 14.766 10.920 442 2HB ALA 61 HB2 ALA 61 9.288 14.014 9.503 443 3HB ALA 61 HB3 ALA 61 9.144 15.755 9.751 444 HA PRO 62 HA PRO 62 14.405 13.183 10.619 445 1HB PRO 62 HB2 PRO 62 16.351 13.119 8.795 446 2HB PRO 62 HB1 PRO 62 14.863 12.194 8.561 447 1HG PRO 62 HG1 PRO 62 15.784 14.657 7.206 448 2HG PRO 62 HG2 PRO 62 14.661 13.413 6.635 449 1HD PRO 62 HD1 PRO 62 14.049 15.959 7.855 450 2HD PRO 62 HD2 PRO 62 12.925 14.744 7.214 451 HA PRO 63 HA PRO 63 15.114 13.013 12.153 452 1HB PRO 63 HB1 PRO 63 16.327 13.382 14.508 453 2HB PRO 63 HB2 PRO 63 17.245 12.897 13.079 454 1HG PRO 63 HG2 PRO 63 17.177 15.497 14.476 455 2HG PRO 63 HG1 PRO 63 18.433 14.817 13.430 456 1HD PRO 63 HD1 PRO 63 16.345 16.699 12.746 457 2HD PRO 63 HD2 PRO 63 17.670 16.099 11.728 458 H GLN 64 HN GLN 64 13.075 12.965 12.925 459 HA GLN 64 HA GLN 64 12.299 14.398 15.253 460 1HB GLN 64 HB1 GLN 64 12.180 16.111 13.306 461 2HB GLN 64 HB2 GLN 64 10.743 15.222 12.820 462 1HG GLN 64 HG1 GLN 64 9.638 15.734 14.862 463 2HG GLN 64 HG2 GLN 64 11.114 16.400 15.560 464 1HE2 GLN 64 HE22 GLN 64 9.278 16.838 12.550 465 2HE2 GLN 64 HE21 GLN 64 9.242 18.563 12.624 466 H GLU 65 HN GLU 65 10.093 13.773 12.585 467 HA GLU 65 HA GLU 65 8.796 11.728 14.219 468 1HB GLU 65 HB1 GLU 65 7.663 12.685 11.626 469 2HB GLU 65 HB2 GLU 65 6.830 12.183 13.091 470 1HG GLU 65 HG2 GLU 65 8.481 14.630 13.257 471 2HG GLU 65 HG1 GLU 65 6.996 14.719 12.310 472 H GLN 66 HN GLN 66 11.219 11.671 12.151 473 HA GLN 66 HA GLN 66 10.614 9.933 10.080 474 1HB GLN 66 HB2 GLN 66 12.891 11.100 10.985 475 2HB GLN 66 HB1 GLN 66 13.179 9.433 11.466 476 1HG GLN 66 HG1 GLN 66 12.243 9.272 8.851 477 2HG GLN 66 HG2 GLN 66 13.339 10.653 8.865 478 1HE2 GLN 66 HE22 GLN 66 13.277 7.473 10.444 479 2HE2 GLN 66 HE21 GLN 66 14.876 7.018 9.973 480 H LYS 67 HN LYS 67 11.283 9.256 13.462 481 HA LYS 67 HA LYS 67 10.508 6.450 12.997 482 1HB LYS 67 HB2 LYS 67 11.909 5.871 14.957 483 2HB LYS 67 HB1 LYS 67 12.843 6.567 13.641 484 1HG LYS 67 HG1 LYS 67 12.851 8.728 14.797 485 2HG LYS 67 HG2 LYS 67 11.941 8.008 16.127 486 1HD LYS 67 HD2 LYS 67 13.742 6.581 16.706 487 2HD LYS 67 HD1 LYS 67 14.605 6.948 15.212 488 1HE LYS 67 HE2 LYS 67 14.983 9.218 15.938 489 2HE LYS 67 HE1 LYS 67 14.007 8.953 17.382 490 1HZ LYS 67 HZ1 LYS 67 16.716 8.015 16.773 491 2HZ LYS 67 HZ2 LYS 67 15.741 7.060 17.773 492 3HZ LYS 67 HZ3 LYS 67 16.096 8.656 18.210 493 H GLN 68 HN GLN 68 8.787 8.744 13.595 494 HA GLN 68 HA GLN 68 7.644 7.750 16.115 495 1HB GLN 68 HB2 GLN 68 8.777 9.905 16.506 496 2HB GLN 68 HB1 GLN 68 7.791 10.645 15.253 497 1HG GLN 68 HG1 GLN 68 5.818 9.748 16.744 498 2HG GLN 68 HG2 GLN 68 7.051 9.801 18.003 499 1HE2 GLN 68 HE21 GLN 68 4.749 11.551 16.321 500 2HE2 GLN 68 HE22 GLN 68 5.207 13.138 16.824 501 H MET 69 HN MET 69 6.918 9.799 13.279 502 HA MET 69 HA MET 69 4.104 9.320 13.500 503 1HB MET 69 HB2 MET 69 3.881 10.679 11.535 504 2HB MET 69 HB1 MET 69 5.091 11.416 12.576 505 1HG MET 69 HG2 MET 69 6.763 11.088 11.104 506 2HG MET 69 HG1 MET 69 6.108 9.551 10.536 507 1HE MET 69 HE1 MET 69 7.529 11.930 9.150 508 2HE MET 69 HE2 MET 69 6.538 13.373 9.357 509 3HE MET 69 HE3 MET 69 6.608 12.570 7.788 510 H LEU 70 HN LEU 70 6.455 7.279 12.580 511 HA LEU 70 HA LEU 70 5.468 6.227 10.141 512 1HB LEU 70 HB1 LEU 70 6.723 4.085 11.255 513 2HB LEU 70 HB2 LEU 70 7.508 5.336 10.323 514 HG LEU 70 HG LEU 70 8.296 6.442 12.297 515 1HD1 LEU 70 HD21 LEU 70 7.836 5.174 14.537 516 2HD1 LEU 70 HD22 LEU 70 6.381 4.634 13.697 517 3HD1 LEU 70 HD23 LEU 70 6.678 6.356 13.928 518 1HD2 LEU 70 HD11 LEU 70 9.473 4.433 13.426 519 2HD2 LEU 70 HD12 LEU 70 9.798 4.781 11.728 520 3HD2 LEU 70 HD13 LEU 70 8.686 3.484 12.166 521 H GLY 71 HN GLY 71 4.821 5.425 13.526 522 1HA GLY 71 HA2 GLY 71 2.558 3.815 12.575 523 2HA GLY 71 HA1 GLY 71 3.644 3.134 13.769 524 H GLU 72 HN GLU 72 2.820 6.525 13.771 525 HA GLU 72 HA GLU 72 0.887 6.110 15.932 526 1HB GLU 72 HB1 GLU 72 3.243 7.997 16.122 527 2HB GLU 72 HB2 GLU 72 1.969 7.818 17.320 528 1HG GLU 72 HG2 GLU 72 2.849 5.262 17.100 529 2HG GLU 72 HG1 GLU 72 4.335 6.169 16.815 530 H ARG 73 HN ARG 73 1.806 7.703 13.122 531 HA ARG 73 HA ARG 73 -0.315 9.702 13.524 532 1HB ARG 73 HB1 ARG 73 2.282 10.387 13.345 533 2HB ARG 73 HB2 ARG 73 1.879 10.341 11.636 534 1HG ARG 73 HG1 ARG 73 0.073 11.828 13.469 535 2HG ARG 73 HG2 ARG 73 1.634 12.543 13.055 536 1HD ARG 73 HD2 ARG 73 1.036 12.136 10.635 537 2HD ARG 73 HD1 ARG 73 -0.593 11.752 11.193 538 HE ARG 73 HE ARG 73 0.140 14.236 12.251 539 1HH1 ARG 73 HH11 ARG 73 -0.576 12.775 9.170 540 2HH1 ARG 73 HH12 ARG 73 -1.165 14.243 8.465 541 1HH2 ARG 73 HH21 ARG 73 -0.634 16.173 11.331 542 2HH2 ARG 73 HH22 ARG 73 -1.198 16.175 9.693 543 H LEU 74 HN LEU 74 0.957 7.167 11.669 544 HA LEU 74 HA LEU 74 -0.239 7.873 9.162 545 1HB LEU 74 HB1 LEU 74 1.416 5.745 10.232 546 2HB LEU 74 HB2 LEU 74 0.158 5.119 9.181 547 HG LEU 74 HG LEU 74 1.641 7.435 8.141 548 1HD1 LEU 74 HD11 LEU 74 3.675 6.445 7.813 549 2HD1 LEU 74 HD12 LEU 74 3.025 4.811 7.958 550 3HD1 LEU 74 HD13 LEU 74 3.252 5.800 9.401 551 1HD2 LEU 74 HD21 LEU 74 0.804 4.779 6.993 552 2HD2 LEU 74 HD22 LEU 74 1.529 6.104 6.083 553 3HD2 LEU 74 HD23 LEU 74 -0.057 6.309 6.828 554 H PHE 75 HN PHE 75 -1.414 6.579 12.060 555 HA PHE 75 HA PHE 75 -3.263 4.694 11.321 556 1HB PHE 75 HB1 PHE 75 -3.031 5.047 13.627 557 2HB PHE 75 HB2 PHE 75 -3.326 6.776 13.487 558 HD1 PHE 75 HD1 PHE 75 -5.250 3.840 12.230 559 HD2 PHE 75 HD2 PHE 75 -5.185 7.279 14.742 560 HE1 PHE 75 HE1 PHE 75 -7.626 3.488 12.779 561 HE2 PHE 75 HE2 PHE 75 -7.558 6.930 15.292 562 HZ PHE 75 HZ PHE 75 -8.781 5.032 14.310 563 HA PRO 76 HA PRO 76 -6.607 8.143 10.473 564 1HB PRO 76 HB2 PRO 76 -4.892 10.460 9.805 565 2HB PRO 76 HB1 PRO 76 -6.380 10.398 10.753 566 1HG PRO 76 HG1 PRO 76 -4.013 10.762 11.932 567 2HG PRO 76 HG2 PRO 76 -5.275 9.775 12.692 568 1HD PRO 76 HD2 PRO 76 -2.828 8.906 11.200 569 2HD PRO 76 HD1 PRO 76 -3.542 8.234 12.681 570 H LEU 77 HN LEU 77 -3.693 7.472 8.860 571 HA LEU 77 HA LEU 77 -4.754 8.275 6.258 572 1HB LEU 77 HB1 LEU 77 -2.027 7.279 7.078 573 2HB LEU 77 HB2 LEU 77 -2.477 7.663 5.433 574 HG LEU 77 HG LEU 77 -1.383 9.585 6.067 575 1HD1 LEU 77 HD21 LEU 77 -3.905 10.614 7.187 576 2HD1 LEU 77 HD22 LEU 77 -4.027 9.837 5.609 577 3HD1 LEU 77 HD23 LEU 77 -2.934 11.202 5.836 578 1HD2 LEU 77 HD11 LEU 77 -2.259 10.492 8.499 579 2HD2 LEU 77 HD12 LEU 77 -0.757 9.619 8.199 580 3HD2 LEU 77 HD13 LEU 77 -2.193 8.744 8.726 581 H ILE 78 HN ILE 78 -3.839 5.383 8.067 582 HA ILE 78 HA ILE 78 -3.926 3.543 5.947 583 HB ILE 78 HB ILE 78 -4.927 2.787 8.655 584 1HG1 ILE 78 HG12 ILE 78 -2.922 4.266 8.938 585 2HG1 ILE 78 HG11 ILE 78 -2.690 2.621 9.521 586 1HG2 ILE 78 HG21 ILE 78 -4.288 1.411 6.317 587 2HG2 ILE 78 HG22 ILE 78 -4.632 0.724 7.905 588 3HG2 ILE 78 HG23 ILE 78 -2.968 1.069 7.439 589 1HD1 ILE 78 HD11 ILE 78 -0.807 3.709 8.197 590 2HD1 ILE 78 HD12 ILE 78 -1.820 3.431 6.780 591 3HD1 ILE 78 HD13 ILE 78 -1.284 2.066 7.762 592 H GLN 79 HN GLN 79 -6.440 4.815 8.062 593 HA GLN 79 HA GLN 79 -8.583 3.208 7.463 594 1HB GLN 79 HB1 GLN 79 -8.227 6.015 8.316 595 2HB GLN 79 HB2 GLN 79 -9.784 5.647 7.589 596 1HG GLN 79 HG1 GLN 79 -10.294 4.052 9.243 597 2HG GLN 79 HG2 GLN 79 -8.629 4.009 9.822 598 1HE2 GLN 79 HE22 GLN 79 -7.801 6.048 10.751 599 2HE2 GLN 79 HE21 GLN 79 -8.888 7.012 11.687 600 H ALA 80 HN ALA 80 -6.897 5.313 5.397 601 HA ALA 80 HA ALA 80 -9.022 5.653 3.460 602 1HB ALA 80 HB1 ALA 80 -7.466 6.938 2.198 603 2HB ALA 80 HB2 ALA 80 -6.100 6.292 3.110 604 3HB ALA 80 HB3 ALA 80 -7.250 7.378 3.892 605 H MET 81 HN MET 81 -6.042 3.777 3.809 606 HA MET 81 HA MET 81 -6.171 2.557 1.226 607 1HB MET 81 HB1 MET 81 -4.810 1.219 3.529 608 2HB MET 81 HB2 MET 81 -4.273 1.370 1.862 609 1HG MET 81 HG1 MET 81 -4.327 3.975 2.804 610 2HG MET 81 HG2 MET 81 -3.705 3.030 4.153 611 1HE MET 81 HE1 MET 81 -1.478 1.231 3.728 612 2HE MET 81 HE2 MET 81 -1.466 2.800 4.541 613 3HE MET 81 HE3 MET 81 -0.197 2.397 3.387 614 H HIS 82 HN HIS 82 -7.238 1.715 4.445 615 HA HIS 82 HA HIS 82 -8.654 -0.635 3.372 616 1HB HIS 82 HB2 HIS 82 -7.737 -0.307 6.228 617 2HB HIS 82 HB1 HIS 82 -8.177 -1.792 5.402 618 HD2 HIS 82 HD2 HIS 82 -6.185 -1.436 2.815 619 HE1 HIS 82 HE1 HIS 82 -3.228 -1.405 5.820 620 HE2 HIS 82 HE2 HIS 82 -3.665 -1.712 3.342 621 HA PRO 83 HA PRO 83 -12.460 1.208 4.717 622 1HB PRO 83 HB1 PRO 83 -13.276 -1.476 5.666 623 2HB PRO 83 HB2 PRO 83 -14.042 -0.426 4.470 624 1HG PRO 83 HG1 PRO 83 -12.724 -2.628 3.727 625 2HG PRO 83 HG2 PRO 83 -12.654 -1.143 2.758 626 1HD PRO 83 HD1 PRO 83 -10.627 -2.268 4.656 627 2HD PRO 83 HD2 PRO 83 -10.383 -1.493 3.077 628 H THR 84 HN THR 84 -11.061 2.169 6.483 629 HA THR 84 HA THR 84 -10.567 2.636 8.649 630 HB THR 84 HB THR 84 -13.187 1.447 9.482 631 HG1 THR 84 HG1 THR 84 -14.294 3.110 8.509 632 1HG2 THR 84 HG21 THR 84 -13.424 3.439 10.780 633 2HG2 THR 84 HG22 THR 84 -11.992 4.148 10.034 634 3HG2 THR 84 HG23 THR 84 -11.833 2.743 11.088 635 H LEU 85 HN LEU 85 -9.868 -0.039 7.649 636 HA LEU 85 HA LEU 85 -10.261 -1.869 9.835 637 1HB LEU 85 HB1 LEU 85 -9.053 -1.947 7.148 638 2HB LEU 85 HB2 LEU 85 -8.298 -2.999 8.329 639 HG LEU 85 HG LEU 85 -11.272 -3.052 7.939 640 1HD1 LEU 85 HD21 LEU 85 -10.526 -5.137 6.455 641 2HD1 LEU 85 HD22 LEU 85 -9.180 -4.054 6.103 642 3HD1 LEU 85 HD23 LEU 85 -10.835 -3.542 5.771 643 1HD2 LEU 85 HD11 LEU 85 -10.266 -4.193 9.875 644 2HD2 LEU 85 HD12 LEU 85 -9.286 -5.160 8.773 645 3HD2 LEU 85 HD13 LEU 85 -11.043 -5.314 8.757 646 H ALA 86 HN ALA 86 -8.418 0.778 9.623 647 HA ALA 86 HA ALA 86 -5.861 -0.109 10.503 648 1HB ALA 86 HB1 ALA 86 -6.513 2.149 9.472 649 2HB ALA 86 HB2 ALA 86 -5.329 2.145 10.779 650 3HB ALA 86 HB3 ALA 86 -7.002 2.599 11.105 651 H GLY 87 HN GLY 87 -6.261 2.130 12.740 652 1HA GLY 87 HA1 GLY 87 -6.838 2.178 14.986 653 2HA GLY 87 HA2 GLY 87 -7.715 0.670 14.760 654 H LYS 88 HN LYS 88 -5.147 -0.366 13.444 655 HA LYS 88 HA LYS 88 -3.308 -0.530 15.661 656 1HB LYS 88 HB1 LYS 88 -4.964 -2.201 16.300 657 2HB LYS 88 HB2 LYS 88 -4.823 -2.973 14.728 658 1HG LYS 88 HG1 LYS 88 -2.262 -3.079 15.481 659 2HG LYS 88 HG2 LYS 88 -3.031 -3.093 17.072 660 1HD LYS 88 HD1 LYS 88 -3.512 -5.247 16.825 661 2HD LYS 88 HD2 LYS 88 -4.466 -4.872 15.387 662 1HE LYS 88 HE2 LYS 88 -2.688 -5.275 13.947 663 2HE LYS 88 HE1 LYS 88 -1.486 -5.069 15.219 664 1HZ LYS 88 HZ1 LYS 88 -3.325 -7.245 15.671 665 2HZ LYS 88 HZ2 LYS 88 -1.641 -7.203 15.817 666 3HZ LYS 88 HZ3 LYS 88 -2.353 -7.441 14.300 667 H ILE 89 HN ILE 89 -4.112 -1.095 12.329 668 HA ILE 89 HA ILE 89 -2.097 -2.699 11.447 669 HB ILE 89 HB ILE 89 -3.164 -0.254 10.031 670 1HG1 ILE 89 HG11 ILE 89 -3.979 -3.142 9.669 671 2HG1 ILE 89 HG12 ILE 89 -4.799 -2.066 10.795 672 1HG2 ILE 89 HG21 ILE 89 -2.447 -2.221 8.179 673 2HG2 ILE 89 HG22 ILE 89 -1.102 -2.135 9.316 674 3HG2 ILE 89 HG23 ILE 89 -1.637 -0.681 8.470 675 1HD1 ILE 89 HD11 ILE 89 -4.585 -0.875 8.178 676 2HD1 ILE 89 HD12 ILE 89 -6.009 -1.170 9.172 677 3HD1 ILE 89 HD13 ILE 89 -5.393 -2.441 8.117 678 H THR 90 HN THR 90 -1.753 0.795 10.833 679 HA THR 90 HA THR 90 1.018 0.719 10.557 680 HB THR 90 HB THR 90 -1.037 2.699 10.579 681 HG1 THR 90 HG1 THR 90 1.267 2.135 9.347 682 1HG2 THR 90 HG21 THR 90 0.738 4.550 11.275 683 2HG2 THR 90 HG22 THR 90 1.163 3.298 12.442 684 3HG2 THR 90 HG23 THR 90 -0.486 3.922 12.382 685 H GLY 91 HN GLY 91 -0.936 1.261 13.471 686 1HA GLY 91 HA2 GLY 91 1.169 1.939 15.223 687 2HA GLY 91 HA1 GLY 91 -0.343 1.170 15.696 688 H MET 92 HN MET 92 0.123 -1.031 13.822 689 HA MET 92 HA MET 92 1.624 -2.786 15.545 690 1HB MET 92 HB1 MET 92 -0.452 -3.255 13.942 691 2HB MET 92 HB2 MET 92 0.819 -3.550 12.768 692 1HG MET 92 HG1 MET 92 1.703 -4.981 14.868 693 2HG MET 92 HG2 MET 92 -0.033 -5.142 15.054 694 1HE MET 92 HE1 MET 92 -0.439 -5.051 11.361 695 2HE MET 92 HE2 MET 92 -1.415 -5.243 12.819 696 3HE MET 92 HE3 MET 92 -1.174 -6.613 11.732 697 H LEU 93 HN LEU 93 1.978 -1.214 12.482 698 HA LEU 93 HA LEU 93 4.188 -2.492 11.440 699 1HB LEU 93 HB2 LEU 93 2.959 0.170 11.142 700 2HB LEU 93 HB1 LEU 93 4.567 -0.040 10.486 701 HG LEU 93 HG LEU 93 2.781 -0.406 8.806 702 1HD1 LEU 93 HD11 LEU 93 3.594 -2.949 8.412 703 2HD1 LEU 93 HD12 LEU 93 4.829 -2.391 9.542 704 3HD1 LEU 93 HD13 LEU 93 4.569 -1.532 8.022 705 1HD2 LEU 93 HD21 LEU 93 0.949 -1.494 9.415 706 2HD2 LEU 93 HD22 LEU 93 1.696 -2.022 10.924 707 3HD2 LEU 93 HD23 LEU 93 1.899 -2.978 9.454 708 H LEU 94 HN LEU 94 4.045 -0.747 14.275 709 HA LEU 94 HA LEU 94 6.922 -0.153 14.195 710 1HB LEU 94 HB1 LEU 94 4.609 1.130 15.491 711 2HB LEU 94 HB2 LEU 94 6.023 0.968 16.511 712 HG LEU 94 HG LEU 94 5.812 3.153 15.265 713 1HD1 LEU 94 HD21 LEU 94 8.064 1.532 15.779 714 2HD1 LEU 94 HD22 LEU 94 7.986 3.291 15.663 715 3HD1 LEU 94 HD23 LEU 94 8.335 2.327 14.227 716 1HD2 LEU 94 HD11 LEU 94 6.497 3.166 12.905 717 2HD2 LEU 94 HD12 LEU 94 4.982 2.292 13.148 718 3HD2 LEU 94 HD13 LEU 94 6.484 1.401 12.902 719 H GLU 95 HN GLU 95 5.627 -2.739 14.483 720 HA GLU 95 HA GLU 95 7.117 -3.766 16.664 721 1HB GLU 95 HB2 GLU 95 5.425 -4.399 18.187 722 2HB GLU 95 HB1 GLU 95 5.101 -2.714 17.808 723 1HG GLU 95 HG1 GLU 95 3.245 -3.243 16.493 724 2HG GLU 95 HG2 GLU 95 3.720 -4.934 16.344 725 H ILE 96 HN ILE 96 5.588 -4.099 13.758 726 HA ILE 96 HA ILE 96 4.670 -6.763 13.792 727 HB ILE 96 HB ILE 96 4.842 -6.788 11.407 728 1HG1 ILE 96 HG12 ILE 96 7.130 -5.832 11.293 729 2HG1 ILE 96 HG11 ILE 96 6.016 -5.179 10.099 730 1HG2 ILE 96 HG21 ILE 96 3.867 -4.422 10.889 731 2HG2 ILE 96 HG22 ILE 96 3.847 -4.286 12.648 732 3HG2 ILE 96 HG23 ILE 96 2.959 -5.588 11.856 733 1HD1 ILE 96 HD11 ILE 96 7.630 -3.775 11.867 734 2HD1 ILE 96 HD12 ILE 96 5.981 -3.578 12.464 735 3HD1 ILE 96 HD13 ILE 96 6.378 -3.133 10.802 736 H ASP 97 HN ASP 97 6.219 -7.657 11.463 737 HA ASP 97 HA ASP 97 8.089 -9.368 12.580 738 1HB ASP 97 HB1 ASP 97 6.949 -9.278 10.229 739 2HB ASP 97 HB2 ASP 97 8.340 -8.294 9.779 740 H ASN 98 HN ASN 98 8.253 -6.059 12.206 741 HA ASN 98 HA ASN 98 9.837 -4.551 12.762 742 1HB ASN 98 HB1 ASN 98 11.228 -7.049 13.433 743 2HB ASN 98 HB2 ASN 98 12.304 -5.732 12.974 744 1HD2 ASN 98 HD22 ASN 98 10.663 -7.145 15.477 745 2HD2 ASN 98 HD21 ASN 98 10.704 -5.839 16.607 746 H SER 99 HN SER 99 10.228 -6.832 10.233 747 HA SER 99 HA SER 99 12.254 -5.360 8.814 748 1HB SER 99 HB2 SER 99 12.382 -7.254 7.636 749 2HB SER 99 HB1 SER 99 11.024 -7.906 8.555 750 HG SER 99 HG SER 99 11.099 -6.868 6.002 751 H GLU 100 HN GLU 100 8.786 -5.487 8.981 752 HA GLU 100 HA GLU 100 8.257 -3.876 6.681 753 1HB GLU 100 HB1 GLU 100 6.595 -4.491 9.112 754 2HB GLU 100 HB2 GLU 100 6.009 -3.618 7.713 755 1HG GLU 100 HG2 GLU 100 5.258 -5.721 7.278 756 2HG GLU 100 HG1 GLU 100 6.791 -5.710 6.403 757 H LEU 101 HN LEU 101 9.033 -3.322 10.013 758 HA LEU 101 HA LEU 101 8.278 -0.583 10.121 759 1HB LEU 101 HB1 LEU 101 8.592 -2.000 12.124 760 2HB LEU 101 HB2 LEU 101 10.303 -2.107 11.771 761 HG LEU 101 HG LEU 101 9.409 -0.435 13.579 762 1HD1 LEU 101 HD21 LEU 101 11.718 -0.605 11.995 763 2HD1 LEU 101 HD22 LEU 101 11.536 0.173 13.567 764 3HD1 LEU 101 HD23 LEU 101 11.301 1.106 12.089 765 1HD2 LEU 101 HD11 LEU 101 9.373 1.480 11.300 766 2HD2 LEU 101 HD12 LEU 101 8.670 1.627 12.910 767 3HD2 LEU 101 HD13 LEU 101 7.905 0.592 11.704 768 H LEU 102 HN LEU 102 11.041 -2.325 8.977 769 HA LEU 102 HA LEU 102 12.710 0.039 8.799 770 1HB LEU 102 HB2 LEU 102 13.059 -2.851 8.594 771 2HB LEU 102 HB1 LEU 102 13.924 -1.978 7.338 772 HG LEU 102 HG LEU 102 14.837 -0.535 9.299 773 1HD1 LEU 102 HD21 LEU 102 13.285 -2.515 10.699 774 2HD1 LEU 102 HD22 LEU 102 14.099 -1.079 11.319 775 3HD1 LEU 102 HD23 LEU 102 14.983 -2.597 11.169 776 1HD2 LEU 102 HD11 LEU 102 16.534 -2.453 9.773 777 2HD2 LEU 102 HD12 LEU 102 16.421 -1.755 8.156 778 3HD2 LEU 102 HD13 LEU 102 15.642 -3.298 8.508 779 H HIS 103 HN HIS 103 11.121 -2.225 6.572 780 HA HIS 103 HA HIS 103 12.029 -0.997 4.212 781 1HB HIS 103 HB1 HIS 103 10.642 -3.293 4.870 782 2HB HIS 103 HB2 HIS 103 9.441 -2.345 4.003 783 HD2 HIS 103 HD2 HIS 103 11.331 -5.088 2.980 784 HE1 HIS 103 HE1 HIS 103 12.266 -2.285 -0.051 785 HE2 HIS 103 HE2 HIS 103 12.300 -4.737 0.599 786 H MET 104 HN MET 104 9.090 -0.541 6.139 787 HA MET 104 HA MET 104 7.648 1.043 4.355 788 1HB MET 104 HB2 MET 104 6.342 1.733 6.219 789 2HB MET 104 HB1 MET 104 6.859 0.089 6.579 790 1HG MET 104 HG2 MET 104 8.804 1.229 7.805 791 2HG MET 104 HG1 MET 104 7.800 2.673 7.745 792 1HE MET 104 HE1 MET 104 5.191 1.965 7.798 793 2HE MET 104 HE2 MET 104 4.596 1.675 9.431 794 3HE MET 104 HE3 MET 104 4.783 0.328 8.306 795 H LEU 105 HN LEU 105 10.255 1.886 6.562 796 HA LEU 105 HA LEU 105 9.963 4.725 6.053 797 1HB LEU 105 HB1 LEU 105 12.289 3.435 7.448 798 2HB LEU 105 HB2 LEU 105 11.660 5.059 7.651 799 HG LEU 105 HG LEU 105 10.193 2.568 8.514 800 1HD1 LEU 105 HD11 LEU 105 10.833 3.449 10.824 801 2HD1 LEU 105 HD12 LEU 105 12.073 4.383 9.990 802 3HD1 LEU 105 HD13 LEU 105 12.084 2.622 9.895 803 1HD2 LEU 105 HD21 LEU 105 8.821 4.134 9.781 804 2HD2 LEU 105 HD22 LEU 105 8.765 4.487 8.053 805 3HD2 LEU 105 HD23 LEU 105 9.747 5.485 9.124 806 H GLU 106 HN GLU 106 11.415 2.115 4.529 807 HA GLU 106 HA GLU 106 13.467 3.837 3.335 808 1HB GLU 106 HB1 GLU 106 14.845 2.019 3.117 809 2HB GLU 106 HB2 GLU 106 13.903 1.495 4.506 810 1HG GLU 106 HG1 GLU 106 13.577 -0.377 3.357 811 2HG GLU 106 HG2 GLU 106 12.407 0.560 2.427 812 H SER 107 HN SER 107 10.446 2.550 2.640 813 HA SER 107 HA SER 107 10.909 3.042 -0.216 814 1HB SER 107 HB2 SER 107 10.873 0.504 0.581 815 2HB SER 107 HB1 SER 107 9.131 0.754 0.474 816 HG SER 107 HG SER 107 10.354 0.015 -1.486 817 HA PRO 108 HA PRO 108 7.178 5.411 0.308 818 1HB PRO 108 HB1 PRO 108 7.068 5.487 -2.622 819 2HB PRO 108 HB2 PRO 108 7.296 6.811 -1.477 820 1HG PRO 108 HG1 PRO 108 9.285 5.939 -3.072 821 2HG PRO 108 HG2 PRO 108 9.586 6.560 -1.438 822 1HD PRO 108 HD2 PRO 108 9.455 3.722 -2.396 823 2HD PRO 108 HD1 PRO 108 10.591 4.475 -1.254 824 H GLU 109 HN GLU 109 7.422 2.337 -0.819 825 HA GLU 109 HA GLU 109 4.511 2.127 -1.237 826 1HB GLU 109 HB2 GLU 109 6.663 0.531 -2.646 827 2HB GLU 109 HB1 GLU 109 4.930 0.298 -2.833 828 1HG GLU 109 HG1 GLU 109 4.762 2.606 -3.715 829 2HG GLU 109 HG2 GLU 109 6.519 2.725 -3.634 830 H SER 110 HN SER 110 7.222 1.200 0.540 831 HA SER 110 HA SER 110 6.259 -1.402 1.312 832 1HB SER 110 HB1 SER 110 8.603 0.274 1.948 833 2HB SER 110 HB2 SER 110 8.039 -0.759 3.262 834 HG SER 110 HG SER 110 8.382 -2.537 2.019 835 H LEU 111 HN LEU 111 6.412 1.823 2.739 836 HA LEU 111 HA LEU 111 5.208 1.432 5.165 837 1HB LEU 111 HB1 LEU 111 6.053 3.571 4.025 838 2HB LEU 111 HB2 LEU 111 4.470 3.670 3.279 839 HG LEU 111 HG LEU 111 4.394 5.143 5.092 840 1HD1 LEU 111 HD21 LEU 111 2.410 3.739 4.975 841 2HD1 LEU 111 HD22 LEU 111 2.763 4.207 6.636 842 3HD1 LEU 111 HD23 LEU 111 3.157 2.582 6.078 843 1HD2 LEU 111 HD11 LEU 111 5.449 3.023 6.931 844 2HD2 LEU 111 HD12 LEU 111 5.203 4.734 7.275 845 3HD2 LEU 111 HD13 LEU 111 6.467 4.235 6.146 846 H ARG 112 HN ARG 112 3.713 1.672 1.973 847 HA ARG 112 HA ARG 112 1.058 1.305 2.996 848 1HB ARG 112 HB2 ARG 112 0.836 2.483 1.084 849 2HB ARG 112 HB1 ARG 112 2.309 1.826 0.380 850 1HG ARG 112 HG1 ARG 112 1.203 -0.069 -0.428 851 2HG ARG 112 HG2 ARG 112 -0.212 0.214 0.589 852 1HD ARG 112 HD2 ARG 112 -1.058 1.824 -0.780 853 2HD ARG 112 HD1 ARG 112 0.532 2.332 -1.349 854 HE ARG 112 HE ARG 112 -0.521 -0.259 -2.219 855 1HH1 ARG 112 HH22 ARG 112 0.372 3.029 -2.952 856 2HH1 ARG 112 HH21 ARG 112 0.360 2.787 -4.666 857 1HH2 ARG 112 HH12 ARG 112 -0.539 -0.587 -4.477 858 2HH2 ARG 112 HH11 ARG 112 -0.157 0.732 -5.533 859 H SER 113 HN SER 113 2.991 -0.656 0.716 860 HA SER 113 HA SER 113 1.417 -2.892 0.637 861 1HB SER 113 HB2 SER 113 3.539 -2.435 -0.688 862 2HB SER 113 HB1 SER 113 4.435 -3.041 0.705 863 HG SER 113 HG SER 113 2.354 -4.592 -0.347 864 H LYS 114 HN LYS 114 4.167 -2.405 2.847 865 HA LYS 114 HA LYS 114 3.841 -4.734 4.330 866 1HB LYS 114 HB1 LYS 114 4.893 -2.079 5.320 867 2HB LYS 114 HB2 LYS 114 5.177 -3.647 6.064 868 1HG LYS 114 HG1 LYS 114 6.101 -2.821 3.318 869 2HG LYS 114 HG2 LYS 114 7.103 -2.877 4.770 870 1HD LYS 114 HD2 LYS 114 6.614 -5.305 4.951 871 2HD LYS 114 HD1 LYS 114 5.747 -5.207 3.417 872 1HE LYS 114 HE2 LYS 114 8.203 -4.006 2.916 873 2HE LYS 114 HE1 LYS 114 8.588 -5.399 3.925 874 1HZ LYS 114 HZ1 LYS 114 7.138 -6.702 2.332 875 2HZ LYS 114 HZ2 LYS 114 8.634 -6.183 1.738 876 3HZ LYS 114 HZ3 LYS 114 7.220 -5.363 1.302 877 H VAL 115 HN VAL 115 2.140 -1.659 4.534 878 HA VAL 115 HA VAL 115 0.948 -2.197 7.079 879 HB VAL 115 HB VAL 115 0.634 -0.117 5.006 880 1HG1 VAL 115 HG11 VAL 115 -1.643 -0.454 4.987 881 2HG1 VAL 115 HG12 VAL 115 -1.488 0.632 6.367 882 3HG1 VAL 115 HG13 VAL 115 -1.669 -1.102 6.627 883 1HG2 VAL 115 HG21 VAL 115 0.147 0.597 7.772 884 2HG2 VAL 115 HG22 VAL 115 1.389 1.172 6.658 885 3HG2 VAL 115 HG23 VAL 115 1.646 -0.313 7.574 886 H ASP 116 HN ASP 116 -0.433 -2.206 3.770 887 HA ASP 116 HA ASP 116 -2.842 -3.390 4.291 888 1HB ASP 116 HB1 ASP 116 -2.311 -2.577 2.083 889 2HB ASP 116 HB2 ASP 116 -1.039 -3.781 1.898 890 H GLU 117 HN GLU 117 0.283 -4.984 3.938 891 HA GLU 117 HA GLU 117 -0.751 -7.642 4.030 892 1HB GLU 117 HB2 GLU 117 1.334 -7.966 3.272 893 2HB GLU 117 HB1 GLU 117 1.821 -6.355 3.776 894 1HG GLU 117 HG1 GLU 117 2.574 -7.083 5.840 895 2HG GLU 117 HG2 GLU 117 1.658 -8.588 5.753 896 H ALA 118 HN ALA 118 0.651 -5.430 6.416 897 HA ALA 118 HA ALA 118 0.631 -7.166 8.617 898 1HB ALA 118 HB1 ALA 118 1.627 -4.783 8.383 899 2HB ALA 118 HB2 ALA 118 1.022 -5.323 9.951 900 3HB ALA 118 HB3 ALA 118 0.040 -4.256 8.946 901 H VAL 119 HN VAL 119 -1.886 -5.404 7.009 902 HA VAL 119 HA VAL 119 -3.900 -5.399 8.954 903 HB VAL 119 HB VAL 119 -4.294 -5.861 6.005 904 1HG1 VAL 119 HG11 VAL 119 -6.326 -6.160 7.243 905 2HG1 VAL 119 HG12 VAL 119 -6.393 -4.594 6.423 906 3HG1 VAL 119 HG13 VAL 119 -6.041 -4.672 8.150 907 1HG2 VAL 119 HG21 VAL 119 -4.428 -3.156 7.150 908 2HG2 VAL 119 HG22 VAL 119 -3.874 -3.698 5.568 909 3HG2 VAL 119 HG23 VAL 119 -2.824 -3.865 6.976 910 H ALA 120 HN ALA 120 -3.118 -7.718 6.417 911 HA ALA 120 HA ALA 120 -5.000 -9.686 6.981 912 1HB ALA 120 HB1 ALA 120 -2.805 -9.349 5.275 913 2HB ALA 120 HB2 ALA 120 -3.967 -10.682 5.271 914 3HB ALA 120 HB3 ALA 120 -2.469 -10.822 6.194 915 H VAL 121 HN VAL 121 -2.075 -8.776 8.572 916 HA VAL 121 HA VAL 121 -1.915 -11.146 10.216 917 HB VAL 121 HB VAL 121 -0.316 -8.618 9.979 918 1HG1 VAL 121 HG21 VAL 121 1.020 -10.247 11.806 919 2HG1 VAL 121 HG22 VAL 121 -0.644 -10.159 12.381 920 3HG1 VAL 121 HG23 VAL 121 0.274 -8.677 12.109 921 1HG2 VAL 121 HG11 VAL 121 1.454 -10.067 9.340 922 2HG2 VAL 121 HG12 VAL 121 0.018 -10.574 8.448 923 3HG2 VAL 121 HG13 VAL 121 0.555 -11.495 9.854 924 H LEU 122 HN LEU 122 -3.126 -7.877 10.426 925 HA LEU 122 HA LEU 122 -3.452 -7.852 13.268 926 1HB LEU 122 HB2 LEU 122 -3.745 -5.683 12.875 927 2HB LEU 122 HB1 LEU 122 -3.680 -5.996 11.154 928 HG LEU 122 HG LEU 122 -6.300 -6.634 11.863 929 1HD1 LEU 122 HD11 LEU 122 -6.943 -4.376 12.917 930 2HD1 LEU 122 HD12 LEU 122 -5.263 -4.315 13.449 931 3HD1 LEU 122 HD13 LEU 122 -6.304 -5.641 13.966 932 1HD2 LEU 122 HD21 LEU 122 -6.688 -4.303 10.773 933 2HD2 LEU 122 HD22 LEU 122 -5.983 -5.614 9.826 934 3HD2 LEU 122 HD23 LEU 122 -4.946 -4.355 10.498 935 H GLN 123 HN GLN 123 -5.488 -8.569 10.491 936 HA GLN 123 HA GLN 123 -7.915 -8.921 11.869 937 1HB GLN 123 HB1 GLN 123 -6.840 -9.902 9.238 938 2HB GLN 123 HB2 GLN 123 -8.403 -10.458 9.825 939 1HG GLN 123 HG1 GLN 123 -7.631 -7.581 9.373 940 2HG GLN 123 HG2 GLN 123 -8.579 -8.572 8.265 941 1HE2 GLN 123 HE22 GLN 123 -10.636 -9.371 9.019 942 2HE2 GLN 123 HE21 GLN 123 -11.537 -8.452 10.171 943 H ALA 124 HN ALA 124 -5.212 -11.037 11.157 944 HA ALA 124 HA ALA 124 -6.362 -13.433 12.191 945 1HB ALA 124 HB1 ALA 124 -3.798 -12.566 11.143 946 2HB ALA 124 HB2 ALA 124 -4.557 -14.158 11.100 947 3HB ALA 124 HB3 ALA 124 -3.624 -13.662 12.512 948 H HIS 125 HN HIS 125 -3.514 -11.872 13.562 949 HA HIS 125 HA HIS 125 -3.435 -12.799 16.026 950 1HB HIS 125 HB1 HIS 125 -2.394 -10.538 14.798 951 2HB HIS 125 HB2 HIS 125 -3.217 -9.896 16.216 952 HD2 HIS 125 HD2 HIS 125 -0.054 -11.859 15.265 953 HE1 HIS 125 HE1 HIS 125 -0.199 -11.535 19.483 954 HE2 HIS 125 HE2 HIS 125 1.224 -12.210 17.495 955 H GLN 126 HN GLN 126 -5.826 -10.424 15.004 956 HA GLN 126 HA GLN 126 -6.855 -9.876 17.581 957 1HB GLN 126 HB1 GLN 126 -7.869 -9.501 14.786 958 2HB GLN 126 HB2 GLN 126 -8.948 -9.232 16.148 959 1HG GLN 126 HG2 GLN 126 -6.388 -7.788 15.513 960 2HG GLN 126 HG1 GLN 126 -8.027 -7.136 15.536 961 1HE2 GLN 126 HE21 GLN 126 -9.087 -6.907 17.567 962 2HE2 GLN 126 HE22 GLN 126 -8.167 -6.715 19.018 963 H ALA 127 HN ALA 127 -8.757 -11.479 15.038 964 HA ALA 127 HA ALA 127 -10.049 -13.071 17.112 965 1HB ALA 127 HB1 ALA 127 -11.175 -13.456 14.502 966 2HB ALA 127 HB2 ALA 127 -10.972 -11.737 14.839 967 3HB ALA 127 HB3 ALA 127 -11.900 -12.749 15.945 968 H LYS 128 HN LYS 128 -7.334 -13.816 16.043 969 HA LYS 128 HA LYS 128 -7.969 -16.347 14.703 970 1HB LYS 128 HB2 LYS 128 -5.668 -16.553 14.151 971 2HB LYS 128 HB1 LYS 128 -6.097 -14.876 13.842 972 1HG LYS 128 HG1 LYS 128 -4.597 -14.132 15.309 973 2HG LYS 128 HG2 LYS 128 -5.102 -15.293 16.538 974 1HD LYS 128 HD2 LYS 128 -2.969 -16.025 16.160 975 2HD LYS 128 HD1 LYS 128 -3.835 -16.988 14.962 976 1HE LYS 128 HE2 LYS 128 -3.204 -15.524 13.203 977 2HE LYS 128 HE1 LYS 128 -2.599 -14.317 14.336 978 1HZ LYS 128 HZ1 LYS 128 -1.131 -16.476 14.974 979 2HZ LYS 128 HZ2 LYS 128 -0.631 -15.257 13.914 980 3HZ LYS 128 HZ3 LYS 128 -1.309 -16.682 13.304 981 H GLU 129 HN GLU 129 -5.698 -17.751 15.560 982 HA GLU 129 HA GLU 129 -6.608 -18.628 18.196 983 1HB GLU 129 HB2 GLU 129 -5.327 -19.889 15.924 984 2HB GLU 129 HB1 GLU 129 -4.421 -20.194 17.400 985 1HG GLU 129 HG2 GLU 129 -6.061 -21.946 16.942 986 2HG GLU 129 HG1 GLU 129 -6.385 -21.113 18.462 987 H ALA 130 HN ALA 130 -5.184 -16.101 17.700 988 HA ALA 130 HA ALA 130 -2.500 -16.191 18.376 989 1HB ALA 130 HB1 ALA 130 -2.665 -13.861 18.853 990 2HB ALA 130 HB2 ALA 130 -4.399 -13.986 19.144 991 3HB ALA 130 HB3 ALA 130 -3.761 -14.211 17.515 992 H ALA 131 HN ALA 131 -5.030 -15.072 20.618 993 HA ALA 131 HA ALA 131 -3.386 -15.736 22.893 994 1HB ALA 131 HB1 ALA 131 -6.201 -14.661 22.767 995 2HB ALA 131 HB2 ALA 131 -4.727 -13.703 22.905 996 3HB ALA 131 HB3 ALA 131 -5.205 -14.779 24.217 997 H GLN 132 HN GLN 132 -5.002 -16.648 24.810 998 HA GLN 132 HA GLN 132 -5.557 -19.369 23.924 999 1HB GLN 132 HB2 GLN 132 -5.320 -18.120 26.664 1000 2HB GLN 132 HB1 GLN 132 -5.782 -19.798 26.407 1001 1HG GLN 132 HG1 GLN 132 -3.579 -20.144 26.674 1002 2HG GLN 132 HG2 GLN 132 -3.533 -19.737 24.959 1003 1HE2 GLN 132 HE21 GLN 132 -2.229 -19.082 27.928 1004 2HE2 GLN 132 HE22 GLN 132 -1.508 -17.551 27.585 1005 H LYS 133 HN LYS 133 -7.170 -17.246 26.288 1006 HA LYS 133 HA LYS 133 -9.710 -18.487 25.766 1007 1HB LYS 133 HB1 LYS 133 -9.073 -16.049 27.438 1008 2HB LYS 133 HB2 LYS 133 -10.572 -16.969 27.471 1009 1HG LYS 133 HG2 LYS 133 -9.698 -18.148 29.130 1010 2HG LYS 133 HG1 LYS 133 -8.594 -18.857 27.949 1011 1HD LYS 133 HD2 LYS 133 -6.974 -18.014 29.250 1012 2HD LYS 133 HD1 LYS 133 -7.381 -16.472 28.495 1013 1HE LYS 133 HE1 LYS 133 -8.816 -17.429 30.946 1014 2HE LYS 133 HE2 LYS 133 -7.269 -16.591 31.065 1015 1HZ LYS 133 HZ1 LYS 133 -8.163 -14.642 30.285 1016 2HZ LYS 133 HZ2 LYS 133 -9.469 -15.257 31.166 1017 3HZ LYS 133 HZ3 LYS 133 -9.442 -15.402 29.481 1018 H ALA 134 HN ALA 134 -11.470 -16.341 25.978 1019 HA ALA 134 HA ALA 134 -11.705 -15.542 23.283 1020 1HB ALA 134 HB1 ALA 134 -13.321 -13.809 24.692 1021 2HB ALA 134 HB2 ALA 134 -13.225 -15.227 25.737 1022 3HB ALA 134 HB3 ALA 134 -13.783 -15.395 24.072 1023 H VAL 135 HN VAL 135 -12.182 -13.083 22.836 1024 HA VAL 135 HA VAL 135 -9.720 -11.663 23.535 1025 HB VAL 135 HB VAL 135 -10.599 -10.053 21.704 1026 1HG1 VAL 135 HG21 VAL 135 -9.917 -12.681 20.515 1027 2HG1 VAL 135 HG22 VAL 135 -8.782 -11.993 21.678 1028 3HG1 VAL 135 HG23 VAL 135 -9.215 -11.089 20.227 1029 1HG2 VAL 135 HG11 VAL 135 -12.867 -10.971 21.600 1030 2HG2 VAL 135 HG12 VAL 135 -12.214 -12.519 21.063 1031 3HG2 VAL 135 HG13 VAL 135 -12.049 -11.090 20.041 1032 H ASN 136 HN ASN 136 -10.451 -11.115 25.678 1033 HA ASN 136 HA ASN 136 -12.674 -9.237 25.865 1034 1HB ASN 136 HB1 ASN 136 -11.203 -10.967 27.740 1035 2HB ASN 136 HB2 ASN 136 -11.635 -9.389 28.391 1036 1HD2 ASN 136 HD21 ASN 136 -12.600 -12.347 28.577 1037 2HD2 ASN 136 HD22 ASN 136 -14.318 -12.177 28.560 1038 H SER 137 HN SER 137 -9.724 -8.864 24.809 1039 HA SER 137 HA SER 137 -8.983 -6.546 26.431 1040 1HB SER 137 HB1 SER 137 -7.308 -8.344 25.680 1041 2HB SER 137 HB2 SER 137 -7.439 -7.627 24.074 1042 HG SER 137 HG SER 137 -6.708 -5.672 24.940 1043 H ALA 138 HN ALA 138 -10.743 -5.216 25.728 1044 HA ALA 138 HA ALA 138 -10.920 -4.488 22.932 1045 1HB ALA 138 HB1 ALA 138 -12.382 -2.708 24.627 1046 2HB ALA 138 HB2 ALA 138 -12.649 -4.371 25.149 1047 3HB ALA 138 HB3 ALA 138 -12.988 -3.905 23.481 1048 H THR 139 HN THR 139 -10.674 -2.412 25.814 1049 HA THR 139 HA THR 139 -8.774 -0.724 24.322 1050 HB THR 139 HB THR 139 -10.110 0.510 26.623 1051 HG1 THR 139 HG1 THR 139 -12.092 0.193 26.049 1052 1HG2 THR 139 HG21 THR 139 -9.090 2.087 25.341 1053 2HG2 THR 139 HG22 THR 139 -10.720 2.137 24.669 1054 3HG2 THR 139 HG23 THR 139 -9.447 1.253 23.828 1055 H GLY 140 HN GLY 140 -9.252 -2.681 27.064 1056 1HA GLY 140 HA2 GLY 140 -6.949 -1.499 28.462 1057 2HA GLY 140 HA1 GLY 140 -8.112 -2.612 29.168 1058 H VAL 141 HN VAL 141 -5.045 -2.313 27.888 1059 HA VAL 141 HA VAL 141 -4.873 -5.149 27.149 1060 HB VAL 141 HB VAL 141 -2.486 -4.424 26.446 1061 1HG1 VAL 141 HG21 VAL 141 -3.334 -4.604 24.399 1062 2HG1 VAL 141 HG22 VAL 141 -4.188 -3.069 24.556 1063 3HG1 VAL 141 HG23 VAL 141 -4.940 -4.561 25.126 1064 1HG2 VAL 141 HG11 VAL 141 -1.918 -2.257 26.425 1065 2HG2 VAL 141 HG12 VAL 141 -3.229 -2.054 27.587 1066 3HG2 VAL 141 HG13 VAL 141 -3.514 -1.747 25.875 1067 HA PRO 142 HA PRO 142 -3.063 -5.464 31.311 1068 1HB PRO 142 HB1 PRO 142 -3.501 -8.105 31.616 1069 2HB PRO 142 HB2 PRO 142 -4.785 -6.910 31.828 1070 1HG PRO 142 HG1 PRO 142 -4.182 -8.645 29.462 1071 2HG PRO 142 HG2 PRO 142 -5.749 -8.275 30.204 1072 1HD PRO 142 HD1 PRO 142 -4.832 -7.030 27.961 1073 2HD PRO 142 HD2 PRO 142 -5.919 -6.250 29.127 1074 H THR 143 HN THR 143 -1.582 -7.460 32.147 1075 HA THR 143 HA THR 143 0.714 -7.408 30.387 1076 HB THR 143 HB THR 143 1.955 -8.287 32.235 1077 HG1 THR 143 HG1 THR 143 0.886 -9.832 33.213 1078 1HG2 THR 143 HG21 THR 143 0.957 -6.888 34.217 1079 2HG2 THR 143 HG22 THR 143 -0.032 -6.200 32.930 1080 3HG2 THR 143 HG23 THR 143 1.728 -6.109 32.835 1081 H VAL 144 HN VAL 144 2.045 -9.629 30.550 1082 HA VAL 144 HA VAL 144 0.531 -11.490 28.988 1083 HB VAL 144 HB VAL 144 3.275 -12.000 30.116 1084 1HG1 VAL 144 HG11 VAL 144 1.798 -12.942 27.666 1085 2HG1 VAL 144 HG12 VAL 144 2.329 -13.906 29.045 1086 3HG1 VAL 144 HG13 VAL 144 3.518 -13.218 27.939 1087 1HG2 VAL 144 HG21 VAL 144 2.483 -9.857 28.392 1088 2HG2 VAL 144 HG22 VAL 144 3.507 -10.984 27.501 1089 3HG2 VAL 144 HG23 VAL 144 4.088 -10.260 29.002 Start of MODEL 18 1 1H GLY 1 HT1 GLY 1 15.996 54.472 -13.008 2 2H GLY 1 HT2 GLY 1 16.454 53.979 -11.456 3 3H GLY 1 HT3 GLY 1 17.631 54.449 -12.575 4 1HA GLY 1 HA1 GLY 1 16.002 56.616 -12.479 5 2HA GLY 1 HA2 GLY 1 16.028 56.053 -10.814 6 HA PRO 2 HA PRO 2 20.117 58.197 -12.044 7 1HB PRO 2 HB2 PRO 2 19.619 60.829 -12.008 8 2HB PRO 2 HB1 PRO 2 19.339 59.856 -13.457 9 1HG PRO 2 HG2 PRO 2 17.377 60.835 -11.419 10 2HG PRO 2 HG1 PRO 2 17.224 60.785 -13.184 11 1HD PRO 2 HD2 PRO 2 16.133 58.918 -11.487 12 2HD PRO 2 HD1 PRO 2 16.552 58.599 -13.181 13 H LEU 3 HN LEU 3 18.930 57.289 -9.576 14 HA LEU 3 HA LEU 3 19.218 59.336 -7.591 15 1HB LEU 3 HB2 LEU 3 17.764 57.240 -7.459 16 2HB LEU 3 HB1 LEU 3 19.240 56.366 -7.101 17 HG LEU 3 HG LEU 3 19.407 58.314 -5.242 18 1HD1 LEU 3 HD11 LEU 3 17.099 58.474 -4.242 19 2HD1 LEU 3 HD12 LEU 3 16.480 57.888 -5.786 20 3HD1 LEU 3 HD13 LEU 3 17.365 59.412 -5.711 21 1HD2 LEU 3 HD21 LEU 3 19.270 56.589 -3.825 22 2HD2 LEU 3 HD22 LEU 3 19.082 55.604 -5.276 23 3HD2 LEU 3 HD23 LEU 3 17.659 56.136 -4.381 24 H GLY 4 HN GLY 4 20.899 59.702 -6.187 25 1HA GLY 4 HA1 GLY 4 23.488 58.665 -7.055 26 2HA GLY 4 HA2 GLY 4 23.224 60.030 -5.981 27 H SER 5 HN SER 5 25.124 58.137 -5.392 28 HA SER 5 HA SER 5 23.912 56.432 -3.336 29 1HB SER 5 HB2 SER 5 25.848 55.089 -3.417 30 2HB SER 5 HB1 SER 5 25.572 55.540 -5.099 31 HG SER 5 HG SER 5 27.632 56.059 -4.887 32 H ALA 6 HN ALA 6 25.751 59.290 -3.759 33 HA ALA 6 HA ALA 6 26.180 59.438 -0.849 34 1HB ALA 6 HB1 ALA 6 28.100 59.970 -3.058 35 2HB ALA 6 HB2 ALA 6 28.363 59.212 -1.487 36 3HB ALA 6 HB3 ALA 6 28.189 60.963 -1.604 37 H ALA 7 HN ALA 7 24.474 60.635 -3.335 38 HA ALA 7 HA ALA 7 24.648 63.451 -2.598 39 1HB ALA 7 HB1 ALA 7 23.891 62.009 -4.949 40 2HB ALA 7 HB2 ALA 7 24.176 63.738 -4.745 41 3HB ALA 7 HB3 ALA 7 22.570 63.068 -4.454 42 H ALA 8 HN ALA 8 22.042 64.267 -3.027 43 HA ALA 8 HA ALA 8 20.879 63.900 -0.504 44 1HB ALA 8 HB1 ALA 8 20.050 65.814 -1.332 45 2HB ALA 8 HB2 ALA 8 18.787 64.774 -1.991 46 3HB ALA 8 HB3 ALA 8 20.149 65.255 -3.002 47 H ALA 9 HN ALA 9 19.412 62.506 0.296 48 HA ALA 9 HA ALA 9 18.248 60.528 -1.553 49 1HB ALA 9 HB1 ALA 9 20.098 59.655 -0.086 50 2HB ALA 9 HB2 ALA 9 18.562 58.798 0.035 51 3HB ALA 9 HB3 ALA 9 19.034 59.943 1.291 52 H THR 10 HN THR 10 17.726 62.813 0.936 53 HA THR 10 HA THR 10 15.089 61.763 1.609 54 HB THR 10 HB THR 10 15.017 63.517 3.294 55 HG1 THR 10 HG1 THR 10 17.574 64.364 2.459 56 1HG2 THR 10 HG21 THR 10 17.306 61.701 3.163 57 2HG2 THR 10 HG22 THR 10 16.130 61.967 4.449 58 3HG2 THR 10 HG23 THR 10 17.495 63.068 4.262 59 HA PRO 11 HA PRO 11 13.041 64.392 -1.312 60 1HB PRO 11 HB1 PRO 11 10.547 64.370 -0.270 61 2HB PRO 11 HB2 PRO 11 11.248 62.968 -1.086 62 1HG PRO 11 HG2 PRO 11 11.017 63.538 1.846 63 2HG PRO 11 HG1 PRO 11 10.709 62.024 0.975 64 1HD PRO 11 HD2 PRO 11 13.015 62.503 2.327 65 2HD PRO 11 HD1 PRO 11 12.944 61.480 0.877 66 H ALA 12 HN ALA 12 13.691 66.476 -1.222 67 HA ALA 12 HA ALA 12 13.143 68.113 1.109 68 1HB ALA 12 HB1 ALA 12 14.873 68.298 -1.251 69 2HB ALA 12 HB2 ALA 12 15.138 68.857 0.400 70 3HB ALA 12 HB3 ALA 12 14.185 69.831 -0.719 71 H VAL 13 HN VAL 13 11.931 67.654 -2.133 72 HA VAL 13 HA VAL 13 10.094 69.920 -1.799 73 HB VAL 13 HB VAL 13 11.392 69.924 -3.876 74 1HG1 VAL 13 HG21 VAL 13 10.834 67.156 -3.858 75 2HG1 VAL 13 HG22 VAL 13 11.812 68.065 -5.010 76 3HG1 VAL 13 HG23 VAL 13 10.089 67.830 -5.308 77 1HG2 VAL 13 HG11 VAL 13 8.498 69.308 -4.447 78 2HG2 VAL 13 HG12 VAL 13 9.585 70.322 -5.396 79 3HG2 VAL 13 HG13 VAL 13 9.076 70.838 -3.789 80 H ARG 14 HN ARG 14 7.884 69.664 -1.906 81 HA ARG 14 HA ARG 14 6.855 67.137 -1.082 82 1HB ARG 14 HB2 ARG 14 5.301 69.563 -1.994 83 2HB ARG 14 HB1 ARG 14 4.701 68.236 -1.010 84 1HG ARG 14 HG1 ARG 14 6.875 69.160 0.414 85 2HG ARG 14 HG2 ARG 14 6.137 70.629 -0.230 86 1HD ARG 14 HD2 ARG 14 3.951 69.854 0.656 87 2HD ARG 14 HD1 ARG 14 4.780 68.488 1.402 88 HE ARG 14 HE ARG 14 5.538 69.886 3.047 89 1HH1 ARG 14 HH11 ARG 14 4.352 71.799 0.386 90 2HH1 ARG 14 HH12 ARG 14 4.473 73.299 1.242 91 1HH2 ARG 14 HH21 ARG 14 5.700 71.858 4.181 92 2HH2 ARG 14 HH22 ARG 14 5.239 73.334 3.399 93 H THR 15 HN THR 15 6.362 65.484 -2.344 94 HA THR 15 HA THR 15 5.672 66.011 -5.158 95 HB THR 15 HB THR 15 6.307 63.508 -5.390 96 HG1 THR 15 HG1 THR 15 7.926 64.002 -3.158 97 1HG2 THR 15 HG21 THR 15 7.916 65.856 -5.458 98 2HG2 THR 15 HG22 THR 15 8.061 64.374 -6.404 99 3HG2 THR 15 HG23 THR 15 8.872 64.508 -4.843 100 H VAL 16 HN VAL 16 3.595 65.785 -5.624 101 HA VAL 16 HA VAL 16 1.858 64.259 -3.866 102 HB VAL 16 HB VAL 16 0.982 65.725 -6.342 103 1HG1 VAL 16 HG11 VAL 16 -0.951 64.803 -5.698 104 2HG1 VAL 16 HG12 VAL 16 -0.936 66.000 -4.403 105 3HG1 VAL 16 HG13 VAL 16 -0.320 64.374 -4.108 106 1HG2 VAL 16 HG21 VAL 16 1.073 66.950 -3.601 107 2HG2 VAL 16 HG22 VAL 16 0.773 67.739 -5.150 108 3HG2 VAL 16 HG23 VAL 16 2.387 67.144 -4.761 109 HA PRO 17 HA PRO 17 1.088 62.010 -8.161 110 1HB PRO 17 HB1 PRO 17 3.718 62.491 -9.441 111 2HB PRO 17 HB2 PRO 17 2.104 62.473 -10.157 112 1HG PRO 17 HG1 PRO 17 3.407 64.769 -9.785 113 2HG PRO 17 HG2 PRO 17 1.655 64.658 -9.524 114 1HD PRO 17 HD2 PRO 17 3.873 64.700 -7.514 115 2HD PRO 17 HD1 PRO 17 2.287 65.497 -7.458 116 H GLN 18 HN GLN 18 1.244 59.956 -7.549 117 HA GLN 18 HA GLN 18 3.490 58.946 -6.109 118 1HB GLN 18 HB2 GLN 18 2.257 56.758 -6.282 119 2HB GLN 18 HB1 GLN 18 1.342 58.070 -5.551 120 1HG GLN 18 HG1 GLN 18 0.237 58.450 -7.736 121 2HG GLN 18 HG2 GLN 18 1.079 57.033 -8.362 122 1HE2 GLN 18 HE21 GLN 18 0.485 54.990 -7.651 123 2HE2 GLN 18 HE22 GLN 18 -1.007 54.698 -6.829 124 H TYR 19 HN TYR 19 4.159 56.550 -6.881 125 HA TYR 19 HA TYR 19 5.728 56.982 -9.236 126 1HB TYR 19 HB1 TYR 19 5.392 54.357 -7.784 127 2HB TYR 19 HB2 TYR 19 6.769 54.902 -8.737 128 HD1 TYR 19 HD1 TYR 19 8.148 56.847 -7.838 129 HD2 TYR 19 HD2 TYR 19 5.313 54.736 -5.471 130 HE1 TYR 19 HE1 TYR 19 9.230 57.693 -5.799 131 HE2 TYR 19 HE2 TYR 19 6.388 55.576 -3.424 132 HH TYR 19 HH TYR 19 9.165 57.784 -3.580 133 H LYS 20 HN LYS 20 4.056 57.287 -10.810 134 HA LYS 20 HA LYS 20 2.567 54.866 -11.543 135 1HB LYS 20 HB2 LYS 20 1.664 57.407 -11.301 136 2HB LYS 20 HB1 LYS 20 2.075 57.387 -13.010 137 1HG LYS 20 HG2 LYS 20 0.690 55.013 -12.590 138 2HG LYS 20 HG1 LYS 20 -0.180 56.223 -11.644 139 1HD LYS 20 HD2 LYS 20 0.627 57.088 -14.336 140 2HD LYS 20 HD1 LYS 20 -0.562 55.783 -14.294 141 1HE LYS 20 HE2 LYS 20 -2.187 57.161 -13.646 142 2HE LYS 20 HE1 LYS 20 -1.182 57.870 -12.383 143 1HZ LYS 20 HZ1 LYS 20 -1.811 58.879 -14.988 144 2HZ LYS 20 HZ2 LYS 20 -0.147 58.889 -14.682 145 3HZ LYS 20 HZ3 LYS 20 -1.205 59.692 -13.635 146 H TYR 21 HN TYR 21 2.381 54.358 -13.860 147 HA TYR 21 HA TYR 21 4.996 54.511 -15.114 148 1HB TYR 21 HB2 TYR 21 2.793 52.658 -15.127 149 2HB TYR 21 HB1 TYR 21 3.207 53.102 -16.781 150 HD1 TYR 21 HD1 TYR 21 5.171 52.272 -17.813 151 HD2 TYR 21 HD2 TYR 21 4.559 51.675 -13.646 152 HE1 TYR 21 HE1 TYR 21 7.060 50.698 -17.767 153 HE2 TYR 21 HE2 TYR 21 6.445 50.099 -13.588 154 HH TYR 21 HH TYR 21 8.114 49.181 -14.736 155 H ALA 22 HN ALA 22 4.631 54.453 -17.730 156 HA ALA 22 HA ALA 22 3.662 57.133 -18.318 157 1HB ALA 22 HB1 ALA 22 4.688 55.835 -20.634 158 2HB ALA 22 HB2 ALA 22 5.770 55.514 -19.279 159 3HB ALA 22 HB3 ALA 22 5.378 57.176 -19.720 160 H ALA 23 HN ALA 23 3.374 53.961 -19.935 161 HA ALA 23 HA ALA 23 1.169 54.720 -21.527 162 1HB ALA 23 HB1 ALA 23 2.879 52.593 -21.485 163 2HB ALA 23 HB2 ALA 23 1.432 52.716 -22.486 164 3HB ALA 23 HB3 ALA 23 1.368 51.863 -20.943 165 H GLY 24 HN GLY 24 -0.984 53.607 -21.445 166 1HA GLY 24 HA1 GLY 24 -2.108 53.978 -18.797 167 2HA GLY 24 HA2 GLY 24 -3.003 53.701 -20.284 168 H VAL 25 HN VAL 25 -0.412 51.761 -18.836 169 HA VAL 25 HA VAL 25 -2.201 49.441 -18.925 170 HB VAL 25 HB VAL 25 0.737 49.313 -18.315 171 1HG1 VAL 25 HG21 VAL 25 0.377 47.093 -19.548 172 2HG1 VAL 25 HG22 VAL 25 -1.344 47.406 -19.327 173 3HG1 VAL 25 HG23 VAL 25 -0.289 47.253 -17.922 174 1HG2 VAL 25 HG11 VAL 25 0.174 50.618 -20.464 175 2HG2 VAL 25 HG12 VAL 25 -0.329 49.053 -21.103 176 3HG2 VAL 25 HG13 VAL 25 1.333 49.293 -20.565 177 H ARG 26 HN ARG 26 -2.919 48.447 -17.141 178 HA ARG 26 HA ARG 26 -2.187 49.587 -14.557 179 1HB ARG 26 HB2 ARG 26 -4.248 47.449 -14.809 180 2HB ARG 26 HB1 ARG 26 -4.217 48.856 -13.758 181 1HG ARG 26 HG2 ARG 26 -5.076 50.253 -15.372 182 2HG ARG 26 HG1 ARG 26 -4.524 49.230 -16.700 183 1HD ARG 26 HD1 ARG 26 -6.190 47.510 -15.911 184 2HD ARG 26 HD2 ARG 26 -6.835 48.747 -14.834 185 HE ARG 26 HE ARG 26 -6.738 49.772 -17.446 186 1HH1 ARG 26 HH11 ARG 26 -8.457 47.393 -15.566 187 2HH1 ARG 26 HH12 ARG 26 -9.901 47.499 -16.514 188 1HH2 ARG 26 HH21 ARG 26 -8.638 49.918 -18.700 189 2HH2 ARG 26 HH22 ARG 26 -10.005 48.933 -18.295 190 H ASN 27 HN ASN 27 -0.533 48.688 -13.527 191 HA ASN 27 HA ASN 27 0.223 45.940 -14.017 192 1HB ASN 27 HB2 ASN 27 1.431 47.927 -12.082 193 2HB ASN 27 HB1 ASN 27 2.159 46.421 -12.635 194 1HD2 ASN 27 HD21 ASN 27 2.686 46.249 -14.904 195 2HD2 ASN 27 HD22 ASN 27 3.125 47.670 -15.782 196 HA PRO 28 HA PRO 28 -2.369 44.692 -10.535 197 1HB PRO 28 HB1 PRO 28 -2.190 42.033 -10.974 198 2HB PRO 28 HB2 PRO 28 -3.242 43.082 -11.931 199 1HG PRO 28 HG2 PRO 28 -0.520 42.018 -12.588 200 2HG PRO 28 HG1 PRO 28 -1.957 42.123 -13.621 201 1HD PRO 28 HD1 PRO 28 0.075 43.921 -13.736 202 2HD PRO 28 HD2 PRO 28 -1.611 44.351 -14.087 203 H GLN 29 HN GLN 29 -0.597 45.516 -9.151 204 HA GLN 29 HA GLN 29 1.353 43.502 -8.320 205 1HB GLN 29 HB1 GLN 29 1.436 46.300 -8.553 206 2HB GLN 29 HB2 GLN 29 1.470 45.972 -6.825 207 1HG GLN 29 HG1 GLN 29 3.438 44.695 -7.000 208 2HG GLN 29 HG2 GLN 29 3.306 44.595 -8.756 209 1HE2 GLN 29 HE21 GLN 29 3.090 47.309 -6.486 210 2HE2 GLN 29 HE22 GLN 29 4.338 48.249 -7.224 211 H GLN 30 HN GLN 30 -0.561 42.250 -7.477 212 HA GLN 30 HA GLN 30 -1.901 43.187 -5.137 213 1HB GLN 30 HB1 GLN 30 -2.413 41.215 -6.916 214 2HB GLN 30 HB2 GLN 30 -1.716 40.270 -5.607 215 1HG GLN 30 HG1 GLN 30 -3.869 40.206 -4.944 216 2HG GLN 30 HG2 GLN 30 -3.418 41.729 -4.180 217 1HE2 GLN 30 HE21 GLN 30 -4.308 40.756 -7.477 218 2HE2 GLN 30 HE22 GLN 30 -5.543 41.948 -7.677 219 H HIS 31 HN HIS 31 -1.786 42.044 -3.032 220 HA HIS 31 HA HIS 31 1.022 41.489 -2.348 221 1HB HIS 31 HB1 HIS 31 0.038 41.937 0.053 222 2HB HIS 31 HB2 HIS 31 0.451 43.281 -1.007 223 HD2 HIS 31 HD2 HIS 31 -2.661 41.582 0.571 224 HE1 HIS 31 HE1 HIS 31 -3.883 45.090 -1.458 225 HE2 HIS 31 HE2 HIS 31 -4.614 43.226 0.098 226 H LEU 32 HN LEU 32 0.366 39.299 -3.302 227 HA LEU 32 HA LEU 32 -1.123 37.636 -1.422 228 1HB LEU 32 HB1 LEU 32 -1.525 37.496 -3.887 229 2HB LEU 32 HB2 LEU 32 0.103 36.873 -4.073 230 HG LEU 32 HG LEU 32 -0.689 35.040 -2.387 231 1HD1 LEU 32 HD21 LEU 32 -3.221 34.643 -3.111 232 2HD1 LEU 32 HD22 LEU 32 -3.201 36.407 -3.152 233 3HD1 LEU 32 HD23 LEU 32 -2.776 35.554 -1.668 234 1HD2 LEU 32 HD11 LEU 32 -0.867 33.644 -4.160 235 2HD2 LEU 32 HD12 LEU 32 -0.278 35.063 -5.026 236 3HD2 LEU 32 HD13 LEU 32 -2.002 34.690 -5.012 237 H ASN 33 HN ASN 33 2.118 38.039 -2.734 238 HA ASN 33 HA ASN 33 3.186 35.738 -1.391 239 1HB ASN 33 HB1 ASN 33 5.377 36.610 -2.152 240 2HB ASN 33 HB2 ASN 33 4.206 36.509 -3.463 241 1HD2 ASN 33 HD21 ASN 33 3.399 38.380 -4.374 242 2HD2 ASN 33 HD22 ASN 33 4.121 39.927 -4.107 243 H ALA 34 HN ALA 34 2.759 39.105 -0.655 244 HA ALA 34 HA ALA 34 4.556 39.028 1.624 245 1HB ALA 34 HB1 ALA 34 3.493 41.384 1.958 246 2HB ALA 34 HB2 ALA 34 2.905 41.142 0.312 247 3HB ALA 34 HB3 ALA 34 4.638 41.112 0.644 248 H GLN 35 HN GLN 35 3.659 37.531 3.029 249 HA GLN 35 HA GLN 35 0.920 37.989 3.954 250 1HB GLN 35 HB2 GLN 35 2.842 35.711 4.464 251 2HB GLN 35 HB1 GLN 35 1.219 35.811 5.133 252 1HG GLN 35 HG1 GLN 35 0.453 36.006 2.685 253 2HG GLN 35 HG2 GLN 35 2.061 35.397 2.293 254 1HE2 GLN 35 HE21 GLN 35 0.360 33.785 1.378 255 2HE2 GLN 35 HE22 GLN 35 0.047 32.416 2.383 256 HA PRO 36 HA PRO 36 2.457 39.979 7.618 257 1HB PRO 36 HB1 PRO 36 0.181 40.020 9.059 258 2HB PRO 36 HB2 PRO 36 0.413 41.049 7.641 259 1HG PRO 36 HG2 PRO 36 -1.073 38.462 7.885 260 2HG PRO 36 HG1 PRO 36 -1.538 39.942 7.026 261 1HD PRO 36 HD1 PRO 36 -0.461 37.761 5.787 262 2HD PRO 36 HD2 PRO 36 -0.269 39.420 5.187 263 H GLN 37 HN GLN 37 1.297 39.441 10.166 264 HA GLN 37 HA GLN 37 2.655 36.929 10.766 265 1HB GLN 37 HB2 GLN 37 2.269 37.723 13.175 266 2HB GLN 37 HB1 GLN 37 3.396 38.644 12.187 267 1HG GLN 37 HG2 GLN 37 2.139 40.491 12.256 268 2HG GLN 37 HG1 GLN 37 0.633 39.596 12.063 269 1HE2 GLN 37 HE22 GLN 37 -0.425 40.770 13.639 270 2HE2 GLN 37 HE21 GLN 37 -0.077 40.594 15.322 271 H VAL 38 HN VAL 38 0.590 36.072 9.540 272 HA VAL 38 HA VAL 38 -1.583 35.626 11.467 273 HB VAL 38 HB VAL 38 -2.686 34.568 9.359 274 1HG1 VAL 38 HG21 VAL 38 -2.471 37.487 8.987 275 2HG1 VAL 38 HG22 VAL 38 -2.951 36.939 10.593 276 3HG1 VAL 38 HG23 VAL 38 -3.896 36.467 9.182 277 1HG2 VAL 38 HG11 VAL 38 -1.953 35.624 7.254 278 2HG2 VAL 38 HG12 VAL 38 -0.732 34.548 7.934 279 3HG2 VAL 38 HG13 VAL 38 -0.560 36.296 8.101 280 H THR 39 HN THR 39 0.876 34.286 11.855 281 HA THR 39 HA THR 39 0.615 31.598 10.831 282 HB THR 39 HB THR 39 2.477 32.557 13.005 283 HG1 THR 39 HG1 THR 39 2.403 33.289 10.427 284 1HG2 THR 39 HG21 THR 39 2.202 30.078 11.535 285 2HG2 THR 39 HG22 THR 39 3.129 30.441 12.990 286 3HG2 THR 39 HG23 THR 39 3.816 30.777 11.401 287 H MET 40 HN MET 40 -0.436 33.365 13.583 288 HA MET 40 HA MET 40 -0.857 30.998 15.211 289 1HB MET 40 HB2 MET 40 -0.270 33.499 15.931 290 2HB MET 40 HB1 MET 40 -2.023 33.634 15.960 291 1HG MET 40 HG2 MET 40 -1.870 32.891 18.048 292 2HG MET 40 HG1 MET 40 -1.606 31.307 17.323 293 1HE MET 40 HE1 MET 40 0.100 33.485 20.172 294 2HE MET 40 HE2 MET 40 -0.305 34.431 18.740 295 3HE MET 40 HE3 MET 40 1.385 34.164 19.171 296 H GLN 41 HN GLN 41 -2.376 32.161 12.612 297 HA GLN 41 HA GLN 41 -4.805 30.771 13.172 298 1HB GLN 41 HB1 GLN 41 -5.040 33.109 14.260 299 2HB GLN 41 HB2 GLN 41 -5.184 33.701 12.611 300 1HG GLN 41 HG2 GLN 41 -7.381 33.417 13.252 301 2HG GLN 41 HG1 GLN 41 -7.036 31.928 12.373 302 1HE2 GLN 41 HE21 GLN 41 -8.612 30.753 13.415 303 2HE2 GLN 41 HE22 GLN 41 -8.486 30.282 15.073 304 H GLN 42 HN GLN 42 -4.622 29.633 11.321 305 HA GLN 42 HA GLN 42 -5.074 31.069 8.832 306 1HB GLN 42 HB2 GLN 42 -3.287 29.440 7.796 307 2HB GLN 42 HB1 GLN 42 -2.795 30.969 8.509 308 1HG GLN 42 HG2 GLN 42 -1.975 29.933 10.442 309 2HG GLN 42 HG1 GLN 42 -2.813 28.423 10.088 310 1HE2 GLN 42 HE21 GLN 42 -0.473 30.592 8.524 311 2HE2 GLN 42 HE22 GLN 42 0.576 29.336 7.970 312 HA PRO 43 HA PRO 43 -8.003 27.811 8.207 313 1HB PRO 43 HB1 PRO 43 -7.271 28.124 5.337 314 2HB PRO 43 HB2 PRO 43 -8.862 28.161 6.103 315 1HG PRO 43 HG2 PRO 43 -7.700 30.411 5.285 316 2HG PRO 43 HG1 PRO 43 -8.616 30.362 6.803 317 1HD PRO 43 HD1 PRO 43 -5.661 30.381 6.370 318 2HD PRO 43 HD2 PRO 43 -6.621 31.164 7.641 319 H ALA 44 HN ALA 44 -7.589 25.737 8.586 320 HA ALA 44 HA ALA 44 -5.170 24.504 7.547 321 1HB ALA 44 HB1 ALA 44 -5.287 23.098 9.297 322 2HB ALA 44 HB2 ALA 44 -7.023 22.851 9.115 323 3HB ALA 44 HB3 ALA 44 -6.420 24.287 9.941 324 H VAL 45 HN VAL 45 -5.163 23.469 5.674 325 HA VAL 45 HA VAL 45 -7.636 22.677 4.402 326 HB VAL 45 HB VAL 45 -4.855 22.160 3.369 327 1HG1 VAL 45 HG21 VAL 45 -6.067 21.127 1.796 328 2HG1 VAL 45 HG22 VAL 45 -6.489 22.751 1.254 329 3HG1 VAL 45 HG23 VAL 45 -7.571 21.874 2.335 330 1HG2 VAL 45 HG11 VAL 45 -5.051 24.302 2.161 331 2HG2 VAL 45 HG12 VAL 45 -4.981 24.513 3.910 332 3HG2 VAL 45 HG13 VAL 45 -6.523 24.654 3.066 333 H HIS 46 HN HIS 46 -8.540 20.876 5.211 334 HA HIS 46 HA HIS 46 -6.823 18.529 5.650 335 1HB HIS 46 HB2 HIS 46 -9.263 19.553 6.977 336 2HB HIS 46 HB1 HIS 46 -9.181 17.808 6.765 337 HD2 HIS 46 HD2 HIS 46 -7.538 16.478 8.471 338 HE1 HIS 46 HE1 HIS 46 -5.946 19.919 10.354 339 HE2 HIS 46 HE2 HIS 46 -6.066 17.385 10.406 340 H VAL 47 HN VAL 47 -7.110 18.753 3.100 341 HA VAL 47 HA VAL 47 -9.547 17.474 2.164 342 HB VAL 47 HB VAL 47 -8.505 19.337 0.881 343 1HG1 VAL 47 HG11 VAL 47 -6.353 19.339 0.342 344 2HG1 VAL 47 HG12 VAL 47 -6.521 17.798 -0.499 345 3HG1 VAL 47 HG13 VAL 47 -6.164 17.826 1.228 346 1HG2 VAL 47 HG21 VAL 47 -8.938 16.655 -0.383 347 2HG2 VAL 47 HG22 VAL 47 -8.558 18.076 -1.355 348 3HG2 VAL 47 HG23 VAL 47 -10.009 18.055 -0.355 349 H GLN 48 HN GLN 48 -9.644 15.467 1.160 350 HA GLN 48 HA GLN 48 -7.588 13.596 2.020 351 1HB GLN 48 HB1 GLN 48 -9.211 11.865 1.290 352 2HB GLN 48 HB2 GLN 48 -9.876 12.977 2.479 353 1HG GLN 48 HG2 GLN 48 -11.304 13.953 0.978 354 2HG GLN 48 HG1 GLN 48 -10.298 13.545 -0.411 355 1HE2 GLN 48 HE22 GLN 48 -12.499 12.228 1.992 356 2HE2 GLN 48 HE21 GLN 48 -13.018 10.878 1.046 357 H GLY 49 HN GLY 49 -7.990 15.495 -0.604 358 1HA GLY 49 HA2 GLY 49 -7.266 13.525 -2.623 359 2HA GLY 49 HA1 GLY 49 -7.557 15.236 -2.894 360 H GLN 50 HN GLN 50 -5.476 14.476 -0.284 361 HA GLN 50 HA GLN 50 -3.207 15.499 -1.822 362 1HB GLN 50 HB2 GLN 50 -3.964 15.464 1.050 363 2HB GLN 50 HB1 GLN 50 -2.247 15.384 0.683 364 1HG GLN 50 HG2 GLN 50 -2.512 17.433 -0.700 365 2HG GLN 50 HG1 GLN 50 -4.178 17.539 -0.135 366 1HE2 GLN 50 HE21 GLN 50 -0.843 17.359 1.023 367 2HE2 GLN 50 HE22 GLN 50 -1.089 18.345 2.421 368 H GLU 51 HN GLU 51 -1.016 14.566 -1.040 369 HA GLU 51 HA GLU 51 -1.027 11.780 -1.702 370 1HB GLU 51 HB1 GLU 51 1.485 12.031 -1.257 371 2HB GLU 51 HB2 GLU 51 0.798 12.972 -2.574 372 1HG GLU 51 HG1 GLU 51 0.573 14.831 -0.775 373 2HG GLU 51 HG2 GLU 51 1.779 13.881 0.092 374 HA PRO 52 HA PRO 52 -1.616 10.348 2.503 375 1HB PRO 52 HB2 PRO 52 -0.617 7.816 1.319 376 2HB PRO 52 HB1 PRO 52 -2.098 8.126 2.231 377 1HG PRO 52 HG1 PRO 52 -2.177 7.742 -0.405 378 2HG PRO 52 HG2 PRO 52 -3.227 8.941 0.375 379 1HD PRO 52 HD1 PRO 52 -0.709 9.354 -1.189 380 2HD PRO 52 HD2 PRO 52 -2.203 10.314 -1.182 381 H LEU 53 HN LEU 53 -0.283 9.011 4.078 382 HA LEU 53 HA LEU 53 2.407 10.043 4.073 383 1HB LEU 53 HB2 LEU 53 0.572 9.374 6.033 384 2HB LEU 53 HB1 LEU 53 1.772 8.100 6.152 385 HG LEU 53 HG LEU 53 3.149 10.592 5.969 386 1HD1 LEU 53 HD21 LEU 53 1.842 10.939 8.469 387 2HD1 LEU 53 HD22 LEU 53 0.622 10.901 7.196 388 3HD1 LEU 53 HD23 LEU 53 1.949 12.059 7.112 389 1HD2 LEU 53 HD11 LEU 53 2.811 8.984 8.473 390 2HD2 LEU 53 HD12 LEU 53 4.233 9.847 7.883 391 3HD2 LEU 53 HD13 LEU 53 3.721 8.351 7.100 392 H THR 54 HN THR 54 4.306 8.890 4.012 393 HA THR 54 HA THR 54 4.403 6.049 3.885 394 HB THR 54 HB THR 54 5.532 6.899 1.365 395 HG1 THR 54 HG1 THR 54 3.914 7.880 0.456 396 1HG2 THR 54 HG21 THR 54 3.835 5.196 0.507 397 2HG2 THR 54 HG22 THR 54 3.491 4.886 2.208 398 3HG2 THR 54 HG23 THR 54 5.117 4.625 1.576 399 H ALA 55 HN ALA 55 6.794 5.670 2.578 400 HA ALA 55 HA ALA 55 8.669 6.423 4.488 401 1HB ALA 55 HB1 ALA 55 9.282 5.711 1.629 402 2HB ALA 55 HB2 ALA 55 8.907 4.537 2.891 403 3HB ALA 55 HB3 ALA 55 10.347 5.547 3.025 404 H SER 56 HN SER 56 7.770 7.971 1.454 405 HA SER 56 HA SER 56 9.857 9.849 1.329 406 1HB SER 56 HB1 SER 56 7.034 10.349 0.375 407 2HB SER 56 HB2 SER 56 8.533 11.011 -0.276 408 HG SER 56 HG SER 56 7.954 9.362 -1.615 409 H MET 57 HN MET 57 6.670 9.966 2.865 410 HA MET 57 HA MET 57 6.804 12.628 3.785 411 1HB MET 57 HB1 MET 57 5.291 10.195 4.709 412 2HB MET 57 HB2 MET 57 5.169 11.722 5.566 413 1HG MET 57 HG1 MET 57 3.500 10.976 3.619 414 2HG MET 57 HG2 MET 57 3.871 12.658 3.992 415 1HE MET 57 HE1 MET 57 4.998 9.587 2.059 416 2HE MET 57 HE2 MET 57 5.356 10.186 0.439 417 3HE MET 57 HE3 MET 57 3.688 10.128 1.010 418 H LEU 58 HN LEU 58 7.806 9.555 5.175 419 HA LEU 58 HA LEU 58 8.548 10.436 7.725 420 1HB LEU 58 HB1 LEU 58 9.452 8.174 5.966 421 2HB LEU 58 HB2 LEU 58 10.187 8.437 7.535 422 HG LEU 58 HG LEU 58 8.537 7.340 8.551 423 1HD1 LEU 58 HD11 LEU 58 7.208 9.436 8.481 424 2HD1 LEU 58 HD12 LEU 58 6.225 7.972 8.468 425 3HD1 LEU 58 HD13 LEU 58 6.478 8.877 6.975 426 1HD2 LEU 58 HD21 LEU 58 7.118 6.866 5.966 427 2HD2 LEU 58 HD22 LEU 58 7.387 5.764 7.317 428 3HD2 LEU 58 HD23 LEU 58 8.723 6.182 6.241 429 H ALA 59 HN ALA 59 10.408 10.155 4.729 430 HA ALA 59 HA ALA 59 12.856 11.086 5.818 431 1HB ALA 59 HB1 ALA 59 13.215 11.584 3.229 432 2HB ALA 59 HB2 ALA 59 11.806 10.530 3.106 433 3HB ALA 59 HB3 ALA 59 13.274 9.953 3.897 434 H SER 60 HN SER 60 9.990 12.699 5.068 435 HA SER 60 HA SER 60 11.126 15.203 4.248 436 1HB SER 60 HB1 SER 60 8.825 14.514 3.613 437 2HB SER 60 HB2 SER 60 8.347 14.628 5.306 438 HG SER 60 HG SER 60 8.151 16.531 3.661 439 H ALA 61 HN ALA 61 10.972 13.612 7.177 440 HA ALA 61 HA ALA 61 11.448 16.114 8.632 441 1HB ALA 61 HB1 ALA 61 9.227 15.483 9.245 442 2HB ALA 61 HB2 ALA 61 10.288 15.084 10.595 443 3HB ALA 61 HB3 ALA 61 9.717 13.810 9.517 444 HA PRO 62 HA PRO 62 15.275 14.023 9.697 445 1HB PRO 62 HB2 PRO 62 15.131 15.895 12.010 446 2HB PRO 62 HB1 PRO 62 16.438 15.649 10.847 447 1HG PRO 62 HG1 PRO 62 14.926 17.823 10.718 448 2HG PRO 62 HG2 PRO 62 15.425 16.986 9.235 449 1HD PRO 62 HD1 PRO 62 12.790 16.913 10.659 450 2HD PRO 62 HD2 PRO 62 13.125 17.006 8.918 451 HA PRO 63 HA PRO 63 14.835 11.229 13.247 452 1HB PRO 63 HB2 PRO 63 15.785 13.295 15.200 453 2HB PRO 63 HB1 PRO 63 16.179 11.574 15.109 454 1HG PRO 63 HG1 PRO 63 17.884 13.400 14.195 455 2HG PRO 63 HG2 PRO 63 17.643 11.871 13.332 456 1HD PRO 63 HD2 PRO 63 16.733 14.604 12.626 457 2HD PRO 63 HD1 PRO 63 17.116 13.232 11.569 458 H GLN 64 HN GLN 64 13.511 14.379 13.290 459 HA GLN 64 HA GLN 64 11.865 14.666 15.412 460 1HB GLN 64 HB2 GLN 64 11.649 15.279 12.505 461 2HB GLN 64 HB1 GLN 64 10.159 15.370 13.437 462 1HG GLN 64 HG1 GLN 64 10.959 17.075 14.792 463 2HG GLN 64 HG2 GLN 64 12.634 16.776 14.337 464 1HE2 GLN 64 HE21 GLN 64 9.545 17.563 12.775 465 2HE2 GLN 64 HE22 GLN 64 10.195 18.754 11.705 466 H GLU 65 HN GLU 65 10.213 13.635 12.538 467 HA GLU 65 HA GLU 65 8.736 11.648 14.118 468 1HB GLU 65 HB1 GLU 65 7.647 12.308 11.486 469 2HB GLU 65 HB2 GLU 65 6.857 12.291 13.057 470 1HG GLU 65 HG1 GLU 65 8.730 14.508 12.432 471 2HG GLU 65 HG2 GLU 65 7.138 14.508 11.676 472 H GLN 66 HN GLN 66 11.334 11.593 12.291 473 HA GLN 66 HA GLN 66 10.872 9.811 10.189 474 1HB GLN 66 HB2 GLN 66 13.119 10.981 11.459 475 2HB GLN 66 HB1 GLN 66 13.406 9.247 11.403 476 1HG GLN 66 HG1 GLN 66 12.538 9.650 8.895 477 2HG GLN 66 HG2 GLN 66 13.268 11.219 9.231 478 1HE2 GLN 66 HE22 GLN 66 15.466 10.916 10.460 479 2HE2 GLN 66 HE21 GLN 66 16.554 9.807 9.704 480 H LYS 67 HN LYS 67 10.986 9.327 13.589 481 HA LYS 67 HA LYS 67 10.565 6.443 13.181 482 1HB LYS 67 HB2 LYS 67 11.850 5.944 15.173 483 2HB LYS 67 HB1 LYS 67 12.844 6.874 14.060 484 1HG LYS 67 HG2 LYS 67 13.270 8.314 15.680 485 2HG LYS 67 HG1 LYS 67 11.556 8.730 15.741 486 1HD LYS 67 HD1 LYS 67 12.137 8.079 17.933 487 2HD LYS 67 HD2 LYS 67 11.260 6.711 17.243 488 1HE LYS 67 HE2 LYS 67 13.338 5.566 16.782 489 2HE LYS 67 HE1 LYS 67 14.261 6.956 17.352 490 1HZ LYS 67 HZ1 LYS 67 14.252 5.905 19.303 491 2HZ LYS 67 HZ2 LYS 67 13.008 4.852 18.853 492 3HZ LYS 67 HZ3 LYS 67 12.638 6.393 19.445 493 H GLN 68 HN GLN 68 8.752 8.792 13.599 494 HA GLN 68 HA GLN 68 7.358 7.740 15.968 495 1HB GLN 68 HB2 GLN 68 8.416 9.904 16.485 496 2HB GLN 68 HB1 GLN 68 7.552 10.643 15.146 497 1HG GLN 68 HG1 GLN 68 5.479 10.433 16.223 498 2HG GLN 68 HG2 GLN 68 6.121 9.300 17.413 499 1HE2 GLN 68 HE21 GLN 68 6.054 10.237 19.324 500 2HE2 GLN 68 HE22 GLN 68 6.571 11.845 19.687 501 H MET 69 HN MET 69 6.806 9.920 13.180 502 HA MET 69 HA MET 69 4.015 9.387 13.147 503 1HB MET 69 HB2 MET 69 3.907 10.837 11.273 504 2HB MET 69 HB1 MET 69 5.136 11.492 12.346 505 1HG MET 69 HG2 MET 69 6.820 11.106 10.888 506 2HG MET 69 HG1 MET 69 6.067 9.652 10.231 507 1HE MET 69 HE1 MET 69 7.112 13.089 9.618 508 2HE MET 69 HE2 MET 69 6.541 13.292 7.961 509 3HE MET 69 HE3 MET 69 7.556 11.912 8.382 510 H LEU 70 HN LEU 70 6.017 7.102 12.650 511 HA LEU 70 HA LEU 70 5.183 6.190 10.010 512 1HB LEU 70 HB1 LEU 70 6.538 4.101 11.260 513 2HB LEU 70 HB2 LEU 70 7.187 5.221 10.079 514 HG LEU 70 HG LEU 70 7.237 5.758 13.041 515 1HD1 LEU 70 HD11 LEU 70 9.410 4.558 11.333 516 2HD1 LEU 70 HD12 LEU 70 8.481 3.704 12.564 517 3HD1 LEU 70 HD13 LEU 70 9.553 5.025 13.028 518 1HD2 LEU 70 HD21 LEU 70 9.224 7.180 12.120 519 2HD2 LEU 70 HD22 LEU 70 7.566 7.774 12.014 520 3HD2 LEU 70 HD23 LEU 70 8.340 7.055 10.601 521 H GLY 71 HN GLY 71 4.729 5.408 13.408 522 1HA GLY 71 HA2 GLY 71 2.464 3.716 12.602 523 2HA GLY 71 HA1 GLY 71 3.582 3.170 13.838 524 H GLU 72 HN GLU 72 2.989 6.548 13.809 525 HA GLU 72 HA GLU 72 0.898 6.237 15.851 526 1HB GLU 72 HB2 GLU 72 2.072 7.267 17.487 527 2HB GLU 72 HB1 GLU 72 3.455 6.718 16.553 528 1HG GLU 72 HG2 GLU 72 4.093 8.791 16.075 529 2HG GLU 72 HG1 GLU 72 2.457 9.297 15.659 530 H ARG 73 HN ARG 73 1.937 7.825 13.065 531 HA ARG 73 HA ARG 73 -0.152 9.866 13.452 532 1HB ARG 73 HB1 ARG 73 2.453 10.499 13.313 533 2HB ARG 73 HB2 ARG 73 2.083 10.459 11.595 534 1HG ARG 73 HG1 ARG 73 0.164 11.948 13.246 535 2HG ARG 73 HG2 ARG 73 1.791 12.630 13.175 536 1HD ARG 73 HD2 ARG 73 1.699 12.601 10.733 537 2HD ARG 73 HD1 ARG 73 0.077 11.912 10.800 538 HE ARG 73 HE ARG 73 0.795 14.624 11.702 539 1HH1 ARG 73 HH12 ARG 73 -1.525 12.303 10.529 540 2HH1 ARG 73 HH11 ARG 73 -2.795 13.468 10.356 541 1HH2 ARG 73 HH21 ARG 73 -0.871 16.164 11.477 542 2HH2 ARG 73 HH22 ARG 73 -2.423 15.663 10.895 543 H LEU 74 HN LEU 74 1.056 7.307 11.599 544 HA LEU 74 HA LEU 74 -0.094 8.053 9.082 545 1HB LEU 74 HB1 LEU 74 1.465 5.868 10.167 546 2HB LEU 74 HB2 LEU 74 0.176 5.278 9.135 547 HG LEU 74 HG LEU 74 1.747 7.515 8.049 548 1HD1 LEU 74 HD11 LEU 74 3.736 6.441 7.726 549 2HD1 LEU 74 HD12 LEU 74 3.021 4.836 7.887 550 3HD1 LEU 74 HD13 LEU 74 3.296 5.827 9.321 551 1HD2 LEU 74 HD21 LEU 74 1.495 6.276 6.005 552 2HD2 LEU 74 HD22 LEU 74 -0.059 6.332 6.837 553 3HD2 LEU 74 HD23 LEU 74 0.916 4.863 6.888 554 H PHE 75 HN PHE 75 -1.356 6.911 11.983 555 HA PHE 75 HA PHE 75 -3.267 5.075 11.372 556 1HB PHE 75 HB1 PHE 75 -2.891 5.826 13.644 557 2HB PHE 75 HB2 PHE 75 -3.543 7.416 13.263 558 HD1 PHE 75 HD1 PHE 75 -4.856 4.060 12.347 559 HD2 PHE 75 HD2 PHE 75 -5.410 7.623 14.612 560 HE1 PHE 75 HE1 PHE 75 -7.106 3.296 13.002 561 HE2 PHE 75 HE2 PHE 75 -7.658 6.866 15.265 562 HZ PHE 75 HZ PHE 75 -8.507 4.700 14.460 563 HA PRO 76 HA PRO 76 -6.483 8.514 10.107 564 1HB PRO 76 HB2 PRO 76 -4.706 10.723 9.270 565 2HB PRO 76 HB1 PRO 76 -6.205 10.776 10.200 566 1HG PRO 76 HG1 PRO 76 -3.839 11.196 11.370 567 2HG PRO 76 HG2 PRO 76 -5.134 10.314 12.202 568 1HD PRO 76 HD1 PRO 76 -2.698 9.249 10.825 569 2HD PRO 76 HD2 PRO 76 -3.437 8.741 12.358 570 H LEU 77 HN LEU 77 -3.459 7.825 8.624 571 HA LEU 77 HA LEU 77 -4.459 8.335 5.937 572 1HB LEU 77 HB1 LEU 77 -1.779 7.484 7.015 573 2HB LEU 77 HB2 LEU 77 -2.131 7.503 5.303 574 HG LEU 77 HG LEU 77 -1.055 9.523 5.609 575 1HD1 LEU 77 HD21 LEU 77 -2.597 11.188 5.120 576 2HD1 LEU 77 HD22 LEU 77 -3.831 10.494 6.173 577 3HD1 LEU 77 HD23 LEU 77 -3.436 9.712 4.642 578 1HD2 LEU 77 HD11 LEU 77 -0.999 10.783 7.518 579 2HD2 LEU 77 HD12 LEU 77 -1.289 9.175 8.179 580 3HD2 LEU 77 HD13 LEU 77 -2.626 10.311 8.009 581 H ILE 78 HN ILE 78 -3.864 5.650 8.095 582 HA ILE 78 HA ILE 78 -3.858 3.629 6.095 583 HB ILE 78 HB ILE 78 -4.725 3.138 8.916 584 1HG1 ILE 78 HG12 ILE 78 -2.665 4.552 8.907 585 2HG1 ILE 78 HG11 ILE 78 -2.415 2.952 9.597 586 1HG2 ILE 78 HG21 ILE 78 -4.859 1.108 7.952 587 2HG2 ILE 78 HG22 ILE 78 -3.113 1.096 8.201 588 3HG2 ILE 78 HG23 ILE 78 -3.776 1.550 6.631 589 1HD1 ILE 78 HD11 ILE 78 -1.744 3.635 6.753 590 2HD1 ILE 78 HD12 ILE 78 -1.275 2.202 7.670 591 3HD1 ILE 78 HD13 ILE 78 -0.601 3.778 8.089 592 H GLN 79 HN GLN 79 -6.365 5.054 8.122 593 HA GLN 79 HA GLN 79 -8.487 3.340 7.583 594 1HB GLN 79 HB1 GLN 79 -8.168 6.164 8.404 595 2HB GLN 79 HB2 GLN 79 -9.708 5.778 7.654 596 1HG GLN 79 HG1 GLN 79 -10.257 4.228 9.326 597 2HG GLN 79 HG2 GLN 79 -8.600 4.164 9.923 598 1HE2 GLN 79 HE22 GLN 79 -11.038 4.713 11.385 599 2HE2 GLN 79 HE21 GLN 79 -10.846 6.280 12.088 600 H ALA 80 HN ALA 80 -6.760 5.369 5.517 601 HA ALA 80 HA ALA 80 -8.836 5.740 3.536 602 1HB ALA 80 HB1 ALA 80 -6.804 7.292 4.088 603 2HB ALA 80 HB2 ALA 80 -7.364 7.117 2.425 604 3HB ALA 80 HB3 ALA 80 -5.945 6.224 2.977 605 H MET 81 HN MET 81 -6.014 3.686 4.049 606 HA MET 81 HA MET 81 -6.116 2.492 1.436 607 1HB MET 81 HB1 MET 81 -4.801 1.130 3.751 608 2HB MET 81 HB2 MET 81 -4.283 1.227 2.076 609 1HG MET 81 HG2 MET 81 -3.143 3.128 2.402 610 2HG MET 81 HG1 MET 81 -4.329 3.782 3.524 611 1HE MET 81 HE1 MET 81 -1.235 2.480 2.747 612 2HE MET 81 HE2 MET 81 -0.834 1.185 3.879 613 3HE MET 81 HE3 MET 81 -0.364 2.852 4.237 614 H HIS 82 HN HIS 82 -7.331 1.727 4.626 615 HA HIS 82 HA HIS 82 -8.791 -0.565 3.488 616 1HB HIS 82 HB1 HIS 82 -7.194 -0.288 5.990 617 2HB HIS 82 HB2 HIS 82 -8.643 -1.282 6.058 618 HD2 HIS 82 HD2 HIS 82 -5.733 -1.136 3.380 619 HE1 HIS 82 HE1 HIS 82 -6.448 -5.134 4.559 620 HE2 HIS 82 HE2 HIS 82 -5.078 -3.622 3.053 621 HA PRO 83 HA PRO 83 -12.534 1.211 5.034 622 1HB PRO 83 HB2 PRO 83 -13.875 -0.918 6.067 623 2HB PRO 83 HB1 PRO 83 -13.686 -0.646 4.331 624 1HG PRO 83 HG1 PRO 83 -12.131 -2.450 6.147 625 2HG PRO 83 HG2 PRO 83 -12.759 -2.773 4.521 626 1HD PRO 83 HD2 PRO 83 -10.174 -2.140 4.963 627 2HD PRO 83 HD1 PRO 83 -11.031 -1.638 3.491 628 H THR 84 HN THR 84 -11.014 2.226 6.701 629 HA THR 84 HA THR 84 -10.447 2.796 8.825 630 HB THR 84 HB THR 84 -12.343 3.035 10.353 631 HG1 THR 84 HG1 THR 84 -13.832 1.582 10.278 632 1HG2 THR 84 HG21 THR 84 -12.150 4.331 8.020 633 2HG2 THR 84 HG22 THR 84 -13.421 4.631 9.206 634 3HG2 THR 84 HG23 THR 84 -13.734 3.582 7.823 635 H LEU 85 HN LEU 85 -9.585 0.234 8.237 636 HA LEU 85 HA LEU 85 -10.176 -1.373 10.617 637 1HB LEU 85 HB1 LEU 85 -9.398 -1.935 7.884 638 2HB LEU 85 HB2 LEU 85 -8.349 -2.752 9.025 639 HG LEU 85 HG LEU 85 -10.430 -3.683 10.116 640 1HD1 LEU 85 HD11 LEU 85 -11.717 -2.628 7.603 641 2HD1 LEU 85 HD12 LEU 85 -12.034 -2.074 9.248 642 3HD1 LEU 85 HD13 LEU 85 -12.472 -3.715 8.770 643 1HD2 LEU 85 HD21 LEU 85 -9.378 -4.373 7.440 644 2HD2 LEU 85 HD22 LEU 85 -10.875 -5.161 7.940 645 3HD2 LEU 85 HD23 LEU 85 -9.422 -5.324 8.925 646 H ALA 86 HN ALA 86 -8.312 1.089 10.084 647 HA ALA 86 HA ALA 86 -5.683 0.205 10.693 648 1HB ALA 86 HB1 ALA 86 -6.741 2.967 11.204 649 2HB ALA 86 HB2 ALA 86 -6.373 2.377 9.584 650 3HB ALA 86 HB3 ALA 86 -5.096 2.476 10.797 651 H GLY 87 HN GLY 87 -7.947 -0.570 12.583 652 1HA GLY 87 HA1 GLY 87 -7.674 0.734 15.037 653 2HA GLY 87 HA2 GLY 87 -8.186 -0.933 14.834 654 H LYS 88 HN LYS 88 -5.443 -1.291 13.413 655 HA LYS 88 HA LYS 88 -3.476 -0.939 15.424 656 1HB LYS 88 HB1 LYS 88 -4.824 -2.758 16.469 657 2HB LYS 88 HB2 LYS 88 -4.482 -3.770 15.076 658 1HG LYS 88 HG1 LYS 88 -1.977 -3.114 15.759 659 2HG LYS 88 HG2 LYS 88 -2.753 -3.019 17.346 660 1HD LYS 88 HD2 LYS 88 -2.380 -5.231 17.429 661 2HD LYS 88 HD1 LYS 88 -3.776 -5.349 16.357 662 1HE LYS 88 HE2 LYS 88 -2.296 -5.305 14.415 663 2HE LYS 88 HE1 LYS 88 -0.896 -5.163 15.476 664 1HZ LYS 88 HZ1 LYS 88 -1.932 -7.485 14.549 665 2HZ LYS 88 HZ2 LYS 88 -2.585 -7.401 16.107 666 3HZ LYS 88 HZ3 LYS 88 -0.909 -7.340 15.888 667 H ILE 89 HN ILE 89 -3.844 -0.601 12.524 668 HA ILE 89 HA ILE 89 -2.140 -2.598 11.331 669 HB ILE 89 HB ILE 89 -3.150 -0.033 10.118 670 1HG1 ILE 89 HG11 ILE 89 -4.133 -2.867 9.687 671 2HG1 ILE 89 HG12 ILE 89 -4.885 -1.755 10.826 672 1HG2 ILE 89 HG21 ILE 89 -1.851 -0.496 8.375 673 2HG2 ILE 89 HG22 ILE 89 -2.501 -2.134 8.276 674 3HG2 ILE 89 HG23 ILE 89 -1.118 -1.796 9.320 675 1HD1 ILE 89 HD11 ILE 89 -5.904 -0.578 9.205 676 2HD1 ILE 89 HD12 ILE 89 -5.705 -2.078 8.303 677 3HD1 ILE 89 HD13 ILE 89 -4.560 -0.757 8.078 678 H THR 90 HN THR 90 -1.699 0.813 10.670 679 HA THR 90 HA THR 90 1.057 0.754 10.537 680 HB THR 90 HB THR 90 -1.010 2.711 10.462 681 HG1 THR 90 HG1 THR 90 1.346 2.148 9.306 682 1HG2 THR 90 HG21 THR 90 1.161 3.389 12.334 683 2HG2 THR 90 HG22 THR 90 -0.498 3.980 12.249 684 3HG2 THR 90 HG23 THR 90 0.720 4.605 11.134 685 H GLY 91 HN GLY 91 -0.999 1.438 13.340 686 1HA GLY 91 HA2 GLY 91 0.970 2.268 15.137 687 2HA GLY 91 HA1 GLY 91 -0.506 1.421 15.585 688 H MET 92 HN MET 92 0.109 -0.916 13.973 689 HA MET 92 HA MET 92 1.849 -2.231 15.869 690 1HB MET 92 HB2 MET 92 0.286 -3.774 15.474 691 2HB MET 92 HB1 MET 92 -0.264 -2.962 14.013 692 1HG MET 92 HG1 MET 92 2.267 -4.327 13.666 693 2HG MET 92 HG2 MET 92 0.963 -5.383 14.176 694 1HE MET 92 HE1 MET 92 -1.214 -5.883 11.270 695 2HE MET 92 HE2 MET 92 -1.175 -5.773 13.031 696 3HE MET 92 HE3 MET 92 -0.005 -6.786 12.182 697 H LEU 93 HN LEU 93 2.000 -0.910 12.705 698 HA LEU 93 HA LEU 93 4.097 -2.413 11.600 699 1HB LEU 93 HB2 LEU 93 2.909 0.244 11.152 700 2HB LEU 93 HB1 LEU 93 4.531 0.020 10.537 701 HG LEU 93 HG LEU 93 2.760 -0.410 8.847 702 1HD1 LEU 93 HD11 LEU 93 3.617 -2.805 8.308 703 2HD1 LEU 93 HD12 LEU 93 4.694 -2.531 9.677 704 3HD1 LEU 93 HD13 LEU 93 4.743 -1.448 8.285 705 1HD2 LEU 93 HD21 LEU 93 2.057 -3.028 9.909 706 2HD2 LEU 93 HD22 LEU 93 1.036 -1.782 9.186 707 3HD2 LEU 93 HD23 LEU 93 1.465 -1.692 10.898 708 H LEU 94 HN LEU 94 4.043 -0.490 14.325 709 HA LEU 94 HA LEU 94 6.927 0.065 14.164 710 1HB LEU 94 HB1 LEU 94 4.657 1.400 15.461 711 2HB LEU 94 HB2 LEU 94 6.052 1.207 16.504 712 HG LEU 94 HG LEU 94 5.947 3.391 15.282 713 1HD1 LEU 94 HD21 LEU 94 8.189 1.543 15.437 714 2HD1 LEU 94 HD22 LEU 94 8.094 3.251 15.868 715 3HD1 LEU 94 HD23 LEU 94 8.394 2.778 14.195 716 1HD2 LEU 94 HD11 LEU 94 6.527 3.438 12.919 717 2HD2 LEU 94 HD12 LEU 94 5.027 2.547 13.175 718 3HD2 LEU 94 HD13 LEU 94 6.530 1.675 12.871 719 H GLU 95 HN GLU 95 5.593 -2.516 14.574 720 HA GLU 95 HA GLU 95 7.158 -3.448 16.768 721 1HB GLU 95 HB2 GLU 95 5.497 -4.068 18.307 722 2HB GLU 95 HB1 GLU 95 5.068 -2.429 17.839 723 1HG GLU 95 HG1 GLU 95 3.280 -3.161 16.507 724 2HG GLU 95 HG2 GLU 95 3.851 -4.830 16.517 725 H ILE 96 HN ILE 96 5.612 -3.925 13.863 726 HA ILE 96 HA ILE 96 4.835 -6.619 13.973 727 HB ILE 96 HB ILE 96 5.020 -6.727 11.598 728 1HG1 ILE 96 HG12 ILE 96 7.294 -5.731 11.468 729 2HG1 ILE 96 HG11 ILE 96 6.180 -5.161 10.232 730 1HG2 ILE 96 HG21 ILE 96 3.960 -4.209 12.732 731 2HG2 ILE 96 HG22 ILE 96 3.118 -5.544 11.945 732 3HG2 ILE 96 HG23 ILE 96 4.030 -4.381 10.978 733 1HD1 ILE 96 HD11 ILE 96 7.755 -3.619 11.867 734 2HD1 ILE 96 HD12 ILE 96 6.142 -3.480 12.568 735 3HD1 ILE 96 HD13 ILE 96 6.406 -3.069 10.870 736 H ASP 97 HN ASP 97 6.402 -7.596 11.726 737 HA ASP 97 HA ASP 97 8.335 -9.165 12.936 738 1HB ASP 97 HB1 ASP 97 7.182 -9.255 10.586 739 2HB ASP 97 HB2 ASP 97 8.557 -8.279 10.072 740 H ASN 98 HN ASN 98 8.407 -5.882 12.351 741 HA ASN 98 HA ASN 98 9.958 -4.302 12.782 742 1HB ASN 98 HB1 ASN 98 11.391 -6.717 13.636 743 2HB ASN 98 HB2 ASN 98 12.447 -5.421 13.083 744 1HD2 ASN 98 HD21 ASN 98 9.337 -5.242 14.748 745 2HD2 ASN 98 HD22 ASN 98 9.930 -4.409 16.139 746 H SER 99 HN SER 99 10.406 -6.746 10.419 747 HA SER 99 HA SER 99 12.403 -5.317 8.906 748 1HB SER 99 HB1 SER 99 10.612 -7.431 7.737 749 2HB SER 99 HB2 SER 99 12.289 -7.051 7.343 750 HG SER 99 HG SER 99 11.845 -9.002 8.672 751 H GLU 100 HN GLU 100 8.977 -5.395 9.223 752 HA GLU 100 HA GLU 100 8.400 -4.002 6.763 753 1HB GLU 100 HB1 GLU 100 6.719 -4.537 9.206 754 2HB GLU 100 HB2 GLU 100 6.129 -3.771 7.750 755 1HG GLU 100 HG2 GLU 100 5.445 -5.925 7.464 756 2HG GLU 100 HG1 GLU 100 6.968 -5.908 6.573 757 H LEU 101 HN LEU 101 8.805 -3.237 10.175 758 HA LEU 101 HA LEU 101 8.078 -0.510 10.028 759 1HB LEU 101 HB2 LEU 101 8.412 -0.613 12.230 760 2HB LEU 101 HB1 LEU 101 8.888 -2.285 12.019 761 HG LEU 101 HG LEU 101 11.245 -1.086 11.502 762 1HD1 LEU 101 HD21 LEU 101 9.652 1.005 12.510 763 2HD1 LEU 101 HD22 LEU 101 11.388 1.014 12.196 764 3HD1 LEU 101 HD23 LEU 101 10.782 0.561 13.790 765 1HD2 LEU 101 HD11 LEU 101 10.031 -1.955 14.103 766 2HD2 LEU 101 HD12 LEU 101 11.718 -1.456 13.980 767 3HD2 LEU 101 HD13 LEU 101 11.137 -2.838 13.049 768 H LEU 102 HN LEU 102 10.816 -2.274 9.020 769 HA LEU 102 HA LEU 102 12.595 0.017 8.905 770 1HB LEU 102 HB2 LEU 102 12.820 -2.905 8.271 771 2HB LEU 102 HB1 LEU 102 14.027 -1.786 7.675 772 HG LEU 102 HG LEU 102 13.772 -3.007 10.278 773 1HD1 LEU 102 HD11 LEU 102 16.088 -2.157 10.487 774 2HD1 LEU 102 HD12 LEU 102 15.871 -1.298 8.962 775 3HD1 LEU 102 HD13 LEU 102 15.795 -3.059 9.000 776 1HD2 LEU 102 HD21 LEU 102 14.417 -0.963 11.585 777 2HD2 LEU 102 HD22 LEU 102 12.723 -1.051 11.102 778 3HD2 LEU 102 HD23 LEU 102 13.837 -0.001 10.225 779 H HIS 103 HN HIS 103 11.151 -2.279 6.609 780 HA HIS 103 HA HIS 103 12.096 -1.011 4.291 781 1HB HIS 103 HB1 HIS 103 10.785 -3.348 4.865 782 2HB HIS 103 HB2 HIS 103 9.531 -2.430 4.041 783 HD2 HIS 103 HD2 HIS 103 11.480 -5.066 2.896 784 HE1 HIS 103 HE1 HIS 103 12.324 -2.130 -0.035 785 HE2 HIS 103 HE2 HIS 103 12.421 -4.603 0.522 786 H MET 104 HN MET 104 9.117 -0.619 6.140 787 HA MET 104 HA MET 104 7.663 0.947 4.369 788 1HB MET 104 HB2 MET 104 6.402 1.693 6.306 789 2HB MET 104 HB1 MET 104 6.765 -0.020 6.473 790 1HG MET 104 HG1 MET 104 8.053 0.297 8.283 791 2HG MET 104 HG2 MET 104 8.733 1.796 7.659 792 1HE MET 104 HE1 MET 104 5.335 0.383 8.285 793 2HE MET 104 HE2 MET 104 4.655 1.943 7.824 794 3HE MET 104 HE3 MET 104 4.581 1.413 9.506 795 H LEU 105 HN LEU 105 10.251 1.828 6.573 796 HA LEU 105 HA LEU 105 9.904 4.663 6.059 797 1HB LEU 105 HB1 LEU 105 12.190 3.350 7.511 798 2HB LEU 105 HB2 LEU 105 11.652 5.012 7.639 799 HG LEU 105 HG LEU 105 10.065 2.626 8.583 800 1HD1 LEU 105 HD11 LEU 105 10.986 4.435 10.630 801 2HD1 LEU 105 HD12 LEU 105 12.339 3.738 9.739 802 3HD1 LEU 105 HD13 LEU 105 11.158 2.683 10.514 803 1HD2 LEU 105 HD21 LEU 105 9.456 5.433 8.206 804 2HD2 LEU 105 HD22 LEU 105 9.205 4.911 9.873 805 3HD2 LEU 105 HD23 LEU 105 8.382 4.077 8.554 806 H GLU 106 HN GLU 106 11.420 2.066 4.571 807 HA GLU 106 HA GLU 106 13.453 3.818 3.387 808 1HB GLU 106 HB1 GLU 106 14.878 2.034 3.238 809 2HB GLU 106 HB2 GLU 106 13.912 1.507 4.611 810 1HG GLU 106 HG1 GLU 106 13.585 -0.380 3.505 811 2HG GLU 106 HG2 GLU 106 12.525 0.535 2.433 812 H SER 107 HN SER 107 10.451 2.585 2.639 813 HA SER 107 HA SER 107 10.989 3.007 -0.212 814 1HB SER 107 HB2 SER 107 10.913 0.479 0.589 815 2HB SER 107 HB1 SER 107 9.173 0.746 0.480 816 HG SER 107 HG SER 107 11.001 1.307 -1.614 817 HA PRO 108 HA PRO 108 7.326 5.493 0.249 818 1HB PRO 108 HB2 PRO 108 7.258 5.469 -2.696 819 2HB PRO 108 HB1 PRO 108 7.428 6.833 -1.588 820 1HG PRO 108 HG2 PRO 108 9.487 5.972 -3.072 821 2HG PRO 108 HG1 PRO 108 9.722 6.585 -1.425 822 1HD PRO 108 HD1 PRO 108 9.630 3.750 -2.398 823 2HD PRO 108 HD2 PRO 108 10.726 4.500 -1.217 824 H GLU 109 HN GLU 109 7.441 2.384 -0.676 825 HA GLU 109 HA GLU 109 4.529 2.252 -1.086 826 1HB GLU 109 HB1 GLU 109 4.967 1.556 -3.187 827 2HB GLU 109 HB2 GLU 109 6.666 1.284 -2.843 828 1HG GLU 109 HG2 GLU 109 6.315 -0.911 -2.196 829 2HG GLU 109 HG1 GLU 109 4.600 -0.648 -1.883 830 H SER 110 HN SER 110 7.418 0.978 0.361 831 HA SER 110 HA SER 110 6.372 -1.461 1.276 832 1HB SER 110 HB1 SER 110 8.733 0.155 1.808 833 2HB SER 110 HB2 SER 110 8.140 -0.664 3.253 834 HG SER 110 HG SER 110 8.500 -2.586 2.334 835 H LEU 111 HN LEU 111 6.405 1.774 2.640 836 HA LEU 111 HA LEU 111 5.253 1.376 5.110 837 1HB LEU 111 HB1 LEU 111 6.062 3.502 3.940 838 2HB LEU 111 HB2 LEU 111 4.477 3.576 3.193 839 HG LEU 111 HG LEU 111 4.400 5.086 4.979 840 1HD1 LEU 111 HD21 LEU 111 2.571 4.405 6.152 841 2HD1 LEU 111 HD22 LEU 111 3.212 2.787 6.432 842 3HD1 LEU 111 HD23 LEU 111 2.565 3.217 4.849 843 1HD2 LEU 111 HD11 LEU 111 5.192 4.715 7.178 844 2HD2 LEU 111 HD12 LEU 111 6.468 4.217 6.063 845 3HD2 LEU 111 HD13 LEU 111 5.461 3.004 6.859 846 H ARG 112 HN ARG 112 3.870 1.133 1.922 847 HA ARG 112 HA ARG 112 1.174 0.799 2.968 848 1HB ARG 112 HB1 ARG 112 2.335 1.043 0.204 849 2HB ARG 112 HB2 ARG 112 0.648 0.592 0.481 850 1HG ARG 112 HG2 ARG 112 0.110 2.633 1.373 851 2HG ARG 112 HG1 ARG 112 1.784 2.972 1.826 852 1HD ARG 112 HD2 ARG 112 0.721 4.243 -0.182 853 2HD ARG 112 HD1 ARG 112 2.370 3.632 -0.315 854 HE ARG 112 HE ARG 112 1.643 2.045 -1.845 855 1HH1 ARG 112 HH11 ARG 112 -1.051 3.820 -0.528 856 2HH1 ARG 112 HH12 ARG 112 -2.174 3.249 -1.717 857 1HH2 ARG 112 HH21 ARG 112 0.173 1.289 -3.414 858 2HH2 ARG 112 HH22 ARG 112 -1.478 1.811 -3.357 859 H SER 113 HN SER 113 3.089 -0.998 0.567 860 HA SER 113 HA SER 113 1.660 -3.320 0.491 861 1HB SER 113 HB2 SER 113 3.658 -2.808 -0.916 862 2HB SER 113 HB1 SER 113 4.686 -3.166 0.472 863 HG SER 113 HG SER 113 4.312 -5.245 0.232 864 H LYS 114 HN LYS 114 3.736 -2.156 3.019 865 HA LYS 114 HA LYS 114 3.779 -4.690 4.432 866 1HB LYS 114 HB1 LYS 114 4.733 -1.956 5.289 867 2HB LYS 114 HB2 LYS 114 4.933 -3.431 6.223 868 1HG LYS 114 HG1 LYS 114 6.165 -2.771 3.562 869 2HG LYS 114 HG2 LYS 114 6.987 -2.973 5.110 870 1HD LYS 114 HD1 LYS 114 7.249 -5.138 4.686 871 2HD LYS 114 HD2 LYS 114 5.497 -5.334 4.603 872 1HE LYS 114 HE1 LYS 114 5.758 -4.408 2.197 873 2HE LYS 114 HE2 LYS 114 7.454 -4.847 2.392 874 1HZ LYS 114 HZ1 LYS 114 5.743 -6.964 3.212 875 2HZ LYS 114 HZ2 LYS 114 6.973 -6.970 2.050 876 3HZ LYS 114 HZ3 LYS 114 5.406 -6.504 1.620 877 H VAL 115 HN VAL 115 2.170 -1.526 4.701 878 HA VAL 115 HA VAL 115 0.834 -2.103 7.132 879 HB VAL 115 HB VAL 115 0.569 -0.033 5.028 880 1HG1 VAL 115 HG11 VAL 115 -1.662 0.058 5.068 881 2HG1 VAL 115 HG12 VAL 115 -1.519 0.576 6.750 882 3HG1 VAL 115 HG13 VAL 115 -1.754 -1.129 6.373 883 1HG2 VAL 115 HG21 VAL 115 1.841 0.781 6.718 884 2HG2 VAL 115 HG22 VAL 115 1.071 -0.239 7.934 885 3HG2 VAL 115 HG23 VAL 115 0.261 1.221 7.368 886 H ASP 116 HN ASP 116 -0.474 -2.046 3.799 887 HA ASP 116 HA ASP 116 -2.933 -3.169 4.314 888 1HB ASP 116 HB1 ASP 116 -2.751 -2.439 2.137 889 2HB ASP 116 HB2 ASP 116 -1.141 -3.119 1.931 890 H GLU 117 HN GLU 117 0.154 -4.817 3.838 891 HA GLU 117 HA GLU 117 -0.980 -7.452 3.887 892 1HB GLU 117 HB1 GLU 117 1.732 -6.276 3.790 893 2HB GLU 117 HB2 GLU 117 1.618 -7.855 4.555 894 1HG GLU 117 HG2 GLU 117 0.151 -8.247 2.305 895 2HG GLU 117 HG1 GLU 117 1.362 -7.097 1.738 896 H ALA 118 HN ALA 118 0.333 -5.211 6.225 897 HA ALA 118 HA ALA 118 0.520 -7.041 8.387 898 1HB ALA 118 HB1 ALA 118 0.707 -4.124 8.059 899 2HB ALA 118 HB2 ALA 118 1.719 -5.235 8.983 900 3HB ALA 118 HB3 ALA 118 0.179 -4.688 9.645 901 H VAL 119 HN VAL 119 -2.058 -5.250 6.920 902 HA VAL 119 HA VAL 119 -3.939 -5.312 9.022 903 HB VAL 119 HB VAL 119 -4.574 -5.557 6.094 904 1HG1 VAL 119 HG11 VAL 119 -6.445 -5.985 7.554 905 2HG1 VAL 119 HG12 VAL 119 -6.650 -4.406 6.790 906 3HG1 VAL 119 HG13 VAL 119 -6.112 -4.511 8.465 907 1HG2 VAL 119 HG21 VAL 119 -4.794 -2.891 7.127 908 2HG2 VAL 119 HG22 VAL 119 -3.874 -3.479 5.744 909 3HG2 VAL 119 HG23 VAL 119 -3.152 -3.496 7.353 910 H ALA 120 HN ALA 120 -3.225 -7.513 6.365 911 HA ALA 120 HA ALA 120 -5.121 -9.494 6.933 912 1HB ALA 120 HB1 ALA 120 -3.079 -9.110 5.090 913 2HB ALA 120 HB2 ALA 120 -4.163 -10.503 5.179 914 3HB ALA 120 HB3 ALA 120 -2.593 -10.556 5.980 915 H VAL 121 HN VAL 121 -2.140 -8.603 8.406 916 HA VAL 121 HA VAL 121 -1.856 -11.028 9.958 917 HB VAL 121 HB VAL 121 -0.303 -8.476 9.690 918 1HG1 VAL 121 HG21 VAL 121 -0.486 -10.063 12.091 919 2HG1 VAL 121 HG22 VAL 121 0.346 -8.532 11.805 920 3HG1 VAL 121 HG23 VAL 121 1.155 -10.057 11.443 921 1HG2 VAL 121 HG11 VAL 121 0.758 -11.272 9.591 922 2HG2 VAL 121 HG12 VAL 121 1.379 -9.812 8.818 923 3HG2 VAL 121 HG13 VAL 121 -0.089 -10.577 8.208 924 H LEU 122 HN LEU 122 -3.088 -7.784 10.328 925 HA LEU 122 HA LEU 122 -3.273 -7.830 13.179 926 1HB LEU 122 HB2 LEU 122 -3.540 -5.659 12.800 927 2HB LEU 122 HB1 LEU 122 -3.704 -5.956 11.083 928 HG LEU 122 HG LEU 122 -6.213 -6.589 12.074 929 1HD1 LEU 122 HD11 LEU 122 -6.835 -4.617 13.418 930 2HD1 LEU 122 HD12 LEU 122 -5.130 -4.177 13.517 931 3HD1 LEU 122 HD13 LEU 122 -5.698 -5.679 14.247 932 1HD2 LEU 122 HD21 LEU 122 -5.812 -5.418 10.015 933 2HD2 LEU 122 HD22 LEU 122 -5.167 -4.026 10.886 934 3HD2 LEU 122 HD23 LEU 122 -6.875 -4.444 11.031 935 H GLN 123 HN GLN 123 -5.431 -8.527 10.495 936 HA GLN 123 HA GLN 123 -7.775 -8.949 12.005 937 1HB GLN 123 HB1 GLN 123 -6.867 -9.858 9.281 938 2HB GLN 123 HB2 GLN 123 -8.415 -10.367 9.943 939 1HG GLN 123 HG1 GLN 123 -7.613 -7.483 9.656 940 2HG GLN 123 HG2 GLN 123 -8.465 -8.384 8.402 941 1HE2 GLN 123 HE21 GLN 123 -8.680 -7.006 11.588 942 2HE2 GLN 123 HE22 GLN 123 -10.402 -7.083 11.723 943 H ALA 124 HN ALA 124 -5.119 -11.022 11.021 944 HA ALA 124 HA ALA 124 -6.217 -13.454 12.067 945 1HB ALA 124 HB1 ALA 124 -4.509 -13.488 10.335 946 2HB ALA 124 HB2 ALA 124 -3.948 -14.333 11.778 947 3HB ALA 124 HB3 ALA 124 -3.365 -12.705 11.426 948 H HIS 125 HN HIS 125 -3.214 -11.938 13.138 949 HA HIS 125 HA HIS 125 -2.823 -12.986 15.526 950 1HB HIS 125 HB1 HIS 125 -1.980 -10.629 14.284 951 2HB HIS 125 HB2 HIS 125 -2.549 -10.118 15.870 952 HD2 HIS 125 HD2 HIS 125 -1.075 -11.042 18.044 953 HE1 HIS 125 HE1 HIS 125 2.029 -12.678 15.675 954 HE2 HIS 125 HE2 HIS 125 1.316 -12.051 18.027 955 H GLN 126 HN GLN 126 -5.353 -10.627 14.910 956 HA GLN 126 HA GLN 126 -6.052 -10.147 17.602 957 1HB GLN 126 HB1 GLN 126 -7.281 -9.674 14.951 958 2HB GLN 126 HB2 GLN 126 -8.389 -9.733 16.315 959 1HG GLN 126 HG1 GLN 126 -6.616 -8.088 17.371 960 2HG GLN 126 HG2 GLN 126 -6.267 -7.763 15.673 961 1HE2 GLN 126 HE22 GLN 126 -8.745 -7.971 14.547 962 2HE2 GLN 126 HE21 GLN 126 -9.771 -6.720 15.154 963 H ALA 127 HN ALA 127 -8.269 -11.765 15.355 964 HA ALA 127 HA ALA 127 -9.148 -13.467 17.554 965 1HB ALA 127 HB1 ALA 127 -11.016 -12.525 16.655 966 2HB ALA 127 HB2 ALA 127 -10.956 -14.026 15.731 967 3HB ALA 127 HB3 ALA 127 -10.366 -12.526 15.015 968 H LYS 128 HN LYS 128 -6.633 -14.067 15.989 969 HA LYS 128 HA LYS 128 -7.406 -16.581 14.697 970 1HB LYS 128 HB2 LYS 128 -5.258 -16.665 13.719 971 2HB LYS 128 HB1 LYS 128 -5.746 -14.979 13.611 972 1HG LYS 128 HG1 LYS 128 -3.950 -14.341 14.742 973 2HG LYS 128 HG2 LYS 128 -4.320 -15.455 16.060 974 1HD LYS 128 HD2 LYS 128 -2.223 -16.154 15.310 975 2HD LYS 128 HD1 LYS 128 -3.345 -17.273 14.531 976 1HE LYS 128 HE1 LYS 128 -3.002 -14.976 12.869 977 2HE LYS 128 HE2 LYS 128 -1.417 -15.602 13.321 978 1HZ LYS 128 HZ1 LYS 128 -1.993 -17.736 12.464 979 2HZ LYS 128 HZ2 LYS 128 -2.348 -16.592 11.270 980 3HZ LYS 128 HZ3 LYS 128 -3.595 -17.270 12.190 981 H GLU 129 HN GLU 129 -5.018 -17.950 15.086 982 HA GLU 129 HA GLU 129 -5.406 -18.915 17.820 983 1HB GLU 129 HB2 GLU 129 -4.738 -20.147 15.351 984 2HB GLU 129 HB1 GLU 129 -3.349 -20.335 16.412 985 1HG GLU 129 HG1 GLU 129 -5.430 -20.977 18.062 986 2HG GLU 129 HG2 GLU 129 -5.972 -21.604 16.507 987 H ALA 130 HN ALA 130 -4.169 -16.347 17.236 988 HA ALA 130 HA ALA 130 -1.399 -16.375 17.338 989 1HB ALA 130 HB1 ALA 130 -3.052 -14.267 18.690 990 2HB ALA 130 HB2 ALA 130 -2.973 -14.412 16.934 991 3HB ALA 130 HB3 ALA 130 -1.506 -14.094 17.861 992 H ALA 131 HN ALA 131 -3.432 -15.470 20.120 993 HA ALA 131 HA ALA 131 -1.356 -16.064 21.987 994 1HB ALA 131 HB1 ALA 131 -3.438 -14.415 22.100 995 2HB ALA 131 HB2 ALA 131 -2.671 -15.068 23.547 996 3HB ALA 131 HB3 ALA 131 -4.153 -15.798 22.927 997 H GLN 132 HN GLN 132 -1.864 -17.474 23.947 998 HA GLN 132 HA GLN 132 -2.629 -20.111 22.955 999 1HB GLN 132 HB1 GLN 132 -1.595 -20.923 25.079 1000 2HB GLN 132 HB2 GLN 132 -0.490 -20.022 24.050 1001 1HG GLN 132 HG1 GLN 132 -1.845 -18.307 25.949 1002 2HG GLN 132 HG2 GLN 132 -0.957 -19.609 26.739 1003 1HE2 GLN 132 HE21 GLN 132 -0.368 -16.824 26.860 1004 2HE2 GLN 132 HE22 GLN 132 1.203 -16.599 26.178 1005 H LYS 133 HN LYS 133 -4.802 -18.477 23.249 1006 HA LYS 133 HA LYS 133 -6.070 -18.525 25.746 1007 1HB LYS 133 HB2 LYS 133 -7.353 -18.583 23.006 1008 2HB LYS 133 HB1 LYS 133 -8.145 -18.115 24.506 1009 1HG LYS 133 HG1 LYS 133 -7.221 -16.063 24.513 1010 2HG LYS 133 HG2 LYS 133 -5.690 -16.631 23.842 1011 1HD LYS 133 HD2 LYS 133 -6.318 -15.741 21.900 1012 2HD LYS 133 HD1 LYS 133 -7.543 -17.008 21.799 1013 1HE LYS 133 HE1 LYS 133 -9.011 -15.462 23.202 1014 2HE LYS 133 HE2 LYS 133 -7.837 -14.201 22.827 1015 1HZ LYS 133 HZ1 LYS 133 -9.441 -13.983 21.186 1016 2HZ LYS 133 HZ2 LYS 133 -9.631 -15.652 20.986 1017 3HZ LYS 133 HZ3 LYS 133 -8.237 -14.885 20.411 1018 H ALA 134 HN ALA 134 -6.650 -20.665 22.947 1019 HA ALA 134 HA ALA 134 -7.987 -22.579 24.689 1020 1HB ALA 134 HB1 ALA 134 -7.591 -22.610 21.699 1021 2HB ALA 134 HB2 ALA 134 -9.027 -22.046 22.552 1022 3HB ALA 134 HB3 ALA 134 -8.573 -23.748 22.623 1023 H VAL 135 HN VAL 135 -7.264 -24.625 25.131 1024 HA VAL 135 HA VAL 135 -4.415 -25.068 24.781 1025 HB VAL 135 HB VAL 135 -6.182 -27.061 26.132 1026 1HG1 VAL 135 HG11 VAL 135 -4.102 -27.846 26.443 1027 2HG1 VAL 135 HG12 VAL 135 -4.008 -26.623 27.711 1028 3HG1 VAL 135 HG13 VAL 135 -3.355 -26.282 26.109 1029 1HG2 VAL 135 HG21 VAL 135 -5.755 -24.259 26.995 1030 2HG2 VAL 135 HG22 VAL 135 -5.628 -25.513 28.228 1031 3HG2 VAL 135 HG23 VAL 135 -7.114 -25.345 27.292 1032 H ASN 136 HN ASN 136 -5.727 -25.182 22.362 1033 HA ASN 136 HA ASN 136 -6.432 -27.863 21.655 1034 1HB ASN 136 HB2 ASN 136 -6.299 -25.252 20.329 1035 2HB ASN 136 HB1 ASN 136 -5.855 -26.594 19.278 1036 1HD2 ASN 136 HD21 ASN 136 -7.545 -27.012 18.050 1037 2HD2 ASN 136 HD22 ASN 136 -9.171 -27.211 18.596 1038 H SER 137 HN SER 137 -4.889 -29.375 21.833 1039 HA SER 137 HA SER 137 -2.147 -28.814 21.087 1040 1HB SER 137 HB1 SER 137 -3.572 -30.927 22.565 1041 2HB SER 137 HB2 SER 137 -2.220 -31.502 21.591 1042 HG SER 137 HG SER 137 -1.713 -29.223 23.059 1043 H ALA 138 HN ALA 138 -1.259 -31.143 20.005 1044 HA ALA 138 HA ALA 138 -1.921 -30.859 17.279 1045 1HB ALA 138 HB1 ALA 138 -0.359 -32.562 16.853 1046 2HB ALA 138 HB2 ALA 138 -0.577 -33.275 18.451 1047 3HB ALA 138 HB3 ALA 138 0.248 -31.725 18.282 1048 H THR 139 HN THR 139 -3.370 -31.856 16.006 1049 HA THR 139 HA THR 139 -5.167 -33.796 17.272 1050 HB THR 139 HB THR 139 -6.091 -33.011 14.689 1051 HG1 THR 139 HG1 THR 139 -4.649 -31.197 15.093 1052 1HG2 THR 139 HG21 THR 139 -7.934 -31.990 15.919 1053 2HG2 THR 139 HG22 THR 139 -7.047 -32.219 17.425 1054 3HG2 THR 139 HG23 THR 139 -7.577 -33.619 16.493 1055 H GLY 140 HN GLY 140 -6.244 -34.912 14.925 1056 1HA GLY 140 HA2 GLY 140 -4.018 -36.676 14.171 1057 2HA GLY 140 HA1 GLY 140 -5.724 -37.085 14.082 1058 H VAL 141 HN VAL 141 -5.970 -34.204 12.885 1059 HA VAL 141 HA VAL 141 -5.798 -35.119 10.145 1060 HB VAL 141 HB VAL 141 -6.646 -32.364 10.997 1061 1HG1 VAL 141 HG21 VAL 141 -6.519 -32.403 8.691 1062 2HG1 VAL 141 HG22 VAL 141 -8.204 -32.841 8.971 1063 3HG1 VAL 141 HG23 VAL 141 -7.020 -34.091 8.588 1064 1HG2 VAL 141 HG11 VAL 141 -8.990 -33.691 10.720 1065 2HG2 VAL 141 HG12 VAL 141 -8.204 -33.375 12.267 1066 3HG2 VAL 141 HG13 VAL 141 -7.990 -34.934 11.473 1067 HA PRO 142 HA PRO 142 -2.829 -31.207 9.964 1068 1HB PRO 142 HB1 PRO 142 -1.834 -31.241 12.759 1069 2HB PRO 142 HB2 PRO 142 -2.216 -29.867 11.715 1070 1HG PRO 142 HG2 PRO 142 -3.828 -30.542 13.726 1071 2HG PRO 142 HG1 PRO 142 -4.486 -29.981 12.178 1072 1HD PRO 142 HD2 PRO 142 -4.292 -32.765 13.259 1073 2HD PRO 142 HD1 PRO 142 -5.609 -32.000 12.346 1074 H THR 143 HN THR 143 -2.462 -34.214 11.547 1075 HA THR 143 HA THR 143 0.398 -34.358 11.406 1076 HB THR 143 HB THR 143 -0.830 -36.955 11.473 1077 HG1 THR 143 HG1 THR 143 -1.776 -35.430 13.602 1078 1HG2 THR 143 HG21 THR 143 1.314 -36.182 12.568 1079 2HG2 THR 143 HG22 THR 143 0.254 -37.216 13.524 1080 3HG2 THR 143 HG23 THR 143 0.294 -35.479 13.822 1081 H VAL 144 HN VAL 144 -1.932 -36.552 9.856 1082 HA VAL 144 HA VAL 144 -0.668 -36.125 7.266 1083 HB VAL 144 HB VAL 144 -0.597 -38.718 7.027 1084 1HG1 VAL 144 HG21 VAL 144 1.295 -36.765 7.541 1085 2HG1 VAL 144 HG22 VAL 144 1.607 -38.405 6.971 1086 3HG1 VAL 144 HG23 VAL 144 1.674 -38.042 8.696 1087 1HG2 VAL 144 HG11 VAL 144 -0.348 -40.010 8.927 1088 2HG2 VAL 144 HG12 VAL 144 -1.611 -38.880 9.415 1089 3HG2 VAL 144 HG13 VAL 144 0.052 -38.625 9.944 Start of MODEL 19 1 1H GLY 1 HT1 GLY 1 14.012 -30.745 -18.942 2 2H GLY 1 HT2 GLY 1 14.363 -29.712 -20.235 3 3H GLY 1 HT3 GLY 1 15.330 -29.689 -18.847 4 1HA GLY 1 HA1 GLY 1 16.665 -30.956 -20.146 5 2HA GLY 1 HA2 GLY 1 15.660 -32.209 -19.433 6 HA PRO 2 HA PRO 2 15.224 -31.870 -24.222 7 1HB PRO 2 HB2 PRO 2 17.141 -33.593 -25.069 8 2HB PRO 2 HB1 PRO 2 17.422 -31.858 -24.892 9 1HG PRO 2 HG2 PRO 2 18.131 -34.094 -23.029 10 2HG PRO 2 HG1 PRO 2 19.102 -32.690 -23.511 11 1HD PRO 2 HD1 PRO 2 17.777 -32.802 -21.153 12 2HD PRO 2 HD2 PRO 2 18.027 -31.282 -22.035 13 H LEU 3 HN LEU 3 14.321 -33.542 -25.533 14 HA LEU 3 HA LEU 3 13.388 -35.825 -23.958 15 1HB LEU 3 HB1 LEU 3 12.365 -34.335 -26.324 16 2HB LEU 3 HB2 LEU 3 11.930 -36.025 -26.176 17 HG LEU 3 HG LEU 3 10.182 -34.610 -25.257 18 1HD1 LEU 3 HD11 LEU 3 11.628 -36.591 -23.705 19 2HD1 LEU 3 HD12 LEU 3 9.895 -36.399 -23.964 20 3HD1 LEU 3 HD13 LEU 3 10.704 -35.478 -22.696 21 1HD2 LEU 3 HD21 LEU 3 11.220 -32.633 -24.604 22 2HD2 LEU 3 HD22 LEU 3 12.429 -33.475 -23.634 23 3HD2 LEU 3 HD23 LEU 3 10.758 -33.385 -23.077 24 H GLY 4 HN GLY 4 14.837 -37.449 -24.079 25 1HA GLY 4 HA1 GLY 4 16.012 -38.108 -26.686 26 2HA GLY 4 HA2 GLY 4 16.569 -38.697 -25.128 27 H SER 5 HN SER 5 15.244 -40.301 -24.030 28 HA SER 5 HA SER 5 14.182 -42.214 -25.927 29 1HB SER 5 HB1 SER 5 15.054 -42.279 -23.080 30 2HB SER 5 HB2 SER 5 13.862 -43.475 -23.588 31 HG SER 5 HG SER 5 15.450 -44.523 -24.446 32 H ALA 6 HN ALA 6 12.292 -43.567 -24.527 33 HA ALA 6 HA ALA 6 10.056 -43.643 -24.137 34 1HB ALA 6 HB1 ALA 6 10.860 -42.334 -22.126 35 2HB ALA 6 HB2 ALA 6 9.154 -42.165 -22.540 36 3HB ALA 6 HB3 ALA 6 10.295 -40.887 -22.963 37 H ALA 7 HN ALA 7 9.832 -40.163 -24.354 38 HA ALA 7 HA ALA 7 8.680 -38.797 -25.763 39 1HB ALA 7 HB1 ALA 7 9.113 -40.201 -28.239 40 2HB ALA 7 HB2 ALA 7 10.588 -40.160 -27.273 41 3HB ALA 7 HB3 ALA 7 9.768 -38.657 -27.693 42 H ALA 8 HN ALA 8 6.702 -39.631 -24.750 43 HA ALA 8 HA ALA 8 4.921 -40.730 -26.781 44 1HB ALA 8 HB1 ALA 8 4.915 -42.759 -25.866 45 2HB ALA 8 HB2 ALA 8 4.064 -42.041 -24.498 46 3HB ALA 8 HB3 ALA 8 5.819 -42.207 -24.456 47 H ALA 9 HN ALA 9 5.400 -39.150 -23.693 48 HA ALA 9 HA ALA 9 2.607 -38.354 -23.523 49 1HB ALA 9 HB1 ALA 9 3.609 -37.075 -21.465 50 2HB ALA 9 HB2 ALA 9 4.961 -38.181 -21.709 51 3HB ALA 9 HB3 ALA 9 3.345 -38.818 -21.404 52 H THR 10 HN THR 10 4.803 -37.378 -25.521 53 HA THR 10 HA THR 10 4.231 -34.508 -25.170 54 HB THR 10 HB THR 10 6.469 -34.940 -26.916 55 HG1 THR 10 HG1 THR 10 7.693 -36.259 -25.830 56 1HG2 THR 10 HG21 THR 10 5.729 -33.108 -25.003 57 2HG2 THR 10 HG22 THR 10 7.260 -33.152 -25.879 58 3HG2 THR 10 HG23 THR 10 7.129 -33.913 -24.293 59 HA PRO 11 HA PRO 11 2.189 -34.727 -29.089 60 1HB PRO 11 HB1 PRO 11 2.246 -32.128 -29.814 61 2HB PRO 11 HB2 PRO 11 1.225 -32.719 -28.497 62 1HG PRO 11 HG2 PRO 11 3.889 -31.354 -28.365 63 2HG PRO 11 HG1 PRO 11 2.443 -31.077 -27.377 64 1HD PRO 11 HD2 PRO 11 4.552 -32.567 -26.527 65 2HD PRO 11 HD1 PRO 11 2.882 -32.874 -26.008 66 H ALA 12 HN ALA 12 2.487 -33.908 -31.413 67 HA ALA 12 HA ALA 12 5.066 -34.729 -32.316 68 1HB ALA 12 HB1 ALA 12 2.642 -33.668 -33.741 69 2HB ALA 12 HB2 ALA 12 3.241 -35.326 -33.684 70 3HB ALA 12 HB3 ALA 12 4.132 -34.096 -34.582 71 H VAL 13 HN VAL 13 3.713 -31.733 -31.410 72 HA VAL 13 HA VAL 13 5.754 -30.220 -32.882 73 HB VAL 13 HB VAL 13 4.401 -28.238 -31.813 74 1HG1 VAL 13 HG11 VAL 13 2.642 -28.842 -33.812 75 2HG1 VAL 13 HG12 VAL 13 4.042 -29.826 -34.242 76 3HG1 VAL 13 HG13 VAL 13 4.217 -28.082 -34.038 77 1HG2 VAL 13 HG21 VAL 13 2.653 -30.600 -31.389 78 2HG2 VAL 13 HG22 VAL 13 1.896 -29.102 -31.930 79 3HG2 VAL 13 HG23 VAL 13 2.824 -29.129 -30.430 80 H ARG 14 HN ARG 14 7.485 -30.924 -31.518 81 HA ARG 14 HA ARG 14 7.443 -30.316 -28.708 82 1HB ARG 14 HB2 ARG 14 9.882 -30.959 -30.361 83 2HB ARG 14 HB1 ARG 14 9.647 -31.209 -28.637 84 1HG ARG 14 HG1 ARG 14 7.825 -32.852 -29.263 85 2HG ARG 14 HG2 ARG 14 8.434 -32.740 -30.916 86 1HD ARG 14 HD1 ARG 14 10.101 -34.135 -30.458 87 2HD ARG 14 HD2 ARG 14 10.609 -33.149 -29.087 88 HE ARG 14 HE ARG 14 9.583 -34.636 -27.688 89 1HH1 ARG 14 HH12 ARG 14 8.393 -35.132 -30.927 90 2HH1 ARG 14 HH11 ARG 14 7.505 -36.562 -30.518 91 1HH2 ARG 14 HH21 ARG 14 8.416 -36.517 -27.144 92 2HH2 ARG 14 HH22 ARG 14 7.517 -37.349 -28.370 93 H THR 15 HN THR 15 8.014 -28.547 -31.524 94 HA THR 15 HA THR 15 9.581 -26.529 -30.059 95 HB THR 15 HB THR 15 10.249 -25.665 -32.265 96 HG1 THR 15 HG1 THR 15 9.001 -27.922 -33.411 97 1HG2 THR 15 HG21 THR 15 11.084 -28.120 -31.188 98 2HG2 THR 15 HG22 THR 15 11.967 -27.041 -32.268 99 3HG2 THR 15 HG23 THR 15 10.970 -28.334 -32.935 100 H VAL 16 HN VAL 16 9.099 -24.248 -30.644 101 HA VAL 16 HA VAL 16 6.193 -23.878 -30.829 102 HB VAL 16 HB VAL 16 6.763 -21.531 -29.984 103 1HG1 VAL 16 HG21 VAL 16 6.657 -24.077 -28.561 104 2HG1 VAL 16 HG22 VAL 16 5.785 -22.573 -28.264 105 3HG1 VAL 16 HG23 VAL 16 7.419 -22.782 -27.636 106 1HG2 VAL 16 HG11 VAL 16 9.342 -22.307 -30.440 107 2HG2 VAL 16 HG12 VAL 16 9.187 -22.546 -28.699 108 3HG2 VAL 16 HG13 VAL 16 8.852 -20.965 -29.406 109 HA PRO 17 HA PRO 17 6.706 -22.389 -35.006 110 1HB PRO 17 HB1 PRO 17 4.146 -21.008 -34.396 111 2HB PRO 17 HB2 PRO 17 4.556 -22.082 -35.739 112 1HG PRO 17 HG1 PRO 17 3.021 -22.935 -33.737 113 2HG PRO 17 HG2 PRO 17 4.232 -24.001 -34.475 114 1HD PRO 17 HD1 PRO 17 4.333 -22.525 -31.876 115 2HD PRO 17 HD2 PRO 17 4.924 -24.152 -32.273 116 H GLN 18 HN GLN 18 5.187 -20.050 -32.772 117 HA GLN 18 HA GLN 18 6.770 -17.916 -33.991 118 1HB GLN 18 HB1 GLN 18 5.279 -16.435 -32.566 119 2HB GLN 18 HB2 GLN 18 4.475 -17.347 -33.838 120 1HG GLN 18 HG1 GLN 18 3.168 -18.387 -32.384 121 2HG GLN 18 HG2 GLN 18 4.535 -18.827 -31.361 122 1HE2 GLN 18 HE21 GLN 18 2.185 -16.327 -32.070 123 2HE2 GLN 18 HE22 GLN 18 2.272 -15.544 -30.533 124 H TYR 19 HN TYR 19 8.069 -16.511 -32.791 125 HA TYR 19 HA TYR 19 9.471 -17.729 -30.625 126 1HB TYR 19 HB1 TYR 19 9.959 -15.661 -32.476 127 2HB TYR 19 HB2 TYR 19 10.042 -14.913 -30.884 128 HD1 TYR 19 HD1 TYR 19 11.322 -17.882 -32.752 129 HD2 TYR 19 HD2 TYR 19 12.030 -15.005 -29.699 130 HE1 TYR 19 HE1 TYR 19 13.602 -18.754 -32.467 131 HE2 TYR 19 HE2 TYR 19 14.313 -15.868 -29.407 132 HH TYR 19 HH TYR 19 15.997 -17.261 -31.189 133 H LYS 20 HN LYS 20 9.995 -16.316 -28.634 134 HA LYS 20 HA LYS 20 7.517 -15.863 -27.255 135 1HB LYS 20 HB2 LYS 20 8.987 -15.341 -25.315 136 2HB LYS 20 HB1 LYS 20 9.334 -16.900 -26.052 137 1HG LYS 20 HG1 LYS 20 11.322 -16.131 -27.017 138 2HG LYS 20 HG2 LYS 20 10.884 -14.438 -26.774 139 1HD LYS 20 HD2 LYS 20 10.857 -15.198 -24.234 140 2HD LYS 20 HD1 LYS 20 11.976 -16.418 -24.847 141 1HE LYS 20 HE2 LYS 20 12.530 -13.701 -25.786 142 2HE LYS 20 HE1 LYS 20 12.672 -13.902 -24.040 143 1HZ LYS 20 HZ1 LYS 20 13.912 -16.077 -25.316 144 2HZ LYS 20 HZ2 LYS 20 14.613 -14.893 -24.332 145 3HZ LYS 20 HZ3 LYS 20 14.503 -14.649 -26.001 146 H TYR 21 HN TYR 21 7.250 -13.863 -25.881 147 HA TYR 21 HA TYR 21 7.468 -11.550 -27.608 148 1HB TYR 21 HB1 TYR 21 5.972 -12.228 -25.119 149 2HB TYR 21 HB2 TYR 21 6.276 -10.528 -25.458 150 HD1 TYR 21 HD1 TYR 21 4.033 -13.167 -25.944 151 HD2 TYR 21 HD2 TYR 21 5.687 -9.795 -27.944 152 HE1 TYR 21 HE1 TYR 21 2.103 -13.131 -27.468 153 HE2 TYR 21 HE2 TYR 21 3.762 -9.750 -29.472 154 HH TYR 21 HH TYR 21 1.388 -10.522 -29.469 155 H ALA 22 HN ALA 22 9.424 -10.615 -27.634 156 HA ALA 22 HA ALA 22 11.159 -10.529 -25.368 157 1HB ALA 22 HB1 ALA 22 11.235 -9.510 -28.151 158 2HB ALA 22 HB2 ALA 22 12.411 -10.481 -27.265 159 3HB ALA 22 HB3 ALA 22 12.299 -8.746 -26.970 160 H ALA 23 HN ALA 23 12.211 -8.089 -25.158 161 HA ALA 23 HA ALA 23 10.266 -6.667 -23.637 162 1HB ALA 23 HB1 ALA 23 13.062 -5.865 -24.430 163 2HB ALA 23 HB2 ALA 23 12.603 -6.728 -22.963 164 3HB ALA 23 HB3 ALA 23 12.068 -5.067 -23.212 165 H GLY 24 HN GLY 24 8.783 -5.330 -24.418 166 1HA GLY 24 HA1 GLY 24 9.114 -4.187 -27.080 167 2HA GLY 24 HA2 GLY 24 7.648 -4.164 -26.111 168 H VAL 25 HN VAL 25 10.801 -3.172 -24.936 169 HA VAL 25 HA VAL 25 9.744 -0.448 -24.616 170 HB VAL 25 HB VAL 25 10.422 -1.702 -22.559 171 1HG1 VAL 25 HG11 VAL 25 12.823 -2.089 -24.086 172 2HG1 VAL 25 HG12 VAL 25 12.332 -2.830 -22.563 173 3HG1 VAL 25 HG13 VAL 25 13.191 -1.291 -22.558 174 1HG2 VAL 25 HG21 VAL 25 10.417 0.437 -21.915 175 2HG2 VAL 25 HG22 VAL 25 11.284 0.972 -23.355 176 3HG2 VAL 25 HG23 VAL 25 12.175 0.312 -21.985 177 H ARG 26 HN ARG 26 10.788 -1.326 -27.116 178 HA ARG 26 HA ARG 26 13.480 -0.432 -27.442 179 1HB ARG 26 HB1 ARG 26 11.346 -1.507 -29.140 180 2HB ARG 26 HB2 ARG 26 12.356 -0.320 -29.953 181 1HG ARG 26 HG1 ARG 26 13.855 -1.901 -30.316 182 2HG ARG 26 HG2 ARG 26 14.105 -2.031 -28.574 183 1HD ARG 26 HD1 ARG 26 11.771 -3.433 -28.983 184 2HD ARG 26 HD2 ARG 26 12.733 -3.830 -30.406 185 HE ARG 26 HE ARG 26 13.212 -4.670 -27.707 186 1HH1 ARG 26 HH11 ARG 26 14.698 -4.025 -30.794 187 2HH1 ARG 26 HH12 ARG 26 16.043 -5.078 -30.510 188 1HH2 ARG 26 HH21 ARG 26 14.979 -6.058 -27.327 189 2HH2 ARG 26 HH22 ARG 26 16.202 -6.234 -28.541 190 H ASN 27 HN ASN 27 13.506 1.169 -29.636 191 HA ASN 27 HA ASN 27 12.585 3.698 -28.511 192 1HB ASN 27 HB1 ASN 27 14.889 2.864 -30.005 193 2HB ASN 27 HB2 ASN 27 14.069 4.156 -30.878 194 1HD2 ASN 27 HD21 ASN 27 16.617 4.366 -29.721 195 2HD2 ASN 27 HD22 ASN 27 16.542 5.550 -28.466 196 HA PRO 28 HA PRO 28 10.800 3.913 -33.044 197 1HB PRO 28 HB2 PRO 28 10.344 1.483 -34.221 198 2HB PRO 28 HB1 PRO 28 11.786 2.462 -34.510 199 1HG PRO 28 HG2 PRO 28 11.416 0.129 -32.671 200 2HG PRO 28 HG1 PRO 28 12.774 0.500 -33.749 201 1HD PRO 28 HD2 PRO 28 12.897 0.981 -31.110 202 2HD PRO 28 HD1 PRO 28 13.669 2.060 -32.289 203 H GLN 29 HN GLN 29 8.809 4.483 -32.440 204 HA GLN 29 HA GLN 29 7.110 2.739 -30.907 205 1HB GLN 29 HB1 GLN 29 6.956 5.541 -31.913 206 2HB GLN 29 HB2 GLN 29 5.452 4.733 -31.493 207 1HG GLN 29 HG1 GLN 29 6.599 4.186 -29.267 208 2HG GLN 29 HG2 GLN 29 7.771 5.420 -29.729 209 1HE2 GLN 29 HE21 GLN 29 7.200 7.551 -29.670 210 2HE2 GLN 29 HE22 GLN 29 5.708 8.118 -29.011 211 H GLN 30 HN GLN 30 4.978 2.070 -31.549 212 HA GLN 30 HA GLN 30 4.885 1.345 -34.382 213 1HB GLN 30 HB2 GLN 30 2.879 0.327 -32.425 214 2HB GLN 30 HB1 GLN 30 3.623 -0.489 -33.793 215 1HG GLN 30 HG1 GLN 30 5.732 -0.022 -32.067 216 2HG GLN 30 HG2 GLN 30 4.393 -0.455 -31.004 217 1HE2 GLN 30 HE22 GLN 30 6.100 -2.233 -30.726 218 2HE2 GLN 30 HE21 GLN 30 5.878 -3.641 -31.703 219 H HIS 31 HN HIS 31 3.886 2.793 -35.627 220 HA HIS 31 HA HIS 31 1.615 4.301 -34.585 221 1HB HIS 31 HB1 HIS 31 3.694 4.881 -36.402 222 2HB HIS 31 HB2 HIS 31 2.210 4.859 -37.350 223 HD2 HIS 31 HD2 HIS 31 0.879 7.176 -37.317 224 HE1 HIS 31 HE1 HIS 31 2.590 8.740 -33.774 225 HE2 HIS 31 HE2 HIS 31 1.016 9.208 -35.707 226 H LEU 32 HN LEU 32 1.752 1.346 -35.542 227 HA LEU 32 HA LEU 32 -0.092 1.277 -37.747 228 1HB LEU 32 HB1 LEU 32 1.326 -0.710 -36.059 229 2HB LEU 32 HB2 LEU 32 -0.163 -1.239 -36.816 230 HG LEU 32 HG LEU 32 1.795 -1.833 -38.160 231 1HD1 LEU 32 HD11 LEU 32 -0.309 -1.422 -39.301 232 2HD1 LEU 32 HD12 LEU 32 1.048 -0.891 -40.294 233 3HD1 LEU 32 HD13 LEU 32 0.074 0.295 -39.424 234 1HD2 LEU 32 HD21 LEU 32 2.769 0.335 -39.376 235 2HD2 LEU 32 HD22 LEU 32 3.486 -0.350 -37.917 236 3HD2 LEU 32 HD23 LEU 32 2.403 1.037 -37.800 237 H ASN 33 HN ASN 33 -0.328 0.032 -34.409 238 HA ASN 33 HA ASN 33 -3.210 -0.003 -34.573 239 1HB ASN 33 HB1 ASN 33 -1.228 -1.291 -32.989 240 2HB ASN 33 HB2 ASN 33 -2.296 -0.414 -31.897 241 1HD2 ASN 33 HD21 ASN 33 -1.844 -3.238 -33.583 242 2HD2 ASN 33 HD22 ASN 33 -3.453 -3.863 -33.504 243 H ALA 34 HN ALA 34 -1.188 1.277 -31.945 244 HA ALA 34 HA ALA 34 -3.114 3.242 -31.233 245 1HB ALA 34 HB1 ALA 34 -1.204 4.108 -29.780 246 2HB ALA 34 HB2 ALA 34 -0.282 2.731 -30.382 247 3HB ALA 34 HB3 ALA 34 -1.772 2.466 -29.477 248 H GLN 35 HN GLN 35 -3.490 5.115 -32.200 249 HA GLN 35 HA GLN 35 -1.587 6.172 -34.111 250 1HB GLN 35 HB1 GLN 35 -4.410 6.254 -33.804 251 2HB GLN 35 HB2 GLN 35 -3.826 7.912 -33.770 252 1HG GLN 35 HG2 GLN 35 -3.799 7.854 -35.979 253 2HG GLN 35 HG1 GLN 35 -2.445 6.731 -35.867 254 1HE2 GLN 35 HE21 GLN 35 -5.951 6.514 -35.343 255 2HE2 GLN 35 HE22 GLN 35 -6.188 5.133 -36.353 256 HA PRO 36 HA PRO 36 -1.762 9.914 -31.055 257 1HB PRO 36 HB2 PRO 36 -2.719 9.481 -28.559 258 2HB PRO 36 HB1 PRO 36 -3.751 9.988 -29.902 259 1HG PRO 36 HG2 PRO 36 -3.322 7.247 -28.768 260 2HG PRO 36 HG1 PRO 36 -4.839 8.033 -29.249 261 1HD PRO 36 HD2 PRO 36 -3.568 6.239 -30.827 262 2HD PRO 36 HD1 PRO 36 -4.501 7.596 -31.488 263 H GLN 37 HN GLN 37 0.222 10.310 -30.324 264 HA GLN 37 HA GLN 37 1.645 8.193 -28.872 265 1HB GLN 37 HB2 GLN 37 3.695 9.418 -29.500 266 2HB GLN 37 HB1 GLN 37 2.741 8.956 -30.903 267 1HG GLN 37 HG2 GLN 37 1.841 11.503 -30.189 268 2HG GLN 37 HG1 GLN 37 3.598 11.558 -30.050 269 1HE2 GLN 37 HE22 GLN 37 1.426 12.520 -32.034 270 2HE2 GLN 37 HE21 GLN 37 2.107 12.124 -33.571 271 H VAL 38 HN VAL 38 -0.317 10.139 -27.728 272 HA VAL 38 HA VAL 38 1.388 11.714 -25.947 273 HB VAL 38 HB VAL 38 -0.601 12.762 -27.071 274 1HG1 VAL 38 HG21 VAL 38 -1.932 10.509 -26.250 275 2HG1 VAL 38 HG22 VAL 38 -2.685 11.993 -26.835 276 3HG1 VAL 38 HG23 VAL 38 -2.487 11.728 -25.102 277 1HG2 VAL 38 HG11 VAL 38 0.457 13.690 -25.039 278 2HG2 VAL 38 HG12 VAL 38 -0.691 12.779 -24.057 279 3HG2 VAL 38 HG13 VAL 38 -1.267 14.046 -25.141 280 H THR 39 HN THR 39 -0.119 8.722 -26.032 281 HA THR 39 HA THR 39 -0.835 8.557 -23.248 282 HB THR 39 HB THR 39 -0.473 6.011 -24.631 283 HG1 THR 39 HG1 THR 39 -0.928 7.361 -26.436 284 1HG2 THR 39 HG21 THR 39 -1.887 6.251 -22.662 285 2HG2 THR 39 HG22 THR 39 -2.798 5.668 -24.056 286 3HG2 THR 39 HG23 THR 39 -2.937 7.354 -23.553 287 H MET 40 HN MET 40 1.511 6.698 -25.196 288 HA MET 40 HA MET 40 3.010 6.066 -22.794 289 1HB MET 40 HB2 MET 40 4.454 4.782 -24.475 290 2HB MET 40 HB1 MET 40 2.806 4.220 -24.231 291 1HG MET 40 HG2 MET 40 2.867 6.152 -26.342 292 2HG MET 40 HG1 MET 40 4.063 4.892 -26.643 293 1HE MET 40 HE1 MET 40 2.823 3.076 -28.629 294 2HE MET 40 HE2 MET 40 2.731 4.834 -28.734 295 3HE MET 40 HE3 MET 40 1.283 3.859 -28.984 296 H GLN 41 HN GLN 41 3.373 8.538 -22.678 297 HA GLN 41 HA GLN 41 6.110 9.000 -23.414 298 1HB GLN 41 HB1 GLN 41 3.921 10.191 -24.967 299 2HB GLN 41 HB2 GLN 41 5.090 11.361 -24.372 300 1HG GLN 41 HG2 GLN 41 6.671 9.341 -25.368 301 2HG GLN 41 HG1 GLN 41 5.325 9.409 -26.505 302 1HE2 GLN 41 HE21 GLN 41 5.263 10.999 -27.965 303 2HE2 GLN 41 HE22 GLN 41 6.375 12.318 -28.040 304 H GLN 42 HN GLN 42 4.724 8.782 -20.961 305 HA GLN 42 HA GLN 42 5.553 11.258 -19.740 306 1HB GLN 42 HB2 GLN 42 3.162 11.637 -20.486 307 2HB GLN 42 HB1 GLN 42 2.691 10.388 -19.342 308 1HG GLN 42 HG1 GLN 42 4.111 11.936 -17.702 309 2HG GLN 42 HG2 GLN 42 3.598 13.157 -18.865 310 1HE2 GLN 42 HE21 GLN 42 1.759 14.119 -18.425 311 2HE2 GLN 42 HE22 GLN 42 0.464 13.467 -17.486 312 HA PRO 43 HA PRO 43 6.482 7.792 -16.969 313 1HB PRO 43 HB2 PRO 43 8.401 9.089 -15.563 314 2HB PRO 43 HB1 PRO 43 8.702 8.364 -17.146 315 1HG PRO 43 HG2 PRO 43 8.149 11.223 -16.444 316 2HG PRO 43 HG1 PRO 43 9.349 10.561 -17.568 317 1HD PRO 43 HD2 PRO 43 6.988 11.602 -18.395 318 2HD PRO 43 HD1 PRO 43 7.801 10.276 -19.250 319 H ALA 44 HN ALA 44 5.959 7.354 -14.839 320 HA ALA 44 HA ALA 44 4.008 9.001 -13.623 321 1HB ALA 44 HB1 ALA 44 4.371 6.443 -13.445 322 2HB ALA 44 HB2 ALA 44 3.759 7.325 -12.046 323 3HB ALA 44 HB3 ALA 44 5.458 6.861 -12.121 324 H VAL 45 HN VAL 45 4.474 10.911 -12.743 325 HA VAL 45 HA VAL 45 7.001 11.269 -11.311 326 HB VAL 45 HB VAL 45 6.198 13.711 -11.238 327 1HG1 VAL 45 HG11 VAL 45 7.803 13.831 -12.766 328 2HG1 VAL 45 HG12 VAL 45 6.605 13.479 -14.011 329 3HG1 VAL 45 HG13 VAL 45 7.505 12.163 -13.257 330 1HG2 VAL 45 HG21 VAL 45 3.991 13.781 -11.817 331 2HG2 VAL 45 HG22 VAL 45 4.134 12.446 -12.962 332 3HG2 VAL 45 HG23 VAL 45 4.717 14.053 -13.401 333 H HIS 46 HN HIS 46 6.731 12.910 -9.391 334 HA HIS 46 HA HIS 46 4.779 11.693 -7.580 335 1HB HIS 46 HB1 HIS 46 6.805 13.594 -6.535 336 2HB HIS 46 HB2 HIS 46 6.246 12.064 -5.868 337 HD2 HIS 46 HD2 HIS 46 7.845 9.925 -6.331 338 HE1 HIS 46 HE1 HIS 46 10.482 11.871 -9.011 339 HE2 HIS 46 HE2 HIS 46 10.047 9.749 -7.693 340 H VAL 47 HN VAL 47 3.573 13.019 -6.097 341 HA VAL 47 HA VAL 47 2.595 15.434 -7.369 342 HB VAL 47 HB VAL 47 0.879 15.430 -5.598 343 1HG1 VAL 47 HG11 VAL 47 1.356 13.174 -7.433 344 2HG1 VAL 47 HG12 VAL 47 -0.022 14.270 -7.309 345 3HG1 VAL 47 HG13 VAL 47 0.130 12.914 -6.192 346 1HG2 VAL 47 HG21 VAL 47 1.039 12.967 -4.403 347 2HG2 VAL 47 HG22 VAL 47 1.475 14.501 -3.652 348 3HG2 VAL 47 HG23 VAL 47 2.719 13.503 -4.406 349 H GLN 48 HN GLN 48 2.356 17.452 -6.246 350 HA GLN 48 HA GLN 48 4.708 18.179 -4.789 351 1HB GLN 48 HB1 GLN 48 2.959 19.538 -6.387 352 2HB GLN 48 HB2 GLN 48 2.463 20.085 -4.792 353 1HG GLN 48 HG2 GLN 48 4.048 21.641 -5.554 354 2HG GLN 48 HG1 GLN 48 4.880 20.644 -4.360 355 1HE2 GLN 48 HE21 GLN 48 5.175 22.047 -7.302 356 2HE2 GLN 48 HE22 GLN 48 6.401 21.042 -7.988 357 H GLY 49 HN GLY 49 1.356 17.531 -3.973 358 1HA GLY 49 HA2 GLY 49 1.635 18.458 -1.251 359 2HA GLY 49 HA1 GLY 49 0.241 17.640 -1.939 360 H GLN 50 HN GLN 50 2.980 17.334 0.028 361 HA GLN 50 HA GLN 50 3.161 14.452 -0.170 362 1HB GLN 50 HB1 GLN 50 4.803 14.753 1.741 363 2HB GLN 50 HB2 GLN 50 5.230 15.536 0.225 364 1HG GLN 50 HG1 GLN 50 5.293 17.531 1.184 365 2HG GLN 50 HG2 GLN 50 3.696 17.308 1.899 366 1HE2 GLN 50 HE22 GLN 50 7.022 16.139 2.321 367 2HE2 GLN 50 HE21 GLN 50 7.009 16.212 4.047 368 H GLU 51 HN GLU 51 0.608 15.002 0.460 369 HA GLU 51 HA GLU 51 0.138 15.058 3.279 370 1HB GLU 51 HB2 GLU 51 -1.803 14.181 1.142 371 2HB GLU 51 HB1 GLU 51 -2.180 14.793 2.746 372 1HG GLU 51 HG1 GLU 51 -1.543 16.984 2.174 373 2HG GLU 51 HG2 GLU 51 -0.753 16.447 0.692 374 HA PRO 52 HA PRO 52 -0.893 10.315 2.520 375 1HB PRO 52 HB2 PRO 52 0.957 9.780 0.265 376 2HB PRO 52 HB1 PRO 52 -0.671 9.159 0.559 377 1HG PRO 52 HG2 PRO 52 -0.229 11.006 -1.313 378 2HG PRO 52 HG1 PRO 52 -1.691 11.051 -0.311 379 1HD PRO 52 HD2 PRO 52 0.803 12.693 -0.106 380 2HD PRO 52 HD1 PRO 52 -0.891 13.184 0.108 381 H LEU 53 HN LEU 53 0.137 9.453 4.189 382 HA LEU 53 HA LEU 53 2.864 9.948 4.798 383 1HB LEU 53 HB2 LEU 53 0.591 8.760 6.048 384 2HB LEU 53 HB1 LEU 53 1.943 7.661 6.196 385 HG LEU 53 HG LEU 53 1.458 9.412 8.065 386 1HD1 LEU 53 HD11 LEU 53 3.351 8.550 8.788 387 2HD1 LEU 53 HD12 LEU 53 4.257 9.663 7.756 388 3HD1 LEU 53 HD13 LEU 53 3.782 8.078 7.143 389 1HD2 LEU 53 HD21 LEU 53 3.383 11.165 6.708 390 2HD2 LEU 53 HD22 LEU 53 2.049 11.555 7.796 391 3HD2 LEU 53 HD23 LEU 53 1.730 11.219 6.094 392 H THR 54 HN THR 54 4.658 8.767 4.426 393 HA THR 54 HA THR 54 4.694 6.013 3.861 394 HB THR 54 HB THR 54 5.769 7.182 1.433 395 HG1 THR 54 HG1 THR 54 2.994 7.199 1.381 396 1HG2 THR 54 HG21 THR 54 4.403 5.474 0.346 397 2HG2 THR 54 HG22 THR 54 3.657 5.094 1.897 398 3HG2 THR 54 HG23 THR 54 5.380 4.806 1.654 399 H ALA 55 HN ALA 55 7.006 5.537 2.718 400 HA ALA 55 HA ALA 55 8.919 6.154 4.596 401 1HB ALA 55 HB1 ALA 55 10.582 5.369 2.977 402 2HB ALA 55 HB2 ALA 55 9.370 5.460 1.699 403 3HB ALA 55 HB3 ALA 55 9.163 4.321 3.031 404 H SER 56 HN SER 56 8.086 7.919 1.664 405 HA SER 56 HA SER 56 10.309 9.670 1.666 406 1HB SER 56 HB1 SER 56 7.571 10.311 0.560 407 2HB SER 56 HB2 SER 56 9.129 10.931 0.018 408 HG SER 56 HG SER 56 8.692 8.168 -0.034 409 H MET 57 HN MET 57 7.003 10.018 2.917 410 HA MET 57 HA MET 57 7.215 12.632 3.889 411 1HB MET 57 HB1 MET 57 5.544 10.264 4.683 412 2HB MET 57 HB2 MET 57 5.436 11.771 5.572 413 1HG MET 57 HG1 MET 57 3.846 11.169 3.528 414 2HG MET 57 HG2 MET 57 4.310 12.822 3.926 415 1HE MET 57 HE1 MET 57 4.457 9.864 1.854 416 2HE MET 57 HE2 MET 57 6.170 9.870 1.433 417 3HE MET 57 HE3 MET 57 4.973 10.420 0.261 418 H LEU 58 HN LEU 58 7.971 9.532 5.357 419 HA LEU 58 HA LEU 58 8.600 10.448 7.939 420 1HB LEU 58 HB1 LEU 58 9.761 8.072 6.491 421 2HB LEU 58 HB2 LEU 58 9.654 8.294 8.229 422 HG LEU 58 HG LEU 58 7.161 8.274 6.574 423 1HD1 LEU 58 HD21 LEU 58 7.284 6.126 6.044 424 2HD1 LEU 58 HD22 LEU 58 7.736 5.687 7.691 425 3HD1 LEU 58 HD23 LEU 58 8.979 6.159 6.531 426 1HD2 LEU 58 HD11 LEU 58 7.486 7.065 9.272 427 2HD2 LEU 58 HD12 LEU 58 6.083 7.852 8.545 428 3HD2 LEU 58 HD13 LEU 58 7.443 8.822 9.118 429 H ALA 59 HN ALA 59 10.607 9.849 5.089 430 HA ALA 59 HA ALA 59 13.071 10.581 6.286 431 1HB ALA 59 HB1 ALA 59 12.842 11.034 3.398 432 2HB ALA 59 HB2 ALA 59 12.367 9.420 3.928 433 3HB ALA 59 HB3 ALA 59 13.977 10.034 4.306 434 H SER 60 HN SER 60 10.384 12.387 5.457 435 HA SER 60 HA SER 60 11.770 14.819 4.726 436 1HB SER 60 HB1 SER 60 9.517 14.238 3.809 437 2HB SER 60 HB2 SER 60 8.848 14.427 5.431 438 HG SER 60 HG SER 60 9.172 16.300 3.647 439 H ALA 61 HN ALA 61 11.151 13.199 7.569 440 HA ALA 61 HA ALA 61 11.556 15.659 9.130 441 1HB ALA 61 HB1 ALA 61 9.557 13.474 9.640 442 2HB ALA 61 HB2 ALA 61 9.279 15.210 9.500 443 3HB ALA 61 HB3 ALA 61 10.107 14.563 10.915 444 HA PRO 62 HA PRO 62 14.632 12.062 9.876 445 1HB PRO 62 HB1 PRO 62 16.458 14.405 9.664 446 2HB PRO 62 HB2 PRO 62 16.671 12.751 9.080 447 1HG PRO 62 HG2 PRO 62 16.054 14.715 7.393 448 2HG PRO 62 HG1 PRO 62 15.343 13.101 7.209 449 1HD PRO 62 HD2 PRO 62 14.115 15.605 8.273 450 2HD PRO 62 HD1 PRO 62 13.379 14.305 7.314 451 HA PRO 63 HA PRO 63 15.761 14.398 13.805 452 1HB PRO 63 HB1 PRO 63 15.847 17.052 13.968 453 2HB PRO 63 HB2 PRO 63 17.069 16.169 13.045 454 1HG PRO 63 HG2 PRO 63 14.752 17.767 12.082 455 2HG PRO 63 HG1 PRO 63 16.342 17.530 11.338 456 1HD PRO 63 HD2 PRO 63 13.933 16.159 10.716 457 2HD PRO 63 HD1 PRO 63 15.560 15.797 10.107 458 H GLN 64 HN GLN 64 12.845 14.605 12.460 459 HA GLN 64 HA GLN 64 11.602 15.745 14.873 460 1HB GLN 64 HB1 GLN 64 11.337 17.038 12.677 461 2HB GLN 64 HB2 GLN 64 10.289 15.724 12.164 462 1HG GLN 64 HG2 GLN 64 8.595 16.382 13.481 463 2HG GLN 64 HG1 GLN 64 9.664 16.869 14.795 464 1HE2 GLN 64 HE21 GLN 64 7.441 18.345 13.995 465 2HE2 GLN 64 HE22 GLN 64 7.982 19.847 13.338 466 H GLU 65 HN GLU 65 9.753 14.235 12.329 467 HA GLU 65 HA GLU 65 9.047 12.100 14.217 468 1HB GLU 65 HB1 GLU 65 7.322 12.418 11.874 469 2HB GLU 65 HB2 GLU 65 6.899 12.319 13.577 470 1HG GLU 65 HG2 GLU 65 8.073 14.812 13.323 471 2HG GLU 65 HG1 GLU 65 7.123 14.627 11.850 472 H GLN 66 HN GLN 66 11.407 11.847 12.627 473 HA GLN 66 HA GLN 66 11.029 10.370 10.276 474 1HB GLN 66 HB1 GLN 66 13.204 11.335 11.473 475 2HB GLN 66 HB2 GLN 66 13.316 9.679 12.054 476 1HG GLN 66 HG2 GLN 66 12.808 9.359 9.373 477 2HG GLN 66 HG1 GLN 66 13.855 10.776 9.421 478 1HE2 GLN 66 HE21 GLN 66 15.799 10.090 8.853 479 2HE2 GLN 66 HE22 GLN 66 16.634 8.744 9.542 480 H LYS 67 HN LYS 67 11.536 9.254 13.608 481 HA LYS 67 HA LYS 67 10.387 6.657 12.822 482 1HB LYS 67 HB2 LYS 67 11.658 5.683 14.713 483 2HB LYS 67 HB1 LYS 67 12.701 6.390 13.487 484 1HG LYS 67 HG2 LYS 67 13.115 8.310 14.851 485 2HG LYS 67 HG1 LYS 67 11.910 7.790 16.030 486 1HD LYS 67 HD1 LYS 67 13.381 6.481 17.073 487 2HD LYS 67 HD2 LYS 67 13.881 5.729 15.557 488 1HE LYS 67 HE1 LYS 67 15.461 7.461 15.129 489 2HE LYS 67 HE2 LYS 67 14.842 8.435 16.463 490 1HZ LYS 67 HZ1 LYS 67 15.646 6.799 18.017 491 2HZ LYS 67 HZ2 LYS 67 16.918 7.294 17.019 492 3HZ LYS 67 HZ3 LYS 67 16.174 5.797 16.761 493 H GLN 68 HN GLN 68 8.849 8.945 13.561 494 HA GLN 68 HA GLN 68 7.685 7.981 16.088 495 1HB GLN 68 HB1 GLN 68 7.715 10.851 15.149 496 2HB GLN 68 HB2 GLN 68 7.147 10.251 16.702 497 1HG GLN 68 HG1 GLN 68 9.956 9.674 15.983 498 2HG GLN 68 HG2 GLN 68 9.546 11.347 16.358 499 1HE2 GLN 68 HE21 GLN 68 9.094 11.923 18.429 500 2HE2 GLN 68 HE22 GLN 68 9.243 10.853 19.776 501 H MET 69 HN MET 69 6.981 9.855 13.135 502 HA MET 69 HA MET 69 4.149 9.447 13.429 503 1HB MET 69 HB2 MET 69 3.915 10.743 11.420 504 2HB MET 69 HB1 MET 69 5.126 11.510 12.438 505 1HG MET 69 HG2 MET 69 6.825 11.067 11.000 506 2HG MET 69 HG1 MET 69 6.076 9.591 10.392 507 1HE MET 69 HE1 MET 69 7.640 11.762 8.855 508 2HE MET 69 HE2 MET 69 6.901 13.275 9.381 509 3HE MET 69 HE3 MET 69 6.695 12.723 7.718 510 H LEU 70 HN LEU 70 6.562 7.451 12.399 511 HA LEU 70 HA LEU 70 5.545 6.312 10.050 512 1HB LEU 70 HB1 LEU 70 6.736 4.175 11.252 513 2HB LEU 70 HB2 LEU 70 7.560 5.374 10.285 514 HG LEU 70 HG LEU 70 8.357 6.528 12.224 515 1HD1 LEU 70 HD21 LEU 70 7.017 4.572 14.051 516 2HD1 LEU 70 HD22 LEU 70 6.189 6.041 13.538 517 3HD1 LEU 70 HD23 LEU 70 7.711 6.150 14.421 518 1HD2 LEU 70 HD11 LEU 70 9.735 4.820 13.233 519 2HD2 LEU 70 HD12 LEU 70 9.568 4.509 11.505 520 3HD2 LEU 70 HD13 LEU 70 8.636 3.562 12.667 521 H GLY 71 HN GLY 71 4.816 5.642 13.439 522 1HA GLY 71 HA2 GLY 71 2.542 4.036 12.508 523 2HA GLY 71 HA1 GLY 71 3.598 3.381 13.743 524 H GLU 72 HN GLU 72 2.797 6.783 13.588 525 HA GLU 72 HA GLU 72 0.804 6.496 15.705 526 1HB GLU 72 HB1 GLU 72 3.319 8.156 15.951 527 2HB GLU 72 HB2 GLU 72 1.937 8.303 17.027 528 1HG GLU 72 HG1 GLU 72 2.630 5.570 16.934 529 2HG GLU 72 HG2 GLU 72 4.122 6.486 17.148 530 H ARG 73 HN ARG 73 1.630 7.753 12.829 531 HA ARG 73 HA ARG 73 -0.236 10.005 13.107 532 1HB ARG 73 HB1 ARG 73 2.400 10.440 12.766 533 2HB ARG 73 HB2 ARG 73 1.921 10.239 11.088 534 1HG ARG 73 HG1 ARG 73 0.393 12.097 12.854 535 2HG ARG 73 HG2 ARG 73 1.937 12.601 12.165 536 1HD ARG 73 HD2 ARG 73 0.931 13.078 10.248 537 2HD ARG 73 HD1 ARG 73 0.417 11.397 10.098 538 HE ARG 73 HE ARG 73 -1.661 11.970 11.039 539 1HH1 ARG 73 HH21 ARG 73 0.453 14.720 10.691 540 2HH1 ARG 73 HH22 ARG 73 -0.819 15.881 10.865 541 1HH2 ARG 73 HH12 ARG 73 -3.341 13.495 11.268 542 2HH2 ARG 73 HH11 ARG 73 -2.975 15.186 11.192 543 H LEU 74 HN LEU 74 0.973 7.298 11.400 544 HA LEU 74 HA LEU 74 -0.436 7.722 8.943 545 1HB LEU 74 HB1 LEU 74 1.327 5.725 10.128 546 2HB LEU 74 HB2 LEU 74 0.037 5.006 9.184 547 HG LEU 74 HG LEU 74 1.503 7.232 7.927 548 1HD1 LEU 74 HD11 LEU 74 3.469 6.114 7.517 549 2HD1 LEU 74 HD12 LEU 74 2.770 4.536 7.887 550 3HD1 LEU 74 HD13 LEU 74 3.138 5.666 9.192 551 1HD2 LEU 74 HD21 LEU 74 -0.394 5.848 6.946 552 2HD2 LEU 74 HD22 LEU 74 0.783 4.539 6.820 553 3HD2 LEU 74 HD23 LEU 74 1.049 6.052 5.952 554 H PHE 75 HN PHE 75 -1.133 6.399 12.027 555 HA PHE 75 HA PHE 75 -3.005 4.495 11.692 556 1HB PHE 75 HB1 PHE 75 -2.160 5.912 13.807 557 2HB PHE 75 HB2 PHE 75 -3.760 6.614 13.632 558 HD1 PHE 75 HD1 PHE 75 -4.393 5.758 15.821 559 HD2 PHE 75 HD2 PHE 75 -3.204 3.131 12.689 560 HE1 PHE 75 HE1 PHE 75 -5.333 3.855 17.066 561 HE2 PHE 75 HE2 PHE 75 -4.140 1.223 13.932 562 HZ PHE 75 HZ PHE 75 -5.208 1.584 16.121 563 HA PRO 76 HA PRO 76 -6.631 7.563 10.907 564 1HB PRO 76 HB1 PRO 76 -6.066 10.148 10.337 565 2HB PRO 76 HB2 PRO 76 -6.312 9.567 11.988 566 1HG PRO 76 HG2 PRO 76 -3.754 10.091 10.522 567 2HG PRO 76 HG1 PRO 76 -4.191 10.502 12.191 568 1HD PRO 76 HD1 PRO 76 -2.662 8.353 11.561 569 2HD PRO 76 HD2 PRO 76 -3.751 8.378 12.961 570 H LEU 77 HN LEU 77 -3.662 7.623 9.171 571 HA LEU 77 HA LEU 77 -4.935 8.352 6.665 572 1HB LEU 77 HB1 LEU 77 -2.077 7.741 7.394 573 2HB LEU 77 HB2 LEU 77 -2.601 8.073 5.754 574 HG LEU 77 HG LEU 77 -2.818 9.977 8.090 575 1HD1 LEU 77 HD11 LEU 77 -0.527 9.435 7.014 576 2HD1 LEU 77 HD12 LEU 77 -0.992 11.118 7.258 577 3HD1 LEU 77 HD13 LEU 77 -1.131 10.387 5.659 578 1HD2 LEU 77 HD21 LEU 77 -4.638 10.204 6.434 579 2HD2 LEU 77 HD22 LEU 77 -3.425 10.447 5.176 580 3HD2 LEU 77 HD23 LEU 77 -3.575 11.611 6.493 581 H ILE 78 HN ILE 78 -4.087 5.493 8.389 582 HA ILE 78 HA ILE 78 -3.887 3.769 6.092 583 HB ILE 78 HB ILE 78 -4.605 2.931 8.884 584 1HG1 ILE 78 HG12 ILE 78 -2.457 4.296 8.705 585 2HG1 ILE 78 HG11 ILE 78 -2.307 2.694 9.418 586 1HG2 ILE 78 HG21 ILE 78 -3.069 0.977 7.649 587 2HG2 ILE 78 HG22 ILE 78 -4.159 1.552 6.385 588 3HG2 ILE 78 HG23 ILE 78 -4.813 0.946 7.908 589 1HD1 ILE 78 HD11 ILE 78 -1.679 3.341 6.551 590 2HD1 ILE 78 HD12 ILE 78 -1.384 1.818 7.392 591 3HD1 ILE 78 HD13 ILE 78 -0.490 3.268 7.851 592 H GLN 79 HN GLN 79 -6.381 4.857 8.314 593 HA GLN 79 HA GLN 79 -8.497 3.181 7.634 594 1HB GLN 79 HB1 GLN 79 -8.169 5.835 8.809 595 2HB GLN 79 HB2 GLN 79 -9.670 5.675 7.908 596 1HG GLN 79 HG2 GLN 79 -10.433 3.931 9.276 597 2HG GLN 79 HG1 GLN 79 -8.833 3.657 9.961 598 1HE2 GLN 79 HE21 GLN 79 -11.153 6.325 9.615 599 2HE2 GLN 79 HE22 GLN 79 -10.991 6.900 11.237 600 H ALA 80 HN ALA 80 -6.778 5.289 5.723 601 HA ALA 80 HA ALA 80 -8.842 5.899 3.786 602 1HB ALA 80 HB1 ALA 80 -5.917 6.291 3.292 603 2HB ALA 80 HB2 ALA 80 -6.773 7.342 4.423 604 3HB ALA 80 HB3 ALA 80 -7.287 7.258 2.739 605 H MET 81 HN MET 81 -5.956 3.842 4.028 606 HA MET 81 HA MET 81 -6.183 2.774 1.377 607 1HB MET 81 HB1 MET 81 -4.822 1.310 3.612 608 2HB MET 81 HB2 MET 81 -4.352 1.422 1.922 609 1HG MET 81 HG2 MET 81 -3.130 3.254 2.268 610 2HG MET 81 HG1 MET 81 -4.316 3.974 3.350 611 1HE MET 81 HE1 MET 81 -0.378 2.550 4.182 612 2HE MET 81 HE2 MET 81 -1.260 2.471 2.655 613 3HE MET 81 HE3 MET 81 -1.170 1.049 3.699 614 H HIS 82 HN HIS 82 -7.270 1.889 4.553 615 HA HIS 82 HA HIS 82 -8.746 -0.407 3.449 616 1HB HIS 82 HB2 HIS 82 -7.905 -0.083 6.331 617 2HB HIS 82 HB1 HIS 82 -8.349 -1.563 5.497 618 HD2 HIS 82 HD2 HIS 82 -6.294 -1.344 2.981 619 HE1 HIS 82 HE1 HIS 82 -3.394 -1.209 6.038 620 HE2 HIS 82 HE2 HIS 82 -3.789 -1.626 3.569 621 HA PRO 83 HA PRO 83 -12.698 1.456 4.206 622 1HB PRO 83 HB1 PRO 83 -12.988 -0.934 5.999 623 2HB PRO 83 HB2 PRO 83 -14.157 -0.237 4.871 624 1HG PRO 83 HG2 PRO 83 -12.662 -2.396 4.239 625 2HG PRO 83 HG1 PRO 83 -13.155 -1.197 3.032 626 1HD PRO 83 HD1 PRO 83 -10.489 -1.757 4.097 627 2HD PRO 83 HD2 PRO 83 -10.951 -0.804 2.673 628 H THR 84 HN THR 84 -11.199 -0.082 7.035 629 HA THR 84 HA THR 84 -10.666 2.214 8.480 630 HB THR 84 HB THR 84 -12.674 1.430 10.242 631 HG1 THR 84 HG1 THR 84 -14.555 1.395 9.051 632 1HG2 THR 84 HG21 THR 84 -11.974 3.776 8.804 633 2HG2 THR 84 HG22 THR 84 -12.871 3.618 10.314 634 3HG2 THR 84 HG23 THR 84 -13.727 3.579 8.772 635 H LEU 85 HN LEU 85 -10.188 -0.778 7.851 636 HA LEU 85 HA LEU 85 -10.143 -2.178 10.302 637 1HB LEU 85 HB1 LEU 85 -9.267 -2.600 7.569 638 2HB LEU 85 HB2 LEU 85 -8.120 -3.258 8.720 639 HG LEU 85 HG LEU 85 -10.052 -4.493 9.782 640 1HD1 LEU 85 HD21 LEU 85 -11.627 -2.857 8.315 641 2HD1 LEU 85 HD22 LEU 85 -12.145 -4.412 8.967 642 3HD1 LEU 85 HD23 LEU 85 -11.601 -4.294 7.293 643 1HD2 LEU 85 HD11 LEU 85 -9.193 -5.049 6.956 644 2HD2 LEU 85 HD12 LEU 85 -10.181 -6.169 7.893 645 3HD2 LEU 85 HD13 LEU 85 -8.563 -5.744 8.450 646 H ALA 86 HN ALA 86 -8.527 0.528 9.638 647 HA ALA 86 HA ALA 86 -5.882 -0.151 10.548 648 1HB ALA 86 HB1 ALA 86 -6.276 1.704 8.990 649 2HB ALA 86 HB2 ALA 86 -5.466 2.246 10.460 650 3HB ALA 86 HB3 ALA 86 -7.188 2.555 10.236 651 H GLY 87 HN GLY 87 -7.578 -1.145 12.414 652 1HA GLY 87 HA1 GLY 87 -7.787 0.758 14.614 653 2HA GLY 87 HA2 GLY 87 -8.337 -0.914 14.624 654 H LYS 88 HN LYS 88 -5.463 -1.217 13.286 655 HA LYS 88 HA LYS 88 -3.597 -0.776 15.347 656 1HB LYS 88 HB1 LYS 88 -4.923 -2.510 16.496 657 2HB LYS 88 HB2 LYS 88 -4.652 -3.606 15.151 658 1HG LYS 88 HG1 LYS 88 -2.104 -2.967 15.786 659 2HG LYS 88 HG2 LYS 88 -2.881 -2.867 17.374 660 1HD LYS 88 HD2 LYS 88 -2.468 -5.086 17.416 661 2HD LYS 88 HD1 LYS 88 -3.949 -5.170 16.456 662 1HE LYS 88 HE2 LYS 88 -2.546 -5.050 14.400 663 2HE LYS 88 HE1 LYS 88 -1.117 -5.141 15.424 664 1HZ LYS 88 HZ1 LYS 88 -1.434 -7.320 15.839 665 2HZ LYS 88 HZ2 LYS 88 -2.257 -7.271 14.362 666 3HZ LYS 88 HZ3 LYS 88 -3.122 -7.214 15.814 667 H ILE 89 HN ILE 89 -3.912 -0.672 12.387 668 HA ILE 89 HA ILE 89 -2.109 -2.708 11.414 669 HB ILE 89 HB ILE 89 -3.224 -0.281 9.997 670 1HG1 ILE 89 HG11 ILE 89 -3.909 -3.171 9.486 671 2HG1 ILE 89 HG12 ILE 89 -4.739 -2.259 10.742 672 1HG2 ILE 89 HG21 ILE 89 -1.115 -2.148 9.282 673 2HG2 ILE 89 HG22 ILE 89 -1.584 -0.626 8.519 674 3HG2 ILE 89 HG23 ILE 89 -2.420 -2.120 8.095 675 1HD1 ILE 89 HD11 ILE 89 -4.705 -0.798 8.261 676 2HD1 ILE 89 HD12 ILE 89 -6.069 -1.299 9.259 677 3HD1 ILE 89 HD13 ILE 89 -5.409 -2.402 8.053 678 H THR 90 HN THR 90 -1.757 0.754 10.705 679 HA THR 90 HA THR 90 1.009 0.732 10.550 680 HB THR 90 HB THR 90 -1.081 2.692 10.582 681 HG1 THR 90 HG1 THR 90 0.207 3.577 9.091 682 1HG2 THR 90 HG21 THR 90 -0.497 3.878 12.411 683 2HG2 THR 90 HG22 THR 90 0.659 4.559 11.264 684 3HG2 THR 90 HG23 THR 90 1.170 3.303 12.393 685 H GLY 91 HN GLY 91 -1.043 1.247 13.403 686 1HA GLY 91 HA2 GLY 91 0.958 1.942 15.247 687 2HA GLY 91 HA1 GLY 91 -0.532 1.089 15.644 688 H MET 92 HN MET 92 0.020 -1.078 13.827 689 HA MET 92 HA MET 92 1.603 -2.769 15.525 690 1HB MET 92 HB1 MET 92 -0.417 -3.350 13.918 691 2HB MET 92 HB2 MET 92 0.856 -3.513 12.723 692 1HG MET 92 HG1 MET 92 1.915 -4.961 14.670 693 2HG MET 92 HG2 MET 92 0.221 -5.199 15.046 694 1HE MET 92 HE1 MET 92 -1.384 -5.328 12.868 695 2HE MET 92 HE2 MET 92 -1.103 -6.556 11.632 696 3HE MET 92 HE3 MET 92 -0.449 -4.931 11.425 697 H LEU 93 HN LEU 93 1.944 -1.216 12.422 698 HA LEU 93 HA LEU 93 4.221 -2.406 11.451 699 1HB LEU 93 HB2 LEU 93 2.994 0.275 11.132 700 2HB LEU 93 HB1 LEU 93 4.567 -0.015 10.423 701 HG LEU 93 HG LEU 93 2.727 -0.363 8.809 702 1HD1 LEU 93 HD11 LEU 93 3.386 -2.952 8.480 703 2HD1 LEU 93 HD12 LEU 93 4.670 -2.442 9.578 704 3HD1 LEU 93 HD13 LEU 93 4.444 -1.611 8.039 705 1HD2 LEU 93 HD21 LEU 93 1.943 -2.728 10.503 706 2HD2 LEU 93 HD22 LEU 93 1.137 -2.105 9.058 707 3HD2 LEU 93 HD23 LEU 93 1.112 -1.175 10.558 708 H LEU 94 HN LEU 94 3.973 -0.609 14.258 709 HA LEU 94 HA LEU 94 6.838 0.050 14.232 710 1HB LEU 94 HB1 LEU 94 4.469 1.290 15.445 711 2HB LEU 94 HB2 LEU 94 5.830 1.139 16.537 712 HG LEU 94 HG LEU 94 5.635 3.327 15.267 713 1HD1 LEU 94 HD21 LEU 94 8.217 2.912 14.482 714 2HD1 LEU 94 HD22 LEU 94 7.980 1.633 15.672 715 3HD1 LEU 94 HD23 LEU 94 7.701 3.316 16.119 716 1HD2 LEU 94 HD11 LEU 94 5.008 2.527 13.094 717 2HD2 LEU 94 HD12 LEU 94 6.464 1.536 12.988 718 3HD2 LEU 94 HD13 LEU 94 6.592 3.296 12.965 719 H GLU 95 HN GLU 95 5.621 -2.576 14.517 720 HA GLU 95 HA GLU 95 7.100 -3.542 16.732 721 1HB GLU 95 HB2 GLU 95 5.401 -4.184 18.246 722 2HB GLU 95 HB1 GLU 95 5.053 -2.511 17.835 723 1HG GLU 95 HG1 GLU 95 3.227 -3.095 16.495 724 2HG GLU 95 HG2 GLU 95 3.727 -4.783 16.399 725 H ILE 96 HN ILE 96 5.583 -3.969 13.819 726 HA ILE 96 HA ILE 96 4.729 -6.650 13.927 727 HB ILE 96 HB ILE 96 4.878 -6.742 11.548 728 1HG1 ILE 96 HG12 ILE 96 7.148 -5.748 11.388 729 2HG1 ILE 96 HG11 ILE 96 6.013 -5.161 10.181 730 1HG2 ILE 96 HG21 ILE 96 3.871 -4.384 10.981 731 2HG2 ILE 96 HG22 ILE 96 3.832 -4.241 12.739 732 3HG2 ILE 96 HG23 ILE 96 2.978 -5.565 11.945 733 1HD1 ILE 96 HD11 ILE 96 7.619 -3.653 11.839 734 2HD1 ILE 96 HD12 ILE 96 5.997 -3.494 12.514 735 3HD1 ILE 96 HD13 ILE 96 6.293 -3.081 10.823 736 H ASP 97 HN ASP 97 6.247 -7.617 11.640 737 HA ASP 97 HA ASP 97 8.169 -9.230 12.820 738 1HB ASP 97 HB1 ASP 97 6.957 -9.322 10.506 739 2HB ASP 97 HB2 ASP 97 8.325 -8.362 9.945 740 H ASN 98 HN ASN 98 8.291 -5.955 12.235 741 HA ASN 98 HA ASN 98 9.891 -4.408 12.624 742 1HB ASN 98 HB1 ASN 98 11.770 -6.754 12.933 743 2HB ASN 98 HB2 ASN 98 12.206 -5.074 13.228 744 1HD2 ASN 98 HD22 ASN 98 11.659 -4.130 15.116 745 2HD2 ASN 98 HD21 ASN 98 10.844 -4.942 16.405 746 H SER 99 HN SER 99 10.241 -6.871 10.249 747 HA SER 99 HA SER 99 12.195 -5.481 8.658 748 1HB SER 99 HB1 SER 99 10.293 -7.525 7.543 749 2HB SER 99 HB2 SER 99 11.969 -7.202 7.095 750 HG SER 99 HG SER 99 11.770 -7.932 9.692 751 H GLU 100 HN GLU 100 8.757 -5.533 9.036 752 HA GLU 100 HA GLU 100 8.135 -4.070 6.641 753 1HB GLU 100 HB1 GLU 100 6.542 -4.566 9.146 754 2HB GLU 100 HB2 GLU 100 5.917 -3.789 7.711 755 1HG GLU 100 HG2 GLU 100 5.166 -5.920 7.449 756 2HG GLU 100 HG1 GLU 100 6.662 -5.956 6.516 757 H LEU 101 HN LEU 101 8.724 -3.377 10.026 758 HA LEU 101 HA LEU 101 8.082 -0.624 9.972 759 1HB LEU 101 HB2 LEU 101 8.219 -1.478 12.118 760 2HB LEU 101 HB1 LEU 101 9.646 -2.429 11.764 761 HG LEU 101 HG LEU 101 10.653 0.085 11.534 762 1HD1 LEU 101 HD11 LEU 101 9.443 1.628 12.562 763 2HD1 LEU 101 HD12 LEU 101 9.358 0.639 14.020 764 3HD1 LEU 101 HD13 LEU 101 8.147 0.449 12.753 765 1HD2 LEU 101 HD21 LEU 101 10.449 -1.256 14.208 766 2HD2 LEU 101 HD22 LEU 101 11.803 -0.364 13.514 767 3HD2 LEU 101 HD23 LEU 101 11.388 -1.959 12.890 768 H LEU 102 HN LEU 102 10.771 -2.470 8.894 769 HA LEU 102 HA LEU 102 12.577 -0.210 8.726 770 1HB LEU 102 HB2 LEU 102 12.732 -3.130 8.064 771 2HB LEU 102 HB1 LEU 102 13.943 -2.027 7.445 772 HG LEU 102 HG LEU 102 13.712 -3.245 10.061 773 1HD1 LEU 102 HD11 LEU 102 15.715 -3.474 8.879 774 2HD1 LEU 102 HD12 LEU 102 16.083 -2.335 10.174 775 3HD1 LEU 102 HD13 LEU 102 15.812 -1.747 8.534 776 1HD2 LEU 102 HD21 LEU 102 14.604 -1.101 11.209 777 2HD2 LEU 102 HD22 LEU 102 12.863 -1.338 11.046 778 3HD2 LEU 102 HD23 LEU 102 13.715 -0.259 9.940 779 H HIS 103 HN HIS 103 10.921 -2.405 6.488 780 HA HIS 103 HA HIS 103 11.860 -1.205 4.127 781 1HB HIS 103 HB1 HIS 103 10.398 -3.449 4.801 782 2HB HIS 103 HB2 HIS 103 9.226 -2.466 3.937 783 HD2 HIS 103 HD2 HIS 103 10.509 -5.257 2.688 784 HE1 HIS 103 HE1 HIS 103 12.392 -2.548 0.035 785 HE2 HIS 103 HE2 HIS 103 11.736 -4.968 0.420 786 H MET 104 HN MET 104 8.919 -0.700 6.032 787 HA MET 104 HA MET 104 7.524 0.957 4.302 788 1HB MET 104 HB2 MET 104 6.321 1.738 6.271 789 2HB MET 104 HB1 MET 104 6.604 0.005 6.400 790 1HG MET 104 HG1 MET 104 7.942 0.231 8.189 791 2HG MET 104 HG2 MET 104 8.665 1.718 7.582 792 1HE MET 104 HE1 MET 104 4.473 1.573 9.423 793 2HE MET 104 HE2 MET 104 5.217 0.383 8.349 794 3HE MET 104 HE3 MET 104 4.661 1.930 7.704 795 H LEU 105 HN LEU 105 10.188 1.707 6.467 796 HA LEU 105 HA LEU 105 9.921 4.564 6.013 797 1HB LEU 105 HB1 LEU 105 12.262 3.242 7.348 798 2HB LEU 105 HB2 LEU 105 11.638 4.861 7.590 799 HG LEU 105 HG LEU 105 10.223 2.342 8.458 800 1HD1 LEU 105 HD11 LEU 105 11.018 2.694 10.630 801 2HD1 LEU 105 HD12 LEU 105 11.592 4.318 10.253 802 3HD1 LEU 105 HD13 LEU 105 12.436 2.911 9.605 803 1HD2 LEU 105 HD21 LEU 105 8.695 4.157 8.040 804 2HD2 LEU 105 HD22 LEU 105 9.689 5.256 8.995 805 3HD2 LEU 105 HD23 LEU 105 8.858 3.912 9.779 806 H GLU 106 HN GLU 106 11.340 1.934 4.470 807 HA GLU 106 HA GLU 106 13.409 3.625 3.267 808 1HB GLU 106 HB1 GLU 106 14.737 1.779 3.044 809 2HB GLU 106 HB2 GLU 106 13.762 1.251 4.408 810 1HG GLU 106 HG1 GLU 106 13.415 -0.589 3.214 811 2HG GLU 106 HG2 GLU 106 12.273 0.391 2.294 812 H SER 107 HN SER 107 10.344 2.440 2.520 813 HA SER 107 HA SER 107 10.852 2.976 -0.319 814 1HB SER 107 HB2 SER 107 10.738 0.417 0.488 815 2HB SER 107 HB1 SER 107 9.017 0.719 0.260 816 HG SER 107 HG SER 107 9.416 0.402 -1.772 817 HA PRO 108 HA PRO 108 7.086 5.305 0.140 818 1HB PRO 108 HB2 PRO 108 6.648 5.867 -2.465 819 2HB PRO 108 HB1 PRO 108 7.932 6.649 -1.534 820 1HG PRO 108 HG2 PRO 108 8.107 4.337 -3.434 821 2HG PRO 108 HG1 PRO 108 9.170 5.750 -3.296 822 1HD PRO 108 HD2 PRO 108 9.796 3.336 -2.230 823 2HD PRO 108 HD1 PRO 108 10.313 4.869 -1.500 824 H GLU 109 HN GLU 109 7.376 2.245 -1.052 825 HA GLU 109 HA GLU 109 4.469 2.004 -1.494 826 1HB GLU 109 HB2 GLU 109 6.672 0.409 -2.824 827 2HB GLU 109 HB1 GLU 109 4.947 0.149 -3.048 828 1HG GLU 109 HG1 GLU 109 4.682 2.146 -4.231 829 2HG GLU 109 HG2 GLU 109 6.233 2.780 -3.681 830 H SER 110 HN SER 110 7.132 1.172 0.362 831 HA SER 110 HA SER 110 6.216 -1.437 1.169 832 1HB SER 110 HB1 SER 110 8.542 0.254 1.710 833 2HB SER 110 HB2 SER 110 7.967 -0.628 3.126 834 HG SER 110 HG SER 110 8.407 -1.870 0.619 835 H LEU 111 HN LEU 111 6.324 1.804 2.531 836 HA LEU 111 HA LEU 111 5.126 1.406 4.973 837 1HB LEU 111 HB1 LEU 111 6.020 3.529 3.870 838 2HB LEU 111 HB2 LEU 111 4.454 3.669 3.092 839 HG LEU 111 HG LEU 111 4.355 5.125 4.914 840 1HD1 LEU 111 HD21 LEU 111 2.532 4.409 6.100 841 2HD1 LEU 111 HD22 LEU 111 3.147 2.766 6.267 842 3HD1 LEU 111 HD23 LEU 111 2.496 3.311 4.722 843 1HD2 LEU 111 HD11 LEU 111 5.198 4.766 7.057 844 2HD2 LEU 111 HD12 LEU 111 6.423 4.105 5.970 845 3HD2 LEU 111 HD13 LEU 111 5.309 3.024 6.818 846 H ARG 112 HN ARG 112 3.667 1.629 1.762 847 HA ARG 112 HA ARG 112 0.992 1.311 2.748 848 1HB ARG 112 HB2 ARG 112 0.755 2.399 0.800 849 2HB ARG 112 HB1 ARG 112 2.285 1.806 0.165 850 1HG ARG 112 HG1 ARG 112 1.260 -0.241 -0.539 851 2HG ARG 112 HG2 ARG 112 -0.259 0.197 0.249 852 1HD ARG 112 HD2 ARG 112 -0.722 1.880 -1.305 853 2HD ARG 112 HD1 ARG 112 0.944 1.933 -1.879 854 HE ARG 112 HE ARG 112 -1.102 -0.002 -2.628 855 1HH1 ARG 112 HH21 ARG 112 2.221 1.033 -2.815 856 2HH1 ARG 112 HH22 ARG 112 2.574 0.078 -4.215 857 1HH2 ARG 112 HH12 ARG 112 -0.644 -1.262 -4.472 858 2HH2 ARG 112 HH11 ARG 112 0.945 -1.227 -5.157 859 H SER 113 HN SER 113 3.043 -0.738 0.662 860 HA SER 113 HA SER 113 1.423 -2.969 0.584 861 1HB SER 113 HB2 SER 113 3.231 -3.066 -0.878 862 2HB SER 113 HB1 SER 113 4.390 -2.590 0.363 863 HG SER 113 HG SER 113 3.772 -5.033 -0.425 864 H LYS 114 HN LYS 114 4.165 -2.455 2.798 865 HA LYS 114 HA LYS 114 3.819 -4.714 4.360 866 1HB LYS 114 HB1 LYS 114 4.814 -2.019 5.302 867 2HB LYS 114 HB2 LYS 114 5.113 -3.567 6.080 868 1HG LYS 114 HG1 LYS 114 6.021 -2.902 3.291 869 2HG LYS 114 HG2 LYS 114 7.014 -2.676 4.732 870 1HD LYS 114 HD1 LYS 114 7.703 -4.775 4.424 871 2HD LYS 114 HD2 LYS 114 6.102 -5.270 4.978 872 1HE LYS 114 HE1 LYS 114 6.962 -6.207 2.745 873 2HE LYS 114 HE2 LYS 114 5.314 -5.584 2.811 874 1HZ LYS 114 HZ1 LYS 114 7.591 -3.914 1.928 875 2HZ LYS 114 HZ2 LYS 114 5.939 -3.638 1.695 876 3HZ LYS 114 HZ3 LYS 114 6.715 -4.880 0.851 877 H VAL 115 HN VAL 115 2.099 -1.640 4.466 878 HA VAL 115 HA VAL 115 0.877 -2.111 7.001 879 HB VAL 115 HB VAL 115 0.534 -0.114 4.841 880 1HG1 VAL 115 HG11 VAL 115 -1.627 -0.340 6.915 881 2HG1 VAL 115 HG12 VAL 115 -1.795 -1.105 5.336 882 3HG1 VAL 115 HG13 VAL 115 -1.602 0.645 5.450 883 1HG2 VAL 115 HG21 VAL 115 0.205 0.476 7.723 884 2HG2 VAL 115 HG22 VAL 115 1.088 1.359 6.476 885 3HG2 VAL 115 HG23 VAL 115 1.787 -0.094 7.190 886 H ASP 116 HN ASP 116 -0.523 -2.187 3.700 887 HA ASP 116 HA ASP 116 -2.916 -3.394 4.290 888 1HB ASP 116 HB1 ASP 116 -1.560 -2.724 1.972 889 2HB ASP 116 HB2 ASP 116 -1.747 -4.470 1.838 890 H GLU 117 HN GLU 117 0.230 -4.924 3.921 891 HA GLU 117 HA GLU 117 -0.781 -7.605 4.039 892 1HB GLU 117 HB1 GLU 117 1.840 -6.300 3.844 893 2HB GLU 117 HB2 GLU 117 1.858 -7.762 4.821 894 1HG GLU 117 HG2 GLU 117 1.655 -9.086 3.043 895 2HG GLU 117 HG1 GLU 117 0.397 -8.081 2.325 896 H ALA 118 HN ALA 118 0.537 -5.285 6.343 897 HA ALA 118 HA ALA 118 0.678 -7.014 8.569 898 1HB ALA 118 HB1 ALA 118 0.919 -5.097 9.905 899 2HB ALA 118 HB2 ALA 118 0.063 -4.078 8.745 900 3HB ALA 118 HB3 ALA 118 1.675 -4.686 8.365 901 H VAL 119 HN VAL 119 -1.912 -5.310 7.007 902 HA VAL 119 HA VAL 119 -3.887 -5.337 8.985 903 HB VAL 119 HB VAL 119 -4.378 -5.879 6.064 904 1HG1 VAL 119 HG11 VAL 119 -6.430 -4.513 6.562 905 2HG1 VAL 119 HG12 VAL 119 -6.008 -4.644 8.269 906 3HG1 VAL 119 HG13 VAL 119 -6.366 -6.101 7.336 907 1HG2 VAL 119 HG21 VAL 119 -2.893 -4.028 6.150 908 2HG2 VAL 119 HG22 VAL 119 -3.803 -3.288 7.465 909 3HG2 VAL 119 HG23 VAL 119 -4.516 -3.406 5.856 910 H ALA 120 HN ALA 120 -3.176 -7.664 6.426 911 HA ALA 120 HA ALA 120 -5.006 -9.643 7.084 912 1HB ALA 120 HB1 ALA 120 -2.552 -10.825 6.200 913 2HB ALA 120 HB2 ALA 120 -2.823 -9.316 5.320 914 3HB ALA 120 HB3 ALA 120 -4.052 -10.586 5.301 915 H VAL 121 HN VAL 121 -2.023 -8.709 8.541 916 HA VAL 121 HA VAL 121 -1.765 -11.076 10.174 917 HB VAL 121 HB VAL 121 -0.215 -8.525 9.869 918 1HG1 VAL 121 HG21 VAL 121 -0.398 -10.102 12.276 919 2HG1 VAL 121 HG22 VAL 121 0.437 -8.575 11.983 920 3HG1 VAL 121 HG23 VAL 121 1.242 -10.104 11.628 921 1HG2 VAL 121 HG11 VAL 121 0.948 -11.261 9.812 922 2HG2 VAL 121 HG12 VAL 121 1.397 -9.822 8.898 923 3HG2 VAL 121 HG13 VAL 121 -0.046 -10.732 8.454 924 H LEU 122 HN LEU 122 -2.994 -7.819 10.451 925 HA LEU 122 HA LEU 122 -3.192 -7.776 13.297 926 1HB LEU 122 HB2 LEU 122 -3.535 -5.625 12.859 927 2HB LEU 122 HB1 LEU 122 -3.638 -5.979 11.148 928 HG LEU 122 HG LEU 122 -6.157 -6.655 12.111 929 1HD1 LEU 122 HD11 LEU 122 -6.858 -4.604 13.312 930 2HD1 LEU 122 HD12 LEU 122 -5.160 -4.151 13.456 931 3HD1 LEU 122 HD13 LEU 122 -5.752 -5.617 14.238 932 1HD2 LEU 122 HD21 LEU 122 -6.084 -5.635 10.057 933 2HD2 LEU 122 HD22 LEU 122 -4.988 -4.365 10.605 934 3HD2 LEU 122 HD23 LEU 122 -6.691 -4.323 11.067 935 H GLN 123 HN GLN 123 -5.388 -8.507 10.639 936 HA GLN 123 HA GLN 123 -7.657 -9.024 12.269 937 1HB GLN 123 HB1 GLN 123 -6.951 -9.774 9.431 938 2HB GLN 123 HB2 GLN 123 -8.485 -10.210 10.174 939 1HG GLN 123 HG1 GLN 123 -7.433 -7.428 9.714 940 2HG GLN 123 HG2 GLN 123 -8.740 -8.223 8.838 941 1HE2 GLN 123 HE21 GLN 123 -10.696 -8.677 9.967 942 2HE2 GLN 123 HE22 GLN 123 -11.160 -7.724 11.331 943 H ALA 124 HN ALA 124 -4.877 -10.838 11.308 944 HA ALA 124 HA ALA 124 -6.007 -13.397 12.107 945 1HB ALA 124 HB1 ALA 124 -4.557 -13.421 10.199 946 2HB ALA 124 HB2 ALA 124 -3.743 -14.260 11.521 947 3HB ALA 124 HB3 ALA 124 -3.276 -12.611 11.103 948 H HIS 125 HN HIS 125 -4.445 -10.793 13.600 949 HA HIS 125 HA HIS 125 -3.535 -12.511 15.816 950 1HB HIS 125 HB1 HIS 125 -2.205 -10.438 14.409 951 2HB HIS 125 HB2 HIS 125 -2.527 -9.829 16.029 952 HD2 HIS 125 HD2 HIS 125 -1.185 -11.122 18.101 953 HE1 HIS 125 HE1 HIS 125 1.285 -13.398 15.524 954 HE2 HIS 125 HE2 HIS 125 0.893 -12.667 17.921 955 H GLN 126 HN GLN 126 -6.017 -10.526 14.943 956 HA GLN 126 HA GLN 126 -6.350 -8.942 17.269 957 1HB GLN 126 HB1 GLN 126 -7.965 -9.624 14.891 958 2HB GLN 126 HB2 GLN 126 -8.878 -9.158 16.320 959 1HG GLN 126 HG2 GLN 126 -6.695 -7.532 15.032 960 2HG GLN 126 HG1 GLN 126 -8.427 -7.260 14.846 961 1HE2 GLN 126 HE21 GLN 126 -5.687 -6.978 16.944 962 2HE2 GLN 126 HE22 GLN 126 -6.445 -5.997 18.147 963 H ALA 127 HN ALA 127 -9.151 -10.819 16.599 964 HA ALA 127 HA ALA 127 -9.024 -11.931 19.299 965 1HB ALA 127 HB1 ALA 127 -11.251 -11.725 19.379 966 2HB ALA 127 HB2 ALA 127 -11.469 -12.386 17.759 967 3HB ALA 127 HB3 ALA 127 -11.050 -10.686 17.968 968 H LYS 128 HN LYS 128 -7.661 -12.980 16.751 969 HA LYS 128 HA LYS 128 -8.899 -15.539 16.309 970 1HB LYS 128 HB2 LYS 128 -6.136 -14.641 15.481 971 2HB LYS 128 HB1 LYS 128 -7.073 -15.963 14.797 972 1HG LYS 128 HG2 LYS 128 -8.671 -13.673 14.559 973 2HG LYS 128 HG1 LYS 128 -7.041 -13.199 14.075 974 1HD LYS 128 HD1 LYS 128 -7.983 -13.971 12.092 975 2HD LYS 128 HD2 LYS 128 -7.064 -15.362 12.674 976 1HE LYS 128 HE1 LYS 128 -8.944 -16.551 13.219 977 2HE LYS 128 HE2 LYS 128 -9.909 -15.102 13.500 978 1HZ LYS 128 HZ1 LYS 128 -10.787 -15.785 11.536 979 2HZ LYS 128 HZ2 LYS 128 -9.357 -16.513 10.998 980 3HZ LYS 128 HZ3 LYS 128 -9.531 -14.831 10.926 981 H GLU 129 HN GLU 129 -6.451 -17.057 16.112 982 HA GLU 129 HA GLU 129 -6.241 -17.856 18.899 983 1HB GLU 129 HB2 GLU 129 -5.046 -19.096 16.410 984 2HB GLU 129 HB1 GLU 129 -5.040 -19.808 18.017 985 1HG GLU 129 HG1 GLU 129 -6.850 -20.890 17.268 986 2HG GLU 129 HG2 GLU 129 -7.679 -19.393 17.691 987 H ALA 130 HN ALA 130 -4.565 -15.930 16.686 988 HA ALA 130 HA ALA 130 -1.899 -16.350 17.565 989 1HB ALA 130 HB1 ALA 130 -1.644 -13.965 16.540 990 2HB ALA 130 HB2 ALA 130 -3.289 -14.249 15.966 991 3HB ALA 130 HB3 ALA 130 -1.989 -15.345 15.497 992 H ALA 131 HN ALA 131 -4.559 -14.848 19.016 993 HA ALA 131 HA ALA 131 -3.359 -12.725 20.408 994 1HB ALA 131 HB1 ALA 131 -5.567 -14.293 21.653 995 2HB ALA 131 HB2 ALA 131 -5.867 -13.427 20.146 996 3HB ALA 131 HB3 ALA 131 -5.327 -12.548 21.578 997 H GLN 132 HN GLN 132 -1.490 -13.092 21.473 998 HA GLN 132 HA GLN 132 -1.079 -15.471 23.046 999 1HB GLN 132 HB2 GLN 132 0.711 -13.081 23.229 1000 2HB GLN 132 HB1 GLN 132 1.126 -14.789 23.270 1001 1HG GLN 132 HG2 GLN 132 0.862 -14.999 20.924 1002 2HG GLN 132 HG1 GLN 132 0.126 -13.402 20.801 1003 1HE2 GLN 132 HE22 GLN 132 1.431 -11.563 21.010 1004 2HE2 GLN 132 HE21 GLN 132 3.143 -11.639 20.787 1005 H LYS 133 HN LYS 133 -1.155 -15.687 25.227 1006 HA LYS 133 HA LYS 133 -2.598 -13.672 26.700 1007 1HB LYS 133 HB2 LYS 133 -1.422 -16.275 27.690 1008 2HB LYS 133 HB1 LYS 133 -2.625 -15.291 28.513 1009 1HG LYS 133 HG2 LYS 133 -4.301 -16.196 27.362 1010 2HG LYS 133 HG1 LYS 133 -3.443 -16.044 25.828 1011 1HD LYS 133 HD2 LYS 133 -2.684 -18.162 25.898 1012 2HD LYS 133 HD1 LYS 133 -2.380 -18.100 27.635 1013 1HE LYS 133 HE1 LYS 133 -4.100 -19.717 27.223 1014 2HE LYS 133 HE2 LYS 133 -4.825 -18.318 28.014 1015 1HZ LYS 133 HZ1 LYS 133 -5.480 -19.467 25.528 1016 2HZ LYS 133 HZ2 LYS 133 -4.971 -17.875 25.275 1017 3HZ LYS 133 HZ3 LYS 133 -6.245 -18.197 26.341 1018 H ALA 134 HN ALA 134 -1.881 -12.737 28.691 1019 HA ALA 134 HA ALA 134 0.968 -12.106 28.636 1020 1HB ALA 134 HB1 ALA 134 -1.099 -10.456 28.879 1021 2HB ALA 134 HB2 ALA 134 0.464 -10.124 29.625 1022 3HB ALA 134 HB3 ALA 134 -0.845 -10.808 30.589 1023 H VAL 135 HN VAL 135 1.553 -14.253 29.443 1024 HA VAL 135 HA VAL 135 0.967 -14.692 32.283 1025 HB VAL 135 HB VAL 135 0.618 -16.596 30.754 1026 1HG1 VAL 135 HG21 VAL 135 2.131 -17.336 29.275 1027 2HG1 VAL 135 HG22 VAL 135 3.470 -17.158 30.409 1028 3HG1 VAL 135 HG23 VAL 135 2.890 -15.760 29.501 1029 1HG2 VAL 135 HG11 VAL 135 1.002 -17.773 32.596 1030 2HG2 VAL 135 HG12 VAL 135 2.173 -16.582 33.160 1031 3HG2 VAL 135 HG13 VAL 135 2.694 -17.907 32.119 1032 H ASN 136 HN ASN 136 3.544 -13.904 30.078 1033 HA ASN 136 HA ASN 136 5.620 -14.284 32.058 1034 1HB ASN 136 HB1 ASN 136 5.722 -14.496 29.410 1035 2HB ASN 136 HB2 ASN 136 6.108 -12.781 29.525 1036 1HD2 ASN 136 HD21 ASN 136 8.191 -13.060 28.790 1037 2HD2 ASN 136 HD22 ASN 136 9.423 -13.805 29.744 1038 H SER 137 HN SER 137 7.178 -12.462 32.466 1039 HA SER 137 HA SER 137 5.646 -10.095 33.227 1040 1HB SER 137 HB1 SER 137 7.473 -11.567 34.624 1041 2HB SER 137 HB2 SER 137 8.483 -10.252 34.019 1042 HG SER 137 HG SER 137 7.684 -9.337 35.769 1043 H ALA 138 HN ALA 138 6.844 -10.819 30.476 1044 HA ALA 138 HA ALA 138 8.719 -8.657 30.028 1045 1HB ALA 138 HB1 ALA 138 7.871 -9.721 27.564 1046 2HB ALA 138 HB2 ALA 138 8.001 -11.076 28.684 1047 3HB ALA 138 HB3 ALA 138 9.387 -10.022 28.411 1048 H THR 139 HN THR 139 5.456 -8.805 30.362 1049 HA THR 139 HA THR 139 4.842 -6.851 28.276 1050 HB THR 139 HB THR 139 2.558 -7.321 29.858 1051 HG1 THR 139 HG1 THR 139 2.819 -9.806 29.293 1052 1HG2 THR 139 HG21 THR 139 2.733 -9.053 27.545 1053 2HG2 THR 139 HG22 THR 139 3.195 -7.388 27.189 1054 3HG2 THR 139 HG23 THR 139 1.617 -7.734 27.897 1055 H GLY 140 HN GLY 140 4.137 -4.775 28.694 1056 1HA GLY 140 HA2 GLY 140 5.047 -3.632 31.177 1057 2HA GLY 140 HA1 GLY 140 4.354 -2.761 29.818 1058 H VAL 141 HN VAL 141 3.862 -3.740 32.963 1059 HA VAL 141 HA VAL 141 1.002 -4.016 32.887 1060 HB VAL 141 HB VAL 141 1.200 -3.843 35.400 1061 1HG1 VAL 141 HG21 VAL 141 1.253 -6.053 35.226 1062 2HG1 VAL 141 HG22 VAL 141 3.006 -5.996 35.049 1063 3HG1 VAL 141 HG23 VAL 141 1.972 -5.924 33.622 1064 1HG2 VAL 141 HG11 VAL 141 4.161 -4.031 34.906 1065 2HG2 VAL 141 HG12 VAL 141 3.321 -3.834 36.443 1066 3HG2 VAL 141 HG13 VAL 141 3.346 -2.510 35.277 1067 HA PRO 142 HA PRO 142 0.041 0.313 33.041 1068 1HB PRO 142 HB2 PRO 142 -2.514 0.170 33.908 1069 2HB PRO 142 HB1 PRO 142 -2.042 -0.299 32.271 1070 1HG PRO 142 HG2 PRO 142 -2.546 -2.024 34.669 1071 2HG PRO 142 HG1 PRO 142 -3.065 -2.265 32.991 1072 1HD PRO 142 HD1 PRO 142 -0.922 -3.538 34.069 1073 2HD PRO 142 HD2 PRO 142 -1.021 -3.108 32.350 1074 H THR 143 HN THR 143 1.253 1.252 34.636 1075 HA THR 143 HA THR 143 0.685 0.763 37.429 1076 HB THR 143 HB THR 143 2.543 2.843 36.270 1077 HG1 THR 143 HG1 THR 143 2.903 0.607 35.529 1078 1HG2 THR 143 HG21 THR 143 1.944 2.719 38.795 1079 2HG2 THR 143 HG22 THR 143 3.621 2.915 38.287 1080 3HG2 THR 143 HG23 THR 143 3.030 1.329 38.785 1081 H VAL 144 HN VAL 144 1.103 3.875 35.757 1082 HA VAL 144 HA VAL 144 -1.183 4.903 37.303 1083 HB VAL 144 HB VAL 144 0.933 6.013 37.835 1084 1HG1 VAL 144 HG11 VAL 144 0.983 6.713 34.903 1085 2HG1 VAL 144 HG12 VAL 144 2.136 5.700 35.774 1086 3HG1 VAL 144 HG13 VAL 144 2.037 7.426 36.125 1087 1HG2 VAL 144 HG21 VAL 144 -1.473 7.243 37.128 1088 2HG2 VAL 144 HG22 VAL 144 -0.205 8.257 36.438 1089 3HG2 VAL 144 HG23 VAL 144 -0.201 7.894 38.163 Start of MODEL 20 1 1H GLY 1 HT1 GLY 1 32.116 -0.393 6.686 2 2H GLY 1 HT2 GLY 1 30.604 -0.619 7.409 3 3H GLY 1 HT3 GLY 1 30.998 -1.458 5.993 4 1HA GLY 1 HA1 GLY 1 31.525 -2.143 8.706 5 2HA GLY 1 HA2 GLY 1 31.628 -3.145 7.266 6 HA PRO 2 HA PRO 2 35.898 -1.729 9.064 7 1HB PRO 2 HB2 PRO 2 35.990 -4.412 10.293 8 2HB PRO 2 HB1 PRO 2 36.442 -2.847 10.975 9 1HG PRO 2 HG2 PRO 2 34.227 -4.122 11.770 10 2HG PRO 2 HG1 PRO 2 34.277 -2.354 11.625 11 1HD PRO 2 HD2 PRO 2 33.088 -4.377 9.763 12 2HD PRO 2 HD1 PRO 2 32.452 -2.797 10.265 13 H LEU 3 HN LEU 3 37.936 -2.649 8.387 14 HA LEU 3 HA LEU 3 37.610 -4.416 6.077 15 1HB LEU 3 HB1 LEU 3 39.308 -2.161 6.718 16 2HB LEU 3 HB2 LEU 3 40.261 -3.533 6.188 17 HG LEU 3 HG LEU 3 37.941 -3.010 4.482 18 1HD1 LEU 3 HD11 LEU 3 39.555 -1.077 3.484 19 2HD1 LEU 3 HD12 LEU 3 39.747 -0.817 5.218 20 3HD1 LEU 3 HD13 LEU 3 38.140 -0.773 4.493 21 1HD2 LEU 3 HD21 LEU 3 39.615 -3.282 2.731 22 2HD2 LEU 3 HD22 LEU 3 39.723 -4.581 3.919 23 3HD2 LEU 3 HD23 LEU 3 40.895 -3.264 3.943 24 H GLY 4 HN GLY 4 37.673 -5.304 8.925 25 1HA GLY 4 HA2 GLY 4 40.192 -6.745 9.131 26 2HA GLY 4 HA1 GLY 4 38.893 -6.741 10.314 27 H SER 5 HN SER 5 37.186 -7.274 7.698 28 HA SER 5 HA SER 5 37.023 -10.103 8.139 29 1HB SER 5 HB2 SER 5 35.133 -8.407 7.497 30 2HB SER 5 HB1 SER 5 35.670 -8.718 5.845 31 HG SER 5 HG SER 5 34.249 -10.314 7.555 32 H ALA 6 HN ALA 6 36.671 -11.395 5.894 33 HA ALA 6 HA ALA 6 38.925 -10.811 4.111 34 1HB ALA 6 HB1 ALA 6 39.922 -12.346 5.592 35 2HB ALA 6 HB2 ALA 6 39.487 -13.280 4.161 36 3HB ALA 6 HB3 ALA 6 38.491 -13.377 5.613 37 H ALA 7 HN ALA 7 35.911 -10.748 3.992 38 HA ALA 7 HA ALA 7 35.681 -11.878 1.367 39 1HB ALA 7 HB1 ALA 7 33.812 -13.382 1.844 40 2HB ALA 7 HB2 ALA 7 33.999 -13.065 3.568 41 3HB ALA 7 HB3 ALA 7 35.281 -13.887 2.679 42 H ALA 8 HN ALA 8 32.874 -11.676 3.416 43 HA ALA 8 HA ALA 8 31.054 -10.312 3.391 44 1HB ALA 8 HB1 ALA 8 33.099 -8.156 2.880 45 2HB ALA 8 HB2 ALA 8 32.642 -8.784 4.464 46 3HB ALA 8 HB3 ALA 8 31.459 -7.920 3.482 47 H ALA 9 HN ALA 9 32.204 -11.410 0.799 48 HA ALA 9 HA ALA 9 30.275 -10.211 -0.934 49 1HB ALA 9 HB1 ALA 9 33.008 -9.221 -1.007 50 2HB ALA 9 HB2 ALA 9 31.544 -8.564 -1.739 51 3HB ALA 9 HB3 ALA 9 32.455 -9.825 -2.569 52 H THR 10 HN THR 10 33.110 -12.266 -0.570 53 HA THR 10 HA THR 10 33.689 -14.276 -1.458 54 HB THR 10 HB THR 10 30.896 -14.903 -2.255 55 HG1 THR 10 HG1 THR 10 30.270 -13.938 -0.457 56 1HG2 THR 10 HG21 THR 10 33.029 -16.463 -1.890 57 2HG2 THR 10 HG22 THR 10 31.372 -17.008 -1.630 58 3HG2 THR 10 HG23 THR 10 32.358 -16.498 -0.259 59 HA PRO 11 HA PRO 11 33.630 -12.755 -5.787 60 1HB PRO 11 HB1 PRO 11 36.230 -13.296 -6.293 61 2HB PRO 11 HB2 PRO 11 35.712 -11.825 -5.461 62 1HG PRO 11 HG2 PRO 11 36.796 -14.370 -4.312 63 2HG PRO 11 HG1 PRO 11 37.187 -12.694 -3.884 64 1HD PRO 11 HD2 PRO 11 35.475 -14.224 -2.434 65 2HD PRO 11 HD1 PRO 11 35.312 -12.462 -2.569 66 H ALA 12 HN ALA 12 33.769 -13.885 -7.764 67 HA ALA 12 HA ALA 12 33.370 -16.738 -7.511 68 1HB ALA 12 HB1 ALA 12 32.854 -16.611 -9.945 69 2HB ALA 12 HB2 ALA 12 33.197 -14.882 -9.878 70 3HB ALA 12 HB3 ALA 12 31.861 -15.553 -8.943 71 H VAL 13 HN VAL 13 35.310 -14.827 -9.813 72 HA VAL 13 HA VAL 13 37.180 -17.046 -10.062 73 HB VAL 13 HB VAL 13 37.382 -14.421 -11.516 74 1HG1 VAL 13 HG11 VAL 13 38.322 -17.228 -12.068 75 2HG1 VAL 13 HG12 VAL 13 39.306 -15.792 -11.781 76 3HG1 VAL 13 HG13 VAL 13 38.366 -15.934 -13.266 77 1HG2 VAL 13 HG21 VAL 13 35.086 -15.302 -11.767 78 2HG2 VAL 13 HG22 VAL 13 35.759 -16.808 -12.391 79 3HG2 VAL 13 HG23 VAL 13 35.991 -15.303 -13.281 80 H ARG 14 HN ARG 14 39.212 -17.071 -9.280 81 HA ARG 14 HA ARG 14 39.972 -14.979 -7.427 82 1HB ARG 14 HB2 ARG 14 40.435 -17.752 -7.632 83 2HB ARG 14 HB1 ARG 14 42.006 -16.982 -7.803 84 1HG ARG 14 HG1 ARG 14 42.018 -17.063 -5.566 85 2HG ARG 14 HG2 ARG 14 41.011 -15.619 -5.691 86 1HD ARG 14 HD2 ARG 14 39.583 -16.781 -4.405 87 2HD ARG 14 HD1 ARG 14 39.145 -17.569 -5.921 88 HE ARG 14 HE ARG 14 40.852 -18.679 -3.816 89 1HH1 ARG 14 HH11 ARG 14 39.184 -19.050 -6.852 90 2HH1 ARG 14 HH12 ARG 14 39.339 -20.774 -6.874 91 1HH2 ARG 14 HH21 ARG 14 41.062 -20.949 -3.836 92 2HH2 ARG 14 HH22 ARG 14 40.406 -21.854 -5.160 93 H THR 15 HN THR 15 40.964 -16.205 -10.556 94 HA THR 15 HA THR 15 43.347 -14.575 -10.649 95 HB THR 15 HB THR 15 42.044 -16.045 -12.942 96 HG1 THR 15 HG1 THR 15 42.864 -17.861 -12.218 97 1HG2 THR 15 HG21 THR 15 44.794 -15.002 -12.438 98 2HG2 THR 15 HG22 THR 15 43.767 -14.814 -13.859 99 3HG2 THR 15 HG23 THR 15 44.525 -16.370 -13.520 100 H VAL 16 HN VAL 16 43.696 -12.785 -11.969 101 HA VAL 16 HA VAL 16 41.252 -11.342 -12.705 102 HB VAL 16 HB VAL 16 42.654 -10.114 -11.190 103 1HG1 VAL 16 HG21 VAL 16 44.963 -9.524 -12.703 104 2HG1 VAL 16 HG22 VAL 16 44.777 -11.277 -12.698 105 3HG1 VAL 16 HG23 VAL 16 44.854 -10.395 -11.173 106 1HG2 VAL 16 HG11 VAL 16 42.249 -8.193 -12.238 107 2HG2 VAL 16 HG12 VAL 16 41.799 -9.154 -13.647 108 3HG2 VAL 16 HG13 VAL 16 43.445 -8.541 -13.487 109 HA PRO 17 HA PRO 17 42.341 -12.077 -16.975 110 1HB PRO 17 HB2 PRO 17 40.262 -10.814 -18.111 111 2HB PRO 17 HB1 PRO 17 40.063 -12.348 -17.257 112 1HG PRO 17 HG2 PRO 17 39.499 -9.564 -16.311 113 2HG PRO 17 HG1 PRO 17 38.532 -11.034 -16.097 114 1HD PRO 17 HD2 PRO 17 40.193 -10.008 -14.174 115 2HD PRO 17 HD1 PRO 17 39.763 -11.725 -14.293 116 H GLN 18 HN GLN 18 41.127 -9.767 -18.638 117 HA GLN 18 HA GLN 18 43.541 -8.288 -18.905 118 1HB GLN 18 HB1 GLN 18 40.836 -7.581 -20.048 119 2HB GLN 18 HB2 GLN 18 42.409 -7.076 -20.648 120 1HG GLN 18 HG2 GLN 18 42.274 -8.777 -22.061 121 2HG GLN 18 HG1 GLN 18 42.562 -9.829 -20.677 122 1HE2 GLN 18 HE21 GLN 18 39.876 -8.065 -22.188 123 2HE2 GLN 18 HE22 GLN 18 38.726 -9.345 -22.038 124 H TYR 19 HN TYR 19 43.793 -5.986 -18.676 125 HA TYR 19 HA TYR 19 42.694 -5.030 -16.194 126 1HB TYR 19 HB1 TYR 19 44.546 -3.656 -18.154 127 2HB TYR 19 HB2 TYR 19 44.197 -3.116 -16.516 128 HD1 TYR 19 HD1 TYR 19 44.732 -4.849 -14.622 129 HD2 TYR 19 HD2 TYR 19 46.415 -4.975 -18.527 130 HE1 TYR 19 HE1 TYR 19 46.596 -6.206 -13.768 131 HE2 TYR 19 HE2 TYR 19 48.284 -6.333 -17.685 132 HH TYR 19 HH TYR 19 48.956 -6.705 -14.409 133 H LYS 20 HN LYS 20 40.491 -5.242 -17.519 134 HA LYS 20 HA LYS 20 39.907 -2.675 -18.815 135 1HB LYS 20 HB1 LYS 20 39.193 -5.290 -19.476 136 2HB LYS 20 HB2 LYS 20 37.725 -4.592 -18.810 137 1HG LYS 20 HG2 LYS 20 39.262 -3.051 -20.842 138 2HG LYS 20 HG1 LYS 20 38.259 -4.408 -21.361 139 1HD LYS 20 HD1 LYS 20 36.468 -3.098 -21.270 140 2HD LYS 20 HD2 LYS 20 36.728 -2.886 -19.537 141 1HE LYS 20 HE2 LYS 20 36.617 -0.730 -20.641 142 2HE LYS 20 HE1 LYS 20 38.237 -1.010 -20.001 143 1HZ LYS 20 HZ1 LYS 20 37.411 -1.374 -22.830 144 2HZ LYS 20 HZ2 LYS 20 38.963 -1.643 -22.216 145 3HZ LYS 20 HZ3 LYS 20 38.317 -0.081 -22.225 146 H TYR 21 HN TYR 21 39.813 -1.455 -16.880 147 HA TYR 21 HA TYR 21 37.812 -2.170 -14.897 148 1HB TYR 21 HB2 TYR 21 40.218 -0.902 -14.686 149 2HB TYR 21 HB1 TYR 21 39.115 0.469 -14.700 150 HD1 TYR 21 HD1 TYR 21 37.029 0.207 -13.080 151 HD2 TYR 21 HD2 TYR 21 40.711 -1.882 -12.655 152 HE1 TYR 21 HE1 TYR 21 36.542 -0.154 -10.697 153 HE2 TYR 21 HE2 TYR 21 40.234 -2.249 -10.271 154 HH TYR 21 HH TYR 21 38.321 -0.641 -8.508 155 H ALA 22 HN ALA 22 36.062 -1.998 -16.510 156 HA ALA 22 HA ALA 22 35.339 0.702 -17.327 157 1HB ALA 22 HB1 ALA 22 34.956 -1.788 -18.464 158 2HB ALA 22 HB2 ALA 22 34.213 -0.275 -18.981 159 3HB ALA 22 HB3 ALA 22 33.356 -1.344 -17.869 160 H ALA 23 HN ALA 23 33.296 1.650 -16.812 161 HA ALA 23 HA ALA 23 32.467 1.061 -14.087 162 1HB ALA 23 HB1 ALA 23 32.966 3.390 -14.879 163 2HB ALA 23 HB2 ALA 23 31.403 3.184 -14.090 164 3HB ALA 23 HB3 ALA 23 31.494 3.300 -15.847 165 H GLY 24 HN GLY 24 31.745 -0.850 -16.104 166 1HA GLY 24 HA2 GLY 24 28.966 -0.451 -16.762 167 2HA GLY 24 HA1 GLY 24 29.910 -1.906 -17.048 168 H VAL 25 HN VAL 25 30.504 -1.274 -13.936 169 HA VAL 25 HA VAL 25 28.273 -2.969 -13.032 170 HB VAL 25 HB VAL 25 30.885 -2.577 -11.583 171 1HG1 VAL 25 HG21 VAL 25 28.614 -3.581 -10.619 172 2HG1 VAL 25 HG22 VAL 25 30.197 -4.199 -10.149 173 3HG1 VAL 25 HG23 VAL 25 29.252 -5.040 -11.379 174 1HG2 VAL 25 HG11 VAL 25 30.971 -3.574 -14.001 175 2HG2 VAL 25 HG12 VAL 25 30.332 -5.015 -13.211 176 3HG2 VAL 25 HG13 VAL 25 31.873 -4.334 -12.691 177 H ARG 26 HN ARG 26 30.074 -0.031 -12.399 178 HA ARG 26 HA ARG 26 28.716 0.572 -9.942 179 1HB ARG 26 HB1 ARG 26 30.836 1.757 -11.574 180 2HB ARG 26 HB2 ARG 26 29.770 2.957 -10.856 181 1HG ARG 26 HG2 ARG 26 30.175 1.528 -8.683 182 2HG ARG 26 HG1 ARG 26 31.635 1.047 -9.551 183 1HD ARG 26 HD2 ARG 26 30.832 3.920 -9.169 184 2HD ARG 26 HD1 ARG 26 31.847 3.052 -8.019 185 HE ARG 26 HE ARG 26 32.569 3.766 -10.771 186 1HH1 ARG 26 HH11 ARG 26 33.448 2.500 -7.645 187 2HH1 ARG 26 HH12 ARG 26 35.151 2.568 -7.953 188 1HH2 ARG 26 HH21 ARG 26 34.809 3.860 -11.183 189 2HH2 ARG 26 HH22 ARG 26 35.925 3.342 -9.964 190 H ASN 27 HN ASN 27 27.009 1.924 -9.595 191 HA ASN 27 HA ASN 27 25.190 2.325 -11.752 192 1HB ASN 27 HB2 ASN 27 25.122 3.346 -8.902 193 2HB ASN 27 HB1 ASN 27 23.782 3.446 -10.041 194 1HD2 ASN 27 HD21 ASN 27 25.911 1.186 -8.379 195 2HD2 ASN 27 HD22 ASN 27 24.784 -0.121 -8.333 196 HA PRO 28 HA PRO 28 26.331 6.268 -13.363 197 1HB PRO 28 HB1 PRO 28 23.446 6.970 -13.178 198 2HB PRO 28 HB2 PRO 28 24.533 7.030 -14.570 199 1HG PRO 28 HG2 PRO 28 22.710 5.101 -14.348 200 2HG PRO 28 HG1 PRO 28 24.325 4.759 -14.996 201 1HD PRO 28 HD2 PRO 28 23.192 4.149 -12.300 202 2HD PRO 28 HD1 PRO 28 24.305 3.194 -13.299 203 H GLN 29 HN GLN 29 27.436 7.255 -11.695 204 HA GLN 29 HA GLN 29 25.990 8.459 -9.492 205 1HB GLN 29 HB1 GLN 29 28.889 8.161 -10.204 206 2HB GLN 29 HB2 GLN 29 28.398 9.303 -8.961 207 1HG GLN 29 HG2 GLN 29 27.722 7.656 -7.516 208 2HG GLN 29 HG1 GLN 29 27.430 6.492 -8.809 209 1HE2 GLN 29 HE21 GLN 29 29.732 6.424 -10.166 210 2HE2 GLN 29 HE22 GLN 29 31.029 5.886 -9.160 211 H GLN 30 HN GLN 30 24.724 9.931 -10.787 212 HA GLN 30 HA GLN 30 26.143 12.097 -12.110 213 1HB GLN 30 HB1 GLN 30 23.392 11.049 -12.093 214 2HB GLN 30 HB2 GLN 30 23.502 12.802 -12.177 215 1HG GLN 30 HG2 GLN 30 24.935 12.624 -14.144 216 2HG GLN 30 HG1 GLN 30 24.835 10.865 -14.058 217 1HE2 GLN 30 HE21 GLN 30 23.189 9.865 -15.026 218 2HE2 GLN 30 HE22 GLN 30 21.837 10.655 -15.757 219 H HIS 31 HN HIS 31 25.329 14.367 -11.669 220 HA HIS 31 HA HIS 31 25.882 15.041 -8.989 221 1HB HIS 31 HB1 HIS 31 24.590 16.736 -11.139 222 2HB HIS 31 HB2 HIS 31 25.317 17.338 -9.653 223 HD2 HIS 31 HD2 HIS 31 26.260 17.265 -13.147 224 HE1 HIS 31 HE1 HIS 31 29.877 16.450 -11.104 225 HE2 HIS 31 HE2 HIS 31 28.846 17.136 -13.318 226 H LEU 32 HN LEU 32 22.910 14.448 -10.712 227 HA LEU 32 HA LEU 32 21.293 15.442 -8.502 228 1HB LEU 32 HB2 LEU 32 20.694 14.459 -11.270 229 2HB LEU 32 HB1 LEU 32 19.415 14.564 -10.075 230 HG LEU 32 HG LEU 32 20.356 17.039 -9.822 231 1HD1 LEU 32 HD11 LEU 32 22.152 16.469 -11.544 232 2HD1 LEU 32 HD12 LEU 32 21.249 17.965 -11.777 233 3HD1 LEU 32 HD13 LEU 32 20.856 16.540 -12.739 234 1HD2 LEU 32 HD21 LEU 32 18.774 17.093 -12.187 235 2HD2 LEU 32 HD22 LEU 32 18.296 17.441 -10.525 236 3HD2 LEU 32 HD23 LEU 32 18.193 15.794 -11.146 237 H ASN 33 HN ASN 33 21.281 14.098 -6.806 238 HA ASN 33 HA ASN 33 21.250 11.224 -7.163 239 1HB ASN 33 HB2 ASN 33 22.593 12.091 -5.355 240 2HB ASN 33 HB1 ASN 33 21.217 12.969 -4.694 241 1HD2 ASN 33 HD21 ASN 33 20.106 12.030 -3.138 242 2HD2 ASN 33 HD22 ASN 33 20.151 10.351 -2.733 243 H ALA 34 HN ALA 34 19.152 13.599 -5.526 244 HA ALA 34 HA ALA 34 16.960 11.668 -5.557 245 1HB ALA 34 HB1 ALA 34 15.856 13.077 -3.995 246 2HB ALA 34 HB2 ALA 34 16.959 14.413 -4.323 247 3HB ALA 34 HB3 ALA 34 17.543 12.972 -3.492 248 H GLN 35 HN GLN 35 14.717 12.850 -5.887 249 HA GLN 35 HA GLN 35 14.887 14.156 -8.514 250 1HB GLN 35 HB1 GLN 35 12.612 12.647 -7.212 251 2HB GLN 35 HB2 GLN 35 12.523 13.425 -8.787 252 1HG GLN 35 HG2 GLN 35 14.792 11.636 -8.583 253 2HG GLN 35 HG1 GLN 35 13.262 10.816 -8.273 254 1HE2 GLN 35 HE21 GLN 35 15.282 10.934 -10.568 255 2HE2 GLN 35 HE22 GLN 35 14.290 11.154 -11.966 256 HA PRO 36 HA PRO 36 13.557 17.738 -6.051 257 1HB PRO 36 HB2 PRO 36 14.208 19.592 -7.914 258 2HB PRO 36 HB1 PRO 36 15.404 18.859 -6.839 259 1HG PRO 36 HG2 PRO 36 14.745 18.186 -9.683 260 2HG PRO 36 HG1 PRO 36 16.334 18.342 -8.911 261 1HD PRO 36 HD2 PRO 36 15.159 15.943 -9.372 262 2HD PRO 36 HD1 PRO 36 16.229 16.234 -7.985 263 H GLN 37 HN GLN 37 11.397 17.896 -5.956 264 HA GLN 37 HA GLN 37 9.783 17.895 -8.359 265 1HB GLN 37 HB2 GLN 37 8.990 18.146 -5.451 266 2HB GLN 37 HB1 GLN 37 7.872 17.955 -6.795 267 1HG GLN 37 HG2 GLN 37 9.229 15.799 -7.282 268 2HG GLN 37 HG1 GLN 37 9.762 15.973 -5.610 269 1HE2 GLN 37 HE21 GLN 37 8.682 14.572 -4.424 270 2HE2 GLN 37 HE22 GLN 37 6.978 14.291 -4.483 271 H VAL 38 HN VAL 38 9.194 19.656 -9.425 272 HA VAL 38 HA VAL 38 9.810 22.274 -8.412 273 HB VAL 38 HB VAL 38 8.165 21.833 -10.874 274 1HG1 VAL 38 HG21 VAL 38 10.212 23.830 -9.959 275 2HG1 VAL 38 HG22 VAL 38 8.529 24.104 -10.409 276 3HG1 VAL 38 HG23 VAL 38 9.719 23.702 -11.648 277 1HG2 VAL 38 HG11 VAL 38 11.053 21.125 -10.496 278 2HG2 VAL 38 HG12 VAL 38 10.439 21.644 -12.066 279 3HG2 VAL 38 HG13 VAL 38 9.777 20.205 -11.292 280 H THR 39 HN THR 39 8.445 23.810 -7.644 281 HA THR 39 HA THR 39 5.663 22.978 -7.188 282 HB THR 39 HB THR 39 6.930 25.285 -5.762 283 HG1 THR 39 HG1 THR 39 8.456 23.766 -5.387 284 1HG2 THR 39 HG21 THR 39 4.496 23.948 -5.527 285 2HG2 THR 39 HG22 THR 39 5.173 25.156 -4.435 286 3HG2 THR 39 HG23 THR 39 5.459 23.441 -4.139 287 H MET 40 HN MET 40 4.342 23.765 -8.692 288 HA MET 40 HA MET 40 4.831 26.446 -9.773 289 1HB MET 40 HB1 MET 40 3.166 24.124 -10.730 290 2HB MET 40 HB2 MET 40 3.014 25.732 -11.426 291 1HG MET 40 HG2 MET 40 5.771 25.007 -11.342 292 2HG MET 40 HG1 MET 40 4.848 23.707 -12.092 293 1HE MET 40 HE1 MET 40 6.887 25.066 -14.265 294 2HE MET 40 HE2 MET 40 7.053 26.048 -12.810 295 3HE MET 40 HE3 MET 40 6.643 26.810 -14.347 296 H GLN 41 HN GLN 41 3.609 28.123 -9.211 297 HA GLN 41 HA GLN 41 1.198 27.603 -7.614 298 1HB GLN 41 HB2 GLN 41 3.035 28.941 -6.576 299 2HB GLN 41 HB1 GLN 41 2.798 30.160 -7.819 300 1HG GLN 41 HG2 GLN 41 1.422 31.117 -6.355 301 2HG GLN 41 HG1 GLN 41 0.274 29.868 -6.836 302 1HE2 GLN 41 HE21 GLN 41 -0.598 28.761 -5.249 303 2HE2 GLN 41 HE22 GLN 41 0.081 28.516 -3.680 304 H GLN 42 HN GLN 42 -0.507 27.520 -8.950 305 HA GLN 42 HA GLN 42 -2.099 28.143 -10.446 306 1HB GLN 42 HB1 GLN 42 -0.975 30.822 -9.656 307 2HB GLN 42 HB2 GLN 42 -2.300 30.681 -10.803 308 1HG GLN 42 HG2 GLN 42 -3.159 29.116 -8.736 309 2HG GLN 42 HG1 GLN 42 -2.286 30.401 -7.901 310 1HE2 GLN 42 HE21 GLN 42 -5.223 29.504 -9.010 311 2HE2 GLN 42 HE22 GLN 42 -5.960 31.055 -9.194 312 HA PRO 43 HA PRO 43 -2.503 26.945 -11.761 313 1HB PRO 43 HB2 PRO 43 -2.059 25.068 -13.616 314 2HB PRO 43 HB1 PRO 43 -2.911 26.566 -14.010 315 1HG PRO 43 HG2 PRO 43 -0.063 25.810 -14.527 316 2HG PRO 43 HG1 PRO 43 -1.203 26.663 -15.582 317 1HD PRO 43 HD1 PRO 43 0.734 27.898 -14.057 318 2HD PRO 43 HD2 PRO 43 -0.749 28.687 -14.629 319 H ALA 44 HN ALA 44 -2.309 25.324 -10.314 320 HA ALA 44 HA ALA 44 0.367 24.371 -9.677 321 1HB ALA 44 HB1 ALA 44 -1.426 25.214 -7.997 322 2HB ALA 44 HB2 ALA 44 -0.427 23.821 -7.579 323 3HB ALA 44 HB3 ALA 44 -2.078 23.582 -8.152 324 H VAL 45 HN VAL 45 1.012 22.736 -10.948 325 HA VAL 45 HA VAL 45 -0.786 20.753 -11.969 326 HB VAL 45 HB VAL 45 1.235 21.501 -13.202 327 1HG1 VAL 45 HG11 VAL 45 2.612 21.391 -10.973 328 2HG1 VAL 45 HG12 VAL 45 3.388 21.090 -12.527 329 3HG1 VAL 45 HG13 VAL 45 2.924 19.736 -11.497 330 1HG2 VAL 45 HG21 VAL 45 2.038 18.840 -13.279 331 2HG2 VAL 45 HG22 VAL 45 0.804 19.605 -14.280 332 3HG2 VAL 45 HG23 VAL 45 0.347 18.785 -12.787 333 H HIS 46 HN HIS 46 -1.041 18.637 -11.354 334 HA HIS 46 HA HIS 46 -0.252 18.007 -8.632 335 1HB HIS 46 HB2 HIS 46 -2.539 17.522 -10.028 336 2HB HIS 46 HB1 HIS 46 -1.716 15.976 -10.196 337 HD2 HIS 46 HD2 HIS 46 -4.401 16.827 -8.186 338 HE1 HIS 46 HE1 HIS 46 -1.683 15.378 -5.281 339 HE2 HIS 46 HE2 HIS 46 -4.107 15.949 -5.762 340 H VAL 47 HN VAL 47 0.667 15.914 -8.075 341 HA VAL 47 HA VAL 47 2.576 14.994 -10.122 342 HB VAL 47 HB VAL 47 3.813 14.076 -8.040 343 1HG1 VAL 47 HG11 VAL 47 4.935 15.718 -9.210 344 2HG1 VAL 47 HG12 VAL 47 4.741 16.471 -7.627 345 3HG1 VAL 47 HG13 VAL 47 3.666 16.916 -8.953 346 1HG2 VAL 47 HG21 VAL 47 3.447 15.237 -5.975 347 2HG2 VAL 47 HG22 VAL 47 1.915 14.536 -6.494 348 3HG2 VAL 47 HG23 VAL 47 2.214 16.259 -6.713 349 H GLN 48 HN GLN 48 3.389 12.694 -8.588 350 HA GLN 48 HA GLN 48 1.507 10.804 -9.549 351 1HB GLN 48 HB1 GLN 48 4.037 10.688 -7.974 352 2HB GLN 48 HB2 GLN 48 2.994 9.273 -7.964 353 1HG GLN 48 HG1 GLN 48 3.304 8.856 -10.202 354 2HG GLN 48 HG2 GLN 48 3.735 10.527 -10.563 355 1HE2 GLN 48 HE21 GLN 48 5.642 10.123 -11.571 356 2HE2 GLN 48 HE22 GLN 48 7.026 9.458 -10.778 357 H GLY 49 HN GLY 49 1.043 8.888 -7.810 358 1HA GLY 49 HA2 GLY 49 -0.838 10.111 -5.970 359 2HA GLY 49 HA1 GLY 49 -0.700 8.399 -6.338 360 H GLN 50 HN GLN 50 1.896 10.542 -5.274 361 HA GLN 50 HA GLN 50 2.265 8.803 -2.940 362 1HB GLN 50 HB1 GLN 50 4.461 10.424 -2.959 363 2HB GLN 50 HB2 GLN 50 4.377 8.846 -3.727 364 1HG GLN 50 HG1 GLN 50 4.124 9.745 -5.846 365 2HG GLN 50 HG2 GLN 50 3.576 11.302 -5.227 366 1HE2 GLN 50 HE21 GLN 50 6.390 9.175 -5.372 367 2HE2 GLN 50 HE22 GLN 50 7.568 10.439 -5.387 368 H GLU 51 HN GLU 51 0.173 10.689 -2.910 369 HA GLU 51 HA GLU 51 1.003 13.022 -1.460 370 1HB GLU 51 HB2 GLU 51 -1.331 12.182 -2.808 371 2HB GLU 51 HB1 GLU 51 -1.797 12.467 -1.137 372 1HG GLU 51 HG1 GLU 51 -0.165 14.625 -1.866 373 2HG GLU 51 HG2 GLU 51 -1.257 14.352 -3.222 374 HA PRO 52 HA PRO 52 -1.184 10.519 2.199 375 1HB PRO 52 HB2 PRO 52 -0.353 7.803 1.308 376 2HB PRO 52 HB1 PRO 52 -1.829 8.315 2.135 377 1HG PRO 52 HG2 PRO 52 -1.878 7.709 -0.452 378 2HG PRO 52 HG1 PRO 52 -2.816 9.079 0.172 379 1HD PRO 52 HD2 PRO 52 -0.226 9.077 -1.325 380 2HD PRO 52 HD1 PRO 52 -1.606 10.185 -1.462 381 H LEU 53 HN LEU 53 -0.077 9.093 3.940 382 HA LEU 53 HA LEU 53 2.646 9.997 4.133 383 1HB LEU 53 HB2 LEU 53 0.620 9.361 5.945 384 2HB LEU 53 HB1 LEU 53 1.846 8.133 6.197 385 HG LEU 53 HG LEU 53 2.978 10.816 6.043 386 1HD1 LEU 53 HD21 LEU 53 1.564 11.934 7.331 387 2HD1 LEU 53 HD22 LEU 53 1.893 10.782 8.627 388 3HD1 LEU 53 HD23 LEU 53 0.547 10.506 7.522 389 1HD2 LEU 53 HD11 LEU 53 4.267 10.072 7.848 390 2HD2 LEU 53 HD12 LEU 53 3.998 8.626 6.875 391 3HD2 LEU 53 HD13 LEU 53 3.053 8.890 8.342 392 H THR 54 HN THR 54 4.486 8.802 4.160 393 HA THR 54 HA THR 54 4.576 5.979 4.212 394 HB THR 54 HB THR 54 5.735 6.492 1.658 395 HG1 THR 54 HG1 THR 54 4.387 7.849 0.830 396 1HG2 THR 54 HG21 THR 54 3.859 4.921 0.916 397 2HG2 THR 54 HG22 THR 54 3.462 4.817 2.631 398 3HG2 THR 54 HG23 THR 54 5.054 4.313 2.062 399 H ALA 55 HN ALA 55 6.970 5.483 2.987 400 HA ALA 55 HA ALA 55 8.819 6.375 4.820 401 1HB ALA 55 HB1 ALA 55 9.567 5.634 2.009 402 2HB ALA 55 HB2 ALA 55 9.025 4.450 3.202 403 3HB ALA 55 HB3 ALA 55 10.491 5.390 3.492 404 H SER 56 HN SER 56 8.008 7.761 1.667 405 HA SER 56 HA SER 56 10.070 9.651 1.507 406 1HB SER 56 HB1 SER 56 7.301 10.214 0.476 407 2HB SER 56 HB2 SER 56 8.855 10.641 -0.239 408 HG SER 56 HG SER 56 7.397 8.581 -0.839 409 H MET 57 HN MET 57 6.757 10.001 2.757 410 HA MET 57 HA MET 57 6.959 12.662 3.602 411 1HB MET 57 HB1 MET 57 5.276 10.347 4.543 412 2HB MET 57 HB2 MET 57 5.143 11.936 5.272 413 1HG MET 57 HG1 MET 57 3.693 11.028 3.148 414 2HG MET 57 HG2 MET 57 3.909 12.719 3.597 415 1HE MET 57 HE1 MET 57 5.700 10.349 0.199 416 2HE MET 57 HE2 MET 57 3.979 10.732 0.211 417 3HE MET 57 HE3 MET 57 4.689 9.820 1.544 418 H LEU 58 HN LEU 58 7.785 9.636 5.184 419 HA LEU 58 HA LEU 58 8.334 10.642 7.751 420 1HB LEU 58 HB1 LEU 58 9.573 8.281 6.334 421 2HB LEU 58 HB2 LEU 58 9.586 8.559 8.065 422 HG LEU 58 HG LEU 58 7.012 8.277 6.541 423 1HD1 LEU 58 HD21 LEU 58 7.891 5.899 7.965 424 2HD1 LEU 58 HD22 LEU 58 8.925 6.299 6.592 425 3HD1 LEU 58 HD23 LEU 58 7.192 6.064 6.355 426 1HD2 LEU 58 HD11 LEU 58 7.442 9.076 9.066 427 2HD2 LEU 58 HD12 LEU 58 7.349 7.330 9.311 428 3HD2 LEU 58 HD13 LEU 58 6.005 8.187 8.553 429 H ALA 59 HN ALA 59 10.369 10.168 4.908 430 HA ALA 59 HA ALA 59 12.822 10.889 6.089 431 1HB ALA 59 HB1 ALA 59 12.348 11.452 3.209 432 2HB ALA 59 HB2 ALA 59 12.241 9.783 3.768 433 3HB ALA 59 HB3 ALA 59 13.731 10.699 4.003 434 H SER 60 HN SER 60 10.116 12.759 5.216 435 HA SER 60 HA SER 60 11.482 15.215 4.671 436 1HB SER 60 HB2 SER 60 8.603 14.621 5.394 437 2HB SER 60 HB1 SER 60 9.199 16.225 4.963 438 HG SER 60 HG SER 60 8.402 15.288 3.116 439 H ALA 61 HN ALA 61 11.058 13.452 7.456 440 HA ALA 61 HA ALA 61 11.565 15.825 9.116 441 1HB ALA 61 HB1 ALA 61 9.982 13.567 10.251 442 2HB ALA 61 HB2 ALA 61 9.175 14.760 9.233 443 3HB ALA 61 HB3 ALA 61 10.001 15.272 10.705 444 HA PRO 62 HA PRO 62 14.707 12.272 9.532 445 1HB PRO 62 HB1 PRO 62 16.535 14.603 9.301 446 2HB PRO 62 HB2 PRO 62 16.662 12.993 8.586 447 1HG PRO 62 HG2 PRO 62 15.955 15.091 7.101 448 2HG PRO 62 HG1 PRO 62 15.204 13.502 6.855 449 1HD PRO 62 HD1 PRO 62 14.114 15.925 8.228 450 2HD PRO 62 HD2 PRO 62 13.284 14.747 7.191 451 HA PRO 63 HA PRO 63 16.158 14.487 13.445 452 1HB PRO 63 HB1 PRO 63 16.085 17.129 13.759 453 2HB PRO 63 HB2 PRO 63 17.289 16.377 12.705 454 1HG PRO 63 HG1 PRO 63 14.781 17.826 11.996 455 2HG PRO 63 HG2 PRO 63 16.342 17.809 11.160 456 1HD PRO 63 HD2 PRO 63 14.082 16.283 10.490 457 2HD PRO 63 HD1 PRO 63 15.732 16.037 9.887 458 H GLN 64 HN GLN 64 13.143 15.584 12.152 459 HA GLN 64 HA GLN 64 11.999 16.317 14.694 460 1HB GLN 64 HB1 GLN 64 11.407 17.023 12.155 461 2HB GLN 64 HB2 GLN 64 10.222 15.747 12.395 462 1HG GLN 64 HG1 GLN 64 8.958 17.025 13.706 463 2HG GLN 64 HG2 GLN 64 10.345 17.594 14.633 464 1HE2 GLN 64 HE22 GLN 64 8.848 19.540 14.496 465 2HE2 GLN 64 HE21 GLN 64 9.142 20.635 13.193 466 H GLU 65 HN GLU 65 10.562 14.074 12.359 467 HA GLU 65 HA GLU 65 9.995 12.251 14.595 468 1HB GLU 65 HB1 GLU 65 8.594 11.939 11.993 469 2HB GLU 65 HB2 GLU 65 7.991 11.717 13.629 470 1HG GLU 65 HG2 GLU 65 8.587 14.454 13.348 471 2HG GLU 65 HG1 GLU 65 7.716 13.963 11.896 472 H GLN 66 HN GLN 66 9.744 11.346 11.237 473 HA GLN 66 HA GLN 66 10.827 9.840 9.925 474 1HB GLN 66 HB1 GLN 66 12.928 10.893 11.524 475 2HB GLN 66 HB2 GLN 66 13.142 9.150 11.449 476 1HG GLN 66 HG1 GLN 66 12.641 9.662 8.861 477 2HG GLN 66 HG2 GLN 66 13.389 11.186 9.336 478 1HE2 GLN 66 HE21 GLN 66 15.330 10.616 10.976 479 2HE2 GLN 66 HE22 GLN 66 16.481 9.527 10.287 480 H LYS 67 HN LYS 67 11.671 8.961 13.273 481 HA LYS 67 HA LYS 67 10.464 6.330 12.796 482 1HB LYS 67 HB2 LYS 67 11.824 5.720 14.895 483 2HB LYS 67 HB1 LYS 67 12.681 5.948 13.380 484 1HG LYS 67 HG2 LYS 67 13.371 8.163 14.053 485 2HG LYS 67 HG1 LYS 67 12.430 8.025 15.541 486 1HD LYS 67 HD2 LYS 67 14.109 6.990 16.565 487 2HD LYS 67 HD1 LYS 67 14.191 5.775 15.287 488 1HE LYS 67 HE1 LYS 67 15.739 7.025 14.046 489 2HE LYS 67 HE2 LYS 67 15.403 8.500 14.952 490 1HZ LYS 67 HZ1 LYS 67 17.143 7.986 16.200 491 2HZ LYS 67 HZ2 LYS 67 17.297 6.455 15.498 492 3HZ LYS 67 HZ3 LYS 67 16.266 6.679 16.820 493 H GLN 68 HN GLN 68 9.112 8.867 13.593 494 HA GLN 68 HA GLN 68 7.933 7.892 16.112 495 1HB GLN 68 HB1 GLN 68 8.119 10.767 15.190 496 2HB GLN 68 HB2 GLN 68 7.420 10.203 16.701 497 1HG GLN 68 HG1 GLN 68 10.084 9.217 16.494 498 2HG GLN 68 HG2 GLN 68 10.084 10.950 16.172 499 1HE2 GLN 68 HE21 GLN 68 9.642 12.366 17.800 500 2HE2 GLN 68 HE22 GLN 68 9.445 11.894 19.450 501 H MET 69 HN MET 69 7.271 9.824 13.200 502 HA MET 69 HA MET 69 4.430 9.492 13.485 503 1HB MET 69 HB2 MET 69 4.280 10.782 11.416 504 2HB MET 69 HB1 MET 69 5.359 11.560 12.566 505 1HG MET 69 HG2 MET 69 7.115 11.400 11.204 506 2HG MET 69 HG1 MET 69 6.726 9.742 10.746 507 1HE MET 69 HE1 MET 69 6.850 12.880 7.856 508 2HE MET 69 HE2 MET 69 7.942 12.185 9.053 509 3HE MET 69 HE3 MET 69 6.794 13.436 9.529 510 H LEU 70 HN LEU 70 6.611 7.283 12.644 511 HA LEU 70 HA LEU 70 5.664 6.302 10.162 512 1HB LEU 70 HB1 LEU 70 6.593 4.070 11.539 513 2HB LEU 70 HB2 LEU 70 7.485 5.055 10.403 514 HG LEU 70 HG LEU 70 8.420 6.377 12.220 515 1HD1 LEU 70 HD21 LEU 70 8.050 5.476 14.582 516 2HD1 LEU 70 HD22 LEU 70 6.604 4.710 13.928 517 3HD1 LEU 70 HD23 LEU 70 6.769 6.463 13.876 518 1HD2 LEU 70 HD11 LEU 70 8.670 3.419 12.200 519 2HD2 LEU 70 HD12 LEU 70 9.467 4.314 13.494 520 3HD2 LEU 70 HD13 LEU 70 9.862 4.658 11.810 521 H GLY 71 HN GLY 71 5.062 5.126 13.477 522 1HA GLY 71 HA2 GLY 71 2.594 3.890 12.440 523 2HA GLY 71 HA1 GLY 71 3.505 3.250 13.796 524 H GLU 72 HN GLU 72 2.852 6.653 13.261 525 HA GLU 72 HA GLU 72 0.793 6.658 15.331 526 1HB GLU 72 HB2 GLU 72 2.045 7.630 16.915 527 2HB GLU 72 HB1 GLU 72 3.432 7.182 15.934 528 1HG GLU 72 HG2 GLU 72 3.948 9.295 15.560 529 2HG GLU 72 HG1 GLU 72 2.317 9.663 15.008 530 H ARG 73 HN ARG 73 1.881 7.704 12.387 531 HA ARG 73 HA ARG 73 0.047 10.005 12.446 532 1HB ARG 73 HB1 ARG 73 2.583 10.478 12.198 533 2HB ARG 73 HB2 ARG 73 2.384 9.855 10.565 534 1HG ARG 73 HG2 ARG 73 1.780 11.889 9.941 535 2HG ARG 73 HG1 ARG 73 0.314 11.692 10.905 536 1HD ARG 73 HD1 ARG 73 1.867 12.418 12.876 537 2HD ARG 73 HD2 ARG 73 2.860 13.093 11.585 538 HE ARG 73 HE ARG 73 0.739 14.305 10.921 539 1HH1 ARG 73 HH22 ARG 73 1.428 13.363 14.204 540 2HH1 ARG 73 HH21 ARG 73 0.477 14.631 14.903 541 1HH2 ARG 73 HH12 ARG 73 -0.515 15.977 11.833 542 2HH2 ARG 73 HH11 ARG 73 -0.627 16.116 13.556 543 H LEU 74 HN LEU 74 1.165 7.137 10.800 544 HA LEU 74 HA LEU 74 -0.150 7.469 8.348 545 1HB LEU 74 HB1 LEU 74 1.004 5.310 9.979 546 2HB LEU 74 HB2 LEU 74 -0.247 4.794 8.870 547 HG LEU 74 HG LEU 74 1.791 4.483 7.802 548 1HD1 LEU 74 HD21 LEU 74 0.521 5.178 6.068 549 2HD1 LEU 74 HD22 LEU 74 1.668 6.518 6.061 550 3HD1 LEU 74 HD23 LEU 74 0.105 6.699 6.860 551 1HD2 LEU 74 HD11 LEU 74 2.761 6.501 9.351 552 2HD2 LEU 74 HD12 LEU 74 2.830 7.167 7.718 553 3HD2 LEU 74 HD13 LEU 74 3.641 5.640 8.082 554 H PHE 75 HN PHE 75 -1.208 6.404 11.499 555 HA PHE 75 HA PHE 75 -3.367 4.900 11.118 556 1HB PHE 75 HB1 PHE 75 -2.629 5.587 13.331 557 2HB PHE 75 HB2 PHE 75 -3.254 7.210 13.060 558 HD1 PHE 75 HD1 PHE 75 -4.934 7.465 14.634 559 HD2 PHE 75 HD2 PHE 75 -4.811 3.929 12.264 560 HE1 PHE 75 HE1 PHE 75 -7.117 6.785 15.545 561 HE2 PHE 75 HE2 PHE 75 -6.994 3.244 13.175 562 HZ PHE 75 HZ PHE 75 -8.148 4.671 14.815 563 HA PRO 76 HA PRO 76 -6.530 8.539 10.423 564 1HB PRO 76 HB1 PRO 76 -4.715 10.652 9.399 565 2HB PRO 76 HB2 PRO 76 -6.123 10.792 10.458 566 1HG PRO 76 HG1 PRO 76 -3.653 11.049 11.428 567 2HG PRO 76 HG2 PRO 76 -4.918 10.216 12.353 568 1HD PRO 76 HD2 PRO 76 -2.654 9.065 10.773 569 2HD PRO 76 HD1 PRO 76 -3.319 8.543 12.333 570 H LEU 77 HN LEU 77 -3.729 7.864 8.508 571 HA LEU 77 HA LEU 77 -5.164 8.339 6.019 572 1HB LEU 77 HB2 LEU 77 -2.372 8.257 6.872 573 2HB LEU 77 HB1 LEU 77 -2.654 7.427 5.357 574 HG LEU 77 HG LEU 77 -3.196 9.368 4.231 575 1HD1 LEU 77 HD21 LEU 77 -5.029 10.089 5.633 576 2HD1 LEU 77 HD22 LEU 77 -3.950 11.449 5.320 577 3HD1 LEU 77 HD23 LEU 77 -3.903 10.626 6.879 578 1HD2 LEU 77 HD11 LEU 77 -1.092 10.065 4.449 579 2HD2 LEU 77 HD12 LEU 77 -1.046 9.641 6.162 580 3HD2 LEU 77 HD13 LEU 77 -1.701 11.199 5.655 581 H ILE 78 HN ILE 78 -4.070 5.678 8.005 582 HA ILE 78 HA ILE 78 -4.039 3.686 5.989 583 HB ILE 78 HB ILE 78 -4.731 3.162 8.862 584 1HG1 ILE 78 HG12 ILE 78 -2.637 4.602 8.514 585 2HG1 ILE 78 HG11 ILE 78 -2.450 3.127 9.453 586 1HG2 ILE 78 HG21 ILE 78 -3.114 1.148 7.921 587 2HG2 ILE 78 HG22 ILE 78 -4.114 1.552 6.525 588 3HG2 ILE 78 HG23 ILE 78 -4.872 1.092 8.050 589 1HD1 ILE 78 HD11 ILE 78 -1.221 2.088 7.833 590 2HD1 ILE 78 HD12 ILE 78 -0.721 3.765 7.614 591 3HD1 ILE 78 HD13 ILE 78 -1.915 3.054 6.530 592 H GLN 79 HN GLN 79 -6.539 4.924 8.138 593 HA GLN 79 HA GLN 79 -8.591 3.116 7.706 594 1HB GLN 79 HB1 GLN 79 -8.412 5.992 8.415 595 2HB GLN 79 HB2 GLN 79 -9.971 5.435 7.826 596 1HG GLN 79 HG2 GLN 79 -10.297 4.029 9.629 597 2HG GLN 79 HG1 GLN 79 -8.575 3.934 9.995 598 1HE2 GLN 79 HE21 GLN 79 -9.103 4.412 12.177 599 2HE2 GLN 79 HE22 GLN 79 -9.431 6.035 12.669 600 H ALA 80 HN ALA 80 -7.125 5.274 5.539 601 HA ALA 80 HA ALA 80 -9.320 5.431 3.665 602 1HB ALA 80 HB1 ALA 80 -7.650 7.264 3.966 603 2HB ALA 80 HB2 ALA 80 -7.848 6.730 2.296 604 3HB ALA 80 HB3 ALA 80 -6.442 6.211 3.228 605 H MET 81 HN MET 81 -6.322 3.620 4.059 606 HA MET 81 HA MET 81 -6.439 2.363 1.484 607 1HB MET 81 HB1 MET 81 -4.968 1.162 3.800 608 2HB MET 81 HB2 MET 81 -4.510 1.224 2.106 609 1HG MET 81 HG1 MET 81 -4.603 3.881 2.898 610 2HG MET 81 HG2 MET 81 -3.877 3.033 4.257 611 1HE MET 81 HE1 MET 81 -0.393 2.350 3.267 612 2HE MET 81 HE2 MET 81 -1.726 1.562 4.115 613 3HE MET 81 HE3 MET 81 -1.384 3.273 4.398 614 H HIS 82 HN HIS 82 -7.549 1.609 4.708 615 HA HIS 82 HA HIS 82 -8.985 -0.726 3.638 616 1HB HIS 82 HB1 HIS 82 -7.185 -0.514 5.995 617 2HB HIS 82 HB2 HIS 82 -8.639 -1.484 6.191 618 HD2 HIS 82 HD2 HIS 82 -6.019 -1.375 3.227 619 HE1 HIS 82 HE1 HIS 82 -6.636 -5.357 4.515 620 HE2 HIS 82 HE2 HIS 82 -5.423 -3.872 2.853 621 HA PRO 83 HA PRO 83 -12.681 1.099 5.246 622 1HB PRO 83 HB1 PRO 83 -13.361 -1.614 6.257 623 2HB PRO 83 HB2 PRO 83 -14.289 -0.537 5.208 624 1HG PRO 83 HG1 PRO 83 -13.055 -2.675 4.209 625 2HG PRO 83 HG2 PRO 83 -13.099 -1.146 3.311 626 1HD PRO 83 HD2 PRO 83 -10.860 -2.367 4.870 627 2HD PRO 83 HD1 PRO 83 -10.811 -1.459 3.345 628 H THR 84 HN THR 84 -11.311 2.164 6.893 629 HA THR 84 HA THR 84 -10.638 2.659 9.015 630 HB THR 84 HB THR 84 -12.454 2.851 10.564 631 HG1 THR 84 HG1 THR 84 -14.313 1.405 9.178 632 1HG2 THR 84 HG21 THR 84 -13.281 3.191 7.719 633 2HG2 THR 84 HG22 THR 84 -12.914 4.414 8.936 634 3HG2 THR 84 HG23 THR 84 -14.418 3.499 9.031 635 H LEU 85 HN LEU 85 -9.756 0.080 8.237 636 HA LEU 85 HA LEU 85 -10.141 -1.601 10.596 637 1HB LEU 85 HB1 LEU 85 -9.056 -2.030 7.851 638 2HB LEU 85 HB2 LEU 85 -8.541 -3.106 9.135 639 HG LEU 85 HG LEU 85 -11.461 -2.635 8.625 640 1HD1 LEU 85 HD11 LEU 85 -10.940 -3.337 6.502 641 2HD1 LEU 85 HD12 LEU 85 -11.193 -4.882 7.316 642 3HD1 LEU 85 HD13 LEU 85 -9.555 -4.288 7.038 643 1HD2 LEU 85 HD21 LEU 85 -11.266 -5.168 9.384 644 2HD2 LEU 85 HD22 LEU 85 -11.327 -3.843 10.546 645 3HD2 LEU 85 HD23 LEU 85 -9.778 -4.568 10.116 646 H ALA 86 HN ALA 86 -8.388 0.952 10.166 647 HA ALA 86 HA ALA 86 -5.716 0.062 10.690 648 1HB ALA 86 HB1 ALA 86 -5.960 2.738 11.494 649 2HB ALA 86 HB2 ALA 86 -7.032 2.537 10.109 650 3HB ALA 86 HB3 ALA 86 -5.325 2.119 9.970 651 H GLY 87 HN GLY 87 -7.938 -0.769 12.556 652 1HA GLY 87 HA1 GLY 87 -7.726 0.520 15.025 653 2HA GLY 87 HA2 GLY 87 -8.182 -1.161 14.801 654 H LYS 88 HN LYS 88 -5.446 -1.474 13.411 655 HA LYS 88 HA LYS 88 -3.480 -1.050 15.404 656 1HB LYS 88 HB1 LYS 88 -4.811 -2.883 16.474 657 2HB LYS 88 HB2 LYS 88 -4.401 -3.914 15.115 658 1HG LYS 88 HG2 LYS 88 -2.978 -4.350 17.050 659 2HG LYS 88 HG1 LYS 88 -2.044 -3.758 15.670 660 1HD LYS 88 HD2 LYS 88 -2.765 -1.462 17.060 661 2HD LYS 88 HD1 LYS 88 -2.345 -2.627 18.319 662 1HE LYS 88 HE1 LYS 88 -0.277 -3.094 16.792 663 2HE LYS 88 HE2 LYS 88 -0.647 -1.512 16.121 664 1HZ LYS 88 HZ1 LYS 88 -0.028 -0.461 18.009 665 2HZ LYS 88 HZ2 LYS 88 0.922 -1.846 18.218 666 3HZ LYS 88 HZ3 LYS 88 -0.556 -1.703 19.029 667 H ILE 89 HN ILE 89 -3.830 -0.734 12.531 668 HA ILE 89 HA ILE 89 -2.152 -2.738 11.318 669 HB ILE 89 HB ILE 89 -3.101 -0.139 10.136 670 1HG1 ILE 89 HG12 ILE 89 -4.218 -2.934 9.790 671 2HG1 ILE 89 HG11 ILE 89 -4.927 -1.712 10.839 672 1HG2 ILE 89 HG21 ILE 89 -1.171 -2.007 9.295 673 2HG2 ILE 89 HG22 ILE 89 -1.830 -0.643 8.389 674 3HG2 ILE 89 HG23 ILE 89 -2.584 -2.233 8.261 675 1HD1 ILE 89 HD11 ILE 89 -4.497 -1.117 7.954 676 2HD1 ILE 89 HD12 ILE 89 -5.680 -0.445 9.075 677 3HD1 ILE 89 HD13 ILE 89 -5.876 -2.089 8.467 678 H THR 90 HN THR 90 -1.663 0.644 10.631 679 HA THR 90 HA THR 90 1.095 0.587 10.527 680 HB THR 90 HB THR 90 -0.992 2.547 10.480 681 HG1 THR 90 HG1 THR 90 1.699 2.697 9.609 682 1HG2 THR 90 HG21 THR 90 -0.422 3.893 12.164 683 2HG2 THR 90 HG22 THR 90 0.884 4.383 11.085 684 3HG2 THR 90 HG23 THR 90 1.181 3.178 12.335 685 H GLY 91 HN GLY 91 -0.997 1.240 13.311 686 1HA GLY 91 HA2 GLY 91 0.949 2.098 15.130 687 2HA GLY 91 HA1 GLY 91 -0.532 1.248 15.561 688 H MET 92 HN MET 92 0.125 -1.082 13.940 689 HA MET 92 HA MET 92 1.818 -2.416 15.858 690 1HB MET 92 HB2 MET 92 0.270 -3.957 15.393 691 2HB MET 92 HB1 MET 92 -0.236 -3.129 13.928 692 1HG MET 92 HG1 MET 92 2.299 -4.441 13.594 693 2HG MET 92 HG2 MET 92 1.045 -5.539 14.137 694 1HE MET 92 HE1 MET 92 -1.461 -5.753 12.622 695 2HE MET 92 HE2 MET 92 -0.070 -6.831 12.768 696 3HE MET 92 HE3 MET 92 -0.753 -6.488 11.180 697 H LEU 93 HN LEU 93 2.040 -1.037 12.729 698 HA LEU 93 HA LEU 93 4.223 -2.472 11.694 699 1HB LEU 93 HB2 LEU 93 3.001 0.181 11.208 700 2HB LEU 93 HB1 LEU 93 4.606 -0.093 10.572 701 HG LEU 93 HG LEU 93 2.822 -0.529 8.910 702 1HD1 LEU 93 HD11 LEU 93 4.688 -2.678 9.806 703 2HD1 LEU 93 HD12 LEU 93 4.741 -1.670 8.358 704 3HD1 LEU 93 HD13 LEU 93 3.576 -2.990 8.472 705 1HD2 LEU 93 HD21 LEU 93 1.949 -3.075 9.848 706 2HD2 LEU 93 HD22 LEU 93 0.991 -1.654 9.429 707 3HD2 LEU 93 HD23 LEU 93 1.597 -1.856 11.079 708 H LEU 94 HN LEU 94 4.033 -0.708 14.461 709 HA LEU 94 HA LEU 94 6.882 0.024 14.397 710 1HB LEU 94 HB1 LEU 94 4.511 1.207 15.664 711 2HB LEU 94 HB2 LEU 94 5.884 1.047 16.740 712 HG LEU 94 HG LEU 94 7.235 2.462 15.372 713 1HD1 LEU 94 HD11 LEU 94 5.010 2.546 13.344 714 2HD1 LEU 94 HD12 LEU 94 6.440 1.524 13.202 715 3HD1 LEU 94 HD13 LEU 94 6.610 3.280 13.218 716 1HD2 LEU 94 HD21 LEU 94 6.261 4.279 16.179 717 2HD2 LEU 94 HD22 LEU 94 4.836 3.302 16.538 718 3HD2 LEU 94 HD23 LEU 94 4.955 4.161 15.001 719 H GLU 95 HN GLU 95 5.586 -2.626 14.716 720 HA GLU 95 HA GLU 95 7.164 -3.595 16.879 721 1HB GLU 95 HB2 GLU 95 5.513 -4.271 18.416 722 2HB GLU 95 HB1 GLU 95 5.089 -2.615 18.006 723 1HG GLU 95 HG1 GLU 95 3.332 -3.349 16.562 724 2HG GLU 95 HG2 GLU 95 3.835 -5.030 16.726 725 H ILE 96 HN ILE 96 5.634 -3.972 13.989 726 HA ILE 96 HA ILE 96 4.818 -6.653 13.961 727 HB ILE 96 HB ILE 96 5.094 -6.634 11.560 728 1HG1 ILE 96 HG12 ILE 96 7.277 -5.577 11.412 729 2HG1 ILE 96 HG11 ILE 96 6.117 -4.766 10.369 730 1HG2 ILE 96 HG21 ILE 96 4.031 -4.190 11.200 731 2HG2 ILE 96 HG22 ILE 96 3.780 -4.400 12.936 732 3HG2 ILE 96 HG23 ILE 96 3.133 -5.586 11.803 733 1HD1 ILE 96 HD11 ILE 96 6.751 -2.864 11.268 734 2HD1 ILE 96 HD12 ILE 96 7.726 -3.703 12.476 735 3HD1 ILE 96 HD13 ILE 96 6.018 -3.394 12.784 736 H ASP 97 HN ASP 97 6.363 -7.573 11.696 737 HA ASP 97 HA ASP 97 8.292 -9.175 12.924 738 1HB ASP 97 HB1 ASP 97 7.037 -9.320 10.611 739 2HB ASP 97 HB2 ASP 97 8.454 -8.459 10.015 740 H ASN 98 HN ASN 98 8.416 -5.929 12.423 741 HA ASN 98 HA ASN 98 10.056 -4.409 12.791 742 1HB ASN 98 HB2 ASN 98 11.796 -5.115 13.987 743 2HB ASN 98 HB1 ASN 98 11.291 -6.769 13.678 744 1HD2 ASN 98 HD22 ASN 98 13.602 -4.341 13.062 745 2HD2 ASN 98 HD21 ASN 98 14.625 -5.256 12.011 746 H SER 99 HN SER 99 10.516 -6.846 10.365 747 HA SER 99 HA SER 99 12.268 -5.328 8.709 748 1HB SER 99 HB1 SER 99 10.428 -7.437 7.621 749 2HB SER 99 HB2 SER 99 12.078 -7.038 7.136 750 HG SER 99 HG SER 99 11.169 -8.648 9.205 751 H GLU 100 HN GLU 100 8.875 -5.378 9.255 752 HA GLU 100 HA GLU 100 8.225 -3.900 6.839 753 1HB GLU 100 HB1 GLU 100 6.308 -4.173 9.101 754 2HB GLU 100 HB2 GLU 100 6.016 -4.212 7.370 755 1HG GLU 100 HG1 GLU 100 7.467 -6.439 7.602 756 2HG GLU 100 HG2 GLU 100 6.749 -6.390 9.211 757 H LEU 101 HN LEU 101 9.020 -3.365 10.153 758 HA LEU 101 HA LEU 101 8.159 -0.620 10.245 759 1HB LEU 101 HB1 LEU 101 8.285 -1.549 12.371 760 2HB LEU 101 HB2 LEU 101 9.756 -2.430 12.010 761 HG LEU 101 HG LEU 101 10.442 0.294 11.854 762 1HD1 LEU 101 HD11 LEU 101 8.934 -0.276 14.398 763 2HD1 LEU 101 HD12 LEU 101 8.310 0.711 13.076 764 3HD1 LEU 101 HD13 LEU 101 9.756 1.219 13.948 765 1HD2 LEU 101 HD21 LEU 101 10.951 -1.429 14.248 766 2HD2 LEU 101 HD22 LEU 101 12.016 -0.262 13.465 767 3HD2 LEU 101 HD23 LEU 101 11.680 -1.808 12.687 768 H LEU 102 HN LEU 102 10.912 -2.430 9.254 769 HA LEU 102 HA LEU 102 12.702 -0.160 9.103 770 1HB LEU 102 HB2 LEU 102 12.883 -3.059 8.315 771 2HB LEU 102 HB1 LEU 102 14.124 -1.915 7.860 772 HG LEU 102 HG LEU 102 13.605 -3.216 10.444 773 1HD1 LEU 102 HD11 LEU 102 15.607 -3.727 9.308 774 2HD1 LEU 102 HD12 LEU 102 16.062 -2.705 10.672 775 3HD1 LEU 102 HD13 LEU 102 15.981 -2.023 9.047 776 1HD2 LEU 102 HD21 LEU 102 13.985 -0.266 10.282 777 2HD2 LEU 102 HD22 LEU 102 14.776 -1.171 11.573 778 3HD2 LEU 102 HD23 LEU 102 13.019 -1.221 11.409 779 H HIS 103 HN HIS 103 11.073 -2.336 6.836 780 HA HIS 103 HA HIS 103 12.004 -1.146 4.485 781 1HB HIS 103 HB2 HIS 103 10.521 -3.354 5.095 782 2HB HIS 103 HB1 HIS 103 9.298 -2.313 4.377 783 HD2 HIS 103 HD2 HIS 103 13.005 -3.040 3.198 784 HE1 HIS 103 HE1 HIS 103 10.292 -3.678 0.014 785 HE2 HIS 103 HE2 HIS 103 12.733 -3.681 0.699 786 H MET 104 HN MET 104 8.970 -0.617 6.281 787 HA MET 104 HA MET 104 7.716 1.136 4.552 788 1HB MET 104 HB2 MET 104 6.450 1.946 6.450 789 2HB MET 104 HB1 MET 104 6.721 0.209 6.646 790 1HG MET 104 HG2 MET 104 8.744 0.890 8.043 791 2HG MET 104 HG1 MET 104 8.024 2.497 8.074 792 1HE MET 104 HE1 MET 104 5.185 2.267 8.124 793 2HE MET 104 HE2 MET 104 4.413 1.418 9.465 794 3HE MET 104 HE3 MET 104 4.834 0.541 7.991 795 H LEU 105 HN LEU 105 10.283 1.799 6.863 796 HA LEU 105 HA LEU 105 10.139 4.653 6.472 797 1HB LEU 105 HB1 LEU 105 12.308 3.028 7.795 798 2HB LEU 105 HB2 LEU 105 12.049 4.754 7.955 799 HG LEU 105 HG LEU 105 10.146 2.623 8.927 800 1HD1 LEU 105 HD11 LEU 105 12.565 3.603 10.056 801 2HD1 LEU 105 HD12 LEU 105 11.409 2.459 10.737 802 3HD1 LEU 105 HD13 LEU 105 11.214 4.189 11.025 803 1HD2 LEU 105 HD21 LEU 105 9.708 5.314 8.327 804 2HD2 LEU 105 HD22 LEU 105 9.856 5.238 10.084 805 3HD2 LEU 105 HD23 LEU 105 8.663 4.237 9.255 806 H GLU 106 HN GLU 106 11.562 2.022 4.891 807 HA GLU 106 HA GLU 106 13.609 3.725 3.691 808 1HB GLU 106 HB1 GLU 106 14.924 1.875 3.449 809 2HB GLU 106 HB2 GLU 106 13.922 1.306 4.779 810 1HG GLU 106 HG1 GLU 106 13.473 -0.470 3.541 811 2HG GLU 106 HG2 GLU 106 12.499 0.586 2.519 812 H SER 107 HN SER 107 10.534 2.495 2.942 813 HA SER 107 HA SER 107 11.004 3.175 0.124 814 1HB SER 107 HB2 SER 107 11.026 0.577 0.800 815 2HB SER 107 HB1 SER 107 9.293 0.800 0.580 816 HG SER 107 HG SER 107 9.638 1.412 -1.517 817 HA PRO 108 HA PRO 108 7.133 5.274 0.687 818 1HB PRO 108 HB1 PRO 108 6.999 5.563 -2.211 819 2HB PRO 108 HB2 PRO 108 7.275 6.800 -0.982 820 1HG PRO 108 HG1 PRO 108 9.201 5.997 -2.711 821 2HG PRO 108 HG2 PRO 108 9.559 6.565 -1.069 822 1HD PRO 108 HD1 PRO 108 9.400 3.758 -2.110 823 2HD PRO 108 HD2 PRO 108 10.577 4.480 -0.991 824 H GLU 109 HN GLU 109 7.509 2.280 -0.570 825 HA GLU 109 HA GLU 109 4.627 1.998 -1.138 826 1HB GLU 109 HB2 GLU 109 6.922 0.483 -2.404 827 2HB GLU 109 HB1 GLU 109 5.217 0.156 -2.686 828 1HG GLU 109 HG1 GLU 109 5.154 2.668 -3.397 829 2HG GLU 109 HG2 GLU 109 6.889 2.437 -3.616 830 H SER 110 HN SER 110 7.401 0.922 0.586 831 HA SER 110 HA SER 110 6.502 -1.646 1.371 832 1HB SER 110 HB2 SER 110 8.018 -1.070 3.441 833 2HB SER 110 HB1 SER 110 8.768 -1.283 1.850 834 HG SER 110 HG SER 110 7.936 1.219 2.885 835 H LEU 111 HN LEU 111 6.478 1.463 3.037 836 HA LEU 111 HA LEU 111 5.112 0.782 5.298 837 1HB LEU 111 HB1 LEU 111 6.106 2.987 4.828 838 2HB LEU 111 HB2 LEU 111 4.789 3.327 3.717 839 HG LEU 111 HG LEU 111 3.987 2.573 6.451 840 1HD1 LEU 111 HD11 LEU 111 5.213 4.046 7.537 841 2HD1 LEU 111 HD12 LEU 111 4.497 5.332 6.564 842 3HD1 LEU 111 HD13 LEU 111 5.997 4.558 6.032 843 1HD2 LEU 111 HD21 LEU 111 3.121 4.954 4.860 844 2HD2 LEU 111 HD22 LEU 111 2.213 4.011 6.043 845 3HD2 LEU 111 HD23 LEU 111 2.553 3.334 4.450 846 H ARG 112 HN ARG 112 3.823 1.242 2.083 847 HA ARG 112 HA ARG 112 1.093 1.161 3.046 848 1HB ARG 112 HB2 ARG 112 1.014 2.521 1.245 849 2HB ARG 112 HB1 ARG 112 2.450 1.811 0.515 850 1HG ARG 112 HG1 ARG 112 1.179 0.020 -0.408 851 2HG ARG 112 HG2 ARG 112 -0.264 0.514 0.480 852 1HD ARG 112 HD2 ARG 112 -0.340 2.602 -0.772 853 2HD ARG 112 HD1 ARG 112 1.123 2.144 -1.645 854 HE ARG 112 HE ARG 112 -0.125 0.709 -2.946 855 1HH1 ARG 112 HH12 ARG 112 -2.052 1.884 -0.293 856 2HH1 ARG 112 HH11 ARG 112 -3.540 1.273 -0.933 857 1HH2 ARG 112 HH22 ARG 112 -2.078 -0.101 -3.798 858 2HH2 ARG 112 HH21 ARG 112 -3.554 0.145 -2.927 859 H SER 113 HN SER 113 2.945 -0.780 0.683 860 HA SER 113 HA SER 113 1.122 -2.859 0.449 861 1HB SER 113 HB1 SER 113 4.139 -2.989 0.209 862 2HB SER 113 HB2 SER 113 3.013 -4.201 -0.404 863 HG SER 113 HG SER 113 2.713 -1.522 -1.181 864 H LYS 114 HN LYS 114 3.607 -2.308 2.854 865 HA LYS 114 HA LYS 114 3.337 -4.912 4.047 866 1HB LYS 114 HB1 LYS 114 4.700 -2.432 5.111 867 2HB LYS 114 HB2 LYS 114 4.828 -4.045 5.798 868 1HG LYS 114 HG1 LYS 114 5.737 -3.255 3.040 869 2HG LYS 114 HG2 LYS 114 6.783 -3.436 4.451 870 1HD LYS 114 HD2 LYS 114 6.917 -5.635 4.140 871 2HD LYS 114 HD1 LYS 114 5.159 -5.784 4.104 872 1HE LYS 114 HE2 LYS 114 6.347 -6.573 2.035 873 2HE LYS 114 HE1 LYS 114 5.083 -5.374 1.770 874 1HZ LYS 114 HZ1 LYS 114 6.804 -3.663 1.658 875 2HZ LYS 114 HZ2 LYS 114 7.031 -4.848 0.473 876 3HZ LYS 114 HZ3 LYS 114 8.002 -4.840 1.858 877 H VAL 115 HN VAL 115 1.958 -1.725 4.504 878 HA VAL 115 HA VAL 115 0.835 -2.283 7.083 879 HB VAL 115 HB VAL 115 0.719 -0.048 5.176 880 1HG1 VAL 115 HG11 VAL 115 -1.373 0.848 6.365 881 2HG1 VAL 115 HG12 VAL 115 -1.707 -0.839 6.754 882 3HG1 VAL 115 HG13 VAL 115 -1.603 -0.327 5.069 883 1HG2 VAL 115 HG21 VAL 115 0.170 0.603 7.910 884 2HG2 VAL 115 HG22 VAL 115 1.586 0.983 6.925 885 3HG2 VAL 115 HG23 VAL 115 1.512 -0.539 7.814 886 H ASP 116 HN ASP 116 -0.495 -2.160 3.784 887 HA ASP 116 HA ASP 116 -3.066 -3.077 4.371 888 1HB ASP 116 HB1 ASP 116 -1.488 -2.569 2.033 889 2HB ASP 116 HB2 ASP 116 -2.337 -4.096 1.834 890 H GLU 117 HN GLU 117 -0.039 -4.756 3.937 891 HA GLU 117 HA GLU 117 -1.254 -7.386 3.872 892 1HB GLU 117 HB1 GLU 117 1.502 -6.283 3.718 893 2HB GLU 117 HB2 GLU 117 1.341 -7.904 4.381 894 1HG GLU 117 HG2 GLU 117 -0.127 -8.287 2.239 895 2HG GLU 117 HG1 GLU 117 0.797 -6.913 1.630 896 H ALA 118 HN ALA 118 0.125 -5.169 6.165 897 HA ALA 118 HA ALA 118 0.371 -7.010 8.326 898 1HB ALA 118 HB1 ALA 118 1.223 -4.466 7.952 899 2HB ALA 118 HB2 ALA 118 1.155 -5.279 9.516 900 3HB ALA 118 HB3 ALA 118 -0.156 -4.209 9.018 901 H VAL 119 HN VAL 119 -2.218 -5.306 6.832 902 HA VAL 119 HA VAL 119 -4.073 -5.338 8.976 903 HB VAL 119 HB VAL 119 -4.783 -5.556 6.068 904 1HG1 VAL 119 HG11 VAL 119 -6.498 -5.920 7.886 905 2HG1 VAL 119 HG12 VAL 119 -6.866 -4.634 6.734 906 3HG1 VAL 119 HG13 VAL 119 -6.253 -4.231 8.336 907 1HG2 VAL 119 HG21 VAL 119 -3.984 -3.533 5.690 908 2HG2 VAL 119 HG22 VAL 119 -3.324 -3.487 7.324 909 3HG2 VAL 119 HG23 VAL 119 -4.954 -2.888 7.011 910 H ALA 120 HN ALA 120 -3.699 -7.420 6.132 911 HA ALA 120 HA ALA 120 -5.511 -9.407 6.831 912 1HB ALA 120 HB1 ALA 120 -3.500 -9.013 4.877 913 2HB ALA 120 HB2 ALA 120 -4.825 -10.182 4.875 914 3HB ALA 120 HB3 ALA 120 -3.267 -10.616 5.581 915 H VAL 121 HN VAL 121 -2.422 -8.623 8.087 916 HA VAL 121 HA VAL 121 -2.021 -11.146 9.447 917 HB VAL 121 HB VAL 121 -0.490 -8.561 9.301 918 1HG1 VAL 121 HG21 VAL 121 1.047 -10.500 10.659 919 2HG1 VAL 121 HG22 VAL 121 -0.500 -10.366 11.494 920 3HG1 VAL 121 HG23 VAL 121 0.494 -8.929 11.242 921 1HG2 VAL 121 HG11 VAL 121 1.048 -9.723 8.034 922 2HG2 VAL 121 HG12 VAL 121 -0.472 -10.465 7.530 923 3HG2 VAL 121 HG13 VAL 121 0.568 -11.287 8.695 924 H LEU 122 HN LEU 122 -3.147 -7.908 10.097 925 HA LEU 122 HA LEU 122 -3.161 -8.111 12.938 926 1HB LEU 122 HB2 LEU 122 -3.465 -5.920 12.724 927 2HB LEU 122 HB1 LEU 122 -3.645 -6.113 10.992 928 HG LEU 122 HG LEU 122 -6.150 -6.771 11.878 929 1HD1 LEU 122 HD11 LEU 122 -6.696 -4.831 13.423 930 2HD1 LEU 122 HD12 LEU 122 -4.963 -4.736 13.738 931 3HD1 LEU 122 HD13 LEU 122 -5.853 -6.205 14.139 932 1HD2 LEU 122 HD21 LEU 122 -6.297 -4.054 11.441 933 2HD2 LEU 122 HD22 LEU 122 -6.381 -5.315 10.210 934 3HD2 LEU 122 HD23 LEU 122 -4.841 -4.536 10.569 935 H GLN 123 HN GLN 123 -5.572 -8.528 10.398 936 HA GLN 123 HA GLN 123 -7.761 -9.090 12.106 937 1HB GLN 123 HB2 GLN 123 -8.645 -10.221 9.940 938 2HB GLN 123 HB1 GLN 123 -8.382 -8.487 9.942 939 1HG GLN 123 HG1 GLN 123 -7.034 -8.629 8.228 940 2HG GLN 123 HG2 GLN 123 -5.985 -9.732 9.114 941 1HE2 GLN 123 HE21 GLN 123 -6.352 -11.988 8.934 942 2HE2 GLN 123 HE22 GLN 123 -7.175 -12.644 7.565 943 H ALA 124 HN ALA 124 -5.188 -10.949 10.717 944 HA ALA 124 HA ALA 124 -6.278 -13.513 11.469 945 1HB ALA 124 HB1 ALA 124 -3.505 -12.794 10.523 946 2HB ALA 124 HB2 ALA 124 -4.853 -13.266 9.486 947 3HB ALA 124 HB3 ALA 124 -4.181 -14.419 10.639 948 H HIS 125 HN HIS 125 -4.508 -11.050 13.022 949 HA HIS 125 HA HIS 125 -3.616 -12.921 15.116 950 1HB HIS 125 HB1 HIS 125 -2.225 -10.863 13.766 951 2HB HIS 125 HB2 HIS 125 -2.471 -10.303 15.416 952 HD2 HIS 125 HD2 HIS 125 -0.461 -12.960 13.447 953 HE1 HIS 125 HE1 HIS 125 0.631 -13.169 17.531 954 HE2 HIS 125 HE2 HIS 125 1.170 -13.980 15.188 955 H GLN 126 HN GLN 126 -6.170 -11.128 14.513 956 HA GLN 126 HA GLN 126 -6.339 -9.515 16.880 957 1HB GLN 126 HB1 GLN 126 -8.077 -10.113 14.561 958 2HB GLN 126 HB2 GLN 126 -8.903 -9.663 16.046 959 1HG GLN 126 HG2 GLN 126 -6.651 -8.005 14.976 960 2HG GLN 126 HG1 GLN 126 -8.291 -7.829 14.353 961 1HE2 GLN 126 HE21 GLN 126 -7.897 -5.619 15.204 962 2HE2 GLN 126 HE22 GLN 126 -8.314 -5.310 16.852 963 H ALA 127 HN ALA 127 -9.194 -11.322 16.287 964 HA ALA 127 HA ALA 127 -8.920 -12.586 18.908 965 1HB ALA 127 HB1 ALA 127 -11.428 -13.126 18.368 966 2HB ALA 127 HB2 ALA 127 -11.227 -11.836 17.181 967 3HB ALA 127 HB3 ALA 127 -10.944 -11.513 18.892 968 H LYS 128 HN LYS 128 -7.640 -13.559 16.354 969 HA LYS 128 HA LYS 128 -8.999 -16.082 15.873 970 1HB LYS 128 HB2 LYS 128 -6.327 -15.304 14.733 971 2HB LYS 128 HB1 LYS 128 -7.541 -16.378 14.051 972 1HG LYS 128 HG2 LYS 128 -8.877 -13.986 14.234 973 2HG LYS 128 HG1 LYS 128 -7.235 -13.501 13.799 974 1HD LYS 128 HD1 LYS 128 -8.431 -13.842 11.767 975 2HD LYS 128 HD2 LYS 128 -7.325 -15.205 11.956 976 1HE LYS 128 HE1 LYS 128 -9.597 -16.083 13.225 977 2HE LYS 128 HE2 LYS 128 -10.242 -15.149 11.875 978 1HZ LYS 128 HZ1 LYS 128 -8.476 -16.496 10.542 979 2HZ LYS 128 HZ2 LYS 128 -9.970 -17.193 10.920 980 3HZ LYS 128 HZ3 LYS 128 -8.601 -17.582 11.834 981 H GLU 129 HN GLU 129 -6.342 -17.364 15.286 982 HA GLU 129 HA GLU 129 -5.984 -18.549 17.892 983 1HB GLU 129 HB1 GLU 129 -4.366 -20.028 16.688 984 2HB GLU 129 HB2 GLU 129 -5.985 -20.030 16.001 985 1HG GLU 129 HG2 GLU 129 -5.333 -18.942 14.098 986 2HG GLU 129 HG1 GLU 129 -3.968 -18.152 14.886 987 H ALA 130 HN ALA 130 -5.089 -15.719 17.180 988 HA ALA 130 HA ALA 130 -2.285 -15.591 17.183 989 1HB ALA 130 HB1 ALA 130 -3.861 -13.466 18.539 990 2HB ALA 130 HB2 ALA 130 -4.141 -13.756 16.821 991 3HB ALA 130 HB3 ALA 130 -2.528 -13.329 17.393 992 H ALA 131 HN ALA 131 -4.570 -15.216 19.895 993 HA ALA 131 HA ALA 131 -2.430 -15.333 21.829 994 1HB ALA 131 HB1 ALA 131 -4.526 -13.926 22.049 995 2HB ALA 131 HB2 ALA 131 -4.060 -14.868 23.465 996 3HB ALA 131 HB3 ALA 131 -5.373 -15.425 22.427 997 H GLN 132 HN GLN 132 -1.571 -17.171 22.521 998 HA GLN 132 HA GLN 132 -2.987 -19.679 22.131 999 1HB GLN 132 HB2 GLN 132 -0.193 -19.162 23.169 1000 2HB GLN 132 HB1 GLN 132 -0.862 -20.735 22.755 1001 1HG GLN 132 HG1 GLN 132 -0.676 -18.519 20.747 1002 2HG GLN 132 HG2 GLN 132 0.671 -19.611 21.062 1003 1HE2 GLN 132 HE21 GLN 132 -2.702 -19.487 20.065 1004 2HE2 GLN 132 HE22 GLN 132 -2.667 -20.934 19.123 1005 H LYS 133 HN LYS 133 -0.891 -18.743 24.836 1006 HA LYS 133 HA LYS 133 -2.515 -20.194 26.695 1007 1HB LYS 133 HB2 LYS 133 -0.047 -20.007 26.899 1008 2HB LYS 133 HB1 LYS 133 -0.228 -18.292 27.239 1009 1HG LYS 133 HG1 LYS 133 -0.252 -18.888 29.383 1010 2HG LYS 133 HG2 LYS 133 -1.900 -19.446 29.081 1011 1HD LYS 133 HD2 LYS 133 0.179 -21.369 28.328 1012 2HD LYS 133 HD1 LYS 133 0.128 -20.995 30.053 1013 1HE LYS 133 HE1 LYS 133 -1.311 -22.844 29.732 1014 2HE LYS 133 HE2 LYS 133 -2.352 -21.438 29.955 1015 1HZ LYS 133 HZ1 LYS 133 -1.612 -22.124 27.218 1016 2HZ LYS 133 HZ2 LYS 133 -3.069 -21.515 27.824 1017 3HZ LYS 133 HZ3 LYS 133 -2.702 -23.157 27.997 1018 H ALA 134 HN ALA 134 -4.027 -19.470 28.078 1019 HA ALA 134 HA ALA 134 -5.201 -16.916 27.658 1020 1HB ALA 134 HB1 ALA 134 -6.781 -18.454 28.276 1021 2HB ALA 134 HB2 ALA 134 -6.485 -17.663 29.824 1022 3HB ALA 134 HB3 ALA 134 -5.731 -19.217 29.472 1023 H VAL 135 HN VAL 135 -4.027 -18.266 30.743 1024 HA VAL 135 HA VAL 135 -3.283 -15.545 31.559 1025 HB VAL 135 HB VAL 135 -3.167 -16.525 33.870 1026 1HG1 VAL 135 HG21 VAL 135 -5.792 -16.954 33.848 1027 2HG1 VAL 135 HG22 VAL 135 -5.625 -16.262 32.234 1028 3HG1 VAL 135 HG23 VAL 135 -5.097 -15.345 33.646 1029 1HG2 VAL 135 HG11 VAL 135 -4.596 -18.688 34.040 1030 2HG2 VAL 135 HG12 VAL 135 -2.884 -18.807 33.632 1031 3HG2 VAL 135 HG13 VAL 135 -4.103 -18.932 32.364 1032 H ASN 136 HN ASN 136 -1.233 -15.026 32.176 1033 HA ASN 136 HA ASN 136 0.850 -16.916 31.432 1034 1HB ASN 136 HB2 ASN 136 2.171 -14.660 32.255 1035 2HB ASN 136 HB1 ASN 136 1.646 -14.973 30.604 1036 1HD2 ASN 136 HD21 ASN 136 -0.189 -13.945 29.811 1037 2HD2 ASN 136 HD22 ASN 136 -0.861 -12.553 30.581 1038 H SER 137 HN SER 137 -0.120 -18.092 33.480 1039 HA SER 137 HA SER 137 0.956 -17.151 35.990 1040 1HB SER 137 HB1 SER 137 0.161 -19.719 36.480 1041 2HB SER 137 HB2 SER 137 -0.902 -18.314 36.572 1042 HG SER 137 HG SER 137 -1.769 -19.978 35.254 1043 H ALA 138 HN ALA 138 2.613 -18.095 37.173 1044 HA ALA 138 HA ALA 138 4.779 -19.141 35.671 1045 1HB ALA 138 HB1 ALA 138 5.388 -19.661 38.311 1046 2HB ALA 138 HB2 ALA 138 4.304 -18.272 38.403 1047 3HB ALA 138 HB3 ALA 138 5.769 -18.184 37.425 1048 H THR 139 HN THR 139 2.328 -20.590 37.732 1049 HA THR 139 HA THR 139 3.553 -23.224 37.475 1050 HB THR 139 HB THR 139 0.946 -23.156 38.770 1051 HG1 THR 139 HG1 THR 139 2.688 -21.870 40.413 1052 1HG2 THR 139 HG21 THR 139 2.722 -24.903 39.050 1053 2HG2 THR 139 HG22 THR 139 2.029 -24.267 40.543 1054 3HG2 THR 139 HG23 THR 139 3.619 -23.723 40.007 1055 H GLY 140 HN GLY 140 3.241 -23.923 35.408 1056 1HA GLY 140 HA2 GLY 140 0.476 -23.924 34.381 1057 2HA GLY 140 HA1 GLY 140 1.920 -24.034 33.386 1058 H VAL 141 HN VAL 141 1.405 -25.917 32.347 1059 HA VAL 141 HA VAL 141 0.481 -28.250 33.702 1060 HB VAL 141 HB VAL 141 -0.074 -27.935 31.372 1061 1HG1 VAL 141 HG21 VAL 141 2.884 -28.126 30.816 1062 2HG1 VAL 141 HG22 VAL 141 1.905 -26.664 30.705 1063 3HG1 VAL 141 HG23 VAL 141 1.606 -28.011 29.606 1064 1HG2 VAL 141 HG11 VAL 141 0.436 -30.267 32.377 1065 2HG2 VAL 141 HG12 VAL 141 1.845 -30.230 31.318 1066 3HG2 VAL 141 HG13 VAL 141 0.223 -30.110 30.634 1067 HA PRO 142 HA PRO 142 0.475 -30.110 34.057 1068 1HB PRO 142 HB2 PRO 142 1.074 -32.096 35.782 1069 2HB PRO 142 HB1 PRO 142 1.358 -32.230 34.045 1070 1HG PRO 142 HG1 PRO 142 3.289 -31.888 36.241 1071 2HG PRO 142 HG2 PRO 142 3.538 -32.540 34.614 1072 1HD PRO 142 HD2 PRO 142 4.151 -29.910 35.582 1073 2HD PRO 142 HD1 PRO 142 4.397 -30.561 33.950 1074 H THR 143 HN THR 143 2.196 -30.698 37.093 1075 HA THR 143 HA THR 143 0.194 -29.064 38.475 1076 HB THR 143 HB THR 143 2.182 -30.818 39.877 1077 HG1 THR 143 HG1 THR 143 0.255 -31.639 38.120 1078 1HG2 THR 143 HG21 THR 143 0.225 -29.288 40.880 1079 2HG2 THR 143 HG22 THR 143 0.790 -30.781 41.631 1080 3HG2 THR 143 HG23 THR 143 -0.658 -30.794 40.623 1081 H VAL 144 HN VAL 144 3.635 -29.809 39.042 1082 HA VAL 144 HA VAL 144 4.156 -26.937 39.345 1083 HB VAL 144 HB VAL 144 3.824 -27.823 41.604 1084 1HG1 VAL 144 HG21 VAL 144 6.249 -29.546 41.304 1085 2HG1 VAL 144 HG22 VAL 144 4.659 -30.164 40.854 1086 3HG1 VAL 144 HG23 VAL 144 4.961 -29.623 42.505 1087 1HG2 VAL 144 HG11 VAL 144 6.604 -27.514 42.006 1088 2HG2 VAL 144 HG12 VAL 144 5.331 -26.310 42.201 1089 3HG2 VAL 144 HG13 VAL 144 6.149 -26.483 40.649 Start of MODEL 21 1 1H GLY 1 HT1 GLY 1 11.372 45.174 2.038 2 2H GLY 1 HT2 GLY 1 10.722 45.597 0.535 3 3H GLY 1 HT3 GLY 1 11.741 46.674 1.349 4 1HA GLY 1 HA1 GLY 1 13.015 45.689 -0.376 5 2HA GLY 1 HA2 GLY 1 13.568 45.039 1.161 6 HA PRO 2 HA PRO 2 12.585 41.527 -1.791 7 1HB PRO 2 HB2 PRO 2 14.970 40.251 -1.524 8 2HB PRO 2 HB1 PRO 2 14.681 41.511 -2.728 9 1HG PRO 2 HG2 PRO 2 16.016 41.713 -0.055 10 2HG PRO 2 HG1 PRO 2 16.503 42.425 -1.605 11 1HD PRO 2 HD2 PRO 2 15.230 43.852 0.306 12 2HD PRO 2 HD1 PRO 2 14.993 44.160 -1.427 13 H LEU 3 HN LEU 3 11.358 40.042 -0.836 14 HA LEU 3 HA LEU 3 11.838 39.251 1.907 15 1HB LEU 3 HB1 LEU 3 9.584 39.478 0.280 16 2HB LEU 3 HB2 LEU 3 9.777 37.752 0.516 17 HG LEU 3 HG LEU 3 9.905 39.511 2.918 18 1HD1 LEU 3 HD21 LEU 3 7.531 39.141 1.187 19 2HD1 LEU 3 HD22 LEU 3 7.963 40.477 2.254 20 3HD1 LEU 3 HD23 LEU 3 7.295 38.990 2.929 21 1HD2 LEU 3 HD11 LEU 3 9.249 36.699 2.240 22 2HD2 LEU 3 HD12 LEU 3 8.431 37.423 3.625 23 3HD2 LEU 3 HD13 LEU 3 10.192 37.354 3.579 24 H GLY 4 HN GLY 4 13.235 38.348 -0.855 25 1HA GLY 4 HA2 GLY 4 13.273 35.473 -0.216 26 2HA GLY 4 HA1 GLY 4 13.726 36.173 -1.762 27 H SER 5 HN SER 5 15.204 34.343 0.009 28 HA SER 5 HA SER 5 17.437 35.985 0.920 29 1HB SER 5 HB2 SER 5 16.582 33.150 1.358 30 2HB SER 5 HB1 SER 5 18.281 33.570 1.579 31 HG SER 5 HG SER 5 16.861 35.424 2.801 32 H ALA 6 HN ALA 6 17.210 36.162 -1.764 33 HA ALA 6 HA ALA 6 18.428 36.037 -3.679 34 1HB ALA 6 HB1 ALA 6 20.750 34.672 -3.157 35 2HB ALA 6 HB2 ALA 6 20.335 35.356 -1.587 36 3HB ALA 6 HB3 ALA 6 20.515 36.412 -2.988 37 H ALA 7 HN ALA 7 17.681 34.774 -5.230 38 HA ALA 7 HA ALA 7 17.112 32.949 -6.461 39 1HB ALA 7 HB1 ALA 7 18.697 30.870 -5.823 40 2HB ALA 7 HB2 ALA 7 19.645 32.199 -5.157 41 3HB ALA 7 HB3 ALA 7 19.200 32.202 -6.863 42 H ALA 8 HN ALA 8 15.153 33.090 -5.003 43 HA ALA 8 HA ALA 8 14.873 31.088 -2.960 44 1HB ALA 8 HB1 ALA 8 13.426 32.690 -2.366 45 2HB ALA 8 HB2 ALA 8 12.329 31.904 -3.501 46 3HB ALA 8 HB3 ALA 8 13.276 33.300 -4.015 47 H ALA 9 HN ALA 9 13.752 29.176 -3.045 48 HA ALA 9 HA ALA 9 13.175 28.165 -5.744 49 1HB ALA 9 HB1 ALA 9 14.817 27.083 -3.935 50 2HB ALA 9 HB2 ALA 9 13.913 26.121 -5.106 51 3HB ALA 9 HB3 ALA 9 13.312 26.296 -3.457 52 H THR 10 HN THR 10 11.420 29.755 -3.793 53 HA THR 10 HA THR 10 9.144 27.884 -3.809 54 HB THR 10 HB THR 10 8.272 29.463 -1.939 55 HG1 THR 10 HG1 THR 10 10.446 30.037 -0.774 56 1HG2 THR 10 HG21 THR 10 10.532 28.074 -0.742 57 2HG2 THR 10 HG22 THR 10 9.559 27.065 -1.812 58 3HG2 THR 10 HG23 THR 10 8.801 27.897 -0.454 59 HA PRO 11 HA PRO 11 8.047 31.294 -6.708 60 1HB PRO 11 HB1 PRO 11 6.524 29.739 -8.330 61 2HB PRO 11 HB2 PRO 11 8.279 29.869 -8.494 62 1HG PRO 11 HG2 PRO 11 6.651 27.737 -7.163 63 2HG PRO 11 HG1 PRO 11 8.057 27.567 -8.230 64 1HD PRO 11 HD2 PRO 11 8.247 27.369 -5.539 65 2HD PRO 11 HD1 PRO 11 9.554 28.036 -6.538 66 H ALA 12 HN ALA 12 6.232 32.527 -6.670 67 HA ALA 12 HA ALA 12 4.026 31.588 -4.990 68 1HB ALA 12 HB1 ALA 12 4.455 33.614 -4.114 69 2HB ALA 12 HB2 ALA 12 3.455 34.191 -5.447 70 3HB ALA 12 HB3 ALA 12 5.213 34.209 -5.592 71 H VAL 13 HN VAL 13 4.312 30.634 -7.706 72 HA VAL 13 HA VAL 13 2.242 32.008 -9.220 73 HB VAL 13 HB VAL 13 3.663 29.470 -10.009 74 1HG1 VAL 13 HG11 VAL 13 2.594 29.642 -11.959 75 2HG1 VAL 13 HG12 VAL 13 2.929 31.370 -12.081 76 3HG1 VAL 13 HG13 VAL 13 1.539 30.804 -11.154 77 1HG2 VAL 13 HG21 VAL 13 4.643 32.246 -9.933 78 2HG2 VAL 13 HG22 VAL 13 4.924 31.375 -11.442 79 3HG2 VAL 13 HG23 VAL 13 5.535 30.724 -9.920 80 H ARG 14 HN ARG 14 0.263 31.622 -8.377 81 HA ARG 14 HA ARG 14 -0.509 29.046 -7.366 82 1HB ARG 14 HB1 ARG 14 -1.372 31.516 -6.812 83 2HB ARG 14 HB2 ARG 14 -2.559 31.095 -8.039 84 1HG ARG 14 HG2 ARG 14 -3.657 30.372 -6.191 85 2HG ARG 14 HG1 ARG 14 -2.762 28.902 -6.582 86 1HD ARG 14 HD1 ARG 14 -2.218 29.054 -4.383 87 2HD ARG 14 HD2 ARG 14 -0.938 30.071 -5.045 88 HE ARG 14 HE ARG 14 -3.115 31.717 -4.512 89 1HH1 ARG 14 HH11 ARG 14 -0.868 29.714 -2.756 90 2HH1 ARG 14 HH12 ARG 14 -0.940 30.672 -1.315 91 1HH2 ARG 14 HH21 ARG 14 -3.217 32.983 -2.619 92 2HH2 ARG 14 HH22 ARG 14 -2.275 32.531 -1.237 93 H THR 15 HN THR 15 -0.146 30.249 -10.425 94 HA THR 15 HA THR 15 -2.363 28.705 -11.560 95 HB THR 15 HB THR 15 -0.700 30.060 -13.506 96 HG1 THR 15 HG1 THR 15 -0.722 32.058 -12.757 97 1HG2 THR 15 HG21 THR 15 -2.674 30.162 -14.475 98 2HG2 THR 15 HG22 THR 15 -3.181 31.345 -13.269 99 3HG2 THR 15 HG23 THR 15 -3.467 29.628 -12.993 100 H VAL 16 HN VAL 16 -1.209 28.201 -14.076 101 HA VAL 16 HA VAL 16 0.791 26.157 -13.366 102 HB VAL 16 HB VAL 16 -0.174 25.340 -15.788 103 1HG1 VAL 16 HG21 VAL 16 -0.424 23.488 -14.594 104 2HG1 VAL 16 HG22 VAL 16 -1.770 24.193 -13.697 105 3HG1 VAL 16 HG23 VAL 16 -0.114 24.434 -13.139 106 1HG2 VAL 16 HG11 VAL 16 -2.491 25.571 -15.934 107 2HG2 VAL 16 HG12 VAL 16 -1.937 27.184 -15.484 108 3HG2 VAL 16 HG13 VAL 16 -2.636 26.118 -14.264 109 HA PRO 17 HA PRO 17 3.423 28.634 -16.035 110 1HB PRO 17 HB2 PRO 17 5.661 27.138 -15.743 111 2HB PRO 17 HB1 PRO 17 5.095 28.261 -14.499 112 1HG PRO 17 HG2 PRO 17 4.747 25.290 -14.675 113 2HG PRO 17 HG1 PRO 17 5.182 26.282 -13.271 114 1HD PRO 17 HD2 PRO 17 2.668 25.361 -13.683 115 2HD PRO 17 HD1 PRO 17 2.998 26.908 -12.879 116 H GLN 18 HN GLN 18 2.540 25.327 -16.379 117 HA GLN 18 HA GLN 18 3.832 25.074 -18.983 118 1HB GLN 18 HB2 GLN 18 2.659 22.758 -18.860 119 2HB GLN 18 HB1 GLN 18 4.050 23.067 -17.831 120 1HG GLN 18 HG1 GLN 18 2.584 23.516 -15.949 121 2HG GLN 18 HG2 GLN 18 1.172 23.266 -16.975 122 1HE2 GLN 18 HE21 GLN 18 1.294 21.088 -18.193 123 2HE2 GLN 18 HE22 GLN 18 1.696 19.721 -17.215 124 H TYR 19 HN TYR 19 2.830 25.589 -20.801 125 HA TYR 19 HA TYR 19 0.057 26.345 -20.795 126 1HB TYR 19 HB1 TYR 19 2.277 26.380 -22.804 127 2HB TYR 19 HB2 TYR 19 0.615 26.544 -23.364 128 HD1 TYR 19 HD1 TYR 19 3.294 28.111 -21.403 129 HD2 TYR 19 HD2 TYR 19 -0.660 28.539 -22.914 130 HE1 TYR 19 HE1 TYR 19 3.356 30.511 -20.869 131 HE2 TYR 19 HE2 TYR 19 -0.609 30.939 -22.385 132 HH TYR 19 HH TYR 19 2.065 32.648 -21.846 133 H LYS 20 HN LYS 20 -1.262 25.583 -22.813 134 HA LYS 20 HA LYS 20 -1.421 22.679 -22.611 135 1HB LYS 20 HB2 LYS 20 -3.304 24.822 -22.981 136 2HB LYS 20 HB1 LYS 20 -3.470 23.658 -24.288 137 1HG LYS 20 HG2 LYS 20 -3.783 21.865 -22.681 138 2HG LYS 20 HG1 LYS 20 -3.561 23.002 -21.351 139 1HD LYS 20 HD1 LYS 20 -5.770 23.302 -21.388 140 2HD LYS 20 HD2 LYS 20 -5.537 24.163 -22.911 141 1HE LYS 20 HE2 LYS 20 -7.240 22.424 -23.124 142 2HE LYS 20 HE1 LYS 20 -5.844 22.089 -24.149 143 1HZ LYS 20 HZ1 LYS 20 -6.531 20.088 -23.051 144 2HZ LYS 20 HZ2 LYS 20 -6.456 20.827 -21.531 145 3HZ LYS 20 HZ3 LYS 20 -5.038 20.563 -22.415 146 H TYR 21 HN TYR 21 -0.913 21.307 -24.209 147 HA TYR 21 HA TYR 21 0.295 22.388 -26.613 148 1HB TYR 21 HB2 TYR 21 0.003 19.525 -25.671 149 2HB TYR 21 HB1 TYR 21 0.949 20.050 -27.060 150 HD1 TYR 21 HD1 TYR 21 0.909 19.581 -23.494 151 HD2 TYR 21 HD2 TYR 21 2.950 21.535 -26.674 152 HE1 TYR 21 HE1 TYR 21 2.861 19.903 -22.034 153 HE2 TYR 21 HE2 TYR 21 4.908 21.863 -25.223 154 HH TYR 21 HH TYR 21 5.759 20.419 -22.924 155 H ALA 22 HN ALA 22 -1.296 23.124 -27.955 156 HA ALA 22 HA ALA 22 -3.717 21.699 -28.451 157 1HB ALA 22 HB1 ALA 22 -2.436 24.157 -29.494 158 2HB ALA 22 HB2 ALA 22 -4.069 23.900 -28.881 159 3HB ALA 22 HB3 ALA 22 -3.648 23.382 -30.514 160 H ALA 23 HN ALA 23 -3.322 19.649 -29.196 161 HA ALA 23 HA ALA 23 -1.457 19.076 -31.279 162 1HB ALA 23 HB1 ALA 23 -1.707 17.094 -30.304 163 2HB ALA 23 HB2 ALA 23 -3.229 16.947 -31.184 164 3HB ALA 23 HB3 ALA 23 -3.219 17.582 -29.539 165 H GLY 24 HN GLY 24 -1.737 19.689 -33.318 166 1HA GLY 24 HA2 GLY 24 -4.459 19.959 -34.378 167 2HA GLY 24 HA1 GLY 24 -3.004 20.637 -35.091 168 H VAL 25 HN VAL 25 -1.840 17.797 -34.466 169 HA VAL 25 HA VAL 25 -2.643 16.689 -37.056 170 HB VAL 25 HB VAL 25 -0.245 17.019 -36.732 171 1HG1 VAL 25 HG11 VAL 25 0.717 16.661 -34.768 172 2HG1 VAL 25 HG12 VAL 25 0.396 14.934 -34.925 173 3HG1 VAL 25 HG13 VAL 25 -0.786 15.983 -34.141 174 1HG2 VAL 25 HG21 VAL 25 0.490 14.637 -37.158 175 2HG2 VAL 25 HG22 VAL 25 -0.785 15.255 -38.209 176 3HG2 VAL 25 HG23 VAL 25 -1.187 14.167 -36.881 177 H ARG 26 HN ARG 26 -3.475 14.652 -37.298 178 HA ARG 26 HA ARG 26 -4.661 13.471 -34.928 179 1HB ARG 26 HB2 ARG 26 -5.852 13.807 -37.166 180 2HB ARG 26 HB1 ARG 26 -4.896 12.454 -37.757 181 1HG ARG 26 HG2 ARG 26 -5.972 11.497 -35.406 182 2HG ARG 26 HG1 ARG 26 -7.272 12.471 -36.096 183 1HD ARG 26 HD2 ARG 26 -7.610 11.042 -37.793 184 2HD ARG 26 HD1 ARG 26 -5.884 10.768 -38.032 185 HE ARG 26 HE ARG 26 -6.479 9.452 -35.714 186 1HH1 ARG 26 HH11 ARG 26 -7.673 9.352 -38.985 187 2HH1 ARG 26 HH12 ARG 26 -8.101 7.675 -38.914 188 1HH2 ARG 26 HH21 ARG 26 -7.041 7.245 -35.610 189 2HH2 ARG 26 HH22 ARG 26 -7.742 6.477 -36.996 190 H ASN 27 HN ASN 27 -4.516 11.177 -34.476 191 HA ASN 27 HA ASN 27 -1.810 10.177 -34.975 192 1HB ASN 27 HB1 ASN 27 -3.469 8.635 -33.122 193 2HB ASN 27 HB2 ASN 27 -1.861 9.313 -32.894 194 1HD2 ASN 27 HD21 ASN 27 -1.885 11.782 -32.711 195 2HD2 ASN 27 HD22 ASN 27 -3.090 12.441 -31.663 196 HA PRO 28 HA PRO 28 -3.531 7.403 -38.056 197 1HB PRO 28 HB2 PRO 28 -0.911 6.062 -37.660 198 2HB PRO 28 HB1 PRO 28 -1.672 6.630 -39.149 199 1HG PRO 28 HG1 PRO 28 0.376 7.955 -38.077 200 2HG PRO 28 HG2 PRO 28 -0.981 8.821 -38.822 201 1HD PRO 28 HD2 PRO 28 -0.375 8.376 -35.926 202 2HD PRO 28 HD1 PRO 28 -1.015 9.822 -36.734 203 H GLN 29 HN GLN 29 -1.343 5.745 -35.780 204 HA GLN 29 HA GLN 29 -3.382 3.671 -35.423 205 1HB GLN 29 HB2 GLN 29 -1.554 2.305 -34.504 206 2HB GLN 29 HB1 GLN 29 -1.178 2.890 -36.120 207 1HG GLN 29 HG2 GLN 29 0.614 4.004 -35.416 208 2HG GLN 29 HG1 GLN 29 -0.241 4.678 -34.029 209 1HE2 GLN 29 HE21 GLN 29 2.409 3.849 -33.929 210 2HE2 GLN 29 HE22 GLN 29 2.526 2.481 -32.880 211 H GLN 30 HN GLN 30 -2.637 2.607 -33.009 212 HA GLN 30 HA GLN 30 -3.602 4.665 -31.172 213 1HB GLN 30 HB2 GLN 30 -3.233 1.951 -30.113 214 2HB GLN 30 HB1 GLN 30 -4.630 3.013 -30.025 215 1HG GLN 30 HG2 GLN 30 -5.657 1.867 -31.608 216 2HG GLN 30 HG1 GLN 30 -4.303 2.101 -32.712 217 1HE2 GLN 30 HE21 GLN 30 -4.950 0.227 -29.764 218 2HE2 GLN 30 HE22 GLN 30 -4.323 -1.263 -30.372 219 H HIS 31 HN HIS 31 -1.651 1.895 -30.233 220 HA HIS 31 HA HIS 31 0.231 1.717 -28.974 221 1HB HIS 31 HB2 HIS 31 0.971 2.938 -31.232 222 2HB HIS 31 HB1 HIS 31 1.368 4.227 -30.099 223 HD2 HIS 31 HD2 HIS 31 3.994 3.316 -31.247 224 HE1 HIS 31 HE1 HIS 31 4.250 0.394 -28.195 225 HE2 HIS 31 HE2 HIS 31 5.539 1.669 -29.969 226 H LEU 32 HN LEU 32 -2.017 3.596 -28.135 227 HA LEU 32 HA LEU 32 -0.534 5.363 -26.329 228 1HB LEU 32 HB1 LEU 32 -2.905 5.675 -27.790 229 2HB LEU 32 HB2 LEU 32 -3.410 5.543 -26.117 230 HG LEU 32 HG LEU 32 -1.158 7.370 -26.488 231 1HD1 LEU 32 HD11 LEU 32 -1.985 8.113 -28.492 232 2HD1 LEU 32 HD12 LEU 32 -2.892 9.126 -27.369 233 3HD1 LEU 32 HD13 LEU 32 -3.651 7.704 -28.084 234 1HD2 LEU 32 HD21 LEU 32 -2.032 8.160 -24.610 235 2HD2 LEU 32 HD22 LEU 32 -3.305 6.946 -24.722 236 3HD2 LEU 32 HD23 LEU 32 -3.544 8.541 -25.433 237 H ASN 33 HN ASN 33 -1.813 5.636 -24.135 238 HA ASN 33 HA ASN 33 -1.761 3.006 -22.899 239 1HB ASN 33 HB1 ASN 33 -2.225 4.613 -20.816 240 2HB ASN 33 HB2 ASN 33 -0.613 4.404 -21.493 241 1HD2 ASN 33 HD21 ASN 33 -3.278 6.542 -21.054 242 2HD2 ASN 33 HD22 ASN 33 -2.521 7.960 -21.686 243 H ALA 34 HN ALA 34 -3.447 3.191 -20.805 244 HA ALA 34 HA ALA 34 -6.008 2.792 -22.058 245 1HB ALA 34 HB1 ALA 34 -6.741 2.137 -19.786 246 2HB ALA 34 HB2 ALA 34 -5.144 2.574 -19.179 247 3HB ALA 34 HB3 ALA 34 -5.316 1.257 -20.339 248 H GLN 35 HN GLN 35 -7.476 4.324 -22.362 249 HA GLN 35 HA GLN 35 -7.198 6.904 -21.116 250 1HB GLN 35 HB1 GLN 35 -8.222 6.045 -23.517 251 2HB GLN 35 HB2 GLN 35 -9.677 6.419 -22.603 252 1HG GLN 35 HG1 GLN 35 -8.144 8.599 -22.080 253 2HG GLN 35 HG2 GLN 35 -7.640 8.199 -23.722 254 1HE2 GLN 35 HE21 GLN 35 -9.382 10.343 -22.395 255 2HE2 GLN 35 HE22 GLN 35 -10.789 10.390 -23.395 256 HA PRO 36 HA PRO 36 -11.540 5.599 -19.239 257 1HB PRO 36 HB2 PRO 36 -11.174 2.660 -19.146 258 2HB PRO 36 HB1 PRO 36 -12.618 3.604 -19.526 259 1HG PRO 36 HG2 PRO 36 -11.270 2.323 -21.441 260 2HG PRO 36 HG1 PRO 36 -11.995 3.914 -21.735 261 1HD PRO 36 HD2 PRO 36 -9.138 3.197 -21.212 262 2HD PRO 36 HD1 PRO 36 -9.812 4.389 -22.341 263 H GLN 37 HN GLN 37 -11.604 5.786 -17.075 264 HA GLN 37 HA GLN 37 -9.264 4.925 -15.561 265 1HB GLN 37 HB2 GLN 37 -10.357 6.309 -13.727 266 2HB GLN 37 HB1 GLN 37 -9.812 7.186 -15.150 267 1HG GLN 37 HG1 GLN 37 -11.932 7.667 -15.841 268 2HG GLN 37 HG2 GLN 37 -12.627 6.242 -15.069 269 1HE2 GLN 37 HE21 GLN 37 -14.256 7.450 -14.104 270 2HE2 GLN 37 HE22 GLN 37 -13.954 8.495 -12.762 271 H VAL 38 HN VAL 38 -9.307 3.489 -13.891 272 HA VAL 38 HA VAL 38 -11.651 1.770 -13.745 273 HB VAL 38 HB VAL 38 -10.096 0.406 -12.207 274 1HG1 VAL 38 HG21 VAL 38 -10.200 0.690 -15.090 275 2HG1 VAL 38 HG22 VAL 38 -10.176 -0.769 -14.099 276 3HG1 VAL 38 HG23 VAL 38 -8.663 0.022 -14.543 277 1HG2 VAL 38 HG11 VAL 38 -8.447 2.684 -12.707 278 2HG2 VAL 38 HG12 VAL 38 -7.676 1.247 -13.381 279 3HG2 VAL 38 HG13 VAL 38 -8.130 1.287 -11.677 280 H THR 39 HN THR 39 -13.163 2.098 -12.269 281 HA THR 39 HA THR 39 -12.446 3.479 -9.775 282 HB THR 39 HB THR 39 -15.275 3.011 -10.649 283 HG1 THR 39 HG1 THR 39 -13.854 5.290 -11.482 284 1HG2 THR 39 HG21 THR 39 -15.553 5.295 -9.667 285 2HG2 THR 39 HG22 THR 39 -13.893 5.165 -9.085 286 3HG2 THR 39 HG23 THR 39 -15.116 4.023 -8.526 287 H MET 40 HN MET 40 -14.281 0.719 -11.035 288 HA MET 40 HA MET 40 -14.599 -0.365 -8.351 289 1HB MET 40 HB1 MET 40 -16.126 -0.492 -10.678 290 2HB MET 40 HB2 MET 40 -15.441 -2.104 -10.523 291 1HG MET 40 HG1 MET 40 -17.369 -2.349 -9.335 292 2HG MET 40 HG2 MET 40 -16.255 -1.888 -8.049 293 1HE MET 40 HE1 MET 40 -16.616 -0.235 -6.476 294 2HE MET 40 HE2 MET 40 -18.225 -0.942 -6.326 295 3HE MET 40 HE3 MET 40 -18.032 0.810 -6.368 296 H GLN 41 HN GLN 41 -14.564 -3.144 -9.516 297 HA GLN 41 HA GLN 41 -13.128 -4.901 -9.589 298 1HB GLN 41 HB2 GLN 41 -11.407 -2.852 -10.996 299 2HB GLN 41 HB1 GLN 41 -11.029 -4.566 -10.914 300 1HG GLN 41 HG1 GLN 41 -13.661 -3.672 -11.998 301 2HG GLN 41 HG2 GLN 41 -12.216 -3.600 -13.004 302 1HE2 GLN 41 HE21 GLN 41 -10.878 -5.712 -12.832 303 2HE2 GLN 41 HE22 GLN 41 -11.787 -7.169 -13.021 304 H GLN 42 HN GLN 42 -10.133 -4.539 -9.536 305 HA GLN 42 HA GLN 42 -9.708 -4.939 -6.819 306 1HB GLN 42 HB2 GLN 42 -7.274 -4.396 -7.397 307 2HB GLN 42 HB1 GLN 42 -8.030 -5.725 -8.264 308 1HG GLN 42 HG2 GLN 42 -7.830 -4.709 -10.239 309 2HG GLN 42 HG1 GLN 42 -8.318 -3.142 -9.593 310 1HE2 GLN 42 HE22 GLN 42 -5.722 -5.126 -10.558 311 2HE2 GLN 42 HE21 GLN 42 -4.439 -4.030 -10.189 312 HA PRO 43 HA PRO 43 -10.264 -0.827 -5.172 313 1HB PRO 43 HB1 PRO 43 -8.616 -1.967 -2.972 314 2HB PRO 43 HB2 PRO 43 -10.174 -1.139 -2.898 315 1HG PRO 43 HG2 PRO 43 -10.031 -3.776 -2.592 316 2HG PRO 43 HG1 PRO 43 -11.360 -3.042 -3.510 317 1HD PRO 43 HD2 PRO 43 -8.920 -4.459 -4.505 318 2HD PRO 43 HD1 PRO 43 -10.583 -4.504 -5.125 319 H ALA 44 HN ALA 44 -9.101 0.848 -5.841 320 HA ALA 44 HA ALA 44 -6.233 0.642 -6.184 321 1HB ALA 44 HB1 ALA 44 -8.043 1.872 -7.674 322 2HB ALA 44 HB2 ALA 44 -6.382 2.457 -7.554 323 3HB ALA 44 HB3 ALA 44 -7.656 3.214 -6.598 324 H VAL 45 HN VAL 45 -4.794 1.206 -4.696 325 HA VAL 45 HA VAL 45 -5.637 2.526 -2.269 326 HB VAL 45 HB VAL 45 -3.166 2.275 -1.669 327 1HG1 VAL 45 HG11 VAL 45 -3.995 0.531 -0.577 328 2HG1 VAL 45 HG12 VAL 45 -3.782 -0.460 -2.021 329 3HG1 VAL 45 HG13 VAL 45 -5.303 0.392 -1.752 330 1HG2 VAL 45 HG21 VAL 45 -2.087 2.060 -3.733 331 2HG2 VAL 45 HG22 VAL 45 -3.239 0.858 -4.313 332 3HG2 VAL 45 HG23 VAL 45 -2.072 0.427 -3.064 333 H HIS 46 HN HIS 46 -4.930 3.717 -5.199 334 HA HIS 46 HA HIS 46 -3.204 5.897 -4.362 335 1HB HIS 46 HB2 HIS 46 -3.313 4.651 -6.701 336 2HB HIS 46 HB1 HIS 46 -4.548 5.862 -7.030 337 HD2 HIS 46 HD2 HIS 46 -3.521 8.595 -6.535 338 HE1 HIS 46 HE1 HIS 46 0.363 7.365 -7.686 339 HE2 HIS 46 HE2 HIS 46 -1.149 9.357 -7.265 340 H VAL 47 HN VAL 47 -3.863 7.879 -3.797 341 HA VAL 47 HA VAL 47 -6.745 8.448 -3.943 342 HB VAL 47 HB VAL 47 -4.748 9.877 -2.195 343 1HG1 VAL 47 HG21 VAL 47 -7.353 9.756 -1.097 344 2HG1 VAL 47 HG22 VAL 47 -7.511 10.240 -2.786 345 3HG1 VAL 47 HG23 VAL 47 -6.481 11.169 -1.695 346 1HG2 VAL 47 HG11 VAL 47 -4.665 8.164 -0.784 347 2HG2 VAL 47 HG12 VAL 47 -5.542 7.187 -1.963 348 3HG2 VAL 47 HG13 VAL 47 -6.426 8.082 -0.727 349 H GLN 48 HN GLN 48 -7.484 10.105 -5.118 350 HA GLN 48 HA GLN 48 -5.604 11.619 -6.715 351 1HB GLN 48 HB2 GLN 48 -8.616 11.851 -6.684 352 2HB GLN 48 HB1 GLN 48 -7.518 12.372 -7.956 353 1HG GLN 48 HG1 GLN 48 -7.392 9.518 -7.253 354 2HG GLN 48 HG2 GLN 48 -8.895 10.064 -7.998 355 1HE2 GLN 48 HE22 GLN 48 -8.805 9.400 -10.029 356 2HE2 GLN 48 HE21 GLN 48 -7.497 9.681 -11.124 357 H GLY 49 HN GLY 49 -6.928 11.988 -3.699 358 1HA GLY 49 HA1 GLY 49 -7.207 14.893 -3.856 359 2HA GLY 49 HA2 GLY 49 -7.594 13.887 -2.469 360 H GLN 50 HN GLN 50 -5.997 13.360 -0.991 361 HA GLN 50 HA GLN 50 -3.544 14.962 -1.231 362 1HB GLN 50 HB1 GLN 50 -3.470 14.393 1.329 363 2HB GLN 50 HB2 GLN 50 -4.529 15.664 0.736 364 1HG GLN 50 HG1 GLN 50 -6.432 14.445 1.097 365 2HG GLN 50 HG2 GLN 50 -5.598 12.897 0.955 366 1HE2 GLN 50 HE21 GLN 50 -6.322 12.037 2.846 367 2HE2 GLN 50 HE22 GLN 50 -5.876 12.638 4.403 368 H GLU 51 HN GLU 51 -1.536 14.059 -0.938 369 HA GLU 51 HA GLU 51 -1.259 11.305 -1.578 370 1HB GLU 51 HB2 GLU 51 0.513 13.610 -1.170 371 2HB GLU 51 HB1 GLU 51 1.227 12.072 -0.705 372 1HG GLU 51 HG1 GLU 51 1.275 11.285 -2.835 373 2HG GLU 51 HG2 GLU 51 -0.144 12.209 -3.327 374 HA PRO 52 HA PRO 52 -1.751 9.739 2.592 375 1HB PRO 52 HB1 PRO 52 -0.588 7.300 1.376 376 2HB PRO 52 HB2 PRO 52 -2.107 7.506 2.252 377 1HG PRO 52 HG2 PRO 52 -2.085 7.160 -0.393 378 2HG PRO 52 HG1 PRO 52 -3.240 8.264 0.378 379 1HD PRO 52 HD2 PRO 52 -0.713 8.890 -1.101 380 2HD PRO 52 HD1 PRO 52 -2.275 9.734 -1.131 381 H LEU 53 HN LEU 53 -0.377 8.758 4.242 382 HA LEU 53 HA LEU 53 2.290 9.815 4.150 383 1HB LEU 53 HB2 LEU 53 0.506 9.305 6.156 384 2HB LEU 53 HB1 LEU 53 1.616 7.958 6.328 385 HG LEU 53 HG LEU 53 3.186 10.308 6.042 386 1HD1 LEU 53 HD21 LEU 53 1.740 11.875 6.782 387 2HD1 LEU 53 HD22 LEU 53 2.205 11.233 8.357 388 3HD1 LEU 53 HD23 LEU 53 0.708 10.698 7.593 389 1HD2 LEU 53 HD11 LEU 53 4.080 9.662 8.138 390 2HD2 LEU 53 HD12 LEU 53 3.655 8.173 7.292 391 3HD2 LEU 53 HD13 LEU 53 2.610 8.787 8.574 392 H THR 54 HN THR 54 4.230 8.677 4.255 393 HA THR 54 HA THR 54 4.407 5.857 4.302 394 HB THR 54 HB THR 54 5.505 6.293 1.744 395 HG1 THR 54 HG1 THR 54 4.135 8.114 1.567 396 1HG2 THR 54 HG21 THR 54 4.693 4.195 1.936 397 2HG2 THR 54 HG22 THR 54 3.317 4.935 1.115 398 3HG2 THR 54 HG23 THR 54 3.281 4.705 2.864 399 H ALA 55 HN ALA 55 6.780 5.549 2.809 400 HA ALA 55 HA ALA 55 8.686 6.383 4.651 401 1HB ALA 55 HB1 ALA 55 8.927 4.504 3.050 402 2HB ALA 55 HB2 ALA 55 10.339 5.557 3.144 403 3HB ALA 55 HB3 ALA 55 9.231 5.687 1.777 404 H SER 56 HN SER 56 7.574 7.917 1.688 405 HA SER 56 HA SER 56 9.595 9.851 1.431 406 1HB SER 56 HB1 SER 56 6.677 9.936 0.632 407 2HB SER 56 HB2 SER 56 7.863 11.154 0.160 408 HG SER 56 HG SER 56 7.497 8.583 -0.771 409 H MET 57 HN MET 57 6.446 9.991 3.070 410 HA MET 57 HA MET 57 6.644 12.597 4.068 411 1HB MET 57 HB1 MET 57 5.190 10.144 5.043 412 2HB MET 57 HB2 MET 57 5.090 11.673 5.902 413 1HG MET 57 HG1 MET 57 3.452 10.825 3.858 414 2HG MET 57 HG2 MET 57 3.579 12.466 4.489 415 1HE MET 57 HE1 MET 57 5.284 10.236 1.250 416 2HE MET 57 HE2 MET 57 3.981 11.100 0.434 417 3HE MET 57 HE3 MET 57 3.642 10.164 1.890 418 H LEU 58 HN LEU 58 7.709 9.507 5.392 419 HA LEU 58 HA LEU 58 8.571 10.368 7.908 420 1HB LEU 58 HB1 LEU 58 9.432 8.132 6.091 421 2HB LEU 58 HB2 LEU 58 10.206 8.384 7.642 422 HG LEU 58 HG LEU 58 8.582 7.295 8.712 423 1HD1 LEU 58 HD11 LEU 58 7.184 9.326 8.642 424 2HD1 LEU 58 HD12 LEU 58 6.233 7.840 8.588 425 3HD1 LEU 58 HD13 LEU 58 6.496 8.774 7.114 426 1HD2 LEU 58 HD21 LEU 58 8.785 6.135 6.377 427 2HD2 LEU 58 HD22 LEU 58 7.126 6.708 6.180 428 3HD2 LEU 58 HD23 LEU 58 7.535 5.639 7.521 429 H ALA 59 HN ALA 59 10.288 10.158 4.827 430 HA ALA 59 HA ALA 59 12.816 10.960 5.754 431 1HB ALA 59 HB1 ALA 59 13.279 10.302 3.686 432 2HB ALA 59 HB2 ALA 59 12.606 11.824 3.100 433 3HB ALA 59 HB3 ALA 59 11.578 10.396 3.225 434 H SER 60 HN SER 60 9.948 12.735 5.336 435 HA SER 60 HA SER 60 11.149 15.279 4.768 436 1HB SER 60 HB1 SER 60 8.764 14.634 4.206 437 2HB SER 60 HB2 SER 60 8.398 14.791 5.924 438 HG SER 60 HG SER 60 8.116 16.694 4.403 439 H ALA 61 HN ALA 61 10.871 13.361 7.523 440 HA ALA 61 HA ALA 61 11.656 15.626 9.220 441 1HB ALA 61 HB1 ALA 61 10.036 15.317 10.747 442 2HB ALA 61 HB2 ALA 61 10.084 13.560 10.591 443 3HB ALA 61 HB3 ALA 61 9.181 14.525 9.423 444 HA PRO 62 HA PRO 62 14.507 11.819 9.255 445 1HB PRO 62 HB1 PRO 62 16.493 14.027 9.106 446 2HB PRO 62 HB2 PRO 62 16.475 12.464 8.281 447 1HG PRO 62 HG2 PRO 62 15.855 14.706 6.975 448 2HG PRO 62 HG1 PRO 62 14.990 13.191 6.655 449 1HD PRO 62 HD1 PRO 62 14.116 15.583 8.216 450 2HD PRO 62 HD2 PRO 62 13.169 14.514 7.163 451 HA PRO 63 HA PRO 63 16.193 13.543 13.284 452 1HB PRO 63 HB1 PRO 63 16.704 16.121 13.682 453 2HB PRO 63 HB2 PRO 63 17.680 15.183 12.546 454 1HG PRO 63 HG2 PRO 63 15.575 17.209 12.010 455 2HG PRO 63 HG1 PRO 63 17.003 16.789 11.050 456 1HD PRO 63 HD1 PRO 63 14.319 15.880 10.678 457 2HD PRO 63 HD2 PRO 63 15.765 15.391 9.773 458 H GLN 64 HN GLN 64 13.241 14.359 12.254 459 HA GLN 64 HA GLN 64 12.405 15.502 14.835 460 1HB GLN 64 HB2 GLN 64 10.841 15.627 12.259 461 2HB GLN 64 HB1 GLN 64 10.558 16.538 13.736 462 1HG GLN 64 HG2 GLN 64 13.178 16.871 12.390 463 2HG GLN 64 HG1 GLN 64 11.759 17.594 11.633 464 1HE2 GLN 64 HE22 GLN 64 14.113 18.822 12.908 465 2HE2 GLN 64 HE21 GLN 64 13.484 19.867 14.131 466 H GLU 65 HN GLU 65 10.158 14.163 12.512 467 HA GLU 65 HA GLU 65 9.442 12.129 14.506 468 1HB GLU 65 HB1 GLU 65 7.517 12.544 12.358 469 2HB GLU 65 HB2 GLU 65 7.280 12.580 14.100 470 1HG GLU 65 HG2 GLU 65 8.587 14.915 13.725 471 2HG GLU 65 HG1 GLU 65 7.717 14.771 12.199 472 H GLN 66 HN GLN 66 11.596 11.619 12.691 473 HA GLN 66 HA GLN 66 10.740 10.077 10.475 474 1HB GLN 66 HB1 GLN 66 13.173 10.962 11.429 475 2HB GLN 66 HB2 GLN 66 13.268 9.220 11.662 476 1HG GLN 66 HG1 GLN 66 12.239 9.439 9.129 477 2HG GLN 66 HG2 GLN 66 13.364 10.792 9.218 478 1HE2 GLN 66 HE22 GLN 66 15.547 10.402 9.381 479 2HE2 GLN 66 HE21 GLN 66 16.240 8.835 9.155 480 H LYS 67 HN LYS 67 11.367 9.334 13.841 481 HA LYS 67 HA LYS 67 10.387 6.595 13.368 482 1HB LYS 67 HB1 LYS 67 11.893 7.076 15.854 483 2HB LYS 67 HB2 LYS 67 11.967 5.721 14.736 484 1HG LYS 67 HG2 LYS 67 13.933 6.494 14.072 485 2HG LYS 67 HG1 LYS 67 13.078 7.851 13.335 486 1HD LYS 67 HD1 LYS 67 13.488 9.255 15.142 487 2HD LYS 67 HD2 LYS 67 13.798 7.909 16.241 488 1HE LYS 67 HE2 LYS 67 15.580 8.544 13.904 489 2HE LYS 67 HE1 LYS 67 15.815 9.254 15.501 490 1HZ LYS 67 HZ1 LYS 67 16.058 7.037 16.418 491 2HZ LYS 67 HZ2 LYS 67 17.188 7.290 15.184 492 3HZ LYS 67 HZ3 LYS 67 15.815 6.347 14.892 493 H GLN 68 HN GLN 68 8.650 8.760 13.770 494 HA GLN 68 HA GLN 68 7.470 7.998 16.350 495 1HB GLN 68 HB1 GLN 68 7.918 10.790 15.317 496 2HB GLN 68 HB2 GLN 68 6.716 10.424 16.547 497 1HG GLN 68 HG2 GLN 68 8.251 10.414 18.135 498 2HG GLN 68 HG1 GLN 68 9.226 9.245 17.247 499 1HE2 GLN 68 HE21 GLN 68 8.442 12.691 17.363 500 2HE2 GLN 68 HE22 GLN 68 10.011 13.242 16.896 501 H MET 69 HN MET 69 6.774 10.009 13.487 502 HA MET 69 HA MET 69 3.979 9.366 13.626 503 1HB MET 69 HB2 MET 69 3.764 10.761 11.631 504 2HB MET 69 HB1 MET 69 4.711 11.569 12.874 505 1HG MET 69 HG2 MET 69 6.654 11.443 11.678 506 2HG MET 69 HG1 MET 69 6.143 10.007 10.791 507 1HE MET 69 HE1 MET 69 7.462 13.049 9.596 508 2HE MET 69 HE2 MET 69 6.767 12.692 8.014 509 3HE MET 69 HE3 MET 69 7.486 11.399 8.972 510 H LEU 70 HN LEU 70 6.256 7.335 12.868 511 HA LEU 70 HA LEU 70 5.438 6.435 10.264 512 1HB LEU 70 HB1 LEU 70 6.696 4.267 11.397 513 2HB LEU 70 HB2 LEU 70 7.446 5.489 10.404 514 HG LEU 70 HG LEU 70 8.269 6.669 12.334 515 1HD1 LEU 70 HD21 LEU 70 6.204 5.209 13.708 516 2HD1 LEU 70 HD22 LEU 70 7.141 6.603 14.246 517 3HD1 LEU 70 HD23 LEU 70 7.765 4.972 14.494 518 1HD2 LEU 70 HD11 LEU 70 8.811 3.839 11.873 519 2HD2 LEU 70 HD12 LEU 70 9.304 4.411 13.466 520 3HD2 LEU 70 HD13 LEU 70 9.924 5.201 12.016 521 H GLY 71 HN GLY 71 4.778 5.469 13.601 522 1HA GLY 71 HA2 GLY 71 2.571 3.837 12.548 523 2HA GLY 71 HA1 GLY 71 3.636 3.180 13.774 524 H GLU 72 HN GLU 72 2.801 6.543 13.870 525 HA GLU 72 HA GLU 72 0.768 6.032 15.919 526 1HB GLU 72 HB1 GLU 72 3.072 7.966 16.247 527 2HB GLU 72 HB2 GLU 72 1.762 7.720 17.393 528 1HG GLU 72 HG1 GLU 72 2.913 5.195 16.901 529 2HG GLU 72 HG2 GLU 72 4.235 6.330 17.163 530 H ARG 73 HN ARG 73 1.700 7.653 13.161 531 HA ARG 73 HA ARG 73 -0.428 9.648 13.559 532 1HB ARG 73 HB1 ARG 73 2.103 10.407 13.442 533 2HB ARG 73 HB2 ARG 73 1.844 10.228 11.712 534 1HG ARG 73 HG1 ARG 73 -0.192 11.766 13.198 535 2HG ARG 73 HG2 ARG 73 1.402 12.505 13.032 536 1HD ARG 73 HD2 ARG 73 1.282 12.164 10.598 537 2HD ARG 73 HD1 ARG 73 -0.337 11.489 10.788 538 HE ARG 73 HE ARG 73 -0.054 14.123 11.897 539 1HH1 ARG 73 HH21 ARG 73 -0.704 12.299 9.000 540 2HH1 ARG 73 HH22 ARG 73 -1.579 13.583 8.234 541 1HH2 ARG 73 HH11 ARG 73 -1.206 15.818 10.896 542 2HH2 ARG 73 HH12 ARG 73 -1.865 15.582 9.312 543 H LEU 74 HN LEU 74 0.847 7.117 11.683 544 HA LEU 74 HA LEU 74 -0.389 7.829 9.198 545 1HB LEU 74 HB1 LEU 74 1.283 5.690 10.218 546 2HB LEU 74 HB2 LEU 74 -0.003 5.074 9.199 547 HG LEU 74 HG LEU 74 1.461 7.390 8.134 548 1HD1 LEU 74 HD11 LEU 74 2.816 4.737 7.975 549 2HD1 LEU 74 HD12 LEU 74 3.124 5.816 9.337 550 3HD1 LEU 74 HD13 LEU 74 3.469 6.351 7.691 551 1HD2 LEU 74 HD21 LEU 74 0.425 4.775 7.074 552 2HD2 LEU 74 HD22 LEU 74 1.369 5.902 6.099 553 3HD2 LEU 74 HD23 LEU 74 -0.188 6.400 6.762 554 H PHE 75 HN PHE 75 -1.595 6.718 12.109 555 HA PHE 75 HA PHE 75 -3.424 4.768 11.482 556 1HB PHE 75 HB1 PHE 75 -3.147 5.389 13.768 557 2HB PHE 75 HB2 PHE 75 -3.673 7.040 13.451 558 HD1 PHE 75 HD1 PHE 75 -5.542 7.303 14.799 559 HD2 PHE 75 HD2 PHE 75 -5.215 3.854 12.316 560 HE1 PHE 75 HE1 PHE 75 -7.858 6.688 15.360 561 HE2 PHE 75 HE2 PHE 75 -7.536 3.237 12.877 562 HZ PHE 75 HZ PHE 75 -8.856 4.653 14.399 563 HA PRO 76 HA PRO 76 -6.747 8.072 10.225 564 1HB PRO 76 HB1 PRO 76 -5.149 10.456 9.577 565 2HB PRO 76 HB2 PRO 76 -6.636 10.325 10.520 566 1HG PRO 76 HG1 PRO 76 -4.271 10.855 11.677 567 2HG PRO 76 HG2 PRO 76 -5.510 9.875 12.483 568 1HD PRO 76 HD1 PRO 76 -3.027 8.997 11.057 569 2HD PRO 76 HD2 PRO 76 -3.734 8.388 12.568 570 H LEU 77 HN LEU 77 -3.690 7.481 8.885 571 HA LEU 77 HA LEU 77 -4.482 8.200 6.177 572 1HB LEU 77 HB1 LEU 77 -1.913 7.254 7.413 573 2HB LEU 77 HB2 LEU 77 -2.129 7.263 5.679 574 HG LEU 77 HG LEU 77 -1.040 9.264 6.050 575 1HD1 LEU 77 HD21 LEU 77 -2.467 10.857 5.277 576 2HD1 LEU 77 HD22 LEU 77 -3.734 10.445 6.433 577 3HD1 LEU 77 HD23 LEU 77 -3.472 9.431 5.013 578 1HD2 LEU 77 HD11 LEU 77 -1.027 10.461 7.968 579 2HD2 LEU 77 HD12 LEU 77 -1.587 8.920 8.618 580 3HD2 LEU 77 HD13 LEU 77 -2.746 10.204 8.274 581 H ILE 78 HN ILE 78 -3.928 5.334 8.155 582 HA ILE 78 HA ILE 78 -3.953 3.473 6.020 583 HB ILE 78 HB ILE 78 -4.966 2.742 8.727 584 1HG1 ILE 78 HG12 ILE 78 -2.943 4.159 9.046 585 2HG1 ILE 78 HG11 ILE 78 -2.711 2.493 9.563 586 1HG2 ILE 78 HG21 ILE 78 -4.872 0.732 7.812 587 2HG2 ILE 78 HG22 ILE 78 -3.119 0.898 7.702 588 3HG2 ILE 78 HG23 ILE 78 -4.139 1.390 6.348 589 1HD1 ILE 78 HD11 ILE 78 -1.056 3.937 7.917 590 2HD1 ILE 78 HD12 ILE 78 -1.946 2.899 6.803 591 3HD1 ILE 78 HD13 ILE 78 -1.045 2.187 8.141 592 H GLN 79 HN GLN 79 -6.457 4.856 8.058 593 HA GLN 79 HA GLN 79 -8.626 3.271 7.420 594 1HB GLN 79 HB1 GLN 79 -8.220 6.052 8.310 595 2HB GLN 79 HB2 GLN 79 -9.744 5.772 7.482 596 1HG GLN 79 HG1 GLN 79 -10.455 4.214 9.081 597 2HG GLN 79 HG2 GLN 79 -8.832 4.034 9.748 598 1HE2 GLN 79 HE21 GLN 79 -8.029 5.600 11.138 599 2HE2 GLN 79 HE22 GLN 79 -9.048 6.775 11.891 600 H ALA 80 HN ALA 80 -6.788 5.305 5.434 601 HA ALA 80 HA ALA 80 -8.789 5.750 3.394 602 1HB ALA 80 HB1 ALA 80 -7.236 7.102 2.343 603 2HB ALA 80 HB2 ALA 80 -5.861 6.191 2.973 604 3HB ALA 80 HB3 ALA 80 -6.773 7.266 4.036 605 H MET 81 HN MET 81 -5.901 3.741 3.844 606 HA MET 81 HA MET 81 -5.991 2.583 1.226 607 1HB MET 81 HB1 MET 81 -4.718 1.169 3.537 608 2HB MET 81 HB2 MET 81 -4.166 1.295 1.876 609 1HG MET 81 HG2 MET 81 -2.997 3.154 2.276 610 2HG MET 81 HG1 MET 81 -4.226 3.837 3.329 611 1HE MET 81 HE1 MET 81 -1.000 2.735 2.841 612 2HE MET 81 HE2 MET 81 -1.023 1.107 3.531 613 3HE MET 81 HE3 MET 81 -0.282 2.440 4.425 614 H HIS 82 HN HIS 82 -7.153 1.705 4.398 615 HA HIS 82 HA HIS 82 -8.607 -0.582 3.246 616 1HB HIS 82 HB2 HIS 82 -7.781 -0.358 6.135 617 2HB HIS 82 HB1 HIS 82 -8.162 -1.810 5.226 618 HD2 HIS 82 HD2 HIS 82 -6.077 -1.445 2.767 619 HE1 HIS 82 HE1 HIS 82 -3.233 -1.285 5.872 620 HE2 HIS 82 HE2 HIS 82 -3.571 -1.644 3.386 621 HA PRO 83 HA PRO 83 -12.382 1.307 4.590 622 1HB PRO 83 HB2 PRO 83 -13.802 -0.883 5.427 623 2HB PRO 83 HB1 PRO 83 -13.595 -0.431 3.732 624 1HG PRO 83 HG1 PRO 83 -12.115 -2.469 5.347 625 2HG PRO 83 HG2 PRO 83 -12.706 -2.576 3.678 626 1HD PRO 83 HD1 PRO 83 -10.119 -2.084 4.242 627 2HD PRO 83 HD2 PRO 83 -10.926 -1.356 2.839 628 H THR 84 HN THR 84 -11.027 2.229 6.391 629 HA THR 84 HA THR 84 -10.602 2.686 8.575 630 HB THR 84 HB THR 84 -13.211 1.438 9.346 631 HG1 THR 84 HG1 THR 84 -13.430 3.922 8.200 632 1HG2 THR 84 HG21 THR 84 -13.080 4.163 10.003 633 2HG2 THR 84 HG22 THR 84 -11.511 3.462 10.398 634 3HG2 THR 84 HG23 THR 84 -12.983 2.772 11.082 635 H LEU 85 HN LEU 85 -9.821 0.038 7.568 636 HA LEU 85 HA LEU 85 -10.254 -1.834 9.708 637 1HB LEU 85 HB1 LEU 85 -9.211 -1.890 7.029 638 2HB LEU 85 HB2 LEU 85 -8.090 -2.686 8.115 639 HG LEU 85 HG LEU 85 -9.617 -4.304 7.140 640 1HD1 LEU 85 HD11 LEU 85 -10.842 -4.513 9.697 641 2HD1 LEU 85 HD12 LEU 85 -9.198 -3.911 9.910 642 3HD1 LEU 85 HD13 LEU 85 -9.477 -5.422 9.046 643 1HD2 LEU 85 HD21 LEU 85 -11.806 -2.659 8.401 644 2HD2 LEU 85 HD22 LEU 85 -12.017 -4.227 7.623 645 3HD2 LEU 85 HD23 LEU 85 -11.494 -2.834 6.675 646 H ALA 86 HN ALA 86 -8.413 0.843 9.573 647 HA ALA 86 HA ALA 86 -5.892 -0.029 10.539 648 1HB ALA 86 HB1 ALA 86 -7.132 2.656 11.094 649 2HB ALA 86 HB2 ALA 86 -6.460 2.221 9.522 650 3HB ALA 86 HB3 ALA 86 -5.423 2.245 10.947 651 H GLY 87 HN GLY 87 -5.978 1.971 12.833 652 1HA GLY 87 HA2 GLY 87 -6.610 2.040 15.079 653 2HA GLY 87 HA1 GLY 87 -7.665 0.661 14.799 654 H LYS 88 HN LYS 88 -4.891 -0.223 13.418 655 HA LYS 88 HA LYS 88 -3.240 -0.853 15.629 656 1HB LYS 88 HB1 LYS 88 -4.968 -2.446 16.164 657 2HB LYS 88 HB2 LYS 88 -5.013 -3.026 14.507 658 1HG LYS 88 HG2 LYS 88 -3.855 -4.605 15.919 659 2HG LYS 88 HG1 LYS 88 -2.730 -3.886 14.757 660 1HD LYS 88 HD2 LYS 88 -2.664 -2.218 17.005 661 2HD LYS 88 HD1 LYS 88 -2.640 -3.869 17.635 662 1HE LYS 88 HE2 LYS 88 -0.944 -3.739 15.368 663 2HE LYS 88 HE1 LYS 88 -0.521 -2.403 16.431 664 1HZ LYS 88 HZ1 LYS 88 -0.909 -5.024 17.664 665 2HZ LYS 88 HZ2 LYS 88 0.184 -3.796 18.061 666 3HZ LYS 88 HZ3 LYS 88 0.490 -4.807 16.740 667 H ILE 89 HN ILE 89 -4.128 -1.179 12.273 668 HA ILE 89 HA ILE 89 -2.167 -2.751 11.250 669 HB ILE 89 HB ILE 89 -3.217 -0.220 10.003 670 1HG1 ILE 89 HG11 ILE 89 -4.116 -3.088 9.623 671 2HG1 ILE 89 HG12 ILE 89 -4.904 -1.963 10.723 672 1HG2 ILE 89 HG21 ILE 89 -2.594 -2.154 8.063 673 2HG2 ILE 89 HG22 ILE 89 -1.211 -2.088 9.157 674 3HG2 ILE 89 HG23 ILE 89 -1.774 -0.618 8.356 675 1HD1 ILE 89 HD11 ILE 89 -4.599 -1.387 7.799 676 2HD1 ILE 89 HD12 ILE 89 -5.678 -0.621 8.963 677 3HD1 ILE 89 HD13 ILE 89 -5.968 -2.284 8.452 678 H THR 90 HN THR 90 -1.763 0.747 10.765 679 HA THR 90 HA THR 90 1.025 0.644 10.500 680 HB THR 90 HB THR 90 -1.021 2.631 10.535 681 HG1 THR 90 HG1 THR 90 0.592 2.164 8.907 682 1HG2 THR 90 HG21 THR 90 1.170 3.193 12.425 683 2HG2 THR 90 HG22 THR 90 -0.485 3.800 12.380 684 3HG2 THR 90 HG23 THR 90 0.729 4.469 11.289 685 H GLY 91 HN GLY 91 -0.980 1.090 13.385 686 1HA GLY 91 HA2 GLY 91 1.046 1.798 15.203 687 2HA GLY 91 HA1 GLY 91 -0.433 0.934 15.617 688 H MET 92 HN MET 92 0.179 -1.192 13.704 689 HA MET 92 HA MET 92 1.772 -2.882 15.419 690 1HB MET 92 HB1 MET 92 -0.272 -3.427 13.748 691 2HB MET 92 HB2 MET 92 1.073 -3.740 12.660 692 1HG MET 92 HG1 MET 92 1.766 -5.562 13.792 693 2HG MET 92 HG2 MET 92 1.218 -4.953 15.352 694 1HE MET 92 HE1 MET 92 0.063 -5.682 11.914 695 2HE MET 92 HE2 MET 92 -1.605 -5.216 12.258 696 3HE MET 92 HE3 MET 92 -1.188 -6.918 12.059 697 H LEU 93 HN LEU 93 2.091 -1.170 12.422 698 HA LEU 93 HA LEU 93 4.377 -2.357 11.393 699 1HB LEU 93 HB2 LEU 93 3.032 0.256 11.091 700 2HB LEU 93 HB1 LEU 93 4.634 0.084 10.413 701 HG LEU 93 HG LEU 93 2.880 -0.341 8.740 702 1HD1 LEU 93 HD11 LEU 93 4.824 -1.451 8.174 703 2HD1 LEU 93 HD12 LEU 93 3.649 -2.767 8.202 704 3HD1 LEU 93 HD13 LEU 93 4.739 -2.529 9.568 705 1HD2 LEU 93 HD21 LEU 93 1.013 -1.313 9.487 706 2HD2 LEU 93 HD22 LEU 93 1.828 -2.021 10.881 707 3HD2 LEU 93 HD23 LEU 93 1.886 -2.836 9.317 708 H LEU 94 HN LEU 94 4.110 -0.764 14.268 709 HA LEU 94 HA LEU 94 6.940 0.051 14.245 710 1HB LEU 94 HB1 LEU 94 4.535 1.164 15.505 711 2HB LEU 94 HB2 LEU 94 5.892 0.998 16.599 712 HG LEU 94 HG LEU 94 7.249 2.456 15.277 713 1HD1 LEU 94 HD11 LEU 94 5.031 2.378 13.232 714 2HD1 LEU 94 HD12 LEU 94 6.649 1.698 13.060 715 3HD1 LEU 94 HD13 LEU 94 6.434 3.446 13.164 716 1HD2 LEU 94 HD21 LEU 94 4.585 3.262 16.148 717 2HD2 LEU 94 HD22 LEU 94 5.300 4.350 14.959 718 3HD2 LEU 94 HD23 LEU 94 6.156 4.001 16.461 719 H GLU 95 HN GLU 95 5.738 -2.624 14.473 720 HA GLU 95 HA GLU 95 7.290 -3.630 16.624 721 1HB GLU 95 HB2 GLU 95 5.627 -4.367 18.139 722 2HB GLU 95 HB1 GLU 95 5.250 -2.682 17.808 723 1HG GLU 95 HG1 GLU 95 3.437 -3.259 16.410 724 2HG GLU 95 HG2 GLU 95 3.929 -4.951 16.352 725 H ILE 96 HN ILE 96 5.835 -3.931 13.724 726 HA ILE 96 HA ILE 96 4.950 -6.593 13.625 727 HB ILE 96 HB ILE 96 5.295 -6.530 11.229 728 1HG1 ILE 96 HG12 ILE 96 7.487 -5.476 11.159 729 2HG1 ILE 96 HG11 ILE 96 6.353 -4.633 10.113 730 1HG2 ILE 96 HG21 ILE 96 4.294 -3.995 10.998 731 2HG2 ILE 96 HG22 ILE 96 3.890 -4.433 12.662 732 3HG2 ILE 96 HG23 ILE 96 3.359 -5.456 11.327 733 1HD1 ILE 96 HD11 ILE 96 7.828 -3.682 12.426 734 2HD1 ILE 96 HD12 ILE 96 6.121 -3.242 12.438 735 3HD1 ILE 96 HD13 ILE 96 7.138 -2.793 11.067 736 H ASP 97 HN ASP 97 6.575 -7.482 11.367 737 HA ASP 97 HA ASP 97 8.406 -9.157 12.648 738 1HB ASP 97 HB1 ASP 97 7.265 -9.154 10.236 739 2HB ASP 97 HB2 ASP 97 8.810 -8.440 9.780 740 H ASN 98 HN ASN 98 8.629 -5.917 12.261 741 HA ASN 98 HA ASN 98 10.267 -4.441 12.729 742 1HB ASN 98 HB1 ASN 98 11.713 -6.982 13.210 743 2HB ASN 98 HB2 ASN 98 12.707 -5.561 12.905 744 1HD2 ASN 98 HD22 ASN 98 9.601 -5.867 14.564 745 2HD2 ASN 98 HD21 ASN 98 10.152 -5.253 16.082 746 H SER 99 HN SER 99 10.695 -6.782 10.214 747 HA SER 99 HA SER 99 12.614 -5.241 8.729 748 1HB SER 99 HB1 SER 99 10.834 -7.343 7.515 749 2HB SER 99 HB2 SER 99 12.488 -6.906 7.084 750 HG SER 99 HG SER 99 12.890 -7.676 9.396 751 H GLU 100 HN GLU 100 9.178 -5.398 9.042 752 HA GLU 100 HA GLU 100 8.621 -3.873 6.652 753 1HB GLU 100 HB1 GLU 100 6.621 -4.169 8.831 754 2HB GLU 100 HB2 GLU 100 6.401 -4.216 7.090 755 1HG GLU 100 HG1 GLU 100 8.047 -6.400 7.891 756 2HG GLU 100 HG2 GLU 100 6.574 -6.379 8.862 757 H LEU 101 HN LEU 101 9.439 -3.288 9.920 758 HA LEU 101 HA LEU 101 8.418 -0.600 10.063 759 1HB LEU 101 HB1 LEU 101 8.805 -1.993 12.073 760 2HB LEU 101 HB2 LEU 101 10.521 -1.990 11.733 761 HG LEU 101 HG LEU 101 9.503 -0.374 13.530 762 1HD1 LEU 101 HD21 LEU 101 11.686 0.087 11.565 763 2HD1 LEU 101 HD22 LEU 101 11.767 -0.215 13.302 764 3HD1 LEU 101 HD23 LEU 101 11.279 1.371 12.704 765 1HD2 LEU 101 HD11 LEU 101 8.415 1.463 12.877 766 2HD2 LEU 101 HD12 LEU 101 8.104 0.571 11.387 767 3HD2 LEU 101 HD13 LEU 101 9.456 1.700 11.475 768 H LEU 102 HN LEU 102 11.225 -2.205 8.879 769 HA LEU 102 HA LEU 102 12.822 0.223 8.708 770 1HB LEU 102 HB2 LEU 102 13.283 -2.671 8.482 771 2HB LEU 102 HB1 LEU 102 14.203 -1.706 7.344 772 HG LEU 102 HG LEU 102 14.922 -0.328 9.410 773 1HD1 LEU 102 HD21 LEU 102 14.646 -1.179 11.512 774 2HD1 LEU 102 HD22 LEU 102 14.469 -2.838 10.938 775 3HD1 LEU 102 HD23 LEU 102 13.132 -1.700 10.771 776 1HD2 LEU 102 HD11 LEU 102 15.843 -3.051 8.618 777 2HD2 LEU 102 HD12 LEU 102 16.596 -2.246 9.995 778 3HD2 LEU 102 HD13 LEU 102 16.630 -1.488 8.403 779 H HIS 103 HN HIS 103 11.308 -2.114 6.517 780 HA HIS 103 HA HIS 103 12.188 -0.818 4.165 781 1HB HIS 103 HB1 HIS 103 10.927 -3.201 4.786 782 2HB HIS 103 HB2 HIS 103 9.684 -2.312 3.919 783 HD2 HIS 103 HD2 HIS 103 10.668 -4.783 2.311 784 HE1 HIS 103 HE1 HIS 103 13.318 -2.156 0.312 785 HE2 HIS 103 HE2 HIS 103 12.194 -4.428 0.242 786 H MET 104 HN MET 104 9.291 -0.509 6.154 787 HA MET 104 HA MET 104 7.723 1.033 4.428 788 1HB MET 104 HB2 MET 104 6.523 1.765 6.426 789 2HB MET 104 HB1 MET 104 6.882 0.043 6.532 790 1HG MET 104 HG1 MET 104 8.204 0.309 8.318 791 2HG MET 104 HG2 MET 104 8.904 1.796 7.690 792 1HE MET 104 HE1 MET 104 4.759 1.540 9.559 793 2HE MET 104 HE2 MET 104 5.474 0.503 8.322 794 3HE MET 104 HE3 MET 104 4.869 2.105 7.892 795 H LEU 105 HN LEU 105 10.360 1.941 6.565 796 HA LEU 105 HA LEU 105 9.957 4.784 6.065 797 1HB LEU 105 HB1 LEU 105 12.325 3.571 7.461 798 2HB LEU 105 HB2 LEU 105 11.654 5.178 7.653 799 HG LEU 105 HG LEU 105 10.235 2.672 8.546 800 1HD1 LEU 105 HD11 LEU 105 11.149 2.851 10.640 801 2HD1 LEU 105 HD12 LEU 105 11.547 4.558 10.442 802 3HD1 LEU 105 HD13 LEU 105 12.525 3.325 9.645 803 1HD2 LEU 105 HD21 LEU 105 8.527 4.082 8.724 804 2HD2 LEU 105 HD22 LEU 105 9.551 5.480 8.399 805 3HD2 LEU 105 HD23 LEU 105 9.416 4.848 10.041 806 H GLU 106 HN GLU 106 11.439 2.157 4.645 807 HA GLU 106 HA GLU 106 13.497 3.791 3.373 808 1HB GLU 106 HB2 GLU 106 13.169 0.851 3.895 809 2HB GLU 106 HB1 GLU 106 14.288 1.406 2.647 810 1HG GLU 106 HG2 GLU 106 14.330 2.062 5.574 811 2HG GLU 106 HG1 GLU 106 15.468 1.034 4.702 812 H SER 107 HN SER 107 10.426 2.732 2.726 813 HA SER 107 HA SER 107 10.825 3.159 -0.129 814 1HB SER 107 HB2 SER 107 10.952 0.617 0.601 815 2HB SER 107 HB1 SER 107 9.197 0.768 0.599 816 HG SER 107 HG SER 107 10.424 1.842 -1.612 817 HA PRO 108 HA PRO 108 6.988 5.334 0.520 818 1HB PRO 108 HB2 PRO 108 6.804 5.409 -2.412 819 2HB PRO 108 HB1 PRO 108 6.958 6.741 -1.266 820 1HG PRO 108 HG1 PRO 108 8.977 6.030 -2.889 821 2HG PRO 108 HG2 PRO 108 9.263 6.634 -1.246 822 1HD PRO 108 HD2 PRO 108 9.292 3.813 -2.260 823 2HD PRO 108 HD1 PRO 108 10.402 4.613 -1.126 824 H GLU 109 HN GLU 109 7.380 2.307 -0.778 825 HA GLU 109 HA GLU 109 4.476 1.928 -1.147 826 1HB GLU 109 HB1 GLU 109 4.942 0.993 -3.117 827 2HB GLU 109 HB2 GLU 109 6.663 1.236 -2.843 828 1HG GLU 109 HG2 GLU 109 6.975 -0.901 -2.071 829 2HG GLU 109 HG1 GLU 109 5.292 -1.065 -1.570 830 H SER 110 HN SER 110 7.407 0.839 0.381 831 HA SER 110 HA SER 110 6.463 -1.617 1.327 832 1HB SER 110 HB1 SER 110 8.732 0.126 1.878 833 2HB SER 110 HB2 SER 110 8.179 -0.750 3.307 834 HG SER 110 HG SER 110 9.077 -1.784 0.835 835 H LEU 111 HN LEU 111 6.324 1.616 2.748 836 HA LEU 111 HA LEU 111 5.176 0.834 5.174 837 1HB LEU 111 HB1 LEU 111 6.104 3.083 4.686 838 2HB LEU 111 HB2 LEU 111 4.685 3.417 3.709 839 HG LEU 111 HG LEU 111 4.102 2.500 6.436 840 1HD1 LEU 111 HD11 LEU 111 5.328 3.916 7.580 841 2HD1 LEU 111 HD12 LEU 111 4.679 5.266 6.649 842 3HD1 LEU 111 HD13 LEU 111 6.129 4.427 6.086 843 1HD2 LEU 111 HD21 LEU 111 2.353 4.060 6.293 844 2HD2 LEU 111 HD22 LEU 111 2.494 3.364 4.676 845 3HD2 LEU 111 HD23 LEU 111 3.157 4.965 5.009 846 H ARG 112 HN ARG 112 3.762 1.290 2.020 847 HA ARG 112 HA ARG 112 1.056 1.130 3.085 848 1HB ARG 112 HB2 ARG 112 0.853 2.532 1.327 849 2HB ARG 112 HB1 ARG 112 2.293 1.912 0.529 850 1HG ARG 112 HG1 ARG 112 1.021 0.020 -0.315 851 2HG ARG 112 HG2 ARG 112 -0.423 0.606 0.515 852 1HD ARG 112 HD2 ARG 112 -0.846 2.147 -1.058 853 2HD ARG 112 HD1 ARG 112 0.851 2.599 -1.203 854 HE ARG 112 HE ARG 112 -0.343 0.260 -2.544 855 1HH1 ARG 112 HH11 ARG 112 1.889 2.936 -2.451 856 2HH1 ARG 112 HH12 ARG 112 2.528 2.623 -4.030 857 1HH2 ARG 112 HH21 ARG 112 0.493 -0.158 -4.621 858 2HH2 ARG 112 HH22 ARG 112 1.734 0.865 -5.264 859 H SER 113 HN SER 113 2.820 -0.582 0.532 860 HA SER 113 HA SER 113 1.215 -2.761 0.235 861 1HB SER 113 HB1 SER 113 4.225 -2.982 0.157 862 2HB SER 113 HB2 SER 113 3.040 -3.804 -0.858 863 HG SER 113 HG SER 113 2.621 -1.254 -1.210 864 H LYS 114 HN LYS 114 3.641 -2.215 2.753 865 HA LYS 114 HA LYS 114 3.347 -4.898 3.802 866 1HB LYS 114 HB1 LYS 114 4.771 -2.508 4.976 867 2HB LYS 114 HB2 LYS 114 4.816 -4.140 5.630 868 1HG LYS 114 HG1 LYS 114 5.771 -3.386 2.882 869 2HG LYS 114 HG2 LYS 114 6.814 -3.529 4.298 870 1HD LYS 114 HD2 LYS 114 6.165 -5.879 4.535 871 2HD LYS 114 HD1 LYS 114 5.130 -5.735 3.114 872 1HE LYS 114 HE2 LYS 114 7.450 -4.835 2.094 873 2HE LYS 114 HE1 LYS 114 8.066 -5.953 3.311 874 1HZ LYS 114 HZ1 LYS 114 6.032 -7.302 2.049 875 2HZ LYS 114 HZ2 LYS 114 7.694 -7.556 1.846 876 3HZ LYS 114 HZ3 LYS 114 6.862 -6.519 0.800 877 H VAL 115 HN VAL 115 2.103 -1.675 4.513 878 HA VAL 115 HA VAL 115 0.973 -2.283 7.032 879 HB VAL 115 HB VAL 115 0.741 -0.068 5.126 880 1HG1 VAL 115 HG11 VAL 115 -1.481 0.190 5.045 881 2HG1 VAL 115 HG12 VAL 115 -1.481 0.369 6.800 882 3HG1 VAL 115 HG13 VAL 115 -1.727 -1.218 6.078 883 1HG2 VAL 115 HG21 VAL 115 1.565 -0.498 7.735 884 2HG2 VAL 115 HG22 VAL 115 0.108 0.485 7.890 885 3HG2 VAL 115 HG23 VAL 115 1.454 1.052 6.901 886 H ASP 116 HN ASP 116 -0.417 -2.319 3.754 887 HA ASP 116 HA ASP 116 -2.925 -3.319 4.372 888 1HB ASP 116 HB1 ASP 116 -2.366 -2.497 2.146 889 2HB ASP 116 HB2 ASP 116 -1.242 -3.831 1.910 890 H GLU 117 HN GLU 117 0.123 -5.026 3.962 891 HA GLU 117 HA GLU 117 -1.024 -7.651 4.068 892 1HB GLU 117 HB2 GLU 117 1.026 -8.044 3.237 893 2HB GLU 117 HB1 GLU 117 1.597 -6.463 3.754 894 1HG GLU 117 HG1 GLU 117 2.254 -7.280 5.866 895 2HG GLU 117 HG2 GLU 117 1.414 -8.810 5.614 896 H ALA 118 HN ALA 118 0.405 -5.408 6.361 897 HA ALA 118 HA ALA 118 0.452 -7.111 8.605 898 1HB ALA 118 HB1 ALA 118 0.841 -5.202 9.906 899 2HB ALA 118 HB2 ALA 118 0.007 -4.146 8.764 900 3HB ALA 118 HB3 ALA 118 1.575 -4.837 8.344 901 H VAL 119 HN VAL 119 -2.062 -5.408 6.973 902 HA VAL 119 HA VAL 119 -4.036 -5.280 8.973 903 HB VAL 119 HB VAL 119 -4.518 -5.836 6.053 904 1HG1 VAL 119 HG11 VAL 119 -6.145 -4.529 8.217 905 2HG1 VAL 119 HG12 VAL 119 -6.531 -5.994 7.308 906 3HG1 VAL 119 HG13 VAL 119 -6.536 -4.419 6.500 907 1HG2 VAL 119 HG21 VAL 119 -3.837 -3.291 7.470 908 2HG2 VAL 119 HG22 VAL 119 -4.633 -3.337 5.897 909 3HG2 VAL 119 HG23 VAL 119 -3.024 -4.030 6.090 910 H ALA 120 HN ALA 120 -3.397 -7.647 6.439 911 HA ALA 120 HA ALA 120 -5.278 -9.576 7.125 912 1HB ALA 120 HB1 ALA 120 -2.875 -10.822 6.203 913 2HB ALA 120 HB2 ALA 120 -3.103 -9.297 5.336 914 3HB ALA 120 HB3 ALA 120 -4.375 -10.525 5.321 915 H VAL 121 HN VAL 121 -2.262 -8.692 8.545 916 HA VAL 121 HA VAL 121 -2.018 -11.062 10.176 917 HB VAL 121 HB VAL 121 -0.433 -8.527 9.893 918 1HG1 VAL 121 HG21 VAL 121 0.880 -10.393 11.615 919 2HG1 VAL 121 HG22 VAL 121 -0.686 -9.953 12.294 920 3HG1 VAL 121 HG23 VAL 121 0.486 -8.696 11.896 921 1HG2 VAL 121 HG11 VAL 121 0.715 -11.259 9.730 922 2HG2 VAL 121 HG12 VAL 121 1.127 -9.800 8.828 923 3HG2 VAL 121 HG13 VAL 121 -0.326 -10.713 8.414 924 H LEU 122 HN LEU 122 -3.210 -7.795 10.461 925 HA LEU 122 HA LEU 122 -3.387 -7.793 13.319 926 1HB LEU 122 HB2 LEU 122 -3.725 -5.612 12.995 927 2HB LEU 122 HB1 LEU 122 -3.638 -5.892 11.268 928 HG LEU 122 HG LEU 122 -6.276 -6.540 12.021 929 1HD1 LEU 122 HD11 LEU 122 -6.396 -3.865 12.848 930 2HD1 LEU 122 HD12 LEU 122 -5.148 -4.632 13.830 931 3HD1 LEU 122 HD13 LEU 122 -6.777 -5.306 13.790 932 1HD2 LEU 122 HD21 LEU 122 -6.612 -4.211 10.833 933 2HD2 LEU 122 HD22 LEU 122 -6.077 -5.635 9.941 934 3HD2 LEU 122 HD23 LEU 122 -4.902 -4.426 10.456 935 H GLN 123 HN GLN 123 -5.575 -8.423 10.635 936 HA GLN 123 HA GLN 123 -7.932 -8.774 12.144 937 1HB GLN 123 HB1 GLN 123 -7.031 -9.686 9.421 938 2HB GLN 123 HB2 GLN 123 -8.580 -10.203 10.077 939 1HG GLN 123 HG1 GLN 123 -7.711 -7.351 9.640 940 2HG GLN 123 HG2 GLN 123 -8.804 -8.272 8.608 941 1HE2 GLN 123 HE22 GLN 123 -8.464 -6.470 11.511 942 2HE2 GLN 123 HE21 GLN 123 -10.124 -6.507 11.988 943 H ALA 124 HN ALA 124 -5.270 -10.862 11.284 944 HA ALA 124 HA ALA 124 -6.454 -13.290 12.300 945 1HB ALA 124 HB1 ALA 124 -4.176 -14.204 11.999 946 2HB ALA 124 HB2 ALA 124 -3.613 -12.593 11.557 947 3HB ALA 124 HB3 ALA 124 -4.799 -13.421 10.547 948 H HIS 125 HN HIS 125 -4.098 -10.911 13.494 949 HA HIS 125 HA HIS 125 -3.563 -12.327 15.876 950 1HB HIS 125 HB1 HIS 125 -2.098 -10.540 14.908 951 2HB HIS 125 HB2 HIS 125 -3.292 -9.346 15.398 952 HD2 HIS 125 HD2 HIS 125 -2.159 -12.233 17.788 953 HE1 HIS 125 HE1 HIS 125 -0.849 -8.510 19.320 954 HE2 HIS 125 HE2 HIS 125 -1.032 -10.998 19.774 955 H GLN 126 HN GLN 126 -6.117 -10.211 14.936 956 HA GLN 126 HA GLN 126 -6.960 -9.624 17.633 957 1HB GLN 126 HB1 GLN 126 -8.035 -9.005 14.900 958 2HB GLN 126 HB2 GLN 126 -9.033 -8.747 16.324 959 1HG GLN 126 HG1 GLN 126 -6.935 -7.436 17.179 960 2HG GLN 126 HG2 GLN 126 -6.560 -7.338 15.460 961 1HE2 GLN 126 HE22 GLN 126 -9.143 -7.152 14.442 962 2HE2 GLN 126 HE21 GLN 126 -9.817 -5.633 14.913 963 H ALA 127 HN ALA 127 -8.138 -11.636 14.952 964 HA ALA 127 HA ALA 127 -10.158 -12.807 16.707 965 1HB ALA 127 HB1 ALA 127 -10.477 -12.025 14.227 966 2HB ALA 127 HB2 ALA 127 -11.303 -13.460 14.836 967 3HB ALA 127 HB3 ALA 127 -9.841 -13.629 13.865 968 H LYS 128 HN LYS 128 -7.443 -13.849 14.658 969 HA LYS 128 HA LYS 128 -7.608 -16.525 15.796 970 1HB LYS 128 HB2 LYS 128 -6.676 -17.275 13.872 971 2HB LYS 128 HB1 LYS 128 -7.163 -15.707 13.246 972 1HG LYS 128 HG1 LYS 128 -5.036 -14.907 13.190 973 2HG LYS 128 HG2 LYS 128 -4.489 -15.940 14.509 974 1HD LYS 128 HD2 LYS 128 -3.459 -16.724 12.515 975 2HD LYS 128 HD1 LYS 128 -4.707 -17.892 12.958 976 1HE LYS 128 HE2 LYS 128 -6.157 -16.326 11.363 977 2HE LYS 128 HE1 LYS 128 -4.570 -16.028 10.657 978 1HZ LYS 128 HZ1 LYS 128 -6.236 -18.329 10.442 979 2HZ LYS 128 HZ2 LYS 128 -4.691 -18.743 10.993 980 3HZ LYS 128 HZ3 LYS 128 -4.872 -17.903 9.537 981 H GLU 129 HN GLU 129 -5.249 -17.483 15.822 982 HA GLU 129 HA GLU 129 -3.813 -16.008 17.905 983 1HB GLU 129 HB2 GLU 129 -4.114 -18.871 17.213 984 2HB GLU 129 HB1 GLU 129 -2.518 -18.383 17.767 985 1HG GLU 129 HG1 GLU 129 -4.325 -17.204 19.545 986 2HG GLU 129 HG2 GLU 129 -4.915 -18.843 19.276 987 H ALA 130 HN ALA 130 -3.474 -14.755 15.611 988 HA ALA 130 HA ALA 130 -1.635 -15.713 13.776 989 1HB ALA 130 HB1 ALA 130 -1.849 -13.710 12.803 990 2HB ALA 130 HB2 ALA 130 -1.429 -12.837 14.278 991 3HB ALA 130 HB3 ALA 130 -3.075 -13.423 14.038 992 H ALA 131 HN ALA 131 -0.829 -13.147 16.106 993 HA ALA 131 HA ALA 131 1.967 -13.745 15.922 994 1HB ALA 131 HB1 ALA 131 2.117 -11.988 17.758 995 2HB ALA 131 HB2 ALA 131 0.376 -11.795 17.557 996 3HB ALA 131 HB3 ALA 131 1.459 -11.474 16.204 997 H GLN 132 HN GLN 132 3.017 -15.246 17.019 998 HA GLN 132 HA GLN 132 1.802 -16.378 19.432 999 1HB GLN 132 HB2 GLN 132 3.365 -17.434 17.245 1000 2HB GLN 132 HB1 GLN 132 4.129 -17.813 18.782 1001 1HG GLN 132 HG2 GLN 132 1.282 -18.287 18.868 1002 2HG GLN 132 HG1 GLN 132 2.055 -19.185 17.562 1003 1HE2 GLN 132 HE21 GLN 132 1.534 -18.956 20.916 1004 2HE2 GLN 132 HE22 GLN 132 2.503 -20.303 21.398 1005 H LYS 133 HN LYS 133 2.820 -16.394 21.401 1006 HA LYS 133 HA LYS 133 4.721 -14.329 21.890 1007 1HB LYS 133 HB2 LYS 133 2.876 -15.705 23.416 1008 2HB LYS 133 HB1 LYS 133 4.412 -16.304 24.027 1009 1HG LYS 133 HG1 LYS 133 4.390 -14.510 25.344 1010 2HG LYS 133 HG2 LYS 133 4.848 -13.606 23.900 1011 1HD LYS 133 HD1 LYS 133 2.671 -12.873 23.516 1012 2HD LYS 133 HD2 LYS 133 1.967 -14.139 24.525 1013 1HE LYS 133 HE2 LYS 133 2.899 -13.071 26.518 1014 2HE LYS 133 HE1 LYS 133 3.609 -11.808 25.513 1015 1HZ LYS 133 HZ1 LYS 133 1.132 -11.757 26.659 1016 2HZ LYS 133 HZ2 LYS 133 0.809 -12.114 25.037 1017 3HZ LYS 133 HZ3 LYS 133 1.687 -10.725 25.439 1018 H ALA 134 HN ALA 134 5.083 -17.423 20.729 1019 HA ALA 134 HA ALA 134 7.618 -17.986 22.025 1020 1HB ALA 134 HB1 ALA 134 6.656 -20.001 21.691 1021 2HB ALA 134 HB2 ALA 134 7.463 -19.873 20.128 1022 3HB ALA 134 HB3 ALA 134 5.755 -19.460 20.276 1023 H VAL 135 HN VAL 135 9.196 -16.625 21.378 1024 HA VAL 135 HA VAL 135 9.443 -15.759 18.642 1025 HB VAL 135 HB VAL 135 10.071 -14.316 20.579 1026 1HG1 VAL 135 HG21 VAL 135 11.740 -16.586 21.183 1027 2HG1 VAL 135 HG22 VAL 135 11.334 -15.192 22.184 1028 3HG1 VAL 135 HG23 VAL 135 12.699 -15.111 21.070 1029 1HG2 VAL 135 HG11 VAL 135 10.928 -13.467 18.632 1030 2HG2 VAL 135 HG12 VAL 135 11.907 -14.898 18.308 1031 3HG2 VAL 135 HG13 VAL 135 12.416 -13.741 19.537 1032 H ASN 136 HN ASN 136 10.603 -18.368 20.544 1033 HA ASN 136 HA ASN 136 12.961 -18.923 19.028 1034 1HB ASN 136 HB1 ASN 136 11.819 -19.854 21.419 1035 2HB ASN 136 HB2 ASN 136 11.870 -21.253 20.351 1036 1HD2 ASN 136 HD21 ASN 136 14.128 -20.822 18.913 1037 2HD2 ASN 136 HD22 ASN 136 15.507 -20.848 19.952 1038 H SER 137 HN SER 137 12.823 -21.620 18.496 1039 HA SER 137 HA SER 137 11.205 -21.609 16.083 1040 1HB SER 137 HB1 SER 137 12.674 -24.064 16.513 1041 2HB SER 137 HB2 SER 137 12.861 -22.865 15.233 1042 HG SER 137 HG SER 137 14.698 -23.260 16.757 1043 H ALA 138 HN ALA 138 9.685 -21.732 18.421 1044 HA ALA 138 HA ALA 138 8.928 -24.487 18.886 1045 1HB ALA 138 HB1 ALA 138 7.275 -23.548 20.433 1046 2HB ALA 138 HB2 ALA 138 7.712 -21.923 19.904 1047 3HB ALA 138 HB3 ALA 138 8.895 -22.924 20.745 1048 H THR 139 HN THR 139 7.654 -21.661 17.207 1049 HA THR 139 HA THR 139 5.329 -23.195 16.317 1050 HB THR 139 HB THR 139 4.943 -20.922 17.170 1051 HG1 THR 139 HG1 THR 139 4.110 -21.876 14.846 1052 1HG2 THR 139 HG21 THR 139 6.999 -19.821 16.553 1053 2HG2 THR 139 HG22 THR 139 5.616 -18.970 15.867 1054 3HG2 THR 139 HG23 THR 139 6.610 -20.006 14.843 1055 H GLY 140 HN GLY 140 8.228 -23.459 15.378 1056 1HA GLY 140 HA2 GLY 140 8.054 -22.687 12.582 1057 2HA GLY 140 HA1 GLY 140 9.415 -23.475 13.365 1058 H VAL 141 HN VAL 141 5.993 -24.208 12.664 1059 HA VAL 141 HA VAL 141 6.573 -27.012 12.342 1060 HB VAL 141 HB VAL 141 4.442 -26.388 13.297 1061 1HG1 VAL 141 HG21 VAL 141 3.075 -24.800 12.510 1062 2HG1 VAL 141 HG22 VAL 141 3.234 -25.354 10.843 1063 3HG1 VAL 141 HG23 VAL 141 4.462 -24.299 11.542 1064 1HG2 VAL 141 HG11 VAL 141 3.220 -28.001 12.269 1065 2HG2 VAL 141 HG12 VAL 141 4.772 -28.323 11.494 1066 3HG2 VAL 141 HG13 VAL 141 3.546 -27.375 10.653 1067 HA PRO 142 HA PRO 142 7.669 -26.764 8.033 1068 1HB PRO 142 HB2 PRO 142 7.253 -29.393 7.402 1069 2HB PRO 142 HB1 PRO 142 8.695 -28.800 8.231 1070 1HG PRO 142 HG1 PRO 142 6.240 -30.076 9.378 1071 2HG PRO 142 HG2 PRO 142 7.943 -30.361 9.784 1072 1HD PRO 142 HD2 PRO 142 6.367 -28.823 11.323 1073 2HD PRO 142 HD1 PRO 142 8.084 -28.443 11.078 1074 H THR 143 HN THR 143 6.720 -27.411 5.890 1075 HA THR 143 HA THR 143 3.948 -26.662 5.832 1076 HB THR 143 HB THR 143 5.340 -25.781 4.102 1077 HG1 THR 143 HG1 THR 143 4.126 -27.721 2.556 1078 1HG2 THR 143 HG21 THR 143 6.748 -28.132 4.205 1079 2HG2 THR 143 HG22 THR 143 6.962 -26.838 3.026 1080 3HG2 THR 143 HG23 THR 143 5.929 -28.215 2.646 1081 H VAL 144 HN VAL 144 2.278 -27.874 4.727 1082 HA VAL 144 HA VAL 144 2.696 -30.790 4.812 1083 HB VAL 144 HB VAL 144 0.288 -30.974 5.534 1084 1HG1 VAL 144 HG21 VAL 144 1.709 -29.520 7.693 1085 2HG1 VAL 144 HG22 VAL 144 2.505 -30.932 6.997 1086 3HG1 VAL 144 HG23 VAL 144 0.905 -31.089 7.721 1087 1HG2 VAL 144 HG11 VAL 144 -0.914 -29.095 5.431 1088 2HG2 VAL 144 HG12 VAL 144 0.529 -28.081 5.366 1089 3HG2 VAL 144 HG13 VAL 144 -0.100 -28.624 6.922 Start of MODEL 22 1 1H GLY 1 HT1 GLY 1 -2.758 -20.179 0.596 2 2H GLY 1 HT2 GLY 1 -2.430 -18.580 1.038 3 3H GLY 1 HT3 GLY 1 -3.598 -19.467 1.881 4 1HA GLY 1 HA1 GLY 1 -1.472 -21.056 2.187 5 2HA GLY 1 HA2 GLY 1 -0.711 -19.473 2.142 6 HA PRO 2 HA PRO 2 -1.621 -20.059 6.588 7 1HB PRO 2 HB2 PRO 2 0.068 -17.621 6.687 8 2HB PRO 2 HB1 PRO 2 0.199 -19.120 7.612 9 1HG PRO 2 HG2 PRO 2 1.915 -18.572 5.646 10 2HG PRO 2 HG1 PRO 2 1.329 -20.223 5.915 11 1HD PRO 2 HD2 PRO 2 0.512 -18.235 3.834 12 2HD PRO 2 HD1 PRO 2 0.737 -19.991 3.691 13 H LEU 3 HN LEU 3 -2.028 -17.347 4.464 14 HA LEU 3 HA LEU 3 -3.365 -15.620 6.282 15 1HB LEU 3 HB2 LEU 3 -3.210 -15.768 3.283 16 2HB LEU 3 HB1 LEU 3 -4.231 -14.590 4.086 17 HG LEU 3 HG LEU 3 -1.764 -14.283 5.328 18 1HD1 LEU 3 HD11 LEU 3 -1.231 -15.650 2.987 19 2HD1 LEU 3 HD12 LEU 3 -0.086 -14.691 3.925 20 3HD1 LEU 3 HD13 LEU 3 -0.942 -13.962 2.567 21 1HD2 LEU 3 HD21 LEU 3 -1.894 -12.128 4.541 22 2HD2 LEU 3 HD22 LEU 3 -3.570 -12.652 4.383 23 3HD2 LEU 3 HD23 LEU 3 -2.519 -12.624 2.968 24 H GLY 4 HN GLY 4 -5.564 -15.209 6.535 25 1HA GLY 4 HA2 GLY 4 -7.295 -17.464 5.770 26 2HA GLY 4 HA1 GLY 4 -7.568 -16.393 7.135 27 H SER 5 HN SER 5 -9.353 -17.133 4.915 28 HA SER 5 HA SER 5 -9.691 -14.528 3.599 29 1HB SER 5 HB2 SER 5 -9.555 -16.715 2.253 30 2HB SER 5 HB1 SER 5 -11.169 -17.055 2.877 31 HG SER 5 HG SER 5 -11.135 -14.561 1.956 32 H ALA 6 HN ALA 6 -11.092 -16.697 5.886 33 HA ALA 6 HA ALA 6 -12.958 -16.618 7.186 34 1HB ALA 6 HB1 ALA 6 -13.809 -14.081 7.403 35 2HB ALA 6 HB2 ALA 6 -12.181 -13.803 6.782 36 3HB ALA 6 HB3 ALA 6 -12.413 -14.718 8.272 37 H ALA 7 HN ALA 7 -14.121 -17.798 5.532 38 HA ALA 7 HA ALA 7 -16.418 -16.274 4.566 39 1HB ALA 7 HB1 ALA 7 -15.111 -16.223 2.614 40 2HB ALA 7 HB2 ALA 7 -16.259 -17.540 2.367 41 3HB ALA 7 HB3 ALA 7 -14.591 -17.896 2.819 42 H ALA 8 HN ALA 8 -18.159 -17.761 3.746 43 HA ALA 8 HA ALA 8 -18.073 -20.388 5.066 44 1HB ALA 8 HB1 ALA 8 -19.490 -18.261 6.071 45 2HB ALA 8 HB2 ALA 8 -19.798 -19.962 6.416 46 3HB ALA 8 HB3 ALA 8 -20.703 -19.142 5.144 47 H ALA 9 HN ALA 9 -18.343 -21.885 3.559 48 HA ALA 9 HA ALA 9 -19.041 -22.992 1.697 49 1HB ALA 9 HB1 ALA 9 -21.237 -23.328 1.774 50 2HB ALA 9 HB2 ALA 9 -21.575 -21.661 1.307 51 3HB ALA 9 HB3 ALA 9 -21.309 -22.065 3.002 52 H THR 10 HN THR 10 -17.392 -21.862 0.469 53 HA THR 10 HA THR 10 -18.587 -20.140 -1.592 54 HB THR 10 HB THR 10 -16.497 -18.823 -1.669 55 HG1 THR 10 HG1 THR 10 -15.793 -20.576 0.410 56 1HG2 THR 10 HG21 THR 10 -17.202 -17.360 -0.156 57 2HG2 THR 10 HG22 THR 10 -17.039 -18.513 1.169 58 3HG2 THR 10 HG23 THR 10 -18.492 -18.518 0.169 59 HA PRO 11 HA PRO 11 -16.714 -23.278 -4.157 60 1HB PRO 11 HB2 PRO 11 -17.431 -22.269 -6.553 61 2HB PRO 11 HB1 PRO 11 -18.594 -23.049 -5.473 62 1HG PRO 11 HG2 PRO 11 -18.073 -20.132 -5.912 63 2HG PRO 11 HG1 PRO 11 -19.623 -20.981 -5.763 64 1HD PRO 11 HD2 PRO 11 -18.471 -19.602 -3.714 65 2HD PRO 11 HD1 PRO 11 -19.528 -21.006 -3.468 66 H ALA 12 HN ALA 12 -15.181 -23.357 -6.027 67 HA ALA 12 HA ALA 12 -13.172 -21.243 -5.727 68 1HB ALA 12 HB1 ALA 12 -12.324 -23.430 -5.270 69 2HB ALA 12 HB2 ALA 12 -11.641 -22.891 -6.804 70 3HB ALA 12 HB3 ALA 12 -12.966 -24.054 -6.789 71 H VAL 13 HN VAL 13 -15.456 -22.501 -7.948 72 HA VAL 13 HA VAL 13 -14.164 -21.167 -10.220 73 HB VAL 13 HB VAL 13 -16.704 -22.560 -10.717 74 1HG1 VAL 13 HG11 VAL 13 -15.604 -21.925 -12.640 75 2HG1 VAL 13 HG12 VAL 13 -15.090 -23.604 -12.480 76 3HG1 VAL 13 HG13 VAL 13 -14.012 -22.301 -11.981 77 1HG2 VAL 13 HG21 VAL 13 -15.087 -24.737 -10.729 78 2HG2 VAL 13 HG22 VAL 13 -16.218 -24.341 -9.434 79 3HG2 VAL 13 HG23 VAL 13 -14.518 -23.900 -9.284 80 H ARG 14 HN ARG 14 -15.300 -19.660 -11.502 81 HA ARG 14 HA ARG 14 -17.284 -18.136 -9.993 82 1HB ARG 14 HB2 ARG 14 -15.877 -17.366 -12.556 83 2HB ARG 14 HB1 ARG 14 -16.789 -16.306 -11.489 84 1HG ARG 14 HG2 ARG 14 -14.830 -15.783 -10.583 85 2HG ARG 14 HG1 ARG 14 -14.890 -17.372 -9.815 86 1HD ARG 14 HD1 ARG 14 -13.932 -17.906 -12.350 87 2HD ARG 14 HD2 ARG 14 -13.149 -16.385 -11.922 88 HE ARG 14 HE ARG 14 -12.848 -18.946 -10.536 89 1HH1 ARG 14 HH11 ARG 14 -11.976 -15.590 -10.884 90 2HH1 ARG 14 HH12 ARG 14 -10.562 -15.722 -9.892 91 1HH2 ARG 14 HH21 ARG 14 -10.989 -19.129 -9.229 92 2HH2 ARG 14 HH22 ARG 14 -10.001 -17.733 -8.952 93 H THR 15 HN THR 15 -17.881 -20.665 -11.450 94 HA THR 15 HA THR 15 -19.612 -19.775 -13.617 95 HB THR 15 HB THR 15 -19.417 -22.604 -12.621 96 HG1 THR 15 HG1 THR 15 -17.436 -21.090 -13.790 97 1HG2 THR 15 HG21 THR 15 -20.890 -22.707 -14.330 98 2HG2 THR 15 HG22 THR 15 -19.395 -22.829 -15.256 99 3HG2 THR 15 HG23 THR 15 -20.233 -21.282 -15.134 100 H VAL 16 HN VAL 16 -21.868 -20.407 -13.696 101 HA VAL 16 HA VAL 16 -23.114 -20.190 -11.056 102 HB VAL 16 HB VAL 16 -23.918 -18.520 -12.525 103 1HG1 VAL 16 HG21 VAL 16 -24.455 -20.694 -14.544 104 2HG1 VAL 16 HG22 VAL 16 -23.169 -19.490 -14.629 105 3HG1 VAL 16 HG23 VAL 16 -24.856 -18.987 -14.736 106 1HG2 VAL 16 HG11 VAL 16 -26.325 -19.758 -13.076 107 2HG2 VAL 16 HG12 VAL 16 -25.897 -18.917 -11.586 108 3HG2 VAL 16 HG13 VAL 16 -25.690 -20.665 -11.703 109 HA PRO 17 HA PRO 17 -23.930 -24.607 -11.580 110 1HB PRO 17 HB2 PRO 17 -24.761 -24.519 -8.787 111 2HB PRO 17 HB1 PRO 17 -23.404 -25.378 -9.517 112 1HG PRO 17 HG1 PRO 17 -23.077 -23.248 -7.873 113 2HG PRO 17 HG2 PRO 17 -21.950 -23.632 -9.187 114 1HD PRO 17 HD2 PRO 17 -24.142 -21.590 -9.106 115 2HD PRO 17 HD1 PRO 17 -22.501 -21.455 -9.775 116 H GLN 18 HN GLN 18 -26.064 -23.408 -9.034 117 HA GLN 18 HA GLN 18 -28.350 -24.527 -10.404 118 1HB GLN 18 HB2 GLN 18 -29.578 -23.797 -8.338 119 2HB GLN 18 HB1 GLN 18 -28.244 -24.906 -8.046 120 1HG GLN 18 HG1 GLN 18 -26.963 -22.564 -7.759 121 2HG GLN 18 HG2 GLN 18 -28.584 -22.093 -7.247 122 1HE2 GLN 18 HE21 GLN 18 -27.321 -21.751 -5.220 123 2HE2 GLN 18 HE22 GLN 18 -27.193 -23.085 -4.130 124 H TYR 19 HN TYR 19 -30.457 -23.098 -10.082 125 HA TYR 19 HA TYR 19 -30.137 -20.871 -11.839 126 1HB TYR 19 HB2 TYR 19 -32.151 -22.510 -11.569 127 2HB TYR 19 HB1 TYR 19 -32.653 -21.408 -10.291 128 HD1 TYR 19 HD1 TYR 19 -31.699 -21.459 -13.894 129 HD2 TYR 19 HD2 TYR 19 -33.901 -19.517 -10.814 130 HE1 TYR 19 HE1 TYR 19 -32.740 -19.991 -15.571 131 HE2 TYR 19 HE2 TYR 19 -34.947 -18.044 -12.482 132 HH TYR 19 HH TYR 19 -35.444 -18.213 -15.033 133 H LYS 20 HN LYS 20 -29.801 -18.804 -11.352 134 HA LYS 20 HA LYS 20 -29.548 -17.988 -8.609 135 1HB LYS 20 HB2 LYS 20 -29.432 -16.192 -11.030 136 2HB LYS 20 HB1 LYS 20 -28.683 -15.939 -9.459 137 1HG LYS 20 HG1 LYS 20 -27.304 -18.013 -9.949 138 2HG LYS 20 HG2 LYS 20 -27.891 -17.878 -11.607 139 1HD LYS 20 HD2 LYS 20 -26.711 -15.470 -10.313 140 2HD LYS 20 HD1 LYS 20 -25.627 -16.752 -10.860 141 1HE LYS 20 HE2 LYS 20 -26.023 -16.339 -13.046 142 2HE LYS 20 HE1 LYS 20 -27.713 -15.918 -12.771 143 1HZ LYS 20 HZ1 LYS 20 -25.688 -14.171 -13.291 144 2HZ LYS 20 HZ2 LYS 20 -25.919 -14.012 -11.624 145 3HZ LYS 20 HZ3 LYS 20 -27.215 -13.769 -12.682 146 H TYR 21 HN TYR 21 -30.469 -15.713 -8.055 147 HA TYR 21 HA TYR 21 -33.361 -15.907 -8.393 148 1HB TYR 21 HB1 TYR 21 -31.538 -14.751 -6.373 149 2HB TYR 21 HB2 TYR 21 -33.019 -13.847 -6.661 150 HD1 TYR 21 HD1 TYR 21 -34.931 -14.426 -5.491 151 HD2 TYR 21 HD2 TYR 21 -31.859 -17.329 -5.979 152 HE1 TYR 21 HE1 TYR 21 -36.166 -15.970 -4.029 153 HE2 TYR 21 HE2 TYR 21 -33.085 -18.881 -4.518 154 HH TYR 21 HH TYR 21 -34.869 -19.181 -3.233 155 H ALA 22 HN ALA 22 -34.576 -13.802 -8.566 156 HA ALA 22 HA ALA 22 -33.560 -12.354 -10.854 157 1HB ALA 22 HB1 ALA 22 -35.707 -11.874 -11.321 158 2HB ALA 22 HB2 ALA 22 -36.093 -11.475 -9.648 159 3HB ALA 22 HB3 ALA 22 -36.047 -13.161 -10.165 160 H ALA 23 HN ALA 23 -34.520 -11.610 -7.520 161 HA ALA 23 HA ALA 23 -34.020 -8.831 -7.677 162 1HB ALA 23 HB1 ALA 23 -33.663 -9.995 -5.028 163 2HB ALA 23 HB2 ALA 23 -35.153 -10.503 -5.825 164 3HB ALA 23 HB3 ALA 23 -34.818 -8.787 -5.593 165 H GLY 24 HN GLY 24 -31.926 -11.515 -7.484 166 1HA GLY 24 HA1 GLY 24 -29.760 -10.189 -6.135 167 2HA GLY 24 HA2 GLY 24 -29.679 -11.734 -6.967 168 H VAL 25 HN VAL 25 -29.718 -8.234 -7.471 169 HA VAL 25 HA VAL 25 -28.616 -8.580 -10.155 170 HB VAL 25 HB VAL 25 -28.955 -5.856 -9.047 171 1HG1 VAL 25 HG21 VAL 25 -30.139 -6.763 -11.607 172 2HG1 VAL 25 HG22 VAL 25 -28.380 -6.773 -11.477 173 3HG1 VAL 25 HG23 VAL 25 -29.274 -5.275 -11.220 174 1HG2 VAL 25 HG11 VAL 25 -31.485 -6.289 -9.914 175 2HG2 VAL 25 HG12 VAL 25 -30.996 -6.308 -8.219 176 3HG2 VAL 25 HG13 VAL 25 -31.137 -7.822 -9.115 177 H ARG 26 HN ARG 26 -27.676 -7.663 -6.945 178 HA ARG 26 HA ARG 26 -25.140 -6.546 -7.824 179 1HB ARG 26 HB2 ARG 26 -26.599 -6.747 -5.228 180 2HB ARG 26 HB1 ARG 26 -24.850 -6.566 -5.183 181 1HG ARG 26 HG1 ARG 26 -24.907 -4.447 -6.062 182 2HG ARG 26 HG2 ARG 26 -26.456 -4.706 -6.868 183 1HD ARG 26 HD2 ARG 26 -26.859 -3.226 -5.057 184 2HD ARG 26 HD1 ARG 26 -27.514 -4.796 -4.595 185 HE ARG 26 HE ARG 26 -24.834 -4.444 -3.684 186 1HH1 ARG 26 HH11 ARG 26 -28.154 -3.640 -2.998 187 2HH1 ARG 26 HH12 ARG 26 -27.888 -3.433 -1.300 188 1HH2 ARG 26 HH21 ARG 26 -24.474 -4.173 -1.450 189 2HH2 ARG 26 HH22 ARG 26 -25.796 -3.736 -0.419 190 H ASN 27 HN ASN 27 -25.892 -9.433 -8.190 191 HA ASN 27 HA ASN 27 -24.265 -10.951 -6.409 192 1HB ASN 27 HB2 ASN 27 -26.049 -11.485 -8.631 193 2HB ASN 27 HB1 ASN 27 -24.597 -12.476 -8.726 194 1HD2 ASN 27 HD21 ASN 27 -26.875 -11.343 -6.247 195 2HD2 ASN 27 HD22 ASN 27 -27.034 -12.871 -5.457 196 HA PRO 28 HA PRO 28 -21.121 -11.047 -10.067 197 1HB PRO 28 HB1 PRO 28 -21.376 -9.217 -12.043 198 2HB PRO 28 HB2 PRO 28 -22.171 -10.795 -12.098 199 1HG PRO 28 HG2 PRO 28 -23.295 -8.129 -11.324 200 2HG PRO 28 HG1 PRO 28 -24.015 -9.394 -12.337 201 1HD PRO 28 HD2 PRO 28 -24.678 -9.039 -9.728 202 2HD PRO 28 HD1 PRO 28 -24.710 -10.626 -10.521 203 H GLN 29 HN GLN 29 -19.837 -10.232 -8.382 204 HA GLN 29 HA GLN 29 -19.569 -7.375 -8.019 205 1HB GLN 29 HB2 GLN 29 -18.960 -9.720 -6.499 206 2HB GLN 29 HB1 GLN 29 -17.488 -8.775 -6.682 207 1HG GLN 29 HG1 GLN 29 -18.192 -7.195 -5.279 208 2HG GLN 29 HG2 GLN 29 -19.807 -7.158 -5.985 209 1HE2 GLN 29 HE21 GLN 29 -17.949 -8.083 -3.342 210 2HE2 GLN 29 HE22 GLN 29 -19.137 -9.026 -2.513 211 H GLN 30 HN GLN 30 -18.721 -6.552 -9.907 212 HA GLN 30 HA GLN 30 -16.442 -7.688 -11.201 213 1HB GLN 30 HB1 GLN 30 -17.345 -4.841 -11.554 214 2HB GLN 30 HB2 GLN 30 -16.599 -5.912 -12.732 215 1HG GLN 30 HG2 GLN 30 -19.261 -6.638 -11.623 216 2HG GLN 30 HG1 GLN 30 -19.157 -5.353 -12.825 217 1HE2 GLN 30 HE21 GLN 30 -17.165 -6.261 -14.451 218 2HE2 GLN 30 HE22 GLN 30 -17.663 -7.719 -15.232 219 H HIS 31 HN HIS 31 -16.652 -4.344 -10.041 220 HA HIS 31 HA HIS 31 -15.133 -2.986 -9.033 221 1HB HIS 31 HB1 HIS 31 -15.270 -5.406 -7.490 222 2HB HIS 31 HB2 HIS 31 -13.631 -4.766 -7.429 223 HD2 HIS 31 HD2 HIS 31 -14.031 -4.046 -4.753 224 HE1 HIS 31 HE1 HIS 31 -16.794 -0.973 -5.667 225 HE2 HIS 31 HE2 HIS 31 -15.342 -1.994 -3.856 226 H LEU 32 HN LEU 32 -14.383 -4.413 -11.517 227 HA LEU 32 HA LEU 32 -11.555 -4.930 -11.302 228 1HB LEU 32 HB2 LEU 32 -13.451 -4.779 -13.640 229 2HB LEU 32 HB1 LEU 32 -11.731 -5.065 -13.831 230 HG LEU 32 HG LEU 32 -12.968 -6.894 -11.922 231 1HD1 LEU 32 HD11 LEU 32 -14.464 -6.310 -14.259 232 2HD1 LEU 32 HD12 LEU 32 -14.757 -7.556 -13.047 233 3HD1 LEU 32 HD13 LEU 32 -13.751 -7.912 -14.451 234 1HD2 LEU 32 HD21 LEU 32 -11.053 -7.849 -12.537 235 2HD2 LEU 32 HD22 LEU 32 -10.920 -6.840 -13.976 236 3HD2 LEU 32 HD23 LEU 32 -11.883 -8.316 -14.022 237 H ASN 33 HN ASN 33 -13.382 -2.658 -13.356 238 HA ASN 33 HA ASN 33 -11.070 -0.887 -13.419 239 1HB ASN 33 HB2 ASN 33 -13.690 -0.887 -14.926 240 2HB ASN 33 HB1 ASN 33 -12.485 0.388 -15.085 241 1HD2 ASN 33 HD21 ASN 33 -10.160 -0.740 -15.291 242 2HD2 ASN 33 HD22 ASN 33 -10.080 -1.872 -16.594 243 H ALA 34 HN ALA 34 -11.648 1.539 -13.372 244 HA ALA 34 HA ALA 34 -12.722 2.098 -10.780 245 1HB ALA 34 HB1 ALA 34 -11.847 4.208 -11.012 246 2HB ALA 34 HB2 ALA 34 -12.148 4.260 -12.749 247 3HB ALA 34 HB3 ALA 34 -10.816 3.295 -12.114 248 H GLN 35 HN GLN 35 -14.721 2.698 -10.235 249 HA GLN 35 HA GLN 35 -16.723 2.922 -12.321 250 1HB GLN 35 HB2 GLN 35 -17.006 2.893 -9.312 251 2HB GLN 35 HB1 GLN 35 -18.345 2.894 -10.452 252 1HG GLN 35 HG2 GLN 35 -17.376 0.755 -11.389 253 2HG GLN 35 HG1 GLN 35 -16.317 0.734 -9.979 254 1HE2 GLN 35 HE21 GLN 35 -19.635 0.575 -11.068 255 2HE2 GLN 35 HE22 GLN 35 -20.272 -0.161 -9.641 256 HA PRO 36 HA PRO 36 -17.274 7.234 -10.214 257 1HB PRO 36 HB1 PRO 36 -15.292 8.150 -8.621 258 2HB PRO 36 HB2 PRO 36 -16.635 7.183 -8.003 259 1HG PRO 36 HG1 PRO 36 -13.853 6.327 -8.713 260 2HG PRO 36 HG2 PRO 36 -14.830 5.891 -7.298 261 1HD PRO 36 HD2 PRO 36 -14.557 4.261 -9.447 262 2HD PRO 36 HD1 PRO 36 -16.031 4.305 -8.460 263 H GLN 37 HN GLN 37 -15.808 9.411 -10.205 264 HA GLN 37 HA GLN 37 -14.385 9.310 -12.754 265 1HB GLN 37 HB1 GLN 37 -15.342 11.670 -11.123 266 2HB GLN 37 HB2 GLN 37 -14.578 11.775 -12.703 267 1HG GLN 37 HG2 GLN 37 -16.804 9.971 -12.804 268 2HG GLN 37 HG1 GLN 37 -17.301 11.520 -12.125 269 1HE2 GLN 37 HE21 GLN 37 -17.351 9.932 -14.858 270 2HE2 GLN 37 HE22 GLN 37 -17.098 11.200 -16.004 271 H VAL 38 HN VAL 38 -12.246 9.316 -12.847 272 HA VAL 38 HA VAL 38 -10.710 9.867 -10.430 273 HB VAL 38 HB VAL 38 -9.619 8.905 -13.069 274 1HG1 VAL 38 HG11 VAL 38 -8.056 7.777 -11.251 275 2HG1 VAL 38 HG12 VAL 38 -8.597 9.155 -10.293 276 3HG1 VAL 38 HG13 VAL 38 -7.775 9.419 -11.830 277 1HG2 VAL 38 HG21 VAL 38 -11.182 7.461 -11.019 278 2HG2 VAL 38 HG22 VAL 38 -9.740 6.651 -11.629 279 3HG2 VAL 38 HG23 VAL 38 -11.011 7.149 -12.746 280 H THR 39 HN THR 39 -11.289 11.181 -13.611 281 HA THR 39 HA THR 39 -9.090 13.039 -13.500 282 HB THR 39 HB THR 39 -11.442 13.225 -15.371 283 HG1 THR 39 HG1 THR 39 -9.169 11.573 -15.731 284 1HG2 THR 39 HG21 THR 39 -8.591 13.640 -16.121 285 2HG2 THR 39 HG22 THR 39 -9.482 14.919 -15.296 286 3HG2 THR 39 HG23 THR 39 -10.056 14.302 -16.845 287 H MET 40 HN MET 40 -12.260 12.930 -12.281 288 HA MET 40 HA MET 40 -12.491 15.840 -12.121 289 1HB MET 40 HB2 MET 40 -14.405 14.154 -12.726 290 2HB MET 40 HB1 MET 40 -14.511 13.940 -10.985 291 1HG MET 40 HG1 MET 40 -14.940 16.303 -10.690 292 2HG MET 40 HG2 MET 40 -14.754 16.572 -12.422 293 1HE MET 40 HE1 MET 40 -16.988 17.857 -11.457 294 2HE MET 40 HE2 MET 40 -17.559 16.886 -10.099 295 3HE MET 40 HE3 MET 40 -18.577 17.094 -11.525 296 H GLN 41 HN GLN 41 -10.393 14.743 -10.644 297 HA GLN 41 HA GLN 41 -10.978 15.792 -8.057 298 1HB GLN 41 HB1 GLN 41 -11.781 13.252 -8.203 299 2HB GLN 41 HB2 GLN 41 -10.079 12.959 -7.872 300 1HG GLN 41 HG2 GLN 41 -10.302 13.496 -5.731 301 2HG GLN 41 HG1 GLN 41 -11.194 14.968 -6.111 302 1HE2 GLN 41 HE21 GLN 41 -11.924 11.554 -6.704 303 2HE2 GLN 41 HE22 GLN 41 -13.427 11.548 -5.853 304 H GLN 42 HN GLN 42 -9.230 17.121 -8.612 305 HA GLN 42 HA GLN 42 -7.061 17.796 -8.696 306 1HB GLN 42 HB2 GLN 42 -7.007 15.441 -6.867 307 2HB GLN 42 HB1 GLN 42 -5.469 16.107 -7.401 308 1HG GLN 42 HG1 GLN 42 -5.612 17.715 -5.896 309 2HG GLN 42 HG2 GLN 42 -7.147 18.250 -6.578 310 1HE2 GLN 42 HE21 GLN 42 -5.707 17.270 -3.827 311 2HE2 GLN 42 HE22 GLN 42 -7.074 16.651 -2.973 312 HA PRO 43 HA PRO 43 -6.218 15.351 -12.509 313 1HB PRO 43 HB2 PRO 43 -4.642 17.847 -12.925 314 2HB PRO 43 HB1 PRO 43 -5.694 16.979 -14.049 315 1HG PRO 43 HG2 PRO 43 -6.513 19.232 -12.893 316 2HG PRO 43 HG1 PRO 43 -7.630 17.876 -13.132 317 1HD PRO 43 HD2 PRO 43 -6.281 18.810 -10.639 318 2HD PRO 43 HD1 PRO 43 -7.901 18.117 -10.855 319 H ALA 44 HN ALA 44 -4.446 14.150 -13.050 320 HA ALA 44 HA ALA 44 -2.265 14.121 -11.146 321 1HB ALA 44 HB1 ALA 44 -3.510 12.225 -12.895 322 2HB ALA 44 HB2 ALA 44 -2.402 11.946 -11.551 323 3HB ALA 44 HB3 ALA 44 -1.768 12.241 -13.171 324 H VAL 45 HN VAL 45 -1.165 16.050 -11.634 325 HA VAL 45 HA VAL 45 0.124 16.174 -14.272 326 HB VAL 45 HB VAL 45 0.778 18.520 -13.456 327 1HG1 VAL 45 HG11 VAL 45 -0.738 18.847 -15.066 328 2HG1 VAL 45 HG12 VAL 45 -1.891 19.088 -13.754 329 3HG1 VAL 45 HG13 VAL 45 -1.739 17.504 -14.514 330 1HG2 VAL 45 HG21 VAL 45 -0.894 19.456 -11.817 331 2HG2 VAL 45 HG22 VAL 45 0.323 18.376 -11.137 332 3HG2 VAL 45 HG23 VAL 45 -1.315 17.788 -11.426 333 H HIS 46 HN HIS 46 2.276 17.816 -13.571 334 HA HIS 46 HA HIS 46 4.076 15.851 -12.472 335 1HB HIS 46 HB1 HIS 46 4.320 18.434 -13.899 336 2HB HIS 46 HB2 HIS 46 5.627 18.050 -12.784 337 HD2 HIS 46 HD2 HIS 46 3.853 16.189 -15.791 338 HE1 HIS 46 HE1 HIS 46 7.977 15.239 -15.686 339 HE2 HIS 46 HE2 HIS 46 5.795 14.904 -16.935 340 H VAL 47 HN VAL 47 2.940 15.869 -10.348 341 HA VAL 47 HA VAL 47 3.690 18.149 -8.657 342 HB VAL 47 HB VAL 47 2.154 17.113 -6.974 343 1HG1 VAL 47 HG11 VAL 47 0.810 18.665 -7.824 344 2HG1 VAL 47 HG12 VAL 47 0.155 17.431 -8.901 345 3HG1 VAL 47 HG13 VAL 47 1.492 18.449 -9.435 346 1HG2 VAL 47 HG21 VAL 47 2.299 14.912 -8.691 347 2HG2 VAL 47 HG22 VAL 47 0.653 15.524 -8.846 348 3HG2 VAL 47 HG23 VAL 47 1.284 15.087 -7.259 349 H GLN 48 HN GLN 48 4.204 17.480 -6.322 350 HA GLN 48 HA GLN 48 6.478 15.700 -6.426 351 1HB GLN 48 HB1 GLN 48 5.810 17.983 -4.962 352 2HB GLN 48 HB2 GLN 48 5.800 16.683 -3.778 353 1HG GLN 48 HG2 GLN 48 8.020 16.475 -3.811 354 2HG GLN 48 HG1 GLN 48 8.102 16.616 -5.567 355 1HE2 GLN 48 HE21 GLN 48 8.898 18.419 -6.395 356 2HE2 GLN 48 HE22 GLN 48 9.173 19.890 -5.530 357 H GLY 49 HN GLY 49 6.168 15.028 -3.521 358 1HA GLY 49 HA2 GLY 49 4.921 12.486 -3.888 359 2HA GLY 49 HA1 GLY 49 5.565 13.119 -2.380 360 H GLN 50 HN GLN 50 2.837 12.039 -3.800 361 HA GLN 50 HA GLN 50 1.030 13.906 -2.459 362 1HB GLN 50 HB1 GLN 50 -0.727 12.408 -3.621 363 2HB GLN 50 HB2 GLN 50 0.245 13.487 -4.614 364 1HG GLN 50 HG1 GLN 50 1.651 11.679 -5.310 365 2HG GLN 50 HG2 GLN 50 0.861 10.574 -4.185 366 1HE2 GLN 50 HE21 GLN 50 -0.055 12.838 -6.763 367 2HE2 GLN 50 HE22 GLN 50 -1.186 11.777 -7.526 368 H GLU 51 HN GLU 51 -0.948 12.823 -1.435 369 HA GLU 51 HA GLU 51 -0.087 11.330 0.802 370 1HB GLU 51 HB1 GLU 51 -2.590 11.097 1.215 371 2HB GLU 51 HB2 GLU 51 -1.966 12.736 1.107 372 1HG GLU 51 HG2 GLU 51 -3.522 13.156 -0.405 373 2HG GLU 51 HG1 GLU 51 -2.683 12.057 -1.499 374 HA PRO 52 HA PRO 52 -1.375 10.072 2.231 375 1HB PRO 52 HB2 PRO 52 -1.230 7.764 3.556 376 2HB PRO 52 HB1 PRO 52 -2.679 8.193 2.640 377 1HG PRO 52 HG2 PRO 52 -0.477 6.305 1.938 378 2HG PRO 52 HG1 PRO 52 -2.216 6.164 1.630 379 1HD PRO 52 HD1 PRO 52 -0.292 7.028 -0.207 380 2HD PRO 52 HD2 PRO 52 -2.044 7.256 -0.353 381 H LEU 53 HN LEU 53 -0.002 8.729 4.291 382 HA LEU 53 HA LEU 53 2.606 9.821 4.004 383 1HB LEU 53 HB2 LEU 53 1.010 9.100 6.113 384 2HB LEU 53 HB1 LEU 53 2.221 7.834 6.134 385 HG LEU 53 HG LEU 53 3.795 10.047 5.916 386 1HD1 LEU 53 HD21 LEU 53 2.796 11.914 6.566 387 2HD1 LEU 53 HD22 LEU 53 2.245 11.137 8.052 388 3HD1 LEU 53 HD23 LEU 53 1.257 11.053 6.593 389 1HD2 LEU 53 HD11 LEU 53 2.965 9.352 8.665 390 2HD2 LEU 53 HD12 LEU 53 4.576 9.424 7.943 391 3HD2 LEU 53 HD13 LEU 53 3.538 8.027 7.650 392 H THR 54 HN THR 54 4.626 8.718 4.045 393 HA THR 54 HA THR 54 4.776 5.886 3.733 394 HB THR 54 HB THR 54 5.927 7.114 1.327 395 HG1 THR 54 HG1 THR 54 4.147 7.786 0.427 396 1HG2 THR 54 HG21 THR 54 4.597 5.180 0.296 397 2HG2 THR 54 HG22 THR 54 4.359 4.657 1.964 398 3HG2 THR 54 HG23 THR 54 5.992 4.805 1.311 399 H ALA 55 HN ALA 55 7.154 5.420 2.755 400 HA ALA 55 HA ALA 55 8.968 6.136 4.686 401 1HB ALA 55 HB1 ALA 55 9.634 5.478 1.823 402 2HB ALA 55 HB2 ALA 55 9.288 4.299 3.088 403 3HB ALA 55 HB3 ALA 55 10.711 5.335 3.213 404 H SER 56 HN SER 56 8.242 7.787 1.660 405 HA SER 56 HA SER 56 10.354 9.641 1.694 406 1HB SER 56 HB1 SER 56 7.600 10.218 0.603 407 2HB SER 56 HB2 SER 56 9.150 10.837 0.033 408 HG SER 56 HG SER 56 7.902 8.433 -0.491 409 H MET 57 HN MET 57 7.069 9.795 3.017 410 HA MET 57 HA MET 57 7.187 12.424 4.007 411 1HB MET 57 HB1 MET 57 5.601 9.994 4.826 412 2HB MET 57 HB2 MET 57 5.443 11.523 5.674 413 1HG MET 57 HG1 MET 57 3.908 10.770 3.595 414 2HG MET 57 HG2 MET 57 4.206 12.444 4.057 415 1HE MET 57 HE1 MET 57 6.121 9.719 1.326 416 2HE MET 57 HE2 MET 57 4.872 10.381 0.271 417 3HE MET 57 HE3 MET 57 4.431 9.683 1.830 418 H LEU 58 HN LEU 58 8.030 9.314 5.437 419 HA LEU 58 HA LEU 58 8.664 10.169 8.021 420 1HB LEU 58 HB1 LEU 58 9.645 7.895 6.314 421 2HB LEU 58 HB2 LEU 58 10.226 8.124 7.951 422 HG LEU 58 HG LEU 58 8.493 6.976 8.734 423 1HD1 LEU 58 HD11 LEU 58 7.219 8.976 8.979 424 2HD1 LEU 58 HD12 LEU 58 6.141 7.729 8.351 425 3HD1 LEU 58 HD13 LEU 58 6.776 8.971 7.271 426 1HD2 LEU 58 HD21 LEU 58 7.244 5.623 7.303 427 2HD2 LEU 58 HD22 LEU 58 8.729 5.948 6.406 428 3HD2 LEU 58 HD23 LEU 58 7.248 6.825 6.013 429 H ALA 59 HN ALA 59 10.680 9.849 5.130 430 HA ALA 59 HA ALA 59 13.078 10.734 6.391 431 1HB ALA 59 HB1 ALA 59 13.294 9.359 4.471 432 2HB ALA 59 HB2 ALA 59 13.904 10.954 4.027 433 3HB ALA 59 HB3 ALA 59 12.299 10.444 3.499 434 H SER 60 HN SER 60 10.307 12.367 5.462 435 HA SER 60 HA SER 60 11.565 14.832 4.646 436 1HB SER 60 HB1 SER 60 9.274 14.029 3.871 437 2HB SER 60 HB2 SER 60 8.683 14.468 5.474 438 HG SER 60 HG SER 60 10.115 16.310 3.892 439 H ALA 61 HN ALA 61 11.085 13.303 7.564 440 HA ALA 61 HA ALA 61 11.439 15.834 9.015 441 1HB ALA 61 HB1 ALA 61 9.380 15.574 9.846 442 2HB ALA 61 HB2 ALA 61 10.089 14.294 10.830 443 3HB ALA 61 HB3 ALA 61 9.278 13.895 9.316 444 HA PRO 62 HA PRO 62 14.676 12.416 9.812 445 1HB PRO 62 HB1 PRO 62 16.366 14.860 9.630 446 2HB PRO 62 HB2 PRO 62 16.674 13.226 9.032 447 1HG PRO 62 HG1 PRO 62 15.953 15.175 7.363 448 2HG PRO 62 HG2 PRO 62 15.345 13.523 7.153 449 1HD PRO 62 HD2 PRO 62 13.954 15.934 8.228 450 2HD PRO 62 HD1 PRO 62 13.308 14.594 7.259 451 HA PRO 63 HA PRO 63 15.624 14.773 13.775 452 1HB PRO 63 HB2 PRO 63 15.616 17.429 13.942 453 2HB PRO 63 HB1 PRO 63 16.884 16.589 13.044 454 1HG PRO 63 HG1 PRO 63 14.547 18.123 12.039 455 2HG PRO 63 HG2 PRO 63 16.150 17.914 11.315 456 1HD PRO 63 HD1 PRO 63 13.767 16.485 10.687 457 2HD PRO 63 HD2 PRO 63 15.401 16.180 10.069 458 H GLN 64 HN GLN 64 12.740 14.763 12.443 459 HA GLN 64 HA GLN 64 11.404 15.887 14.813 460 1HB GLN 64 HB2 GLN 64 10.177 15.845 12.061 461 2HB GLN 64 HB1 GLN 64 9.611 16.707 13.484 462 1HG GLN 64 HG2 GLN 64 12.065 17.785 13.205 463 2HG GLN 64 HG1 GLN 64 11.671 17.434 11.523 464 1HE2 GLN 64 HE22 GLN 64 10.552 18.903 10.466 465 2HE2 GLN 64 HE21 GLN 64 9.604 20.162 11.173 466 H GLU 65 HN GLU 65 9.675 14.337 12.217 467 HA GLU 65 HA GLU 65 8.989 12.163 14.062 468 1HB GLU 65 HB1 GLU 65 7.307 12.374 11.706 469 2HB GLU 65 HB2 GLU 65 6.858 12.407 13.406 470 1HG GLU 65 HG1 GLU 65 8.128 14.870 12.609 471 2HG GLU 65 HG2 GLU 65 6.741 14.504 11.588 472 H GLN 66 HN GLN 66 11.402 11.961 12.581 473 HA GLN 66 HA GLN 66 11.153 10.509 10.193 474 1HB GLN 66 HB1 GLN 66 13.252 11.484 11.591 475 2HB GLN 66 HB2 GLN 66 13.391 9.776 11.986 476 1HG GLN 66 HG2 GLN 66 13.056 9.580 9.343 477 2HG GLN 66 HG1 GLN 66 13.801 11.175 9.423 478 1HE2 GLN 66 HE22 GLN 66 14.213 7.915 10.759 479 2HE2 GLN 66 HE21 GLN 66 15.937 7.904 10.654 480 H LYS 67 HN LYS 67 11.535 9.379 13.534 481 HA LYS 67 HA LYS 67 10.445 6.774 12.693 482 1HB LYS 67 HB1 LYS 67 12.316 7.240 15.019 483 2HB LYS 67 HB2 LYS 67 11.780 5.693 14.380 484 1HG LYS 67 HG1 LYS 67 12.917 6.727 12.177 485 2HG LYS 67 HG2 LYS 67 13.890 7.509 13.426 486 1HD LYS 67 HD2 LYS 67 13.945 5.055 14.412 487 2HD LYS 67 HD1 LYS 67 13.652 4.629 12.724 488 1HE LYS 67 HE2 LYS 67 15.614 5.988 12.082 489 2HE LYS 67 HE1 LYS 67 15.926 6.299 13.788 490 1HZ LYS 67 HZ1 LYS 67 15.829 3.670 13.840 491 2HZ LYS 67 HZ2 LYS 67 17.257 4.511 13.502 492 3HZ LYS 67 HZ3 LYS 67 16.338 3.864 12.238 493 H GLN 68 HN GLN 68 8.851 8.978 13.447 494 HA GLN 68 HA GLN 68 7.738 7.985 15.983 495 1HB GLN 68 HB2 GLN 68 8.876 10.189 16.240 496 2HB GLN 68 HB1 GLN 68 7.757 10.864 15.064 497 1HG GLN 68 HG1 GLN 68 5.896 10.479 16.520 498 2HG GLN 68 HG2 GLN 68 6.914 9.599 17.660 499 1HE2 GLN 68 HE21 GLN 68 5.822 11.283 19.052 500 2HE2 GLN 68 HE22 GLN 68 6.665 12.775 19.265 501 H MET 69 HN MET 69 6.908 10.027 13.169 502 HA MET 69 HA MET 69 4.117 9.495 13.431 503 1HB MET 69 HB2 MET 69 3.846 10.812 11.443 504 2HB MET 69 HB1 MET 69 5.066 11.581 12.448 505 1HG MET 69 HG2 MET 69 6.780 11.065 11.010 506 2HG MET 69 HG1 MET 69 5.919 9.696 10.307 507 1HE MET 69 HE1 MET 69 6.609 13.379 8.192 508 2HE MET 69 HE2 MET 69 7.466 11.849 8.383 509 3HE MET 69 HE3 MET 69 7.287 12.938 9.760 510 H LEU 70 HN LEU 70 6.488 7.475 12.471 511 HA LEU 70 HA LEU 70 5.502 6.376 10.072 512 1HB LEU 70 HB1 LEU 70 6.713 4.238 11.256 513 2HB LEU 70 HB2 LEU 70 7.519 5.450 10.291 514 HG LEU 70 HG LEU 70 8.286 6.620 12.246 515 1HD1 LEU 70 HD21 LEU 70 7.807 5.879 14.503 516 2HD1 LEU 70 HD22 LEU 70 6.772 4.594 13.885 517 3HD1 LEU 70 HD23 LEU 70 6.307 6.280 13.666 518 1HD2 LEU 70 HD11 LEU 70 9.704 4.838 11.578 519 2HD2 LEU 70 HD12 LEU 70 8.677 3.642 12.369 520 3HD2 LEU 70 HD13 LEU 70 9.605 4.788 13.338 521 H GLY 71 HN GLY 71 4.834 5.572 13.462 522 1HA GLY 71 HA2 GLY 71 2.565 3.979 12.489 523 2HA GLY 71 HA1 GLY 71 3.627 3.316 13.715 524 H GLU 72 HN GLU 72 2.838 6.706 13.668 525 HA GLU 72 HA GLU 72 0.830 6.337 15.765 526 1HB GLU 72 HB2 GLU 72 1.982 7.408 17.396 527 2HB GLU 72 HB1 GLU 72 3.375 6.880 16.465 528 1HG GLU 72 HG2 GLU 72 3.980 8.962 15.996 529 2HG GLU 72 HG1 GLU 72 2.344 9.422 15.531 530 H ARG 73 HN ARG 73 1.738 7.737 12.927 531 HA ARG 73 HA ARG 73 -0.262 9.880 13.217 532 1HB ARG 73 HB1 ARG 73 1.951 10.880 13.100 533 2HB ARG 73 HB2 ARG 73 2.335 9.942 11.668 534 1HG ARG 73 HG2 ARG 73 1.764 11.831 10.603 535 2HG ARG 73 HG1 ARG 73 0.125 11.208 10.809 536 1HD ARG 73 HD1 ARG 73 1.334 12.875 12.965 537 2HD ARG 73 HD2 ARG 73 0.722 13.658 11.508 538 HE ARG 73 HE ARG 73 -1.217 11.880 12.508 539 1HH1 ARG 73 HH21 ARG 73 0.279 14.938 13.259 540 2HH1 ARG 73 HH22 ARG 73 -1.101 15.548 14.108 541 1HH2 ARG 73 HH11 ARG 73 -3.036 12.677 13.623 542 2HH2 ARG 73 HH12 ARG 73 -2.985 14.264 14.315 543 H LEU 74 HN LEU 74 1.082 7.283 11.416 544 HA LEU 74 HA LEU 74 -0.328 7.747 8.971 545 1HB LEU 74 HB1 LEU 74 1.485 5.759 10.083 546 2HB LEU 74 HB2 LEU 74 0.229 5.040 9.093 547 HG LEU 74 HG LEU 74 1.663 7.375 7.980 548 1HD1 LEU 74 HD11 LEU 74 3.279 5.704 9.147 549 2HD1 LEU 74 HD12 LEU 74 3.634 6.291 7.519 550 3HD1 LEU 74 HD13 LEU 74 2.928 4.690 7.746 551 1HD2 LEU 74 HD21 LEU 74 1.287 6.244 5.916 552 2HD2 LEU 74 HD22 LEU 74 -0.210 6.159 6.849 553 3HD2 LEU 74 HD23 LEU 74 0.849 4.752 6.750 554 H PHE 75 HN PHE 75 -0.988 6.105 11.947 555 HA PHE 75 HA PHE 75 -2.827 4.226 11.411 556 1HB PHE 75 HB2 PHE 75 -2.012 5.578 13.649 557 2HB PHE 75 HB1 PHE 75 -3.705 6.015 13.560 558 HD1 PHE 75 HD1 PHE 75 -3.806 4.861 15.793 559 HD2 PHE 75 HD2 PHE 75 -2.949 2.795 12.172 560 HE1 PHE 75 HE1 PHE 75 -4.388 2.733 16.876 561 HE2 PHE 75 HE2 PHE 75 -3.529 0.661 13.251 562 HZ PHE 75 HZ PHE 75 -4.249 0.630 15.606 563 HA PRO 76 HA PRO 76 -6.493 7.387 11.028 564 1HB PRO 76 HB1 PRO 76 -5.808 9.960 10.423 565 2HB PRO 76 HB2 PRO 76 -6.111 9.390 12.067 566 1HG PRO 76 HG1 PRO 76 -3.506 9.794 10.650 567 2HG PRO 76 HG2 PRO 76 -3.950 10.206 12.317 568 1HD PRO 76 HD2 PRO 76 -2.507 8.009 11.723 569 2HD PRO 76 HD1 PRO 76 -3.676 8.033 13.059 570 H LEU 77 HN LEU 77 -3.549 7.711 9.162 571 HA LEU 77 HA LEU 77 -4.921 8.359 6.712 572 1HB LEU 77 HB1 LEU 77 -2.057 7.672 7.346 573 2HB LEU 77 HB2 LEU 77 -2.621 7.973 5.714 574 HG LEU 77 HG LEU 77 -2.679 9.947 8.001 575 1HD1 LEU 77 HD11 LEU 77 -0.954 9.729 5.542 576 2HD1 LEU 77 HD12 LEU 77 -0.440 9.654 7.228 577 3HD1 LEU 77 HD13 LEU 77 -1.049 11.168 6.558 578 1HD2 LEU 77 HD21 LEU 77 -3.094 11.344 5.684 579 2HD2 LEU 77 HD22 LEU 77 -4.342 10.885 6.843 580 3HD2 LEU 77 HD23 LEU 77 -4.045 9.881 5.424 581 H ILE 78 HN ILE 78 -4.054 5.491 8.405 582 HA ILE 78 HA ILE 78 -3.910 3.729 6.163 583 HB ILE 78 HB ILE 78 -4.744 2.942 8.938 584 1HG1 ILE 78 HG12 ILE 78 -2.642 4.292 8.977 585 2HG1 ILE 78 HG11 ILE 78 -2.415 2.629 9.504 586 1HG2 ILE 78 HG21 ILE 78 -4.005 1.543 6.481 587 2HG2 ILE 78 HG22 ILE 78 -4.955 0.993 7.862 588 3HG2 ILE 78 HG23 ILE 78 -3.193 0.949 7.929 589 1HD1 ILE 78 HD11 ILE 78 -1.886 3.430 6.672 590 2HD1 ILE 78 HD12 ILE 78 -1.270 2.044 7.575 591 3HD1 ILE 78 HD13 ILE 78 -0.678 3.666 7.937 592 H GLN 79 HN GLN 79 -6.463 4.888 8.287 593 HA GLN 79 HA GLN 79 -8.555 3.190 7.579 594 1HB GLN 79 HB1 GLN 79 -8.268 5.851 8.750 595 2HB GLN 79 HB2 GLN 79 -9.740 5.692 7.803 596 1HG GLN 79 HG2 GLN 79 -10.455 3.821 9.124 597 2HG GLN 79 HG1 GLN 79 -8.922 3.802 9.996 598 1HE2 GLN 79 HE21 GLN 79 -8.468 6.311 10.692 599 2HE2 GLN 79 HE22 GLN 79 -9.736 6.940 11.682 600 H ALA 80 HN ALA 80 -6.817 5.350 5.690 601 HA ALA 80 HA ALA 80 -8.870 5.898 3.725 602 1HB ALA 80 HB1 ALA 80 -5.969 6.342 3.194 603 2HB ALA 80 HB2 ALA 80 -6.787 7.350 4.389 604 3HB ALA 80 HB3 ALA 80 -7.364 7.316 2.723 605 H MET 81 HN MET 81 -6.037 3.811 4.084 606 HA MET 81 HA MET 81 -6.188 2.739 1.426 607 1HB MET 81 HB1 MET 81 -4.888 1.276 3.695 608 2HB MET 81 HB2 MET 81 -4.386 1.385 2.014 609 1HG MET 81 HG2 MET 81 -3.196 3.252 2.357 610 2HG MET 81 HG1 MET 81 -4.364 3.923 3.489 611 1HE MET 81 HE1 MET 81 -1.018 1.203 3.689 612 2HE MET 81 HE2 MET 81 -0.392 2.755 4.260 613 3HE MET 81 HE3 MET 81 -1.261 2.663 2.726 614 H HIS 82 HN HIS 82 -7.150 1.660 4.637 615 HA HIS 82 HA HIS 82 -8.790 -0.454 3.412 616 1HB HIS 82 HB1 HIS 82 -7.337 -0.257 6.032 617 2HB HIS 82 HB2 HIS 82 -8.721 -1.330 5.883 618 HD2 HIS 82 HD2 HIS 82 -5.584 -0.817 3.529 619 HE1 HIS 82 HE1 HIS 82 -6.167 -4.929 4.327 620 HE2 HIS 82 HE2 HIS 82 -4.752 -3.231 3.081 621 HA PRO 83 HA PRO 83 -12.696 1.389 4.302 622 1HB PRO 83 HB1 PRO 83 -13.242 -0.726 6.269 623 2HB PRO 83 HB2 PRO 83 -14.104 -0.327 4.783 624 1HG PRO 83 HG2 PRO 83 -12.145 -2.393 5.216 625 2HG PRO 83 HG1 PRO 83 -13.075 -2.049 3.751 626 1HD PRO 83 HD1 PRO 83 -10.348 -1.723 3.984 627 2HD PRO 83 HD2 PRO 83 -11.365 -0.866 2.807 628 H THR 84 HN THR 84 -11.134 -0.048 7.153 629 HA THR 84 HA THR 84 -10.554 2.276 8.515 630 HB THR 84 HB THR 84 -13.005 2.662 8.563 631 HG1 THR 84 HG1 THR 84 -13.079 3.153 10.716 632 1HG2 THR 84 HG21 THR 84 -14.129 0.671 8.630 633 2HG2 THR 84 HG22 THR 84 -14.229 1.188 10.314 634 3HG2 THR 84 HG23 THR 84 -13.043 -0.027 9.832 635 H LEU 85 HN LEU 85 -9.941 -0.611 7.996 636 HA LEU 85 HA LEU 85 -10.036 -1.998 10.478 637 1HB LEU 85 HB1 LEU 85 -8.622 -2.411 7.871 638 2HB LEU 85 HB2 LEU 85 -8.204 -3.402 9.255 639 HG LEU 85 HG LEU 85 -11.012 -3.168 8.179 640 1HD1 LEU 85 HD21 LEU 85 -9.637 -4.097 6.432 641 2HD1 LEU 85 HD22 LEU 85 -10.604 -5.380 7.158 642 3HD1 LEU 85 HD23 LEU 85 -8.896 -5.224 7.568 643 1HD2 LEU 85 HD11 LEU 85 -10.190 -4.062 10.595 644 2HD2 LEU 85 HD12 LEU 85 -10.114 -5.548 9.648 645 3HD2 LEU 85 HD13 LEU 85 -11.627 -4.647 9.755 646 H ALA 86 HN ALA 86 -8.521 0.730 10.028 647 HA ALA 86 HA ALA 86 -5.834 0.124 10.817 648 1HB ALA 86 HB1 ALA 86 -5.980 2.086 9.598 649 2HB ALA 86 HB2 ALA 86 -5.832 2.678 11.252 650 3HB ALA 86 HB3 ALA 86 -7.409 2.643 10.467 651 H GLY 87 HN GLY 87 -7.496 -1.143 12.609 652 1HA GLY 87 HA2 GLY 87 -7.677 0.484 15.016 653 2HA GLY 87 HA1 GLY 87 -8.172 -1.197 14.851 654 H LYS 88 HN LYS 88 -5.365 -1.353 13.435 655 HA LYS 88 HA LYS 88 -3.404 -0.998 15.402 656 1HB LYS 88 HB1 LYS 88 -4.646 -2.789 16.564 657 2HB LYS 88 HB2 LYS 88 -4.427 -3.837 15.173 658 1HG LYS 88 HG2 LYS 88 -2.854 -4.425 16.895 659 2HG LYS 88 HG1 LYS 88 -1.993 -3.749 15.508 660 1HD LYS 88 HD1 LYS 88 -2.555 -1.553 17.114 661 2HD LYS 88 HD2 LYS 88 -2.094 -2.825 18.249 662 1HE LYS 88 HE1 LYS 88 -0.150 -3.222 16.542 663 2HE LYS 88 HE2 LYS 88 -0.506 -1.570 16.051 664 1HZ LYS 88 HZ1 LYS 88 -0.411 -1.356 18.732 665 2HZ LYS 88 HZ2 LYS 88 0.888 -1.033 17.697 666 3HZ LYS 88 HZ3 LYS 88 0.762 -2.541 18.454 667 H ILE 89 HN ILE 89 -3.863 -0.690 12.538 668 HA ILE 89 HA ILE 89 -2.206 -2.648 11.237 669 HB ILE 89 HB ILE 89 -3.225 -0.030 10.144 670 1HG1 ILE 89 HG12 ILE 89 -4.304 -2.848 9.836 671 2HG1 ILE 89 HG11 ILE 89 -5.023 -1.597 10.842 672 1HG2 ILE 89 HG21 ILE 89 -2.309 -0.565 8.149 673 2HG2 ILE 89 HG22 ILE 89 -2.558 -2.295 8.377 674 3HG2 ILE 89 HG23 ILE 89 -1.194 -1.492 9.154 675 1HD1 ILE 89 HD11 ILE 89 -4.622 -0.935 7.995 676 2HD1 ILE 89 HD12 ILE 89 -5.946 -0.526 9.084 677 3HD1 ILE 89 HD13 ILE 89 -5.856 -2.137 8.375 678 H THR 90 HN THR 90 -1.764 0.791 10.688 679 HA THR 90 HA THR 90 0.996 0.729 10.486 680 HB THR 90 HB THR 90 -1.078 2.693 10.542 681 HG1 THR 90 HG1 THR 90 1.563 3.149 9.698 682 1HG2 THR 90 HG21 THR 90 -0.515 4.016 12.246 683 2HG2 THR 90 HG22 THR 90 0.813 4.513 11.189 684 3HG2 THR 90 HG23 THR 90 1.082 3.276 12.421 685 H GLY 91 HN GLY 91 -1.018 1.204 13.347 686 1HA GLY 91 HA2 GLY 91 0.968 1.984 15.161 687 2HA GLY 91 HA1 GLY 91 -0.486 1.085 15.581 688 H MET 92 HN MET 92 0.155 -1.130 13.802 689 HA MET 92 HA MET 92 1.926 -2.561 15.577 690 1HB MET 92 HB2 MET 92 -0.025 -3.709 14.855 691 2HB MET 92 HB1 MET 92 0.341 -3.446 13.168 692 1HG MET 92 HG1 MET 92 2.229 -4.879 13.365 693 2HG MET 92 HG2 MET 92 1.998 -5.022 15.092 694 1HE MET 92 HE1 MET 92 0.054 -5.011 11.954 695 2HE MET 92 HE2 MET 92 -1.452 -5.654 12.612 696 3HE MET 92 HE3 MET 92 -0.382 -6.699 11.673 697 H LEU 93 HN LEU 93 2.050 -0.992 12.537 698 HA LEU 93 HA LEU 93 4.220 -2.339 11.379 699 1HB LEU 93 HB2 LEU 93 2.968 0.325 11.083 700 2HB LEU 93 HB1 LEU 93 4.552 0.093 10.378 701 HG LEU 93 HG LEU 93 2.768 -0.285 8.735 702 1HD1 LEU 93 HD11 LEU 93 4.689 -1.492 8.214 703 2HD1 LEU 93 HD12 LEU 93 3.420 -2.716 8.178 704 3HD1 LEU 93 HD13 LEU 93 4.486 -2.591 9.579 705 1HD2 LEU 93 HD21 LEU 93 1.614 -2.666 9.279 706 2HD2 LEU 93 HD22 LEU 93 0.875 -1.103 9.624 707 3HD2 LEU 93 HD23 LEU 93 1.722 -1.977 10.903 708 H LEU 94 HN LEU 94 4.077 -0.682 14.226 709 HA LEU 94 HA LEU 94 6.936 -0.001 14.149 710 1HB LEU 94 HB1 LEU 94 4.595 1.220 15.463 711 2HB LEU 94 HB2 LEU 94 6.017 1.077 16.474 712 HG LEU 94 HG LEU 94 5.717 3.271 15.228 713 1HD1 LEU 94 HD21 LEU 94 8.227 3.076 14.377 714 2HD1 LEU 94 HD22 LEU 94 8.153 1.591 15.323 715 3HD1 LEU 94 HD23 LEU 94 7.810 3.143 16.088 716 1HD2 LEU 94 HD11 LEU 94 6.463 1.508 12.899 717 2HD2 LEU 94 HD12 LEU 94 6.548 3.271 12.883 718 3HD2 LEU 94 HD13 LEU 94 4.991 2.463 13.087 719 H GLU 95 HN GLU 95 5.452 -2.589 14.511 720 HA GLU 95 HA GLU 95 7.048 -3.619 16.651 721 1HB GLU 95 HB2 GLU 95 5.399 -4.252 18.193 722 2HB GLU 95 HB1 GLU 95 4.986 -2.596 17.774 723 1HG GLU 95 HG1 GLU 95 3.182 -3.278 16.426 724 2HG GLU 95 HG2 GLU 95 3.715 -4.958 16.430 725 H ILE 96 HN ILE 96 5.518 -3.940 13.758 726 HA ILE 96 HA ILE 96 4.648 -6.586 13.669 727 HB ILE 96 HB ILE 96 5.012 -6.553 11.277 728 1HG1 ILE 96 HG12 ILE 96 7.233 -5.572 11.208 729 2HG1 ILE 96 HG11 ILE 96 6.138 -4.693 10.151 730 1HG2 ILE 96 HG21 ILE 96 4.142 -3.900 11.138 731 2HG2 ILE 96 HG22 ILE 96 3.562 -4.534 12.682 732 3HG2 ILE 96 HG23 ILE 96 3.163 -5.367 11.178 733 1HD1 ILE 96 HD11 ILE 96 5.993 -3.344 12.558 734 2HD1 ILE 96 HD12 ILE 96 6.867 -2.848 11.107 735 3HD1 ILE 96 HD13 ILE 96 7.698 -3.755 12.372 736 H ASP 97 HN ASP 97 6.239 -7.562 11.452 737 HA ASP 97 HA ASP 97 8.064 -9.231 12.749 738 1HB ASP 97 HB1 ASP 97 6.893 -9.272 10.357 739 2HB ASP 97 HB2 ASP 97 8.433 -8.578 9.859 740 H ASN 98 HN ASN 98 8.338 -6.000 12.289 741 HA ASN 98 HA ASN 98 10.016 -4.547 12.712 742 1HB ASN 98 HB1 ASN 98 11.345 -7.102 13.291 743 2HB ASN 98 HB2 ASN 98 12.438 -5.819 12.781 744 1HD2 ASN 98 HD22 ASN 98 10.556 -7.084 15.301 745 2HD2 ASN 98 HD21 ASN 98 10.838 -5.835 16.460 746 H SER 99 HN SER 99 10.416 -6.958 10.244 747 HA SER 99 HA SER 99 12.320 -5.469 8.702 748 1HB SER 99 HB1 SER 99 10.494 -7.529 7.503 749 2HB SER 99 HB2 SER 99 12.179 -7.176 7.121 750 HG SER 99 HG SER 99 11.507 -9.130 8.510 751 H GLU 100 HN GLU 100 8.870 -5.614 9.001 752 HA GLU 100 HA GLU 100 8.321 -4.083 6.618 753 1HB GLU 100 HB1 GLU 100 6.356 -4.337 8.842 754 2HB GLU 100 HB2 GLU 100 6.092 -4.370 7.106 755 1HG GLU 100 HG1 GLU 100 7.599 -6.593 7.449 756 2HG GLU 100 HG2 GLU 100 6.689 -6.552 8.959 757 H LEU 101 HN LEU 101 9.188 -3.496 9.866 758 HA LEU 101 HA LEU 101 8.213 -0.796 10.018 759 1HB LEU 101 HB1 LEU 101 8.484 -1.797 12.110 760 2HB LEU 101 HB2 LEU 101 10.023 -2.514 11.678 761 HG LEU 101 HG LEU 101 10.734 0.065 11.569 762 1HD1 LEU 101 HD11 LEU 101 9.038 0.271 13.962 763 2HD1 LEU 101 HD12 LEU 101 8.194 0.381 12.418 764 3HD1 LEU 101 HD13 LEU 101 9.504 1.501 12.788 765 1HD2 LEU 101 HD21 LEU 101 12.102 -0.703 13.132 766 2HD2 LEU 101 HD22 LEU 101 11.048 -2.099 13.360 767 3HD2 LEU 101 HD23 LEU 101 10.804 -0.642 14.324 768 H LEU 102 HN LEU 102 10.983 -2.434 8.796 769 HA LEU 102 HA LEU 102 12.606 -0.022 8.610 770 1HB LEU 102 HB2 LEU 102 13.033 -2.920 8.398 771 2HB LEU 102 HB1 LEU 102 13.944 -1.978 7.234 772 HG LEU 102 HG LEU 102 14.721 -0.589 9.267 773 1HD1 LEU 102 HD21 LEU 102 13.076 -1.504 10.842 774 2HD1 LEU 102 HD22 LEU 102 14.732 -1.770 11.386 775 3HD1 LEU 102 HD23 LEU 102 13.814 -3.097 10.673 776 1HD2 LEU 102 HD11 LEU 102 16.455 -1.739 8.376 777 2HD2 LEU 102 HD12 LEU 102 15.585 -3.273 8.378 778 3HD2 LEU 102 HD13 LEU 102 16.294 -2.660 9.872 779 H HIS 103 HN HIS 103 11.082 -2.366 6.428 780 HA HIS 103 HA HIS 103 11.949 -1.120 4.067 781 1HB HIS 103 HB1 HIS 103 10.595 -3.430 4.729 782 2HB HIS 103 HB2 HIS 103 9.372 -2.496 3.880 783 HD2 HIS 103 HD2 HIS 103 11.080 -5.225 2.730 784 HE1 HIS 103 HE1 HIS 103 12.316 -2.363 -0.133 785 HE2 HIS 103 HE2 HIS 103 12.136 -4.838 0.391 786 H MET 104 HN MET 104 9.070 -0.659 6.064 787 HA MET 104 HA MET 104 7.602 0.952 4.320 788 1HB MET 104 HB2 MET 104 6.388 1.686 6.310 789 2HB MET 104 HB1 MET 104 6.679 -0.047 6.378 790 1HG MET 104 HG1 MET 104 7.982 0.123 8.193 791 2HG MET 104 HG2 MET 104 8.734 1.608 7.626 792 1HE MET 104 HE1 MET 104 5.252 0.336 8.306 793 2HE MET 104 HE2 MET 104 4.756 1.910 7.683 794 3HE MET 104 HE3 MET 104 4.515 1.522 9.387 795 H LEU 105 HN LEU 105 10.209 1.753 6.549 796 HA LEU 105 HA LEU 105 9.890 4.611 6.077 797 1HB LEU 105 HB1 LEU 105 12.185 3.344 7.541 798 2HB LEU 105 HB2 LEU 105 11.514 4.951 7.740 799 HG LEU 105 HG LEU 105 10.100 2.410 8.541 800 1HD1 LEU 105 HD11 LEU 105 10.930 4.192 10.671 801 2HD1 LEU 105 HD12 LEU 105 12.301 3.547 9.769 802 3HD1 LEU 105 HD13 LEU 105 11.138 2.448 10.509 803 1HD2 LEU 105 HD21 LEU 105 8.641 3.960 9.773 804 2HD2 LEU 105 HD22 LEU 105 8.585 4.216 8.028 805 3HD2 LEU 105 HD23 LEU 105 9.507 5.317 9.052 806 H GLU 106 HN GLU 106 11.281 2.031 4.559 807 HA GLU 106 HA GLU 106 13.500 3.612 3.508 808 1HB GLU 106 HB2 GLU 106 12.963 0.671 3.798 809 2HB GLU 106 HB1 GLU 106 14.185 1.238 2.658 810 1HG GLU 106 HG2 GLU 106 14.110 1.635 5.632 811 2HG GLU 106 HG1 GLU 106 15.253 0.659 4.708 812 H SER 107 HN SER 107 10.439 2.418 2.588 813 HA SER 107 HA SER 107 11.084 3.004 -0.218 814 1HB SER 107 HB1 SER 107 10.272 0.485 0.977 815 2HB SER 107 HB2 SER 107 9.182 0.992 -0.295 816 HG SER 107 HG SER 107 11.033 -0.276 -0.995 817 HA PRO 108 HA PRO 108 7.357 5.421 -0.003 818 1HB PRO 108 HB2 PRO 108 7.341 5.451 -2.920 819 2HB PRO 108 HB1 PRO 108 7.657 6.773 -1.795 820 1HG PRO 108 HG1 PRO 108 9.587 5.698 -3.356 821 2HG PRO 108 HG2 PRO 108 9.919 6.371 -1.750 822 1HD PRO 108 HD2 PRO 108 9.589 3.507 -2.573 823 2HD PRO 108 HD1 PRO 108 10.779 4.231 -1.469 824 H GLU 109 HN GLU 109 7.351 2.342 -0.493 825 HA GLU 109 HA GLU 109 4.507 2.209 -1.142 826 1HB GLU 109 HB1 GLU 109 4.947 1.510 -3.232 827 2HB GLU 109 HB2 GLU 109 6.655 1.281 -2.891 828 1HG GLU 109 HG2 GLU 109 6.342 -0.921 -2.199 829 2HG GLU 109 HG1 GLU 109 4.607 -0.700 -1.980 830 H SER 110 HN SER 110 7.362 0.846 0.314 831 HA SER 110 HA SER 110 6.251 -1.573 1.205 832 1HB SER 110 HB1 SER 110 8.664 -0.041 1.707 833 2HB SER 110 HB2 SER 110 8.053 -0.806 3.177 834 HG SER 110 HG SER 110 8.151 -2.787 2.160 835 H LEU 111 HN LEU 111 6.372 1.666 2.574 836 HA LEU 111 HA LEU 111 5.199 1.325 5.032 837 1HB LEU 111 HB1 LEU 111 6.004 3.430 3.793 838 2HB LEU 111 HB2 LEU 111 4.405 3.489 3.081 839 HG LEU 111 HG LEU 111 4.416 5.040 4.854 840 1HD1 LEU 111 HD21 LEU 111 3.134 2.918 6.423 841 2HD1 LEU 111 HD22 LEU 111 2.580 3.077 4.756 842 3HD1 LEU 111 HD23 LEU 111 2.497 4.458 5.848 843 1HD2 LEU 111 HD11 LEU 111 5.334 2.954 6.795 844 2HD2 LEU 111 HD12 LEU 111 5.240 4.700 7.015 845 3HD2 LEU 111 HD13 LEU 111 6.456 4.014 5.934 846 H ARG 112 HN ARG 112 3.834 1.024 1.848 847 HA ARG 112 HA ARG 112 1.129 0.732 2.879 848 1HB ARG 112 HB1 ARG 112 2.315 0.955 0.127 849 2HB ARG 112 HB2 ARG 112 0.628 0.488 0.383 850 1HG ARG 112 HG2 ARG 112 0.055 2.530 1.254 851 2HG ARG 112 HG1 ARG 112 1.718 2.887 1.735 852 1HD ARG 112 HD2 ARG 112 0.811 4.212 -0.231 853 2HD ARG 112 HD1 ARG 112 2.355 3.401 -0.481 854 HE ARG 112 HE ARG 112 0.020 1.915 -1.327 855 1HH1 ARG 112 HH12 ARG 112 2.566 4.116 -2.232 856 2HH1 ARG 112 HH11 ARG 112 2.459 3.747 -3.921 857 1HH2 ARG 112 HH21 ARG 112 -0.126 1.422 -3.546 858 2HH2 ARG 112 HH22 ARG 112 0.929 2.215 -4.668 859 H SER 113 HN SER 113 3.080 -1.135 0.549 860 HA SER 113 HA SER 113 1.605 -3.445 0.527 861 1HB SER 113 HB2 SER 113 3.489 -3.157 -0.971 862 2HB SER 113 HB1 SER 113 4.615 -3.146 0.385 863 HG SER 113 HG SER 113 3.006 -5.366 0.291 864 H LYS 114 HN LYS 114 3.676 -2.219 3.015 865 HA LYS 114 HA LYS 114 3.742 -4.710 4.499 866 1HB LYS 114 HB1 LYS 114 4.666 -1.940 5.273 867 2HB LYS 114 HB2 LYS 114 4.875 -3.383 6.257 868 1HG LYS 114 HG1 LYS 114 6.055 -2.913 3.526 869 2HG LYS 114 HG2 LYS 114 6.918 -2.830 5.063 870 1HD LYS 114 HD2 LYS 114 6.951 -5.098 5.328 871 2HD LYS 114 HD1 LYS 114 5.447 -5.333 4.435 872 1HE LYS 114 HE2 LYS 114 6.688 -4.741 2.348 873 2HE LYS 114 HE1 LYS 114 8.173 -4.744 3.298 874 1HZ LYS 114 HZ1 LYS 114 6.484 -7.114 3.472 875 2HZ LYS 114 HZ2 LYS 114 8.170 -6.985 3.469 876 3HZ LYS 114 HZ3 LYS 114 7.309 -6.873 2.016 877 H VAL 115 HN VAL 115 2.101 -1.558 4.674 878 HA VAL 115 HA VAL 115 0.744 -2.091 7.103 879 HB VAL 115 HB VAL 115 0.482 -0.070 4.944 880 1HG1 VAL 115 HG11 VAL 115 -1.859 -1.168 5.961 881 2HG1 VAL 115 HG12 VAL 115 -1.692 0.394 5.163 882 3HG1 VAL 115 HG13 VAL 115 -1.605 0.287 6.922 883 1HG2 VAL 115 HG21 VAL 115 1.350 1.245 6.518 884 2HG2 VAL 115 HG22 VAL 115 1.565 -0.208 7.495 885 3HG2 VAL 115 HG23 VAL 115 0.113 0.776 7.685 886 H ASP 116 HN ASP 116 -0.508 -2.094 3.752 887 HA ASP 116 HA ASP 116 -2.969 -3.208 4.205 888 1HB ASP 116 HB1 ASP 116 -2.520 -2.468 2.011 889 2HB ASP 116 HB2 ASP 116 -1.079 -3.470 1.877 890 H GLU 117 HN GLU 117 0.129 -4.888 3.876 891 HA GLU 117 HA GLU 117 -1.019 -7.511 4.032 892 1HB GLU 117 HB1 GLU 117 1.731 -6.367 4.013 893 2HB GLU 117 HB2 GLU 117 1.530 -7.973 4.698 894 1HG GLU 117 HG1 GLU 117 1.975 -7.434 2.077 895 2HG GLU 117 HG2 GLU 117 1.263 -8.921 2.700 896 H ALA 118 HN ALA 118 0.269 -5.175 6.298 897 HA ALA 118 HA ALA 118 0.400 -6.927 8.534 898 1HB ALA 118 HB1 ALA 118 1.452 -4.554 8.179 899 2HB ALA 118 HB2 ALA 118 0.995 -5.113 9.789 900 3HB ALA 118 HB3 ALA 118 -0.063 -4.013 8.902 901 H VAL 119 HN VAL 119 -2.123 -5.317 6.877 902 HA VAL 119 HA VAL 119 -4.040 -5.221 8.978 903 HB VAL 119 HB VAL 119 -4.602 -5.476 6.036 904 1HG1 VAL 119 HG11 VAL 119 -6.209 -4.313 8.308 905 2HG1 VAL 119 HG12 VAL 119 -6.500 -5.869 7.529 906 3HG1 VAL 119 HG13 VAL 119 -6.697 -4.371 6.615 907 1HG2 VAL 119 HG21 VAL 119 -4.789 -2.945 6.192 908 2HG2 VAL 119 HG22 VAL 119 -3.161 -3.625 6.200 909 3HG2 VAL 119 HG23 VAL 119 -3.898 -3.083 7.707 910 H ALA 120 HN ALA 120 -3.289 -7.499 6.394 911 HA ALA 120 HA ALA 120 -5.270 -9.414 7.000 912 1HB ALA 120 HB1 ALA 120 -3.211 -9.106 5.121 913 2HB ALA 120 HB2 ALA 120 -4.422 -10.390 5.182 914 3HB ALA 120 HB3 ALA 120 -2.860 -10.613 5.973 915 H VAL 121 HN VAL 121 -2.104 -8.713 8.245 916 HA VAL 121 HA VAL 121 -1.854 -11.094 9.831 917 HB VAL 121 HB VAL 121 -0.296 -8.537 9.575 918 1HG1 VAL 121 HG21 VAL 121 0.514 -8.705 11.623 919 2HG1 VAL 121 HG22 VAL 121 1.190 -10.277 11.191 920 3HG1 VAL 121 HG23 VAL 121 -0.413 -10.176 11.918 921 1HG2 VAL 121 HG11 VAL 121 0.848 -11.270 9.322 922 2HG2 VAL 121 HG12 VAL 121 1.261 -9.785 8.464 923 3HG2 VAL 121 HG13 VAL 121 -0.204 -10.671 8.039 924 H LEU 122 HN LEU 122 -3.036 -7.846 10.244 925 HA LEU 122 HA LEU 122 -3.137 -7.915 13.100 926 1HB LEU 122 HB2 LEU 122 -3.336 -5.725 12.752 927 2HB LEU 122 HB1 LEU 122 -3.542 -5.995 11.034 928 HG LEU 122 HG LEU 122 -6.049 -6.545 12.171 929 1HD1 LEU 122 HD11 LEU 122 -5.769 -5.490 14.184 930 2HD1 LEU 122 HD12 LEU 122 -6.332 -4.149 13.185 931 3HD1 LEU 122 HD13 LEU 122 -4.611 -4.326 13.535 932 1HD2 LEU 122 HD21 LEU 122 -6.757 -5.087 10.603 933 2HD2 LEU 122 HD22 LEU 122 -5.096 -5.238 10.033 934 3HD2 LEU 122 HD23 LEU 122 -5.560 -3.867 11.040 935 H GLN 123 HN GLN 123 -5.425 -8.448 10.472 936 HA GLN 123 HA GLN 123 -7.738 -8.781 12.040 937 1HB GLN 123 HB1 GLN 123 -6.922 -9.702 9.297 938 2HB GLN 123 HB2 GLN 123 -8.447 -10.232 9.998 939 1HG GLN 123 HG1 GLN 123 -7.618 -7.370 9.561 940 2HG GLN 123 HG2 GLN 123 -8.715 -8.293 8.536 941 1HE2 GLN 123 HE22 GLN 123 -10.792 -8.709 9.234 942 2HE2 GLN 123 HE21 GLN 123 -11.494 -7.919 10.599 943 H ALA 124 HN ALA 124 -5.072 -10.848 11.229 944 HA ALA 124 HA ALA 124 -6.231 -13.307 12.153 945 1HB ALA 124 HB1 ALA 124 -4.124 -12.785 10.601 946 2HB ALA 124 HB2 ALA 124 -4.269 -14.274 11.537 947 3HB ALA 124 HB3 ALA 124 -3.289 -12.940 12.147 948 H HIS 125 HN HIS 125 -3.798 -11.071 13.526 949 HA HIS 125 HA HIS 125 -3.670 -12.441 15.979 950 1HB HIS 125 HB1 HIS 125 -2.066 -10.641 14.933 951 2HB HIS 125 HB2 HIS 125 -3.101 -9.495 15.778 952 HD2 HIS 125 HD2 HIS 125 -0.496 -9.129 17.136 953 HE1 HIS 125 HE1 HIS 125 -1.364 -12.376 19.709 954 HE2 HIS 125 HE2 HIS 125 0.116 -10.350 19.343 955 H GLN 126 HN GLN 126 -6.037 -10.338 14.731 956 HA GLN 126 HA GLN 126 -6.985 -9.471 17.333 957 1HB GLN 126 HB1 GLN 126 -7.821 -8.946 14.499 958 2HB GLN 126 HB2 GLN 126 -8.905 -8.552 15.826 959 1HG GLN 126 HG2 GLN 126 -6.080 -7.561 15.786 960 2HG GLN 126 HG1 GLN 126 -7.365 -6.719 14.918 961 1HE2 GLN 126 HE22 GLN 126 -8.720 -5.427 16.015 962 2HE2 GLN 126 HE21 GLN 126 -8.685 -5.193 17.726 963 H ALA 127 HN ALA 127 -8.207 -11.455 14.643 964 HA ALA 127 HA ALA 127 -10.325 -12.483 16.372 965 1HB ALA 127 HB1 ALA 127 -11.398 -13.262 14.427 966 2HB ALA 127 HB2 ALA 127 -9.923 -13.135 13.467 967 3HB ALA 127 HB3 ALA 127 -10.749 -11.675 14.012 968 H LYS 128 HN LYS 128 -7.560 -13.661 14.477 969 HA LYS 128 HA LYS 128 -7.987 -16.347 15.515 970 1HB LYS 128 HB2 LYS 128 -6.939 -17.116 13.660 971 2HB LYS 128 HB1 LYS 128 -7.314 -15.519 13.032 972 1HG LYS 128 HG2 LYS 128 -5.166 -15.306 12.583 973 2HG LYS 128 HG1 LYS 128 -4.898 -15.178 14.322 974 1HD LYS 128 HD2 LYS 128 -3.529 -16.942 13.968 975 2HD LYS 128 HD1 LYS 128 -5.033 -17.860 14.051 976 1HE LYS 128 HE1 LYS 128 -3.742 -16.829 11.528 977 2HE LYS 128 HE2 LYS 128 -3.676 -18.493 12.107 978 1HZ LYS 128 HZ1 LYS 128 -5.428 -18.650 10.699 979 2HZ LYS 128 HZ2 LYS 128 -5.894 -17.037 10.889 980 3HZ LYS 128 HZ3 LYS 128 -6.278 -18.173 12.082 981 H GLU 129 HN GLU 129 -5.776 -17.484 15.796 982 HA GLU 129 HA GLU 129 -4.382 -16.096 17.963 983 1HB GLU 129 HB1 GLU 129 -3.333 -18.444 18.260 984 2HB GLU 129 HB2 GLU 129 -5.004 -18.204 18.751 985 1HG GLU 129 HG1 GLU 129 -5.839 -19.453 17.017 986 2HG GLU 129 HG2 GLU 129 -4.428 -19.176 15.997 987 H ALA 130 HN ALA 130 -3.563 -14.800 15.966 988 HA ALA 130 HA ALA 130 -1.814 -15.894 14.120 989 1HB ALA 130 HB1 ALA 130 -2.734 -13.615 13.984 990 2HB ALA 130 HB2 ALA 130 -0.987 -13.653 13.747 991 3HB ALA 130 HB3 ALA 130 -1.656 -13.119 15.288 992 H ALA 131 HN ALA 131 -0.756 -13.947 16.924 993 HA ALA 131 HA ALA 131 1.885 -15.089 16.804 994 1HB ALA 131 HB1 ALA 131 0.999 -12.695 17.622 995 2HB ALA 131 HB2 ALA 131 2.529 -13.394 18.152 996 3HB ALA 131 HB3 ALA 131 1.099 -13.521 19.177 997 H GLN 132 HN GLN 132 2.885 -16.371 18.376 998 HA GLN 132 HA GLN 132 1.138 -18.260 19.660 999 1HB GLN 132 HB2 GLN 132 4.148 -17.998 19.586 1000 2HB GLN 132 HB1 GLN 132 3.305 -19.305 20.405 1001 1HG GLN 132 HG1 GLN 132 2.437 -20.142 18.368 1002 2HG GLN 132 HG2 GLN 132 2.948 -18.705 17.484 1003 1HE2 GLN 132 HE21 GLN 132 3.674 -21.010 16.427 1004 2HE2 GLN 132 HE22 GLN 132 5.352 -21.332 16.677 1005 H LYS 133 HN LYS 133 2.131 -18.983 21.978 1006 HA LYS 133 HA LYS 133 1.520 -16.737 23.703 1007 1HB LYS 133 HB2 LYS 133 1.728 -18.517 25.515 1008 2HB LYS 133 HB1 LYS 133 0.438 -18.736 24.341 1009 1HG LYS 133 HG2 LYS 133 1.802 -20.360 23.135 1010 2HG LYS 133 HG1 LYS 133 3.106 -20.135 24.303 1011 1HD LYS 133 HD1 LYS 133 2.175 -21.868 25.380 1012 2HD LYS 133 HD2 LYS 133 0.985 -20.685 25.929 1013 1HE LYS 133 HE2 LYS 133 -0.463 -22.189 25.058 1014 2HE LYS 133 HE1 LYS 133 -0.097 -21.321 23.567 1015 1HZ LYS 133 HZ1 LYS 133 0.045 -23.882 23.610 1016 2HZ LYS 133 HZ2 LYS 133 1.543 -23.634 24.356 1017 3HZ LYS 133 HZ3 LYS 133 1.253 -23.006 22.812 1018 H ALA 134 HN ALA 134 2.892 -16.999 25.936 1019 HA ALA 134 HA ALA 134 5.527 -16.099 25.210 1020 1HB ALA 134 HB1 ALA 134 4.054 -16.323 27.815 1021 2HB ALA 134 HB2 ALA 134 4.546 -14.870 26.944 1022 3HB ALA 134 HB3 ALA 134 5.758 -15.872 27.743 1023 H VAL 135 HN VAL 135 6.657 -17.854 24.411 1024 HA VAL 135 HA VAL 135 6.902 -20.252 26.044 1025 HB VAL 135 HB VAL 135 8.416 -21.010 24.144 1026 1HG1 VAL 135 HG21 VAL 135 6.538 -21.544 22.688 1027 2HG1 VAL 135 HG22 VAL 135 5.560 -20.304 23.474 1028 3HG1 VAL 135 HG23 VAL 135 6.084 -21.721 24.383 1029 1HG2 VAL 135 HG11 VAL 135 7.271 -19.200 22.218 1030 2HG2 VAL 135 HG12 VAL 135 8.959 -19.629 22.490 1031 3HG2 VAL 135 HG13 VAL 135 8.222 -18.322 23.416 1032 H ASN 136 HN ASN 136 8.754 -20.931 27.049 1033 HA ASN 136 HA ASN 136 10.623 -18.902 27.812 1034 1HB ASN 136 HB2 ASN 136 11.062 -21.809 28.397 1035 2HB ASN 136 HB1 ASN 136 11.380 -20.406 29.415 1036 1HD2 ASN 136 HD21 ASN 136 9.322 -22.954 28.832 1037 2HD2 ASN 136 HD22 ASN 136 7.973 -22.430 29.777 1038 H SER 137 HN SER 137 11.420 -22.179 26.696 1039 HA SER 137 HA SER 137 13.799 -21.132 25.392 1040 1HB SER 137 HB1 SER 137 13.274 -23.469 26.780 1041 2HB SER 137 HB2 SER 137 13.302 -24.000 25.098 1042 HG SER 137 HG SER 137 15.355 -23.286 26.693 1043 H ALA 138 HN ALA 138 14.234 -21.248 23.219 1044 HA ALA 138 HA ALA 138 11.997 -21.177 21.458 1045 1HB ALA 138 HB1 ALA 138 13.527 -19.822 20.537 1046 2HB ALA 138 HB2 ALA 138 14.145 -21.297 19.795 1047 3HB ALA 138 HB3 ALA 138 14.879 -20.682 21.275 1048 H THR 139 HN THR 139 11.041 -23.249 21.686 1049 HA THR 139 HA THR 139 12.530 -25.411 20.346 1050 HB THR 139 HB THR 139 12.106 -25.998 22.654 1051 HG1 THR 139 HG1 THR 139 10.492 -27.771 22.194 1052 1HG2 THR 139 HG21 THR 139 9.842 -26.239 23.542 1053 2HG2 THR 139 HG22 THR 139 9.202 -25.463 22.093 1054 3HG2 THR 139 HG23 THR 139 10.247 -24.559 23.189 1055 H GLY 140 HN GLY 140 9.725 -23.432 20.348 1056 1HA GLY 140 HA1 GLY 140 8.301 -25.171 18.477 1057 2HA GLY 140 HA2 GLY 140 7.674 -23.703 19.211 1058 H VAL 141 HN VAL 141 9.466 -21.806 18.584 1059 HA VAL 141 HA VAL 141 8.927 -21.332 15.826 1060 HB VAL 141 HB VAL 141 10.578 -19.354 16.256 1061 1HG1 VAL 141 HG11 VAL 141 8.378 -18.782 18.000 1062 2HG1 VAL 141 HG12 VAL 141 7.824 -19.748 16.633 1063 3HG1 VAL 141 HG13 VAL 141 8.669 -18.225 16.353 1064 1HG2 VAL 141 HG21 VAL 141 9.858 -19.641 19.106 1065 2HG2 VAL 141 HG22 VAL 141 11.282 -18.915 18.362 1066 3HG2 VAL 141 HG23 VAL 141 11.165 -20.668 18.516 1067 HA PRO 142 HA PRO 142 12.582 -23.266 14.183 1068 1HB PRO 142 HB2 PRO 142 12.402 -22.377 11.645 1069 2HB PRO 142 HB1 PRO 142 11.308 -23.606 12.292 1070 1HG PRO 142 HG2 PRO 142 10.858 -20.668 11.923 1071 2HG PRO 142 HG1 PRO 142 9.763 -22.019 11.575 1072 1HD PRO 142 HD2 PRO 142 9.586 -20.493 13.826 1073 2HD PRO 142 HD1 PRO 142 9.083 -22.193 13.761 1074 H THR 143 HN THR 143 14.633 -22.653 14.398 1075 HA THR 143 HA THR 143 15.316 -19.831 14.327 1076 HB THR 143 HB THR 143 17.625 -20.820 14.997 1077 HG1 THR 143 HG1 THR 143 16.267 -22.998 15.999 1078 1HG2 THR 143 HG21 THR 143 15.759 -19.811 16.519 1079 2HG2 THR 143 HG22 THR 143 17.129 -20.674 17.218 1080 3HG2 THR 143 HG23 THR 143 15.574 -21.486 17.040 1081 H VAL 144 HN VAL 144 16.917 -22.739 13.024 1082 HA VAL 144 HA VAL 144 18.141 -23.085 11.137 1083 HB VAL 144 HB VAL 144 16.410 -21.022 9.794 1084 1HG1 VAL 144 HG11 VAL 144 17.633 -23.590 8.790 1085 2HG1 VAL 144 HG12 VAL 144 18.281 -21.974 8.510 1086 3HG1 VAL 144 HG13 VAL 144 16.713 -22.424 7.839 1087 1HG2 VAL 144 HG21 VAL 144 14.662 -22.200 10.588 1088 2HG2 VAL 144 HG22 VAL 144 15.651 -23.606 10.979 1089 3HG2 VAL 144 HG23 VAL 144 15.108 -23.342 9.322 Start of MODEL 23 1 1H GLY 1 HT1 GLY 1 -28.628 -8.499 -77.390 2 2H GLY 1 HT2 GLY 1 -29.615 -8.621 -78.758 3 3H GLY 1 HT3 GLY 1 -29.711 -9.791 -77.541 4 1HA GLY 1 HA1 GLY 1 -30.697 -7.015 -77.527 5 2HA GLY 1 HA2 GLY 1 -31.568 -8.490 -77.140 6 HA PRO 2 HA PRO 2 -29.621 -6.433 -73.288 7 1HB PRO 2 HB2 PRO 2 -31.634 -4.871 -72.399 8 2HB PRO 2 HB1 PRO 2 -30.419 -4.287 -73.540 9 1HG PRO 2 HG2 PRO 2 -33.204 -5.251 -74.063 10 2HG PRO 2 HG1 PRO 2 -32.358 -3.853 -74.751 11 1HD PRO 2 HD2 PRO 2 -32.632 -6.228 -76.059 12 2HD PRO 2 HD1 PRO 2 -31.260 -5.131 -76.311 13 H LEU 3 HN LEU 3 -30.040 -8.792 -72.926 14 HA LEU 3 HA LEU 3 -32.563 -9.512 -71.718 15 1HB LEU 3 HB2 LEU 3 -30.885 -10.974 -73.125 16 2HB LEU 3 HB1 LEU 3 -30.120 -11.229 -71.568 17 HG LEU 3 HG LEU 3 -32.432 -11.985 -70.751 18 1HD1 LEU 3 HD11 LEU 3 -33.129 -11.192 -73.355 19 2HD1 LEU 3 HD12 LEU 3 -34.149 -11.984 -72.153 20 3HD1 LEU 3 HD13 LEU 3 -33.245 -12.952 -73.318 21 1HD2 LEU 3 HD21 LEU 3 -32.000 -14.165 -72.358 22 2HD2 LEU 3 HD22 LEU 3 -31.191 -13.839 -70.826 23 3HD2 LEU 3 HD23 LEU 3 -30.425 -13.371 -72.344 24 H GLY 4 HN GLY 4 -33.049 -9.150 -69.662 25 1HA GLY 4 HA2 GLY 4 -30.909 -8.512 -67.777 26 2HA GLY 4 HA1 GLY 4 -32.627 -8.239 -67.529 27 H SER 5 HN SER 5 -31.001 -11.228 -68.511 28 HA SER 5 HA SER 5 -32.327 -12.624 -66.332 29 1HB SER 5 HB2 SER 5 -30.705 -13.600 -68.691 30 2HB SER 5 HB1 SER 5 -31.376 -14.670 -67.460 31 HG SER 5 HG SER 5 -33.268 -12.987 -68.373 32 H ALA 6 HN ALA 6 -31.230 -12.046 -64.487 33 HA ALA 6 HA ALA 6 -28.496 -13.106 -64.272 34 1HB ALA 6 HB1 ALA 6 -28.955 -10.440 -64.340 35 2HB ALA 6 HB2 ALA 6 -27.603 -11.194 -63.495 36 3HB ALA 6 HB3 ALA 6 -29.062 -10.751 -62.608 37 H ALA 7 HN ALA 7 -28.963 -14.903 -63.102 38 HA ALA 7 HA ALA 7 -30.433 -14.524 -60.574 39 1HB ALA 7 HB1 ALA 7 -31.594 -16.393 -60.948 40 2HB ALA 7 HB2 ALA 7 -30.163 -17.281 -61.470 41 3HB ALA 7 HB3 ALA 7 -31.034 -16.262 -62.616 42 H ALA 8 HN ALA 8 -29.799 -16.279 -58.916 43 HA ALA 8 HA ALA 8 -26.868 -16.596 -58.919 44 1HB ALA 8 HB1 ALA 8 -28.693 -15.665 -56.736 45 2HB ALA 8 HB2 ALA 8 -27.198 -14.938 -57.326 46 3HB ALA 8 HB3 ALA 8 -27.140 -16.414 -56.363 47 H ALA 9 HN ALA 9 -26.026 -18.458 -57.928 48 HA ALA 9 HA ALA 9 -27.952 -20.527 -57.144 49 1HB ALA 9 HB1 ALA 9 -27.571 -21.794 -58.923 50 2HB ALA 9 HB2 ALA 9 -25.836 -21.763 -58.608 51 3HB ALA 9 HB3 ALA 9 -26.575 -20.509 -59.604 52 H THR 10 HN THR 10 -25.991 -22.588 -56.946 53 HA THR 10 HA THR 10 -25.050 -22.199 -54.353 54 HB THR 10 HB THR 10 -23.776 -24.248 -54.670 55 HG1 THR 10 HG1 THR 10 -22.986 -23.660 -56.793 56 1HG2 THR 10 HG21 THR 10 -26.482 -24.106 -55.004 57 2HG2 THR 10 HG22 THR 10 -25.543 -25.584 -54.795 58 3HG2 THR 10 HG23 THR 10 -25.965 -25.029 -56.415 59 HA PRO 11 HA PRO 11 -23.365 -23.013 -53.104 60 1HB PRO 11 HB1 PRO 11 -21.790 -21.922 -51.234 61 2HB PRO 11 HB2 PRO 11 -21.143 -23.027 -52.451 62 1HG PRO 11 HG2 PRO 11 -21.023 -20.040 -52.343 63 2HG PRO 11 HG1 PRO 11 -19.763 -21.195 -52.815 64 1HD PRO 11 HD2 PRO 11 -21.341 -19.794 -54.590 65 2HD PRO 11 HD1 PRO 11 -20.534 -21.329 -54.961 66 H ALA 12 HN ALA 12 -23.873 -19.810 -53.858 67 HA ALA 12 HA ALA 12 -24.872 -18.807 -51.391 68 1HB ALA 12 HB1 ALA 12 -24.832 -16.910 -52.536 69 2HB ALA 12 HB2 ALA 12 -26.122 -17.496 -53.586 70 3HB ALA 12 HB3 ALA 12 -24.436 -17.808 -54.001 71 H VAL 13 HN VAL 13 -26.296 -20.359 -50.563 72 HA VAL 13 HA VAL 13 -28.627 -21.135 -52.104 73 HB VAL 13 HB VAL 13 -28.127 -21.739 -49.195 74 1HG1 VAL 13 HG11 VAL 13 -30.228 -22.327 -50.992 75 2HG1 VAL 13 HG12 VAL 13 -30.021 -22.886 -49.332 76 3HG1 VAL 13 HG13 VAL 13 -29.372 -23.835 -50.669 77 1HG2 VAL 13 HG21 VAL 13 -26.248 -22.754 -49.912 78 2HG2 VAL 13 HG22 VAL 13 -26.781 -22.785 -51.593 79 3HG2 VAL 13 HG23 VAL 13 -27.368 -24.002 -50.459 80 H ARG 14 HN ARG 14 -30.716 -20.490 -51.746 81 HA ARG 14 HA ARG 14 -31.112 -17.918 -50.607 82 1HB ARG 14 HB2 ARG 14 -32.407 -18.852 -52.535 83 2HB ARG 14 HB1 ARG 14 -33.215 -19.935 -51.410 84 1HG ARG 14 HG2 ARG 14 -34.751 -18.358 -51.158 85 2HG ARG 14 HG1 ARG 14 -33.536 -17.423 -50.284 86 1HD ARG 14 HD2 ARG 14 -33.310 -15.951 -51.950 87 2HD ARG 14 HD1 ARG 14 -33.276 -17.217 -53.178 88 HE ARG 14 HE ARG 14 -35.784 -17.231 -52.903 89 1HH1 ARG 14 HH11 ARG 14 -33.855 -14.396 -52.286 90 2HH1 ARG 14 HH12 ARG 14 -35.138 -13.288 -52.641 91 1HH2 ARG 14 HH21 ARG 14 -37.479 -15.779 -53.373 92 2HH2 ARG 14 HH22 ARG 14 -37.197 -14.074 -53.260 93 H THR 15 HN THR 15 -31.754 -17.325 -48.628 94 HA THR 15 HA THR 15 -32.265 -19.448 -46.672 95 HB THR 15 HB THR 15 -31.895 -16.600 -45.863 96 HG1 THR 15 HG1 THR 15 -29.943 -18.224 -47.059 97 1HG2 THR 15 HG21 THR 15 -31.012 -17.424 -43.924 98 2HG2 THR 15 HG22 THR 15 -30.473 -18.926 -44.677 99 3HG2 THR 15 HG23 THR 15 -32.185 -18.679 -44.326 100 H VAL 16 HN VAL 16 -34.446 -19.826 -47.219 101 HA VAL 16 HA VAL 16 -36.315 -17.619 -46.711 102 HB VAL 16 HB VAL 16 -36.667 -18.733 -48.833 103 1HG1 VAL 16 HG21 VAL 16 -37.662 -21.253 -48.219 104 2HG1 VAL 16 HG22 VAL 16 -36.188 -21.110 -47.262 105 3HG1 VAL 16 HG23 VAL 16 -36.129 -20.884 -49.010 106 1HG2 VAL 16 HG11 VAL 16 -38.992 -19.158 -48.672 107 2HG2 VAL 16 HG12 VAL 16 -38.617 -17.951 -47.442 108 3HG2 VAL 16 HG13 VAL 16 -38.858 -19.636 -46.979 109 HA PRO 17 HA PRO 17 -38.223 -17.087 -45.963 110 1HB PRO 17 HB2 PRO 17 -38.940 -15.835 -43.684 111 2HB PRO 17 HB1 PRO 17 -39.909 -17.133 -44.393 112 1HG PRO 17 HG2 PRO 17 -37.949 -17.248 -42.130 113 2HG PRO 17 HG1 PRO 17 -39.551 -17.998 -42.261 114 1HD PRO 17 HD2 PRO 17 -37.235 -19.358 -42.697 115 2HD PRO 17 HD1 PRO 17 -38.761 -19.759 -43.509 116 H GLN 18 HN GLN 18 -37.366 -15.075 -46.300 117 HA GLN 18 HA GLN 18 -34.672 -14.631 -45.490 118 1HB GLN 18 HB1 GLN 18 -36.499 -13.559 -47.419 119 2HB GLN 18 HB2 GLN 18 -35.778 -12.230 -46.523 120 1HG GLN 18 HG1 GLN 18 -33.636 -13.879 -47.087 121 2HG GLN 18 HG2 GLN 18 -34.625 -13.952 -48.544 122 1HE2 GLN 18 HE21 GLN 18 -32.087 -12.445 -47.306 123 2HE2 GLN 18 HE22 GLN 18 -32.229 -10.892 -48.052 124 H TYR 19 HN TYR 19 -33.921 -13.620 -43.751 125 HA TYR 19 HA TYR 19 -35.739 -12.490 -41.833 126 1HB TYR 19 HB1 TYR 19 -33.031 -13.476 -41.847 127 2HB TYR 19 HB2 TYR 19 -33.087 -11.894 -41.076 128 HD1 TYR 19 HD1 TYR 19 -34.743 -15.231 -41.014 129 HD2 TYR 19 HD2 TYR 19 -33.731 -11.713 -38.848 130 HE1 TYR 19 HE1 TYR 19 -35.570 -16.274 -38.946 131 HE2 TYR 19 HE2 TYR 19 -34.555 -12.745 -36.773 132 HH TYR 19 HH TYR 19 -35.003 -14.908 -35.843 133 H LYS 20 HN LYS 20 -34.720 -10.369 -40.707 134 HA LYS 20 HA LYS 20 -35.107 -8.295 -42.660 135 1HB LYS 20 HB2 LYS 20 -34.390 -8.070 -39.729 136 2HB LYS 20 HB1 LYS 20 -34.958 -6.762 -40.758 137 1HG LYS 20 HG2 LYS 20 -37.119 -7.528 -40.777 138 2HG LYS 20 HG1 LYS 20 -36.645 -9.197 -40.453 139 1HD LYS 20 HD2 LYS 20 -36.127 -7.114 -38.382 140 2HD LYS 20 HD1 LYS 20 -37.769 -7.730 -38.586 141 1HE LYS 20 HE2 LYS 20 -35.584 -9.725 -38.432 142 2HE LYS 20 HE1 LYS 20 -35.988 -8.861 -36.949 143 1HZ LYS 20 HZ1 LYS 20 -37.212 -11.006 -37.367 144 2HZ LYS 20 HZ2 LYS 20 -38.041 -10.205 -38.605 145 3HZ LYS 20 HZ3 LYS 20 -38.178 -9.664 -37.008 146 H TYR 21 HN TYR 21 -33.637 -6.880 -43.478 147 HA TYR 21 HA TYR 21 -30.928 -7.670 -43.611 148 1HB TYR 21 HB2 TYR 21 -32.615 -5.611 -44.778 149 2HB TYR 21 HB1 TYR 21 -31.010 -4.994 -44.400 150 HD1 TYR 21 HD1 TYR 21 -32.961 -6.730 -46.779 151 HD2 TYR 21 HD2 TYR 21 -29.008 -6.453 -45.232 152 HE1 TYR 21 HE1 TYR 21 -32.090 -7.758 -48.836 153 HE2 TYR 21 HE2 TYR 21 -28.126 -7.480 -47.285 154 HH TYR 21 HH TYR 21 -28.949 -7.652 -49.759 155 H ALA 22 HN ALA 22 -29.908 -7.727 -41.654 156 HA ALA 22 HA ALA 22 -29.993 -5.403 -39.905 157 1HB ALA 22 HB1 ALA 22 -28.521 -6.857 -38.445 158 2HB ALA 22 HB2 ALA 22 -28.793 -8.143 -39.622 159 3HB ALA 22 HB3 ALA 22 -30.155 -7.448 -38.745 160 H ALA 23 HN ALA 23 -27.449 -7.383 -41.435 161 HA ALA 23 HA ALA 23 -25.372 -5.530 -40.885 162 1HB ALA 23 HB1 ALA 23 -24.329 -6.960 -42.897 163 2HB ALA 23 HB2 ALA 23 -25.648 -8.033 -42.428 164 3HB ALA 23 HB3 ALA 23 -24.435 -7.556 -41.241 165 H GLY 24 HN GLY 24 -25.427 -3.525 -41.695 166 1HA GLY 24 HA2 GLY 24 -26.227 -3.173 -44.511 167 2HA GLY 24 HA1 GLY 24 -26.272 -1.916 -43.285 168 H VAL 25 HN VAL 25 -24.162 -1.201 -42.415 169 HA VAL 25 HA VAL 25 -22.180 -1.112 -44.581 170 HB VAL 25 HB VAL 25 -22.233 0.677 -42.159 171 1HG1 VAL 25 HG21 VAL 25 -21.048 1.062 -44.905 172 2HG1 VAL 25 HG22 VAL 25 -20.149 0.558 -43.474 173 3HG1 VAL 25 HG23 VAL 25 -20.897 2.155 -43.530 174 1HG2 VAL 25 HG11 VAL 25 -24.295 0.576 -43.930 175 2HG2 VAL 25 HG12 VAL 25 -23.249 1.786 -44.674 176 3HG2 VAL 25 HG13 VAL 25 -23.819 2.010 -43.020 177 H ARG 26 HN ARG 26 -20.459 -2.375 -44.389 178 HA ARG 26 HA ARG 26 -19.801 -3.687 -41.935 179 1HB ARG 26 HB2 ARG 26 -18.204 -3.573 -44.500 180 2HB ARG 26 HB1 ARG 26 -18.005 -4.736 -43.197 181 1HG ARG 26 HG2 ARG 26 -20.087 -5.762 -43.672 182 2HG ARG 26 HG1 ARG 26 -20.550 -4.461 -44.770 183 1HD ARG 26 HD2 ARG 26 -18.342 -6.472 -45.173 184 2HD ARG 26 HD1 ARG 26 -19.868 -6.385 -46.053 185 HE ARG 26 HE ARG 26 -17.738 -4.353 -46.230 186 1HH1 ARG 26 HH11 ARG 26 -20.365 -6.171 -47.622 187 2HH1 ARG 26 HH12 ARG 26 -20.203 -5.450 -49.188 188 1HH2 ARG 26 HH21 ARG 26 -17.518 -3.400 -48.290 189 2HH2 ARG 26 HH22 ARG 26 -18.585 -3.876 -49.568 190 H ASN 27 HN ASN 27 -19.377 -1.898 -40.540 191 HA ASN 27 HA ASN 27 -17.018 -0.289 -41.119 192 1HB ASN 27 HB1 ASN 27 -19.377 0.018 -39.454 193 2HB ASN 27 HB2 ASN 27 -17.903 0.368 -38.555 194 1HD2 ASN 27 HD21 ASN 27 -19.838 2.278 -39.139 195 2HD2 ASN 27 HD22 ASN 27 -19.157 3.445 -40.214 196 HA PRO 28 HA PRO 28 -15.578 -2.549 -37.116 197 1HB PRO 28 HB1 PRO 28 -16.963 -4.696 -36.249 198 2HB PRO 28 HB2 PRO 28 -17.369 -3.049 -35.754 199 1HG PRO 28 HG2 PRO 28 -18.634 -4.763 -37.860 200 2HG PRO 28 HG1 PRO 28 -19.411 -3.730 -36.643 201 1HD PRO 28 HD2 PRO 28 -19.064 -2.969 -39.231 202 2HD PRO 28 HD1 PRO 28 -19.086 -1.819 -37.880 203 H GLN 29 HN GLN 29 -13.917 -3.217 -38.468 204 HA GLN 29 HA GLN 29 -14.209 -5.713 -39.940 205 1HB GLN 29 HB1 GLN 29 -11.583 -4.348 -39.873 206 2HB GLN 29 HB2 GLN 29 -12.456 -5.044 -41.230 207 1HG GLN 29 HG1 GLN 29 -13.243 -3.067 -41.839 208 2HG GLN 29 HG2 GLN 29 -13.824 -2.723 -40.210 209 1HE2 GLN 29 HE21 GLN 29 -13.194 -0.642 -40.038 210 2HE2 GLN 29 HE22 GLN 29 -11.549 -0.117 -40.082 211 H GLN 30 HN GLN 30 -11.290 -4.621 -38.279 212 HA GLN 30 HA GLN 30 -11.100 -7.264 -37.025 213 1HB GLN 30 HB1 GLN 30 -9.192 -5.399 -38.172 214 2HB GLN 30 HB2 GLN 30 -8.717 -5.891 -36.552 215 1HG GLN 30 HG2 GLN 30 -8.049 -7.873 -37.272 216 2HG GLN 30 HG1 GLN 30 -9.585 -8.163 -38.087 217 1HE2 GLN 30 HE21 GLN 30 -8.195 -9.253 -39.650 218 2HE2 GLN 30 HE22 GLN 30 -7.453 -8.319 -40.899 219 H HIS 31 HN HIS 31 -9.326 -6.684 -34.980 220 HA HIS 31 HA HIS 31 -10.532 -4.646 -33.297 221 1HB HIS 31 HB2 HIS 31 -11.233 -7.436 -33.082 222 2HB HIS 31 HB1 HIS 31 -10.418 -6.904 -31.615 223 HD2 HIS 31 HD2 HIS 31 -11.701 -4.706 -30.293 224 HE1 HIS 31 HE1 HIS 31 -15.400 -5.473 -32.204 225 HE2 HIS 31 HE2 HIS 31 -14.250 -4.219 -30.322 226 H LEU 32 HN LEU 32 -7.876 -5.660 -34.531 227 HA LEU 32 HA LEU 32 -6.255 -5.924 -32.121 228 1HB LEU 32 HB2 LEU 32 -5.459 -5.982 -35.034 229 2HB LEU 32 HB1 LEU 32 -4.389 -6.302 -33.683 230 HG LEU 32 HG LEU 32 -6.644 -8.044 -33.476 231 1HD1 LEU 32 HD11 LEU 32 -6.985 -8.918 -35.510 232 2HD1 LEU 32 HD12 LEU 32 -5.282 -8.801 -35.954 233 3HD1 LEU 32 HD13 LEU 32 -6.331 -7.391 -36.101 234 1HD2 LEU 32 HD21 LEU 32 -3.913 -8.894 -34.338 235 2HD2 LEU 32 HD22 LEU 32 -5.025 -9.667 -33.208 236 3HD2 LEU 32 HD23 LEU 32 -4.158 -8.206 -32.732 237 H ASN 33 HN ASN 33 -5.581 -4.116 -35.101 238 HA ASN 33 HA ASN 33 -4.698 -1.862 -33.435 239 1HB ASN 33 HB2 ASN 33 -4.078 -2.335 -36.356 240 2HB ASN 33 HB1 ASN 33 -3.300 -1.188 -35.270 241 1HD2 ASN 33 HD21 ASN 33 -1.693 -1.862 -33.940 242 2HD2 ASN 33 HD22 ASN 33 -1.031 -3.458 -33.965 243 H ALA 34 HN ALA 34 -7.011 -1.302 -33.196 244 HA ALA 34 HA ALA 34 -8.552 -0.454 -35.423 245 1HB ALA 34 HB1 ALA 34 -9.971 0.655 -33.677 246 2HB ALA 34 HB2 ALA 34 -8.804 0.103 -32.476 247 3HB ALA 34 HB3 ALA 34 -9.701 -1.072 -33.437 248 H GLN 35 HN GLN 35 -8.473 1.370 -36.550 249 HA GLN 35 HA GLN 35 -6.667 3.491 -35.691 250 1HB GLN 35 HB2 GLN 35 -8.186 3.206 -38.292 251 2HB GLN 35 HB1 GLN 35 -6.890 4.347 -37.958 252 1HG GLN 35 HG2 GLN 35 -6.601 1.350 -37.990 253 2HG GLN 35 HG1 GLN 35 -6.149 2.437 -39.303 254 1HE2 GLN 35 HE21 GLN 35 -4.307 3.669 -39.131 255 2HE2 GLN 35 HE22 GLN 35 -3.129 3.429 -37.890 256 HA PRO 36 HA PRO 36 -6.458 5.687 -36.668 257 1HB PRO 36 HB1 PRO 36 -6.649 7.990 -34.910 258 2HB PRO 36 HB2 PRO 36 -6.579 7.946 -36.673 259 1HG PRO 36 HG2 PRO 36 -8.799 8.696 -35.290 260 2HG PRO 36 HG1 PRO 36 -8.862 7.937 -36.891 261 1HD PRO 36 HD2 PRO 36 -9.291 6.707 -34.192 262 2HD PRO 36 HD1 PRO 36 -10.193 6.453 -35.702 263 H GLN 37 HN GLN 37 -7.386 6.395 -33.292 264 HA GLN 37 HA GLN 37 -4.740 5.789 -32.337 265 1HB GLN 37 HB2 GLN 37 -7.153 7.019 -31.293 266 2HB GLN 37 HB1 GLN 37 -6.452 5.898 -30.134 267 1HG GLN 37 HG2 GLN 37 -4.564 7.739 -31.442 268 2HG GLN 37 HG1 GLN 37 -5.739 8.477 -30.353 269 1HE2 GLN 37 HE21 GLN 37 -3.163 8.684 -29.695 270 2HE2 GLN 37 HE22 GLN 37 -2.774 7.654 -28.364 271 H VAL 38 HN VAL 38 -4.002 3.928 -31.529 272 HA VAL 38 HA VAL 38 -5.662 1.577 -31.689 273 HB VAL 38 HB VAL 38 -2.924 1.515 -30.494 274 1HG1 VAL 38 HG11 VAL 38 -4.650 -0.304 -32.127 275 2HG1 VAL 38 HG12 VAL 38 -3.867 -0.603 -30.575 276 3HG1 VAL 38 HG13 VAL 38 -2.905 -0.549 -32.052 277 1HG2 VAL 38 HG21 VAL 38 -3.550 2.625 -33.084 278 2HG2 VAL 38 HG22 VAL 38 -2.549 1.181 -33.233 279 3HG2 VAL 38 HG23 VAL 38 -2.002 2.535 -32.243 280 H THR 39 HN THR 39 -5.799 0.010 -29.916 281 HA THR 39 HA THR 39 -6.283 1.387 -27.377 282 HB THR 39 HB THR 39 -7.144 -1.372 -27.424 283 HG1 THR 39 HG1 THR 39 -7.210 -0.928 -29.710 284 1HG2 THR 39 HG21 THR 39 -8.739 -0.484 -26.194 285 2HG2 THR 39 HG22 THR 39 -9.333 0.411 -27.594 286 3HG2 THR 39 HG23 THR 39 -8.114 1.128 -26.541 287 H MET 40 HN MET 40 -3.596 0.728 -28.160 288 HA MET 40 HA MET 40 -2.884 -1.532 -26.453 289 1HB MET 40 HB2 MET 40 -0.599 -1.191 -27.356 290 2HB MET 40 HB1 MET 40 -1.798 -1.464 -28.612 291 1HG MET 40 HG2 MET 40 -1.141 0.387 -29.615 292 2HG MET 40 HG1 MET 40 -1.660 1.319 -28.212 293 1HE MET 40 HE1 MET 40 2.423 -0.571 -28.802 294 2HE MET 40 HE2 MET 40 1.854 0.356 -30.191 295 3HE MET 40 HE3 MET 40 0.894 -0.988 -29.574 296 H GLN 41 HN GLN 41 -1.086 -1.290 -24.920 297 HA GLN 41 HA GLN 41 -0.943 1.407 -23.751 298 1HB GLN 41 HB2 GLN 41 -1.657 -1.188 -22.458 299 2HB GLN 41 HB1 GLN 41 -0.735 -0.018 -21.524 300 1HG GLN 41 HG1 GLN 41 -3.376 0.533 -22.856 301 2HG GLN 41 HG2 GLN 41 -3.158 0.143 -21.150 302 1HE2 GLN 41 HE22 GLN 41 -4.165 2.560 -22.617 303 2HE2 GLN 41 HE21 GLN 41 -3.263 3.876 -21.954 304 H GLN 42 HN GLN 42 0.849 1.289 -21.896 305 HA GLN 42 HA GLN 42 3.081 -0.413 -22.446 306 1HB GLN 42 HB1 GLN 42 4.623 1.463 -23.093 307 2HB GLN 42 HB2 GLN 42 3.444 1.021 -24.320 308 1HG GLN 42 HG1 GLN 42 2.031 2.935 -23.306 309 2HG GLN 42 HG2 GLN 42 3.562 3.465 -22.609 310 1HE2 GLN 42 HE21 GLN 42 3.720 5.321 -23.805 311 2HE2 GLN 42 HE22 GLN 42 3.999 5.328 -25.510 312 HA PRO 43 HA PRO 43 3.872 0.784 -18.260 313 1HB PRO 43 HB2 PRO 43 6.389 -0.139 -17.963 314 2HB PRO 43 HB1 PRO 43 5.001 -1.222 -18.104 315 1HG PRO 43 HG1 PRO 43 6.980 -0.395 -20.195 316 2HG PRO 43 HG2 PRO 43 6.321 -2.006 -19.856 317 1HD PRO 43 HD1 PRO 43 5.403 -0.420 -21.867 318 2HD PRO 43 HD2 PRO 43 4.378 -1.591 -21.014 319 H ALA 44 HN ALA 44 3.805 3.090 -18.779 320 HA ALA 44 HA ALA 44 6.197 4.470 -19.532 321 1HB ALA 44 HB1 ALA 44 4.462 6.317 -18.351 322 2HB ALA 44 HB2 ALA 44 3.425 5.124 -19.135 323 3HB ALA 44 HB3 ALA 44 4.656 5.973 -20.070 324 H VAL 45 HN VAL 45 6.798 6.456 -18.057 325 HA VAL 45 HA VAL 45 7.650 5.302 -15.519 326 HB VAL 45 HB VAL 45 8.495 8.046 -16.240 327 1HG1 VAL 45 HG21 VAL 45 10.508 7.422 -15.225 328 2HG1 VAL 45 HG22 VAL 45 10.200 5.702 -15.465 329 3HG1 VAL 45 HG23 VAL 45 9.268 6.608 -14.271 330 1HG2 VAL 45 HG11 VAL 45 9.024 7.521 -18.349 331 2HG2 VAL 45 HG12 VAL 45 8.789 5.796 -18.074 332 3HG2 VAL 45 HG13 VAL 45 10.321 6.557 -17.642 333 H HIS 46 HN HIS 46 4.886 6.450 -16.188 334 HA HIS 46 HA HIS 46 4.647 8.733 -14.447 335 1HB HIS 46 HB2 HIS 46 3.189 7.952 -16.550 336 2HB HIS 46 HB1 HIS 46 2.240 7.192 -15.278 337 HD2 HIS 46 HD2 HIS 46 3.735 10.843 -15.646 338 HE1 HIS 46 HE1 HIS 46 -0.286 11.006 -14.334 339 HE2 HIS 46 HE2 HIS 46 1.760 12.373 -14.945 340 H VAL 47 HN VAL 47 4.590 8.599 -12.316 341 HA VAL 47 HA VAL 47 3.757 6.082 -11.059 342 HB VAL 47 HB VAL 47 4.786 7.053 -8.990 343 1HG1 VAL 47 HG11 VAL 47 6.491 6.686 -11.444 344 2HG1 VAL 47 HG12 VAL 47 6.052 5.472 -10.243 345 3HG1 VAL 47 HG13 VAL 47 7.142 6.790 -9.809 346 1HG2 VAL 47 HG21 VAL 47 4.580 9.440 -10.059 347 2HG2 VAL 47 HG22 VAL 47 6.178 9.058 -10.700 348 3HG2 VAL 47 HG23 VAL 47 5.903 9.057 -8.957 349 H GLN 48 HN GLN 48 2.894 6.666 -8.666 350 HA GLN 48 HA GLN 48 0.418 8.120 -9.151 351 1HB GLN 48 HB1 GLN 48 1.294 5.973 -7.365 352 2HB GLN 48 HB2 GLN 48 0.293 7.175 -6.562 353 1HG GLN 48 HG2 GLN 48 -1.403 6.869 -8.349 354 2HG GLN 48 HG1 GLN 48 -0.418 5.559 -8.997 355 1HE2 GLN 48 HE21 GLN 48 -1.143 3.645 -8.453 356 2HE2 GLN 48 HE22 GLN 48 -1.899 3.221 -6.957 357 H GLY 49 HN GLY 49 -0.395 9.194 -6.921 358 1HA GLY 49 HA2 GLY 49 1.439 11.405 -6.516 359 2HA GLY 49 HA1 GLY 49 -0.215 11.299 -5.932 360 H GLN 50 HN GLN 50 2.911 11.432 -4.966 361 HA GLN 50 HA GLN 50 2.715 9.615 -2.719 362 1HB GLN 50 HB2 GLN 50 4.878 11.663 -3.175 363 2HB GLN 50 HB1 GLN 50 4.975 10.161 -2.267 364 1HG GLN 50 HG2 GLN 50 4.638 10.367 -5.249 365 2HG GLN 50 HG1 GLN 50 6.156 10.047 -4.411 366 1HE2 GLN 50 HE21 GLN 50 6.457 8.057 -3.390 367 2HE2 GLN 50 HE22 GLN 50 5.483 6.682 -3.770 368 H GLU 51 HN GLU 51 0.709 11.577 -2.722 369 HA GLU 51 HA GLU 51 1.402 13.745 -1.000 370 1HB GLU 51 HB2 GLU 51 -0.930 12.856 -2.455 371 2HB GLU 51 HB1 GLU 51 -1.370 13.340 -0.822 372 1HG GLU 51 HG2 GLU 51 0.383 15.118 -2.444 373 2HG GLU 51 HG1 GLU 51 -1.348 15.072 -2.772 374 HA PRO 52 HA PRO 52 -0.956 11.025 2.332 375 1HB PRO 52 HB2 PRO 52 -0.362 8.319 1.284 376 2HB PRO 52 HB1 PRO 52 -1.838 8.940 2.029 377 1HG PRO 52 HG2 PRO 52 -1.716 8.476 -0.596 378 2HG PRO 52 HG1 PRO 52 -2.604 9.868 0.050 379 1HD PRO 52 HD2 PRO 52 0.097 9.770 -1.237 380 2HD PRO 52 HD1 PRO 52 -1.194 10.977 -1.415 381 H LEU 53 HN LEU 53 -0.055 9.415 3.978 382 HA LEU 53 HA LEU 53 2.676 10.036 4.461 383 1HB LEU 53 HB2 LEU 53 0.476 8.952 5.888 384 2HB LEU 53 HB1 LEU 53 1.799 7.820 6.034 385 HG LEU 53 HG LEU 53 1.441 9.708 7.813 386 1HD1 LEU 53 HD11 LEU 53 4.213 9.812 7.519 387 2HD1 LEU 53 HD12 LEU 53 3.717 8.254 6.855 388 3HD1 LEU 53 HD13 LEU 53 3.271 8.689 8.506 389 1HD2 LEU 53 HD21 LEU 53 2.103 11.795 7.374 390 2HD2 LEU 53 HD22 LEU 53 1.782 11.355 5.696 391 3HD2 LEU 53 HD23 LEU 53 3.425 11.271 6.331 392 H THR 54 HN THR 54 4.488 8.852 4.176 393 HA THR 54 HA THR 54 4.561 6.064 3.787 394 HB THR 54 HB THR 54 5.623 7.061 1.288 395 HG1 THR 54 HG1 THR 54 3.340 7.285 0.456 396 1HG2 THR 54 HG21 THR 54 4.167 5.333 0.321 397 2HG2 THR 54 HG22 THR 54 3.479 5.051 1.919 398 3HG2 THR 54 HG23 THR 54 5.186 4.721 1.625 399 H ALA 55 HN ALA 55 6.878 5.536 2.696 400 HA ALA 55 HA ALA 55 8.780 6.290 4.525 401 1HB ALA 55 HB1 ALA 55 8.988 4.378 3.000 402 2HB ALA 55 HB2 ALA 55 10.444 5.375 3.033 403 3HB ALA 55 HB3 ALA 55 9.326 5.490 1.673 404 H SER 56 HN SER 56 7.896 7.921 1.540 405 HA SER 56 HA SER 56 10.128 9.676 1.455 406 1HB SER 56 HB2 SER 56 9.152 9.737 -0.592 407 2HB SER 56 HB1 SER 56 7.539 9.425 0.050 408 HG SER 56 HG SER 56 8.938 11.895 0.064 409 H MET 57 HN MET 57 6.811 10.050 2.666 410 HA MET 57 HA MET 57 7.007 12.706 3.545 411 1HB MET 57 HB1 MET 57 5.349 10.359 4.436 412 2HB MET 57 HB2 MET 57 5.226 11.910 5.244 413 1HG MET 57 HG1 MET 57 3.648 11.178 3.233 414 2HG MET 57 HG2 MET 57 4.085 12.857 3.547 415 1HE MET 57 HE1 MET 57 4.111 10.172 0.518 416 2HE MET 57 HE2 MET 57 5.053 9.651 1.917 417 3HE MET 57 HE3 MET 57 5.869 10.072 0.410 418 H LEU 58 HN LEU 58 7.871 9.656 5.002 419 HA LEU 58 HA LEU 58 8.486 10.600 7.592 420 1HB LEU 58 HB1 LEU 58 9.632 8.223 6.131 421 2HB LEU 58 HB2 LEU 58 9.595 8.461 7.868 422 HG LEU 58 HG LEU 58 7.074 8.328 6.238 423 1HD1 LEU 58 HD21 LEU 58 7.716 5.897 7.667 424 2HD1 LEU 58 HD22 LEU 58 8.892 6.248 6.398 425 3HD1 LEU 58 HD23 LEU 58 7.176 6.122 6.004 426 1HD2 LEU 58 HD11 LEU 58 5.987 8.318 8.203 427 2HD2 LEU 58 HD12 LEU 58 7.466 9.085 8.790 428 3HD2 LEU 58 HD13 LEU 58 7.224 7.349 9.005 429 H ALA 59 HN ALA 59 10.420 10.044 4.695 430 HA ALA 59 HA ALA 59 12.912 10.776 5.830 431 1HB ALA 59 HB1 ALA 59 13.191 11.331 3.165 432 2HB ALA 59 HB2 ALA 59 11.884 10.148 3.170 433 3HB ALA 59 HB3 ALA 59 13.434 9.752 3.911 434 H SER 60 HN SER 60 10.190 12.590 5.137 435 HA SER 60 HA SER 60 11.492 15.028 4.344 436 1HB SER 60 HB2 SER 60 8.668 14.568 5.344 437 2HB SER 60 HB1 SER 60 9.263 16.034 4.559 438 HG SER 60 HG SER 60 8.130 14.481 3.179 439 H ALA 61 HN ALA 61 11.261 13.398 7.237 440 HA ALA 61 HA ALA 61 11.757 15.870 8.743 441 1HB ALA 61 HB1 ALA 61 9.848 13.658 9.318 442 2HB ALA 61 HB2 ALA 61 9.670 15.397 9.557 443 3HB ALA 61 HB3 ALA 61 10.658 14.452 10.670 444 HA PRO 62 HA PRO 62 15.574 13.334 9.296 445 1HB PRO 62 HB2 PRO 62 16.215 15.895 10.683 446 2HB PRO 62 HB1 PRO 62 17.191 14.962 9.543 447 1HG PRO 62 HG1 PRO 62 16.003 17.208 8.767 448 2HG PRO 62 HG2 PRO 62 16.059 15.798 7.691 449 1HD PRO 62 HD2 PRO 62 13.788 16.846 9.332 450 2HD PRO 62 HD1 PRO 62 13.772 16.141 7.701 451 HA PRO 63 HA PRO 63 15.649 11.737 13.492 452 1HB PRO 63 HB2 PRO 63 17.261 14.142 14.284 453 2HB PRO 63 HB1 PRO 63 17.443 12.459 14.792 454 1HG PRO 63 HG2 PRO 63 18.930 13.624 12.801 455 2HG PRO 63 HG1 PRO 63 18.605 11.888 12.908 456 1HD PRO 63 HD1 PRO 63 17.695 13.746 10.907 457 2HD PRO 63 HD2 PRO 63 17.387 12.001 11.003 458 H GLN 64 HN GLN 64 13.369 12.362 13.364 459 HA GLN 64 HA GLN 64 12.589 14.089 15.541 460 1HB GLN 64 HB1 GLN 64 12.851 15.674 13.643 461 2HB GLN 64 HB2 GLN 64 11.706 14.719 12.702 462 1HG GLN 64 HG1 GLN 64 9.956 15.680 13.686 463 2HG GLN 64 HG2 GLN 64 10.648 15.495 15.296 464 1HE2 GLN 64 HE21 GLN 64 9.217 17.736 13.976 465 2HE2 GLN 64 HE22 GLN 64 10.256 19.105 14.165 466 H GLU 65 HN GLU 65 10.727 13.275 12.661 467 HA GLU 65 HA GLU 65 9.064 11.492 14.303 468 1HB GLU 65 HB1 GLU 65 8.102 12.438 11.657 469 2HB GLU 65 HB2 GLU 65 7.208 12.170 13.146 470 1HG GLU 65 HG2 GLU 65 9.138 14.421 13.064 471 2HG GLU 65 HG1 GLU 65 7.622 14.583 12.178 472 H GLN 66 HN GLN 66 11.571 11.284 12.324 473 HA GLN 66 HA GLN 66 10.889 9.528 10.267 474 1HB GLN 66 HB2 GLN 66 13.291 10.497 11.508 475 2HB GLN 66 HB1 GLN 66 13.438 8.769 11.216 476 1HG GLN 66 HG1 GLN 66 12.511 9.420 8.851 477 2HG GLN 66 HG2 GLN 66 13.149 11.004 9.283 478 1HE2 GLN 66 HE22 GLN 66 13.939 8.854 7.306 479 2HE2 GLN 66 HE21 GLN 66 15.632 8.636 7.576 480 H LYS 67 HN LYS 67 11.032 9.039 13.642 481 HA LYS 67 HA LYS 67 10.461 6.192 13.250 482 1HB LYS 67 HB2 LYS 67 11.804 5.609 15.195 483 2HB LYS 67 HB1 LYS 67 12.789 6.419 13.987 484 1HG LYS 67 HG2 LYS 67 12.540 8.528 15.273 485 2HG LYS 67 HG1 LYS 67 11.711 7.605 16.530 486 1HD LYS 67 HD1 LYS 67 14.166 6.302 15.823 487 2HD LYS 67 HD2 LYS 67 14.478 7.993 16.219 488 1HE LYS 67 HE1 LYS 67 13.561 7.771 18.370 489 2HE LYS 67 HE2 LYS 67 12.783 6.240 17.970 490 1HZ LYS 67 HZ1 LYS 67 15.599 6.779 18.605 491 2HZ LYS 67 HZ2 LYS 67 15.224 5.476 17.594 492 3HZ LYS 67 HZ3 LYS 67 14.591 5.541 19.161 493 H GLN 68 HN GLN 68 8.798 8.595 13.732 494 HA GLN 68 HA GLN 68 7.436 7.596 16.134 495 1HB GLN 68 HB1 GLN 68 7.950 10.491 15.442 496 2HB GLN 68 HB2 GLN 68 6.862 9.957 16.715 497 1HG GLN 68 HG2 GLN 68 9.480 8.752 16.963 498 2HG GLN 68 HG1 GLN 68 9.557 10.514 16.962 499 1HE2 GLN 68 HE21 GLN 68 8.908 11.614 18.720 500 2HE2 GLN 68 HE22 GLN 68 8.275 10.886 20.152 501 H MET 69 HN MET 69 7.075 9.720 13.284 502 HA MET 69 HA MET 69 4.216 9.536 13.391 503 1HB MET 69 HB2 MET 69 4.185 11.009 11.533 504 2HB MET 69 HB1 MET 69 5.490 11.542 12.585 505 1HG MET 69 HG2 MET 69 7.040 11.213 11.020 506 2HG MET 69 HG1 MET 69 6.364 9.653 10.549 507 1HE MET 69 HE1 MET 69 7.732 11.760 8.608 508 2HE MET 69 HE2 MET 69 7.062 13.190 9.395 509 3HE MET 69 HE3 MET 69 6.642 12.826 7.720 510 H LEU 70 HN LEU 70 6.314 7.235 12.463 511 HA LEU 70 HA LEU 70 5.145 6.457 9.954 512 1HB LEU 70 HB1 LEU 70 6.349 4.208 11.227 513 2HB LEU 70 HB2 LEU 70 6.899 5.096 9.823 514 HG LEU 70 HG LEU 70 8.674 4.997 11.416 515 1HD1 LEU 70 HD11 LEU 70 8.700 7.570 12.039 516 2HD1 LEU 70 HD12 LEU 70 7.372 7.583 10.878 517 3HD1 LEU 70 HD13 LEU 70 8.962 6.986 10.397 518 1HD2 LEU 70 HD21 LEU 70 8.395 5.015 13.607 519 2HD2 LEU 70 HD22 LEU 70 6.656 5.121 13.328 520 3HD2 LEU 70 HD23 LEU 70 7.604 6.591 13.545 521 H GLY 71 HN GLY 71 4.686 5.698 13.337 522 1HA GLY 71 HA2 GLY 71 2.324 4.174 12.524 523 2HA GLY 71 HA1 GLY 71 3.362 3.576 13.801 524 H GLU 72 HN GLU 72 2.684 6.985 13.433 525 HA GLU 72 HA GLU 72 0.626 6.900 15.499 526 1HB GLU 72 HB1 GLU 72 3.177 8.505 15.769 527 2HB GLU 72 HB2 GLU 72 1.781 8.649 16.828 528 1HG GLU 72 HG1 GLU 72 2.353 5.950 16.868 529 2HG GLU 72 HG2 GLU 72 3.939 6.718 16.847 530 H ARG 73 HN ARG 73 1.646 8.032 12.610 531 HA ARG 73 HA ARG 73 -0.106 10.391 12.765 532 1HB ARG 73 HB1 ARG 73 2.521 10.694 12.453 533 2HB ARG 73 HB2 ARG 73 2.116 10.342 10.779 534 1HG ARG 73 HG1 ARG 73 0.522 12.402 12.207 535 2HG ARG 73 HG2 ARG 73 2.165 12.805 11.700 536 1HD ARG 73 HD2 ARG 73 1.567 12.057 9.401 537 2HD ARG 73 HD1 ARG 73 -0.096 11.850 9.949 538 HE ARG 73 HE ARG 73 1.281 14.350 9.443 539 1HH1 ARG 73 HH22 ARG 73 -1.483 12.760 10.849 540 2HH1 ARG 73 HH21 ARG 73 -2.463 14.187 10.851 541 1HH2 ARG 73 HH11 ARG 73 -0.005 16.233 9.442 542 2HH2 ARG 73 HH12 ARG 73 -1.624 16.161 10.052 543 H LEU 74 HN LEU 74 0.883 7.524 11.197 544 HA LEU 74 HA LEU 74 -0.520 7.962 8.723 545 1HB LEU 74 HB1 LEU 74 1.117 5.860 9.953 546 2HB LEU 74 HB2 LEU 74 -0.188 5.248 8.955 547 HG LEU 74 HG LEU 74 1.430 7.394 7.763 548 1HD1 LEU 74 HD11 LEU 74 3.041 5.910 9.044 549 2HD1 LEU 74 HD12 LEU 74 3.340 6.116 7.318 550 3HD1 LEU 74 HD13 LEU 74 2.588 4.635 7.913 551 1HD2 LEU 74 HD21 LEU 74 0.513 4.720 6.726 552 2HD2 LEU 74 HD22 LEU 74 1.128 6.073 5.777 553 3HD2 LEU 74 HD23 LEU 74 -0.418 6.217 6.617 554 H PHE 75 HN PHE 75 -1.218 6.804 11.858 555 HA PHE 75 HA PHE 75 -3.161 4.989 11.736 556 1HB PHE 75 HB1 PHE 75 -2.284 6.571 13.686 557 2HB PHE 75 HB2 PHE 75 -3.824 7.369 13.401 558 HD1 PHE 75 HD1 PHE 75 -4.721 6.845 15.553 559 HD2 PHE 75 HD2 PHE 75 -3.356 3.748 12.970 560 HE1 PHE 75 HE1 PHE 75 -5.825 5.173 16.982 561 HE2 PHE 75 HE2 PHE 75 -4.456 2.071 14.397 562 HZ PHE 75 HZ PHE 75 -5.693 2.783 16.404 563 HA PRO 76 HA PRO 76 -6.710 8.038 10.602 564 1HB PRO 76 HB1 PRO 76 -6.086 10.508 9.688 565 2HB PRO 76 HB2 PRO 76 -6.308 10.154 11.405 566 1HG PRO 76 HG1 PRO 76 -3.769 10.386 9.831 567 2HG PRO 76 HG2 PRO 76 -4.155 11.047 11.430 568 1HD PRO 76 HD2 PRO 76 -2.710 8.783 11.105 569 2HD PRO 76 HD1 PRO 76 -3.793 9.030 12.490 570 H LEU 77 HN LEU 77 -3.751 8.011 8.757 571 HA LEU 77 HA LEU 77 -5.141 8.354 6.240 572 1HB LEU 77 HB1 LEU 77 -2.238 7.914 6.915 573 2HB LEU 77 HB2 LEU 77 -2.837 8.070 5.275 574 HG LEU 77 HG LEU 77 -3.075 10.187 7.417 575 1HD1 LEU 77 HD11 LEU 77 -1.342 11.365 6.303 576 2HD1 LEU 77 HD12 LEU 77 -1.308 10.196 4.983 577 3HD1 LEU 77 HD13 LEU 77 -0.756 9.727 6.591 578 1HD2 LEU 77 HD21 LEU 77 -3.825 11.635 5.621 579 2HD2 LEU 77 HD22 LEU 77 -4.890 10.238 5.771 580 3HD2 LEU 77 HD23 LEU 77 -3.700 10.304 4.471 581 H ILE 78 HN ILE 78 -4.172 5.736 8.243 582 HA ILE 78 HA ILE 78 -3.928 3.778 6.154 583 HB ILE 78 HB ILE 78 -4.571 3.238 9.038 584 1HG1 ILE 78 HG12 ILE 78 -2.498 4.666 8.660 585 2HG1 ILE 78 HG11 ILE 78 -2.245 3.157 9.528 586 1HG2 ILE 78 HG21 ILE 78 -3.823 1.606 6.694 587 2HG2 ILE 78 HG22 ILE 78 -4.840 1.208 8.081 588 3HG2 ILE 78 HG23 ILE 78 -3.084 1.165 8.234 589 1HD1 ILE 78 HD11 ILE 78 -1.324 2.124 7.583 590 2HD1 ILE 78 HD12 ILE 78 -0.505 3.663 7.848 591 3HD1 ILE 78 HD13 ILE 78 -1.734 3.523 6.590 592 H GLN 79 HN GLN 79 -6.452 4.896 8.348 593 HA GLN 79 HA GLN 79 -8.460 3.035 7.784 594 1HB GLN 79 HB1 GLN 79 -8.320 5.806 8.794 595 2HB GLN 79 HB2 GLN 79 -9.848 5.386 8.034 596 1HG GLN 79 HG1 GLN 79 -10.490 4.198 9.795 597 2HG GLN 79 HG2 GLN 79 -8.963 3.318 9.848 598 1HE2 GLN 79 HE21 GLN 79 -10.911 5.557 11.390 599 2HE2 GLN 79 HE22 GLN 79 -9.766 6.157 12.534 600 H ALA 80 HN ALA 80 -6.971 5.330 5.810 601 HA ALA 80 HA ALA 80 -9.104 5.700 3.911 602 1HB ALA 80 HB1 ALA 80 -6.211 6.260 3.360 603 2HB ALA 80 HB2 ALA 80 -7.147 7.300 4.436 604 3HB ALA 80 HB3 ALA 80 -7.643 7.098 2.755 605 H MET 81 HN MET 81 -6.217 3.703 4.228 606 HA MET 81 HA MET 81 -6.351 2.618 1.579 607 1HB MET 81 HB1 MET 81 -5.021 1.204 3.866 608 2HB MET 81 HB2 MET 81 -4.532 1.283 2.179 609 1HG MET 81 HG2 MET 81 -3.417 3.220 2.454 610 2HG MET 81 HG1 MET 81 -4.540 3.832 3.663 611 1HE MET 81 HE1 MET 81 -1.204 1.128 3.577 612 2HE MET 81 HE2 MET 81 -0.490 2.630 4.168 613 3HE MET 81 HE3 MET 81 -1.454 2.635 2.691 614 H HIS 82 HN HIS 82 -7.253 1.457 4.791 615 HA HIS 82 HA HIS 82 -8.834 -0.685 3.532 616 1HB HIS 82 HB1 HIS 82 -7.241 -0.507 6.047 617 2HB HIS 82 HB2 HIS 82 -8.682 -1.515 6.066 618 HD2 HIS 82 HD2 HIS 82 -5.821 -1.237 3.347 619 HE1 HIS 82 HE1 HIS 82 -6.385 -5.273 4.480 620 HE2 HIS 82 HE2 HIS 82 -5.102 -3.698 2.961 621 HA PRO 83 HA PRO 83 -12.619 1.153 4.924 622 1HB PRO 83 HB2 PRO 83 -13.398 -1.563 5.846 623 2HB PRO 83 HB1 PRO 83 -14.233 -0.467 4.740 624 1HG PRO 83 HG1 PRO 83 -12.955 -2.614 3.818 625 2HG PRO 83 HG2 PRO 83 -12.912 -1.079 2.931 626 1HD PRO 83 HD2 PRO 83 -10.816 -2.331 4.660 627 2HD PRO 83 HD1 PRO 83 -10.634 -1.435 3.137 628 H THR 84 HN THR 84 -11.340 2.173 6.673 629 HA THR 84 HA THR 84 -10.806 2.638 8.834 630 HB THR 84 HB THR 84 -12.693 2.570 10.384 631 HG1 THR 84 HG1 THR 84 -14.606 1.539 8.895 632 1HG2 THR 84 HG21 THR 84 -14.497 3.266 8.414 633 2HG2 THR 84 HG22 THR 84 -12.921 3.661 7.726 634 3HG2 THR 84 HG23 THR 84 -13.402 4.345 9.279 635 H LEU 85 HN LEU 85 -9.887 0.082 7.933 636 HA LEU 85 HA LEU 85 -10.249 -1.736 10.174 637 1HB LEU 85 HB1 LEU 85 -9.270 -1.910 7.425 638 2HB LEU 85 HB2 LEU 85 -8.296 -2.820 8.562 639 HG LEU 85 HG LEU 85 -11.070 -3.359 9.057 640 1HD1 LEU 85 HD21 LEU 85 -11.790 -2.991 6.922 641 2HD1 LEU 85 HD22 LEU 85 -11.226 -4.655 6.769 642 3HD1 LEU 85 HD23 LEU 85 -10.210 -3.325 6.212 643 1HD2 LEU 85 HD11 LEU 85 -9.366 -4.857 9.756 644 2HD2 LEU 85 HD12 LEU 85 -8.719 -4.984 8.120 645 3HD2 LEU 85 HD13 LEU 85 -10.295 -5.679 8.502 646 H ALA 86 HN ALA 86 -8.554 0.942 9.878 647 HA ALA 86 HA ALA 86 -5.928 0.062 10.680 648 1HB ALA 86 HB1 ALA 86 -5.322 2.339 10.686 649 2HB ALA 86 HB2 ALA 86 -6.994 2.869 10.866 650 3HB ALA 86 HB3 ALA 86 -6.453 2.156 9.346 651 H GLY 87 HN GLY 87 -7.689 -1.069 12.421 652 1HA GLY 87 HA1 GLY 87 -7.892 0.562 14.813 653 2HA GLY 87 HA2 GLY 87 -8.398 -1.114 14.644 654 H LYS 88 HN LYS 88 -5.505 -1.244 13.337 655 HA LYS 88 HA LYS 88 -3.670 -0.942 15.445 656 1HB LYS 88 HB1 LYS 88 -5.002 -2.817 16.402 657 2HB LYS 88 HB2 LYS 88 -4.594 -3.789 15.001 658 1HG LYS 88 HG2 LYS 88 -3.203 -4.366 16.906 659 2HG LYS 88 HG1 LYS 88 -2.233 -3.682 15.597 660 1HD LYS 88 HD2 LYS 88 -3.227 -1.718 17.535 661 2HD LYS 88 HD1 LYS 88 -2.099 -2.902 18.200 662 1HE LYS 88 HE1 LYS 88 -0.362 -2.183 16.900 663 2HE LYS 88 HE2 LYS 88 -1.410 -1.633 15.601 664 1HZ LYS 88 HZ1 LYS 88 -1.443 0.410 16.443 665 2HZ LYS 88 HZ2 LYS 88 -0.209 -0.064 17.500 666 3HZ LYS 88 HZ3 LYS 88 -1.824 -0.138 17.998 667 H ILE 89 HN ILE 89 -3.967 -0.578 12.527 668 HA ILE 89 HA ILE 89 -2.181 -2.499 11.352 669 HB ILE 89 HB ILE 89 -3.208 0.063 10.152 670 1HG1 ILE 89 HG12 ILE 89 -4.169 -2.789 9.781 671 2HG1 ILE 89 HG11 ILE 89 -4.972 -1.598 10.797 672 1HG2 ILE 89 HG21 ILE 89 -1.857 -0.368 8.437 673 2HG2 ILE 89 HG22 ILE 89 -2.538 -1.986 8.274 674 3HG2 ILE 89 HG23 ILE 89 -1.166 -1.711 9.349 675 1HD1 ILE 89 HD11 ILE 89 -5.901 -0.539 9.050 676 2HD1 ILE 89 HD12 ILE 89 -5.657 -2.099 8.262 677 3HD1 ILE 89 HD13 ILE 89 -4.499 -0.792 8.010 678 H THR 90 HN THR 90 -1.753 0.888 10.644 679 HA THR 90 HA THR 90 0.993 0.867 10.581 680 HB THR 90 HB THR 90 -1.088 2.789 10.420 681 HG1 THR 90 HG1 THR 90 1.139 2.181 9.223 682 1HG2 THR 90 HG21 THR 90 1.025 3.561 12.335 683 2HG2 THR 90 HG22 THR 90 -0.662 4.068 12.233 684 3HG2 THR 90 HG23 THR 90 0.531 4.745 11.122 685 H GLY 91 HN GLY 91 -1.097 1.542 13.356 686 1HA GLY 91 HA2 GLY 91 0.850 2.444 15.152 687 2HA GLY 91 HA1 GLY 91 -0.620 1.586 15.603 688 H MET 92 HN MET 92 0.044 -0.758 14.012 689 HA MET 92 HA MET 92 1.755 -2.053 15.943 690 1HB MET 92 HB2 MET 92 0.189 -3.588 15.508 691 2HB MET 92 HB1 MET 92 -0.290 -2.804 14.011 692 1HG MET 92 HG1 MET 92 2.247 -4.148 13.776 693 2HG MET 92 HG2 MET 92 0.956 -5.214 14.297 694 1HE MET 92 HE1 MET 92 -0.432 -6.415 11.357 695 2HE MET 92 HE2 MET 92 -1.538 -5.472 12.361 696 3HE MET 92 HE3 MET 92 -0.233 -6.393 13.111 697 H LEU 93 HN LEU 93 1.948 -0.741 12.778 698 HA LEU 93 HA LEU 93 4.116 -2.197 11.752 699 1HB LEU 93 HB2 LEU 93 2.890 0.441 11.228 700 2HB LEU 93 HB1 LEU 93 4.496 0.167 10.589 701 HG LEU 93 HG LEU 93 2.714 -0.312 8.940 702 1HD1 LEU 93 HD11 LEU 93 3.482 -2.892 8.755 703 2HD1 LEU 93 HD12 LEU 93 4.723 -2.266 9.843 704 3HD1 LEU 93 HD13 LEU 93 4.484 -1.528 8.259 705 1HD2 LEU 93 HD21 LEU 93 0.889 -1.445 9.479 706 2HD2 LEU 93 HD22 LEU 93 1.488 -1.575 11.138 707 3HD2 LEU 93 HD23 LEU 93 1.856 -2.839 9.961 708 H LEU 94 HN LEU 94 3.965 -0.341 14.475 709 HA LEU 94 HA LEU 94 6.833 0.306 14.350 710 1HB LEU 94 HB1 LEU 94 4.523 1.677 15.528 711 2HB LEU 94 HB2 LEU 94 5.893 1.536 16.612 712 HG LEU 94 HG LEU 94 7.324 2.675 15.002 713 1HD1 LEU 94 HD11 LEU 94 6.088 1.779 12.998 714 2HD1 LEU 94 HD12 LEU 94 6.568 3.473 12.905 715 3HD1 LEU 94 HD13 LEU 94 4.895 3.049 13.268 716 1HD2 LEU 94 HD21 LEU 94 5.054 4.524 14.947 717 2HD2 LEU 94 HD22 LEU 94 6.660 4.712 15.653 718 3HD2 LEU 94 HD23 LEU 94 5.405 3.839 16.534 719 H GLU 95 HN GLU 95 5.508 -2.256 14.793 720 HA GLU 95 HA GLU 95 7.020 -3.135 17.041 721 1HB GLU 95 HB2 GLU 95 5.296 -3.790 18.530 722 2HB GLU 95 HB1 GLU 95 4.964 -2.117 18.108 723 1HG GLU 95 HG1 GLU 95 3.230 -2.791 16.584 724 2HG GLU 95 HG2 GLU 95 3.627 -4.491 16.831 725 H ILE 96 HN ILE 96 5.549 -3.630 14.127 726 HA ILE 96 HA ILE 96 4.762 -6.324 14.204 727 HB ILE 96 HB ILE 96 5.046 -6.406 11.815 728 1HG1 ILE 96 HG12 ILE 96 7.235 -5.356 11.635 729 2HG1 ILE 96 HG11 ILE 96 6.082 -4.600 10.542 730 1HG2 ILE 96 HG21 ILE 96 3.685 -4.176 13.101 731 2HG2 ILE 96 HG22 ILE 96 3.103 -5.333 11.904 732 3HG2 ILE 96 HG23 ILE 96 4.025 -3.919 11.387 733 1HD1 ILE 96 HD11 ILE 96 6.673 -2.650 11.358 734 2HD1 ILE 96 HD12 ILE 96 7.679 -3.421 12.585 735 3HD1 ILE 96 HD13 ILE 96 5.971 -3.125 12.905 736 H ASP 97 HN ASP 97 6.369 -7.325 12.011 737 HA ASP 97 HA ASP 97 8.306 -8.825 13.354 738 1HB ASP 97 HB1 ASP 97 7.091 -9.053 10.995 739 2HB ASP 97 HB2 ASP 97 8.574 -8.291 10.427 740 H ASN 98 HN ASN 98 8.383 -5.607 12.666 741 HA ASN 98 HA ASN 98 9.978 -4.028 12.934 742 1HB ASN 98 HB1 ASN 98 11.397 -6.419 13.809 743 2HB ASN 98 HB2 ASN 98 12.467 -5.236 13.064 744 1HD2 ASN 98 HD21 ASN 98 13.151 -5.504 15.461 745 2HD2 ASN 98 HD22 ASN 98 12.514 -4.310 16.535 746 H SER 99 HN SER 99 10.428 -6.608 10.665 747 HA SER 99 HA SER 99 12.251 -5.167 8.978 748 1HB SER 99 HB1 SER 99 10.502 -7.394 7.978 749 2HB SER 99 HB2 SER 99 12.156 -6.980 7.520 750 HG SER 99 HG SER 99 11.576 -7.811 10.144 751 H GLU 100 HN GLU 100 8.839 -5.353 9.440 752 HA GLU 100 HA GLU 100 8.173 -4.038 6.946 753 1HB GLU 100 HB1 GLU 100 6.253 -4.205 9.214 754 2HB GLU 100 HB2 GLU 100 5.965 -4.368 7.490 755 1HG GLU 100 HG1 GLU 100 7.655 -6.491 8.325 756 2HG GLU 100 HG2 GLU 100 6.269 -6.404 9.413 757 H LEU 101 HN LEU 101 8.952 -3.246 10.206 758 HA LEU 101 HA LEU 101 7.990 -0.535 10.123 759 1HB LEU 101 HB1 LEU 101 8.156 -1.309 12.302 760 2HB LEU 101 HB2 LEU 101 9.648 -2.172 11.994 761 HG LEU 101 HG LEU 101 10.443 0.424 11.664 762 1HD1 LEU 101 HD11 LEU 101 8.501 1.504 12.373 763 2HD1 LEU 101 HD12 LEU 101 9.537 1.502 13.800 764 3HD1 LEU 101 HD13 LEU 101 8.216 0.341 13.668 765 1HD2 LEU 101 HD21 LEU 101 11.457 -1.476 12.984 766 2HD2 LEU 101 HD22 LEU 101 10.423 -0.977 14.323 767 3HD2 LEU 101 HD23 LEU 101 11.634 0.134 13.681 768 H LEU 102 HN LEU 102 10.782 -2.296 9.169 769 HA LEU 102 HA LEU 102 12.493 0.027 8.908 770 1HB LEU 102 HB2 LEU 102 12.794 -2.905 8.314 771 2HB LEU 102 HB1 LEU 102 13.997 -1.746 7.793 772 HG LEU 102 HG LEU 102 13.490 -2.886 10.458 773 1HD1 LEU 102 HD11 LEU 102 15.688 -3.213 10.377 774 2HD1 LEU 102 HD12 LEU 102 16.009 -1.531 9.959 775 3HD1 LEU 102 HD13 LEU 102 15.591 -2.689 8.696 776 1HD2 LEU 102 HD21 LEU 102 12.888 -0.887 11.347 777 2HD2 LEU 102 HD22 LEU 102 13.689 0.047 10.083 778 3HD2 LEU 102 HD23 LEU 102 14.640 -0.681 11.378 779 H HIS 103 HN HIS 103 10.948 -2.334 6.756 780 HA HIS 103 HA HIS 103 11.876 -1.240 4.347 781 1HB HIS 103 HB1 HIS 103 10.415 -3.453 5.110 782 2HB HIS 103 HB2 HIS 103 9.241 -2.506 4.210 783 HD2 HIS 103 HD2 HIS 103 10.784 -5.366 3.198 784 HE1 HIS 103 HE1 HIS 103 12.218 -2.724 0.218 785 HE2 HIS 103 HE2 HIS 103 11.878 -5.155 0.854 786 H MET 104 HN MET 104 8.919 -0.674 6.204 787 HA MET 104 HA MET 104 7.544 0.925 4.402 788 1HB MET 104 HB2 MET 104 6.308 1.747 6.323 789 2HB MET 104 HB1 MET 104 6.605 0.023 6.516 790 1HG MET 104 HG1 MET 104 7.894 0.317 8.324 791 2HG MET 104 HG2 MET 104 8.650 1.767 7.669 792 1HE MET 104 HE1 MET 104 4.657 1.909 7.743 793 2HE MET 104 HE2 MET 104 4.441 1.757 9.489 794 3HE MET 104 HE3 MET 104 5.208 0.454 8.573 795 H LEU 105 HN LEU 105 10.185 1.726 6.574 796 HA LEU 105 HA LEU 105 9.934 4.572 6.061 797 1HB LEU 105 HB1 LEU 105 12.192 3.167 7.475 798 2HB LEU 105 HB2 LEU 105 11.745 4.857 7.591 799 HG LEU 105 HG LEU 105 10.071 2.564 8.614 800 1HD1 LEU 105 HD11 LEU 105 11.887 2.593 10.052 801 2HD1 LEU 105 HD12 LEU 105 10.747 3.680 10.844 802 3HD1 LEU 105 HD13 LEU 105 12.095 4.340 9.918 803 1HD2 LEU 105 HD21 LEU 105 8.864 4.394 9.785 804 2HD2 LEU 105 HD22 LEU 105 8.694 4.426 8.029 805 3HD2 LEU 105 HD23 LEU 105 9.790 5.553 8.829 806 H GLU 106 HN GLU 106 11.338 1.926 4.546 807 HA GLU 106 HA GLU 106 13.428 3.595 3.351 808 1HB GLU 106 HB1 GLU 106 14.755 1.745 3.159 809 2HB GLU 106 HB2 GLU 106 13.767 1.230 4.519 810 1HG GLU 106 HG1 GLU 106 13.240 -0.586 3.381 811 2HG GLU 106 HG2 GLU 106 12.370 0.431 2.233 812 H SER 107 HN SER 107 10.372 2.386 2.606 813 HA SER 107 HA SER 107 10.891 2.889 -0.239 814 1HB SER 107 HB2 SER 107 10.762 0.343 0.588 815 2HB SER 107 HB1 SER 107 9.040 0.650 0.380 816 HG SER 107 HG SER 107 10.323 1.636 -1.730 817 HA PRO 108 HA PRO 108 7.154 5.267 0.235 818 1HB PRO 108 HB2 PRO 108 6.752 5.869 -2.370 819 2HB PRO 108 HB1 PRO 108 8.020 6.635 -1.406 820 1HG PRO 108 HG2 PRO 108 8.225 4.362 -3.346 821 2HG PRO 108 HG1 PRO 108 9.291 5.767 -3.154 822 1HD PRO 108 HD1 PRO 108 9.883 3.323 -2.133 823 2HD PRO 108 HD2 PRO 108 10.400 4.837 -1.362 824 H GLU 109 HN GLU 109 7.423 2.215 -0.894 825 HA GLU 109 HA GLU 109 4.528 1.992 -1.399 826 1HB GLU 109 HB2 GLU 109 6.692 0.313 -2.690 827 2HB GLU 109 HB1 GLU 109 4.963 0.202 -2.993 828 1HG GLU 109 HG1 GLU 109 5.184 2.680 -3.712 829 2HG GLU 109 HG2 GLU 109 6.901 2.304 -3.851 830 H SER 110 HN SER 110 7.172 1.133 0.484 831 HA SER 110 HA SER 110 6.213 -1.462 1.288 832 1HB SER 110 HB1 SER 110 8.564 0.189 1.830 833 2HB SER 110 HB2 SER 110 7.964 -0.658 3.257 834 HG SER 110 HG SER 110 8.132 -2.600 2.111 835 H LEU 111 HN LEU 111 6.329 1.789 2.624 836 HA LEU 111 HA LEU 111 5.117 1.424 5.069 837 1HB LEU 111 HB1 LEU 111 6.032 3.528 3.968 838 2HB LEU 111 HB2 LEU 111 4.495 3.661 3.134 839 HG LEU 111 HG LEU 111 4.318 5.150 4.910 840 1HD1 LEU 111 HD21 LEU 111 2.519 3.223 4.760 841 2HD1 LEU 111 HD22 LEU 111 2.448 4.474 5.999 842 3HD1 LEU 111 HD23 LEU 111 3.109 2.886 6.387 843 1HD2 LEU 111 HD11 LEU 111 6.360 4.326 6.058 844 2HD2 LEU 111 HD12 LEU 111 5.361 3.083 6.820 845 3HD2 LEU 111 HD13 LEU 111 5.043 4.787 7.142 846 H ARG 112 HN ARG 112 3.685 1.643 1.848 847 HA ARG 112 HA ARG 112 1.000 1.349 2.816 848 1HB ARG 112 HB2 ARG 112 0.795 2.448 0.867 849 2HB ARG 112 HB1 ARG 112 2.323 1.835 0.244 850 1HG ARG 112 HG1 ARG 112 1.273 -0.207 -0.451 851 2HG ARG 112 HG2 ARG 112 -0.251 0.272 0.301 852 1HD ARG 112 HD2 ARG 112 -0.360 2.208 -1.225 853 2HD ARG 112 HD1 ARG 112 1.109 1.637 -2.018 854 HE ARG 112 HE ARG 112 -1.412 0.106 -1.981 855 1HH1 ARG 112 HH22 ARG 112 1.466 1.239 -3.586 856 2HH1 ARG 112 HH21 ARG 112 1.123 0.408 -5.066 857 1HH2 ARG 112 HH11 ARG 112 -1.872 -0.990 -3.924 858 2HH2 ARG 112 HH12 ARG 112 -0.775 -0.860 -5.259 859 H SER 113 HN SER 113 3.089 -0.722 0.788 860 HA SER 113 HA SER 113 1.427 -2.932 0.660 861 1HB SER 113 HB2 SER 113 3.432 -2.753 -0.713 862 2HB SER 113 HB1 SER 113 4.455 -2.856 0.720 863 HG SER 113 HG SER 113 3.508 -4.968 1.059 864 H LYS 114 HN LYS 114 4.133 -2.451 2.921 865 HA LYS 114 HA LYS 114 3.746 -4.691 4.487 866 1HB LYS 114 HB1 LYS 114 4.733 -1.986 5.406 867 2HB LYS 114 HB2 LYS 114 4.989 -3.511 6.241 868 1HG LYS 114 HG1 LYS 114 6.001 -2.899 3.475 869 2HG LYS 114 HG2 LYS 114 6.951 -2.724 4.952 870 1HD LYS 114 HD1 LYS 114 7.397 -4.908 5.021 871 2HD LYS 114 HD2 LYS 114 5.698 -5.328 4.796 872 1HE LYS 114 HE2 LYS 114 7.118 -4.312 2.418 873 2HE LYS 114 HE1 LYS 114 7.622 -5.896 3.006 874 1HZ LYS 114 HZ1 LYS 114 5.883 -6.720 1.934 875 2HZ LYS 114 HZ2 LYS 114 5.275 -5.183 1.578 876 3HZ LYS 114 HZ3 LYS 114 4.871 -5.935 3.038 877 H VAL 115 HN VAL 115 2.033 -1.608 4.576 878 HA VAL 115 HA VAL 115 0.770 -2.113 7.093 879 HB VAL 115 HB VAL 115 0.507 -0.047 4.981 880 1HG1 VAL 115 HG11 VAL 115 -1.846 -1.142 5.984 881 2HG1 VAL 115 HG12 VAL 115 -1.663 0.435 5.216 882 3HG1 VAL 115 HG13 VAL 115 -1.568 0.291 6.972 883 1HG2 VAL 115 HG21 VAL 115 0.152 0.970 7.569 884 2HG2 VAL 115 HG22 VAL 115 1.608 1.035 6.574 885 3HG2 VAL 115 HG23 VAL 115 1.369 -0.300 7.702 886 H ASP 116 HN ASP 116 -0.505 -2.121 3.749 887 HA ASP 116 HA ASP 116 -2.982 -3.246 4.312 888 1HB ASP 116 HB1 ASP 116 -2.876 -2.501 2.138 889 2HB ASP 116 HB2 ASP 116 -1.238 -3.101 1.900 890 H GLU 117 HN GLU 117 0.162 -4.712 4.036 891 HA GLU 117 HA GLU 117 -0.846 -7.425 3.992 892 1HB GLU 117 HB1 GLU 117 1.918 -6.234 4.231 893 2HB GLU 117 HB2 GLU 117 1.625 -7.961 4.389 894 1HG GLU 117 HG2 GLU 117 0.471 -6.701 1.998 895 2HG GLU 117 HG1 GLU 117 2.233 -6.721 2.074 896 H ALA 118 HN ALA 118 0.312 -5.075 6.291 897 HA ALA 118 HA ALA 118 0.566 -6.874 8.490 898 1HB ALA 118 HB1 ALA 118 0.885 -4.038 8.052 899 2HB ALA 118 HB2 ALA 118 1.623 -5.084 9.266 900 3HB ALA 118 HB3 ALA 118 0.037 -4.373 9.562 901 H VAL 119 HN VAL 119 -2.044 -5.375 6.858 902 HA VAL 119 HA VAL 119 -3.945 -5.430 8.990 903 HB VAL 119 HB VAL 119 -4.548 -5.603 6.053 904 1HG1 VAL 119 HG11 VAL 119 -6.128 -4.657 8.440 905 2HG1 VAL 119 HG12 VAL 119 -6.412 -6.124 7.500 906 3HG1 VAL 119 HG13 VAL 119 -6.659 -4.537 6.763 907 1HG2 VAL 119 HG21 VAL 119 -3.778 -3.540 5.794 908 2HG2 VAL 119 HG22 VAL 119 -3.264 -3.505 7.481 909 3HG2 VAL 119 HG23 VAL 119 -4.889 -2.975 7.041 910 H ALA 120 HN ALA 120 -3.151 -7.546 6.273 911 HA ALA 120 HA ALA 120 -5.010 -9.580 6.835 912 1HB ALA 120 HB1 ALA 120 -3.054 -9.127 4.918 913 2HB ALA 120 HB2 ALA 120 -4.092 -10.550 5.033 914 3HB ALA 120 HB3 ALA 120 -2.490 -10.565 5.772 915 H VAL 121 HN VAL 121 -2.025 -8.642 8.232 916 HA VAL 121 HA VAL 121 -1.618 -11.095 9.719 917 HB VAL 121 HB VAL 121 -0.163 -8.480 9.481 918 1HG1 VAL 121 HG21 VAL 121 1.336 -10.165 11.165 919 2HG1 VAL 121 HG22 VAL 121 -0.279 -10.041 11.860 920 3HG1 VAL 121 HG23 VAL 121 0.653 -8.580 11.529 921 1HG2 VAL 121 HG11 VAL 121 1.066 -11.189 9.289 922 2HG2 VAL 121 HG12 VAL 121 1.496 -9.694 8.458 923 3HG2 VAL 121 HG13 VAL 121 0.064 -10.597 7.962 924 H LEU 122 HN LEU 122 -2.837 -7.854 10.173 925 HA LEU 122 HA LEU 122 -3.043 -7.928 13.006 926 1HB LEU 122 HB2 LEU 122 -3.350 -5.767 12.571 927 2HB LEU 122 HB1 LEU 122 -3.646 -6.097 10.879 928 HG LEU 122 HG LEU 122 -6.047 -6.789 11.965 929 1HD1 LEU 122 HD11 LEU 122 -6.233 -4.443 13.365 930 2HD1 LEU 122 HD12 LEU 122 -4.666 -5.075 13.873 931 3HD1 LEU 122 HD13 LEU 122 -6.119 -6.056 14.072 932 1HD2 LEU 122 HD21 LEU 122 -6.842 -4.637 11.125 933 2HD2 LEU 122 HD22 LEU 122 -5.697 -5.381 10.011 934 3HD2 LEU 122 HD23 LEU 122 -5.181 -4.052 11.049 935 H GLN 123 HN GLN 123 -5.009 -8.907 10.326 936 HA GLN 123 HA GLN 123 -7.310 -9.575 11.936 937 1HB GLN 123 HB1 GLN 123 -6.597 -10.100 9.042 938 2HB GLN 123 HB2 GLN 123 -8.108 -10.621 9.776 939 1HG GLN 123 HG2 GLN 123 -7.716 -7.847 10.308 940 2HG GLN 123 HG1 GLN 123 -7.497 -8.144 8.585 941 1HE2 GLN 123 HE22 GLN 123 -9.709 -8.480 11.283 942 2HE2 GLN 123 HE21 GLN 123 -11.148 -8.591 10.335 943 H ALA 124 HN ALA 124 -4.420 -11.056 10.747 944 HA ALA 124 HA ALA 124 -5.285 -13.759 11.394 945 1HB ALA 124 HB1 ALA 124 -3.744 -13.007 9.426 946 2HB ALA 124 HB2 ALA 124 -3.407 -14.510 10.286 947 3HB ALA 124 HB3 ALA 124 -2.482 -13.055 10.658 948 H HIS 125 HN HIS 125 -4.541 -11.336 13.268 949 HA HIS 125 HA HIS 125 -3.119 -13.060 15.173 950 1HB HIS 125 HB1 HIS 125 -2.023 -10.768 14.112 951 2HB HIS 125 HB2 HIS 125 -2.763 -10.168 15.593 952 HD2 HIS 125 HD2 HIS 125 -1.263 -10.484 17.791 953 HE1 HIS 125 HE1 HIS 125 1.387 -13.386 16.217 954 HE2 HIS 125 HE2 HIS 125 0.860 -11.915 18.215 955 H GLN 126 HN GLN 126 -5.507 -10.642 14.497 956 HA GLN 126 HA GLN 126 -6.456 -10.566 17.252 957 1HB GLN 126 HB1 GLN 126 -7.286 -9.110 14.745 958 2HB GLN 126 HB2 GLN 126 -8.190 -8.991 16.249 959 1HG GLN 126 HG1 GLN 126 -5.263 -8.417 16.232 960 2HG GLN 126 HG2 GLN 126 -6.403 -7.204 15.651 961 1HE2 GLN 126 HE21 GLN 126 -5.459 -9.149 18.409 962 2HE2 GLN 126 HE22 GLN 126 -6.171 -8.131 19.611 963 H ALA 127 HN ALA 127 -8.024 -11.098 14.088 964 HA ALA 127 HA ALA 127 -10.073 -12.700 15.408 965 1HB ALA 127 HB1 ALA 127 -10.241 -10.816 13.461 966 2HB ALA 127 HB2 ALA 127 -11.475 -12.030 13.797 967 3HB ALA 127 HB3 ALA 127 -10.294 -12.303 12.516 968 H LYS 128 HN LYS 128 -7.208 -13.591 14.657 969 HA LYS 128 HA LYS 128 -7.526 -15.651 12.701 970 1HB LYS 128 HB2 LYS 128 -5.344 -16.485 13.674 971 2HB LYS 128 HB1 LYS 128 -5.313 -14.832 13.072 972 1HG LYS 128 HG1 LYS 128 -5.080 -13.938 15.160 973 2HG LYS 128 HG2 LYS 128 -5.928 -15.271 15.944 974 1HD LYS 128 HD1 LYS 128 -3.174 -15.486 14.733 975 2HD LYS 128 HD2 LYS 128 -3.488 -15.188 16.443 976 1HE LYS 128 HE1 LYS 128 -4.956 -17.340 16.247 977 2HE LYS 128 HE2 LYS 128 -3.962 -17.653 14.826 978 1HZ LYS 128 HZ1 LYS 128 -3.192 -17.590 17.652 979 2HZ LYS 128 HZ2 LYS 128 -2.042 -17.131 16.499 980 3HZ LYS 128 HZ3 LYS 128 -2.736 -18.672 16.435 981 H GLU 129 HN GLU 129 -6.058 -17.629 14.399 982 HA GLU 129 HA GLU 129 -8.378 -18.964 15.526 983 1HB GLU 129 HB2 GLU 129 -5.468 -19.788 15.363 984 2HB GLU 129 HB1 GLU 129 -6.757 -20.795 16.006 985 1HG GLU 129 HG1 GLU 129 -7.838 -20.857 13.848 986 2HG GLU 129 HG2 GLU 129 -6.630 -19.756 13.186 987 H ALA 130 HN ALA 130 -6.755 -16.481 16.467 988 HA ALA 130 HA ALA 130 -5.576 -16.971 18.922 989 1HB ALA 130 HB1 ALA 130 -5.212 -14.776 18.838 990 2HB ALA 130 HB2 ALA 130 -6.942 -14.427 18.883 991 3HB ALA 130 HB3 ALA 130 -6.146 -14.749 17.339 992 H ALA 131 HN ALA 131 -8.903 -16.951 18.038 993 HA ALA 131 HA ALA 131 -9.890 -16.532 20.723 994 1HB ALA 131 HB1 ALA 131 -11.416 -15.691 19.243 995 2HB ALA 131 HB2 ALA 131 -12.085 -17.304 19.491 996 3HB ALA 131 HB3 ALA 131 -11.126 -16.959 18.052 997 H GLN 132 HN GLN 132 -11.909 -18.311 21.015 998 HA GLN 132 HA GLN 132 -10.540 -20.638 21.916 999 1HB GLN 132 HB2 GLN 132 -13.375 -19.695 21.926 1000 2HB GLN 132 HB1 GLN 132 -13.053 -21.394 22.245 1001 1HG GLN 132 HG2 GLN 132 -11.584 -20.768 24.094 1002 2HG GLN 132 HG1 GLN 132 -11.914 -19.066 23.776 1003 1HE2 GLN 132 HE22 GLN 132 -13.416 -18.184 24.990 1004 2HE2 GLN 132 HE21 GLN 132 -14.717 -19.011 25.767 1005 H LYS 133 HN LYS 133 -13.474 -20.657 19.916 1006 HA LYS 133 HA LYS 133 -12.881 -23.164 18.762 1007 1HB LYS 133 HB2 LYS 133 -14.852 -20.996 18.065 1008 2HB LYS 133 HB1 LYS 133 -14.726 -22.470 17.116 1009 1HG LYS 133 HG1 LYS 133 -16.387 -23.068 18.549 1010 2HG LYS 133 HG2 LYS 133 -14.987 -23.607 19.479 1011 1HD LYS 133 HD1 LYS 133 -15.018 -21.432 20.679 1012 2HD LYS 133 HD2 LYS 133 -16.505 -21.024 19.823 1013 1HE LYS 133 HE1 LYS 133 -17.535 -21.949 21.584 1014 2HE LYS 133 HE2 LYS 133 -17.107 -23.483 20.826 1015 1HZ LYS 133 HZ1 LYS 133 -16.498 -23.035 23.293 1016 2HZ LYS 133 HZ2 LYS 133 -15.188 -22.191 22.637 1017 3HZ LYS 133 HZ3 LYS 133 -15.395 -23.832 22.289 1018 H ALA 134 HN ALA 134 -11.443 -23.638 17.252 1019 HA ALA 134 HA ALA 134 -10.248 -21.531 15.658 1020 1HB ALA 134 HB1 ALA 134 -8.898 -23.317 16.764 1021 2HB ALA 134 HB2 ALA 134 -8.599 -23.138 15.035 1022 3HB ALA 134 HB3 ALA 134 -9.594 -24.469 15.625 1023 H VAL 135 HN VAL 135 -12.932 -21.926 15.019 1024 HA VAL 135 HA VAL 135 -12.910 -23.430 12.503 1025 HB VAL 135 HB VAL 135 -15.410 -22.100 13.327 1026 1HG1 VAL 135 HG11 VAL 135 -14.522 -24.630 12.060 1027 2HG1 VAL 135 HG12 VAL 135 -15.790 -23.505 11.576 1028 3HG1 VAL 135 HG13 VAL 135 -16.073 -24.635 12.899 1029 1HG2 VAL 135 HG21 VAL 135 -13.963 -23.954 15.119 1030 2HG2 VAL 135 HG22 VAL 135 -15.683 -24.262 14.881 1031 3HG2 VAL 135 HG23 VAL 135 -15.144 -22.700 15.496 1032 H ASN 136 HN ASN 136 -14.108 -22.404 10.653 1033 HA ASN 136 HA ASN 136 -13.096 -19.693 10.294 1034 1HB ASN 136 HB1 ASN 136 -14.342 -21.589 8.289 1035 2HB ASN 136 HB2 ASN 136 -13.575 -20.049 7.912 1036 1HD2 ASN 136 HD21 ASN 136 -12.907 -22.715 6.982 1037 2HD2 ASN 136 HD22 ASN 136 -11.267 -22.993 7.446 1038 H SER 137 HN SER 137 -14.915 -19.197 11.966 1039 HA SER 137 HA SER 137 -17.479 -18.768 10.604 1040 1HB SER 137 HB2 SER 137 -17.499 -17.971 13.374 1041 2HB SER 137 HB1 SER 137 -18.429 -19.241 12.579 1042 HG SER 137 HG SER 137 -16.562 -19.595 14.329 1043 H ALA 138 HN ALA 138 -18.617 -16.681 11.401 1044 HA ALA 138 HA ALA 138 -17.141 -14.482 10.416 1045 1HB ALA 138 HB1 ALA 138 -19.831 -15.039 11.049 1046 2HB ALA 138 HB2 ALA 138 -19.181 -13.641 10.194 1047 3HB ALA 138 HB3 ALA 138 -19.380 -13.589 11.945 1048 H THR 139 HN THR 139 -16.160 -12.777 11.430 1049 HA THR 139 HA THR 139 -15.600 -13.149 14.285 1050 HB THR 139 HB THR 139 -13.611 -11.896 13.963 1051 HG1 THR 139 HG1 THR 139 -13.211 -10.795 11.994 1052 1HG2 THR 139 HG21 THR 139 -13.664 -13.226 11.308 1053 2HG2 THR 139 HG22 THR 139 -13.796 -14.207 12.768 1054 3HG2 THR 139 HG23 THR 139 -12.387 -13.173 12.524 1055 H GLY 140 HN GLY 140 -15.445 -11.228 15.657 1056 1HA GLY 140 HA2 GLY 140 -17.729 -9.497 15.207 1057 2HA GLY 140 HA1 GLY 140 -16.763 -9.593 16.671 1058 H VAL 141 HN VAL 141 -17.273 -7.968 13.690 1059 HA VAL 141 HA VAL 141 -14.839 -6.377 13.997 1060 HB VAL 141 HB VAL 141 -16.834 -6.018 11.783 1061 1HG1 VAL 141 HG11 VAL 141 -14.373 -4.826 12.478 1062 2HG1 VAL 141 HG12 VAL 141 -15.345 -4.555 11.032 1063 3HG1 VAL 141 HG13 VAL 141 -14.090 -5.794 11.031 1064 1HG2 VAL 141 HG21 VAL 141 -15.242 -8.367 12.313 1065 2HG2 VAL 141 HG22 VAL 141 -14.781 -7.614 10.787 1066 3HG2 VAL 141 HG23 VAL 141 -16.456 -8.090 11.065 1067 HA PRO 142 HA PRO 142 -18.283 -2.973 14.172 1068 1HB PRO 142 HB1 PRO 142 -20.812 -3.784 14.739 1069 2HB PRO 142 HB2 PRO 142 -20.206 -3.601 13.088 1070 1HG PRO 142 HG2 PRO 142 -20.476 -6.081 14.746 1071 2HG PRO 142 HG1 PRO 142 -20.879 -5.829 13.038 1072 1HD PRO 142 HD2 PRO 142 -18.597 -7.044 13.817 1073 2HD PRO 142 HD1 PRO 142 -18.684 -6.035 12.358 1074 H THR 143 HN THR 143 -19.367 -1.947 16.020 1075 HA THR 143 HA THR 143 -18.610 -3.271 18.531 1076 HB THR 143 HB THR 143 -17.474 -1.195 18.307 1077 HG1 THR 143 HG1 THR 143 -19.164 -1.591 20.237 1078 1HG2 THR 143 HG21 THR 143 -19.121 -0.300 16.559 1079 2HG2 THR 143 HG22 THR 143 -18.347 0.843 17.657 1080 3HG2 THR 143 HG23 THR 143 -20.012 0.335 17.942 1081 H VAL 144 HN VAL 144 -20.030 -3.414 20.249 1082 HA VAL 144 HA VAL 144 -22.757 -2.429 19.895 1083 HB VAL 144 HB VAL 144 -23.562 -4.736 20.745 1084 1HG1 VAL 144 HG21 VAL 144 -23.510 -5.601 18.314 1085 2HG1 VAL 144 HG22 VAL 144 -22.711 -4.071 17.952 1086 3HG1 VAL 144 HG23 VAL 144 -24.329 -4.075 18.654 1087 1HG2 VAL 144 HG11 VAL 144 -20.966 -5.557 19.447 1088 2HG2 VAL 144 HG12 VAL 144 -22.225 -6.634 20.053 1089 3HG2 VAL 144 HG13 VAL 144 -21.309 -5.631 21.176 Start of MODEL 24 1 1H GLY 1 HT1 GLY 1 11.168 -16.750 41.696 2 2H GLY 1 HT2 GLY 1 11.931 -15.609 40.710 3 3H GLY 1 HT3 GLY 1 12.238 -15.629 42.373 4 1HA GLY 1 HA1 GLY 1 13.145 -17.522 40.301 5 2HA GLY 1 HA2 GLY 1 14.110 -16.644 41.477 6 HA PRO 2 HA PRO 2 13.592 -20.988 43.044 7 1HB PRO 2 HB2 PRO 2 16.120 -21.160 44.051 8 2HB PRO 2 HB1 PRO 2 15.704 -21.580 42.387 9 1HG PRO 2 HG2 PRO 2 16.901 -19.055 43.463 10 2HG PRO 2 HG1 PRO 2 17.331 -19.963 42.001 11 1HD PRO 2 HD2 PRO 2 15.810 -17.735 41.916 12 2HD PRO 2 HD1 PRO 2 15.571 -19.085 40.788 13 H LEU 3 HN LEU 3 15.643 -18.598 44.731 14 HA LEU 3 HA LEU 3 14.432 -19.345 47.267 15 1HB LEU 3 HB2 LEU 3 16.788 -17.693 46.451 16 2HB LEU 3 HB1 LEU 3 16.109 -17.493 48.055 17 HG LEU 3 HG LEU 3 16.423 -20.262 47.721 18 1HD1 LEU 3 HD11 LEU 3 19.037 -20.075 47.372 19 2HD1 LEU 3 HD12 LEU 3 18.559 -18.700 46.376 20 3HD1 LEU 3 HD13 LEU 3 17.933 -20.309 46.017 21 1HD2 LEU 3 HD21 LEU 3 17.177 -18.183 49.495 22 2HD2 LEU 3 HD22 LEU 3 18.597 -19.181 49.187 23 3HD2 LEU 3 HD23 LEU 3 17.116 -19.919 49.796 24 H GLY 4 HN GLY 4 15.319 -16.122 46.046 25 1HA GLY 4 HA1 GLY 4 12.749 -15.133 47.097 26 2HA GLY 4 HA2 GLY 4 14.203 -14.164 46.916 27 H SER 5 HN SER 5 12.138 -12.961 45.931 28 HA SER 5 HA SER 5 11.855 -13.647 43.100 29 1HB SER 5 HB2 SER 5 10.244 -12.116 45.063 30 2HB SER 5 HB1 SER 5 10.227 -11.512 43.406 31 HG SER 5 HG SER 5 8.970 -13.105 42.901 32 H ALA 6 HN ALA 6 13.030 -11.101 45.221 33 HA ALA 6 HA ALA 6 13.780 -9.427 42.960 34 1HB ALA 6 HB1 ALA 6 13.092 -7.991 44.575 35 2HB ALA 6 HB2 ALA 6 14.791 -8.093 45.038 36 3HB ALA 6 HB3 ALA 6 13.585 -9.058 45.890 37 H ALA 7 HN ALA 7 15.630 -9.771 41.939 38 HA ALA 7 HA ALA 7 18.086 -10.143 43.405 39 1HB ALA 7 HB1 ALA 7 17.013 -12.450 43.110 40 2HB ALA 7 HB2 ALA 7 18.698 -12.258 42.628 41 3HB ALA 7 HB3 ALA 7 17.429 -12.278 41.404 42 H ALA 8 HN ALA 8 19.874 -9.513 42.256 43 HA ALA 8 HA ALA 8 21.072 -8.416 40.664 44 1HB ALA 8 HB1 ALA 8 20.499 -10.622 39.498 45 2HB ALA 8 HB2 ALA 8 21.040 -9.278 38.494 46 3HB ALA 8 HB3 ALA 8 19.325 -9.679 38.579 47 H ALA 9 HN ALA 9 20.411 -7.330 38.202 48 HA ALA 9 HA ALA 9 19.022 -4.969 39.013 49 1HB ALA 9 HB1 ALA 9 19.290 -4.555 36.405 50 2HB ALA 9 HB2 ALA 9 20.450 -5.872 36.578 51 3HB ALA 9 HB3 ALA 9 20.641 -4.397 37.526 52 H THR 10 HN THR 10 16.949 -4.432 38.757 53 HA THR 10 HA THR 10 15.123 -6.382 37.682 54 HB THR 10 HB THR 10 14.028 -3.758 38.429 55 HG1 THR 10 HG1 THR 10 15.707 -5.205 40.148 56 1HG2 THR 10 HG21 THR 10 12.348 -4.940 39.376 57 2HG2 THR 10 HG22 THR 10 13.408 -6.251 39.895 58 3HG2 THR 10 HG23 THR 10 12.908 -6.135 38.208 59 HA PRO 11 HA PRO 11 16.879 -3.186 37.675 60 1HB PRO 11 HB2 PRO 11 17.203 -0.751 36.651 61 2HB PRO 11 HB1 PRO 11 17.939 -2.161 35.880 62 1HG PRO 11 HG1 PRO 11 15.493 -0.634 35.108 63 2HG PRO 11 HG2 PRO 11 16.737 -1.356 34.074 64 1HD PRO 11 HD2 PRO 11 14.253 -2.487 34.672 65 2HD PRO 11 HD1 PRO 11 15.651 -3.349 34.002 66 H ALA 12 HN ALA 12 16.812 -1.286 39.139 67 HA ALA 12 HA ALA 12 14.132 -0.869 40.101 68 1HB ALA 12 HB1 ALA 12 15.430 -1.013 41.936 69 2HB ALA 12 HB2 ALA 12 15.628 0.721 41.681 70 3HB ALA 12 HB3 ALA 12 16.859 -0.402 41.104 71 H VAL 13 HN VAL 13 16.763 1.365 39.190 72 HA VAL 13 HA VAL 13 14.896 3.558 38.949 73 HB VAL 13 HB VAL 13 17.024 4.757 38.083 74 1HG1 VAL 13 HG11 VAL 13 17.834 5.041 40.417 75 2HG1 VAL 13 HG12 VAL 13 16.764 3.726 40.902 76 3HG1 VAL 13 HG13 VAL 13 16.087 5.215 40.244 77 1HG2 VAL 13 HG21 VAL 13 18.923 3.294 39.455 78 2HG2 VAL 13 HG22 VAL 13 18.762 3.413 37.703 79 3HG2 VAL 13 HG23 VAL 13 18.013 2.071 38.568 80 H ARG 14 HN ARG 14 13.578 3.404 37.220 81 HA ARG 14 HA ARG 14 14.723 2.696 34.618 82 1HB ARG 14 HB2 ARG 14 12.073 2.472 35.858 83 2HB ARG 14 HB1 ARG 14 12.030 3.053 34.199 84 1HG ARG 14 HG1 ARG 14 13.624 1.034 33.756 85 2HG ARG 14 HG2 ARG 14 12.939 0.423 35.263 86 1HD ARG 14 HD2 ARG 14 10.720 1.275 33.890 87 2HD ARG 14 HD1 ARG 14 11.747 0.632 32.608 88 HE ARG 14 HE ARG 14 11.632 -1.169 34.790 89 1HH1 ARG 14 HH11 ARG 14 9.752 0.019 32.107 90 2HH1 ARG 14 HH12 ARG 14 8.818 -1.431 31.952 91 1HH2 ARG 14 HH21 ARG 14 10.410 -3.081 34.593 92 2HH2 ARG 14 HH22 ARG 14 9.193 -3.195 33.366 93 H THR 15 HN THR 15 15.174 4.200 33.155 94 HA THR 15 HA THR 15 14.271 6.941 33.643 95 HB THR 15 HB THR 15 16.175 6.403 31.446 96 HG1 THR 15 HG1 THR 15 16.725 5.764 34.135 97 1HG2 THR 15 HG21 THR 15 17.361 8.150 33.163 98 2HG2 THR 15 HG22 THR 15 15.648 8.496 33.397 99 3HG2 THR 15 HG23 THR 15 16.354 8.591 31.784 100 H VAL 16 HN VAL 16 12.575 7.672 32.570 101 HA VAL 16 HA VAL 16 11.822 6.381 30.053 102 HB VAL 16 HB VAL 16 9.787 6.380 30.926 103 1HG1 VAL 16 HG11 VAL 16 10.638 8.405 32.988 104 2HG1 VAL 16 HG12 VAL 16 10.795 6.656 33.150 105 3HG1 VAL 16 HG13 VAL 16 9.195 7.392 33.038 106 1HG2 VAL 16 HG21 VAL 16 9.444 8.274 29.453 107 2HG2 VAL 16 HG22 VAL 16 9.949 9.383 30.728 108 3HG2 VAL 16 HG23 VAL 16 8.466 8.448 30.910 109 HA PRO 17 HA PRO 17 11.757 11.177 29.014 110 1HB PRO 17 HB2 PRO 17 13.652 12.586 30.433 111 2HB PRO 17 HB1 PRO 17 11.926 12.569 30.808 112 1HG PRO 17 HG2 PRO 17 14.151 10.995 32.038 113 2HG PRO 17 HG1 PRO 17 12.764 11.775 32.819 114 1HD PRO 17 HD1 PRO 17 12.818 9.131 32.380 115 2HD PRO 17 HD2 PRO 17 11.313 10.063 32.237 116 H GLN 18 HN GLN 18 14.931 10.235 30.364 117 HA GLN 18 HA GLN 18 16.242 10.942 27.885 118 1HB GLN 18 HB1 GLN 18 17.029 10.537 30.628 119 2HB GLN 18 HB2 GLN 18 18.055 9.586 29.564 120 1HG GLN 18 HG1 GLN 18 19.197 11.384 28.983 121 2HG GLN 18 HG2 GLN 18 17.722 12.201 28.466 122 1HE2 GLN 18 HE21 GLN 18 20.034 13.350 29.737 123 2HE2 GLN 18 HE22 GLN 18 19.492 14.054 31.219 124 H TYR 19 HN TYR 19 14.954 9.323 26.667 125 HA TYR 19 HA TYR 19 15.552 6.537 27.057 126 1HB TYR 19 HB1 TYR 19 13.407 7.592 26.046 127 2HB TYR 19 HB2 TYR 19 14.341 7.688 24.556 128 HD1 TYR 19 HD1 TYR 19 13.611 5.155 27.217 129 HD2 TYR 19 HD2 TYR 19 14.052 5.965 23.063 130 HE1 TYR 19 HE1 TYR 19 13.031 2.822 26.706 131 HE2 TYR 19 HE2 TYR 19 13.473 3.632 22.541 132 HH TYR 19 HH TYR 19 12.663 1.320 25.115 133 H LYS 20 HN LYS 20 16.851 5.224 25.805 134 HA LYS 20 HA LYS 20 19.142 6.471 24.639 135 1HB LYS 20 HB2 LYS 20 19.150 4.295 25.908 136 2HB LYS 20 HB1 LYS 20 18.372 3.553 24.517 137 1HG LYS 20 HG2 LYS 20 20.565 4.838 23.434 138 2HG LYS 20 HG1 LYS 20 21.159 4.190 24.964 139 1HD LYS 20 HD1 LYS 20 20.169 1.983 24.311 140 2HD LYS 20 HD2 LYS 20 19.832 2.674 22.723 141 1HE LYS 20 HE1 LYS 20 22.113 2.926 22.226 142 2HE LYS 20 HE2 LYS 20 22.589 2.708 23.911 143 1HZ LYS 20 HZ1 LYS 20 22.331 0.449 23.786 144 2HZ LYS 20 HZ2 LYS 20 22.857 0.779 22.212 145 3HZ LYS 20 HZ3 LYS 20 21.213 0.518 22.518 146 H TYR 21 HN TYR 21 19.796 6.526 22.504 147 HA TYR 21 HA TYR 21 17.642 6.364 20.554 148 1HB TYR 21 HB2 TYR 21 20.405 7.551 20.543 149 2HB TYR 21 HB1 TYR 21 19.526 7.314 19.036 150 HD1 TYR 21 HD1 TYR 21 19.804 9.296 22.067 151 HD2 TYR 21 HD2 TYR 21 17.430 8.554 18.615 152 HE1 TYR 21 HE1 TYR 21 18.631 11.428 22.422 153 HE2 TYR 21 HE2 TYR 21 16.251 10.684 18.960 154 HH TYR 21 HH TYR 21 15.885 12.372 20.421 155 H ALA 22 HN ALA 22 17.456 4.067 20.485 156 HA ALA 22 HA ALA 22 19.725 2.576 19.412 157 1HB ALA 22 HB1 ALA 22 18.072 0.629 19.667 158 2HB ALA 22 HB2 ALA 22 17.079 1.775 20.568 159 3HB ALA 22 HB3 ALA 22 18.702 1.380 21.132 160 H ALA 23 HN ALA 23 16.997 4.227 18.302 161 HA ALA 23 HA ALA 23 16.592 2.579 15.948 162 1HB ALA 23 HB1 ALA 23 14.703 3.705 17.120 163 2HB ALA 23 HB2 ALA 23 14.802 4.067 15.398 164 3HB ALA 23 HB3 ALA 23 15.356 5.252 16.581 165 H GLY 24 HN GLY 24 19.029 4.447 16.725 166 1HA GLY 24 HA1 GLY 24 19.147 6.035 14.268 167 2HA GLY 24 HA2 GLY 24 20.256 6.147 15.626 168 H VAL 25 HN VAL 25 19.825 4.994 12.514 169 HA VAL 25 HA VAL 25 22.018 3.049 12.798 170 HB VAL 25 HB VAL 25 20.127 3.304 10.461 171 1HG1 VAL 25 HG21 VAL 25 22.157 1.229 11.263 172 2HG1 VAL 25 HG22 VAL 25 22.158 2.241 9.819 173 3HG1 VAL 25 HG23 VAL 25 20.943 0.978 10.009 174 1HG2 VAL 25 HG11 VAL 25 18.606 2.015 11.471 175 2HG2 VAL 25 HG12 VAL 25 19.412 2.466 12.973 176 3HG2 VAL 25 HG13 VAL 25 19.834 0.957 12.165 177 H ARG 26 HN ARG 26 23.939 3.493 11.921 178 HA ARG 26 HA ARG 26 24.458 6.023 10.745 179 1HB ARG 26 HB2 ARG 26 26.164 3.538 10.975 180 2HB ARG 26 HB1 ARG 26 26.753 5.077 10.361 181 1HG ARG 26 HG1 ARG 26 25.438 5.097 13.012 182 2HG ARG 26 HG2 ARG 26 27.028 4.340 12.898 183 1HD ARG 26 HD2 ARG 26 27.826 6.413 13.177 184 2HD ARG 26 HD1 ARG 26 27.397 6.643 11.482 185 HE ARG 26 HE ARG 26 25.383 7.727 12.196 186 1HH1 ARG 26 HH11 ARG 26 27.691 7.076 14.726 187 2HH1 ARG 26 HH12 ARG 26 27.035 8.259 15.806 188 1HH2 ARG 26 HH21 ARG 26 24.512 9.287 13.612 189 2HH2 ARG 26 HH22 ARG 26 25.227 9.517 15.173 190 H ASN 27 HN ASN 27 23.480 6.405 8.827 191 HA ASN 27 HA ASN 27 23.675 4.414 6.698 192 1HB ASN 27 HB2 ASN 27 22.098 5.853 5.478 193 2HB ASN 27 HB1 ASN 27 21.482 5.447 7.077 194 1HD2 ASN 27 HD21 ASN 27 21.310 7.791 5.042 195 2HD2 ASN 27 HD22 ASN 27 21.434 9.181 6.061 196 HA PRO 28 HA PRO 28 27.144 6.321 4.729 197 1HB PRO 28 HB1 PRO 28 25.818 5.595 2.177 198 2HB PRO 28 HB2 PRO 28 27.420 5.154 2.780 199 1HG PRO 28 HG2 PRO 28 25.439 3.369 2.725 200 2HG PRO 28 HG1 PRO 28 26.599 3.407 4.067 201 1HD PRO 28 HD2 PRO 28 23.787 4.429 3.959 202 2HD PRO 28 HD1 PRO 28 24.632 3.590 5.277 203 H GLN 29 HN GLN 29 23.888 7.240 4.129 204 HA GLN 29 HA GLN 29 24.596 9.495 2.444 205 1HB GLN 29 HB1 GLN 29 22.277 7.959 2.818 206 2HB GLN 29 HB2 GLN 29 21.884 9.555 3.444 207 1HG GLN 29 HG2 GLN 29 22.045 10.552 1.407 208 2HG GLN 29 HG1 GLN 29 23.234 9.395 0.809 209 1HE2 GLN 29 HE21 GLN 29 19.876 9.387 1.969 210 2HE2 GLN 29 HE22 GLN 29 19.268 8.364 0.717 211 H GLN 30 HN GLN 30 25.978 9.825 4.687 212 HA GLN 30 HA GLN 30 24.517 11.383 6.630 213 1HB GLN 30 HB1 GLN 30 27.243 10.295 6.362 214 2HB GLN 30 HB2 GLN 30 27.146 11.840 7.196 215 1HG GLN 30 HG2 GLN 30 25.782 9.267 7.939 216 2HG GLN 30 HG1 GLN 30 27.049 10.114 8.825 217 1HE2 GLN 30 HE21 GLN 30 26.499 12.275 9.641 218 2HE2 GLN 30 HE22 GLN 30 24.884 12.562 10.184 219 H HIS 31 HN HIS 31 26.880 11.982 4.067 220 HA HIS 31 HA HIS 31 27.551 13.875 3.003 221 1HB HIS 31 HB1 HIS 31 24.763 14.730 3.802 222 2HB HIS 31 HB2 HIS 31 25.788 15.635 2.693 223 HD2 HIS 31 HD2 HIS 31 23.849 12.235 2.825 224 HE1 HIS 31 HE1 HIS 31 24.840 13.155 -1.186 225 HE2 HIS 31 HE2 HIS 31 23.575 11.566 0.333 226 H LEU 32 HN LEU 32 28.847 13.826 5.234 227 HA LEU 32 HA LEU 32 28.336 16.228 6.805 228 1HB LEU 32 HB2 LEU 32 30.550 15.316 7.933 229 2HB LEU 32 HB1 LEU 32 28.976 14.638 8.302 230 HG LEU 32 HG LEU 32 29.861 13.136 6.136 231 1HD1 LEU 32 HD11 LEU 32 32.078 12.422 6.640 232 2HD1 LEU 32 HD12 LEU 32 32.132 13.423 8.091 233 3HD1 LEU 32 HD13 LEU 32 32.103 14.179 6.498 234 1HD2 LEU 32 HD21 LEU 32 30.431 12.125 8.851 235 2HD2 LEU 32 HD22 LEU 32 29.496 11.403 7.540 236 3HD2 LEU 32 HD23 LEU 32 28.783 12.669 8.540 237 H ASN 33 HN ASN 33 28.807 17.856 5.319 238 HA ASN 33 HA ASN 33 31.526 17.961 4.242 239 1HB ASN 33 HB1 ASN 33 29.099 19.681 3.678 240 2HB ASN 33 HB2 ASN 33 30.670 19.876 2.907 241 1HD2 ASN 33 HD21 ASN 33 30.953 18.886 1.050 242 2HD2 ASN 33 HD22 ASN 33 30.034 17.547 0.460 243 H ALA 34 HN ALA 34 31.856 20.695 4.006 244 HA ALA 34 HA ALA 34 32.909 21.364 6.536 245 1HB ALA 34 HB1 ALA 34 33.912 22.214 4.512 246 2HB ALA 34 HB2 ALA 34 33.391 23.562 5.523 247 3HB ALA 34 HB3 ALA 34 32.437 23.096 4.114 248 H GLN 35 HN GLN 35 31.665 21.762 8.245 249 HA GLN 35 HA GLN 35 29.252 23.405 7.891 250 1HB GLN 35 HB2 GLN 35 29.334 21.005 9.033 251 2HB GLN 35 HB1 GLN 35 29.800 21.954 10.439 252 1HG GLN 35 HG1 GLN 35 27.769 23.086 10.503 253 2HG GLN 35 HG2 GLN 35 27.370 22.655 8.840 254 1HE2 GLN 35 HE21 GLN 35 27.445 21.595 12.140 255 2HE2 GLN 35 HE22 GLN 35 26.483 20.178 11.924 256 HA PRO 36 HA PRO 36 32.142 26.408 9.809 257 1HB PRO 36 HB2 PRO 36 30.615 28.578 9.117 258 2HB PRO 36 HB1 PRO 36 31.842 27.858 8.070 259 1HG PRO 36 HG1 PRO 36 28.874 27.473 8.058 260 2HG PRO 36 HG2 PRO 36 29.983 27.675 6.689 261 1HD PRO 36 HD1 PRO 36 29.041 25.260 7.402 262 2HD PRO 36 HD2 PRO 36 30.689 25.471 6.775 263 H GLN 37 HN GLN 37 28.718 27.388 9.860 264 HA GLN 37 HA GLN 37 28.929 27.691 12.769 265 1HB GLN 37 HB2 GLN 37 26.601 28.687 11.169 266 2HB GLN 37 HB1 GLN 37 27.275 29.322 12.663 267 1HG GLN 37 HG1 GLN 37 28.678 29.462 10.008 268 2HG GLN 37 HG2 GLN 37 27.643 30.740 10.645 269 1HE2 GLN 37 HE21 GLN 37 30.726 29.277 10.728 270 2HE2 GLN 37 HE22 GLN 37 31.446 30.325 11.897 271 H VAL 38 HN VAL 38 26.514 27.488 13.737 272 HA VAL 38 HA VAL 38 25.893 24.682 13.474 273 HB VAL 38 HB VAL 38 25.941 25.730 15.691 274 1HG1 VAL 38 HG21 VAL 38 24.082 27.593 14.401 275 2HG1 VAL 38 HG22 VAL 38 25.172 27.836 15.767 276 3HG1 VAL 38 HG23 VAL 38 23.599 27.079 16.018 277 1HG2 VAL 38 HG11 VAL 38 24.543 24.116 16.289 278 2HG2 VAL 38 HG12 VAL 38 23.894 24.065 14.649 279 3HG2 VAL 38 HG13 VAL 38 23.170 25.134 15.850 280 H THR 39 HN THR 39 24.591 27.710 12.399 281 HA THR 39 HA THR 39 22.025 26.570 11.669 282 HB THR 39 HB THR 39 22.721 29.216 10.591 283 HG1 THR 39 HG1 THR 39 23.786 29.649 12.401 284 1HG2 THR 39 HG21 THR 39 20.464 28.842 10.528 285 2HG2 THR 39 HG22 THR 39 20.628 29.755 12.028 286 3HG2 THR 39 HG23 THR 39 20.449 28.000 12.077 287 H MET 40 HN MET 40 22.221 25.128 10.046 288 HA MET 40 HA MET 40 23.730 25.914 7.652 289 1HB MET 40 HB1 MET 40 23.358 23.423 9.047 290 2HB MET 40 HB2 MET 40 22.803 23.262 7.386 291 1HG MET 40 HG2 MET 40 25.405 24.595 7.768 292 2HG MET 40 HG1 MET 40 25.337 22.875 8.151 293 1HE MET 40 HE1 MET 40 25.829 25.063 4.496 294 2HE MET 40 HE2 MET 40 24.939 25.653 5.900 295 3HE MET 40 HE3 MET 40 24.066 25.019 4.506 296 H GLN 41 HN GLN 41 21.223 27.109 8.194 297 HA GLN 41 HA GLN 41 19.094 27.410 7.402 298 1HB GLN 41 HB1 GLN 41 19.039 27.800 5.007 299 2HB GLN 41 HB2 GLN 41 20.538 28.416 5.687 300 1HG GLN 41 HG1 GLN 41 21.825 26.807 4.668 301 2HG GLN 41 HG2 GLN 41 20.480 25.677 4.514 302 1HE2 GLN 41 HE21 GLN 41 20.812 25.335 2.338 303 2HE2 GLN 41 HE22 GLN 41 20.470 26.533 1.141 304 H GLN 42 HN GLN 42 19.360 24.791 8.311 305 HA GLN 42 HA GLN 42 18.120 23.079 6.305 306 1HB GLN 42 HB1 GLN 42 18.323 21.315 8.025 307 2HB GLN 42 HB2 GLN 42 19.862 22.089 7.673 308 1HG GLN 42 HG2 GLN 42 19.703 23.405 9.694 309 2HG GLN 42 HG1 GLN 42 18.109 22.733 10.033 310 1HE2 GLN 42 HE21 GLN 42 19.709 22.448 12.027 311 2HE2 GLN 42 HE22 GLN 42 20.373 20.857 12.150 312 HA PRO 43 HA PRO 43 17.049 21.243 6.432 313 1HB PRO 43 HB2 PRO 43 14.728 20.091 5.717 314 2HB PRO 43 HB1 PRO 43 15.432 19.860 7.319 315 1HG PRO 43 HG1 PRO 43 13.090 21.464 6.504 316 2HG PRO 43 HG2 PRO 43 13.466 20.738 8.074 317 1HD PRO 43 HD1 PRO 43 13.833 23.456 7.266 318 2HD PRO 43 HD2 PRO 43 14.265 22.715 8.818 319 H ALA 44 HN ALA 44 17.820 21.958 4.542 320 HA ALA 44 HA ALA 44 16.171 23.532 2.748 321 1HB ALA 44 HB1 ALA 44 18.297 24.411 2.811 322 2HB ALA 44 HB2 ALA 44 18.376 23.409 1.361 323 3HB ALA 44 HB3 ALA 44 19.067 22.825 2.875 324 H VAL 45 HN VAL 45 14.760 21.473 2.629 325 HA VAL 45 HA VAL 45 15.756 19.458 0.789 326 HB VAL 45 HB VAL 45 13.422 18.513 1.035 327 1HG1 VAL 45 HG11 VAL 45 13.832 17.733 3.372 328 2HG1 VAL 45 HG12 VAL 45 15.161 18.889 3.465 329 3HG1 VAL 45 HG13 VAL 45 15.220 17.570 2.296 330 1HG2 VAL 45 HG21 VAL 45 12.668 20.912 1.881 331 2HG2 VAL 45 HG22 VAL 45 13.054 20.199 3.447 332 3HG2 VAL 45 HG23 VAL 45 11.855 19.437 2.402 333 H HIS 46 HN HIS 46 14.827 19.001 -1.237 334 HA HIS 46 HA HIS 46 13.514 21.319 -2.485 335 1HB HIS 46 HB1 HIS 46 14.338 20.163 -4.642 336 2HB HIS 46 HB2 HIS 46 15.530 20.971 -3.629 337 HD2 HIS 46 HD2 HIS 46 17.593 19.431 -2.824 338 HE1 HIS 46 HE1 HIS 46 15.948 15.719 -4.024 339 HE2 HIS 46 HE2 HIS 46 18.003 16.884 -3.100 340 H VAL 47 HN VAL 47 12.590 18.613 -1.102 341 HA VAL 47 HA VAL 47 10.868 17.571 -3.204 342 HB VAL 47 HB VAL 47 11.946 15.970 -1.704 343 1HG1 VAL 47 HG11 VAL 47 10.232 16.914 0.559 344 2HG1 VAL 47 HG12 VAL 47 11.810 17.645 0.266 345 3HG1 VAL 47 HG13 VAL 47 11.686 15.917 0.597 346 1HG2 VAL 47 HG21 VAL 47 9.059 16.173 -2.062 347 2HG2 VAL 47 HG22 VAL 47 9.527 15.145 -0.708 348 3HG2 VAL 47 HG23 VAL 47 10.142 14.806 -2.325 349 H GLN 48 HN GLN 48 8.657 17.746 -3.253 350 HA GLN 48 HA GLN 48 7.525 19.993 -1.858 351 1HB GLN 48 HB2 GLN 48 6.801 18.289 -4.128 352 2HB GLN 48 HB1 GLN 48 5.424 18.743 -3.132 353 1HG GLN 48 HG2 GLN 48 7.030 21.051 -3.558 354 2HG GLN 48 HG1 GLN 48 6.744 20.264 -5.110 355 1HE2 GLN 48 HE21 GLN 48 4.571 19.910 -5.776 356 2HE2 GLN 48 HE22 GLN 48 3.299 20.919 -5.185 357 H GLY 49 HN GLY 49 5.706 19.948 -0.474 358 1HA GLY 49 HA2 GLY 49 5.734 17.773 1.389 359 2HA GLY 49 HA1 GLY 49 4.695 19.188 1.456 360 H GLN 50 HN GLN 50 4.660 15.933 1.220 361 HA GLN 50 HA GLN 50 2.284 15.835 -0.499 362 1HB GLN 50 HB2 GLN 50 4.416 13.921 0.207 363 2HB GLN 50 HB1 GLN 50 2.799 13.235 0.115 364 1HG GLN 50 HG2 GLN 50 2.596 14.265 -2.160 365 2HG GLN 50 HG1 GLN 50 4.307 14.674 -2.048 366 1HE2 GLN 50 HE22 GLN 50 5.746 13.211 -2.665 367 2HE2 GLN 50 HE21 GLN 50 5.407 11.552 -3.006 368 H GLU 51 HN GLU 51 0.317 15.220 0.247 369 HA GLU 51 HA GLU 51 -0.198 15.463 3.029 370 1HB GLU 51 HB2 GLU 51 -1.718 15.460 0.627 371 2HB GLU 51 HB1 GLU 51 -2.413 14.249 1.696 372 1HG GLU 51 HG1 GLU 51 -3.579 16.043 2.416 373 2HG GLU 51 HG2 GLU 51 -2.167 16.219 3.457 374 HA PRO 52 HA PRO 52 -1.173 10.666 2.698 375 1HB PRO 52 HB1 PRO 52 0.399 9.386 0.835 376 2HB PRO 52 HB2 PRO 52 -1.287 9.847 0.574 377 1HG PRO 52 HG1 PRO 52 1.218 11.247 -0.273 378 2HG PRO 52 HG2 PRO 52 -0.289 11.002 -1.176 379 1HD PRO 52 HD2 PRO 52 0.275 13.350 -0.014 380 2HD PRO 52 HD1 PRO 52 -1.383 12.716 -0.056 381 H LEU 53 HN LEU 53 -0.063 9.237 3.970 382 HA LEU 53 HA LEU 53 2.601 10.062 4.811 383 1HB LEU 53 HB2 LEU 53 0.316 8.935 6.058 384 2HB LEU 53 HB1 LEU 53 1.621 7.779 6.218 385 HG LEU 53 HG LEU 53 1.246 9.474 8.110 386 1HD1 LEU 53 HD11 LEU 53 3.150 8.431 8.588 387 2HD1 LEU 53 HD12 LEU 53 3.941 9.878 7.956 388 3HD1 LEU 53 HD13 LEU 53 3.707 8.473 6.914 389 1HD2 LEU 53 HD21 LEU 53 1.295 11.357 6.239 390 2HD2 LEU 53 HD22 LEU 53 3.012 11.330 6.641 391 3HD2 LEU 53 HD23 LEU 53 1.815 11.646 7.899 392 H THR 54 HN THR 54 4.429 8.872 4.546 393 HA THR 54 HA THR 54 4.528 6.113 4.048 394 HB THR 54 HB THR 54 5.610 7.127 1.583 395 HG1 THR 54 HG1 THR 54 2.839 7.349 1.529 396 1HG2 THR 54 HG21 THR 54 3.422 5.167 2.201 397 2HG2 THR 54 HG22 THR 54 5.103 4.816 1.793 398 3HG2 THR 54 HG23 THR 54 4.023 5.499 0.577 399 H ALA 55 HN ALA 55 6.837 5.673 2.847 400 HA ALA 55 HA ALA 55 8.791 6.305 4.665 401 1HB ALA 55 HB1 ALA 55 8.961 4.535 2.957 402 2HB ALA 55 HB2 ALA 55 10.412 5.532 3.062 403 3HB ALA 55 HB3 ALA 55 9.269 5.773 1.740 404 H SER 56 HN SER 56 8.087 8.005 1.623 405 HA SER 56 HA SER 56 10.182 9.836 1.689 406 1HB SER 56 HB1 SER 56 7.378 10.342 0.667 407 2HB SER 56 HB2 SER 56 8.837 11.220 0.207 408 HG SER 56 HG SER 56 8.528 9.716 -1.363 409 H MET 57 HN MET 57 6.944 10.053 3.115 410 HA MET 57 HA MET 57 7.160 12.644 4.167 411 1HB MET 57 HB1 MET 57 5.534 10.229 4.912 412 2HB MET 57 HB2 MET 57 5.461 11.689 5.886 413 1HG MET 57 HG1 MET 57 3.804 11.180 3.861 414 2HG MET 57 HG2 MET 57 4.249 12.810 4.363 415 1HE MET 57 HE1 MET 57 5.879 10.395 0.883 416 2HE MET 57 HE2 MET 57 4.130 10.620 0.937 417 3HE MET 57 HE3 MET 57 4.963 9.850 2.288 418 H LEU 58 HN LEU 58 7.989 9.486 5.505 419 HA LEU 58 HA LEU 58 8.697 10.284 8.089 420 1HB LEU 58 HB1 LEU 58 9.619 8.028 6.324 421 2HB LEU 58 HB2 LEU 58 10.223 8.223 7.957 422 HG LEU 58 HG LEU 58 8.474 7.109 8.761 423 1HD1 LEU 58 HD11 LEU 58 7.303 9.350 8.688 424 2HD1 LEU 58 HD12 LEU 58 6.263 7.926 8.725 425 3HD1 LEU 58 HD13 LEU 58 6.523 8.788 7.209 426 1HD2 LEU 58 HD21 LEU 58 7.293 5.710 7.352 427 2HD2 LEU 58 HD22 LEU 58 8.717 6.113 6.389 428 3HD2 LEU 58 HD23 LEU 58 7.179 6.922 6.075 429 H ALA 59 HN ALA 59 10.651 9.966 5.153 430 HA ALA 59 HA ALA 59 13.084 10.826 6.341 431 1HB ALA 59 HB1 ALA 59 12.124 10.283 3.593 432 2HB ALA 59 HB2 ALA 59 13.554 9.688 4.436 433 3HB ALA 59 HB3 ALA 59 13.542 11.317 3.761 434 H SER 60 HN SER 60 10.288 12.499 5.572 435 HA SER 60 HA SER 60 11.529 14.985 4.792 436 1HB SER 60 HB1 SER 60 9.296 14.364 3.940 437 2HB SER 60 HB2 SER 60 8.662 14.403 5.586 438 HG SER 60 HG SER 60 8.774 16.547 5.601 439 H ALA 61 HN ALA 61 11.081 13.386 7.695 440 HA ALA 61 HA ALA 61 11.478 15.891 9.181 441 1HB ALA 61 HB1 ALA 61 9.108 14.671 9.288 442 2HB ALA 61 HB2 ALA 61 9.810 15.517 10.667 443 3HB ALA 61 HB3 ALA 61 9.944 13.763 10.546 444 HA PRO 62 HA PRO 62 14.667 12.423 9.950 445 1HB PRO 62 HB1 PRO 62 16.418 14.809 9.635 446 2HB PRO 62 HB2 PRO 62 16.654 13.152 9.067 447 1HG PRO 62 HG2 PRO 62 15.937 15.081 7.375 448 2HG PRO 62 HG1 PRO 62 15.267 13.444 7.230 449 1HD PRO 62 HD1 PRO 62 14.001 15.925 8.307 450 2HD PRO 62 HD2 PRO 62 13.276 14.601 7.374 451 HA PRO 63 HA PRO 63 15.923 14.975 13.741 452 1HB PRO 63 HB1 PRO 63 15.567 17.607 13.921 453 2HB PRO 63 HB2 PRO 63 16.863 16.936 12.923 454 1HG PRO 63 HG1 PRO 63 14.204 18.028 12.103 455 2HG PRO 63 HG2 PRO 63 15.783 18.214 11.319 456 1HD PRO 63 HD1 PRO 63 13.817 16.389 10.575 457 2HD PRO 63 HD2 PRO 63 15.533 16.288 10.136 458 H GLN 64 HN GLN 64 12.825 15.339 12.402 459 HA GLN 64 HA GLN 64 11.608 16.099 14.950 460 1HB GLN 64 HB1 GLN 64 10.934 17.133 12.711 461 2HB GLN 64 HB2 GLN 64 10.160 15.595 12.355 462 1HG GLN 64 HG1 GLN 64 8.390 16.728 13.210 463 2HG GLN 64 HG2 GLN 64 9.023 16.012 14.692 464 1HE2 GLN 64 HE21 GLN 64 10.941 17.491 15.564 465 2HE2 GLN 64 HE22 GLN 64 10.490 19.145 15.770 466 H GLU 65 HN GLU 65 10.387 13.858 12.482 467 HA GLU 65 HA GLU 65 9.843 11.934 14.635 468 1HB GLU 65 HB1 GLU 65 8.618 11.427 12.017 469 2HB GLU 65 HB2 GLU 65 7.899 11.412 13.621 470 1HG GLU 65 HG2 GLU 65 8.607 14.076 12.631 471 2HG GLU 65 HG1 GLU 65 7.370 13.243 11.692 472 H GLN 66 HN GLN 66 9.833 11.052 11.269 473 HA GLN 66 HA GLN 66 11.138 9.689 9.995 474 1HB GLN 66 HB2 GLN 66 13.025 10.901 11.654 475 2HB GLN 66 HB1 GLN 66 13.346 9.177 11.796 476 1HG GLN 66 HG2 GLN 66 13.010 9.478 9.107 477 2HG GLN 66 HG1 GLN 66 13.781 10.994 9.564 478 1HE2 GLN 66 HE21 GLN 66 14.120 7.646 10.685 479 2HE2 GLN 66 HE22 GLN 66 15.828 7.555 10.441 480 H LYS 67 HN LYS 67 11.285 8.882 13.445 481 HA LYS 67 HA LYS 67 10.480 6.144 12.749 482 1HB LYS 67 HB2 LYS 67 11.827 5.339 14.653 483 2HB LYS 67 HB1 LYS 67 12.807 6.119 13.422 484 1HG LYS 67 HG2 LYS 67 13.703 7.344 15.028 485 2HG LYS 67 HG1 LYS 67 12.146 8.160 15.186 486 1HD LYS 67 HD2 LYS 67 11.673 5.935 16.635 487 2HD LYS 67 HD1 LYS 67 13.407 6.124 16.906 488 1HE LYS 67 HE1 LYS 67 11.287 8.215 17.393 489 2HE LYS 67 HE2 LYS 67 12.124 7.274 18.629 490 1HZ LYS 67 HZ1 LYS 67 13.193 9.415 16.903 491 2HZ LYS 67 HZ2 LYS 67 14.231 8.278 17.606 492 3HZ LYS 67 HZ3 LYS 67 13.272 9.268 18.586 493 H GLN 68 HN GLN 68 8.933 8.565 13.597 494 HA GLN 68 HA GLN 68 7.693 7.370 15.986 495 1HB GLN 68 HB2 GLN 68 8.862 9.356 16.682 496 2HB GLN 68 HB1 GLN 68 8.143 10.293 15.379 497 1HG GLN 68 HG1 GLN 68 6.237 10.638 16.504 498 2HG GLN 68 HG2 GLN 68 6.220 9.013 17.187 499 1HE2 GLN 68 HE21 GLN 68 8.233 8.722 18.731 500 2HE2 GLN 68 HE22 GLN 68 8.372 9.954 19.934 501 H MET 69 HN MET 69 7.044 9.688 13.335 502 HA MET 69 HA MET 69 4.211 9.373 13.614 503 1HB MET 69 HB2 MET 69 4.019 10.925 11.796 504 2HB MET 69 HB1 MET 69 5.296 11.483 12.868 505 1HG MET 69 HG2 MET 69 6.877 11.284 11.297 506 2HG MET 69 HG1 MET 69 6.216 9.771 10.677 507 1HE MET 69 HE1 MET 69 7.007 12.048 7.970 508 2HE MET 69 HE2 MET 69 7.570 12.333 9.618 509 3HE MET 69 HE3 MET 69 6.553 13.529 8.813 510 H LEU 70 HN LEU 70 5.947 7.015 12.807 511 HA LEU 70 HA LEU 70 4.885 6.352 10.176 512 1HB LEU 70 HB1 LEU 70 6.160 4.099 11.263 513 2HB LEU 70 HB2 LEU 70 6.789 5.199 10.051 514 HG LEU 70 HG LEU 70 7.105 5.678 13.009 515 1HD1 LEU 70 HD11 LEU 70 8.165 3.515 11.985 516 2HD1 LEU 70 HD12 LEU 70 9.100 4.554 13.060 517 3HD1 LEU 70 HD13 LEU 70 9.330 4.656 11.314 518 1HD2 LEU 70 HD21 LEU 70 7.392 7.675 11.833 519 2HD2 LEU 70 HD22 LEU 70 8.260 6.881 10.517 520 3HD2 LEU 70 HD23 LEU 70 9.028 7.068 12.093 521 H GLY 71 HN GLY 71 4.845 4.971 13.451 522 1HA GLY 71 HA2 GLY 71 2.380 3.553 12.699 523 2HA GLY 71 HA1 GLY 71 3.473 3.030 13.967 524 H GLU 72 HN GLU 72 2.886 6.415 13.753 525 HA GLU 72 HA GLU 72 0.795 6.245 15.814 526 1HB GLU 72 HB1 GLU 72 3.289 7.948 15.976 527 2HB GLU 72 HB2 GLU 72 1.940 8.026 17.102 528 1HG GLU 72 HG1 GLU 72 2.928 5.326 16.813 529 2HG GLU 72 HG2 GLU 72 4.201 6.440 17.310 530 H ARG 73 HN ARG 73 1.879 7.688 12.952 531 HA ARG 73 HA ARG 73 -0.159 9.796 13.238 532 1HB ARG 73 HB1 ARG 73 2.503 10.270 13.011 533 2HB ARG 73 HB2 ARG 73 2.027 10.265 11.320 534 1HG ARG 73 HG1 ARG 73 0.425 11.868 13.248 535 2HG ARG 73 HG2 ARG 73 2.004 12.471 12.742 536 1HD ARG 73 HD2 ARG 73 1.350 12.770 10.566 537 2HD ARG 73 HD1 ARG 73 0.112 11.517 10.654 538 HE ARG 73 HE ARG 73 -1.390 13.110 11.300 539 1HH1 ARG 73 HH12 ARG 73 1.831 14.345 11.802 540 2HH1 ARG 73 HH11 ARG 73 1.293 15.935 12.229 541 1HH2 ARG 73 HH22 ARG 73 -2.106 15.200 11.862 542 2HH2 ARG 73 HH21 ARG 73 -0.944 16.420 12.264 543 H LEU 74 HN LEU 74 0.990 7.134 11.478 544 HA LEU 74 HA LEU 74 -0.179 7.804 8.949 545 1HB LEU 74 HB1 LEU 74 1.401 5.668 10.090 546 2HB LEU 74 HB2 LEU 74 0.111 5.038 9.084 547 HG LEU 74 HG LEU 74 1.626 7.257 7.913 548 1HD1 LEU 74 HD11 LEU 74 3.310 5.856 9.205 549 2HD1 LEU 74 HD12 LEU 74 3.615 6.114 7.485 550 3HD1 LEU 74 HD13 LEU 74 2.953 4.577 8.044 551 1HD2 LEU 74 HD21 LEU 74 0.716 4.554 6.950 552 2HD2 LEU 74 HD22 LEU 74 1.499 5.773 5.945 553 3HD2 LEU 74 HD23 LEU 74 -0.078 6.104 6.664 554 H PHE 75 HN PHE 75 -1.421 6.718 11.888 555 HA PHE 75 HA PHE 75 -3.324 4.855 11.247 556 1HB PHE 75 HB1 PHE 75 -3.023 5.412 13.536 557 2HB PHE 75 HB2 PHE 75 -3.448 7.097 13.257 558 HD1 PHE 75 HD1 PHE 75 -5.317 7.502 14.548 559 HD2 PHE 75 HD2 PHE 75 -5.164 3.983 12.152 560 HE1 PHE 75 HE1 PHE 75 -7.661 7.019 15.118 561 HE2 PHE 75 HE2 PHE 75 -7.511 3.497 12.721 562 HZ PHE 75 HZ PHE 75 -8.761 5.015 14.204 563 HA PRO 76 HA PRO 76 -6.554 8.323 10.134 564 1HB PRO 76 HB2 PRO 76 -4.805 10.580 9.376 565 2HB PRO 76 HB1 PRO 76 -6.292 10.579 10.330 566 1HG PRO 76 HG1 PRO 76 -3.908 10.969 11.479 567 2HG PRO 76 HG2 PRO 76 -5.186 10.048 12.293 568 1HD PRO 76 HD1 PRO 76 -2.765 9.051 10.838 569 2HD PRO 76 HD2 PRO 76 -3.478 8.478 12.360 570 H LEU 77 HN LEU 77 -3.649 7.475 8.623 571 HA LEU 77 HA LEU 77 -4.606 8.196 5.958 572 1HB LEU 77 HB1 LEU 77 -1.952 7.173 6.950 573 2HB LEU 77 HB2 LEU 77 -2.325 7.369 5.253 574 HG LEU 77 HG LEU 77 -1.169 9.309 5.721 575 1HD1 LEU 77 HD21 LEU 77 -2.629 10.935 5.180 576 2HD1 LEU 77 HD22 LEU 77 -3.707 10.564 6.526 577 3HD1 LEU 77 HD23 LEU 77 -3.765 9.591 5.055 578 1HD2 LEU 77 HD11 LEU 77 -2.573 10.125 8.162 579 2HD2 LEU 77 HD12 LEU 77 -0.857 10.190 7.756 580 3HD2 LEU 77 HD13 LEU 77 -1.575 8.679 8.310 581 H ILE 78 HN ILE 78 -3.800 5.351 7.906 582 HA ILE 78 HA ILE 78 -3.965 3.435 5.860 583 HB ILE 78 HB ILE 78 -4.931 2.796 8.607 584 1HG1 ILE 78 HG12 ILE 78 -2.901 4.251 8.816 585 2HG1 ILE 78 HG11 ILE 78 -2.683 2.622 9.446 586 1HG2 ILE 78 HG21 ILE 78 -4.280 1.341 6.291 587 2HG2 ILE 78 HG22 ILE 78 -4.726 0.714 7.880 588 3HG2 ILE 78 HG23 ILE 78 -3.028 0.983 7.485 589 1HD1 ILE 78 HD11 ILE 78 -1.849 3.310 6.664 590 2HD1 ILE 78 HD12 ILE 78 -1.293 2.001 7.707 591 3HD1 ILE 78 HD13 ILE 78 -0.814 3.664 8.047 592 H GLN 79 HN GLN 79 -6.425 4.786 8.001 593 HA GLN 79 HA GLN 79 -8.592 3.191 7.460 594 1HB GLN 79 HB1 GLN 79 -8.187 5.990 8.291 595 2HB GLN 79 HB2 GLN 79 -9.749 5.669 7.551 596 1HG GLN 79 HG1 GLN 79 -10.205 3.944 9.180 597 2HG GLN 79 HG2 GLN 79 -8.601 4.151 9.883 598 1HE2 GLN 79 HE22 GLN 79 -10.858 6.630 8.789 599 2HE2 GLN 79 HE21 GLN 79 -11.071 7.374 10.334 600 H ALA 80 HN ALA 80 -6.920 5.236 5.324 601 HA ALA 80 HA ALA 80 -9.082 5.564 3.424 602 1HB ALA 80 HB1 ALA 80 -6.156 6.236 3.138 603 2HB ALA 80 HB2 ALA 80 -7.401 7.333 3.736 604 3HB ALA 80 HB3 ALA 80 -7.462 6.754 2.071 605 H MET 81 HN MET 81 -6.128 3.650 3.762 606 HA MET 81 HA MET 81 -6.302 2.434 1.171 607 1HB MET 81 HB1 MET 81 -4.881 1.081 3.418 608 2HB MET 81 HB2 MET 81 -4.372 1.293 1.751 609 1HG MET 81 HG1 MET 81 -4.434 3.864 2.753 610 2HG MET 81 HG2 MET 81 -3.815 2.899 4.088 611 1HE MET 81 HE1 MET 81 -1.617 2.636 4.497 612 2HE MET 81 HE2 MET 81 -0.301 2.340 3.361 613 3HE MET 81 HE3 MET 81 -1.543 1.109 3.612 614 H HIS 82 HN HIS 82 -7.364 1.661 4.396 615 HA HIS 82 HA HIS 82 -8.711 -0.760 3.394 616 1HB HIS 82 HB2 HIS 82 -7.820 -0.270 6.240 617 2HB HIS 82 HB1 HIS 82 -8.267 -1.801 5.507 618 HD2 HIS 82 HD2 HIS 82 -6.279 -1.573 2.891 619 HE1 HIS 82 HE1 HIS 82 -3.321 -1.445 5.889 620 HE2 HIS 82 HE2 HIS 82 -3.762 -1.851 3.427 621 HA PRO 83 HA PRO 83 -12.566 0.941 4.769 622 1HB PRO 83 HB2 PRO 83 -13.354 -1.649 5.904 623 2HB PRO 83 HB1 PRO 83 -14.044 -0.772 4.535 624 1HG PRO 83 HG2 PRO 83 -12.620 -3.032 4.205 625 2HG PRO 83 HG1 PRO 83 -12.577 -1.711 3.024 626 1HD PRO 83 HD2 PRO 83 -10.586 -2.419 5.148 627 2HD PRO 83 HD1 PRO 83 -10.308 -1.910 3.469 628 H THR 84 HN THR 84 -11.036 1.961 6.483 629 HA THR 84 HA THR 84 -10.581 2.574 8.618 630 HB THR 84 HB THR 84 -13.190 1.421 9.529 631 HG1 THR 84 HG1 THR 84 -14.010 3.528 8.531 632 1HG2 THR 84 HG21 THR 84 -12.651 2.772 11.212 633 2HG2 THR 84 HG22 THR 84 -13.190 4.066 10.143 634 3HG2 THR 84 HG23 THR 84 -11.476 3.666 10.248 635 H LEU 85 HN LEU 85 -9.997 -0.227 7.736 636 HA LEU 85 HA LEU 85 -10.340 -1.902 10.038 637 1HB LEU 85 HB1 LEU 85 -9.394 -2.178 7.327 638 2HB LEU 85 HB2 LEU 85 -8.284 -2.953 8.441 639 HG LEU 85 HG LEU 85 -10.795 -3.802 9.289 640 1HD1 LEU 85 HD11 LEU 85 -11.245 -2.852 6.781 641 2HD1 LEU 85 HD12 LEU 85 -12.174 -4.135 7.557 642 3HD1 LEU 85 HD13 LEU 85 -10.857 -4.541 6.457 643 1HD2 LEU 85 HD21 LEU 85 -8.939 -5.243 9.361 644 2HD2 LEU 85 HD22 LEU 85 -8.635 -5.070 7.632 645 3HD2 LEU 85 HD23 LEU 85 -10.047 -5.966 8.194 646 H ALA 86 HN ALA 86 -8.483 0.714 9.650 647 HA ALA 86 HA ALA 86 -5.916 -0.111 10.545 648 1HB ALA 86 HB1 ALA 86 -7.363 2.506 10.409 649 2HB ALA 86 HB2 ALA 86 -5.921 1.974 9.546 650 3HB ALA 86 HB3 ALA 86 -5.821 2.385 11.257 651 H GLY 87 HN GLY 87 -6.181 2.168 12.703 652 1HA GLY 87 HA2 GLY 87 -6.714 2.317 14.960 653 2HA GLY 87 HA1 GLY 87 -7.644 0.832 14.808 654 H LYS 88 HN LYS 88 -5.120 -0.306 13.458 655 HA LYS 88 HA LYS 88 -3.251 -0.456 15.650 656 1HB LYS 88 HB1 LYS 88 -4.980 -2.100 16.273 657 2HB LYS 88 HB2 LYS 88 -4.747 -2.919 14.738 658 1HG LYS 88 HG1 LYS 88 -2.215 -2.885 15.680 659 2HG LYS 88 HG2 LYS 88 -3.137 -2.994 17.188 660 1HD LYS 88 HD1 LYS 88 -3.250 -5.190 16.794 661 2HD LYS 88 HD2 LYS 88 -4.398 -4.794 15.510 662 1HE LYS 88 HE1 LYS 88 -2.920 -5.257 13.889 663 2HE LYS 88 HE2 LYS 88 -1.607 -4.458 14.743 664 1HZ LYS 88 HZ1 LYS 88 -2.031 -7.186 14.456 665 2HZ LYS 88 HZ2 LYS 88 -2.303 -6.836 16.090 666 3HZ LYS 88 HZ3 LYS 88 -0.831 -6.422 15.369 667 H ILE 89 HN ILE 89 -4.112 -1.046 12.334 668 HA ILE 89 HA ILE 89 -2.121 -2.690 11.456 669 HB ILE 89 HB ILE 89 -3.175 -0.261 10.007 670 1HG1 ILE 89 HG12 ILE 89 -4.030 -3.134 9.659 671 2HG1 ILE 89 HG11 ILE 89 -4.807 -2.072 10.830 672 1HG2 ILE 89 HG21 ILE 89 -1.643 -0.735 8.460 673 2HG2 ILE 89 HG22 ILE 89 -2.506 -2.246 8.171 674 3HG2 ILE 89 HG23 ILE 89 -1.157 -2.206 9.307 675 1HD1 ILE 89 HD11 ILE 89 -6.142 -2.066 8.877 676 2HD1 ILE 89 HD12 ILE 89 -4.743 -1.781 7.842 677 3HD1 ILE 89 HD13 ILE 89 -5.306 -0.514 8.931 678 H THR 90 HN THR 90 -1.768 0.785 10.773 679 HA THR 90 HA THR 90 0.998 0.701 10.485 680 HB THR 90 HB THR 90 -1.051 2.674 10.479 681 HG1 THR 90 HG1 THR 90 1.295 2.128 9.300 682 1HG2 THR 90 HG21 THR 90 1.033 3.271 12.435 683 2HG2 THR 90 HG22 THR 90 -0.554 4.001 12.196 684 3HG2 THR 90 HG23 THR 90 0.807 4.502 11.190 685 H GLY 91 HN GLY 91 -0.927 1.285 13.409 686 1HA GLY 91 HA2 GLY 91 1.194 1.967 15.136 687 2HA GLY 91 HA1 GLY 91 -0.314 1.203 15.630 688 H MET 92 HN MET 92 0.123 -1.016 13.778 689 HA MET 92 HA MET 92 1.644 -2.755 15.495 690 1HB MET 92 HB1 MET 92 -0.447 -3.257 13.946 691 2HB MET 92 HB2 MET 92 0.789 -3.515 12.727 692 1HG MET 92 HG1 MET 92 1.751 -4.950 14.806 693 2HG MET 92 HG2 MET 92 0.021 -5.161 14.992 694 1HE MET 92 HE1 MET 92 -1.281 -5.083 12.737 695 2HE MET 92 HE2 MET 92 -1.273 -6.686 11.995 696 3HE MET 92 HE3 MET 92 -0.483 -5.333 11.183 697 H LEU 93 HN LEU 93 1.975 -1.214 12.407 698 HA LEU 93 HA LEU 93 4.175 -2.504 11.367 699 1HB LEU 93 HB2 LEU 93 2.980 0.179 11.052 700 2HB LEU 93 HB1 LEU 93 4.558 -0.094 10.350 701 HG LEU 93 HG LEU 93 2.739 -0.441 8.724 702 1HD1 LEU 93 HD11 LEU 93 4.388 -2.828 9.518 703 2HD1 LEU 93 HD12 LEU 93 4.722 -1.636 8.262 704 3HD1 LEU 93 HD13 LEU 93 3.404 -2.791 8.054 705 1HD2 LEU 93 HD21 LEU 93 1.592 -2.828 9.264 706 2HD2 LEU 93 HD22 LEU 93 0.856 -1.269 9.634 707 3HD2 LEU 93 HD23 LEU 93 1.718 -2.155 10.892 708 H LEU 94 HN LEU 94 4.067 -0.726 14.187 709 HA LEU 94 HA LEU 94 6.948 -0.142 14.074 710 1HB LEU 94 HB1 LEU 94 4.668 1.185 15.345 711 2HB LEU 94 HB2 LEU 94 6.024 0.943 16.429 712 HG LEU 94 HG LEU 94 7.494 2.146 14.869 713 1HD1 LEU 94 HD11 LEU 94 6.445 1.629 12.771 714 2HD1 LEU 94 HD12 LEU 94 6.469 3.381 12.979 715 3HD1 LEU 94 HD13 LEU 94 4.975 2.481 13.248 716 1HD2 LEU 94 HD21 LEU 94 6.079 3.281 16.666 717 2HD2 LEU 94 HD22 LEU 94 5.066 3.842 15.336 718 3HD2 LEU 94 HD23 LEU 94 6.769 4.301 15.404 719 H GLU 95 HN GLU 95 5.614 -2.722 14.390 720 HA GLU 95 HA GLU 95 7.148 -3.769 16.532 721 1HB GLU 95 HB2 GLU 95 5.492 -4.365 18.102 722 2HB GLU 95 HB1 GLU 95 5.169 -2.681 17.714 723 1HG GLU 95 HG1 GLU 95 3.280 -3.216 16.441 724 2HG GLU 95 HG2 GLU 95 3.735 -4.915 16.322 725 H ILE 96 HN ILE 96 5.573 -4.093 13.658 726 HA ILE 96 HA ILE 96 4.600 -6.738 13.721 727 HB ILE 96 HB ILE 96 4.744 -6.785 11.333 728 1HG1 ILE 96 HG12 ILE 96 7.043 -5.867 11.181 729 2HG1 ILE 96 HG11 ILE 96 5.924 -5.203 10.000 730 1HG2 ILE 96 HG21 ILE 96 3.842 -4.346 10.849 731 2HG2 ILE 96 HG22 ILE 96 3.755 -4.316 12.611 732 3HG2 ILE 96 HG23 ILE 96 2.886 -5.558 11.710 733 1HD1 ILE 96 HD11 ILE 96 7.597 -3.804 11.686 734 2HD1 ILE 96 HD12 ILE 96 5.987 -3.603 12.380 735 3HD1 ILE 96 HD13 ILE 96 6.287 -3.154 10.698 736 H ASP 97 HN ASP 97 6.111 -7.664 11.371 737 HA ASP 97 HA ASP 97 7.966 -9.401 12.483 738 1HB ASP 97 HB1 ASP 97 6.798 -9.284 10.130 739 2HB ASP 97 HB2 ASP 97 8.234 -8.371 9.673 740 H ASN 98 HN ASN 98 8.164 -6.098 12.091 741 HA ASN 98 HA ASN 98 9.771 -4.607 12.617 742 1HB ASN 98 HB1 ASN 98 11.109 -7.115 13.318 743 2HB ASN 98 HB2 ASN 98 12.223 -5.852 12.799 744 1HD2 ASN 98 HD21 ASN 98 12.905 -4.523 14.305 745 2HD2 ASN 98 HD22 ASN 98 12.121 -4.198 15.809 746 H SER 99 HN SER 99 10.140 -6.926 10.113 747 HA SER 99 HA SER 99 12.173 -5.487 8.667 748 1HB SER 99 HB1 SER 99 10.295 -7.442 7.373 749 2HB SER 99 HB2 SER 99 11.997 -7.136 7.027 750 HG SER 99 HG SER 99 12.261 -7.984 9.312 751 H GLU 100 HN GLU 100 8.727 -5.499 8.934 752 HA GLU 100 HA GLU 100 8.197 -3.960 6.573 753 1HB GLU 100 HB1 GLU 100 6.544 -4.560 9.009 754 2HB GLU 100 HB2 GLU 100 5.954 -3.654 7.634 755 1HG GLU 100 HG2 GLU 100 5.171 -5.730 7.156 756 2HG GLU 100 HG1 GLU 100 6.705 -5.742 6.285 757 H LEU 101 HN LEU 101 8.852 -3.327 9.945 758 HA LEU 101 HA LEU 101 8.147 -0.586 9.968 759 1HB LEU 101 HB1 LEU 101 8.362 -1.492 12.089 760 2HB LEU 101 HB2 LEU 101 9.818 -2.375 11.679 761 HG LEU 101 HG LEU 101 10.502 0.345 11.477 762 1HD1 LEU 101 HD11 LEU 101 9.203 1.457 12.887 763 2HD1 LEU 101 HD12 LEU 101 9.817 0.444 14.192 764 3HD1 LEU 101 HD13 LEU 101 8.348 -0.019 13.333 765 1HD2 LEU 101 HD21 LEU 101 11.302 -0.801 13.976 766 2HD2 LEU 101 HD22 LEU 101 12.266 -0.487 12.533 767 3HD2 LEU 101 HD23 LEU 101 11.401 -2.016 12.701 768 H LEU 102 HN LEU 102 10.922 -2.349 8.871 769 HA LEU 102 HA LEU 102 12.606 -0.002 8.638 770 1HB LEU 102 HB2 LEU 102 12.912 -2.907 8.407 771 2HB LEU 102 HB1 LEU 102 13.826 -2.011 7.207 772 HG LEU 102 HG LEU 102 14.728 -0.645 9.201 773 1HD1 LEU 102 HD21 LEU 102 13.966 -1.144 11.221 774 2HD1 LEU 102 HD22 LEU 102 14.647 -2.762 11.060 775 3HD1 LEU 102 HD23 LEU 102 12.986 -2.450 10.557 776 1HD2 LEU 102 HD11 LEU 102 16.402 -1.866 8.316 777 2HD2 LEU 102 HD12 LEU 102 15.445 -3.347 8.273 778 3HD2 LEU 102 HD13 LEU 102 16.195 -2.824 9.782 779 H HIS 103 HN HIS 103 11.024 -2.274 6.416 780 HA HIS 103 HA HIS 103 11.888 -0.986 4.074 781 1HB HIS 103 HB1 HIS 103 10.540 -3.312 4.710 782 2HB HIS 103 HB2 HIS 103 9.320 -2.373 3.865 783 HD2 HIS 103 HD2 HIS 103 11.704 -1.079 1.761 784 HE1 HIS 103 HE1 HIS 103 11.779 -5.130 0.537 785 HE2 HIS 103 HE2 HIS 103 12.411 -2.756 -0.089 786 H MET 104 HN MET 104 8.973 -0.600 6.042 787 HA MET 104 HA MET 104 7.480 0.992 4.325 788 1HB MET 104 HB2 MET 104 6.255 1.715 6.290 789 2HB MET 104 HB1 MET 104 6.624 0.001 6.432 790 1HG MET 104 HG1 MET 104 7.918 0.299 8.232 791 2HG MET 104 HG2 MET 104 8.617 1.785 7.599 792 1HE MET 104 HE1 MET 104 4.578 1.946 7.774 793 2HE MET 104 HE2 MET 104 4.460 1.546 9.491 794 3HE MET 104 HE3 MET 104 5.206 0.407 8.364 795 H LEU 105 HN LEU 105 10.102 1.873 6.511 796 HA LEU 105 HA LEU 105 9.753 4.711 5.941 797 1HB LEU 105 HB1 LEU 105 12.097 3.586 7.421 798 2HB LEU 105 HB2 LEU 105 11.317 5.144 7.609 799 HG LEU 105 HG LEU 105 10.044 2.540 8.434 800 1HD1 LEU 105 HD11 LEU 105 12.007 2.795 9.772 801 2HD1 LEU 105 HD12 LEU 105 10.620 3.277 10.749 802 3HD1 LEU 105 HD13 LEU 105 11.668 4.504 10.039 803 1HD2 LEU 105 HD21 LEU 105 8.490 4.359 7.990 804 2HD2 LEU 105 HD22 LEU 105 9.397 5.412 9.075 805 3HD2 LEU 105 HD23 LEU 105 8.561 3.995 9.714 806 H GLU 106 HN GLU 106 11.207 2.059 4.572 807 HA GLU 106 HA GLU 106 13.378 3.627 3.414 808 1HB GLU 106 HB2 GLU 106 12.905 0.693 3.845 809 2HB GLU 106 HB1 GLU 106 14.089 1.227 2.650 810 1HG GLU 106 HG2 GLU 106 14.060 1.799 5.592 811 2HG GLU 106 HG1 GLU 106 15.193 0.767 4.721 812 H SER 107 HN SER 107 10.299 2.570 2.606 813 HA SER 107 HA SER 107 10.850 3.104 -0.220 814 1HB SER 107 HB2 SER 107 10.713 0.539 0.519 815 2HB SER 107 HB1 SER 107 8.989 0.853 0.339 816 HG SER 107 HG SER 107 9.591 0.282 -1.657 817 HA PRO 108 HA PRO 108 7.156 5.536 0.306 818 1HB PRO 108 HB2 PRO 108 6.705 6.112 -2.310 819 2HB PRO 108 HB1 PRO 108 7.964 6.899 -1.353 820 1HG PRO 108 HG1 PRO 108 8.195 4.626 -3.289 821 2HG PRO 108 HG2 PRO 108 9.248 6.039 -3.094 822 1HD PRO 108 HD2 PRO 108 9.876 3.610 -2.083 823 2HD PRO 108 HD1 PRO 108 10.352 5.123 -1.287 824 H GLU 109 HN GLU 109 7.321 2.471 -0.829 825 HA GLU 109 HA GLU 109 4.410 2.329 -1.282 826 1HB GLU 109 HB1 GLU 109 4.966 1.638 -3.362 827 2HB GLU 109 HB2 GLU 109 6.636 1.329 -2.917 828 1HG GLU 109 HG2 GLU 109 6.215 -0.854 -2.325 829 2HG GLU 109 HG1 GLU 109 4.504 -0.555 -2.031 830 H SER 110 HN SER 110 7.256 1.048 0.249 831 HA SER 110 HA SER 110 6.163 -1.374 1.144 832 1HB SER 110 HB1 SER 110 8.556 0.176 1.671 833 2HB SER 110 HB2 SER 110 7.940 -0.597 3.134 834 HG SER 110 HG SER 110 8.059 -2.124 0.800 835 H LEU 111 HN LEU 111 6.257 1.835 2.573 836 HA LEU 111 HA LEU 111 5.103 1.377 5.025 837 1HB LEU 111 HB1 LEU 111 5.916 3.541 3.925 838 2HB LEU 111 HB2 LEU 111 4.329 3.640 3.187 839 HG LEU 111 HG LEU 111 4.180 5.059 5.014 840 1HD1 LEU 111 HD21 LEU 111 3.123 2.389 5.899 841 2HD1 LEU 111 HD22 LEU 111 2.259 3.655 5.028 842 3HD1 LEU 111 HD23 LEU 111 2.751 3.914 6.699 843 1HD2 LEU 111 HD11 LEU 111 5.352 3.046 6.888 844 2HD2 LEU 111 HD12 LEU 111 5.154 4.783 7.109 845 3HD2 LEU 111 HD13 LEU 111 6.364 4.173 5.978 846 H ARG 112 HN ARG 112 3.578 1.657 1.849 847 HA ARG 112 HA ARG 112 0.938 1.269 2.875 848 1HB ARG 112 HB2 ARG 112 0.653 2.399 0.962 849 2HB ARG 112 HB1 ARG 112 2.184 1.848 0.292 850 1HG ARG 112 HG1 ARG 112 1.225 -0.088 -0.591 851 2HG ARG 112 HG2 ARG 112 -0.234 0.078 0.390 852 1HD ARG 112 HD2 ARG 112 -0.900 2.039 -0.847 853 2HD ARG 112 HD1 ARG 112 0.597 1.998 -1.779 854 HE ARG 112 HE ARG 112 -1.361 -0.196 -1.928 855 1HH1 ARG 112 HH21 ARG 112 0.610 2.247 -3.442 856 2HH1 ARG 112 HH22 ARG 112 0.263 1.712 -5.052 857 1HH2 ARG 112 HH11 ARG 112 -1.823 -0.907 -4.045 858 2HH2 ARG 112 HH12 ARG 112 -1.120 -0.080 -5.396 859 H SER 113 HN SER 113 2.825 -0.722 0.582 860 HA SER 113 HA SER 113 1.247 -2.951 0.560 861 1HB SER 113 HB2 SER 113 3.097 -2.808 -0.953 862 2HB SER 113 HB1 SER 113 4.257 -2.740 0.374 863 HG SER 113 HG SER 113 4.170 -4.824 -0.516 864 H LYS 114 HN LYS 114 4.031 -2.435 2.722 865 HA LYS 114 HA LYS 114 3.725 -4.773 4.210 866 1HB LYS 114 HB1 LYS 114 4.842 -2.138 5.178 867 2HB LYS 114 HB2 LYS 114 5.135 -3.718 5.892 868 1HG LYS 114 HG1 LYS 114 5.957 -2.891 3.115 869 2HG LYS 114 HG2 LYS 114 7.016 -2.926 4.527 870 1HD LYS 114 HD2 LYS 114 7.195 -5.183 4.507 871 2HD LYS 114 HD1 LYS 114 5.538 -5.414 3.945 872 1HE LYS 114 HE1 LYS 114 6.887 -4.149 1.843 873 2HE LYS 114 HE2 LYS 114 7.990 -5.387 2.442 874 1HZ LYS 114 HZ1 LYS 114 5.161 -5.874 1.684 875 2HZ LYS 114 HZ2 LYS 114 6.294 -7.043 2.145 876 3HZ LYS 114 HZ3 LYS 114 6.493 -6.199 0.692 877 H VAL 115 HN VAL 115 2.016 -1.715 4.404 878 HA VAL 115 HA VAL 115 0.925 -2.209 7.010 879 HB VAL 115 HB VAL 115 0.548 -0.142 4.939 880 1HG1 VAL 115 HG11 VAL 115 -1.726 -0.451 4.969 881 2HG1 VAL 115 HG12 VAL 115 -1.549 0.586 6.384 882 3HG1 VAL 115 HG13 VAL 115 -1.719 -1.157 6.585 883 1HG2 VAL 115 HG21 VAL 115 1.196 -0.391 7.779 884 2HG2 VAL 115 HG22 VAL 115 0.163 0.985 7.393 885 3HG2 VAL 115 HG23 VAL 115 1.725 0.803 6.594 886 H ASP 116 HN ASP 116 -0.553 -2.261 3.741 887 HA ASP 116 HA ASP 116 -2.937 -3.466 4.385 888 1HB ASP 116 HB1 ASP 116 -1.948 -2.632 2.087 889 2HB ASP 116 HB2 ASP 116 -1.543 -4.335 1.887 890 H GLU 117 HN GLU 117 0.206 -4.971 3.934 891 HA GLU 117 HA GLU 117 -0.755 -7.662 4.050 892 1HB GLU 117 HB1 GLU 117 1.965 -6.394 4.295 893 2HB GLU 117 HB2 GLU 117 1.737 -8.112 4.591 894 1HG GLU 117 HG2 GLU 117 0.452 -7.601 2.167 895 2HG GLU 117 HG1 GLU 117 1.964 -6.696 2.103 896 H ALA 118 HN ALA 118 0.548 -5.368 6.402 897 HA ALA 118 HA ALA 118 0.675 -7.151 8.588 898 1HB ALA 118 HB1 ALA 118 0.018 -4.276 9.015 899 2HB ALA 118 HB2 ALA 118 1.584 -4.709 8.329 900 3HB ALA 118 HB3 ALA 118 1.112 -5.332 9.912 901 H VAL 119 HN VAL 119 -1.906 -5.395 7.068 902 HA VAL 119 HA VAL 119 -3.879 -5.441 9.042 903 HB VAL 119 HB VAL 119 -4.314 -5.907 6.098 904 1HG1 VAL 119 HG11 VAL 119 -6.308 -6.259 7.421 905 2HG1 VAL 119 HG12 VAL 119 -6.442 -4.741 6.520 906 3HG1 VAL 119 HG13 VAL 119 -6.061 -4.716 8.243 907 1HG2 VAL 119 HG21 VAL 119 -4.470 -3.214 7.290 908 2HG2 VAL 119 HG22 VAL 119 -3.986 -3.716 5.673 909 3HG2 VAL 119 HG23 VAL 119 -2.865 -3.892 7.022 910 H ALA 120 HN ALA 120 -3.084 -7.769 6.514 911 HA ALA 120 HA ALA 120 -4.934 -9.758 7.101 912 1HB ALA 120 HB1 ALA 120 -3.890 -10.727 5.384 913 2HB ALA 120 HB2 ALA 120 -2.412 -10.900 6.333 914 3HB ALA 120 HB3 ALA 120 -2.705 -9.416 5.416 915 H VAL 121 HN VAL 121 -1.977 -8.822 8.639 916 HA VAL 121 HA VAL 121 -1.808 -11.142 10.345 917 HB VAL 121 HB VAL 121 -0.235 -8.599 10.065 918 1HG1 VAL 121 HG21 VAL 121 0.367 -8.640 12.190 919 2HG1 VAL 121 HG22 VAL 121 1.132 -10.202 11.890 920 3HG1 VAL 121 HG23 VAL 121 -0.530 -10.133 12.476 921 1HG2 VAL 121 HG11 VAL 121 1.372 -9.890 9.113 922 2HG2 VAL 121 HG12 VAL 121 -0.036 -10.871 8.706 923 3HG2 VAL 121 HG13 VAL 121 0.972 -11.305 10.087 924 H LEU 122 HN LEU 122 -3.026 -7.871 10.494 925 HA LEU 122 HA LEU 122 -3.313 -7.730 13.321 926 1HB LEU 122 HB2 LEU 122 -3.661 -5.598 12.784 927 2HB LEU 122 HB1 LEU 122 -3.733 -6.024 11.088 928 HG LEU 122 HG LEU 122 -6.256 -6.682 11.919 929 1HD1 LEU 122 HD11 LEU 122 -5.348 -4.279 13.493 930 2HD1 LEU 122 HD12 LEU 122 -5.971 -5.801 14.133 931 3HD1 LEU 122 HD13 LEU 122 -7.035 -4.723 13.229 932 1HD2 LEU 122 HD21 LEU 122 -6.061 -5.512 9.944 933 2HD2 LEU 122 HD22 LEU 122 -5.060 -4.252 10.668 934 3HD2 LEU 122 HD23 LEU 122 -6.789 -4.310 11.010 935 H GLN 123 HN GLN 123 -5.436 -8.599 10.647 936 HA GLN 123 HA GLN 123 -7.762 -9.038 12.192 937 1HB GLN 123 HB1 GLN 123 -6.862 -9.962 9.469 938 2HB GLN 123 HB2 GLN 123 -8.396 -10.482 10.153 939 1HG GLN 123 HG1 GLN 123 -7.556 -7.643 9.603 940 2HG GLN 123 HG2 GLN 123 -8.702 -8.599 8.663 941 1HE2 GLN 123 HE22 GLN 123 -8.264 -6.537 11.317 942 2HE2 GLN 123 HE21 GLN 123 -9.875 -6.597 11.938 943 H ALA 124 HN ALA 124 -4.956 -10.943 11.414 944 HA ALA 124 HA ALA 124 -6.081 -13.386 12.520 945 1HB ALA 124 HB1 ALA 124 -3.296 -12.815 11.514 946 2HB ALA 124 HB2 ALA 124 -4.616 -13.479 10.550 947 3HB ALA 124 HB3 ALA 124 -3.964 -14.401 11.905 948 H HIS 125 HN HIS 125 -4.830 -10.640 13.832 949 HA HIS 125 HA HIS 125 -3.674 -12.103 16.115 950 1HB HIS 125 HB1 HIS 125 -2.237 -10.466 14.601 951 2HB HIS 125 HB2 HIS 125 -2.976 -9.242 15.628 952 HD2 HIS 125 HD2 HIS 125 -0.116 -11.751 15.666 953 HE1 HIS 125 HE1 HIS 125 -0.556 -10.255 19.601 954 HE2 HIS 125 HE2 HIS 125 0.919 -11.606 18.042 955 H GLN 126 HN GLN 126 -6.212 -10.160 15.103 956 HA GLN 126 HA GLN 126 -6.618 -8.533 17.371 957 1HB GLN 126 HB1 GLN 126 -8.371 -9.484 15.137 958 2HB GLN 126 HB2 GLN 126 -9.087 -8.645 16.507 959 1HG GLN 126 HG2 GLN 126 -6.745 -7.422 15.132 960 2HG GLN 126 HG1 GLN 126 -8.332 -7.344 14.367 961 1HE2 GLN 126 HE21 GLN 126 -10.088 -6.432 15.657 962 2HE2 GLN 126 HE22 GLN 126 -9.727 -5.157 16.765 963 H ALA 127 HN ALA 127 -9.389 -10.471 16.810 964 HA ALA 127 HA ALA 127 -9.190 -11.518 19.532 965 1HB ALA 127 HB1 ALA 127 -11.679 -12.220 18.620 966 2HB ALA 127 HB2 ALA 127 -11.371 -10.700 17.779 967 3HB ALA 127 HB3 ALA 127 -11.292 -10.767 19.540 968 H LYS 128 HN LYS 128 -7.562 -12.717 17.521 969 HA LYS 128 HA LYS 128 -8.869 -15.270 16.947 970 1HB LYS 128 HB2 LYS 128 -6.101 -14.386 16.125 971 2HB LYS 128 HB1 LYS 128 -7.042 -15.714 15.459 972 1HG LYS 128 HG2 LYS 128 -8.578 -13.350 15.191 973 2HG LYS 128 HG1 LYS 128 -6.943 -13.011 14.617 974 1HD LYS 128 HD1 LYS 128 -7.904 -13.839 12.702 975 2HD LYS 128 HD2 LYS 128 -7.232 -15.316 13.397 976 1HE LYS 128 HE2 LYS 128 -9.500 -15.711 12.637 977 2HE LYS 128 HE1 LYS 128 -9.418 -15.825 14.395 978 1HZ LYS 128 HZ1 LYS 128 -11.178 -14.462 14.293 979 2HZ LYS 128 HZ2 LYS 128 -10.825 -13.921 12.730 980 3HZ LYS 128 HZ3 LYS 128 -10.029 -13.244 14.061 981 H GLU 129 HN GLU 129 -6.297 -16.679 16.848 982 HA GLU 129 HA GLU 129 -6.217 -17.494 19.623 983 1HB GLU 129 HB2 GLU 129 -5.778 -18.757 17.154 984 2HB GLU 129 HB1 GLU 129 -4.215 -18.753 17.961 985 1HG GLU 129 HG2 GLU 129 -5.764 -19.566 19.991 986 2HG GLU 129 HG1 GLU 129 -6.698 -20.193 18.633 987 H ALA 130 HN ALA 130 -4.928 -14.955 18.229 988 HA ALA 130 HA ALA 130 -2.180 -15.231 19.139 989 1HB ALA 130 HB1 ALA 130 -3.660 -13.383 17.408 990 2HB ALA 130 HB2 ALA 130 -1.990 -13.942 17.311 991 3HB ALA 130 HB3 ALA 130 -2.417 -12.627 18.405 992 H ALA 131 HN ALA 131 -4.990 -14.711 20.666 993 HA ALA 131 HA ALA 131 -4.147 -12.520 22.378 994 1HB ALA 131 HB1 ALA 131 -6.492 -13.872 23.326 995 2HB ALA 131 HB2 ALA 131 -6.627 -13.563 21.595 996 3HB ALA 131 HB3 ALA 131 -6.322 -12.229 22.709 997 H GLN 132 HN GLN 132 -2.500 -13.141 23.676 998 HA GLN 132 HA GLN 132 -2.497 -15.724 24.971 999 1HB GLN 132 HB2 GLN 132 -0.594 -13.558 25.747 1000 2HB GLN 132 HB1 GLN 132 -0.311 -15.284 25.571 1001 1HG GLN 132 HG1 GLN 132 -0.932 -13.650 23.157 1002 2HG GLN 132 HG2 GLN 132 0.685 -13.592 23.859 1003 1HE2 GLN 132 HE22 GLN 132 -1.780 -15.883 22.758 1004 2HE2 GLN 132 HE21 GLN 132 -0.667 -17.048 22.135 1005 H LYS 133 HN LYS 133 -4.521 -15.409 26.122 1006 HA LYS 133 HA LYS 133 -4.790 -13.415 28.133 1007 1HB LYS 133 HB2 LYS 133 -6.241 -15.989 27.549 1008 2HB LYS 133 HB1 LYS 133 -6.630 -15.015 28.959 1009 1HG LYS 133 HG2 LYS 133 -7.697 -13.455 27.751 1010 2HG LYS 133 HG1 LYS 133 -6.542 -13.545 26.420 1011 1HD LYS 133 HD1 LYS 133 -7.991 -14.759 25.256 1012 2HD LYS 133 HD2 LYS 133 -7.941 -16.005 26.504 1013 1HE LYS 133 HE1 LYS 133 -9.565 -14.037 27.579 1014 2HE LYS 133 HE2 LYS 133 -10.022 -14.083 25.877 1015 1HZ LYS 133 HZ1 LYS 133 -10.559 -16.358 26.032 1016 2HZ LYS 133 HZ2 LYS 133 -11.271 -15.627 27.381 1017 3HZ LYS 133 HZ3 LYS 133 -9.844 -16.517 27.556 1018 H ALA 134 HN ALA 134 -4.490 -16.951 28.515 1019 HA ALA 134 HA ALA 134 -3.601 -16.665 31.235 1020 1HB ALA 134 HB1 ALA 134 -3.721 -18.992 31.385 1021 2HB ALA 134 HB2 ALA 134 -3.485 -19.208 29.650 1022 3HB ALA 134 HB3 ALA 134 -5.010 -18.566 30.260 1023 H VAL 135 HN VAL 135 -1.661 -15.536 31.174 1024 HA VAL 135 HA VAL 135 0.521 -16.312 29.501 1025 HB VAL 135 HB VAL 135 0.745 -14.652 32.005 1026 1HG1 VAL 135 HG11 VAL 135 2.539 -15.422 29.918 1027 2HG1 VAL 135 HG12 VAL 135 2.859 -14.458 31.359 1028 3HG1 VAL 135 HG13 VAL 135 2.312 -13.673 29.878 1029 1HG2 VAL 135 HG21 VAL 135 0.517 -12.834 29.993 1030 2HG2 VAL 135 HG22 VAL 135 -0.788 -13.295 31.087 1031 3HG2 VAL 135 HG23 VAL 135 -0.656 -14.056 29.501 1032 H ASN 136 HN ASN 136 2.122 -17.721 29.868 1033 HA ASN 136 HA ASN 136 2.021 -19.300 32.318 1034 1HB ASN 136 HB2 ASN 136 3.687 -19.729 29.827 1035 2HB ASN 136 HB1 ASN 136 3.462 -20.876 31.145 1036 1HD2 ASN 136 HD21 ASN 136 0.896 -20.970 31.637 1037 2HD2 ASN 136 HD22 ASN 136 -0.021 -21.419 30.242 1038 H SER 137 HN SER 137 4.563 -17.772 30.331 1039 HA SER 137 HA SER 137 6.359 -17.741 32.618 1040 1HB SER 137 HB2 SER 137 6.939 -16.554 29.906 1041 2HB SER 137 HB1 SER 137 8.079 -17.176 31.098 1042 HG SER 137 HG SER 137 6.151 -18.861 29.921 1043 H ALA 138 HN ALA 138 6.221 -16.140 34.033 1044 HA ALA 138 HA ALA 138 4.894 -13.678 33.467 1045 1HB ALA 138 HB1 ALA 138 6.583 -14.423 35.851 1046 2HB ALA 138 HB2 ALA 138 4.851 -14.712 35.689 1047 3HB ALA 138 HB3 ALA 138 5.468 -13.060 35.744 1048 H THR 139 HN THR 139 6.056 -12.767 31.729 1049 HA THR 139 HA THR 139 8.710 -11.711 32.451 1050 HB THR 139 HB THR 139 9.121 -13.057 30.594 1051 HG1 THR 139 HG1 THR 139 9.674 -11.636 29.031 1052 1HG2 THR 139 HG21 THR 139 6.704 -13.482 30.074 1053 2HG2 THR 139 HG22 THR 139 7.779 -13.347 28.683 1054 3HG2 THR 139 HG23 THR 139 6.733 -11.997 29.123 1055 H GLY 140 HN GLY 140 8.307 -9.725 33.239 1056 1HA GLY 140 HA1 GLY 140 6.268 -8.025 32.109 1057 2HA GLY 140 HA2 GLY 140 7.360 -7.615 33.423 1058 H VAL 141 HN VAL 141 9.539 -8.637 31.419 1059 HA VAL 141 HA VAL 141 9.985 -5.992 30.265 1060 HB VAL 141 HB VAL 141 11.835 -6.924 31.524 1061 1HG1 VAL 141 HG21 VAL 141 12.947 -8.958 30.949 1062 2HG1 VAL 141 HG22 VAL 141 11.941 -9.164 29.515 1063 3HG1 VAL 141 HG23 VAL 141 11.228 -9.312 31.121 1064 1HG2 VAL 141 HG11 VAL 141 12.896 -5.631 30.024 1065 2HG2 VAL 141 HG12 VAL 141 12.050 -6.349 28.652 1066 3HG2 VAL 141 HG13 VAL 141 13.443 -7.169 29.356 1067 HA PRO 142 HA PRO 142 8.758 -7.534 26.265 1068 1HB PRO 142 HB1 PRO 142 9.330 -5.343 24.813 1069 2HB PRO 142 HB2 PRO 142 7.961 -5.392 25.930 1070 1HG PRO 142 HG1 PRO 142 10.677 -4.190 26.307 1071 2HG PRO 142 HG2 PRO 142 9.092 -3.537 26.759 1072 1HD PRO 142 HD1 PRO 142 10.779 -4.778 28.519 1073 2HD PRO 142 HD2 PRO 142 9.015 -4.742 28.707 1074 H THR 143 HN THR 143 10.758 -8.987 26.614 1075 HA THR 143 HA THR 143 13.027 -8.161 24.960 1076 HB THR 143 HB THR 143 13.704 -9.053 27.064 1077 HG1 THR 143 HG1 THR 143 15.126 -9.921 25.747 1078 1HG2 THR 143 HG21 THR 143 12.612 -11.746 26.751 1079 2HG2 THR 143 HG22 THR 143 11.421 -10.498 27.115 1080 3HG2 THR 143 HG23 THR 143 12.795 -10.746 28.193 1081 H VAL 144 HN VAL 144 10.446 -10.531 25.121 1082 HA VAL 144 HA VAL 144 11.344 -12.193 23.014 1083 HB VAL 144 HB VAL 144 8.464 -11.770 23.802 1084 1HG1 VAL 144 HG21 VAL 144 9.353 -13.203 21.759 1085 2HG1 VAL 144 HG22 VAL 144 7.999 -13.739 22.752 1086 3HG1 VAL 144 HG23 VAL 144 9.610 -14.398 23.030 1087 1HG2 VAL 144 HG11 VAL 144 9.723 -14.036 25.062 1088 2HG2 VAL 144 HG12 VAL 144 8.800 -12.719 25.785 1089 3HG2 VAL 144 HG13 VAL 144 10.532 -12.534 25.512 Start of MODEL 25 1 1H GLY 1 HT1 GLY 1 -13.033 18.600 36.267 2 2H GLY 1 HT2 GLY 1 -14.677 18.228 36.131 3 3H GLY 1 HT3 GLY 1 -14.171 19.842 36.122 4 1HA GLY 1 HA1 GLY 1 -14.168 17.877 33.983 5 2HA GLY 1 HA2 GLY 1 -14.389 19.618 33.904 6 HA PRO 2 HA PRO 2 -10.243 18.902 32.080 7 1HB PRO 2 HB2 PRO 2 -10.274 21.165 30.567 8 2HB PRO 2 HB1 PRO 2 -11.009 19.644 30.049 9 1HG PRO 2 HG2 PRO 2 -12.299 22.055 31.271 10 2HG PRO 2 HG1 PRO 2 -12.851 21.061 29.909 11 1HD PRO 2 HD2 PRO 2 -13.869 20.787 32.394 12 2HD PRO 2 HD1 PRO 2 -13.684 19.407 31.292 13 H LEU 3 HN LEU 3 -8.558 19.408 33.313 14 HA LEU 3 HA LEU 3 -8.541 21.959 34.751 15 1HB LEU 3 HB2 LEU 3 -6.411 20.726 35.766 16 2HB LEU 3 HB1 LEU 3 -8.035 20.446 36.361 17 HG LEU 3 HG LEU 3 -7.511 18.628 34.211 18 1HD1 LEU 3 HD11 LEU 3 -5.233 18.586 34.492 19 2HD1 LEU 3 HD12 LEU 3 -5.736 17.351 35.645 20 3HD1 LEU 3 HD13 LEU 3 -5.328 18.970 36.210 21 1HD2 LEU 3 HD21 LEU 3 -7.580 17.699 37.013 22 2HD2 LEU 3 HD22 LEU 3 -8.502 17.156 35.611 23 3HD2 LEU 3 HD23 LEU 3 -8.968 18.633 36.456 24 H GLY 4 HN GLY 4 -8.110 22.370 32.136 25 1HA GLY 4 HA2 GLY 4 -5.190 22.567 31.803 26 2HA GLY 4 HA1 GLY 4 -6.366 22.643 30.501 27 H SER 5 HN SER 5 -4.837 24.564 30.111 28 HA SER 5 HA SER 5 -5.288 26.888 31.748 29 1HB SER 5 HB2 SER 5 -3.163 26.367 30.423 30 2HB SER 5 HB1 SER 5 -4.061 26.866 28.990 31 HG SER 5 HG SER 5 -3.098 28.385 31.109 32 H ALA 6 HN ALA 6 -6.126 28.924 30.844 33 HA ALA 6 HA ALA 6 -8.694 28.513 29.665 34 1HB ALA 6 HB1 ALA 6 -8.680 31.093 29.673 35 2HB ALA 6 HB2 ALA 6 -7.169 30.925 30.567 36 3HB ALA 6 HB3 ALA 6 -8.659 30.239 31.216 37 H ALA 7 HN ALA 7 -9.193 28.437 27.579 38 HA ALA 7 HA ALA 7 -7.784 30.072 25.646 39 1HB ALA 7 HB1 ALA 7 -7.333 28.103 24.158 40 2HB ALA 7 HB2 ALA 7 -7.682 27.065 25.542 41 3HB ALA 7 HB3 ALA 7 -6.328 28.193 25.604 42 H ALA 8 HN ALA 8 -10.548 29.423 26.824 43 HA ALA 8 HA ALA 8 -11.938 29.456 24.242 44 1HB ALA 8 HB1 ALA 8 -13.320 27.706 24.674 45 2HB ALA 8 HB2 ALA 8 -13.252 27.937 26.421 46 3HB ALA 8 HB3 ALA 8 -11.909 27.161 25.581 47 H ALA 9 HN ALA 9 -11.260 31.157 26.829 48 HA ALA 9 HA ALA 9 -13.917 32.416 26.930 49 1HB ALA 9 HB1 ALA 9 -12.169 32.399 29.353 50 2HB ALA 9 HB2 ALA 9 -13.211 31.021 29.002 51 3HB ALA 9 HB3 ALA 9 -13.914 32.622 29.231 52 H THR 10 HN THR 10 -10.713 33.108 28.323 53 HA THR 10 HA THR 10 -9.393 34.956 28.270 54 HB THR 10 HB THR 10 -10.526 35.697 25.597 55 HG1 THR 10 HG1 THR 10 -10.317 33.537 25.326 56 1HG2 THR 10 HG21 THR 10 -8.696 37.043 26.421 57 2HG2 THR 10 HG22 THR 10 -8.188 36.086 25.030 58 3HG2 THR 10 HG23 THR 10 -7.716 35.596 26.657 59 HA PRO 11 HA PRO 11 -12.741 37.793 29.600 60 1HB PRO 11 HB1 PRO 11 -11.428 38.717 31.783 61 2HB PRO 11 HB2 PRO 11 -12.341 37.205 31.787 62 1HG PRO 11 HG1 PRO 11 -9.392 37.639 31.489 63 2HG PRO 11 HG2 PRO 11 -10.251 36.430 32.461 64 1HD PRO 11 HD2 PRO 11 -9.157 35.856 30.050 65 2HD PRO 11 HD1 PRO 11 -10.624 35.055 30.647 66 H ALA 12 HN ALA 12 -12.746 39.482 28.226 67 HA ALA 12 HA ALA 12 -10.365 41.043 27.732 68 1HB ALA 12 HB1 ALA 12 -11.371 41.549 25.820 69 2HB ALA 12 HB2 ALA 12 -12.766 42.219 26.666 70 3HB ALA 12 HB3 ALA 12 -12.698 40.494 26.304 71 H VAL 13 HN VAL 13 -13.587 41.656 29.117 72 HA VAL 13 HA VAL 13 -12.726 44.257 30.088 73 HB VAL 13 HB VAL 13 -15.085 44.355 31.008 74 1HG1 VAL 13 HG11 VAL 13 -14.268 44.291 28.171 75 2HG1 VAL 13 HG12 VAL 13 -14.988 45.594 29.117 76 3HG1 VAL 13 HG13 VAL 13 -16.002 44.296 28.489 77 1HG2 VAL 13 HG21 VAL 13 -15.953 42.236 29.175 78 2HG2 VAL 13 HG22 VAL 13 -16.545 42.664 30.779 79 3HG2 VAL 13 HG23 VAL 13 -15.099 41.668 30.610 80 H ARG 14 HN ARG 14 -13.158 44.864 32.363 81 HA ARG 14 HA ARG 14 -11.927 42.985 34.131 82 1HB ARG 14 HB2 ARG 14 -12.142 45.725 34.059 83 2HB ARG 14 HB1 ARG 14 -13.229 45.301 35.375 84 1HG ARG 14 HG2 ARG 14 -11.324 45.483 36.572 85 2HG ARG 14 HG1 ARG 14 -11.144 43.799 36.074 86 1HD ARG 14 HD2 ARG 14 -9.400 44.250 34.731 87 2HD ARG 14 HD1 ARG 14 -10.109 45.758 34.153 88 HE ARG 14 HE ARG 14 -8.942 46.893 35.766 89 1HH1 ARG 14 HH11 ARG 14 -8.860 43.482 36.475 90 2HH1 ARG 14 HH12 ARG 14 -7.691 43.642 37.742 91 1HH2 ARG 14 HH21 ARG 14 -7.402 47.113 37.434 92 2HH2 ARG 14 HH22 ARG 14 -6.863 45.706 38.288 93 H THR 15 HN THR 15 -12.885 41.462 35.288 94 HA THR 15 HA THR 15 -15.786 41.427 35.499 95 HB THR 15 HB THR 15 -15.512 39.133 36.276 96 HG1 THR 15 HG1 THR 15 -12.862 38.865 35.919 97 1HG2 THR 15 HG21 THR 15 -14.297 38.121 34.394 98 2HG2 THR 15 HG22 THR 15 -13.732 39.726 33.929 99 3HG2 THR 15 HG23 THR 15 -15.455 39.352 33.889 100 H VAL 16 HN VAL 16 -16.834 42.129 37.228 101 HA VAL 16 HA VAL 16 -15.346 42.681 39.681 102 HB VAL 16 HB VAL 16 -18.208 43.405 39.050 103 1HG1 VAL 16 HG11 VAL 16 -16.343 44.706 41.017 104 2HG1 VAL 16 HG12 VAL 16 -17.402 43.366 41.455 105 3HG1 VAL 16 HG13 VAL 16 -18.092 44.885 40.883 106 1HG2 VAL 16 HG21 VAL 16 -17.492 45.510 38.274 107 2HG2 VAL 16 HG22 VAL 16 -16.471 44.333 37.449 108 3HG2 VAL 16 HG23 VAL 16 -15.839 45.241 38.823 109 HA PRO 17 HA PRO 17 -16.927 38.966 41.570 110 1HB PRO 17 HB2 PRO 17 -16.341 39.601 44.157 111 2HB PRO 17 HB1 PRO 17 -15.137 39.026 42.998 112 1HG PRO 17 HG2 PRO 17 -15.748 41.827 43.864 113 2HG PRO 17 HG1 PRO 17 -14.173 41.051 43.616 114 1HD PRO 17 HD2 PRO 17 -15.257 42.700 41.781 115 2HD PRO 17 HD1 PRO 17 -14.271 41.297 41.319 116 H GLN 18 HN GLN 18 -18.291 38.504 43.660 117 HA GLN 18 HA GLN 18 -20.757 39.929 43.326 118 1HB GLN 18 HB2 GLN 18 -19.935 37.405 44.363 119 2HB GLN 18 HB1 GLN 18 -20.847 38.233 45.618 120 1HG GLN 18 HG1 GLN 18 -22.789 38.211 44.420 121 2HG GLN 18 HG2 GLN 18 -21.959 38.183 42.865 122 1HE2 GLN 18 HE21 GLN 18 -23.718 36.518 42.585 123 2HE2 GLN 18 HE22 GLN 18 -23.311 34.886 42.976 124 H TYR 19 HN TYR 19 -21.666 41.435 44.604 125 HA TYR 19 HA TYR 19 -20.021 42.754 46.551 126 1HB TYR 19 HB1 TYR 19 -22.087 43.537 44.890 127 2HB TYR 19 HB2 TYR 19 -22.839 43.549 46.482 128 HD1 TYR 19 HD1 TYR 19 -19.817 44.791 44.684 129 HD2 TYR 19 HD2 TYR 19 -22.580 45.401 47.861 130 HE1 TYR 19 HE1 TYR 19 -18.793 46.977 45.146 131 HE2 TYR 19 HE2 TYR 19 -21.564 47.590 48.332 132 HH TYR 19 HH TYR 19 -20.233 49.303 47.115 133 H LYS 20 HN LYS 20 -22.393 43.524 48.207 134 HA LYS 20 HA LYS 20 -22.072 41.536 50.226 135 1HB LYS 20 HB1 LYS 20 -23.703 42.904 51.496 136 2HB LYS 20 HB2 LYS 20 -22.373 43.856 50.849 137 1HG LYS 20 HG2 LYS 20 -23.811 45.203 49.850 138 2HG LYS 20 HG1 LYS 20 -24.466 43.846 48.930 139 1HD LYS 20 HD2 LYS 20 -26.153 43.447 50.484 140 2HD LYS 20 HD1 LYS 20 -25.312 44.324 51.764 141 1HE LYS 20 HE2 LYS 20 -25.876 46.021 49.486 142 2HE LYS 20 HE1 LYS 20 -27.344 45.293 50.138 143 1HZ LYS 20 HZ1 LYS 20 -25.987 46.101 52.350 144 2HZ LYS 20 HZ2 LYS 20 -27.277 46.924 51.629 145 3HZ LYS 20 HZ3 LYS 20 -25.684 47.347 51.246 146 H TYR 21 HN TYR 21 -24.647 41.405 51.342 147 HA TYR 21 HA TYR 21 -25.701 39.167 49.998 148 1HB TYR 21 HB2 TYR 21 -27.141 40.886 52.026 149 2HB TYR 21 HB1 TYR 21 -27.453 39.194 51.651 150 HD1 TYR 21 HD1 TYR 21 -25.710 37.475 52.253 151 HD2 TYR 21 HD2 TYR 21 -25.525 41.494 53.635 152 HE1 TYR 21 HE1 TYR 21 -24.148 36.788 54.024 153 HE2 TYR 21 HE2 TYR 21 -23.963 40.818 55.411 154 HH TYR 21 HH TYR 21 -22.423 39.062 55.938 155 H ALA 22 HN ALA 22 -26.334 39.528 47.922 156 HA ALA 22 HA ALA 22 -28.231 41.689 47.375 157 1HB ALA 22 HB1 ALA 22 -27.438 40.008 45.122 158 2HB ALA 22 HB2 ALA 22 -26.086 40.787 45.943 159 3HB ALA 22 HB3 ALA 22 -27.406 41.763 45.298 160 H ALA 23 HN ALA 23 -29.643 40.714 45.268 161 HA ALA 23 HA ALA 23 -31.546 39.001 46.582 162 1HB ALA 23 HB1 ALA 23 -32.083 39.442 43.780 163 2HB ALA 23 HB2 ALA 23 -31.678 40.948 44.603 164 3HB ALA 23 HB3 ALA 23 -33.004 39.948 45.195 165 H GLY 24 HN GLY 24 -32.520 37.133 45.342 166 1HA GLY 24 HA1 GLY 24 -30.349 35.360 44.545 167 2HA GLY 24 HA2 GLY 24 -32.003 34.887 44.901 168 H VAL 25 HN VAL 25 -30.148 36.776 42.518 169 HA VAL 25 HA VAL 25 -32.085 35.989 40.461 170 HB VAL 25 HB VAL 25 -30.693 37.657 39.056 171 1HG1 VAL 25 HG11 VAL 25 -32.049 39.506 39.821 172 2HG1 VAL 25 HG12 VAL 25 -32.343 38.693 41.357 173 3HG1 VAL 25 HG13 VAL 25 -32.996 38.020 39.864 174 1HG2 VAL 25 HG21 VAL 25 -29.268 39.125 40.080 175 2HG2 VAL 25 HG22 VAL 25 -28.967 37.680 41.047 176 3HG2 VAL 25 HG23 VAL 25 -30.037 38.943 41.658 177 H ARG 26 HN ARG 26 -31.224 33.787 40.481 178 HA ARG 26 HA ARG 26 -28.549 33.237 39.696 179 1HB ARG 26 HB1 ARG 26 -29.491 30.932 39.202 180 2HB ARG 26 HB2 ARG 26 -29.689 31.513 40.849 181 1HG ARG 26 HG2 ARG 26 -31.858 31.119 40.700 182 2HG ARG 26 HG1 ARG 26 -31.974 32.335 39.425 183 1HD ARG 26 HD1 ARG 26 -30.909 29.799 38.476 184 2HD ARG 26 HD2 ARG 26 -32.524 29.645 39.166 185 HE ARG 26 HE ARG 26 -32.062 31.743 37.184 186 1HH1 ARG 26 HH11 ARG 26 -33.452 28.655 38.008 187 2HH1 ARG 26 HH12 ARG 26 -34.513 28.623 36.639 188 1HH2 ARG 26 HH21 ARG 26 -33.455 31.707 35.378 189 2HH2 ARG 26 HH22 ARG 26 -34.515 30.356 35.145 190 H ASN 27 HN ASN 27 -27.660 32.899 37.721 191 HA ASN 27 HA ASN 27 -29.028 33.963 35.450 192 1HB ASN 27 HB1 ASN 27 -26.331 33.439 36.162 193 2HB ASN 27 HB2 ASN 27 -26.655 32.582 34.658 194 1HD2 ASN 27 HD21 ASN 27 -26.059 35.585 36.120 195 2HD2 ASN 27 HD22 ASN 27 -26.226 36.572 34.712 196 HA PRO 28 HA PRO 28 -27.644 31.201 37.360 197 1HB PRO 28 HB1 PRO 28 -27.083 28.606 37.576 198 2HB PRO 28 HB2 PRO 28 -28.711 29.213 37.893 199 1HG PRO 28 HG2 PRO 28 -27.652 27.769 35.513 200 2HG PRO 28 HG1 PRO 28 -29.253 27.673 36.264 201 1HD PRO 28 HD1 PRO 28 -28.560 29.183 33.993 202 2HD PRO 28 HD2 PRO 28 -30.057 29.322 34.933 203 H GLN 29 HN GLN 29 -26.617 29.222 34.573 204 HA GLN 29 HA GLN 29 -23.830 29.515 35.229 205 1HB GLN 29 HB2 GLN 29 -24.832 27.490 34.118 206 2HB GLN 29 HB1 GLN 29 -25.040 28.462 32.668 207 1HG GLN 29 HG2 GLN 29 -22.703 28.707 32.388 208 2HG GLN 29 HG1 GLN 29 -22.375 28.046 33.989 209 1HE2 GLN 29 HE21 GLN 29 -23.198 25.778 34.319 210 2HE2 GLN 29 HE22 GLN 29 -22.970 24.670 33.013 211 H GLN 30 HN GLN 30 -22.321 30.800 34.255 212 HA GLN 30 HA GLN 30 -23.237 33.214 33.051 213 1HB GLN 30 HB2 GLN 30 -20.478 32.074 33.504 214 2HB GLN 30 HB1 GLN 30 -20.752 33.647 32.766 215 1HG GLN 30 HG1 GLN 30 -22.170 34.088 34.908 216 2HG GLN 30 HG2 GLN 30 -21.213 32.763 35.573 217 1HE2 GLN 30 HE21 GLN 30 -20.295 35.302 33.292 218 2HE2 GLN 30 HE22 GLN 30 -19.049 35.982 34.277 219 H HIS 31 HN HIS 31 -22.303 34.060 30.988 220 HA HIS 31 HA HIS 31 -22.136 31.929 28.961 221 1HB HIS 31 HB2 HIS 31 -24.267 33.518 29.156 222 2HB HIS 31 HB1 HIS 31 -23.239 34.595 28.215 223 HD2 HIS 31 HD2 HIS 31 -22.444 33.533 25.675 224 HE1 HIS 31 HE1 HIS 31 -25.629 30.746 25.627 225 HE2 HIS 31 HE2 HIS 31 -23.828 31.872 24.241 226 H LEU 32 HN LEU 32 -19.835 32.846 30.089 227 HA LEU 32 HA LEU 32 -18.750 34.868 28.271 228 1HB LEU 32 HB1 LEU 32 -16.973 35.149 29.779 229 2HB LEU 32 HB2 LEU 32 -18.400 34.970 30.782 230 HG LEU 32 HG LEU 32 -17.054 32.428 30.287 231 1HD1 LEU 32 HD21 LEU 32 -15.495 34.002 32.198 232 2HD1 LEU 32 HD22 LEU 32 -15.286 34.488 30.516 233 3HD1 LEU 32 HD23 LEU 32 -14.969 32.822 30.999 234 1HD2 LEU 32 HD11 LEU 32 -18.459 32.207 32.032 235 2HD2 LEU 32 HD12 LEU 32 -18.356 33.911 32.471 236 3HD2 LEU 32 HD13 LEU 32 -17.078 32.797 32.957 237 H ASN 33 HN ASN 33 -18.878 31.505 28.704 238 HA ASN 33 HA ASN 33 -16.368 30.910 27.408 239 1HB ASN 33 HB1 ASN 33 -18.707 29.169 28.213 240 2HB ASN 33 HB2 ASN 33 -17.237 28.549 27.469 241 1HD2 ASN 33 HD21 ASN 33 -17.851 27.497 29.798 242 2HD2 ASN 33 HD22 ASN 33 -16.842 28.099 31.065 243 H ALA 34 HN ALA 34 -17.077 28.815 25.727 244 HA ALA 34 HA ALA 34 -17.745 30.231 23.349 245 1HB ALA 34 HB1 ALA 34 -16.293 28.049 23.782 246 2HB ALA 34 HB2 ALA 34 -17.056 28.380 22.227 247 3HB ALA 34 HB3 ALA 34 -17.818 27.269 23.366 248 H GLN 35 HN GLN 35 -19.314 28.517 21.885 249 HA GLN 35 HA GLN 35 -21.925 29.057 23.045 250 1HB GLN 35 HB2 GLN 35 -20.901 29.199 20.452 251 2HB GLN 35 HB1 GLN 35 -22.006 27.833 20.424 252 1HG GLN 35 HG1 GLN 35 -23.336 29.635 19.829 253 2HG GLN 35 HG2 GLN 35 -23.684 29.405 21.542 254 1HE2 GLN 35 HE21 GLN 35 -23.186 31.678 19.297 255 2HE2 GLN 35 HE22 GLN 35 -22.539 32.948 20.273 256 HA PRO 36 HA PRO 36 -19.331 27.058 21.511 257 1HB PRO 36 HB1 PRO 36 -18.355 24.679 20.827 258 2HB PRO 36 HB2 PRO 36 -18.368 25.192 22.518 259 1HG PRO 36 HG1 PRO 36 -20.126 23.248 21.111 260 2HG PRO 36 HG2 PRO 36 -19.563 23.244 22.790 261 1HD PRO 36 HD2 PRO 36 -22.071 24.157 21.829 262 2HD PRO 36 HD1 PRO 36 -21.425 24.335 23.472 263 H GLN 37 HN GLN 37 -18.307 25.854 19.311 264 HA GLN 37 HA GLN 37 -20.078 26.688 17.250 265 1HB GLN 37 HB2 GLN 37 -17.368 26.377 17.459 266 2HB GLN 37 HB1 GLN 37 -17.800 24.999 16.456 267 1HG GLN 37 HG1 GLN 37 -18.791 26.418 14.811 268 2HG GLN 37 HG2 GLN 37 -18.612 27.831 15.852 269 1HE2 GLN 37 HE21 GLN 37 -17.491 26.747 13.143 270 2HE2 GLN 37 HE22 GLN 37 -15.821 27.178 13.236 271 H VAL 38 HN VAL 38 -21.562 25.575 16.171 272 HA VAL 38 HA VAL 38 -22.064 22.824 16.799 273 HB VAL 38 HB VAL 38 -23.402 24.391 14.604 274 1HG1 VAL 38 HG11 VAL 38 -24.961 22.584 16.294 275 2HG1 VAL 38 HG12 VAL 38 -23.685 21.785 15.375 276 3HG1 VAL 38 HG13 VAL 38 -24.911 22.737 14.538 277 1HG2 VAL 38 HG21 VAL 38 -23.607 25.855 16.422 278 2HG2 VAL 38 HG22 VAL 38 -23.823 24.537 17.573 279 3HG2 VAL 38 HG23 VAL 38 -25.107 24.929 16.430 280 H THR 39 HN THR 39 -20.296 21.649 16.044 281 HA THR 39 HA THR 39 -19.817 21.684 13.147 282 HB THR 39 HB THR 39 -18.057 19.969 14.715 283 HG1 THR 39 HG1 THR 39 -17.113 21.535 15.939 284 1HG2 THR 39 HG21 THR 39 -17.481 20.701 12.481 285 2HG2 THR 39 HG22 THR 39 -16.297 21.274 13.655 286 3HG2 THR 39 HG23 THR 39 -17.507 22.382 13.010 287 H MET 40 HN MET 40 -21.244 20.359 12.186 288 HA MET 40 HA MET 40 -22.009 17.848 13.402 289 1HB MET 40 HB2 MET 40 -23.217 19.625 11.614 290 2HB MET 40 HB1 MET 40 -22.890 18.181 10.667 291 1HG MET 40 HG1 MET 40 -24.068 17.684 13.305 292 2HG MET 40 HG2 MET 40 -25.096 18.573 12.183 293 1HE MET 40 HE1 MET 40 -24.067 15.486 13.561 294 2HE MET 40 HE2 MET 40 -22.893 15.060 12.316 295 3HE MET 40 HE3 MET 40 -24.429 14.199 12.411 296 H GLN 41 HN GLN 41 -21.461 18.158 9.974 297 HA GLN 41 HA GLN 41 -20.187 15.661 9.757 298 1HB GLN 41 HB1 GLN 41 -21.040 17.770 7.988 299 2HB GLN 41 HB2 GLN 41 -19.447 17.196 7.512 300 1HG GLN 41 HG2 GLN 41 -21.406 15.094 8.124 301 2HG GLN 41 HG1 GLN 41 -21.775 16.090 6.717 302 1HE2 GLN 41 HE22 GLN 41 -19.514 16.569 5.503 303 2HE2 GLN 41 HE21 GLN 41 -18.684 15.121 5.058 304 H GLN 42 HN GLN 42 -18.246 15.168 10.515 305 HA GLN 42 HA GLN 42 -16.261 17.053 11.191 306 1HB GLN 42 HB1 GLN 42 -15.941 14.083 10.718 307 2HB GLN 42 HB2 GLN 42 -14.822 15.117 11.592 308 1HG GLN 42 HG2 GLN 42 -16.091 15.156 13.456 309 2HG GLN 42 HG1 GLN 42 -17.608 15.098 12.557 310 1HE2 GLN 42 HE22 GLN 42 -14.787 12.952 12.648 311 2HE2 GLN 42 HE21 GLN 42 -15.668 11.528 13.072 312 HA PRO 43 HA PRO 43 -14.234 17.728 7.320 313 1HB PRO 43 HB1 PRO 43 -11.747 18.384 8.176 314 2HB PRO 43 HB2 PRO 43 -13.134 19.466 8.344 315 1HG PRO 43 HG1 PRO 43 -11.892 17.647 10.374 316 2HG PRO 43 HG2 PRO 43 -12.453 19.318 10.565 317 1HD PRO 43 HD1 PRO 43 -13.918 17.187 11.372 318 2HD PRO 43 HD2 PRO 43 -14.660 18.685 10.777 319 H ALA 44 HN ALA 44 -14.369 15.495 6.647 320 HA ALA 44 HA ALA 44 -12.280 13.647 7.328 321 1HB ALA 44 HB1 ALA 44 -14.536 13.568 5.346 322 2HB ALA 44 HB2 ALA 44 -14.370 12.673 6.857 323 3HB ALA 44 HB3 ALA 44 -13.345 12.275 5.479 324 H VAL 45 HN VAL 45 -10.597 12.921 6.042 325 HA VAL 45 HA VAL 45 -9.761 14.794 3.948 326 HB VAL 45 HB VAL 45 -8.079 12.620 5.185 327 1HG1 VAL 45 HG21 VAL 45 -7.406 15.144 3.680 328 2HG1 VAL 45 HG22 VAL 45 -7.204 13.486 3.115 329 3HG1 VAL 45 HG23 VAL 45 -6.224 14.088 4.453 330 1HG2 VAL 45 HG11 VAL 45 -7.895 13.770 7.074 331 2HG2 VAL 45 HG12 VAL 45 -9.116 14.899 6.489 332 3HG2 VAL 45 HG13 VAL 45 -7.408 15.210 6.179 333 H HIS 46 HN HIS 46 -11.213 13.919 2.353 334 HA HIS 46 HA HIS 46 -10.448 11.261 1.349 335 1HB HIS 46 HB1 HIS 46 -12.592 11.151 0.263 336 2HB HIS 46 HB2 HIS 46 -12.858 11.633 1.935 337 HD2 HIS 46 HD2 HIS 46 -13.304 14.505 2.216 338 HE1 HIS 46 HE1 HIS 46 -14.828 14.749 -1.726 339 HE2 HIS 46 HE2 HIS 46 -14.633 15.935 0.508 340 H VAL 47 HN VAL 47 -9.712 14.392 0.868 341 HA VAL 47 HA VAL 47 -9.621 14.235 -2.057 342 HB VAL 47 HB VAL 47 -8.995 16.615 -1.988 343 1HG1 VAL 47 HG11 VAL 47 -11.421 16.280 -0.262 344 2HG1 VAL 47 HG12 VAL 47 -11.406 15.716 -1.933 345 3HG1 VAL 47 HG13 VAL 47 -11.141 17.423 -1.576 346 1HG2 VAL 47 HG21 VAL 47 -8.277 16.075 0.639 347 2HG2 VAL 47 HG22 VAL 47 -9.707 17.099 0.774 348 3HG2 VAL 47 HG23 VAL 47 -8.306 17.655 -0.143 349 H GLN 48 HN GLN 48 -7.657 14.763 -3.187 350 HA GLN 48 HA GLN 48 -5.314 13.691 -1.827 351 1HB GLN 48 HB1 GLN 48 -6.248 13.884 -4.595 352 2HB GLN 48 HB2 GLN 48 -4.541 14.258 -4.412 353 1HG GLN 48 HG2 GLN 48 -5.436 11.863 -2.979 354 2HG GLN 48 HG1 GLN 48 -5.552 11.771 -4.736 355 1HE2 GLN 48 HE22 GLN 48 -3.587 12.371 -5.943 356 2HE2 GLN 48 HE21 GLN 48 -2.055 11.934 -5.275 357 H GLY 49 HN GLY 49 -6.206 16.302 -1.051 358 1HA GLY 49 HA1 GLY 49 -4.538 18.270 -2.315 359 2HA GLY 49 HA2 GLY 49 -5.482 18.489 -0.850 360 H GLN 50 HN GLN 50 -4.249 16.165 0.464 361 HA GLN 50 HA GLN 50 -1.694 17.440 1.160 362 1HB GLN 50 HB2 GLN 50 -3.842 16.334 2.721 363 2HB GLN 50 HB1 GLN 50 -2.352 15.469 3.074 364 1HG GLN 50 HG2 GLN 50 -1.244 17.511 3.674 365 2HG GLN 50 HG1 GLN 50 -2.638 18.462 3.165 366 1HE2 GLN 50 HE21 GLN 50 -1.838 15.775 5.340 367 2HE2 GLN 50 HE22 GLN 50 -2.850 16.300 6.638 368 H GLU 51 HN GLU 51 0.177 16.192 1.440 369 HA GLU 51 HA GLU 51 0.418 13.997 -0.368 370 1HB GLU 51 HB2 GLU 51 2.292 15.407 1.504 371 2HB GLU 51 HB1 GLU 51 2.780 13.902 0.737 372 1HG GLU 51 HG1 GLU 51 1.665 15.998 -1.022 373 2HG GLU 51 HG2 GLU 51 3.254 16.299 -0.321 374 HA PRO 52 HA PRO 52 -0.818 10.812 2.510 375 1HB PRO 52 HB1 PRO 52 0.516 9.026 0.564 376 2HB PRO 52 HB2 PRO 52 -1.151 9.008 1.149 377 1HG PRO 52 HG1 PRO 52 -0.571 9.826 -1.326 378 2HG PRO 52 HG2 PRO 52 -1.841 10.613 -0.372 379 1HD PRO 52 HD1 PRO 52 0.960 11.524 -0.915 380 2HD PRO 52 HD2 PRO 52 -0.545 12.467 -0.882 381 H LEU 53 HN LEU 53 0.142 9.471 4.021 382 HA LEU 53 HA LEU 53 2.866 10.008 4.670 383 1HB LEU 53 HB2 LEU 53 0.578 8.917 5.943 384 2HB LEU 53 HB1 LEU 53 1.859 7.733 6.075 385 HG LEU 53 HG LEU 53 1.499 9.500 7.959 386 1HD1 LEU 53 HD11 LEU 53 3.698 7.999 7.061 387 2HD1 LEU 53 HD12 LEU 53 3.371 8.597 8.689 388 3HD1 LEU 53 HD13 LEU 53 4.320 9.573 7.562 389 1HD2 LEU 53 HD21 LEU 53 2.053 11.241 5.873 390 2HD2 LEU 53 HD22 LEU 53 3.536 11.189 6.830 391 3HD2 LEU 53 HD23 LEU 53 2.005 11.617 7.596 392 H THR 54 HN THR 54 4.659 8.793 4.385 393 HA THR 54 HA THR 54 4.711 6.037 3.893 394 HB THR 54 HB THR 54 5.793 7.062 1.419 395 HG1 THR 54 HG1 THR 54 3.874 7.673 0.450 396 1HG2 THR 54 HG21 THR 54 5.393 4.882 1.129 397 2HG2 THR 54 HG22 THR 54 3.774 5.426 0.686 398 3HG2 THR 54 HG23 THR 54 4.096 4.855 2.322 399 H ALA 55 HN ALA 55 7.018 5.518 2.773 400 HA ALA 55 HA ALA 55 8.945 6.183 4.602 401 1HB ALA 55 HB1 ALA 55 9.124 4.341 2.988 402 2HB ALA 55 HB2 ALA 55 10.585 5.329 3.044 403 3HB ALA 55 HB3 ALA 55 9.448 5.512 1.708 404 H SER 56 HN SER 56 8.147 7.879 1.610 405 HA SER 56 HA SER 56 10.346 9.645 1.608 406 1HB SER 56 HB1 SER 56 7.683 10.490 0.527 407 2HB SER 56 HB2 SER 56 9.294 10.735 -0.148 408 HG SER 56 HG SER 56 8.136 9.152 -1.307 409 H MET 57 HN MET 57 7.035 10.022 2.835 410 HA MET 57 HA MET 57 7.256 12.638 3.799 411 1HB MET 57 HB1 MET 57 5.571 10.278 4.589 412 2HB MET 57 HB2 MET 57 5.459 11.788 5.473 413 1HG MET 57 HG1 MET 57 3.880 11.186 3.429 414 2HG MET 57 HG2 MET 57 4.360 12.840 3.805 415 1HE MET 57 HE1 MET 57 5.043 10.375 0.172 416 2HE MET 57 HE2 MET 57 4.453 9.863 1.753 417 3HE MET 57 HE3 MET 57 6.180 9.818 1.400 418 H LEU 58 HN LEU 58 8.023 9.543 5.250 419 HA LEU 58 HA LEU 58 8.593 10.442 7.853 420 1HB LEU 58 HB1 LEU 58 9.773 8.077 6.403 421 2HB LEU 58 HB2 LEU 58 9.654 8.288 8.140 422 HG LEU 58 HG LEU 58 7.205 8.226 6.403 423 1HD1 LEU 58 HD21 LEU 58 8.960 6.137 6.455 424 2HD1 LEU 58 HD22 LEU 58 7.225 6.007 6.162 425 3HD1 LEU 58 HD23 LEU 58 7.866 5.739 7.782 426 1HD2 LEU 58 HD11 LEU 58 6.029 8.063 8.330 427 2HD2 LEU 58 HD12 LEU 58 7.439 8.922 8.958 428 3HD2 LEU 58 HD13 LEU 58 7.305 7.175 9.166 429 H ALA 59 HN ALA 59 10.646 9.902 5.029 430 HA ALA 59 HA ALA 59 13.085 10.629 6.292 431 1HB ALA 59 HB1 ALA 59 12.567 9.390 4.006 432 2HB ALA 59 HB2 ALA 59 14.076 10.264 4.275 433 3HB ALA 59 HB3 ALA 59 12.766 11.022 3.369 434 H SER 60 HN SER 60 10.409 12.433 5.499 435 HA SER 60 HA SER 60 11.778 14.873 4.762 436 1HB SER 60 HB1 SER 60 9.508 14.279 3.878 437 2HB SER 60 HB2 SER 60 8.870 14.483 5.512 438 HG SER 60 HG SER 60 10.063 16.670 5.210 439 H ALA 61 HN ALA 61 11.281 13.237 7.595 440 HA ALA 61 HA ALA 61 11.603 15.706 9.166 441 1HB ALA 61 HB1 ALA 61 9.279 14.501 9.233 442 2HB ALA 61 HB2 ALA 61 10.010 15.113 10.718 443 3HB ALA 61 HB3 ALA 61 10.111 13.395 10.326 444 HA PRO 62 HA PRO 62 14.901 12.306 9.840 445 1HB PRO 62 HB1 PRO 62 16.614 14.716 9.524 446 2HB PRO 62 HB2 PRO 62 16.861 13.069 8.935 447 1HG PRO 62 HG1 PRO 62 16.095 15.008 7.275 448 2HG PRO 62 HG2 PRO 62 15.443 13.366 7.121 449 1HD PRO 62 HD1 PRO 62 14.168 15.817 8.256 450 2HD PRO 62 HD2 PRO 62 13.443 14.505 7.306 451 HA PRO 63 HA PRO 63 16.041 14.742 13.697 452 1HB PRO 63 HB1 PRO 63 16.126 17.399 13.789 453 2HB PRO 63 HB2 PRO 63 17.325 16.496 12.857 454 1HG PRO 63 HG2 PRO 63 14.993 18.079 11.915 455 2HG PRO 63 HG1 PRO 63 16.555 17.797 11.127 456 1HD PRO 63 HD1 PRO 63 14.100 16.429 10.651 457 2HD PRO 63 HD2 PRO 63 15.692 16.060 9.962 458 H GLN 64 HN GLN 64 13.129 14.639 12.585 459 HA GLN 64 HA GLN 64 11.918 15.938 14.929 460 1HB GLN 64 HB2 GLN 64 10.878 15.945 12.093 461 2HB GLN 64 HB1 GLN 64 9.926 16.438 13.486 462 1HG GLN 64 HG2 GLN 64 12.047 17.991 13.869 463 2HG GLN 64 HG1 GLN 64 12.148 17.819 12.119 464 1HE2 GLN 64 HE21 GLN 64 10.972 19.143 10.926 465 2HE2 GLN 64 HE22 GLN 64 9.646 20.101 11.484 466 H GLU 65 HN GLU 65 9.964 14.390 12.535 467 HA GLU 65 HA GLU 65 9.373 12.266 14.470 468 1HB GLU 65 HB1 GLU 65 7.583 12.592 12.154 469 2HB GLU 65 HB2 GLU 65 7.197 12.384 13.856 470 1HG GLU 65 HG2 GLU 65 8.380 14.952 13.476 471 2HG GLU 65 HG1 GLU 65 7.076 14.732 12.310 472 H GLN 66 HN GLN 66 11.679 11.973 12.850 473 HA GLN 66 HA GLN 66 11.180 10.355 10.569 474 1HB GLN 66 HB1 GLN 66 13.409 11.510 11.664 475 2HB GLN 66 HB2 GLN 66 13.665 9.811 12.038 476 1HG GLN 66 HG1 GLN 66 12.965 9.582 9.471 477 2HG GLN 66 HG2 GLN 66 13.653 11.203 9.441 478 1HE2 GLN 66 HE21 GLN 66 15.634 10.889 11.372 479 2HE2 GLN 66 HE22 GLN 66 16.836 9.808 10.762 480 H LYS 67 HN LYS 67 11.415 9.757 13.974 481 HA LYS 67 HA LYS 67 10.730 6.940 13.495 482 1HB LYS 67 HB1 LYS 67 12.208 7.479 15.979 483 2HB LYS 67 HB2 LYS 67 12.356 6.139 14.853 484 1HG LYS 67 HG2 LYS 67 13.882 7.264 13.515 485 2HG LYS 67 HG1 LYS 67 13.412 8.845 14.145 486 1HD LYS 67 HD1 LYS 67 14.417 7.044 16.205 487 2HD LYS 67 HD2 LYS 67 15.600 7.379 14.940 488 1HE LYS 67 HE2 LYS 67 15.330 9.763 15.276 489 2HE LYS 67 HE1 LYS 67 14.066 9.476 16.471 490 1HZ LYS 67 HZ1 LYS 67 16.144 8.023 17.417 491 2HZ LYS 67 HZ2 LYS 67 15.720 9.575 17.941 492 3HZ LYS 67 HZ3 LYS 67 16.923 9.379 16.768 493 H GLN 68 HN GLN 68 8.917 9.044 13.891 494 HA GLN 68 HA GLN 68 7.746 8.200 16.446 495 1HB GLN 68 HB2 GLN 68 8.781 10.353 16.871 496 2HB GLN 68 HB1 GLN 68 7.979 11.050 15.470 497 1HG GLN 68 HG1 GLN 68 5.820 10.769 16.531 498 2HG GLN 68 HG2 GLN 68 6.582 9.987 17.916 499 1HE2 GLN 68 HE22 GLN 68 6.598 11.289 19.594 500 2HE2 GLN 68 HE21 GLN 68 6.920 12.986 19.569 501 H MET 69 HN MET 69 7.079 10.079 13.481 502 HA MET 69 HA MET 69 4.257 9.583 13.706 503 1HB MET 69 HB2 MET 69 4.002 10.977 11.790 504 2HB MET 69 HB1 MET 69 5.219 11.712 12.825 505 1HG MET 69 HG2 MET 69 6.936 11.255 11.366 506 2HG MET 69 HG1 MET 69 6.075 9.918 10.605 507 1HE MET 69 HE1 MET 69 6.804 13.079 8.068 508 2HE MET 69 HE2 MET 69 7.429 11.494 8.524 509 3HE MET 69 HE3 MET 69 7.644 12.872 9.604 510 H LEU 70 HN LEU 70 6.545 7.484 12.840 511 HA LEU 70 HA LEU 70 5.736 6.531 10.318 512 1HB LEU 70 HB2 LEU 70 6.608 4.545 12.331 513 2HB LEU 70 HB1 LEU 70 7.155 4.761 10.689 514 HG LEU 70 HG LEU 70 9.034 5.289 11.893 515 1HD1 LEU 70 HD11 LEU 70 8.859 7.954 12.200 516 2HD1 LEU 70 HD12 LEU 70 7.509 7.660 11.102 517 3HD1 LEU 70 HD13 LEU 70 9.139 7.152 10.654 518 1HD2 LEU 70 HD21 LEU 70 7.788 7.034 13.905 519 2HD2 LEU 70 HD22 LEU 70 9.117 5.885 14.059 520 3HD2 LEU 70 HD23 LEU 70 7.450 5.307 14.031 521 H GLY 71 HN GLY 71 4.997 5.260 13.553 522 1HA GLY 71 HA2 GLY 71 2.552 4.122 12.384 523 2HA GLY 71 HA1 GLY 71 3.447 3.342 13.675 524 H GLU 72 HN GLU 72 2.799 6.797 13.520 525 HA GLU 72 HA GLU 72 0.719 6.539 15.561 526 1HB GLU 72 HB1 GLU 72 3.216 8.216 15.867 527 2HB GLU 72 HB2 GLU 72 1.812 8.325 16.920 528 1HG GLU 72 HG2 GLU 72 2.295 5.695 17.092 529 2HG GLU 72 HG1 GLU 72 3.929 6.280 16.780 530 H ARG 73 HN ARG 73 1.666 7.809 12.704 531 HA ARG 73 HA ARG 73 -0.191 10.077 12.948 532 1HB ARG 73 HB1 ARG 73 2.455 10.438 12.590 533 2HB ARG 73 HB2 ARG 73 1.958 10.245 10.916 534 1HG ARG 73 HG1 ARG 73 0.500 12.148 12.696 535 2HG ARG 73 HG2 ARG 73 2.043 12.609 11.975 536 1HD ARG 73 HD2 ARG 73 1.192 12.695 9.870 537 2HD ARG 73 HD1 ARG 73 0.023 11.412 10.174 538 HE ARG 73 HE ARG 73 -0.382 14.068 11.355 539 1HH1 ARG 73 HH22 ARG 73 -1.404 11.524 9.202 540 2HH1 ARG 73 HH21 ARG 73 -2.975 12.203 8.940 541 1HH2 ARG 73 HH11 ARG 73 -2.448 14.967 11.015 542 2HH2 ARG 73 HH12 ARG 73 -3.569 14.159 9.971 543 H LEU 74 HN LEU 74 0.940 7.328 11.243 544 HA LEU 74 HA LEU 74 -0.496 7.790 8.802 545 1HB LEU 74 HB1 LEU 74 1.235 5.735 9.955 546 2HB LEU 74 HB2 LEU 74 -0.070 5.072 8.991 547 HG LEU 74 HG LEU 74 1.434 7.291 7.773 548 1HD1 LEU 74 HD11 LEU 74 3.187 5.983 8.918 549 2HD1 LEU 74 HD12 LEU 74 3.315 5.931 7.158 550 3HD1 LEU 74 HD13 LEU 74 2.651 4.553 8.037 551 1HD2 LEU 74 HD21 LEU 74 1.150 5.922 5.784 552 2HD2 LEU 74 HD22 LEU 74 -0.388 6.131 6.625 553 3HD2 LEU 74 HD23 LEU 74 0.495 4.610 6.765 554 H PHE 75 HN PHE 75 -1.185 6.545 11.902 555 HA PHE 75 HA PHE 75 -3.067 4.649 11.660 556 1HB PHE 75 HB1 PHE 75 -2.222 6.104 13.713 557 2HB PHE 75 HB2 PHE 75 -3.773 6.898 13.485 558 HD1 PHE 75 HD1 PHE 75 -3.194 3.321 12.831 559 HD2 PHE 75 HD2 PHE 75 -4.723 6.210 15.556 560 HE1 PHE 75 HE1 PHE 75 -4.266 1.526 14.128 561 HE2 PHE 75 HE2 PHE 75 -5.801 4.420 16.855 562 HZ PHE 75 HZ PHE 75 -5.573 2.075 16.141 563 HA PRO 76 HA PRO 76 -6.688 7.673 10.713 564 1HB PRO 76 HB1 PRO 76 -6.135 10.226 10.009 565 2HB PRO 76 HB2 PRO 76 -6.360 9.728 11.691 566 1HG PRO 76 HG2 PRO 76 -3.817 10.170 10.169 567 2HG PRO 76 HG1 PRO 76 -4.237 10.682 11.814 568 1HD PRO 76 HD2 PRO 76 -2.716 8.497 11.305 569 2HD PRO 76 HD1 PRO 76 -3.802 8.600 12.705 570 H LEU 77 HN LEU 77 -3.732 7.667 8.939 571 HA LEU 77 HA LEU 77 -5.054 8.261 6.416 572 1HB LEU 77 HB1 LEU 77 -2.173 7.748 7.130 573 2HB LEU 77 HB2 LEU 77 -2.726 7.990 5.484 574 HG LEU 77 HG LEU 77 -2.837 9.991 7.742 575 1HD1 LEU 77 HD11 LEU 77 -0.637 9.683 6.714 576 2HD1 LEU 77 HD12 LEU 77 -1.314 11.272 6.349 577 3HD1 LEU 77 HD13 LEU 77 -1.340 10.001 5.127 578 1HD2 LEU 77 HD21 LEU 77 -4.494 11.021 6.690 579 2HD2 LEU 77 HD22 LEU 77 -4.512 9.774 5.443 580 3HD2 LEU 77 HD23 LEU 77 -3.469 11.185 5.265 581 H ILE 78 HN ILE 78 -4.088 5.513 8.257 582 HA ILE 78 HA ILE 78 -3.860 3.684 6.052 583 HB ILE 78 HB ILE 78 -4.495 2.994 8.908 584 1HG1 ILE 78 HG12 ILE 78 -2.390 4.393 8.571 585 2HG1 ILE 78 HG11 ILE 78 -2.170 2.840 9.369 586 1HG2 ILE 78 HG21 ILE 78 -3.041 0.942 7.949 587 2HG2 ILE 78 HG22 ILE 78 -3.859 1.466 6.476 588 3HG2 ILE 78 HG23 ILE 78 -4.803 1.008 7.896 589 1HD1 ILE 78 HD11 ILE 78 -1.293 1.870 7.372 590 2HD1 ILE 78 HD12 ILE 78 -0.433 3.376 7.693 591 3HD1 ILE 78 HD13 ILE 78 -1.677 3.320 6.444 592 H GLN 79 HN GLN 79 -6.378 4.709 8.292 593 HA GLN 79 HA GLN 79 -8.396 2.889 7.695 594 1HB GLN 79 HB1 GLN 79 -8.248 5.655 8.716 595 2HB GLN 79 HB2 GLN 79 -9.780 5.232 7.966 596 1HG GLN 79 HG1 GLN 79 -10.368 3.852 9.640 597 2HG GLN 79 HG2 GLN 79 -8.724 3.254 9.865 598 1HE2 GLN 79 HE22 GLN 79 -7.258 5.318 10.530 599 2HE2 GLN 79 HE21 GLN 79 -7.844 6.107 11.951 600 H ALA 80 HN ALA 80 -6.914 5.212 5.735 601 HA ALA 80 HA ALA 80 -9.049 5.598 3.848 602 1HB ALA 80 HB1 ALA 80 -7.601 7.005 2.710 603 2HB ALA 80 HB2 ALA 80 -6.166 6.124 3.242 604 3HB ALA 80 HB3 ALA 80 -7.043 7.155 4.376 605 H MET 81 HN MET 81 -6.152 3.599 4.106 606 HA MET 81 HA MET 81 -6.332 2.511 1.466 607 1HB MET 81 HB1 MET 81 -4.967 1.126 3.755 608 2HB MET 81 HB2 MET 81 -4.511 1.157 2.058 609 1HG MET 81 HG2 MET 81 -3.383 3.093 2.260 610 2HG MET 81 HG1 MET 81 -4.499 3.753 3.450 611 1HE MET 81 HE1 MET 81 -1.519 2.256 2.452 612 2HE MET 81 HE2 MET 81 -1.007 1.090 3.677 613 3HE MET 81 HE3 MET 81 -0.508 2.780 3.802 614 H HIS 82 HN HIS 82 -7.253 1.396 4.684 615 HA HIS 82 HA HIS 82 -8.848 -0.748 3.443 616 1HB HIS 82 HB1 HIS 82 -7.253 -0.599 5.967 617 2HB HIS 82 HB2 HIS 82 -8.681 -1.625 5.940 618 HD2 HIS 82 HD2 HIS 82 -5.825 -1.264 3.230 619 HE1 HIS 82 HE1 HIS 82 -6.296 -5.318 4.345 620 HE2 HIS 82 HE2 HIS 82 -5.053 -3.706 2.827 621 HA PRO 83 HA PRO 83 -12.566 1.303 4.732 622 1HB PRO 83 HB2 PRO 83 -13.430 -1.442 5.519 623 2HB PRO 83 HB1 PRO 83 -14.261 -0.243 4.522 624 1HG PRO 83 HG1 PRO 83 -13.063 -2.336 3.400 625 2HG PRO 83 HG2 PRO 83 -12.990 -0.735 2.641 626 1HD PRO 83 HD1 PRO 83 -10.891 -2.212 4.164 627 2HD PRO 83 HD2 PRO 83 -10.722 -1.124 2.772 628 H THR 84 HN THR 84 -11.373 2.256 6.537 629 HA THR 84 HA THR 84 -10.865 2.636 8.723 630 HB THR 84 HB THR 84 -12.826 2.450 10.245 631 HG1 THR 84 HG1 THR 84 -13.613 0.481 9.165 632 1HG2 THR 84 HG21 THR 84 -12.940 3.797 7.644 633 2HG2 THR 84 HG22 THR 84 -13.153 4.437 9.274 634 3HG2 THR 84 HG23 THR 84 -14.484 3.601 8.474 635 H LEU 85 HN LEU 85 -9.837 0.182 7.861 636 HA LEU 85 HA LEU 85 -10.351 -1.696 10.044 637 1HB LEU 85 HB1 LEU 85 -9.317 -1.884 7.302 638 2HB LEU 85 HB2 LEU 85 -8.463 -2.884 8.462 639 HG LEU 85 HG LEU 85 -11.447 -2.995 8.393 640 1HD1 LEU 85 HD11 LEU 85 -9.970 -3.378 6.077 641 2HD1 LEU 85 HD12 LEU 85 -11.607 -3.955 6.395 642 3HD1 LEU 85 HD13 LEU 85 -10.225 -5.005 6.711 643 1HD2 LEU 85 HD21 LEU 85 -9.420 -5.179 8.790 644 2HD2 LEU 85 HD22 LEU 85 -11.129 -5.183 9.224 645 3HD2 LEU 85 HD23 LEU 85 -9.998 -4.156 10.105 646 H ALA 86 HN ALA 86 -8.538 0.918 9.763 647 HA ALA 86 HA ALA 86 -5.970 -0.085 10.614 648 1HB ALA 86 HB1 ALA 86 -6.386 2.737 11.093 649 2HB ALA 86 HB2 ALA 86 -6.880 2.277 9.464 650 3HB ALA 86 HB3 ALA 86 -5.242 1.931 10.019 651 H GLY 87 HN GLY 87 -7.511 -1.220 12.370 652 1HA GLY 87 HA1 GLY 87 -7.872 0.471 14.719 653 2HA GLY 87 HA2 GLY 87 -8.311 -1.227 14.580 654 H LYS 88 HN LYS 88 -5.426 -1.260 13.275 655 HA LYS 88 HA LYS 88 -3.563 -0.834 15.309 656 1HB LYS 88 HB1 LYS 88 -4.819 -2.660 16.436 657 2HB LYS 88 HB2 LYS 88 -4.462 -3.716 15.081 658 1HG LYS 88 HG2 LYS 88 -2.988 -4.142 16.979 659 2HG LYS 88 HG1 LYS 88 -2.088 -3.582 15.564 660 1HD LYS 88 HD2 LYS 88 -2.719 -1.252 16.923 661 2HD LYS 88 HD1 LYS 88 -2.317 -2.399 18.203 662 1HE LYS 88 HE1 LYS 88 -0.288 -2.961 16.648 663 2HE LYS 88 HE2 LYS 88 -0.616 -1.373 15.970 664 1HZ LYS 88 HZ1 LYS 88 0.455 -0.472 17.669 665 2HZ LYS 88 HZ2 LYS 88 0.752 -2.000 18.331 666 3HZ LYS 88 HZ3 LYS 88 -0.646 -1.150 18.761 667 H ILE 89 HN ILE 89 -3.905 -0.606 12.408 668 HA ILE 89 HA ILE 89 -2.175 -2.594 11.261 669 HB ILE 89 HB ILE 89 -3.230 -0.046 10.047 670 1HG1 ILE 89 HG11 ILE 89 -4.089 -2.910 9.573 671 2HG1 ILE 89 HG12 ILE 89 -4.895 -1.842 10.718 672 1HG2 ILE 89 HG21 ILE 89 -1.710 -0.397 8.459 673 2HG2 ILE 89 HG22 ILE 89 -2.584 -1.872 8.045 674 3HG2 ILE 89 HG23 ILE 89 -1.228 -1.936 9.172 675 1HD1 ILE 89 HD11 ILE 89 -6.058 -1.989 8.570 676 2HD1 ILE 89 HD12 ILE 89 -4.634 -1.328 7.767 677 3HD1 ILE 89 HD13 ILE 89 -5.524 -0.349 8.934 678 H THR 90 HN THR 90 -1.721 0.824 10.593 679 HA THR 90 HA THR 90 1.026 0.751 10.432 680 HB THR 90 HB THR 90 -1.017 2.728 10.402 681 HG1 THR 90 HG1 THR 90 0.327 3.605 8.941 682 1HG2 THR 90 HG21 THR 90 -0.481 3.952 12.218 683 2HG2 THR 90 HG22 THR 90 0.718 4.600 11.097 684 3HG2 THR 90 HG23 THR 90 1.181 3.362 12.266 685 H GLY 91 HN GLY 91 -0.958 1.434 13.296 686 1HA GLY 91 HA2 GLY 91 1.084 2.213 15.044 687 2HA GLY 91 HA1 GLY 91 -0.400 1.399 15.527 688 H MET 92 HN MET 92 0.138 -0.904 13.829 689 HA MET 92 HA MET 92 1.853 -2.344 15.670 690 1HB MET 92 HB2 MET 92 0.243 -3.838 15.211 691 2HB MET 92 HB1 MET 92 -0.228 -3.014 13.733 692 1HG MET 92 HG2 MET 92 1.084 -4.309 12.426 693 2HG MET 92 HG1 MET 92 2.289 -4.556 13.685 694 1HE MET 92 HE1 MET 92 -1.630 -5.953 12.841 695 2HE MET 92 HE2 MET 92 -0.709 -7.299 12.166 696 3HE MET 92 HE3 MET 92 -0.339 -5.645 11.677 697 H LEU 93 HN LEU 93 2.022 -0.929 12.552 698 HA LEU 93 HA LEU 93 4.115 -2.391 11.413 699 1HB LEU 93 HB2 LEU 93 2.986 0.321 11.068 700 2HB LEU 93 HB1 LEU 93 4.560 0.016 10.369 701 HG LEU 93 HG LEU 93 2.677 -0.312 8.772 702 1HD1 LEU 93 HD11 LEU 93 4.595 -1.424 8.111 703 2HD1 LEU 93 HD12 LEU 93 3.413 -2.732 8.171 704 3HD1 LEU 93 HD13 LEU 93 4.562 -2.518 9.495 705 1HD2 LEU 93 HD21 LEU 93 1.829 -2.886 9.592 706 2HD2 LEU 93 HD22 LEU 93 0.865 -1.425 9.392 707 3HD2 LEU 93 HD23 LEU 93 1.603 -1.787 10.956 708 H LEU 94 HN LEU 94 4.107 -0.516 14.180 709 HA LEU 94 HA LEU 94 7.003 -0.054 13.994 710 1HB LEU 94 HB1 LEU 94 4.790 1.381 15.308 711 2HB LEU 94 HB2 LEU 94 6.242 1.212 16.276 712 HG LEU 94 HG LEU 94 7.559 2.340 14.572 713 1HD1 LEU 94 HD11 LEU 94 6.841 2.881 12.467 714 2HD1 LEU 94 HD12 LEU 94 5.149 2.990 12.956 715 3HD1 LEU 94 HD13 LEU 94 5.902 1.411 12.738 716 1HD2 LEU 94 HD21 LEU 94 5.893 4.479 14.457 717 2HD2 LEU 94 HD22 LEU 94 6.899 4.063 15.844 718 3HD2 LEU 94 HD23 LEU 94 5.205 3.574 15.805 719 H GLU 95 HN GLU 95 5.568 -2.559 14.435 720 HA GLU 95 HA GLU 95 7.094 -3.539 16.638 721 1HB GLU 95 HB2 GLU 95 5.414 -4.057 18.187 722 2HB GLU 95 HB1 GLU 95 5.025 -2.421 17.677 723 1HG GLU 95 HG1 GLU 95 3.225 -3.148 16.349 724 2HG GLU 95 HG2 GLU 95 3.753 -4.828 16.418 725 H ILE 96 HN ILE 96 5.565 -3.952 13.731 726 HA ILE 96 HA ILE 96 4.630 -6.601 13.836 727 HB ILE 96 HB ILE 96 4.822 -6.703 11.455 728 1HG1 ILE 96 HG12 ILE 96 7.134 -5.798 11.345 729 2HG1 ILE 96 HG11 ILE 96 6.047 -5.180 10.109 730 1HG2 ILE 96 HG21 ILE 96 3.635 -4.429 12.765 731 2HG2 ILE 96 HG22 ILE 96 3.022 -5.421 11.441 732 3HG2 ILE 96 HG23 ILE 96 4.088 -4.058 11.098 733 1HD1 ILE 96 HD11 ILE 96 7.675 -3.709 11.755 734 2HD1 ILE 96 HD12 ILE 96 6.067 -3.511 12.454 735 3HD1 ILE 96 HD13 ILE 96 6.351 -3.102 10.759 736 H ASP 97 HN ASP 97 6.141 -7.631 11.578 737 HA ASP 97 HA ASP 97 8.015 -9.291 12.773 738 1HB ASP 97 HB1 ASP 97 6.815 -9.345 10.446 739 2HB ASP 97 HB2 ASP 97 8.213 -8.423 9.899 740 H ASN 98 HN ASN 98 8.196 -6.020 12.225 741 HA ASN 98 HA ASN 98 9.815 -4.501 12.640 742 1HB ASN 98 HB2 ASN 98 11.586 -5.100 13.859 743 2HB ASN 98 HB1 ASN 98 10.946 -6.734 13.793 744 1HD2 ASN 98 HD22 ASN 98 13.179 -4.478 12.296 745 2HD2 ASN 98 HD21 ASN 98 14.236 -5.673 11.634 746 H SER 99 HN SER 99 10.286 -6.998 10.307 747 HA SER 99 HA SER 99 12.189 -5.624 8.689 748 1HB SER 99 HB1 SER 99 10.232 -7.630 7.594 749 2HB SER 99 HB2 SER 99 11.900 -7.325 7.107 750 HG SER 99 HG SER 99 11.120 -8.408 9.612 751 H GLU 100 HN GLU 100 8.744 -5.564 9.044 752 HA GLU 100 HA GLU 100 8.214 -4.091 6.629 753 1HB GLU 100 HB1 GLU 100 6.536 -4.559 9.084 754 2HB GLU 100 HB2 GLU 100 5.972 -3.770 7.631 755 1HG GLU 100 HG2 GLU 100 5.192 -5.881 7.330 756 2HG GLU 100 HG1 GLU 100 6.725 -5.949 6.460 757 H LEU 101 HN LEU 101 8.848 -3.411 9.998 758 HA LEU 101 HA LEU 101 8.187 -0.662 9.966 759 1HB LEU 101 HB1 LEU 101 8.380 -1.609 12.096 760 2HB LEU 101 HB2 LEU 101 9.896 -2.401 11.712 761 HG LEU 101 HG LEU 101 10.615 0.216 11.492 762 1HD1 LEU 101 HD11 LEU 101 8.132 0.193 12.912 763 2HD1 LEU 101 HD12 LEU 101 9.155 1.562 12.474 764 3HD1 LEU 101 HD13 LEU 101 9.431 0.705 13.991 765 1HD2 LEU 101 HD21 LEU 101 11.440 -0.105 13.894 766 2HD2 LEU 101 HD22 LEU 101 11.978 -1.262 12.677 767 3HD2 LEU 101 HD23 LEU 101 10.689 -1.698 13.799 768 H LEU 102 HN LEU 102 10.981 -2.496 8.997 769 HA LEU 102 HA LEU 102 12.687 -0.188 8.711 770 1HB LEU 102 HB2 LEU 102 12.931 -3.105 8.417 771 2HB LEU 102 HB1 LEU 102 13.898 -2.177 7.286 772 HG LEU 102 HG LEU 102 14.847 -0.938 9.277 773 1HD1 LEU 102 HD21 LEU 102 13.092 -1.466 10.880 774 2HD1 LEU 102 HD22 LEU 102 14.660 -2.031 11.457 775 3HD1 LEU 102 HD23 LEU 102 13.502 -3.178 10.782 776 1HD2 LEU 102 HD11 LEU 102 15.767 -3.546 9.939 777 2HD2 LEU 102 HD12 LEU 102 16.556 -2.309 8.960 778 3HD2 LEU 102 HD13 LEU 102 15.472 -3.477 8.202 779 H HIS 103 HN HIS 103 11.036 -2.436 6.510 780 HA HIS 103 HA HIS 103 11.948 -1.258 4.129 781 1HB HIS 103 HB1 HIS 103 10.455 -3.484 4.861 782 2HB HIS 103 HB2 HIS 103 9.322 -2.509 3.938 783 HD2 HIS 103 HD2 HIS 103 13.055 -2.552 2.858 784 HE1 HIS 103 HE1 HIS 103 10.795 -4.818 0.088 785 HE2 HIS 103 HE2 HIS 103 13.069 -3.815 0.591 786 H MET 104 HN MET 104 9.006 -0.752 6.032 787 HA MET 104 HA MET 104 7.607 0.882 4.290 788 1HB MET 104 HB2 MET 104 6.376 1.653 6.227 789 2HB MET 104 HB1 MET 104 6.703 -0.067 6.404 790 1HG MET 104 HG1 MET 104 7.998 0.234 8.208 791 2HG MET 104 HG2 MET 104 8.721 1.704 7.563 792 1HE MET 104 HE1 MET 104 5.277 0.364 8.363 793 2HE MET 104 HE2 MET 104 4.721 1.869 7.629 794 3HE MET 104 HE3 MET 104 4.509 1.602 9.362 795 H LEU 105 HN LEU 105 10.249 1.681 6.469 796 HA LEU 105 HA LEU 105 9.956 4.529 5.997 797 1HB LEU 105 HB1 LEU 105 12.308 3.223 7.334 798 2HB LEU 105 HB2 LEU 105 11.688 4.846 7.561 799 HG LEU 105 HG LEU 105 10.238 2.353 8.442 800 1HD1 LEU 105 HD11 LEU 105 11.765 2.248 10.065 801 2HD1 LEU 105 HD12 LEU 105 11.021 3.717 10.696 802 3HD1 LEU 105 HD13 LEU 105 12.439 3.825 9.651 803 1HD2 LEU 105 HD21 LEU 105 9.061 4.089 9.882 804 2HD2 LEU 105 HD22 LEU 105 8.666 4.062 8.162 805 3HD2 LEU 105 HD23 LEU 105 9.760 5.292 8.797 806 H GLU 106 HN GLU 106 11.403 1.918 4.445 807 HA GLU 106 HA GLU 106 13.419 3.659 3.218 808 1HB GLU 106 HB1 GLU 106 14.835 1.898 3.109 809 2HB GLU 106 HB2 GLU 106 13.798 1.253 4.373 810 1HG GLU 106 HG2 GLU 106 12.562 -0.040 2.753 811 2HG GLU 106 HG1 GLU 106 13.506 0.661 1.439 812 H SER 107 HN SER 107 10.380 2.469 2.532 813 HA SER 107 HA SER 107 10.847 2.936 -0.322 814 1HB SER 107 HB2 SER 107 10.807 0.393 0.464 815 2HB SER 107 HB1 SER 107 9.066 0.650 0.356 816 HG SER 107 HG SER 107 9.239 1.043 -1.781 817 HA PRO 108 HA PRO 108 7.093 5.269 0.191 818 1HB PRO 108 HB2 PRO 108 6.962 5.358 -2.732 819 2HB PRO 108 HB1 PRO 108 7.222 6.675 -1.586 820 1HG PRO 108 HG1 PRO 108 9.178 5.779 -3.214 821 2HG PRO 108 HG2 PRO 108 9.508 6.403 -1.586 822 1HD PRO 108 HD2 PRO 108 9.327 3.562 -2.528 823 2HD PRO 108 HD1 PRO 108 10.497 4.307 -1.417 824 H GLU 109 HN GLU 109 7.363 2.202 -0.976 825 HA GLU 109 HA GLU 109 4.449 1.965 -1.365 826 1HB GLU 109 HB2 GLU 109 6.628 0.419 -2.790 827 2HB GLU 109 HB1 GLU 109 4.905 0.096 -2.932 828 1HG GLU 109 HG1 GLU 109 4.538 2.239 -3.959 829 2HG GLU 109 HG2 GLU 109 6.223 2.689 -3.701 830 H SER 110 HN SER 110 7.171 1.090 0.406 831 HA SER 110 HA SER 110 6.242 -1.510 1.215 832 1HB SER 110 HB1 SER 110 8.592 0.156 1.737 833 2HB SER 110 HB2 SER 110 8.033 -0.739 3.152 834 HG SER 110 HG SER 110 9.462 -1.652 1.150 835 H LEU 111 HN LEU 111 6.345 1.724 2.556 836 HA LEU 111 HA LEU 111 5.216 1.343 5.037 837 1HB LEU 111 HB1 LEU 111 6.063 3.458 3.901 838 2HB LEU 111 HB2 LEU 111 4.500 3.558 3.111 839 HG LEU 111 HG LEU 111 4.361 5.060 4.885 840 1HD1 LEU 111 HD21 LEU 111 3.195 2.825 6.424 841 2HD1 LEU 111 HD22 LEU 111 2.590 3.078 4.786 842 3HD1 LEU 111 HD23 LEU 111 2.502 4.381 5.968 843 1HD2 LEU 111 HD11 LEU 111 5.464 3.000 6.770 844 2HD2 LEU 111 HD12 LEU 111 5.135 4.700 7.102 845 3HD2 LEU 111 HD13 LEU 111 6.431 4.255 5.990 846 H ARG 112 HN ARG 112 3.674 1.576 1.864 847 HA ARG 112 HA ARG 112 1.038 1.235 2.932 848 1HB ARG 112 HB2 ARG 112 0.814 2.426 1.029 849 2HB ARG 112 HB1 ARG 112 2.257 1.734 0.297 850 1HG ARG 112 HG1 ARG 112 1.092 -0.136 -0.484 851 2HG ARG 112 HG2 ARG 112 -0.298 0.185 0.556 852 1HD ARG 112 HD1 ARG 112 0.469 1.416 -2.026 853 2HD ARG 112 HD2 ARG 112 -1.124 0.988 -1.403 854 HE ARG 112 HE ARG 112 -0.928 3.001 0.031 855 1HH1 ARG 112 HH12 ARG 112 0.971 2.747 -2.879 856 2HH1 ARG 112 HH11 ARG 112 1.130 4.460 -3.079 857 1HH2 ARG 112 HH22 ARG 112 -0.723 5.258 -0.225 858 2HH2 ARG 112 HH21 ARG 112 0.167 5.887 -1.570 859 H SER 113 HN SER 113 2.956 -0.756 0.667 860 HA SER 113 HA SER 113 1.345 -2.966 0.561 861 1HB SER 113 HB1 SER 113 4.115 -2.380 -0.032 862 2HB SER 113 HB2 SER 113 3.948 -4.017 0.602 863 HG SER 113 HG SER 113 3.465 -3.247 -1.830 864 H LYS 114 HN LYS 114 4.031 -2.480 2.849 865 HA LYS 114 HA LYS 114 3.632 -4.831 4.308 866 1HB LYS 114 HB1 LYS 114 4.772 -2.215 5.307 867 2HB LYS 114 HB2 LYS 114 4.984 -3.788 6.061 868 1HG LYS 114 HG1 LYS 114 5.986 -2.993 3.335 869 2HG LYS 114 HG2 LYS 114 6.959 -3.128 4.802 870 1HD LYS 114 HD2 LYS 114 6.229 -5.539 4.925 871 2HD LYS 114 HD1 LYS 114 5.552 -5.333 3.308 872 1HE LYS 114 HE1 LYS 114 7.704 -4.838 2.395 873 2HE LYS 114 HE2 LYS 114 8.429 -4.773 4.001 874 1HZ LYS 114 HZ1 LYS 114 8.492 -6.924 2.431 875 2HZ LYS 114 HZ2 LYS 114 7.098 -7.261 3.329 876 3HZ LYS 114 HZ3 LYS 114 8.570 -6.999 4.120 877 H VAL 115 HN VAL 115 2.019 -1.722 4.465 878 HA VAL 115 HA VAL 115 0.801 -2.183 7.013 879 HB VAL 115 HB VAL 115 0.606 -0.117 4.921 880 1HG1 VAL 115 HG11 VAL 115 -1.685 -0.291 6.846 881 2HG1 VAL 115 HG12 VAL 115 -1.783 -1.037 5.253 882 3HG1 VAL 115 HG13 VAL 115 -1.527 0.701 5.398 883 1HG2 VAL 115 HG21 VAL 115 1.750 -0.190 7.293 884 2HG2 VAL 115 HG22 VAL 115 0.152 0.333 7.824 885 3HG2 VAL 115 HG23 VAL 115 1.053 1.301 6.658 886 H ASP 116 HN ASP 116 -0.497 -2.267 3.678 887 HA ASP 116 HA ASP 116 -3.000 -3.296 4.258 888 1HB ASP 116 HB1 ASP 116 -2.846 -2.671 2.051 889 2HB ASP 116 HB2 ASP 116 -1.226 -3.335 1.865 890 H GLU 117 HN GLU 117 0.088 -4.933 3.972 891 HA GLU 117 HA GLU 117 -1.016 -7.584 4.077 892 1HB GLU 117 HB2 GLU 117 1.046 -7.936 3.246 893 2HB GLU 117 HB1 GLU 117 1.602 -6.358 3.785 894 1HG GLU 117 HG1 GLU 117 2.257 -7.181 5.879 895 2HG GLU 117 HG2 GLU 117 1.387 -8.697 5.646 896 H ALA 118 HN ALA 118 0.349 -5.255 6.327 897 HA ALA 118 HA ALA 118 0.406 -6.908 8.606 898 1HB ALA 118 HB1 ALA 118 -0.140 -4.305 9.484 899 2HB ALA 118 HB2 ALA 118 0.844 -4.137 8.030 900 3HB ALA 118 HB3 ALA 118 1.429 -5.106 9.386 901 H VAL 119 HN VAL 119 -2.160 -5.405 6.887 902 HA VAL 119 HA VAL 119 -4.085 -5.341 8.987 903 HB VAL 119 HB VAL 119 -4.671 -5.647 6.060 904 1HG1 VAL 119 HG11 VAL 119 -6.223 -4.496 8.374 905 2HG1 VAL 119 HG12 VAL 119 -6.549 -6.018 7.543 906 3HG1 VAL 119 HG13 VAL 119 -6.747 -4.483 6.692 907 1HG2 VAL 119 HG21 VAL 119 -3.890 -3.234 7.655 908 2HG2 VAL 119 HG22 VAL 119 -4.887 -3.095 6.207 909 3HG2 VAL 119 HG23 VAL 119 -3.266 -3.784 6.100 910 H ALA 120 HN ALA 120 -3.347 -7.585 6.363 911 HA ALA 120 HA ALA 120 -5.256 -9.550 7.008 912 1HB ALA 120 HB1 ALA 120 -3.252 -9.195 5.090 913 2HB ALA 120 HB2 ALA 120 -4.388 -10.544 5.199 914 3HB ALA 120 HB3 ALA 120 -2.801 -10.665 5.959 915 H VAL 121 HN VAL 121 -2.194 -8.666 8.311 916 HA VAL 121 HA VAL 121 -1.825 -11.066 9.873 917 HB VAL 121 HB VAL 121 -0.337 -8.477 9.568 918 1HG1 VAL 121 HG21 VAL 121 -0.391 -10.110 11.939 919 2HG1 VAL 121 HG22 VAL 121 0.415 -8.565 11.646 920 3HG1 VAL 121 HG23 VAL 121 1.222 -10.076 11.221 921 1HG2 VAL 121 HG11 VAL 121 -0.159 -10.580 8.049 922 2HG2 VAL 121 HG12 VAL 121 0.815 -11.225 9.371 923 3HG2 VAL 121 HG13 VAL 121 1.308 -9.740 8.557 924 H LEU 122 HN LEU 122 -3.109 -7.850 10.254 925 HA LEU 122 HA LEU 122 -3.253 -7.928 13.119 926 1HB LEU 122 HB2 LEU 122 -3.462 -5.743 12.774 927 2HB LEU 122 HB1 LEU 122 -3.661 -6.002 11.054 928 HG LEU 122 HG LEU 122 -6.167 -6.591 12.000 929 1HD1 LEU 122 HD11 LEU 122 -5.487 -5.840 14.257 930 2HD1 LEU 122 HD12 LEU 122 -6.794 -4.876 13.568 931 3HD1 LEU 122 HD13 LEU 122 -5.147 -4.243 13.589 932 1HD2 LEU 122 HD21 LEU 122 -5.861 -3.768 11.435 933 2HD2 LEU 122 HD22 LEU 122 -6.701 -5.020 10.520 934 3HD2 LEU 122 HD23 LEU 122 -4.969 -4.775 10.295 935 H GLN 123 HN GLN 123 -5.298 -8.718 10.419 936 HA GLN 123 HA GLN 123 -7.720 -9.043 11.858 937 1HB GLN 123 HB1 GLN 123 -6.716 -9.952 9.175 938 2HB GLN 123 HB2 GLN 123 -8.251 -10.547 9.793 939 1HG GLN 123 HG2 GLN 123 -8.337 -7.782 10.138 940 2HG GLN 123 HG1 GLN 123 -7.614 -8.034 8.551 941 1HE2 GLN 123 HE21 GLN 123 -10.365 -7.209 9.723 942 2HE2 GLN 123 HE22 GLN 123 -11.477 -8.098 8.744 943 H ALA 124 HN ALA 124 -4.976 -11.064 11.146 944 HA ALA 124 HA ALA 124 -6.156 -13.491 12.160 945 1HB ALA 124 HB1 ALA 124 -4.436 -13.633 10.465 946 2HB ALA 124 HB2 ALA 124 -3.869 -14.394 11.952 947 3HB ALA 124 HB3 ALA 124 -3.296 -12.784 11.511 948 H HIS 125 HN HIS 125 -3.165 -11.955 13.232 949 HA HIS 125 HA HIS 125 -2.719 -12.944 15.609 950 1HB HIS 125 HB1 HIS 125 -2.021 -10.542 14.387 951 2HB HIS 125 HB2 HIS 125 -2.660 -10.055 15.954 952 HD2 HIS 125 HD2 HIS 125 0.613 -10.889 14.531 953 HE1 HIS 125 HE1 HIS 125 0.789 -12.276 18.528 954 HE2 HIS 125 HE2 HIS 125 2.144 -11.716 16.458 955 H GLN 126 HN GLN 126 -5.318 -10.607 15.085 956 HA GLN 126 HA GLN 126 -6.052 -10.324 17.793 957 1HB GLN 126 HB1 GLN 126 -7.466 -9.851 15.187 958 2HB GLN 126 HB2 GLN 126 -8.328 -9.688 16.711 959 1HG GLN 126 HG2 GLN 126 -5.840 -8.177 15.948 960 2HG GLN 126 HG1 GLN 126 -7.485 -7.547 15.876 961 1HE2 GLN 126 HE22 GLN 126 -8.683 -8.005 18.068 962 2HE2 GLN 126 HE21 GLN 126 -7.818 -7.482 19.469 963 H ALA 127 HN ALA 127 -8.221 -11.821 15.416 964 HA ALA 127 HA ALA 127 -9.112 -13.663 17.494 965 1HB ALA 127 HB1 ALA 127 -10.477 -13.625 14.879 966 2HB ALA 127 HB2 ALA 127 -10.537 -12.138 15.825 967 3HB ALA 127 HB3 ALA 127 -11.142 -13.646 16.512 968 H LYS 128 HN LYS 128 -6.557 -14.214 16.083 969 HA LYS 128 HA LYS 128 -7.265 -16.596 14.526 970 1HB LYS 128 HB2 LYS 128 -4.956 -16.707 13.842 971 2HB LYS 128 HB1 LYS 128 -5.532 -15.061 13.605 972 1HG LYS 128 HG1 LYS 128 -4.271 -14.252 15.388 973 2HG LYS 128 HG2 LYS 128 -4.064 -15.857 16.089 974 1HD LYS 128 HD1 LYS 128 -2.960 -15.254 13.377 975 2HD LYS 128 HD2 LYS 128 -2.085 -14.743 14.822 976 1HE LYS 128 HE1 LYS 128 -1.371 -16.812 15.230 977 2HE LYS 128 HE2 LYS 128 -2.987 -17.486 15.024 978 1HZ LYS 128 HZ1 LYS 128 -2.357 -16.987 12.499 979 2HZ LYS 128 HZ2 LYS 128 -2.009 -18.458 13.260 980 3HZ LYS 128 HZ3 LYS 128 -0.807 -17.277 13.111 981 H GLU 129 HN GLU 129 -4.822 -17.959 15.050 982 HA GLU 129 HA GLU 129 -5.528 -19.216 17.591 983 1HB GLU 129 HB2 GLU 129 -3.922 -20.004 15.203 984 2HB GLU 129 HB1 GLU 129 -3.489 -20.716 16.751 985 1HG GLU 129 HG2 GLU 129 -4.987 -22.272 16.169 986 2HG GLU 129 HG1 GLU 129 -6.153 -21.098 16.780 987 H ALA 130 HN ALA 130 -4.195 -16.548 17.189 988 HA ALA 130 HA ALA 130 -1.501 -16.645 17.886 989 1HB ALA 130 HB1 ALA 130 -2.889 -14.345 18.996 990 2HB ALA 130 HB2 ALA 130 -3.328 -14.664 17.317 991 3HB ALA 130 HB3 ALA 130 -1.636 -14.424 17.757 992 H ALA 131 HN ALA 131 -4.400 -16.818 19.833 993 HA ALA 131 HA ALA 131 -3.301 -16.290 22.355 994 1HB ALA 131 HB1 ALA 131 -5.290 -17.140 23.268 995 2HB ALA 131 HB2 ALA 131 -5.562 -18.210 21.892 996 3HB ALA 131 HB3 ALA 131 -5.753 -16.467 21.704 997 H GLN 132 HN GLN 132 -1.448 -17.301 22.904 998 HA GLN 132 HA GLN 132 -1.282 -20.213 22.644 999 1HB GLN 132 HB1 GLN 132 1.131 -19.511 23.646 1000 2HB GLN 132 HB2 GLN 132 0.765 -19.561 21.929 1001 1HG GLN 132 HG2 GLN 132 0.975 -17.355 21.699 1002 2HG GLN 132 HG1 GLN 132 0.081 -17.022 23.182 1003 1HE2 GLN 132 HE21 GLN 132 1.432 -17.886 25.183 1004 2HE2 GLN 132 HE22 GLN 132 3.051 -17.285 25.234 1005 H LYS 133 HN LYS 133 -3.047 -19.067 24.572 1006 HA LYS 133 HA LYS 133 -1.958 -18.979 27.162 1007 1HB LYS 133 HB1 LYS 133 -4.763 -19.819 26.414 1008 2HB LYS 133 HB2 LYS 133 -4.233 -19.149 27.951 1009 1HG LYS 133 HG1 LYS 133 -3.502 -17.307 25.936 1010 2HG LYS 133 HG2 LYS 133 -5.173 -17.791 25.636 1011 1HD LYS 133 HD2 LYS 133 -4.203 -16.957 28.358 1012 2HD LYS 133 HD1 LYS 133 -4.812 -15.796 27.176 1013 1HE LYS 133 HE2 LYS 133 -6.559 -18.102 27.519 1014 2HE LYS 133 HE1 LYS 133 -6.326 -17.185 29.007 1015 1HZ LYS 133 HZ1 LYS 133 -6.903 -15.162 27.681 1016 2HZ LYS 133 HZ2 LYS 133 -8.174 -16.256 27.900 1017 3HZ LYS 133 HZ3 LYS 133 -7.364 -16.188 26.417 1018 H ALA 134 HN ALA 134 -2.763 -20.585 28.905 1019 HA ALA 134 HA ALA 134 -1.714 -23.187 28.175 1020 1HB ALA 134 HB1 ALA 134 -1.199 -23.441 30.351 1021 2HB ALA 134 HB2 ALA 134 -2.744 -22.793 30.903 1022 3HB ALA 134 HB3 ALA 134 -1.452 -21.698 30.414 1023 H VAL 135 HN VAL 135 -3.053 -24.871 29.895 1024 HA VAL 135 HA VAL 135 -5.424 -25.428 28.388 1025 HB VAL 135 HB VAL 135 -5.702 -27.333 29.984 1026 1HG1 VAL 135 HG21 VAL 135 -2.937 -27.737 29.238 1027 2HG1 VAL 135 HG22 VAL 135 -3.859 -26.975 27.941 1028 3HG1 VAL 135 HG23 VAL 135 -4.396 -28.511 28.620 1029 1HG2 VAL 135 HG11 VAL 135 -3.945 -25.786 31.562 1030 2HG2 VAL 135 HG12 VAL 135 -3.095 -27.271 31.138 1031 3HG2 VAL 135 HG13 VAL 135 -4.662 -27.352 31.944 1032 H ASN 136 HN ASN 136 -7.559 -25.685 29.263 1033 HA ASN 136 HA ASN 136 -8.234 -23.559 31.105 1034 1HB ASN 136 HB2 ASN 136 -9.691 -25.251 29.160 1035 2HB ASN 136 HB1 ASN 136 -10.615 -24.720 30.561 1036 1HD2 ASN 136 HD21 ASN 136 -9.827 -23.968 27.483 1037 2HD2 ASN 136 HD22 ASN 136 -10.087 -22.261 27.518 1038 H SER 137 HN SER 137 -10.469 -26.087 31.333 1039 HA SER 137 HA SER 137 -9.524 -26.691 34.047 1040 1HB SER 137 HB1 SER 137 -12.207 -27.636 33.385 1041 2HB SER 137 HB2 SER 137 -11.672 -26.618 34.722 1042 HG SER 137 HG SER 137 -13.144 -25.700 33.019 1043 H ALA 138 HN ALA 138 -8.449 -28.532 34.242 1044 HA ALA 138 HA ALA 138 -8.629 -30.630 32.298 1045 1HB ALA 138 HB1 ALA 138 -7.010 -31.797 33.732 1046 2HB ALA 138 HB2 ALA 138 -7.201 -30.538 34.952 1047 3HB ALA 138 HB3 ALA 138 -6.513 -30.142 33.376 1048 H THR 139 HN THR 139 -9.317 -32.782 32.654 1049 HA THR 139 HA THR 139 -11.602 -32.966 34.439 1050 HB THR 139 HB THR 139 -11.920 -33.744 32.170 1051 HG1 THR 139 HG1 THR 139 -12.918 -34.943 33.893 1052 1HG2 THR 139 HG21 THR 139 -9.949 -35.951 32.580 1053 2HG2 THR 139 HG22 THR 139 -9.468 -34.412 31.866 1054 3HG2 THR 139 HG23 THR 139 -10.710 -35.395 31.089 1055 H GLY 140 HN GLY 140 -11.883 -34.580 36.008 1056 1HA GLY 140 HA1 GLY 140 -9.343 -35.629 37.062 1057 2HA GLY 140 HA2 GLY 140 -10.797 -35.345 38.007 1058 H VAL 141 HN VAL 141 -10.766 -37.443 38.851 1059 HA VAL 141 HA VAL 141 -10.886 -39.712 37.057 1060 HB VAL 141 HB VAL 141 -11.205 -41.030 39.169 1061 1HG1 VAL 141 HG11 VAL 141 -8.961 -41.105 39.549 1062 2HG1 VAL 141 HG12 VAL 141 -8.799 -39.349 39.607 1063 3HG1 VAL 141 HG13 VAL 141 -8.956 -40.169 38.054 1064 1HG2 VAL 141 HG21 VAL 141 -10.375 -38.727 40.811 1065 2HG2 VAL 141 HG22 VAL 141 -11.427 -40.085 41.207 1066 3HG2 VAL 141 HG23 VAL 141 -12.054 -38.726 40.275 1067 HA PRO 142 HA PRO 142 -11.647 -41.752 37.097 1068 1HB PRO 142 HB1 PRO 142 -13.172 -43.198 35.437 1069 2HB PRO 142 HB2 PRO 142 -13.379 -43.288 37.191 1070 1HG PRO 142 HG2 PRO 142 -14.982 -41.775 35.166 1071 2HG PRO 142 HG1 PRO 142 -15.543 -42.714 36.561 1072 1HD PRO 142 HD2 PRO 142 -15.284 -39.976 36.541 1073 2HD PRO 142 HD1 PRO 142 -15.225 -40.972 38.007 1074 H THR 143 HN THR 143 -11.000 -42.649 34.837 1075 HA THR 143 HA THR 143 -10.858 -40.356 33.002 1076 HB THR 143 HB THR 143 -8.957 -42.002 32.055 1077 HG1 THR 143 HG1 THR 143 -7.924 -42.947 33.897 1078 1HG2 THR 143 HG21 THR 143 -7.800 -40.197 32.574 1079 2HG2 THR 143 HG22 THR 143 -7.632 -40.844 34.206 1080 3HG2 THR 143 HG23 THR 143 -8.957 -39.745 33.825 1081 H VAL 144 HN VAL 144 -12.891 -42.685 33.310 1082 HA VAL 144 HA VAL 144 -12.739 -43.773 30.593 1083 HB VAL 144 HB VAL 144 -14.685 -45.202 31.374 1084 1HG1 VAL 144 HG21 VAL 144 -12.091 -45.489 32.886 1085 2HG1 VAL 144 HG22 VAL 144 -12.359 -46.002 31.221 1086 3HG1 VAL 144 HG23 VAL 144 -13.250 -46.771 32.534 1087 1HG2 VAL 144 HG11 VAL 144 -15.482 -43.940 33.232 1088 2HG2 VAL 144 HG12 VAL 144 -13.899 -43.970 34.008 1089 3HG2 VAL 144 HG13 VAL 144 -14.838 -45.456 33.863 Start of MODEL 26 1 1H GLY 1 HT1 GLY 1 -36.798 50.585 -37.541 2 2H GLY 1 HT2 GLY 1 -36.009 49.295 -38.300 3 3H GLY 1 HT3 GLY 1 -36.339 49.228 -36.642 4 1HA GLY 1 HA1 GLY 1 -38.728 49.239 -37.109 5 2HA GLY 1 HA2 GLY 1 -38.351 49.235 -38.825 6 HA PRO 2 HA PRO 2 -38.339 44.837 -38.946 7 1HB PRO 2 HB1 PRO 2 -35.732 44.891 -40.351 8 2HB PRO 2 HB2 PRO 2 -37.279 44.221 -40.875 9 1HG PRO 2 HG2 PRO 2 -36.326 46.479 -41.937 10 2HG PRO 2 HG1 PRO 2 -38.060 46.269 -41.628 11 1HD PRO 2 HD2 PRO 2 -36.026 47.810 -40.063 12 2HD PRO 2 HD1 PRO 2 -37.708 48.229 -40.445 13 H LEU 3 HN LEU 3 -37.277 42.927 -38.168 14 HA LEU 3 HA LEU 3 -35.457 43.501 -35.967 15 1HB LEU 3 HB2 LEU 3 -36.707 40.851 -36.670 16 2HB LEU 3 HB1 LEU 3 -36.005 41.328 -35.136 17 HG LEU 3 HG LEU 3 -38.199 43.072 -35.917 18 1HD1 LEU 3 HD11 LEU 3 -39.953 41.348 -35.439 19 2HD1 LEU 3 HD12 LEU 3 -38.710 40.116 -35.659 20 3HD1 LEU 3 HD13 LEU 3 -39.148 41.177 -36.998 21 1HD2 LEU 3 HD21 LEU 3 -38.652 41.558 -33.543 22 2HD2 LEU 3 HD22 LEU 3 -38.247 43.265 -33.710 23 3HD2 LEU 3 HD23 LEU 3 -36.963 42.062 -33.594 24 H GLY 4 HN GLY 4 -33.355 43.491 -36.419 25 1HA GLY 4 HA2 GLY 4 -32.288 41.957 -38.620 26 2HA GLY 4 HA1 GLY 4 -31.383 43.010 -37.543 27 H SER 5 HN SER 5 -29.779 41.279 -37.627 28 HA SER 5 HA SER 5 -30.463 38.845 -36.176 29 1HB SER 5 HB2 SER 5 -27.724 38.800 -36.732 30 2HB SER 5 HB1 SER 5 -28.997 38.004 -37.658 31 HG SER 5 HG SER 5 -27.947 40.605 -38.086 32 H ALA 6 HN ALA 6 -30.225 41.604 -34.953 33 HA ALA 6 HA ALA 6 -29.477 42.553 -33.025 34 1HB ALA 6 HB1 ALA 6 -29.631 41.216 -31.224 35 2HB ALA 6 HB2 ALA 6 -28.478 40.044 -31.863 36 3HB ALA 6 HB3 ALA 6 -30.158 40.013 -32.403 37 H ALA 7 HN ALA 7 -27.348 41.784 -31.305 38 HA ALA 7 HA ALA 7 -24.950 41.577 -32.906 39 1HB ALA 7 HB1 ALA 7 -25.123 44.043 -31.235 40 2HB ALA 7 HB2 ALA 7 -25.792 44.042 -32.867 41 3HB ALA 7 HB3 ALA 7 -24.082 43.690 -32.615 42 H ALA 8 HN ALA 8 -26.644 41.015 -30.144 43 HA ALA 8 HA ALA 8 -24.245 40.118 -28.749 44 1HB ALA 8 HB1 ALA 8 -24.585 42.320 -27.820 45 2HB ALA 8 HB2 ALA 8 -24.993 41.101 -26.614 46 3HB ALA 8 HB3 ALA 8 -26.275 41.948 -27.479 47 H ALA 9 HN ALA 9 -27.765 40.451 -28.250 48 HA ALA 9 HA ALA 9 -29.370 38.963 -27.632 49 1HB ALA 9 HB1 ALA 9 -29.043 36.585 -28.373 50 2HB ALA 9 HB2 ALA 9 -27.453 37.066 -28.966 51 3HB ALA 9 HB3 ALA 9 -28.907 37.798 -29.646 52 H THR 10 HN THR 10 -29.453 36.521 -26.530 53 HA THR 10 HA THR 10 -28.096 36.951 -23.986 54 HB THR 10 HB THR 10 -29.937 34.653 -24.318 55 HG1 THR 10 HG1 THR 10 -31.208 37.094 -24.026 56 1HG2 THR 10 HG21 THR 10 -30.248 36.826 -22.312 57 2HG2 THR 10 HG22 THR 10 -28.940 35.657 -22.138 58 3HG2 THR 10 HG23 THR 10 -30.615 35.107 -22.182 59 HA PRO 11 HA PRO 11 -24.915 33.967 -24.800 60 1HB PRO 11 HB1 PRO 11 -24.993 33.509 -21.873 61 2HB PRO 11 HB2 PRO 11 -23.639 33.985 -22.903 62 1HG PRO 11 HG1 PRO 11 -24.806 35.745 -21.271 63 2HG PRO 11 HG2 PRO 11 -24.239 36.222 -22.882 64 1HD PRO 11 HD2 PRO 11 -27.022 35.654 -21.942 65 2HD PRO 11 HD1 PRO 11 -26.442 36.907 -23.059 66 H ALA 12 HN ALA 12 -25.962 32.287 -25.824 67 HA ALA 12 HA ALA 12 -27.645 30.461 -24.343 68 1HB ALA 12 HB1 ALA 12 -27.298 31.149 -27.067 69 2HB ALA 12 HB2 ALA 12 -28.513 30.092 -26.348 70 3HB ALA 12 HB3 ALA 12 -26.979 29.422 -26.904 71 H VAL 13 HN VAL 13 -24.487 30.858 -24.229 72 HA VAL 13 HA VAL 13 -23.662 28.089 -24.586 73 HB VAL 13 HB VAL 13 -22.138 29.826 -25.354 74 1HG1 VAL 13 HG11 VAL 13 -21.631 30.676 -22.531 75 2HG1 VAL 13 HG12 VAL 13 -22.917 31.426 -23.475 76 3HG1 VAL 13 HG13 VAL 13 -21.248 31.510 -24.036 77 1HG2 VAL 13 HG21 VAL 13 -20.958 28.498 -22.923 78 2HG2 VAL 13 HG22 VAL 13 -20.123 28.990 -24.396 79 3HG2 VAL 13 HG23 VAL 13 -21.280 27.659 -24.441 80 H ARG 14 HN ARG 14 -23.113 26.699 -22.963 81 HA ARG 14 HA ARG 14 -24.163 27.285 -20.343 82 1HB ARG 14 HB2 ARG 14 -23.239 24.904 -19.892 83 2HB ARG 14 HB1 ARG 14 -24.613 25.090 -20.973 84 1HG ARG 14 HG1 ARG 14 -21.984 25.173 -22.279 85 2HG ARG 14 HG2 ARG 14 -22.411 23.632 -21.533 86 1HD ARG 14 HD2 ARG 14 -24.717 24.481 -22.864 87 2HD ARG 14 HD1 ARG 14 -23.386 24.824 -23.968 88 HE ARG 14 HE ARG 14 -24.322 22.222 -23.114 89 1HH1 ARG 14 HH11 ARG 14 -21.762 24.059 -24.604 90 2HH1 ARG 14 HH12 ARG 14 -21.083 22.692 -25.422 91 1HH2 ARG 14 HH21 ARG 14 -23.434 20.417 -24.188 92 2HH2 ARG 14 HH22 ARG 14 -22.034 20.621 -25.186 93 H THR 15 HN THR 15 -22.965 28.606 -19.116 94 HA THR 15 HA THR 15 -20.066 28.154 -18.977 95 HB THR 15 HB THR 15 -20.173 30.423 -17.730 96 HG1 THR 15 HG1 THR 15 -22.594 30.657 -19.161 97 1HG2 THR 15 HG21 THR 15 -20.590 31.651 -19.984 98 2HG2 THR 15 HG22 THR 15 -20.567 30.018 -20.648 99 3HG2 THR 15 HG23 THR 15 -19.166 30.633 -19.769 100 H VAL 16 HN VAL 16 -19.879 26.506 -17.516 101 HA VAL 16 HA VAL 16 -20.970 27.003 -14.825 102 HB VAL 16 HB VAL 16 -21.969 25.010 -15.622 103 1HG1 VAL 16 HG21 VAL 16 -19.283 24.482 -16.759 104 2HG1 VAL 16 HG22 VAL 16 -20.884 24.215 -17.452 105 3HG1 VAL 16 HG23 VAL 16 -20.242 23.090 -16.255 106 1HG2 VAL 16 HG11 VAL 16 -19.638 24.068 -13.965 107 2HG2 VAL 16 HG12 VAL 16 -21.263 23.385 -14.036 108 3HG2 VAL 16 HG13 VAL 16 -21.003 24.970 -13.307 109 HA PRO 17 HA PRO 17 -16.589 27.699 -13.953 110 1HB PRO 17 HB2 PRO 17 -17.674 27.881 -11.197 111 2HB PRO 17 HB1 PRO 17 -16.651 29.018 -12.082 112 1HG PRO 17 HG1 PRO 17 -19.231 29.543 -11.670 113 2HG PRO 17 HG2 PRO 17 -18.447 29.963 -13.205 114 1HD PRO 17 HD2 PRO 17 -20.266 27.672 -12.570 115 2HD PRO 17 HD1 PRO 17 -20.196 28.686 -14.026 116 H GLN 18 HN GLN 18 -15.665 25.702 -14.227 117 HA GLN 18 HA GLN 18 -16.151 23.637 -12.213 118 1HB GLN 18 HB2 GLN 18 -14.707 23.580 -14.866 119 2HB GLN 18 HB1 GLN 18 -14.754 22.215 -13.759 120 1HG GLN 18 HG1 GLN 18 -17.404 23.221 -14.254 121 2HG GLN 18 HG2 GLN 18 -16.582 22.833 -15.764 122 1HE2 GLN 18 HE21 GLN 18 -18.084 21.611 -12.949 123 2HE2 GLN 18 HE22 GLN 18 -17.906 19.930 -13.305 124 H TYR 19 HN TYR 19 -14.978 25.360 -10.798 125 HA TYR 19 HA TYR 19 -12.159 25.601 -11.028 126 1HB TYR 19 HB1 TYR 19 -14.207 26.273 -8.968 127 2HB TYR 19 HB2 TYR 19 -12.525 26.194 -8.454 128 HD1 TYR 19 HD1 TYR 19 -11.383 28.192 -8.447 129 HD2 TYR 19 HD2 TYR 19 -14.476 27.621 -11.312 130 HE1 TYR 19 HE1 TYR 19 -11.013 30.471 -9.292 131 HE2 TYR 19 HE2 TYR 19 -14.115 29.898 -12.166 132 HH TYR 19 HH TYR 19 -11.506 31.937 -10.915 133 H LYS 20 HN LYS 20 -11.243 25.082 -8.442 134 HA LYS 20 HA LYS 20 -10.642 22.304 -8.655 135 1HB LYS 20 HB1 LYS 20 -9.275 24.341 -7.642 136 2HB LYS 20 HB2 LYS 20 -10.060 23.828 -6.156 137 1HG LYS 20 HG2 LYS 20 -8.010 22.717 -6.157 138 2HG LYS 20 HG1 LYS 20 -9.172 21.499 -6.687 139 1HD LYS 20 HD2 LYS 20 -8.553 22.167 -9.063 140 2HD LYS 20 HD1 LYS 20 -7.192 23.035 -8.349 141 1HE LYS 20 HE2 LYS 20 -6.815 20.715 -7.139 142 2HE LYS 20 HE1 LYS 20 -7.698 20.110 -8.540 143 1HZ LYS 20 HZ1 LYS 20 -5.010 20.758 -8.395 144 2HZ LYS 20 HZ2 LYS 20 -5.719 21.947 -9.368 145 3HZ LYS 20 HZ3 LYS 20 -5.887 20.314 -9.772 146 H TYR 21 HN TYR 21 -10.857 20.791 -6.792 147 HA TYR 21 HA TYR 21 -13.608 20.844 -5.845 148 1HB TYR 21 HB2 TYR 21 -12.970 18.497 -5.016 149 2HB TYR 21 HB1 TYR 21 -13.042 18.751 -6.756 150 HD1 TYR 21 HD1 TYR 21 -10.777 18.311 -3.881 151 HD2 TYR 21 HD2 TYR 21 -11.088 18.553 -8.117 152 HE1 TYR 21 HE1 TYR 21 -8.474 17.475 -4.092 153 HE2 TYR 21 HE2 TYR 21 -8.786 17.718 -8.341 154 HH TYR 21 HH TYR 21 -6.592 17.719 -5.978 155 H ALA 22 HN ALA 22 -10.502 21.584 -4.693 156 HA ALA 22 HA ALA 22 -10.972 20.970 -1.926 157 1HB ALA 22 HB1 ALA 22 -8.790 22.184 -3.505 158 2HB ALA 22 HB2 ALA 22 -8.733 20.953 -2.242 159 3HB ALA 22 HB3 ALA 22 -8.898 22.654 -1.809 160 H ALA 23 HN ALA 23 -10.142 24.136 -3.318 161 HA ALA 23 HA ALA 23 -11.778 25.437 -1.297 162 1HB ALA 23 HB1 ALA 23 -9.415 26.106 -2.713 163 2HB ALA 23 HB2 ALA 23 -10.203 26.991 -1.408 164 3HB ALA 23 HB3 ALA 23 -10.635 27.323 -3.085 165 H GLY 24 HN GLY 24 -13.544 24.163 -2.739 166 1HA GLY 24 HA2 GLY 24 -14.513 25.993 -4.831 167 2HA GLY 24 HA1 GLY 24 -15.014 24.321 -4.629 168 H VAL 25 HN VAL 25 -16.014 23.945 -2.323 169 HA VAL 25 HA VAL 25 -18.120 25.967 -2.046 170 HB VAL 25 HB VAL 25 -19.121 24.042 -0.554 171 1HG1 VAL 25 HG11 VAL 25 -20.586 24.024 -2.220 172 2HG1 VAL 25 HG12 VAL 25 -19.470 23.112 -3.236 173 3HG1 VAL 25 HG13 VAL 25 -19.414 24.875 -3.224 174 1HG2 VAL 25 HG21 VAL 25 -17.645 22.311 -2.486 175 2HG2 VAL 25 HG22 VAL 25 -18.419 21.886 -0.959 176 3HG2 VAL 25 HG23 VAL 25 -16.886 22.758 -0.957 177 H ARG 26 HN ARG 26 -17.311 27.484 -0.677 178 HA ARG 26 HA ARG 26 -16.057 26.654 1.820 179 1HB ARG 26 HB2 ARG 26 -15.256 28.588 0.304 180 2HB ARG 26 HB1 ARG 26 -16.596 29.495 0.993 181 1HG ARG 26 HG2 ARG 26 -14.878 30.113 2.373 182 2HG ARG 26 HG1 ARG 26 -15.557 28.751 3.267 183 1HD ARG 26 HD1 ARG 26 -13.849 27.285 2.464 184 2HD ARG 26 HD2 ARG 26 -13.251 28.509 1.345 185 HE ARG 26 HE ARG 26 -12.074 29.454 3.064 186 1HH1 ARG 26 HH11 ARG 26 -14.470 27.294 4.385 187 2HH1 ARG 26 HH12 ARG 26 -13.873 27.417 6.006 188 1HH2 ARG 26 HH21 ARG 26 -11.282 29.620 5.196 189 2HH2 ARG 26 HH22 ARG 26 -12.062 28.739 6.467 190 H ASN 27 HN ASN 27 -19.126 27.377 0.661 191 HA ASN 27 HA ASN 27 -20.108 28.387 3.220 192 1HB ASN 27 HB2 ASN 27 -22.293 28.569 1.971 193 2HB ASN 27 HB1 ASN 27 -20.984 29.554 1.324 194 1HD2 ASN 27 HD21 ASN 27 -19.909 28.831 -0.579 195 2HD2 ASN 27 HD22 ASN 27 -20.722 27.803 -1.704 196 HA PRO 28 HA PRO 28 -21.227 24.305 4.574 197 1HB PRO 28 HB1 PRO 28 -23.209 25.703 6.264 198 2HB PRO 28 HB2 PRO 28 -21.880 24.639 6.734 199 1HG PRO 28 HG2 PRO 28 -21.764 27.279 7.157 200 2HG PRO 28 HG1 PRO 28 -20.324 26.351 6.697 201 1HD PRO 28 HD1 PRO 28 -22.059 28.117 5.014 202 2HD PRO 28 HD2 PRO 28 -20.290 27.950 5.021 203 H GLN 29 HN GLN 29 -23.344 26.572 3.121 204 HA GLN 29 HA GLN 29 -25.697 24.925 3.156 205 1HB GLN 29 HB1 GLN 29 -25.068 27.309 1.405 206 2HB GLN 29 HB2 GLN 29 -26.656 26.606 1.680 207 1HG GLN 29 HG2 GLN 29 -25.088 27.580 4.013 208 2HG GLN 29 HG1 GLN 29 -25.883 28.751 2.962 209 1HE2 GLN 29 HE21 GLN 29 -26.622 28.619 5.549 210 2HE2 GLN 29 HE22 GLN 29 -28.198 27.924 5.696 211 H GLN 30 HN GLN 30 -25.521 23.007 2.146 212 HA GLN 30 HA GLN 30 -24.270 22.905 -0.503 213 1HB GLN 30 HB1 GLN 30 -24.036 21.218 1.640 214 2HB GLN 30 HB2 GLN 30 -25.252 20.394 0.673 215 1HG GLN 30 HG2 GLN 30 -23.771 19.767 -0.872 216 2HG GLN 30 HG1 GLN 30 -22.971 21.338 -0.879 217 1HE2 GLN 30 HE21 GLN 30 -21.516 19.039 -1.097 218 2HE2 GLN 30 HE22 GLN 30 -20.588 18.794 0.340 219 H HIS 31 HN HIS 31 -27.308 23.058 0.970 220 HA HIS 31 HA HIS 31 -29.448 22.833 0.232 221 1HB HIS 31 HB1 HIS 31 -27.902 23.501 -2.232 222 2HB HIS 31 HB2 HIS 31 -29.583 23.007 -2.414 223 HD2 HIS 31 HD2 HIS 31 -27.793 25.646 -0.063 224 HE1 HIS 31 HE1 HIS 31 -31.363 27.260 -1.664 225 HE2 HIS 31 HE2 HIS 31 -29.364 27.708 -0.169 226 H LEU 32 HN LEU 32 -28.274 20.442 0.850 227 HA LEU 32 HA LEU 32 -28.755 18.558 -1.299 228 1HB LEU 32 HB1 LEU 32 -27.712 18.372 1.498 229 2HB LEU 32 HB2 LEU 32 -28.281 16.921 0.697 230 HG LEU 32 HG LEU 32 -26.324 18.606 -0.775 231 1HD1 LEU 32 HD11 LEU 32 -24.652 16.961 0.576 232 2HD1 LEU 32 HD12 LEU 32 -25.805 17.381 1.843 233 3HD1 LEU 32 HD13 LEU 32 -24.933 18.653 0.987 234 1HD2 LEU 32 HD21 LEU 32 -27.159 15.765 -0.612 235 2HD2 LEU 32 HD22 LEU 32 -25.491 16.107 -1.071 236 3HD2 LEU 32 HD23 LEU 32 -26.821 16.770 -2.021 237 H ASN 33 HN ASN 33 -30.172 16.679 -0.977 238 HA ASN 33 HA ASN 33 -32.665 17.506 0.331 239 1HB ASN 33 HB2 ASN 33 -32.028 15.727 -1.993 240 2HB ASN 33 HB1 ASN 33 -33.527 15.474 -1.104 241 1HD2 ASN 33 HD21 ASN 33 -35.170 16.936 -1.281 242 2HD2 ASN 33 HD22 ASN 33 -35.161 18.242 -2.411 243 H ALA 34 HN ALA 34 -33.970 15.828 1.380 244 HA ALA 34 HA ALA 34 -32.495 14.443 3.342 245 1HB ALA 34 HB1 ALA 34 -34.491 14.033 4.328 246 2HB ALA 34 HB2 ALA 34 -35.270 13.571 2.815 247 3HB ALA 34 HB3 ALA 34 -35.031 15.277 3.200 248 H GLN 35 HN GLN 35 -31.620 12.473 3.366 249 HA GLN 35 HA GLN 35 -32.093 10.723 1.064 250 1HB GLN 35 HB1 GLN 35 -29.827 11.153 2.940 251 2HB GLN 35 HB2 GLN 35 -30.042 9.529 2.303 252 1HG GLN 35 HG2 GLN 35 -30.245 10.959 0.033 253 2HG GLN 35 HG1 GLN 35 -29.156 11.990 0.961 254 1HE2 GLN 35 HE21 GLN 35 -27.726 10.143 2.379 255 2HE2 GLN 35 HE22 GLN 35 -26.788 9.175 1.298 256 HA PRO 36 HA PRO 36 -34.341 7.917 3.664 257 1HB PRO 36 HB1 PRO 36 -34.486 5.808 2.011 258 2HB PRO 36 HB2 PRO 36 -35.363 7.307 1.680 259 1HG PRO 36 HG2 PRO 36 -32.790 6.316 0.515 260 2HG PRO 36 HG1 PRO 36 -34.152 7.111 -0.295 261 1HD PRO 36 HD2 PRO 36 -31.845 8.397 0.461 262 2HD PRO 36 HD1 PRO 36 -33.414 9.203 0.262 263 H GLN 37 HN GLN 37 -31.121 7.445 2.666 264 HA GLN 37 HA GLN 37 -30.749 4.873 3.913 265 1HB GLN 37 HB2 GLN 37 -28.884 6.885 2.672 266 2HB GLN 37 HB1 GLN 37 -28.279 5.468 3.516 267 1HG GLN 37 HG1 GLN 37 -30.265 4.596 1.702 268 2HG GLN 37 HG2 GLN 37 -29.189 5.695 0.839 269 1HE2 GLN 37 HE21 GLN 37 -29.079 3.312 -0.120 270 2HE2 GLN 37 HE22 GLN 37 -27.700 2.420 0.414 271 H VAL 38 HN VAL 38 -28.332 5.189 5.229 272 HA VAL 38 HA VAL 38 -29.241 6.190 7.764 273 HB VAL 38 HB VAL 38 -26.403 5.376 7.275 274 1HG1 VAL 38 HG21 VAL 38 -27.494 6.182 9.504 275 2HG1 VAL 38 HG22 VAL 38 -26.384 4.812 9.509 276 3HG1 VAL 38 HG23 VAL 38 -28.125 4.535 9.564 277 1HG2 VAL 38 HG11 VAL 38 -28.365 3.240 7.885 278 2HG2 VAL 38 HG12 VAL 38 -26.836 3.161 7.007 279 3HG2 VAL 38 HG13 VAL 38 -28.275 3.807 6.217 280 H THR 39 HN THR 39 -28.608 7.991 8.847 281 HA THR 39 HA THR 39 -27.231 10.031 7.289 282 HB THR 39 HB THR 39 -28.095 10.793 9.974 283 HG1 THR 39 HG1 THR 39 -30.095 9.932 8.164 284 1HG2 THR 39 HG21 THR 39 -28.857 11.753 7.230 285 2HG2 THR 39 HG22 THR 39 -27.668 12.472 8.317 286 3HG2 THR 39 HG23 THR 39 -29.379 12.492 8.745 287 H MET 40 HN MET 40 -26.406 7.688 9.490 288 HA MET 40 HA MET 40 -24.362 9.234 10.863 289 1HB MET 40 HB1 MET 40 -25.815 7.330 11.868 290 2HB MET 40 HB2 MET 40 -24.686 6.254 11.057 291 1HG MET 40 HG2 MET 40 -22.835 7.332 12.282 292 2HG MET 40 HG1 MET 40 -24.018 8.313 13.147 293 1HE MET 40 HE1 MET 40 -24.705 7.965 15.119 294 2HE MET 40 HE2 MET 40 -23.352 7.125 15.876 295 3HE MET 40 HE3 MET 40 -24.985 6.475 16.020 296 H GLN 41 HN GLN 41 -22.935 9.798 9.219 297 HA GLN 41 HA GLN 41 -21.508 7.554 7.951 298 1HB GLN 41 HB1 GLN 41 -20.789 9.287 6.254 299 2HB GLN 41 HB2 GLN 41 -22.495 8.863 6.233 300 1HG GLN 41 HG2 GLN 41 -22.238 11.032 7.999 301 2HG GLN 41 HG1 GLN 41 -21.268 11.419 6.580 302 1HE2 GLN 41 HE21 GLN 41 -23.558 12.826 7.296 303 2HE2 GLN 41 HE22 GLN 41 -24.766 12.571 6.087 304 H GLN 42 HN GLN 42 -19.448 7.251 8.472 305 HA GLN 42 HA GLN 42 -18.141 9.212 10.191 306 1HB GLN 42 HB1 GLN 42 -17.605 6.318 9.575 307 2HB GLN 42 HB2 GLN 42 -16.408 7.314 10.392 308 1HG GLN 42 HG2 GLN 42 -18.232 7.854 12.074 309 2HG GLN 42 HG1 GLN 42 -19.144 6.536 11.340 310 1HE2 GLN 42 HE21 GLN 42 -18.317 6.613 14.024 311 2HE2 GLN 42 HE22 GLN 42 -17.196 5.323 14.279 312 HA PRO 43 HA PRO 43 -14.861 8.719 6.674 313 1HB PRO 43 HB2 PRO 43 -15.653 7.608 4.335 314 2HB PRO 43 HB1 PRO 43 -14.989 6.656 5.667 315 1HG PRO 43 HG1 PRO 43 -17.851 7.092 4.891 316 2HG PRO 43 HG2 PRO 43 -17.039 5.588 5.363 317 1HD PRO 43 HD1 PRO 43 -18.568 7.013 7.080 318 2HD PRO 43 HD2 PRO 43 -17.151 6.086 7.612 319 H ALA 44 HN ALA 44 -15.469 10.976 6.830 320 HA ALA 44 HA ALA 44 -17.374 12.088 4.993 321 1HB ALA 44 HB1 ALA 44 -15.381 13.881 6.211 322 2HB ALA 44 HB2 ALA 44 -16.371 12.954 7.337 323 3HB ALA 44 HB3 ALA 44 -17.138 14.008 6.150 324 H VAL 45 HN VAL 45 -17.043 12.931 3.017 325 HA VAL 45 HA VAL 45 -14.450 12.524 1.786 326 HB VAL 45 HB VAL 45 -15.622 13.250 -0.305 327 1HG1 VAL 45 HG11 VAL 45 -17.285 11.216 -0.183 328 2HG1 VAL 45 HG12 VAL 45 -16.454 10.916 1.344 329 3HG1 VAL 45 HG13 VAL 45 -15.540 10.965 -0.163 330 1HG2 VAL 45 HG21 VAL 45 -17.423 14.545 0.083 331 2HG2 VAL 45 HG22 VAL 45 -17.739 13.814 1.656 332 3HG2 VAL 45 HG23 VAL 45 -18.266 12.999 0.184 333 H HIS 46 HN HIS 46 -15.308 14.814 3.735 334 HA HIS 46 HA HIS 46 -14.557 17.103 2.068 335 1HB HIS 46 HB2 HIS 46 -16.538 16.997 3.824 336 2HB HIS 46 HB1 HIS 46 -15.252 17.382 4.962 337 HD2 HIS 46 HD2 HIS 46 -17.109 18.999 1.929 338 HE1 HIS 46 HE1 HIS 46 -14.891 21.966 3.976 339 HE2 HIS 46 HE2 HIS 46 -16.577 21.530 2.133 340 H VAL 47 HN VAL 47 -13.120 14.831 4.029 341 HA VAL 47 HA VAL 47 -10.981 16.666 4.873 342 HB VAL 47 HB VAL 47 -11.124 13.835 5.823 343 1HG1 VAL 47 HG21 VAL 47 -10.391 15.300 7.936 344 2HG1 VAL 47 HG22 VAL 47 -9.865 16.382 6.646 345 3HG1 VAL 47 HG23 VAL 47 -9.247 14.732 6.721 346 1HG2 VAL 47 HG11 VAL 47 -12.631 14.373 7.591 347 2HG2 VAL 47 HG12 VAL 47 -13.402 14.842 6.077 348 3HG2 VAL 47 HG13 VAL 47 -12.677 16.070 7.114 349 H GLN 48 HN GLN 48 -11.140 15.891 2.168 350 HA GLN 48 HA GLN 48 -9.205 13.765 1.769 351 1HB GLN 48 HB1 GLN 48 -9.524 14.385 -0.672 352 2HB GLN 48 HB2 GLN 48 -10.949 13.786 0.166 353 1HG GLN 48 HG2 GLN 48 -11.646 16.157 0.509 354 2HG GLN 48 HG1 GLN 48 -10.304 16.640 -0.528 355 1HE2 GLN 48 HE21 GLN 48 -12.570 13.932 -0.769 356 2HE2 GLN 48 HE22 GLN 48 -13.192 14.362 -2.322 357 H GLY 49 HN GLY 49 -8.801 16.712 2.866 358 1HA GLY 49 HA2 GLY 49 -6.697 17.603 1.054 359 2HA GLY 49 HA1 GLY 49 -7.290 18.465 2.466 360 H GLN 50 HN GLN 50 -6.563 15.142 2.902 361 HA GLN 50 HA GLN 50 -4.241 15.885 4.519 362 1HB GLN 50 HB2 GLN 50 -6.261 13.739 4.603 363 2HB GLN 50 HB1 GLN 50 -4.628 13.233 5.014 364 1HG GLN 50 HG1 GLN 50 -6.163 15.467 6.325 365 2HG GLN 50 HG2 GLN 50 -5.902 13.855 6.991 366 1HE2 GLN 50 HE21 GLN 50 -3.469 13.238 6.955 367 2HE2 GLN 50 HE22 GLN 50 -2.406 14.437 7.601 368 H GLU 51 HN GLU 51 -2.211 15.142 4.151 369 HA GLU 51 HA GLU 51 -1.686 14.004 1.540 370 1HB GLU 51 HB2 GLU 51 -0.053 15.282 3.685 371 2HB GLU 51 HB1 GLU 51 0.762 14.220 2.546 372 1HG GLU 51 HG2 GLU 51 0.250 15.589 0.724 373 2HG GLU 51 HG1 GLU 51 -0.993 16.463 1.619 374 HA PRO 52 HA PRO 52 -1.531 9.797 2.979 375 1HB PRO 52 HB2 PRO 52 0.280 9.407 0.667 376 2HB PRO 52 HB1 PRO 52 -1.232 8.584 1.063 377 1HG PRO 52 HG1 PRO 52 -1.118 10.374 -0.915 378 2HG PRO 52 HG2 PRO 52 -2.538 10.262 0.141 379 1HD PRO 52 HD2 PRO 52 -0.307 12.255 0.169 380 2HD PRO 52 HD1 PRO 52 -2.046 12.505 0.433 381 H LEU 53 HN LEU 53 -0.275 8.961 4.514 382 HA LEU 53 HA LEU 53 2.410 9.943 4.903 383 1HB LEU 53 HB2 LEU 53 0.377 8.830 6.521 384 2HB LEU 53 HB1 LEU 53 1.747 7.744 6.619 385 HG LEU 53 HG LEU 53 1.457 9.712 8.335 386 1HD1 LEU 53 HD11 LEU 53 3.334 8.637 8.861 387 2HD1 LEU 53 HD12 LEU 53 4.152 9.933 7.986 388 3HD1 LEU 53 HD13 LEU 53 3.792 8.410 7.172 389 1HD2 LEU 53 HD21 LEU 53 3.119 11.148 6.306 390 2HD2 LEU 53 HD22 LEU 53 2.382 11.767 7.782 391 3HD2 LEU 53 HD23 LEU 53 1.371 11.375 6.390 392 H THR 54 HN THR 54 4.284 8.877 4.575 393 HA THR 54 HA THR 54 4.502 6.080 4.198 394 HB THR 54 HB THR 54 5.413 7.198 1.677 395 HG1 THR 54 HG1 THR 54 2.670 7.024 1.618 396 1HG2 THR 54 HG21 THR 54 5.161 4.806 2.047 397 2HG2 THR 54 HG22 THR 54 4.163 5.361 0.703 398 3HG2 THR 54 HG23 THR 54 3.425 5.021 2.267 399 H ALA 55 HN ALA 55 6.787 5.646 3.093 400 HA ALA 55 HA ALA 55 8.746 6.473 4.791 401 1HB ALA 55 HB1 ALA 55 10.348 5.624 3.273 402 2HB ALA 55 HB2 ALA 55 9.302 5.931 1.886 403 3HB ALA 55 HB3 ALA 55 8.886 4.665 3.043 404 H SER 56 HN SER 56 7.872 8.033 1.721 405 HA SER 56 HA SER 56 9.895 9.953 1.661 406 1HB SER 56 HB2 SER 56 8.837 10.241 -0.296 407 2HB SER 56 HB1 SER 56 7.356 9.507 0.317 408 HG SER 56 HG SER 56 6.749 11.543 -0.028 409 H MET 57 HN MET 57 6.664 10.099 3.122 410 HA MET 57 HA MET 57 6.788 12.727 4.080 411 1HB MET 57 HB1 MET 57 5.312 10.270 4.995 412 2HB MET 57 HB2 MET 57 5.189 11.777 5.888 413 1HG MET 57 HG1 MET 57 3.502 11.063 3.942 414 2HG MET 57 HG2 MET 57 3.864 12.738 4.354 415 1HE MET 57 HE1 MET 57 5.571 9.912 1.690 416 2HE MET 57 HE2 MET 57 4.404 10.557 0.536 417 3HE MET 57 HE3 MET 57 3.856 9.953 2.099 418 H LEU 58 HN LEU 58 7.832 9.668 5.488 419 HA LEU 58 HA LEU 58 8.644 10.626 8.000 420 1HB LEU 58 HB1 LEU 58 9.522 8.291 6.315 421 2HB LEU 58 HB2 LEU 58 10.214 8.596 7.894 422 HG LEU 58 HG LEU 58 8.578 7.402 8.807 423 1HD1 LEU 58 HD11 LEU 58 6.510 9.171 7.527 424 2HD1 LEU 58 HD12 LEU 58 7.440 9.640 8.951 425 3HD1 LEU 58 HD13 LEU 58 6.372 8.237 9.016 426 1HD2 LEU 58 HD21 LEU 58 8.527 6.243 6.635 427 2HD2 LEU 58 HD22 LEU 58 7.234 7.327 6.115 428 3HD2 LEU 58 HD23 LEU 58 6.967 6.221 7.462 429 H ALA 59 HN ALA 59 10.346 10.306 4.924 430 HA ALA 59 HA ALA 59 12.905 11.033 5.794 431 1HB ALA 59 HB1 ALA 59 11.627 10.499 3.317 432 2HB ALA 59 HB2 ALA 59 13.351 10.517 3.687 433 3HB ALA 59 HB3 ALA 59 12.548 11.993 3.153 434 H SER 60 HN SER 60 10.085 12.930 5.465 435 HA SER 60 HA SER 60 11.294 15.443 4.908 436 1HB SER 60 HB1 SER 60 8.801 14.755 4.712 437 2HB SER 60 HB2 SER 60 8.717 15.144 6.431 438 HG SER 60 HG SER 60 9.351 16.854 4.271 439 H ALA 61 HN ALA 61 11.003 13.537 7.755 440 HA ALA 61 HA ALA 61 12.216 15.713 9.321 441 1HB ALA 61 HB1 ALA 61 10.858 14.468 11.270 442 2HB ALA 61 HB2 ALA 61 9.760 14.166 9.922 443 3HB ALA 61 HB3 ALA 61 10.197 15.821 10.353 444 HA PRO 62 HA PRO 62 14.673 11.671 9.213 445 1HB PRO 62 HB1 PRO 62 16.831 13.717 9.175 446 2HB PRO 62 HB2 PRO 62 16.693 12.204 8.273 447 1HG PRO 62 HG1 PRO 62 16.249 14.549 7.083 448 2HG PRO 62 HG2 PRO 62 15.269 13.124 6.691 449 1HD PRO 62 HD2 PRO 62 14.580 15.501 8.359 450 2HD PRO 62 HD1 PRO 62 13.551 14.545 7.274 451 HA PRO 63 HA PRO 63 16.520 13.023 13.320 452 1HB PRO 63 HB2 PRO 63 17.170 15.538 13.883 453 2HB PRO 63 HB1 PRO 63 18.092 14.625 12.683 454 1HG PRO 63 HG1 PRO 63 16.085 16.783 12.292 455 2HG PRO 63 HG2 PRO 63 17.503 16.374 11.312 456 1HD PRO 63 HD1 PRO 63 14.795 15.622 10.839 457 2HD PRO 63 HD2 PRO 63 16.232 15.100 9.940 458 H GLN 64 HN GLN 64 13.593 13.678 12.505 459 HA GLN 64 HA GLN 64 12.820 14.716 15.144 460 1HB GLN 64 HB2 GLN 64 11.649 15.494 12.472 461 2HB GLN 64 HB1 GLN 64 10.910 15.889 14.018 462 1HG GLN 64 HG2 GLN 64 13.739 16.669 13.610 463 2HG GLN 64 HG1 GLN 64 12.502 17.565 12.728 464 1HE2 GLN 64 HE22 GLN 64 12.635 19.461 13.811 465 2HE2 GLN 64 HE21 GLN 64 12.247 19.649 15.484 466 H GLU 65 HN GLU 65 10.620 13.920 12.520 467 HA GLU 65 HA GLU 65 9.524 11.802 14.209 468 1HB GLU 65 HB2 GLU 65 7.408 12.304 13.265 469 2HB GLU 65 HB1 GLU 65 8.184 13.852 13.570 470 1HG GLU 65 HG2 GLU 65 8.928 13.289 10.996 471 2HG GLU 65 HG1 GLU 65 7.267 12.718 11.086 472 H GLN 66 HN GLN 66 11.787 11.324 12.477 473 HA GLN 66 HA GLN 66 10.882 9.937 10.138 474 1HB GLN 66 HB1 GLN 66 13.299 10.914 10.966 475 2HB GLN 66 HB2 GLN 66 13.507 9.185 11.220 476 1HG GLN 66 HG1 GLN 66 12.374 9.264 8.743 477 2HG GLN 66 HG2 GLN 66 13.361 10.721 8.754 478 1HE2 GLN 66 HE22 GLN 66 15.473 9.905 10.319 479 2HE2 GLN 66 HE21 GLN 66 16.348 8.662 9.498 480 H LYS 67 HN LYS 67 11.449 9.123 13.448 481 HA LYS 67 HA LYS 67 10.701 6.332 12.869 482 1HB LYS 67 HB2 LYS 67 12.154 5.595 14.693 483 2HB LYS 67 HB1 LYS 67 13.078 6.461 13.474 484 1HG LYS 67 HG2 LYS 67 13.720 8.031 14.917 485 2HG LYS 67 HG1 LYS 67 12.099 8.191 15.599 486 1HD LYS 67 HD2 LYS 67 13.228 5.666 16.356 487 2HD LYS 67 HD1 LYS 67 14.346 6.968 16.766 488 1HE LYS 67 HE2 LYS 67 12.822 8.003 18.181 489 2HE LYS 67 HE1 LYS 67 11.440 7.194 17.442 490 1HZ LYS 67 HZ1 LYS 67 13.365 6.151 19.405 491 2HZ LYS 67 HZ2 LYS 67 12.573 5.077 18.365 492 3HZ LYS 67 HZ3 LYS 67 11.676 6.061 19.409 493 H GLN 68 HN GLN 68 9.025 8.615 13.606 494 HA GLN 68 HA GLN 68 7.919 7.506 16.094 495 1HB GLN 68 HB2 GLN 68 9.086 9.613 16.589 496 2HB GLN 68 HB1 GLN 68 8.105 10.440 15.387 497 1HG GLN 68 HG2 GLN 68 6.217 10.395 16.693 498 2HG GLN 68 HG1 GLN 68 6.760 8.995 17.617 499 1HE2 GLN 68 HE22 GLN 68 6.506 9.867 19.619 500 2HE2 GLN 68 HE21 GLN 68 7.444 11.190 20.214 501 H MET 69 HN MET 69 7.131 9.771 13.442 502 HA MET 69 HA MET 69 4.323 9.233 13.711 503 1HB MET 69 HB2 MET 69 4.004 10.863 11.998 504 2HB MET 69 HB1 MET 69 5.267 11.454 13.071 505 1HG MET 69 HG2 MET 69 6.873 11.344 11.483 506 2HG MET 69 HG1 MET 69 6.157 9.923 10.710 507 1HE MET 69 HE1 MET 69 7.503 12.400 9.333 508 2HE MET 69 HE2 MET 69 6.409 12.968 8.072 509 3HE MET 69 HE3 MET 69 6.782 11.250 8.206 510 H LEU 70 HN LEU 70 6.041 6.962 12.953 511 HA LEU 70 HA LEU 70 5.215 6.371 10.215 512 1HB LEU 70 HB1 LEU 70 6.387 4.095 11.450 513 2HB LEU 70 HB2 LEU 70 7.064 5.122 10.204 514 HG LEU 70 HG LEU 70 7.290 5.733 13.144 515 1HD1 LEU 70 HD11 LEU 70 8.690 3.765 11.561 516 2HD1 LEU 70 HD12 LEU 70 8.758 4.076 13.295 517 3HD1 LEU 70 HD13 LEU 70 9.789 4.990 12.194 518 1HD2 LEU 70 HD21 LEU 70 7.688 7.707 12.064 519 2HD2 LEU 70 HD22 LEU 70 8.334 6.920 10.623 520 3HD2 LEU 70 HD23 LEU 70 9.310 7.014 12.087 521 H GLY 71 HN GLY 71 4.787 5.128 13.497 522 1HA GLY 71 HA2 GLY 71 2.416 3.666 12.539 523 2HA GLY 71 HA1 GLY 71 3.363 3.177 13.936 524 H GLU 72 HN GLU 72 3.047 6.531 13.650 525 HA GLU 72 HA GLU 72 0.745 6.557 15.489 526 1HB GLU 72 HB1 GLU 72 3.171 8.351 15.686 527 2HB GLU 72 HB2 GLU 72 1.810 8.295 16.799 528 1HG GLU 72 HG2 GLU 72 3.065 5.702 16.474 529 2HG GLU 72 HG1 GLU 72 4.196 6.932 17.041 530 H ARG 73 HN ARG 73 1.781 7.500 12.518 531 HA ARG 73 HA ARG 73 0.014 9.855 12.550 532 1HB ARG 73 HB1 ARG 73 2.681 9.974 12.098 533 2HB ARG 73 HB2 ARG 73 2.093 9.728 10.461 534 1HG ARG 73 HG1 ARG 73 0.972 11.863 12.245 535 2HG ARG 73 HG2 ARG 73 2.409 12.125 11.255 536 1HD ARG 73 HD2 ARG 73 1.241 12.085 9.299 537 2HD ARG 73 HD1 ARG 73 0.015 10.986 9.927 538 HE ARG 73 HE ARG 73 -0.745 13.026 11.249 539 1HH1 ARG 73 HH12 ARG 73 0.758 13.208 8.111 540 2HH1 ARG 73 HH11 ARG 73 -0.018 14.695 7.683 541 1HH2 ARG 73 HH22 ARG 73 -1.770 14.981 10.697 542 2HH2 ARG 73 HH21 ARG 73 -1.457 15.704 9.154 543 H LEU 74 HN LEU 74 1.090 6.978 10.820 544 HA LEU 74 HA LEU 74 -0.236 7.290 8.412 545 1HB LEU 74 HB1 LEU 74 0.766 5.098 10.093 546 2HB LEU 74 HB2 LEU 74 -0.486 4.638 8.963 547 HG LEU 74 HG LEU 74 1.659 4.218 8.039 548 1HD1 LEU 74 HD21 LEU 74 -0.137 6.203 6.845 549 2HD1 LEU 74 HD22 LEU 74 0.435 4.663 6.205 550 3HD1 LEU 74 HD23 LEU 74 1.461 6.093 6.108 551 1HD2 LEU 74 HD11 LEU 74 2.591 6.289 9.419 552 2HD2 LEU 74 HD12 LEU 74 2.478 7.012 7.813 553 3HD2 LEU 74 HD13 LEU 74 3.441 5.552 8.055 554 H PHE 75 HN PHE 75 -1.465 6.531 11.566 555 HA PHE 75 HA PHE 75 -3.607 5.002 11.228 556 1HB PHE 75 HB1 PHE 75 -2.940 6.023 13.374 557 2HB PHE 75 HB2 PHE 75 -3.716 7.522 12.880 558 HD1 PHE 75 HD1 PHE 75 -4.962 4.090 12.279 559 HD2 PHE 75 HD2 PHE 75 -5.402 7.701 14.501 560 HE1 PHE 75 HE1 PHE 75 -7.107 3.280 13.181 561 HE2 PHE 75 HE2 PHE 75 -7.544 6.893 15.402 562 HZ PHE 75 HZ PHE 75 -8.399 4.679 14.743 563 HA PRO 76 HA PRO 76 -6.720 8.438 9.823 564 1HB PRO 76 HB2 PRO 76 -5.610 10.736 8.819 565 2HB PRO 76 HB1 PRO 76 -6.186 10.560 10.480 566 1HG PRO 76 HG1 PRO 76 -3.399 10.339 9.407 567 2HG PRO 76 HG2 PRO 76 -3.971 11.150 10.877 568 1HD PRO 76 HD1 PRO 76 -2.810 8.737 10.978 569 2HD PRO 76 HD2 PRO 76 -4.159 9.158 12.052 570 H LEU 77 HN LEU 77 -3.717 7.685 8.354 571 HA LEU 77 HA LEU 77 -4.738 8.081 5.653 572 1HB LEU 77 HB1 LEU 77 -2.015 7.284 6.679 573 2HB LEU 77 HB2 LEU 77 -2.413 7.426 4.983 574 HG LEU 77 HG LEU 77 -1.376 9.442 5.403 575 1HD1 LEU 77 HD21 LEU 77 -3.638 9.782 4.434 576 2HD1 LEU 77 HD22 LEU 77 -3.032 11.173 5.334 577 3HD1 LEU 77 HD23 LEU 77 -4.239 10.111 6.058 578 1HD2 LEU 77 HD11 LEU 77 -2.747 10.329 7.799 579 2HD2 LEU 77 HD12 LEU 77 -1.022 10.267 7.433 580 3HD2 LEU 77 HD13 LEU 77 -1.848 8.831 8.039 581 H ILE 78 HN ILE 78 -4.119 5.492 7.913 582 HA ILE 78 HA ILE 78 -3.983 3.398 5.982 583 HB ILE 78 HB ILE 78 -4.901 3.028 8.810 584 1HG1 ILE 78 HG12 ILE 78 -2.760 4.386 8.643 585 2HG1 ILE 78 HG11 ILE 78 -2.646 2.887 9.558 586 1HG2 ILE 78 HG21 ILE 78 -3.226 0.958 7.962 587 2HG2 ILE 78 HG22 ILE 78 -4.285 1.311 6.594 588 3HG2 ILE 78 HG23 ILE 78 -4.976 0.908 8.167 589 1HD1 ILE 78 HD11 ILE 78 -1.164 2.002 8.149 590 2HD1 ILE 78 HD12 ILE 78 -0.913 3.670 7.634 591 3HD1 ILE 78 HD13 ILE 78 -1.997 2.619 6.722 592 H GLN 79 HN GLN 79 -6.553 4.688 8.043 593 HA GLN 79 HA GLN 79 -8.626 2.963 7.458 594 1HB GLN 79 HB1 GLN 79 -8.399 5.810 8.254 595 2HB GLN 79 HB2 GLN 79 -9.948 5.315 7.586 596 1HG GLN 79 HG2 GLN 79 -9.955 3.456 9.281 597 2HG GLN 79 HG1 GLN 79 -8.555 4.233 10.018 598 1HE2 GLN 79 HE21 GLN 79 -9.142 5.262 11.778 599 2HE2 GLN 79 HE22 GLN 79 -10.562 6.227 11.972 600 H ALA 80 HN ALA 80 -7.012 5.145 5.418 601 HA ALA 80 HA ALA 80 -9.108 5.428 3.454 602 1HB ALA 80 HB1 ALA 80 -7.355 7.164 3.896 603 2HB ALA 80 HB2 ALA 80 -7.533 6.710 2.202 604 3HB ALA 80 HB3 ALA 80 -6.183 6.078 3.146 605 H MET 81 HN MET 81 -6.186 3.502 3.903 606 HA MET 81 HA MET 81 -6.266 2.317 1.291 607 1HB MET 81 HB1 MET 81 -4.870 0.963 3.549 608 2HB MET 81 HB2 MET 81 -4.334 1.214 1.895 609 1HG MET 81 HG1 MET 81 -4.509 3.765 2.997 610 2HG MET 81 HG2 MET 81 -3.803 2.762 4.256 611 1HE MET 81 HE1 MET 81 -0.646 2.948 3.999 612 2HE MET 81 HE2 MET 81 -0.746 1.391 3.174 613 3HE MET 81 HE3 MET 81 -1.926 1.805 4.416 614 H HIS 82 HN HIS 82 -7.387 1.443 4.493 615 HA HIS 82 HA HIS 82 -8.801 -0.869 3.334 616 1HB HIS 82 HB1 HIS 82 -7.166 -0.603 5.808 617 2HB HIS 82 HB2 HIS 82 -8.608 -1.603 5.906 618 HD2 HIS 82 HD2 HIS 82 -5.869 -1.469 3.058 619 HE1 HIS 82 HE1 HIS 82 -6.342 -5.430 4.473 620 HE2 HIS 82 HE2 HIS 82 -5.149 -3.949 2.793 621 HA PRO 83 HA PRO 83 -12.595 0.915 4.779 622 1HB PRO 83 HB2 PRO 83 -13.345 -1.780 5.760 623 2HB PRO 83 HB1 PRO 83 -14.175 -0.731 4.606 624 1HG PRO 83 HG1 PRO 83 -12.864 -2.909 3.789 625 2HG PRO 83 HG2 PRO 83 -12.852 -1.416 2.831 626 1HD PRO 83 HD2 PRO 83 -10.730 -2.543 4.615 627 2HD PRO 83 HD1 PRO 83 -10.568 -1.725 3.047 628 H THR 84 HN THR 84 -11.311 1.980 6.484 629 HA THR 84 HA THR 84 -10.658 2.424 8.621 630 HB THR 84 HB THR 84 -13.071 3.050 8.532 631 HG1 THR 84 HG1 THR 84 -11.522 2.810 10.620 632 1HG2 THR 84 HG21 THR 84 -14.527 1.578 10.082 633 2HG2 THR 84 HG22 THR 84 -13.438 0.286 9.577 634 3HG2 THR 84 HG23 THR 84 -14.375 1.170 8.372 635 H LEU 85 HN LEU 85 -9.865 -0.174 7.822 636 HA LEU 85 HA LEU 85 -10.374 -1.956 10.050 637 1HB LEU 85 HB1 LEU 85 -9.348 -2.178 7.361 638 2HB LEU 85 HB2 LEU 85 -8.271 -2.974 8.493 639 HG LEU 85 HG LEU 85 -10.386 -4.159 9.371 640 1HD1 LEU 85 HD11 LEU 85 -11.425 -3.490 6.633 641 2HD1 LEU 85 HD12 LEU 85 -11.894 -2.584 8.073 642 3HD1 LEU 85 HD13 LEU 85 -12.259 -4.305 7.956 643 1HD2 LEU 85 HD21 LEU 85 -9.221 -4.721 6.653 644 2HD2 LEU 85 HD22 LEU 85 -10.245 -5.846 7.543 645 3HD2 LEU 85 HD23 LEU 85 -8.684 -5.363 8.205 646 H ALA 86 HN ALA 86 -8.525 0.677 9.767 647 HA ALA 86 HA ALA 86 -5.974 -0.151 10.697 648 1HB ALA 86 HB1 ALA 86 -6.372 2.010 9.612 649 2HB ALA 86 HB2 ALA 86 -5.604 2.201 11.188 650 3HB ALA 86 HB3 ALA 86 -7.327 2.530 11.000 651 H GLY 87 HN GLY 87 -6.086 1.979 12.906 652 1HA GLY 87 HA2 GLY 87 -6.601 2.110 15.169 653 2HA GLY 87 HA1 GLY 87 -7.681 0.735 14.972 654 H LYS 88 HN LYS 88 -5.046 -0.325 13.527 655 HA LYS 88 HA LYS 88 -3.323 -0.884 15.740 656 1HB LYS 88 HB1 LYS 88 -4.985 -2.481 16.346 657 2HB LYS 88 HB2 LYS 88 -5.165 -3.027 14.685 658 1HG LYS 88 HG2 LYS 88 -3.953 -4.710 15.779 659 2HG LYS 88 HG1 LYS 88 -2.763 -3.815 14.827 660 1HD LYS 88 HD2 LYS 88 -2.888 -2.522 17.312 661 2HD LYS 88 HD1 LYS 88 -2.872 -4.251 17.669 662 1HE LYS 88 HE1 LYS 88 -0.941 -4.307 15.918 663 2HE LYS 88 HE2 LYS 88 -0.824 -2.585 16.265 664 1HZ LYS 88 HZ1 LYS 88 -0.300 -3.001 18.492 665 2HZ LYS 88 HZ2 LYS 88 0.615 -4.133 17.631 666 3HZ LYS 88 HZ3 LYS 88 -0.802 -4.614 18.418 667 H ILE 89 HN ILE 89 -4.213 -1.256 12.384 668 HA ILE 89 HA ILE 89 -2.264 -2.864 11.386 669 HB ILE 89 HB ILE 89 -3.231 -0.319 10.096 670 1HG1 ILE 89 HG12 ILE 89 -4.229 -3.131 9.637 671 2HG1 ILE 89 HG11 ILE 89 -4.956 -2.063 10.833 672 1HG2 ILE 89 HG21 ILE 89 -1.619 -0.809 8.615 673 2HG2 ILE 89 HG22 ILE 89 -2.694 -2.111 8.102 674 3HG2 ILE 89 HG23 ILE 89 -1.400 -2.439 9.256 675 1HD1 ILE 89 HD11 ILE 89 -6.213 -2.046 8.763 676 2HD1 ILE 89 HD12 ILE 89 -4.775 -1.539 7.877 677 3HD1 ILE 89 HD13 ILE 89 -5.498 -0.464 9.073 678 H THR 90 HN THR 90 -1.831 0.615 10.868 679 HA THR 90 HA THR 90 0.955 0.481 10.603 680 HB THR 90 HB THR 90 -1.069 2.449 10.507 681 HG1 THR 90 HG1 THR 90 1.508 3.184 9.893 682 1HG2 THR 90 HG21 THR 90 -0.674 3.747 12.282 683 2HG2 THR 90 HG22 THR 90 0.701 4.299 11.323 684 3HG2 THR 90 HG23 THR 90 0.928 3.064 12.561 685 H GLY 91 HN GLY 91 -1.062 0.990 13.462 686 1HA GLY 91 HA2 GLY 91 0.952 1.757 15.274 687 2HA GLY 91 HA1 GLY 91 -0.526 0.899 15.699 688 H MET 92 HN MET 92 0.112 -1.254 13.818 689 HA MET 92 HA MET 92 1.699 -2.914 15.568 690 1HB MET 92 HB1 MET 92 -0.336 -3.478 13.892 691 2HB MET 92 HB2 MET 92 1.015 -3.809 12.820 692 1HG MET 92 HG1 MET 92 1.684 -5.621 13.968 693 2HG MET 92 HG2 MET 92 1.159 -4.981 15.520 694 1HE MET 92 HE1 MET 92 -0.050 -5.679 12.122 695 2HE MET 92 HE2 MET 92 -1.761 -5.397 12.449 696 3HE MET 92 HE3 MET 92 -1.156 -7.045 12.274 697 H LEU 93 HN LEU 93 2.013 -1.264 12.534 698 HA LEU 93 HA LEU 93 4.304 -2.445 11.516 699 1HB LEU 93 HB2 LEU 93 2.952 0.169 11.205 700 2HB LEU 93 HB1 LEU 93 4.561 0.005 10.543 701 HG LEU 93 HG LEU 93 2.770 -0.417 8.877 702 1HD1 LEU 93 HD11 LEU 93 3.653 -2.822 8.311 703 2HD1 LEU 93 HD12 LEU 93 4.788 -2.477 9.618 704 3HD1 LEU 93 HD13 LEU 93 4.719 -1.420 8.207 705 1HD2 LEU 93 HD21 LEU 93 1.538 -1.781 10.919 706 2HD2 LEU 93 HD22 LEU 93 2.125 -3.073 9.872 707 3HD2 LEU 93 HD23 LEU 93 1.072 -1.818 9.218 708 H LEU 94 HN LEU 94 4.002 -0.704 14.347 709 HA LEU 94 HA LEU 94 6.834 0.091 14.315 710 1HB LEU 94 HB1 LEU 94 4.423 1.176 15.591 711 2HB LEU 94 HB2 LEU 94 5.797 1.049 16.668 712 HG LEU 94 HG LEU 94 5.475 3.270 15.473 713 1HD1 LEU 94 HD21 LEU 94 7.547 2.667 16.598 714 2HD1 LEU 94 HD22 LEU 94 7.872 3.580 15.124 715 3HD1 LEU 94 HD23 LEU 94 8.103 1.831 15.148 716 1HD2 LEU 94 HD11 LEU 94 6.387 3.400 13.188 717 2HD2 LEU 94 HD12 LEU 94 4.906 2.443 13.272 718 3HD2 LEU 94 HD13 LEU 94 6.471 1.639 13.140 719 H GLU 95 HN GLU 95 5.693 -2.608 14.561 720 HA GLU 95 HA GLU 95 7.277 -3.565 16.712 721 1HB GLU 95 HB2 GLU 95 5.635 -4.300 18.251 722 2HB GLU 95 HB1 GLU 95 5.240 -2.624 17.896 723 1HG GLU 95 HG1 GLU 95 3.440 -3.261 16.478 724 2HG GLU 95 HG2 GLU 95 3.923 -4.956 16.530 725 H ILE 96 HN ILE 96 5.731 -3.984 13.832 726 HA ILE 96 HA ILE 96 4.923 -6.681 13.888 727 HB ILE 96 HB ILE 96 5.070 -6.707 11.500 728 1HG1 ILE 96 HG12 ILE 96 7.313 -5.664 11.344 729 2HG1 ILE 96 HG11 ILE 96 6.155 -5.037 10.180 730 1HG2 ILE 96 HG21 ILE 96 3.210 -5.534 11.508 731 2HG2 ILE 96 HG22 ILE 96 4.181 -4.077 11.289 732 3HG2 ILE 96 HG23 ILE 96 3.740 -4.611 12.915 733 1HD1 ILE 96 HD11 ILE 96 6.429 -2.985 10.908 734 2HD1 ILE 96 HD12 ILE 96 7.761 -3.588 11.897 735 3HD1 ILE 96 HD13 ILE 96 6.139 -3.472 12.581 736 H ASP 97 HN ASP 97 6.480 -7.513 11.537 737 HA ASP 97 HA ASP 97 8.417 -9.160 12.641 738 1HB ASP 97 HB1 ASP 97 7.255 -9.136 10.307 739 2HB ASP 97 HB2 ASP 97 8.585 -8.083 9.834 740 H ASN 98 HN ASN 98 8.453 -5.854 12.275 741 HA ASN 98 HA ASN 98 9.979 -4.288 12.815 742 1HB ASN 98 HB1 ASN 98 11.529 -6.735 13.400 743 2HB ASN 98 HB2 ASN 98 12.482 -5.293 13.059 744 1HD2 ASN 98 HD22 ASN 98 12.895 -4.013 14.704 745 2HD2 ASN 98 HD21 ASN 98 12.019 -3.951 16.191 746 H SER 99 HN SER 99 10.421 -6.530 10.265 747 HA SER 99 HA SER 99 12.379 -4.956 8.842 748 1HB SER 99 HB1 SER 99 10.626 -7.065 7.595 749 2HB SER 99 HB2 SER 99 12.258 -6.573 7.138 750 HG SER 99 HG SER 99 12.931 -8.105 8.390 751 H GLU 100 HN GLU 100 8.955 -5.116 9.180 752 HA GLU 100 HA GLU 100 8.345 -3.592 6.807 753 1HB GLU 100 HB1 GLU 100 6.662 -4.308 9.195 754 2HB GLU 100 HB2 GLU 100 6.071 -3.488 7.770 755 1HG GLU 100 HG2 GLU 100 5.457 -5.634 7.346 756 2HG GLU 100 HG1 GLU 100 7.007 -5.541 6.508 757 H LEU 101 HN LEU 101 9.182 -3.023 10.094 758 HA LEU 101 HA LEU 101 8.232 -0.324 10.218 759 1HB LEU 101 HB1 LEU 101 8.425 -1.250 12.326 760 2HB LEU 101 HB2 LEU 101 9.908 -2.098 11.935 761 HG LEU 101 HG LEU 101 10.906 0.344 11.841 762 1HD1 LEU 101 HD11 LEU 101 8.909 0.833 13.988 763 2HD1 LEU 101 HD12 LEU 101 8.447 1.146 12.315 764 3HD1 LEU 101 HD13 LEU 101 9.832 1.981 13.019 765 1HD2 LEU 101 HD21 LEU 101 10.388 -0.526 14.615 766 2HD2 LEU 101 HD22 LEU 101 11.909 -0.151 13.806 767 3HD2 LEU 101 HD23 LEU 101 11.129 -1.710 13.539 768 H LEU 102 HN LEU 102 11.081 -1.943 9.131 769 HA LEU 102 HA LEU 102 12.651 0.497 8.959 770 1HB LEU 102 HB2 LEU 102 13.124 -2.396 8.698 771 2HB LEU 102 HB1 LEU 102 14.042 -1.405 7.578 772 HG LEU 102 HG LEU 102 14.886 -0.092 9.549 773 1HD1 LEU 102 HD21 LEU 102 13.200 -0.565 11.177 774 2HD1 LEU 102 HD22 LEU 102 14.724 -1.236 11.757 775 3HD1 LEU 102 HD23 LEU 102 13.503 -2.299 11.061 776 1HD2 LEU 102 HD11 LEU 102 15.715 -2.858 10.110 777 2HD2 LEU 102 HD12 LEU 102 16.680 -1.443 9.690 778 3HD2 LEU 102 HD13 LEU 102 15.843 -2.347 8.427 779 H HIS 103 HN HIS 103 11.174 -1.880 6.789 780 HA HIS 103 HA HIS 103 12.025 -0.706 4.388 781 1HB HIS 103 HB2 HIS 103 10.744 -3.008 5.030 782 2HB HIS 103 HB1 HIS 103 9.404 -2.077 4.368 783 HD2 HIS 103 HD2 HIS 103 11.592 -4.609 3.072 784 HE1 HIS 103 HE1 HIS 103 11.409 -1.783 -0.076 785 HE2 HIS 103 HE2 HIS 103 12.043 -4.157 0.557 786 H MET 104 HN MET 104 8.990 -0.342 6.214 787 HA MET 104 HA MET 104 7.591 1.267 4.456 788 1HB MET 104 HB2 MET 104 6.268 1.983 6.327 789 2HB MET 104 HB1 MET 104 6.748 0.313 6.638 790 1HG MET 104 HG2 MET 104 8.712 1.377 7.909 791 2HG MET 104 HG1 MET 104 7.727 2.837 7.900 792 1HE MET 104 HE1 MET 104 4.630 0.456 8.540 793 2HE MET 104 HE2 MET 104 5.107 1.989 7.813 794 3HE MET 104 HE3 MET 104 4.542 1.946 9.484 795 H LEU 105 HN LEU 105 10.155 2.171 6.688 796 HA LEU 105 HA LEU 105 9.783 5.002 6.231 797 1HB LEU 105 HB1 LEU 105 12.131 3.666 7.562 798 2HB LEU 105 HB2 LEU 105 11.596 5.324 7.748 799 HG LEU 105 HG LEU 105 10.073 2.901 8.705 800 1HD1 LEU 105 HD11 LEU 105 11.529 4.935 10.372 801 2HD1 LEU 105 HD12 LEU 105 12.249 3.401 9.880 802 3HD1 LEU 105 HD13 LEU 105 10.805 3.413 10.892 803 1HD2 LEU 105 HD21 LEU 105 9.611 5.845 9.155 804 2HD2 LEU 105 HD22 LEU 105 8.680 4.526 9.866 805 3HD2 LEU 105 HD23 LEU 105 8.644 4.791 8.122 806 H GLU 106 HN GLU 106 11.329 2.466 4.656 807 HA GLU 106 HA GLU 106 13.281 4.282 3.451 808 1HB GLU 106 HB1 GLU 106 14.730 2.540 3.272 809 2HB GLU 106 HB2 GLU 106 13.742 1.891 4.574 810 1HG GLU 106 HG1 GLU 106 13.522 0.085 3.312 811 2HG GLU 106 HG2 GLU 106 12.419 1.041 2.323 812 H SER 107 HN SER 107 10.315 2.800 2.730 813 HA SER 107 HA SER 107 10.730 3.454 -0.105 814 1HB SER 107 HB2 SER 107 10.845 0.874 0.655 815 2HB SER 107 HB1 SER 107 9.106 1.033 0.427 816 HG SER 107 HG SER 107 11.055 1.769 -1.501 817 HA PRO 108 HA PRO 108 6.781 5.415 0.435 818 1HB PRO 108 HB2 PRO 108 6.575 5.594 -2.463 819 2HB PRO 108 HB1 PRO 108 6.846 6.882 -1.288 820 1HG PRO 108 HG2 PRO 108 8.746 6.059 -3.045 821 2HG PRO 108 HG1 PRO 108 9.128 6.728 -1.449 822 1HD PRO 108 HD2 PRO 108 9.059 3.869 -2.339 823 2HD PRO 108 HD1 PRO 108 10.226 4.692 -1.281 824 H GLU 109 HN GLU 109 7.289 2.404 -0.767 825 HA GLU 109 HA GLU 109 4.418 1.958 -1.286 826 1HB GLU 109 HB2 GLU 109 6.767 0.448 -2.450 827 2HB GLU 109 HB1 GLU 109 5.071 0.108 -2.766 828 1HG GLU 109 HG1 GLU 109 4.811 2.243 -3.865 829 2HG GLU 109 HG2 GLU 109 6.478 2.671 -3.479 830 H SER 110 HN SER 110 7.135 1.237 0.612 831 HA SER 110 HA SER 110 6.316 -1.370 1.481 832 1HB SER 110 HB2 SER 110 7.974 -0.781 3.405 833 2HB SER 110 HB1 SER 110 8.621 -0.991 1.772 834 HG SER 110 HG SER 110 7.830 1.517 2.816 835 H LEU 111 HN LEU 111 6.292 1.868 2.901 836 HA LEU 111 HA LEU 111 5.014 1.395 5.272 837 1HB LEU 111 HB1 LEU 111 5.876 3.578 4.202 838 2HB LEU 111 HB2 LEU 111 4.295 3.690 3.456 839 HG LEU 111 HG LEU 111 4.030 5.052 5.276 840 1HD1 LEU 111 HD21 LEU 111 2.205 3.611 5.480 841 2HD1 LEU 111 HD22 LEU 111 2.865 3.735 7.110 842 3HD1 LEU 111 HD23 LEU 111 3.198 2.309 6.133 843 1HD2 LEU 111 HD11 LEU 111 5.124 4.942 7.307 844 2HD2 LEU 111 HD12 LEU 111 6.326 4.318 6.172 845 3HD2 LEU 111 HD13 LEU 111 5.390 3.204 7.183 846 H ARG 112 HN ARG 112 3.641 1.637 2.029 847 HA ARG 112 HA ARG 112 0.955 1.278 2.975 848 1HB ARG 112 HB2 ARG 112 0.811 2.459 1.051 849 2HB ARG 112 HB1 ARG 112 2.271 1.750 0.375 850 1HG ARG 112 HG1 ARG 112 1.100 -0.168 -0.361 851 2HG ARG 112 HG2 ARG 112 -0.341 0.276 0.558 852 1HD ARG 112 HD2 ARG 112 -0.666 2.229 -0.846 853 2HD ARG 112 HD1 ARG 112 0.803 1.850 -1.745 854 HE ARG 112 HE ARG 112 -0.921 -0.356 -1.868 855 1HH1 ARG 112 HH12 ARG 112 -0.699 2.925 -3.018 856 2HH1 ARG 112 HH11 ARG 112 -1.633 2.625 -4.446 857 1HH2 ARG 112 HH22 ARG 112 -2.151 -0.762 -3.746 858 2HH2 ARG 112 HH21 ARG 112 -2.458 0.529 -4.860 859 H SER 113 HN SER 113 2.900 -0.689 0.715 860 HA SER 113 HA SER 113 1.352 -2.932 0.643 861 1HB SER 113 HB1 SER 113 4.373 -2.754 0.606 862 2HB SER 113 HB2 SER 113 3.467 -4.202 0.170 863 HG SER 113 HG SER 113 4.083 -2.183 -1.386 864 H LYS 114 HN LYS 114 4.056 -2.415 2.902 865 HA LYS 114 HA LYS 114 3.717 -4.754 4.374 866 1HB LYS 114 HB1 LYS 114 4.760 -2.111 5.404 867 2HB LYS 114 HB2 LYS 114 5.063 -3.695 6.101 868 1HG LYS 114 HG1 LYS 114 5.960 -2.799 3.369 869 2HG LYS 114 HG2 LYS 114 6.972 -2.855 4.814 870 1HD LYS 114 HD1 LYS 114 7.290 -5.064 4.641 871 2HD LYS 114 HD2 LYS 114 5.590 -5.367 4.272 872 1HE LYS 114 HE1 LYS 114 6.344 -4.213 1.973 873 2HE LYS 114 HE2 LYS 114 7.883 -4.925 2.457 874 1HZ LYS 114 HZ1 LYS 114 5.597 -6.193 1.366 875 2HZ LYS 114 HZ2 LYS 114 5.976 -6.879 2.865 876 3HZ LYS 114 HZ3 LYS 114 7.140 -6.830 1.638 877 H VAL 115 HN VAL 115 2.065 -1.648 4.615 878 HA VAL 115 HA VAL 115 0.847 -2.199 7.142 879 HB VAL 115 HB VAL 115 0.623 -0.074 5.108 880 1HG1 VAL 115 HG11 VAL 115 -1.501 0.784 5.936 881 2HG1 VAL 115 HG12 VAL 115 -1.689 -0.634 6.965 882 3HG1 VAL 115 HG13 VAL 115 -1.721 -0.808 5.210 883 1HG2 VAL 115 HG21 VAL 115 1.543 1.034 6.784 884 2HG2 VAL 115 HG22 VAL 115 1.402 -0.390 7.816 885 3HG2 VAL 115 HG23 VAL 115 0.089 0.788 7.753 886 H ASP 116 HN ASP 116 -0.425 -2.208 3.803 887 HA ASP 116 HA ASP 116 -2.923 -3.272 4.276 888 1HB ASP 116 HB1 ASP 116 -1.229 -2.842 2.023 889 2HB ASP 116 HB2 ASP 116 -1.923 -4.453 1.885 890 H GLU 117 HN GLU 117 0.161 -4.946 3.937 891 HA GLU 117 HA GLU 117 -0.979 -7.574 4.070 892 1HB GLU 117 HB1 GLU 117 1.783 -6.430 4.098 893 2HB GLU 117 HB2 GLU 117 1.554 -8.071 4.687 894 1HG GLU 117 HG2 GLU 117 0.149 -7.921 2.270 895 2HG GLU 117 HG1 GLU 117 1.687 -7.105 1.994 896 H ALA 118 HN ALA 118 0.349 -5.259 6.341 897 HA ALA 118 HA ALA 118 0.478 -7.008 8.572 898 1HB ALA 118 HB1 ALA 118 0.022 -4.063 8.830 899 2HB ALA 118 HB2 ALA 118 1.575 -4.699 8.285 900 3HB ALA 118 HB3 ALA 118 0.948 -5.145 9.872 901 H VAL 119 HN VAL 119 -2.069 -5.347 6.957 902 HA VAL 119 HA VAL 119 -3.987 -5.276 9.041 903 HB VAL 119 HB VAL 119 -4.584 -5.638 6.119 904 1HG1 VAL 119 HG11 VAL 119 -6.637 -4.382 6.773 905 2HG1 VAL 119 HG12 VAL 119 -6.120 -4.511 8.452 906 3HG1 VAL 119 HG13 VAL 119 -6.489 -5.970 7.529 907 1HG2 VAL 119 HG21 VAL 119 -3.802 -3.612 5.686 908 2HG2 VAL 119 HG22 VAL 119 -3.180 -3.516 7.334 909 3HG2 VAL 119 HG23 VAL 119 -4.802 -2.928 6.966 910 H ALA 120 HN ALA 120 -3.352 -7.553 6.417 911 HA ALA 120 HA ALA 120 -5.232 -9.506 7.088 912 1HB ALA 120 HB1 ALA 120 -4.360 -10.439 5.260 913 2HB ALA 120 HB2 ALA 120 -2.836 -10.722 6.105 914 3HB ALA 120 HB3 ALA 120 -3.103 -9.196 5.256 915 H VAL 121 HN VAL 121 -2.238 -8.582 8.494 916 HA VAL 121 HA VAL 121 -1.883 -10.977 10.058 917 HB VAL 121 HB VAL 121 -0.442 -8.340 9.909 918 1HG1 VAL 121 HG21 VAL 121 0.887 -10.385 11.485 919 2HG1 VAL 121 HG22 VAL 121 -0.610 -9.814 12.221 920 3HG1 VAL 121 HG23 VAL 121 0.662 -8.665 11.810 921 1HG2 VAL 121 HG11 VAL 121 1.209 -9.467 8.776 922 2HG2 VAL 121 HG12 VAL 121 -0.232 -10.318 8.220 923 3HG2 VAL 121 HG13 VAL 121 0.779 -11.025 9.480 924 H LEU 122 HN LEU 122 -3.186 -7.753 10.457 925 HA LEU 122 HA LEU 122 -3.384 -7.868 13.307 926 1HB LEU 122 HB2 LEU 122 -3.765 -5.692 13.037 927 2HB LEU 122 HB1 LEU 122 -3.749 -5.920 11.300 928 HG LEU 122 HG LEU 122 -6.329 -6.671 12.134 929 1HD1 LEU 122 HD11 LEU 122 -5.187 -4.520 13.795 930 2HD1 LEU 122 HD12 LEU 122 -6.512 -5.635 14.128 931 3HD1 LEU 122 HD13 LEU 122 -6.786 -4.218 13.114 932 1HD2 LEU 122 HD21 LEU 122 -5.986 -5.664 10.041 933 2HD2 LEU 122 HD22 LEU 122 -5.193 -4.260 10.756 934 3HD2 LEU 122 HD23 LEU 122 -6.926 -4.499 10.973 935 H GLN 123 HN GLN 123 -5.600 -8.412 10.607 936 HA GLN 123 HA GLN 123 -7.895 -8.966 12.159 937 1HB GLN 123 HB1 GLN 123 -7.099 -9.762 9.355 938 2HB GLN 123 HB2 GLN 123 -8.663 -10.165 10.053 939 1HG GLN 123 HG1 GLN 123 -7.583 -7.374 9.714 940 2HG GLN 123 HG2 GLN 123 -8.722 -8.163 8.623 941 1HE2 GLN 123 HE22 GLN 123 -8.317 -6.430 11.528 942 2HE2 GLN 123 HE21 GLN 123 -9.972 -6.408 12.020 943 H ALA 124 HN ALA 124 -5.133 -10.829 11.192 944 HA ALA 124 HA ALA 124 -6.207 -13.401 11.900 945 1HB ALA 124 HB1 ALA 124 -3.695 -13.997 11.821 946 2HB ALA 124 HB2 ALA 124 -3.490 -12.366 11.179 947 3HB ALA 124 HB3 ALA 124 -4.506 -13.529 10.326 948 H HIS 125 HN HIS 125 -3.839 -11.199 13.429 949 HA HIS 125 HA HIS 125 -3.571 -12.830 15.711 950 1HB HIS 125 HB1 HIS 125 -2.167 -10.732 14.732 951 2HB HIS 125 HB2 HIS 125 -3.055 -9.923 16.018 952 HD2 HIS 125 HD2 HIS 125 0.277 -10.807 15.918 953 HE1 HIS 125 HE1 HIS 125 -0.958 -12.867 19.404 954 HE2 HIS 125 HE2 HIS 125 1.033 -11.990 18.100 955 H GLN 126 HN GLN 126 -6.007 -10.624 14.789 956 HA GLN 126 HA GLN 126 -6.894 -10.127 17.511 957 1HB GLN 126 HB1 GLN 126 -7.873 -9.252 14.804 958 2HB GLN 126 HB2 GLN 126 -8.842 -8.999 16.250 959 1HG GLN 126 HG2 GLN 126 -6.014 -8.081 16.251 960 2HG GLN 126 HG1 GLN 126 -7.212 -7.149 15.353 961 1HE2 GLN 126 HE22 GLN 126 -5.934 -5.957 17.398 962 2HE2 GLN 126 HE21 GLN 126 -6.998 -5.741 18.742 963 H ALA 127 HN ALA 127 -8.037 -11.843 14.624 964 HA ALA 127 HA ALA 127 -10.181 -13.069 16.183 965 1HB ALA 127 HB1 ALA 127 -10.659 -12.098 13.949 966 2HB ALA 127 HB2 ALA 127 -11.098 -13.800 14.093 967 3HB ALA 127 HB3 ALA 127 -9.629 -13.339 13.235 968 H LYS 128 HN LYS 128 -7.430 -14.057 14.144 969 HA LYS 128 HA LYS 128 -7.749 -16.806 15.042 970 1HB LYS 128 HB2 LYS 128 -6.732 -17.423 13.107 971 2HB LYS 128 HB1 LYS 128 -7.187 -15.804 12.600 972 1HG LYS 128 HG1 LYS 128 -5.080 -15.107 12.473 973 2HG LYS 128 HG2 LYS 128 -4.600 -15.946 13.947 974 1HD LYS 128 HD2 LYS 128 -3.551 -17.436 12.678 975 2HD LYS 128 HD1 LYS 128 -5.130 -17.967 12.096 976 1HE LYS 128 HE1 LYS 128 -5.026 -16.453 10.243 977 2HE LYS 128 HE2 LYS 128 -3.557 -15.709 10.874 978 1HZ LYS 128 HZ1 LYS 128 -2.661 -18.135 10.690 979 2HZ LYS 128 HZ2 LYS 128 -2.703 -17.134 9.326 980 3HZ LYS 128 HZ3 LYS 128 -3.902 -18.305 9.553 981 H GLU 129 HN GLU 129 -5.460 -17.883 15.090 982 HA GLU 129 HA GLU 129 -4.018 -16.652 17.320 983 1HB GLU 129 HB1 GLU 129 -2.835 -18.992 17.229 984 2HB GLU 129 HB2 GLU 129 -4.428 -18.836 17.956 985 1HG GLU 129 HG2 GLU 129 -5.466 -19.643 15.919 986 2HG GLU 129 HG1 GLU 129 -3.888 -19.743 15.137 987 H ALA 130 HN ALA 130 -3.405 -15.133 15.378 988 HA ALA 130 HA ALA 130 -1.678 -15.956 13.376 989 1HB ALA 130 HB1 ALA 130 -2.628 -13.804 13.210 990 2HB ALA 130 HB2 ALA 130 -0.888 -13.560 13.369 991 3HB ALA 130 HB3 ALA 130 -1.945 -13.301 14.757 992 H ALA 131 HN ALA 131 -1.059 -15.521 16.744 993 HA ALA 131 HA ALA 131 1.797 -15.263 16.491 994 1HB ALA 131 HB1 ALA 131 1.539 -15.909 19.050 995 2HB ALA 131 HB2 ALA 131 -0.136 -15.454 18.734 996 3HB ALA 131 HB3 ALA 131 1.162 -14.294 18.449 997 H GLN 132 HN GLN 132 2.709 -16.982 15.473 998 HA GLN 132 HA GLN 132 1.942 -19.690 16.060 999 1HB GLN 132 HB2 GLN 132 4.064 -18.434 14.337 1000 2HB GLN 132 HB1 GLN 132 4.026 -20.170 14.609 1001 1HG GLN 132 HG1 GLN 132 2.236 -20.476 13.281 1002 2HG GLN 132 HG2 GLN 132 1.482 -18.956 13.763 1003 1HE2 GLN 132 HE22 GLN 132 0.986 -18.721 11.503 1004 2HE2 GLN 132 HE21 GLN 132 2.180 -18.092 10.424 1005 H LYS 133 HN LYS 133 4.009 -21.234 16.338 1006 HA LYS 133 HA LYS 133 5.106 -20.498 18.930 1007 1HB LYS 133 HB1 LYS 133 5.448 -23.106 17.444 1008 2HB LYS 133 HB2 LYS 133 5.713 -22.813 19.157 1009 1HG LYS 133 HG2 LYS 133 3.064 -22.059 18.661 1010 2HG LYS 133 HG1 LYS 133 3.312 -23.573 17.787 1011 1HD LYS 133 HD2 LYS 133 3.746 -24.767 19.703 1012 2HD LYS 133 HD1 LYS 133 4.304 -23.346 20.589 1013 1HE LYS 133 HE2 LYS 133 1.666 -22.763 20.027 1014 2HE LYS 133 HE1 LYS 133 1.638 -24.490 20.381 1015 1HZ LYS 133 HZ1 LYS 133 1.829 -24.041 22.525 1016 2HZ LYS 133 HZ2 LYS 133 1.766 -22.385 22.190 1017 3HZ LYS 133 HZ3 LYS 133 3.259 -23.176 22.270 1018 H ALA 134 HN ALA 134 6.184 -18.946 16.935 1019 HA ALA 134 HA ALA 134 8.609 -19.989 15.880 1020 1HB ALA 134 HB1 ALA 134 8.134 -18.193 14.627 1021 2HB ALA 134 HB2 ALA 134 8.996 -17.297 15.877 1022 3HB ALA 134 HB3 ALA 134 7.236 -17.402 15.923 1023 H VAL 135 HN VAL 135 10.736 -18.767 16.376 1024 HA VAL 135 HA VAL 135 11.337 -19.245 19.153 1025 HB VAL 135 HB VAL 135 13.664 -18.653 18.514 1026 1HG1 VAL 135 HG21 VAL 135 12.177 -20.709 16.904 1027 2HG1 VAL 135 HG22 VAL 135 13.123 -20.941 18.374 1028 3HG1 VAL 135 HG23 VAL 135 13.933 -20.556 16.855 1029 1HG2 VAL 135 HG11 VAL 135 12.391 -17.385 16.352 1030 2HG2 VAL 135 HG12 VAL 135 13.331 -18.712 15.670 1031 3HG2 VAL 135 HG13 VAL 135 14.120 -17.496 16.675 1032 H ASN 136 HN ASN 136 13.270 -17.430 19.771 1033 HA ASN 136 HA ASN 136 11.753 -15.198 20.641 1034 1HB ASN 136 HB2 ASN 136 14.427 -16.260 21.056 1035 2HB ASN 136 HB1 ASN 136 14.442 -14.504 20.923 1036 1HD2 ASN 136 HD21 ASN 136 14.680 -13.830 22.943 1037 2HD2 ASN 136 HD22 ASN 136 13.663 -14.266 24.271 1038 H SER 137 HN SER 137 11.988 -12.993 20.098 1039 HA SER 137 HA SER 137 12.370 -12.526 17.296 1040 1HB SER 137 HB2 SER 137 11.211 -11.107 19.560 1041 2HB SER 137 HB1 SER 137 12.147 -10.035 18.519 1042 HG SER 137 HG SER 137 10.698 -11.634 16.972 1043 H ALA 138 HN ALA 138 13.573 -10.309 16.792 1044 HA ALA 138 HA ALA 138 16.345 -10.817 17.413 1045 1HB ALA 138 HB1 ALA 138 15.785 -10.251 15.146 1046 2HB ALA 138 HB2 ALA 138 16.776 -8.961 15.825 1047 3HB ALA 138 HB3 ALA 138 15.034 -8.742 15.664 1048 H THR 139 HN THR 139 16.137 -10.354 19.725 1049 HA THR 139 HA THR 139 16.155 -7.463 20.293 1050 HB THR 139 HB THR 139 14.386 -8.276 21.567 1051 HG1 THR 139 HG1 THR 139 16.403 -8.824 23.439 1052 1HG2 THR 139 HG21 THR 139 14.599 -10.638 21.153 1053 2HG2 THR 139 HG22 THR 139 14.426 -10.340 22.883 1054 3HG2 THR 139 HG23 THR 139 16.010 -10.723 22.207 1055 H GLY 140 HN GLY 140 17.565 -10.556 21.359 1056 1HA GLY 140 HA2 GLY 140 19.926 -9.068 22.301 1057 2HA GLY 140 HA1 GLY 140 19.468 -10.681 22.827 1058 H VAL 141 HN VAL 141 20.682 -8.829 20.074 1059 HA VAL 141 HA VAL 141 21.627 -11.280 18.799 1060 HB VAL 141 HB VAL 141 20.562 -9.717 17.312 1061 1HG1 VAL 141 HG11 VAL 141 22.318 -7.534 17.164 1062 2HG1 VAL 141 HG12 VAL 141 21.971 -7.770 18.877 1063 3HG1 VAL 141 HG13 VAL 141 20.649 -7.540 17.734 1064 1HG2 VAL 141 HG21 VAL 141 22.867 -9.045 16.012 1065 2HG2 VAL 141 HG22 VAL 141 22.061 -10.610 15.908 1066 3HG2 VAL 141 HG23 VAL 141 23.398 -10.380 17.036 1067 HA PRO 142 HA PRO 142 25.671 -10.983 20.628 1068 1HB PRO 142 HB1 PRO 142 26.518 -12.265 18.080 1069 2HB PRO 142 HB2 PRO 142 26.825 -12.761 19.747 1070 1HG PRO 142 HG1 PRO 142 25.038 -14.051 18.251 1071 2HG PRO 142 HG2 PRO 142 24.741 -13.754 19.974 1072 1HD PRO 142 HD1 PRO 142 23.598 -12.370 17.586 1073 2HD PRO 142 HD2 PRO 142 22.823 -12.785 19.129 1074 H THR 143 HN THR 143 26.254 -8.854 20.584 1075 HA THR 143 HA THR 143 27.169 -7.715 18.038 1076 HB THR 143 HB THR 143 27.228 -5.805 20.166 1077 HG1 THR 143 HG1 THR 143 25.736 -7.012 21.277 1078 1HG2 THR 143 HG21 THR 143 26.606 -4.618 18.411 1079 2HG2 THR 143 HG22 THR 143 24.982 -5.271 18.636 1080 3HG2 THR 143 HG23 THR 143 26.105 -6.060 17.529 1081 H VAL 144 HN VAL 144 29.260 -8.092 17.682 1082 HA VAL 144 HA VAL 144 31.137 -8.237 19.902 1083 HB VAL 144 HB VAL 144 32.804 -8.777 18.084 1084 1HG1 VAL 144 HG21 VAL 144 30.608 -10.747 17.816 1085 2HG1 VAL 144 HG22 VAL 144 31.166 -10.378 19.448 1086 3HG1 VAL 144 HG23 VAL 144 32.302 -10.987 18.245 1087 1HG2 VAL 144 HG11 VAL 144 32.278 -8.588 15.933 1088 2HG2 VAL 144 HG12 VAL 144 30.758 -7.840 16.425 1089 3HG2 VAL 144 HG13 VAL 144 30.835 -9.579 16.144 Start of MODEL 27 1 1H GLY 1 HT1 GLY 1 22.579 46.087 13.662 2 2H GLY 1 HT2 GLY 1 23.196 45.339 12.276 3 3H GLY 1 HT3 GLY 1 23.483 46.983 12.548 4 1HA GLY 1 HA1 GLY 1 24.533 44.721 14.159 5 2HA GLY 1 HA2 GLY 1 25.461 45.721 13.052 6 HA PRO 2 HA PRO 2 25.047 47.518 17.531 7 1HB PRO 2 HB2 PRO 2 27.411 46.622 18.580 8 2HB PRO 2 HB1 PRO 2 25.860 45.809 18.813 9 1HG PRO 2 HG1 PRO 2 28.054 45.191 16.873 10 2HG PRO 2 HG2 PRO 2 27.076 44.079 17.849 11 1HD PRO 2 HD2 PRO 2 26.580 44.497 15.235 12 2HD PRO 2 HD1 PRO 2 25.276 44.192 16.401 13 H LEU 3 HN LEU 3 28.449 46.945 16.753 14 HA LEU 3 HA LEU 3 28.797 49.838 16.427 15 1HB LEU 3 HB2 LEU 3 30.732 47.614 17.055 16 2HB LEU 3 HB1 LEU 3 31.254 49.242 16.669 17 HG LEU 3 HG LEU 3 29.373 49.594 18.692 18 1HD1 LEU 3 HD21 LEU 3 30.594 48.070 20.442 19 2HD1 LEU 3 HD22 LEU 3 30.883 47.050 19.033 20 3HD1 LEU 3 HD23 LEU 3 29.233 47.456 19.504 21 1HD2 LEU 3 HD11 LEU 3 31.243 50.973 18.644 22 2HD2 LEU 3 HD12 LEU 3 32.364 49.615 18.567 23 3HD2 LEU 3 HD13 LEU 3 31.515 49.972 20.070 24 H GLY 4 HN GLY 4 29.170 46.786 14.772 25 1HA GLY 4 HA2 GLY 4 30.605 47.966 12.543 26 2HA GLY 4 HA1 GLY 4 30.083 46.293 12.683 27 H SER 5 HN SER 5 29.543 49.210 11.151 28 HA SER 5 HA SER 5 26.759 48.556 10.492 29 1HB SER 5 HB1 SER 5 27.667 50.931 11.238 30 2HB SER 5 HB2 SER 5 28.085 51.058 9.529 31 HG SER 5 HG SER 5 25.674 51.285 10.713 32 H ALA 6 HN ALA 6 28.693 46.878 9.415 33 HA ALA 6 HA ALA 6 29.374 45.935 7.460 34 1HB ALA 6 HB1 ALA 6 27.312 47.664 6.115 35 2HB ALA 6 HB2 ALA 6 26.913 46.206 7.021 36 3HB ALA 6 HB3 ALA 6 27.932 46.100 5.586 37 H ALA 7 HN ALA 7 29.644 46.843 4.882 38 HA ALA 7 HA ALA 7 31.818 48.757 5.201 39 1HB ALA 7 HB1 ALA 7 31.002 46.997 2.899 40 2HB ALA 7 HB2 ALA 7 32.383 46.791 3.975 41 3HB ALA 7 HB3 ALA 7 32.344 48.139 2.838 42 H ALA 8 HN ALA 8 29.019 48.315 3.034 43 HA ALA 8 HA ALA 8 29.169 51.138 2.292 44 1HB ALA 8 HB1 ALA 8 27.006 49.892 0.982 45 2HB ALA 8 HB2 ALA 8 28.351 48.752 0.956 46 3HB ALA 8 HB3 ALA 8 28.559 50.376 0.302 47 H ALA 9 HN ALA 9 26.584 51.752 1.726 48 HA ALA 9 HA ALA 9 25.443 51.988 4.404 49 1HB ALA 9 HB1 ALA 9 25.611 53.707 2.148 50 2HB ALA 9 HB2 ALA 9 24.982 54.056 3.757 51 3HB ALA 9 HB3 ALA 9 23.908 53.426 2.508 52 H THR 10 HN THR 10 22.839 52.276 4.101 53 HA THR 10 HA THR 10 21.948 49.722 2.937 54 HB THR 10 HB THR 10 20.111 50.894 4.861 55 HG1 THR 10 HG1 THR 10 21.842 50.087 6.540 56 1HG2 THR 10 HG21 THR 10 21.067 48.314 4.111 57 2HG2 THR 10 HG22 THR 10 19.643 48.750 5.054 58 3HG2 THR 10 HG23 THR 10 21.195 48.512 5.859 59 HA PRO 11 HA PRO 11 19.829 52.825 0.321 60 1HB PRO 11 HB1 PRO 11 19.455 51.137 -1.777 61 2HB PRO 11 HB2 PRO 11 20.960 52.023 -1.509 62 1HG PRO 11 HG2 PRO 11 20.289 49.182 -0.843 63 2HG PRO 11 HG1 PRO 11 21.772 49.843 -1.556 64 1HD PRO 11 HD2 PRO 11 21.587 49.198 1.063 65 2HD PRO 11 HD1 PRO 11 22.592 50.542 0.484 66 H ALA 12 HN ALA 12 17.729 53.214 0.571 67 HA ALA 12 HA ALA 12 15.927 50.989 1.179 68 1HB ALA 12 HB1 ALA 12 16.150 53.131 2.606 69 2HB ALA 12 HB2 ALA 12 14.541 52.494 2.268 70 3HB ALA 12 HB3 ALA 12 15.153 53.873 1.355 71 H VAL 13 HN VAL 13 16.604 53.368 -1.246 72 HA VAL 13 HA VAL 13 14.073 52.926 -2.617 73 HB VAL 13 HB VAL 13 14.781 55.185 -2.693 74 1HG1 VAL 13 HG21 VAL 13 17.267 54.941 -4.157 75 2HG1 VAL 13 HG22 VAL 13 17.352 54.160 -2.578 76 3HG1 VAL 13 HG23 VAL 13 16.901 55.861 -2.698 77 1HG2 VAL 13 HG11 VAL 13 13.847 54.318 -4.790 78 2HG2 VAL 13 HG12 VAL 13 15.477 53.951 -5.355 79 3HG2 VAL 13 HG13 VAL 13 14.997 55.624 -5.072 80 H ARG 14 HN ARG 14 13.874 51.153 -3.806 81 HA ARG 14 HA ARG 14 16.241 50.023 -5.116 82 1HB ARG 14 HB1 ARG 14 13.685 48.917 -4.103 83 2HB ARG 14 HB2 ARG 14 14.334 48.172 -5.558 84 1HG ARG 14 HG1 ARG 14 15.810 47.025 -4.375 85 2HG ARG 14 HG2 ARG 14 16.421 48.501 -3.622 86 1HD ARG 14 HD1 ARG 14 14.379 48.360 -2.097 87 2HD ARG 14 HD2 ARG 14 14.193 46.712 -2.696 88 HE ARG 14 HE ARG 14 16.472 47.716 -1.130 89 1HH1 ARG 14 HH11 ARG 14 14.570 45.087 -2.402 90 2HH1 ARG 14 HH12 ARG 14 15.383 43.876 -1.470 91 1HH2 ARG 14 HH21 ARG 14 17.548 46.127 0.102 92 2HH2 ARG 14 HH22 ARG 14 17.076 44.467 -0.046 93 H THR 15 HN THR 15 16.429 49.858 -7.288 94 HA THR 15 HA THR 15 14.275 51.059 -8.895 95 HB THR 15 HB THR 15 16.278 52.349 -9.094 96 HG1 THR 15 HG1 THR 15 16.747 52.053 -11.313 97 1HG2 THR 15 HG21 THR 15 18.048 51.053 -8.361 98 2HG2 THR 15 HG22 THR 15 18.350 51.223 -10.090 99 3HG2 THR 15 HG23 THR 15 17.661 49.727 -9.459 100 H VAL 16 HN VAL 16 13.409 49.973 -10.591 101 HA VAL 16 HA VAL 16 14.421 47.248 -11.076 102 HB VAL 16 HB VAL 16 12.270 47.102 -10.021 103 1HG1 VAL 16 HG21 VAL 16 11.256 48.939 -12.187 104 2HG1 VAL 16 HG22 VAL 16 11.467 49.353 -10.485 105 3HG1 VAL 16 HG23 VAL 16 10.267 48.149 -10.959 106 1HG2 VAL 16 HG11 VAL 16 12.889 45.836 -12.300 107 2HG2 VAL 16 HG12 VAL 16 11.402 46.638 -12.806 108 3HG2 VAL 16 HG13 VAL 16 11.391 45.554 -11.415 109 HA PRO 17 HA PRO 17 14.688 45.802 -12.358 110 1HB PRO 17 HB1 PRO 17 16.593 45.324 -14.442 111 2HB PRO 17 HB2 PRO 17 15.034 44.536 -14.197 112 1HG PRO 17 HG2 PRO 17 15.638 46.203 -16.313 113 2HG PRO 17 HG1 PRO 17 14.000 45.848 -15.742 114 1HD PRO 17 HD1 PRO 17 15.719 48.235 -15.208 115 2HD PRO 17 HD2 PRO 17 13.967 48.146 -15.494 116 H GLN 18 HN GLN 18 16.924 44.810 -11.886 117 HA GLN 18 HA GLN 18 18.684 46.981 -10.996 118 1HB GLN 18 HB1 GLN 18 18.796 44.088 -10.145 119 2HB GLN 18 HB2 GLN 18 19.537 45.471 -9.353 120 1HG GLN 18 HG2 GLN 18 17.003 46.254 -9.213 121 2HG GLN 18 HG1 GLN 18 16.740 44.511 -9.279 122 1HE2 GLN 18 HE21 GLN 18 17.893 43.202 -7.692 123 2HE2 GLN 18 HE22 GLN 18 18.183 43.861 -6.122 124 H TYR 19 HN TYR 19 19.478 47.183 -13.229 125 HA TYR 19 HA TYR 19 20.915 45.084 -14.478 126 1HB TYR 19 HB1 TYR 19 19.934 47.255 -15.506 127 2HB TYR 19 HB2 TYR 19 21.447 47.997 -14.996 128 HD1 TYR 19 HD1 TYR 19 23.575 47.314 -16.017 129 HD2 TYR 19 HD2 TYR 19 19.865 45.715 -17.354 130 HE1 TYR 19 HE1 TYR 19 24.667 46.507 -18.066 131 HE2 TYR 19 HE2 TYR 19 20.948 44.903 -19.406 132 HH TYR 19 HH TYR 19 23.601 45.936 -20.617 133 H LYS 20 HN LYS 20 21.722 47.367 -12.032 134 HA LYS 20 HA LYS 20 24.584 46.790 -12.324 135 1HB LYS 20 HB2 LYS 20 23.250 49.156 -11.793 136 2HB LYS 20 HB1 LYS 20 23.836 48.662 -10.210 137 1HG LYS 20 HG1 LYS 20 26.017 48.268 -11.849 138 2HG LYS 20 HG2 LYS 20 25.284 49.745 -12.477 139 1HD LYS 20 HD2 LYS 20 25.278 49.840 -9.622 140 2HD LYS 20 HD1 LYS 20 26.903 49.440 -10.182 141 1HE LYS 20 HE2 LYS 20 25.583 51.574 -11.698 142 2HE LYS 20 HE1 LYS 20 25.889 51.962 -10.005 143 1HZ LYS 20 HZ1 LYS 20 27.774 52.636 -11.238 144 2HZ LYS 20 HZ2 LYS 20 27.873 51.159 -12.055 145 3HZ LYS 20 HZ3 LYS 20 28.229 51.236 -10.404 146 H TYR 21 HN TYR 21 25.834 46.314 -10.390 147 HA TYR 21 HA TYR 21 24.417 44.427 -8.689 148 1HB TYR 21 HB2 TYR 21 27.377 45.047 -8.840 149 2HB TYR 21 HB1 TYR 21 26.640 43.699 -7.980 150 HD1 TYR 21 HD1 TYR 21 25.536 41.871 -9.279 151 HD2 TYR 21 HD2 TYR 21 27.821 44.922 -11.168 152 HE1 TYR 21 HE1 TYR 21 25.719 40.476 -11.295 153 HE2 TYR 21 HE2 TYR 21 28.009 43.536 -13.190 154 HH TYR 21 HH TYR 21 27.524 40.376 -13.307 155 H ALA 22 HN ALA 22 23.275 45.668 -7.239 156 HA ALA 22 HA ALA 22 24.517 47.810 -5.773 157 1HB ALA 22 HB1 ALA 22 22.081 46.906 -4.564 158 2HB ALA 22 HB2 ALA 22 21.885 47.002 -6.314 159 3HB ALA 22 HB3 ALA 22 22.415 48.418 -5.408 160 H ALA 23 HN ALA 23 22.943 44.809 -4.650 161 HA ALA 23 HA ALA 23 24.288 44.902 -2.128 162 1HB ALA 23 HB1 ALA 23 22.224 43.896 -1.954 163 2HB ALA 23 HB2 ALA 23 23.294 42.494 -2.010 164 3HB ALA 23 HB3 ALA 23 22.419 42.994 -3.458 165 H GLY 24 HN GLY 24 26.152 43.983 -1.520 166 1HA GLY 24 HA1 GLY 24 27.724 42.607 -3.554 167 2HA GLY 24 HA2 GLY 24 28.313 43.206 -2.010 168 H VAL 25 HN VAL 25 25.630 41.012 -2.798 169 HA VAL 25 HA VAL 25 26.451 39.198 -0.714 170 HB VAL 25 HB VAL 25 24.484 37.868 -1.379 171 1HG1 VAL 25 HG21 VAL 25 24.171 39.614 0.246 172 2HG1 VAL 25 HG22 VAL 25 22.773 39.578 -0.828 173 3HG1 VAL 25 HG23 VAL 25 24.006 40.824 -1.028 174 1HG2 VAL 25 HG11 VAL 25 24.574 38.344 -3.791 175 2HG2 VAL 25 HG12 VAL 25 24.062 40.001 -3.471 176 3HG2 VAL 25 HG13 VAL 25 22.978 38.657 -3.111 177 H ARG 26 HN ARG 26 26.160 36.728 -1.432 178 HA ARG 26 HA ARG 26 28.281 36.285 -3.379 179 1HB ARG 26 HB1 ARG 26 27.022 33.985 -1.996 180 2HB ARG 26 HB2 ARG 26 28.720 34.322 -2.303 181 1HG ARG 26 HG2 ARG 26 28.799 34.687 -0.096 182 2HG ARG 26 HG1 ARG 26 28.137 36.268 -0.517 183 1HD ARG 26 HD2 ARG 26 26.485 35.768 0.902 184 2HD ARG 26 HD1 ARG 26 25.892 34.703 -0.371 185 HE ARG 26 HE ARG 26 27.231 32.921 0.765 186 1HH1 ARG 26 HH11 ARG 26 26.079 35.702 2.519 187 2HH1 ARG 26 HH12 ARG 26 26.053 34.888 4.048 188 1HH2 ARG 26 HH21 ARG 26 27.199 31.841 2.774 189 2HH2 ARG 26 HH22 ARG 26 26.689 32.694 4.193 190 H ASN 27 HN ASN 27 25.300 34.467 -2.677 191 HA ASN 27 HA ASN 27 25.036 33.863 -5.517 192 1HB ASN 27 HB2 ASN 27 23.184 32.856 -3.373 193 2HB ASN 27 HB1 ASN 27 23.625 32.096 -4.899 194 1HD2 ASN 27 HD21 ASN 27 23.819 31.478 -1.865 195 2HD2 ASN 27 HD22 ASN 27 25.408 30.815 -1.716 196 HA PRO 28 HA PRO 28 22.113 37.134 -6.242 197 1HB PRO 28 HB2 PRO 28 21.046 35.231 -8.265 198 2HB PRO 28 HB1 PRO 28 21.550 36.913 -8.457 199 1HG PRO 28 HG1 PRO 28 23.085 34.926 -9.345 200 2HG PRO 28 HG2 PRO 28 23.801 36.360 -8.586 201 1HD PRO 28 HD1 PRO 28 23.393 33.621 -7.463 202 2HD PRO 28 HD2 PRO 28 24.745 34.747 -7.228 203 H GLN 29 HN GLN 29 20.840 33.803 -6.427 204 HA GLN 29 HA GLN 29 18.320 34.718 -5.261 205 1HB GLN 29 HB1 GLN 29 18.884 31.896 -6.121 206 2HB GLN 29 HB2 GLN 29 17.344 32.740 -6.053 207 1HG GLN 29 HG2 GLN 29 19.340 33.864 -7.902 208 2HG GLN 29 HG1 GLN 29 18.706 32.273 -8.320 209 1HE2 GLN 29 HE21 GLN 29 17.584 32.987 -10.098 210 2HE2 GLN 29 HE22 GLN 29 16.171 33.976 -9.983 211 H GLN 30 HN GLN 30 19.209 35.105 -3.152 212 HA GLN 30 HA GLN 30 20.137 32.777 -1.663 213 1HB GLN 30 HB1 GLN 30 20.886 35.394 -1.573 214 2HB GLN 30 HB2 GLN 30 19.750 35.326 -0.232 215 1HG GLN 30 HG1 GLN 30 21.412 34.567 1.014 216 2HG GLN 30 HG2 GLN 30 21.328 33.069 0.088 217 1HE2 GLN 30 HE21 GLN 30 22.480 36.319 -0.730 218 2HE2 GLN 30 HE22 GLN 30 24.071 35.827 -1.190 219 H HIS 31 HN HIS 31 18.071 35.393 -0.474 220 HA HIS 31 HA HIS 31 16.127 33.352 0.386 221 1HB HIS 31 HB1 HIS 31 17.406 35.582 1.843 222 2HB HIS 31 HB2 HIS 31 15.677 35.396 2.116 223 HD2 HIS 31 HD2 HIS 31 16.057 34.474 4.700 224 HE1 HIS 31 HE1 HIS 31 18.015 30.907 3.529 225 HE2 HIS 31 HE2 HIS 31 16.952 32.160 5.461 226 H LEU 32 HN LEU 32 16.640 36.098 -1.492 227 HA LEU 32 HA LEU 32 14.009 37.225 -1.311 228 1HB LEU 32 HB1 LEU 32 16.491 37.771 -2.771 229 2HB LEU 32 HB2 LEU 32 15.041 38.114 -3.697 230 HG LEU 32 HG LEU 32 14.261 39.523 -1.742 231 1HD1 LEU 32 HD11 LEU 32 16.868 38.605 -0.732 232 2HD1 LEU 32 HD12 LEU 32 15.426 39.119 0.142 233 3HD1 LEU 32 HD13 LEU 32 16.530 40.323 -0.523 234 1HD2 LEU 32 HD21 LEU 32 16.708 40.872 -2.525 235 2HD2 LEU 32 HD22 LEU 32 15.028 41.278 -2.876 236 3HD2 LEU 32 HD23 LEU 32 15.887 40.119 -3.891 237 H ASN 33 HN ASN 33 12.230 36.522 -2.271 238 HA ASN 33 HA ASN 33 12.461 34.473 -4.351 239 1HB ASN 33 HB1 ASN 33 9.853 34.439 -3.850 240 2HB ASN 33 HB2 ASN 33 11.000 33.604 -2.805 241 1HD2 ASN 33 HD21 ASN 33 8.776 36.214 -3.102 242 2HD2 ASN 33 HD22 ASN 33 8.834 36.736 -1.456 243 H ALA 34 HN ALA 34 11.547 34.674 -6.360 244 HA ALA 34 HA ALA 34 11.140 37.357 -7.310 245 1HB ALA 34 HB1 ALA 34 10.572 34.991 -9.022 246 2HB ALA 34 HB2 ALA 34 12.231 35.276 -8.495 247 3HB ALA 34 HB3 ALA 34 11.375 36.509 -9.421 248 H GLN 35 HN GLN 35 9.241 37.294 -9.177 249 HA GLN 35 HA GLN 35 6.792 37.027 -7.601 250 1HB GLN 35 HB1 GLN 35 7.723 39.030 -9.274 251 2HB GLN 35 HB2 GLN 35 6.513 38.212 -10.254 252 1HG GLN 35 HG1 GLN 35 4.796 38.690 -8.747 253 2HG GLN 35 HG2 GLN 35 5.924 39.073 -7.447 254 1HE2 GLN 35 HE21 GLN 35 5.873 41.140 -6.979 255 2HE2 GLN 35 HE22 GLN 35 5.737 42.442 -8.107 256 HA PRO 36 HA PRO 36 6.138 33.217 -9.955 257 1HB PRO 36 HB1 PRO 36 3.825 32.549 -8.651 258 2HB PRO 36 HB2 PRO 36 5.442 32.185 -8.037 259 1HG PRO 36 HG1 PRO 36 3.601 34.435 -7.319 260 2HG PRO 36 HG2 PRO 36 4.610 33.431 -6.259 261 1HD PRO 36 HD1 PRO 36 5.346 35.916 -6.984 262 2HD PRO 36 HD2 PRO 36 6.534 34.615 -6.761 263 H GLN 37 HN GLN 37 5.213 33.132 -11.893 264 HA GLN 37 HA GLN 37 2.961 34.916 -12.467 265 1HB GLN 37 HB2 GLN 37 5.299 34.372 -13.860 266 2HB GLN 37 HB1 GLN 37 4.075 33.469 -14.741 267 1HG GLN 37 HG1 GLN 37 2.790 35.804 -14.462 268 2HG GLN 37 HG2 GLN 37 4.458 36.377 -14.464 269 1HE2 GLN 37 HE22 GLN 37 2.160 34.394 -16.262 270 2HE2 GLN 37 HE21 GLN 37 2.851 34.686 -17.818 271 H VAL 38 HN VAL 38 1.781 33.760 -14.600 272 HA VAL 38 HA VAL 38 0.229 31.676 -13.376 273 HB VAL 38 HB VAL 38 -0.029 32.431 -16.265 274 1HG1 VAL 38 HG11 VAL 38 -2.077 31.513 -16.124 275 2HG1 VAL 38 HG12 VAL 38 -2.376 32.173 -14.515 276 3HG1 VAL 38 HG13 VAL 38 -1.417 30.705 -14.702 277 1HG2 VAL 38 HG21 VAL 38 -0.390 34.571 -15.796 278 2HG2 VAL 38 HG22 VAL 38 -0.143 34.273 -14.075 279 3HG2 VAL 38 HG23 VAL 38 -1.749 34.090 -14.780 280 H THR 39 HN THR 39 3.028 31.754 -15.280 281 HA THR 39 HA THR 39 2.604 29.187 -16.552 282 HB THR 39 HB THR 39 5.287 30.500 -16.426 283 HG1 THR 39 HG1 THR 39 2.988 31.605 -17.514 284 1HG2 THR 39 HG21 THR 39 4.236 29.750 -19.018 285 2HG2 THR 39 HG22 THR 39 4.280 28.402 -17.882 286 3HG2 THR 39 HG23 THR 39 5.752 29.308 -18.233 287 H MET 40 HN MET 40 2.198 28.491 -14.131 288 HA MET 40 HA MET 40 4.657 27.811 -12.741 289 1HB MET 40 HB1 MET 40 1.738 27.643 -12.096 290 2HB MET 40 HB2 MET 40 2.877 26.659 -11.187 291 1HG MET 40 HG1 MET 40 3.322 29.598 -11.499 292 2HG MET 40 HG2 MET 40 2.202 28.979 -10.286 293 1HE MET 40 HE1 MET 40 4.196 26.677 -8.177 294 2HE MET 40 HE2 MET 40 2.640 27.269 -8.760 295 3HE MET 40 HE3 MET 40 3.550 28.202 -7.572 296 H GLN 41 HN GLN 41 4.116 25.405 -11.605 297 HA GLN 41 HA GLN 41 4.774 23.597 -13.706 298 1HB GLN 41 HB2 GLN 41 5.111 23.655 -10.952 299 2HB GLN 41 HB1 GLN 41 3.972 22.339 -11.201 300 1HG GLN 41 HG1 GLN 41 6.449 22.491 -12.855 301 2HG GLN 41 HG2 GLN 41 6.523 21.873 -11.205 302 1HE2 GLN 41 HE21 GLN 41 4.975 21.432 -14.333 303 2HE2 GLN 41 HE22 GLN 41 4.652 19.747 -14.142 304 H GLN 42 HN GLN 42 3.483 22.377 -14.916 305 HA GLN 42 HA GLN 42 0.933 21.449 -13.918 306 1HB GLN 42 HB2 GLN 42 -0.284 22.336 -15.941 307 2HB GLN 42 HB1 GLN 42 0.183 23.546 -14.756 308 1HG GLN 42 HG1 GLN 42 2.300 23.770 -16.288 309 2HG GLN 42 HG2 GLN 42 1.223 23.077 -17.500 310 1HE2 GLN 42 HE21 GLN 42 -0.830 24.183 -17.854 311 2HE2 GLN 42 HE22 GLN 42 -0.890 25.901 -17.687 312 HA PRO 43 HA PRO 43 -0.617 19.996 -14.377 313 1HB PRO 43 HB2 PRO 43 -0.010 17.160 -13.939 314 2HB PRO 43 HB1 PRO 43 -1.492 17.907 -14.541 315 1HG PRO 43 HG2 PRO 43 0.130 16.465 -16.135 316 2HG PRO 43 HG1 PRO 43 -0.779 17.866 -16.733 317 1HD PRO 43 HD2 PRO 43 2.109 17.673 -15.954 318 2HD PRO 43 HD1 PRO 43 1.370 18.500 -17.342 319 H ALA 44 HN ALA 44 -0.706 20.183 -12.182 320 HA ALA 44 HA ALA 44 1.811 20.067 -10.755 321 1HB ALA 44 HB1 ALA 44 -0.573 21.592 -10.557 322 2HB ALA 44 HB2 ALA 44 0.943 21.799 -9.680 323 3HB ALA 44 HB3 ALA 44 -0.322 20.762 -9.020 324 H VAL 45 HN VAL 45 1.684 19.258 -8.406 325 HA VAL 45 HA VAL 45 0.583 16.542 -8.478 326 HB VAL 45 HB VAL 45 2.113 16.212 -6.468 327 1HG1 VAL 45 HG11 VAL 45 3.800 16.923 -8.800 328 2HG1 VAL 45 HG12 VAL 45 2.512 15.745 -9.050 329 3HG1 VAL 45 HG13 VAL 45 3.759 15.445 -7.839 330 1HG2 VAL 45 HG21 VAL 45 2.788 18.994 -7.231 331 2HG2 VAL 45 HG22 VAL 45 4.115 17.935 -6.755 332 3HG2 VAL 45 HG23 VAL 45 2.776 18.224 -5.645 333 H HIS 46 HN HIS 46 -0.393 19.445 -7.426 334 HA HIS 46 HA HIS 46 -1.545 18.411 -4.924 335 1HB HIS 46 HB1 HIS 46 -0.306 20.904 -5.573 336 2HB HIS 46 HB2 HIS 46 -1.994 21.211 -5.175 337 HD2 HIS 46 HD2 HIS 46 -2.061 21.941 -2.611 338 HE1 HIS 46 HE1 HIS 46 0.740 19.124 -1.151 339 HE2 HIS 46 HE2 HIS 46 -0.853 20.994 -0.520 340 H VAL 47 HN VAL 47 -3.319 17.353 -5.762 341 HA VAL 47 HA VAL 47 -5.222 18.937 -7.341 342 HB VAL 47 HB VAL 47 -6.390 16.726 -7.666 343 1HG1 VAL 47 HG11 VAL 47 -4.902 17.727 -9.352 344 2HG1 VAL 47 HG12 VAL 47 -4.857 15.964 -9.382 345 3HG1 VAL 47 HG13 VAL 47 -3.537 16.867 -8.637 346 1HG2 VAL 47 HG21 VAL 47 -3.828 15.541 -6.619 347 2HG2 VAL 47 HG22 VAL 47 -5.285 14.691 -7.133 348 3HG2 VAL 47 HG23 VAL 47 -5.305 15.663 -5.661 349 H GLN 48 HN GLN 48 -7.504 17.350 -6.658 350 HA GLN 48 HA GLN 48 -8.395 18.758 -4.362 351 1HB GLN 48 HB1 GLN 48 -9.900 18.059 -6.190 352 2HB GLN 48 HB2 GLN 48 -9.642 16.376 -5.750 353 1HG GLN 48 HG2 GLN 48 -10.479 17.832 -3.443 354 2HG GLN 48 HG1 GLN 48 -11.589 18.152 -4.775 355 1HE2 GLN 48 HE22 GLN 48 -12.204 16.114 -6.021 356 2HE2 GLN 48 HE21 GLN 48 -12.618 14.738 -5.064 357 H GLY 49 HN GLY 49 -7.125 15.538 -4.899 358 1HA GLY 49 HA2 GLY 49 -7.573 14.871 -2.070 359 2HA GLY 49 HA1 GLY 49 -7.200 13.718 -3.342 360 H GLN 50 HN GLN 50 -5.935 14.447 -0.677 361 HA GLN 50 HA GLN 50 -3.256 15.209 -1.572 362 1HB GLN 50 HB1 GLN 50 -2.960 14.955 1.088 363 2HB GLN 50 HB2 GLN 50 -3.524 16.432 0.321 364 1HG GLN 50 HG2 GLN 50 -5.875 15.518 0.664 365 2HG GLN 50 HG1 GLN 50 -5.130 14.335 1.740 366 1HE2 GLN 50 HE22 GLN 50 -4.911 14.878 3.791 367 2HE2 GLN 50 HE21 GLN 50 -4.995 16.481 4.430 368 H GLU 51 HN GLU 51 -1.482 13.898 -1.384 369 HA GLU 51 HA GLU 51 -1.904 11.104 -1.515 370 1HB GLU 51 HB2 GLU 51 0.653 12.679 -1.155 371 2HB GLU 51 HB1 GLU 51 0.578 10.963 -1.532 372 1HG GLU 51 HG1 GLU 51 -0.636 11.527 -3.618 373 2HG GLU 51 HG2 GLU 51 -0.389 13.234 -3.251 374 HA PRO 52 HA PRO 52 -1.792 9.987 2.759 375 1HB PRO 52 HB1 PRO 52 -0.968 7.412 2.562 376 2HB PRO 52 HB2 PRO 52 -2.594 7.934 2.112 377 1HG PRO 52 HG1 PRO 52 -0.218 7.416 0.365 378 2HG PRO 52 HG2 PRO 52 -1.912 6.952 0.116 379 1HD PRO 52 HD2 PRO 52 -0.786 9.090 -1.111 380 2HD PRO 52 HD1 PRO 52 -2.501 9.042 -0.655 381 H LEU 53 HN LEU 53 -0.169 8.378 4.128 382 HA LEU 53 HA LEU 53 2.391 9.786 4.024 383 1HB LEU 53 HB2 LEU 53 0.713 9.104 6.110 384 2HB LEU 53 HB1 LEU 53 1.978 7.898 6.218 385 HG LEU 53 HG LEU 53 3.163 10.496 5.877 386 1HD1 LEU 53 HD21 LEU 53 2.240 11.797 7.486 387 2HD1 LEU 53 HD22 LEU 53 1.718 10.418 8.455 388 3HD1 LEU 53 HD23 LEU 53 0.793 10.897 7.030 389 1HD2 LEU 53 HD11 LEU 53 3.137 8.632 8.246 390 2HD2 LEU 53 HD12 LEU 53 4.324 9.892 7.900 391 3HD2 LEU 53 HD13 LEU 53 4.210 8.479 6.852 392 H THR 54 HN THR 54 4.383 8.678 4.182 393 HA THR 54 HA THR 54 4.603 5.861 4.090 394 HB THR 54 HB THR 54 5.786 6.446 1.605 395 HG1 THR 54 HG1 THR 54 3.077 7.162 1.446 396 1HG2 THR 54 HG21 THR 54 4.985 4.358 1.547 397 2HG2 THR 54 HG22 THR 54 3.547 5.136 0.885 398 3HG2 THR 54 HG23 THR 54 3.624 4.738 2.602 399 H ALA 55 HN ALA 55 7.030 5.566 2.819 400 HA ALA 55 HA ALA 55 8.818 6.408 4.747 401 1HB ALA 55 HB1 ALA 55 10.552 5.580 3.359 402 2HB ALA 55 HB2 ALA 55 9.577 5.794 1.904 403 3HB ALA 55 HB3 ALA 55 9.135 4.564 3.090 404 H SER 56 HN SER 56 7.858 8.000 1.765 405 HA SER 56 HA SER 56 9.897 9.956 1.708 406 1HB SER 56 HB1 SER 56 7.087 9.988 0.579 407 2HB SER 56 HB2 SER 56 8.304 11.220 0.238 408 HG SER 56 HG SER 56 9.634 9.352 -0.474 409 H MET 57 HN MET 57 6.554 10.084 2.924 410 HA MET 57 HA MET 57 6.618 12.694 3.926 411 1HB MET 57 HB1 MET 57 5.047 10.247 4.702 412 2HB MET 57 HB2 MET 57 4.839 11.771 5.546 413 1HG MET 57 HG1 MET 57 3.402 10.980 3.397 414 2HG MET 57 HG2 MET 57 3.617 12.654 3.903 415 1HE MET 57 HE1 MET 57 5.475 9.901 1.441 416 2HE MET 57 HE2 MET 57 4.793 10.734 0.046 417 3HE MET 57 HE3 MET 57 3.735 10.163 1.336 418 H LEU 58 HN LEU 58 7.609 9.635 5.325 419 HA LEU 58 HA LEU 58 8.091 10.516 7.958 420 1HB LEU 58 HB1 LEU 58 9.456 8.319 6.402 421 2HB LEU 58 HB2 LEU 58 9.478 8.500 8.147 422 HG LEU 58 HG LEU 58 6.879 8.197 6.690 423 1HD1 LEU 58 HD21 LEU 58 7.789 5.704 7.764 424 2HD1 LEU 58 HD22 LEU 58 8.951 6.300 6.577 425 3HD1 LEU 58 HD23 LEU 58 7.258 6.085 6.127 426 1HD2 LEU 58 HD11 LEU 58 7.457 8.719 9.275 427 2HD2 LEU 58 HD12 LEU 58 7.378 6.956 9.303 428 3HD2 LEU 58 HD13 LEU 58 5.997 7.892 8.730 429 H ALA 59 HN ALA 59 10.160 10.275 5.108 430 HA ALA 59 HA ALA 59 12.567 11.084 6.299 431 1HB ALA 59 HB1 ALA 59 12.138 10.070 3.968 432 2HB ALA 59 HB2 ALA 59 13.440 11.245 4.153 433 3HB ALA 59 HB3 ALA 59 11.899 11.741 3.456 434 H SER 60 HN SER 60 9.736 12.844 5.625 435 HA SER 60 HA SER 60 10.915 15.414 5.221 436 1HB SER 60 HB1 SER 60 8.605 14.833 4.492 437 2HB SER 60 HB2 SER 60 8.124 14.754 6.188 438 HG SER 60 HG SER 60 7.661 16.793 5.264 439 H ALA 61 HN ALA 61 10.785 13.442 7.888 440 HA ALA 61 HA ALA 61 11.205 15.736 9.684 441 1HB ALA 61 HB1 ALA 61 9.305 13.484 9.981 442 2HB ALA 61 HB2 ALA 61 9.181 15.154 10.532 443 3HB ALA 61 HB3 ALA 61 10.170 14.001 11.428 444 HA PRO 62 HA PRO 62 14.671 12.491 9.634 445 1HB PRO 62 HB1 PRO 62 16.280 14.977 9.440 446 2HB PRO 62 HB2 PRO 62 16.465 13.441 8.587 447 1HG PRO 62 HG1 PRO 62 15.477 15.583 7.344 448 2HG PRO 62 HG2 PRO 62 14.832 13.962 7.025 449 1HD PRO 62 HD1 PRO 62 13.683 16.168 8.689 450 2HD PRO 62 HD2 PRO 62 12.859 15.020 7.613 451 HA PRO 63 HA PRO 63 16.291 14.557 13.558 452 1HB PRO 63 HB2 PRO 63 16.044 17.156 14.074 453 2HB PRO 63 HB1 PRO 63 17.189 16.582 12.855 454 1HG PRO 63 HG1 PRO 63 14.507 17.840 12.500 455 2HG PRO 63 HG2 PRO 63 15.977 18.040 11.532 456 1HD PRO 63 HD2 PRO 63 13.816 16.361 10.924 457 2HD PRO 63 HD1 PRO 63 15.428 16.299 10.185 458 H GLN 64 HN GLN 64 13.071 15.350 12.645 459 HA GLN 64 HA GLN 64 12.164 15.847 15.350 460 1HB GLN 64 HB2 GLN 64 10.381 15.403 12.967 461 2HB GLN 64 HB1 GLN 64 10.058 16.346 14.415 462 1HG GLN 64 HG1 GLN 64 12.034 17.050 12.256 463 2HG GLN 64 HG2 GLN 64 10.442 17.773 12.485 464 1HE2 GLN 64 HE22 GLN 64 10.071 18.953 14.468 465 2HE2 GLN 64 HE21 GLN 64 11.391 19.764 15.234 466 H GLU 65 HN GLU 65 10.615 13.709 12.989 467 HA GLU 65 HA GLU 65 10.345 11.692 15.105 468 1HB GLU 65 HB1 GLU 65 8.825 11.706 12.514 469 2HB GLU 65 HB2 GLU 65 8.395 10.938 14.037 470 1HG GLU 65 HG2 GLU 65 8.655 13.897 13.970 471 2HG GLU 65 HG1 GLU 65 7.237 13.157 13.231 472 H GLN 66 HN GLN 66 9.937 10.938 11.729 473 HA GLN 66 HA GLN 66 11.010 9.532 10.303 474 1HB GLN 66 HB2 GLN 66 13.149 10.749 11.798 475 2HB GLN 66 HB1 GLN 66 13.544 9.075 11.427 476 1HG GLN 66 HG1 GLN 66 12.689 9.773 9.037 477 2HG GLN 66 HG2 GLN 66 13.132 11.378 9.612 478 1HE2 GLN 66 HE21 GLN 66 15.313 10.587 11.233 479 2HE2 GLN 66 HE22 GLN 66 16.591 10.077 10.190 480 H LYS 67 HN LYS 67 10.775 8.922 13.622 481 HA LYS 67 HA LYS 67 10.688 6.045 13.112 482 1HB LYS 67 HB1 LYS 67 12.005 7.252 15.553 483 2HB LYS 67 HB2 LYS 67 11.872 5.542 15.171 484 1HG LYS 67 HG2 LYS 67 13.607 5.588 13.738 485 2HG LYS 67 HG1 LYS 67 13.205 7.198 13.136 486 1HD LYS 67 HD1 LYS 67 13.952 7.839 15.627 487 2HD LYS 67 HD2 LYS 67 14.932 6.389 15.398 488 1HE LYS 67 HE2 LYS 67 15.106 7.952 13.035 489 2HE LYS 67 HE1 LYS 67 15.390 9.015 14.414 490 1HZ LYS 67 HZ1 LYS 67 17.175 7.243 13.260 491 2HZ LYS 67 HZ2 LYS 67 16.783 6.584 14.767 492 3HZ LYS 67 HZ3 LYS 67 17.399 8.156 14.666 493 H GLN 68 HN GLN 68 8.949 8.568 13.797 494 HA GLN 68 HA GLN 68 7.345 7.217 15.867 495 1HB GLN 68 HB2 GLN 68 8.016 9.162 16.925 496 2HB GLN 68 HB1 GLN 68 8.015 10.101 15.438 497 1HG GLN 68 HG1 GLN 68 5.890 10.735 15.706 498 2HG GLN 68 HG2 GLN 68 5.373 9.127 16.212 499 1HE2 GLN 68 HE21 GLN 68 5.119 12.051 17.213 500 2HE2 GLN 68 HE22 GLN 68 5.384 11.896 18.913 501 H MET 69 HN MET 69 6.979 9.589 13.211 502 HA MET 69 HA MET 69 4.218 9.326 12.939 503 1HB MET 69 HB1 MET 69 6.167 10.009 10.736 504 2HB MET 69 HB2 MET 69 4.456 10.414 10.794 505 1HG MET 69 HG1 MET 69 5.000 11.725 12.896 506 2HG MET 69 HG2 MET 69 6.692 11.529 12.450 507 1HE MET 69 HE1 MET 69 6.474 13.046 8.773 508 2HE MET 69 HE2 MET 69 6.636 11.455 9.517 509 3HE MET 69 HE3 MET 69 7.711 12.766 9.999 510 H LEU 70 HN LEU 70 6.501 6.994 12.266 511 HA LEU 70 HA LEU 70 5.494 5.879 9.869 512 1HB LEU 70 HB1 LEU 70 6.527 3.772 11.431 513 2HB LEU 70 HB2 LEU 70 7.319 4.628 10.124 514 HG LEU 70 HG LEU 70 7.407 5.548 12.993 515 1HD1 LEU 70 HD11 LEU 70 9.903 4.533 12.101 516 2HD1 LEU 70 HD12 LEU 70 8.676 3.292 11.844 517 3HD1 LEU 70 HD13 LEU 70 8.906 3.984 13.450 518 1HD2 LEU 70 HD21 LEU 70 8.512 6.483 10.426 519 2HD2 LEU 70 HD22 LEU 70 9.602 6.528 11.811 520 3HD2 LEU 70 HD23 LEU 70 8.061 7.387 11.872 521 H GLY 71 HN GLY 71 4.912 5.127 13.278 522 1HA GLY 71 HA2 GLY 71 2.470 3.720 12.421 523 2HA GLY 71 HA1 GLY 71 3.411 3.226 13.819 524 H GLU 72 HN GLU 72 3.245 6.597 13.374 525 HA GLU 72 HA GLU 72 0.997 6.782 15.267 526 1HB GLU 72 HB1 GLU 72 3.589 8.332 15.349 527 2HB GLU 72 HB2 GLU 72 2.194 8.679 16.359 528 1HG GLU 72 HG2 GLU 72 2.695 5.961 16.718 529 2HG GLU 72 HG1 GLU 72 4.280 6.733 16.716 530 H ARG 73 HN ARG 73 1.947 7.556 12.237 531 HA ARG 73 HA ARG 73 0.266 9.975 12.237 532 1HB ARG 73 HB1 ARG 73 2.877 10.102 11.717 533 2HB ARG 73 HB2 ARG 73 2.324 9.637 10.115 534 1HG ARG 73 HG2 ARG 73 2.421 11.979 10.097 535 2HG ARG 73 HG1 ARG 73 0.709 11.581 10.257 536 1HD ARG 73 HD1 ARG 73 0.627 12.241 12.471 537 2HD ARG 73 HD2 ARG 73 2.364 12.042 12.701 538 HE ARG 73 HE ARG 73 2.409 14.052 11.035 539 1HH1 ARG 73 HH22 ARG 73 0.183 13.515 13.662 540 2HH1 ARG 73 HH21 ARG 73 -0.086 15.202 13.948 541 1HH2 ARG 73 HH11 ARG 73 2.059 16.275 11.404 542 2HH2 ARG 73 HH12 ARG 73 0.979 16.771 12.664 543 H LEU 74 HN LEU 74 1.261 7.046 10.533 544 HA LEU 74 HA LEU 74 -0.262 7.287 8.229 545 1HB LEU 74 HB1 LEU 74 0.896 5.115 9.873 546 2HB LEU 74 HB2 LEU 74 -0.351 4.645 8.741 547 HG LEU 74 HG LEU 74 1.740 4.310 7.721 548 1HD1 LEU 74 HD21 LEU 74 -0.014 6.441 6.726 549 2HD1 LEU 74 HD22 LEU 74 0.520 4.953 5.943 550 3HD1 LEU 74 HD23 LEU 74 1.580 6.362 5.971 551 1HD2 LEU 74 HD11 LEU 74 2.718 6.235 9.285 552 2HD2 LEU 74 HD12 LEU 74 2.636 7.090 7.744 553 3HD2 LEU 74 HD13 LEU 74 3.559 5.589 7.871 554 H PHE 75 HN PHE 75 -1.140 6.252 11.461 555 HA PHE 75 HA PHE 75 -3.302 4.756 11.251 556 1HB PHE 75 HB1 PHE 75 -2.439 5.618 13.384 557 2HB PHE 75 HB2 PHE 75 -3.219 7.164 13.071 558 HD1 PHE 75 HD1 PHE 75 -4.604 7.179 14.993 559 HD2 PHE 75 HD2 PHE 75 -4.739 3.906 12.270 560 HE1 PHE 75 HE1 PHE 75 -6.661 6.371 16.075 561 HE2 PHE 75 HE2 PHE 75 -6.798 3.094 13.352 562 HZ PHE 75 HZ PHE 75 -7.761 4.325 15.254 563 HA PRO 76 HA PRO 76 -6.580 8.214 10.442 564 1HB PRO 76 HB2 PRO 76 -5.643 10.621 9.532 565 2HB PRO 76 HB1 PRO 76 -5.999 10.281 11.229 566 1HG PRO 76 HG2 PRO 76 -3.369 10.237 9.798 567 2HG PRO 76 HG1 PRO 76 -3.763 10.902 11.395 568 1HD PRO 76 HD1 PRO 76 -2.557 8.519 11.126 569 2HD PRO 76 HD2 PRO 76 -3.752 8.815 12.405 570 H LEU 77 HN LEU 77 -3.729 7.749 8.564 571 HA LEU 77 HA LEU 77 -5.115 8.306 6.066 572 1HB LEU 77 HB1 LEU 77 -2.241 7.752 6.757 573 2HB LEU 77 HB2 LEU 77 -2.803 7.858 5.099 574 HG LEU 77 HG LEU 77 -2.895 10.056 7.174 575 1HD1 LEU 77 HD11 LEU 77 -0.800 9.226 5.612 576 2HD1 LEU 77 HD12 LEU 77 -0.986 10.825 6.330 577 3HD1 LEU 77 HD13 LEU 77 -1.505 10.539 4.668 578 1HD2 LEU 77 HD21 LEU 77 -4.847 10.236 5.786 579 2HD2 LEU 77 HD22 LEU 77 -3.880 10.017 4.327 580 3HD2 LEU 77 HD23 LEU 77 -3.686 11.473 5.302 581 H ILE 78 HN ILE 78 -4.093 5.562 7.953 582 HA ILE 78 HA ILE 78 -4.002 3.687 5.805 583 HB ILE 78 HB ILE 78 -4.684 2.955 8.631 584 1HG1 ILE 78 HG12 ILE 78 -2.582 4.512 8.232 585 2HG1 ILE 78 HG11 ILE 78 -2.509 3.155 9.350 586 1HG2 ILE 78 HG21 ILE 78 -3.051 1.030 7.710 587 2HG2 ILE 78 HG22 ILE 78 -3.799 1.556 6.201 588 3HG2 ILE 78 HG23 ILE 78 -4.807 0.996 7.535 589 1HD1 ILE 78 HD11 ILE 78 -0.701 3.642 7.418 590 2HD1 ILE 78 HD12 ILE 78 -1.779 2.525 6.584 591 3HD1 ILE 78 HD13 ILE 78 -1.022 2.048 8.105 592 H GLN 79 HN GLN 79 -6.485 4.896 7.955 593 HA GLN 79 HA GLN 79 -8.551 3.099 7.480 594 1HB GLN 79 HB1 GLN 79 -8.318 5.901 8.354 595 2HB GLN 79 HB2 GLN 79 -9.858 5.505 7.603 596 1HG GLN 79 HG1 GLN 79 -10.390 3.936 9.237 597 2HG GLN 79 HG2 GLN 79 -8.719 3.798 9.780 598 1HE2 GLN 79 HE22 GLN 79 -9.809 4.093 11.887 599 2HE2 GLN 79 HE21 GLN 79 -10.054 5.706 12.453 600 H ALA 80 HN ALA 80 -7.007 5.230 5.362 601 HA ALA 80 HA ALA 80 -9.179 5.471 3.462 602 1HB ALA 80 HB1 ALA 80 -6.280 6.252 3.178 603 2HB ALA 80 HB2 ALA 80 -7.565 7.304 3.774 604 3HB ALA 80 HB3 ALA 80 -7.604 6.721 2.110 605 H MET 81 HN MET 81 -6.172 3.660 3.840 606 HA MET 81 HA MET 81 -6.236 2.442 1.258 607 1HB MET 81 HB1 MET 81 -4.883 1.223 3.648 608 2HB MET 81 HB2 MET 81 -4.380 1.188 1.963 609 1HG MET 81 HG1 MET 81 -4.385 3.878 2.610 610 2HG MET 81 HG2 MET 81 -3.752 3.085 4.050 611 1HE MET 81 HE1 MET 81 -1.368 3.077 4.359 612 2HE MET 81 HE2 MET 81 -0.260 2.243 3.267 613 3HE MET 81 HE3 MET 81 -1.631 1.374 3.963 614 H HIS 82 HN HIS 82 -7.211 1.437 4.494 615 HA HIS 82 HA HIS 82 -8.695 -0.820 3.313 616 1HB HIS 82 HB1 HIS 82 -7.074 -0.535 5.784 617 2HB HIS 82 HB2 HIS 82 -8.556 -1.471 5.933 618 HD2 HIS 82 HD2 HIS 82 -5.850 -1.563 3.053 619 HE1 HIS 82 HE1 HIS 82 -6.454 -5.440 4.639 620 HE2 HIS 82 HE2 HIS 82 -5.227 -4.076 2.884 621 HA PRO 83 HA PRO 83 -12.487 0.980 4.715 622 1HB PRO 83 HB1 PRO 83 -13.332 -1.658 5.737 623 2HB PRO 83 HB2 PRO 83 -14.062 -0.653 4.482 624 1HG PRO 83 HG2 PRO 83 -12.745 -2.903 3.872 625 2HG PRO 83 HG1 PRO 83 -12.663 -1.470 2.829 626 1HD PRO 83 HD2 PRO 83 -10.660 -2.493 4.808 627 2HD PRO 83 HD1 PRO 83 -10.398 -1.811 3.189 628 H THR 84 HN THR 84 -11.110 1.995 6.460 629 HA THR 84 HA THR 84 -10.627 2.516 8.621 630 HB THR 84 HB THR 84 -12.543 2.653 10.082 631 HG1 THR 84 HG1 THR 84 -13.468 0.667 9.932 632 1HG2 THR 84 HG21 THR 84 -12.935 4.324 8.600 633 2HG2 THR 84 HG22 THR 84 -14.379 3.345 8.337 634 3HG2 THR 84 HG23 THR 84 -13.021 3.233 7.217 635 H LEU 85 HN LEU 85 -9.508 0.109 7.998 636 HA LEU 85 HA LEU 85 -10.081 -1.664 10.268 637 1HB LEU 85 HB1 LEU 85 -9.225 -2.056 7.530 638 2HB LEU 85 HB2 LEU 85 -8.144 -2.858 8.651 639 HG LEU 85 HG LEU 85 -10.152 -3.988 9.658 640 1HD1 LEU 85 HD21 LEU 85 -11.573 -2.132 8.205 641 2HD1 LEU 85 HD22 LEU 85 -12.234 -3.568 8.986 642 3HD1 LEU 85 HD23 LEU 85 -11.783 -3.621 7.282 643 1HD2 LEU 85 HD11 LEU 85 -9.645 -5.712 8.355 644 2HD2 LEU 85 HD12 LEU 85 -8.683 -4.603 7.377 645 3HD2 LEU 85 HD13 LEU 85 -10.360 -4.935 6.943 646 H ALA 86 HN ALA 86 -8.293 0.914 9.848 647 HA ALA 86 HA ALA 86 -5.658 0.086 10.524 648 1HB ALA 86 HB1 ALA 86 -7.032 2.759 10.706 649 2HB ALA 86 HB2 ALA 86 -5.955 2.181 9.435 650 3HB ALA 86 HB3 ALA 86 -5.320 2.508 11.048 651 H GLY 87 HN GLY 87 -7.989 -0.765 12.318 652 1HA GLY 87 HA2 GLY 87 -7.941 0.393 14.808 653 2HA GLY 87 HA1 GLY 87 -8.135 -1.333 14.542 654 H LYS 88 HN LYS 88 -5.443 -1.484 13.279 655 HA LYS 88 HA LYS 88 -3.481 -0.630 15.111 656 1HB LYS 88 HB1 LYS 88 -4.625 -2.360 16.516 657 2HB LYS 88 HB2 LYS 88 -4.162 -3.566 15.326 658 1HG LYS 88 HG1 LYS 88 -1.761 -2.540 15.777 659 2HG LYS 88 HG2 LYS 88 -2.510 -2.144 17.330 660 1HD LYS 88 HD1 LYS 88 -1.920 -4.222 17.924 661 2HD LYS 88 HD2 LYS 88 -3.292 -4.739 16.937 662 1HE LYS 88 HE2 LYS 88 -1.784 -4.921 14.992 663 2HE LYS 88 HE1 LYS 88 -0.426 -4.481 16.025 664 1HZ LYS 88 HZ1 LYS 88 -0.221 -6.622 16.501 665 2HZ LYS 88 HZ2 LYS 88 -1.634 -7.013 15.657 666 3HZ LYS 88 HZ3 LYS 88 -1.716 -6.578 17.289 667 H ILE 89 HN ILE 89 -3.738 -0.609 12.311 668 HA ILE 89 HA ILE 89 -2.102 -2.737 11.250 669 HB ILE 89 HB ILE 89 -2.936 -0.178 9.894 670 1HG1 ILE 89 HG12 ILE 89 -4.141 -2.918 9.510 671 2HG1 ILE 89 HG11 ILE 89 -4.780 -1.783 10.694 672 1HG2 ILE 89 HG21 ILE 89 -1.206 -2.388 9.175 673 2HG2 ILE 89 HG22 ILE 89 -1.433 -0.827 8.380 674 3HG2 ILE 89 HG23 ILE 89 -2.519 -2.170 8.014 675 1HD1 ILE 89 HD11 ILE 89 -4.603 -1.349 7.724 676 2HD1 ILE 89 HD12 ILE 89 -5.187 -0.166 8.893 677 3HD1 ILE 89 HD13 ILE 89 -6.062 -1.680 8.658 678 H THR 90 HN THR 90 -1.577 0.701 10.639 679 HA THR 90 HA THR 90 1.202 0.536 10.459 680 HB THR 90 HB THR 90 -0.758 2.496 10.212 681 HG1 THR 90 HG1 THR 90 2.031 2.437 9.832 682 1HG2 THR 90 HG21 THR 90 1.008 3.154 12.475 683 2HG2 THR 90 HG22 THR 90 -0.623 3.712 12.099 684 3HG2 THR 90 HG23 THR 90 0.765 4.405 11.255 685 H GLY 91 HN GLY 91 -0.889 1.037 13.254 686 1HA GLY 91 HA2 GLY 91 1.073 1.769 15.142 687 2HA GLY 91 HA1 GLY 91 -0.427 0.918 15.506 688 H MET 92 HN MET 92 0.204 -1.231 13.651 689 HA MET 92 HA MET 92 1.749 -2.925 15.396 690 1HB MET 92 HB1 MET 92 -0.226 -3.614 13.850 691 2HB MET 92 HB2 MET 92 0.969 -3.587 12.566 692 1HG MET 92 HG1 MET 92 2.193 -5.329 13.471 693 2HG MET 92 HG2 MET 92 1.439 -5.168 15.053 694 1HE MET 92 HE1 MET 92 -1.538 -5.063 12.417 695 2HE MET 92 HE2 MET 92 -1.014 -6.428 11.429 696 3HE MET 92 HE3 MET 92 0.031 -5.017 11.609 697 H LEU 93 HN LEU 93 2.150 -1.250 12.370 698 HA LEU 93 HA LEU 93 4.482 -2.450 11.456 699 1HB LEU 93 HB2 LEU 93 3.172 0.179 11.021 700 2HB LEU 93 HB1 LEU 93 4.763 -0.096 10.351 701 HG LEU 93 HG LEU 93 3.003 -0.532 8.696 702 1HD1 LEU 93 HD11 LEU 93 3.635 -3.151 8.520 703 2HD1 LEU 93 HD12 LEU 93 4.901 -2.585 9.612 704 3HD1 LEU 93 HD13 LEU 93 4.706 -1.840 8.026 705 1HD2 LEU 93 HD21 LEU 93 1.930 -2.237 10.878 706 2HD2 LEU 93 HD22 LEU 93 1.762 -2.822 9.217 707 3HD2 LEU 93 HD23 LEU 93 1.091 -1.257 9.671 708 H LEU 94 HN LEU 94 4.125 -0.814 14.279 709 HA LEU 94 HA LEU 94 6.940 0.039 14.306 710 1HB LEU 94 HB1 LEU 94 4.508 1.170 15.488 711 2HB LEU 94 HB2 LEU 94 5.831 1.014 16.625 712 HG LEU 94 HG LEU 94 7.254 2.403 15.248 713 1HD1 LEU 94 HD11 LEU 94 6.463 3.404 13.175 714 2HD1 LEU 94 HD12 LEU 94 4.950 2.505 13.306 715 3HD1 LEU 94 HD13 LEU 94 6.470 1.644 13.063 716 1HD2 LEU 94 HD21 LEU 94 4.795 4.018 15.121 717 2HD2 LEU 94 HD22 LEU 94 6.341 4.354 15.902 718 3HD2 LEU 94 HD23 LEU 94 5.165 3.301 16.690 719 H GLU 95 HN GLU 95 5.752 -2.630 14.525 720 HA GLU 95 HA GLU 95 7.260 -3.630 16.704 721 1HB GLU 95 HB2 GLU 95 5.539 -4.395 18.166 722 2HB GLU 95 HB1 GLU 95 5.241 -2.687 17.878 723 1HG GLU 95 HG1 GLU 95 3.427 -3.141 16.438 724 2HG GLU 95 HG2 GLU 95 3.849 -4.849 16.327 725 H ILE 96 HN ILE 96 5.861 -3.949 13.777 726 HA ILE 96 HA ILE 96 4.968 -6.613 13.689 727 HB ILE 96 HB ILE 96 5.344 -6.586 11.301 728 1HG1 ILE 96 HG12 ILE 96 7.556 -5.521 11.303 729 2HG1 ILE 96 HG11 ILE 96 6.457 -4.776 10.149 730 1HG2 ILE 96 HG21 ILE 96 3.399 -5.521 11.414 731 2HG2 ILE 96 HG22 ILE 96 4.337 -4.100 10.950 732 3HG2 ILE 96 HG23 ILE 96 3.968 -4.400 12.650 733 1HD1 ILE 96 HD11 ILE 96 6.220 -3.350 12.558 734 2HD1 ILE 96 HD12 ILE 96 6.902 -2.812 11.020 735 3HD1 ILE 96 HD13 ILE 96 7.939 -3.571 12.232 736 H ASP 97 HN ASP 97 6.621 -7.494 11.453 737 HA ASP 97 HA ASP 97 8.461 -9.154 12.741 738 1HB ASP 97 HB1 ASP 97 7.324 -9.269 10.385 739 2HB ASP 97 HB2 ASP 97 8.736 -8.354 9.857 740 H ASN 98 HN ASN 98 8.629 -5.910 12.347 741 HA ASN 98 HA ASN 98 10.241 -4.399 12.811 742 1HB ASN 98 HB1 ASN 98 11.799 -6.903 13.230 743 2HB ASN 98 HB2 ASN 98 12.692 -5.398 13.030 744 1HD2 ASN 98 HD21 ASN 98 13.258 -4.588 14.900 745 2HD2 ASN 98 HD22 ASN 98 12.307 -4.577 16.342 746 H SER 99 HN SER 99 10.777 -6.786 10.345 747 HA SER 99 HA SER 99 12.661 -5.286 8.827 748 1HB SER 99 HB2 SER 99 12.742 -7.153 7.598 749 2HB SER 99 HB1 SER 99 11.511 -7.843 8.657 750 HG SER 99 HG SER 99 11.307 -7.020 6.080 751 H GLU 100 HN GLU 100 9.168 -5.487 8.962 752 HA GLU 100 HA GLU 100 8.667 -3.864 6.671 753 1HB GLU 100 HB1 GLU 100 6.713 -3.986 8.926 754 2HB GLU 100 HB2 GLU 100 6.438 -4.023 7.193 755 1HG GLU 100 HG1 GLU 100 7.722 -6.324 7.406 756 2HG GLU 100 HG2 GLU 100 7.085 -6.228 9.049 757 H LEU 101 HN LEU 101 8.886 -3.226 10.151 758 HA LEU 101 HA LEU 101 8.357 -0.508 10.134 759 1HB LEU 101 HB1 LEU 101 8.583 -1.603 12.223 760 2HB LEU 101 HB2 LEU 101 10.192 -2.180 11.835 761 HG LEU 101 HG LEU 101 10.090 0.715 11.807 762 1HD1 LEU 101 HD11 LEU 101 9.628 1.146 14.095 763 2HD1 LEU 101 HD12 LEU 101 9.474 -0.573 14.454 764 3HD1 LEU 101 HD13 LEU 101 8.262 0.232 13.456 765 1HD2 LEU 101 HD21 LEU 101 11.709 -1.471 12.990 766 2HD2 LEU 101 HD22 LEU 101 11.828 0.132 13.716 767 3HD2 LEU 101 HD23 LEU 101 12.207 -0.093 12.009 768 H LEU 102 HN LEU 102 11.071 -2.204 8.868 769 HA LEU 102 HA LEU 102 12.745 0.180 8.730 770 1HB LEU 102 HB2 LEU 102 13.141 -2.715 8.524 771 2HB LEU 102 HB1 LEU 102 14.042 -1.803 7.328 772 HG LEU 102 HG LEU 102 14.873 -0.391 9.326 773 1HD1 LEU 102 HD21 LEU 102 13.217 -2.322 10.664 774 2HD1 LEU 102 HD22 LEU 102 14.041 -0.907 11.317 775 3HD1 LEU 102 HD23 LEU 102 14.887 -2.451 11.214 776 1HD2 LEU 102 HD11 LEU 102 16.688 -1.961 9.747 777 2HD2 LEU 102 HD12 LEU 102 16.281 -1.908 8.032 778 3HD2 LEU 102 HD13 LEU 102 15.741 -3.262 9.025 779 H HIS 103 HN HIS 103 11.170 -2.089 6.506 780 HA HIS 103 HA HIS 103 12.103 -0.785 4.177 781 1HB HIS 103 HB1 HIS 103 10.849 -3.167 4.749 782 2HB HIS 103 HB2 HIS 103 9.595 -2.277 3.897 783 HD2 HIS 103 HD2 HIS 103 11.665 -0.832 1.713 784 HE1 HIS 103 HE1 HIS 103 12.434 -4.859 0.664 785 HE2 HIS 103 HE2 HIS 103 12.621 -2.442 -0.082 786 H MET 104 HN MET 104 9.299 -0.311 6.214 787 HA MET 104 HA MET 104 7.732 1.178 4.390 788 1HB MET 104 HB2 MET 104 6.612 2.061 6.460 789 2HB MET 104 HB1 MET 104 6.674 0.298 6.349 790 1HG MET 104 HG1 MET 104 8.017 0.111 8.135 791 2HG MET 104 HG2 MET 104 8.932 1.558 7.726 792 1HE MET 104 HE1 MET 104 4.914 2.191 8.011 793 2HE MET 104 HE2 MET 104 4.792 1.468 9.616 794 3HE MET 104 HE3 MET 104 5.416 0.517 8.265 795 H LEU 105 HN LEU 105 10.350 2.025 6.553 796 HA LEU 105 HA LEU 105 10.029 4.880 6.046 797 1HB LEU 105 HB1 LEU 105 12.410 3.702 7.417 798 2HB LEU 105 HB2 LEU 105 11.635 5.251 7.682 799 HG LEU 105 HG LEU 105 10.384 2.624 8.460 800 1HD1 LEU 105 HD11 LEU 105 11.314 4.258 10.650 801 2HD1 LEU 105 HD12 LEU 105 12.647 3.775 9.603 802 3HD1 LEU 105 HD13 LEU 105 11.600 2.550 10.320 803 1HD2 LEU 105 HD21 LEU 105 9.586 5.428 8.521 804 2HD2 LEU 105 HD22 LEU 105 9.411 4.605 10.072 805 3HD2 LEU 105 HD23 LEU 105 8.610 3.963 8.638 806 H GLU 106 HN GLU 106 11.480 2.195 4.675 807 HA GLU 106 HA GLU 106 13.599 3.763 3.427 808 1HB GLU 106 HB2 GLU 106 13.155 0.834 3.930 809 2HB GLU 106 HB1 GLU 106 14.307 1.350 2.696 810 1HG GLU 106 HG2 GLU 106 14.346 1.986 5.627 811 2HG GLU 106 HG1 GLU 106 15.456 0.929 4.754 812 H SER 107 HN SER 107 10.508 2.785 2.734 813 HA SER 107 HA SER 107 10.947 3.229 -0.113 814 1HB SER 107 HB2 SER 107 10.968 0.681 0.583 815 2HB SER 107 HB1 SER 107 9.220 0.899 0.599 816 HG SER 107 HG SER 107 9.209 1.179 -1.519 817 HA PRO 108 HA PRO 108 7.165 5.479 0.555 818 1HB PRO 108 HB1 PRO 108 6.720 6.261 -1.985 819 2HB PRO 108 HB2 PRO 108 8.015 6.954 -1.003 820 1HG PRO 108 HG1 PRO 108 8.160 4.812 -3.094 821 2HG PRO 108 HG2 PRO 108 9.232 6.203 -2.846 822 1HD PRO 108 HD2 PRO 108 9.842 3.695 -1.989 823 2HD PRO 108 HD1 PRO 108 10.397 5.161 -1.157 824 H GLU 109 HN GLU 109 7.397 2.483 -0.625 825 HA GLU 109 HA GLU 109 4.504 2.290 -1.142 826 1HB GLU 109 HB2 GLU 109 6.686 0.851 -2.675 827 2HB GLU 109 HB1 GLU 109 4.959 0.588 -2.878 828 1HG GLU 109 HG1 GLU 109 4.668 2.481 -4.075 829 2HG GLU 109 HG2 GLU 109 5.915 3.363 -3.193 830 H SER 110 HN SER 110 7.344 1.051 0.366 831 HA SER 110 HA SER 110 6.419 -1.563 0.949 832 1HB SER 110 HB1 SER 110 8.721 -0.026 1.556 833 2HB SER 110 HB2 SER 110 8.033 -0.578 3.088 834 HG SER 110 HG SER 110 8.519 -2.579 2.587 835 H LEU 111 HN LEU 111 6.485 1.408 2.826 836 HA LEU 111 HA LEU 111 5.224 0.613 5.096 837 1HB LEU 111 HB1 LEU 111 6.132 2.877 4.634 838 2HB LEU 111 HB2 LEU 111 4.723 3.211 3.645 839 HG LEU 111 HG LEU 111 4.280 2.352 6.457 840 1HD1 LEU 111 HD11 LEU 111 4.436 5.188 6.365 841 2HD1 LEU 111 HD12 LEU 111 5.983 4.517 5.827 842 3HD1 LEU 111 HD13 LEU 111 5.308 4.059 7.400 843 1HD2 LEU 111 HD21 LEU 111 2.918 4.503 4.872 844 2HD2 LEU 111 HD22 LEU 111 2.308 3.595 6.256 845 3HD2 LEU 111 HD23 LEU 111 2.501 2.797 4.694 846 H ARG 112 HN ARG 112 3.758 1.306 1.982 847 HA ARG 112 HA ARG 112 1.084 1.056 3.052 848 1HB ARG 112 HB2 ARG 112 0.826 2.506 1.373 849 2HB ARG 112 HB1 ARG 112 2.315 2.001 0.576 850 1HG ARG 112 HG1 ARG 112 1.159 0.134 -0.437 851 2HG ARG 112 HG2 ARG 112 -0.328 0.569 0.409 852 1HD ARG 112 HD2 ARG 112 -0.033 2.865 -0.746 853 2HD ARG 112 HD1 ARG 112 1.051 1.996 -1.833 854 HE ARG 112 HE ARG 112 -1.814 1.831 -1.749 855 1HH1 ARG 112 HH22 ARG 112 1.119 0.172 -2.638 856 2HH1 ARG 112 HH21 ARG 112 0.346 -0.830 -3.821 857 1HH2 ARG 112 HH11 ARG 112 -2.839 0.517 -3.304 858 2HH2 ARG 112 HH12 ARG 112 -1.904 -0.634 -4.200 859 H SER 113 HN SER 113 3.050 -0.692 0.681 860 HA SER 113 HA SER 113 1.292 -2.692 0.024 861 1HB SER 113 HB1 SER 113 4.303 -2.676 0.192 862 2HB SER 113 HB2 SER 113 3.409 -4.077 -0.398 863 HG SER 113 HG SER 113 3.907 -1.671 -1.614 864 H LYS 114 HN LYS 114 3.690 -2.734 2.682 865 HA LYS 114 HA LYS 114 2.743 -5.329 3.518 866 1HB LYS 114 HB2 LYS 114 4.385 -5.166 5.300 867 2HB LYS 114 HB1 LYS 114 5.088 -4.809 3.732 868 1HG LYS 114 HG1 LYS 114 4.374 -2.337 4.602 869 2HG LYS 114 HG2 LYS 114 4.867 -3.145 6.094 870 1HD LYS 114 HD1 LYS 114 6.934 -3.897 4.822 871 2HD LYS 114 HD2 LYS 114 6.464 -2.733 3.580 872 1HE LYS 114 HE2 LYS 114 8.058 -2.152 5.673 873 2HE LYS 114 HE1 LYS 114 7.063 -0.969 4.825 874 1HZ LYS 114 HZ1 LYS 114 6.914 -1.103 7.370 875 2HZ LYS 114 HZ2 LYS 114 5.970 -2.480 7.111 876 3HZ LYS 114 HZ3 LYS 114 5.475 -0.987 6.491 877 H VAL 115 HN VAL 115 2.054 -2.020 4.318 878 HA VAL 115 HA VAL 115 1.002 -2.456 6.919 879 HB VAL 115 HB VAL 115 0.917 -0.250 5.023 880 1HG1 VAL 115 HG11 VAL 115 -1.515 -0.585 6.769 881 2HG1 VAL 115 HG12 VAL 115 -1.508 -0.841 5.023 882 3HG1 VAL 115 HG13 VAL 115 -1.157 0.756 5.685 883 1HG2 VAL 115 HG21 VAL 115 1.807 0.709 6.812 884 2HG2 VAL 115 HG22 VAL 115 1.510 -0.758 7.745 885 3HG2 VAL 115 HG23 VAL 115 0.286 0.514 7.686 886 H ASP 116 HN ASP 116 -0.568 -2.388 3.718 887 HA ASP 116 HA ASP 116 -3.109 -3.207 4.539 888 1HB ASP 116 HB1 ASP 116 -3.371 -2.730 2.359 889 2HB ASP 116 HB2 ASP 116 -1.654 -2.940 2.043 890 H GLU 117 HN GLU 117 -0.188 -5.033 3.913 891 HA GLU 117 HA GLU 117 -1.489 -7.605 4.072 892 1HB GLU 117 HB1 GLU 117 1.407 -6.746 4.043 893 2HB GLU 117 HB2 GLU 117 0.921 -8.425 4.237 894 1HG GLU 117 HG2 GLU 117 -0.477 -7.458 2.005 895 2HG GLU 117 HG1 GLU 117 1.179 -6.875 1.848 896 H ALA 118 HN ALA 118 -0.047 -5.314 6.209 897 HA ALA 118 HA ALA 118 0.304 -7.090 8.425 898 1HB ALA 118 HB1 ALA 118 0.652 -5.071 9.751 899 2HB ALA 118 HB2 ALA 118 0.133 -4.078 8.389 900 3HB ALA 118 HB3 ALA 118 1.617 -5.029 8.274 901 H VAL 119 HN VAL 119 -2.249 -5.217 7.033 902 HA VAL 119 HA VAL 119 -4.061 -5.096 9.172 903 HB VAL 119 HB VAL 119 -4.825 -5.570 6.308 904 1HG1 VAL 119 HG11 VAL 119 -6.179 -4.170 8.607 905 2HG1 VAL 119 HG12 VAL 119 -6.643 -5.716 7.890 906 3HG1 VAL 119 HG13 VAL 119 -6.790 -4.226 6.955 907 1HG2 VAL 119 HG21 VAL 119 -3.902 -3.060 7.664 908 2HG2 VAL 119 HG22 VAL 119 -4.872 -3.046 6.191 909 3HG2 VAL 119 HG23 VAL 119 -3.277 -3.801 6.192 910 H ALA 120 HN ALA 120 -3.633 -7.475 6.603 911 HA ALA 120 HA ALA 120 -5.553 -9.326 7.383 912 1HB ALA 120 HB1 ALA 120 -3.151 -10.603 6.404 913 2HB ALA 120 HB2 ALA 120 -3.532 -9.154 5.467 914 3HB ALA 120 HB3 ALA 120 -4.730 -10.445 5.633 915 H VAL 121 HN VAL 121 -2.417 -8.580 8.647 916 HA VAL 121 HA VAL 121 -2.271 -10.900 10.361 917 HB VAL 121 HB VAL 121 -0.528 -8.518 9.852 918 1HG1 VAL 121 HG21 VAL 121 0.420 -8.533 11.848 919 2HG1 VAL 121 HG22 VAL 121 0.744 -10.262 11.711 920 3HG1 VAL 121 HG23 VAL 121 -0.781 -9.702 12.397 921 1HG2 VAL 121 HG11 VAL 121 -0.559 -10.710 8.510 922 2HG2 VAL 121 HG12 VAL 121 0.271 -11.401 9.904 923 3HG2 VAL 121 HG13 VAL 121 0.998 -10.058 9.021 924 H LEU 122 HN LEU 122 -3.237 -7.553 10.575 925 HA LEU 122 HA LEU 122 -3.258 -7.363 13.420 926 1HB LEU 122 HB2 LEU 122 -3.508 -5.226 12.887 927 2HB LEU 122 HB1 LEU 122 -3.769 -5.655 11.211 928 HG LEU 122 HG LEU 122 -6.230 -6.143 12.414 929 1HD1 LEU 122 HD11 LEU 122 -4.929 -3.700 13.581 930 2HD1 LEU 122 HD12 LEU 122 -5.713 -5.032 14.431 931 3HD1 LEU 122 HD13 LEU 122 -6.678 -3.903 13.481 932 1HD2 LEU 122 HD21 LEU 122 -5.257 -3.728 10.906 933 2HD2 LEU 122 HD22 LEU 122 -6.947 -4.162 11.159 934 3HD2 LEU 122 HD23 LEU 122 -5.898 -5.214 10.207 935 H GLN 123 HN GLN 123 -5.637 -8.154 10.947 936 HA GLN 123 HA GLN 123 -7.824 -8.459 12.760 937 1HB GLN 123 HB1 GLN 123 -7.403 -9.364 9.906 938 2HB GLN 123 HB2 GLN 123 -8.913 -9.582 10.782 939 1HG GLN 123 HG1 GLN 123 -7.628 -6.899 10.334 940 2HG GLN 123 HG2 GLN 123 -8.818 -7.608 9.242 941 1HE2 GLN 123 HE22 GLN 123 -8.897 -5.175 10.916 942 2HE2 GLN 123 HE21 GLN 123 -10.320 -5.334 11.883 943 H ALA 124 HN ALA 124 -5.221 -10.430 11.666 944 HA ALA 124 HA ALA 124 -6.424 -12.923 12.558 945 1HB ALA 124 HB1 ALA 124 -3.647 -12.369 11.530 946 2HB ALA 124 HB2 ALA 124 -5.020 -12.876 10.545 947 3HB ALA 124 HB3 ALA 124 -4.373 -13.958 11.780 948 H HIS 125 HN HIS 125 -4.857 -10.365 14.015 949 HA HIS 125 HA HIS 125 -3.771 -12.103 16.130 950 1HB HIS 125 HB1 HIS 125 -2.315 -10.339 14.768 951 2HB HIS 125 HB2 HIS 125 -2.994 -9.223 15.948 952 HD2 HIS 125 HD2 HIS 125 -0.923 -8.827 17.615 953 HE1 HIS 125 HE1 HIS 125 0.004 -12.905 18.270 954 HE2 HIS 125 HE2 HIS 125 0.538 -10.517 18.935 955 H GLN 126 HN GLN 126 -5.913 -9.453 15.404 956 HA GLN 126 HA GLN 126 -6.379 -8.499 18.020 957 1HB GLN 126 HB1 GLN 126 -8.002 -8.518 15.491 958 2HB GLN 126 HB2 GLN 126 -8.718 -7.959 16.997 959 1HG GLN 126 HG2 GLN 126 -6.182 -6.839 15.829 960 2HG GLN 126 HG1 GLN 126 -7.785 -6.164 15.541 961 1HE2 GLN 126 HE21 GLN 126 -5.182 -5.436 17.099 962 2HE2 GLN 126 HE22 GLN 126 -5.804 -4.794 18.577 963 H ALA 127 HN ALA 127 -8.697 -10.419 16.152 964 HA ALA 127 HA ALA 127 -9.443 -11.875 18.587 965 1HB ALA 127 HB1 ALA 127 -11.510 -11.966 17.750 966 2HB ALA 127 HB2 ALA 127 -10.926 -12.620 16.221 967 3HB ALA 127 HB3 ALA 127 -10.967 -10.876 16.475 968 H LYS 128 HN LYS 128 -6.997 -12.490 17.946 969 HA LYS 128 HA LYS 128 -6.557 -14.318 15.893 970 1HB LYS 128 HB2 LYS 128 -4.460 -14.866 17.138 971 2HB LYS 128 HB1 LYS 128 -4.707 -13.148 16.861 972 1HG LYS 128 HG2 LYS 128 -5.417 -12.831 19.137 973 2HG LYS 128 HG1 LYS 128 -5.349 -14.569 19.431 974 1HD LYS 128 HD1 LYS 128 -2.885 -14.416 18.795 975 2HD LYS 128 HD2 LYS 128 -3.073 -12.668 18.947 976 1HE LYS 128 HE2 LYS 128 -3.945 -14.478 21.162 977 2HE LYS 128 HE1 LYS 128 -2.244 -14.051 20.983 978 1HZ LYS 128 HZ1 LYS 128 -4.322 -11.959 21.037 979 2HZ LYS 128 HZ2 LYS 128 -2.675 -11.828 21.395 980 3HZ LYS 128 HZ3 LYS 128 -3.716 -12.607 22.477 981 H GLU 129 HN GLU 129 -7.398 -16.198 15.655 982 HA GLU 129 HA GLU 129 -8.194 -17.838 17.934 983 1HB GLU 129 HB2 GLU 129 -9.325 -17.497 15.474 984 2HB GLU 129 HB1 GLU 129 -8.394 -18.966 15.213 985 1HG GLU 129 HG2 GLU 129 -9.626 -20.181 16.725 986 2HG GLU 129 HG1 GLU 129 -10.147 -18.750 17.613 987 H ALA 130 HN ALA 130 -5.405 -17.125 16.769 988 HA ALA 130 HA ALA 130 -4.270 -19.679 16.093 989 1HB ALA 130 HB1 ALA 130 -3.326 -17.801 15.010 990 2HB ALA 130 HB2 ALA 130 -2.118 -18.348 16.174 991 3HB ALA 130 HB3 ALA 130 -3.115 -16.936 16.534 992 H ALA 131 HN ALA 131 -5.508 -19.058 18.836 993 HA ALA 131 HA ALA 131 -3.281 -19.317 20.654 994 1HB ALA 131 HB1 ALA 131 -5.737 -19.923 21.941 995 2HB ALA 131 HB2 ALA 131 -6.004 -18.559 20.856 996 3HB ALA 131 HB3 ALA 131 -4.745 -18.473 22.087 997 H GLN 132 HN GLN 132 -4.108 -21.414 18.545 998 HA GLN 132 HA GLN 132 -4.912 -23.733 19.966 999 1HB GLN 132 HB1 GLN 132 -3.999 -24.920 17.897 1000 2HB GLN 132 HB2 GLN 132 -5.298 -23.763 17.640 1001 1HG GLN 132 HG2 GLN 132 -4.049 -22.571 16.258 1002 2HG GLN 132 HG1 GLN 132 -2.750 -22.456 17.444 1003 1HE2 GLN 132 HE21 GLN 132 -3.993 -24.192 14.710 1004 2HE2 GLN 132 HE22 GLN 132 -2.564 -25.105 14.381 1005 H LYS 133 HN LYS 133 -3.568 -25.708 20.163 1006 HA LYS 133 HA LYS 133 -1.075 -25.046 21.473 1007 1HB LYS 133 HB2 LYS 133 -3.024 -27.139 21.652 1008 2HB LYS 133 HB1 LYS 133 -1.442 -27.855 21.375 1009 1HG LYS 133 HG1 LYS 133 -1.002 -27.619 23.528 1010 2HG LYS 133 HG2 LYS 133 -1.075 -25.867 23.324 1011 1HD LYS 133 HD1 LYS 133 -3.283 -25.747 24.028 1012 2HD LYS 133 HD2 LYS 133 -3.590 -27.449 23.675 1013 1HE LYS 133 HE2 LYS 133 -3.419 -27.618 25.927 1014 2HE LYS 133 HE1 LYS 133 -1.704 -27.750 25.535 1015 1HZ LYS 133 HZ1 LYS 133 -1.887 -25.138 25.738 1016 2HZ LYS 133 HZ2 LYS 133 -1.603 -26.122 27.084 1017 3HZ LYS 133 HZ3 LYS 133 -3.162 -25.546 26.772 1018 H ALA 134 HN ALA 134 0.434 -24.540 19.944 1019 HA ALA 134 HA ALA 134 0.825 -26.066 17.563 1020 1HB ALA 134 HB1 ALA 134 1.748 -24.101 17.062 1021 2HB ALA 134 HB2 ALA 134 3.161 -24.654 17.960 1022 3HB ALA 134 HB3 ALA 134 1.938 -23.667 18.760 1023 H VAL 135 HN VAL 135 1.837 -27.940 17.362 1024 HA VAL 135 HA VAL 135 3.512 -28.903 19.559 1025 HB VAL 135 HB VAL 135 2.935 -30.662 17.242 1026 1HG1 VAL 135 HG11 VAL 135 4.085 -31.065 19.631 1027 2HG1 VAL 135 HG12 VAL 135 3.235 -32.329 18.741 1028 3HG1 VAL 135 HG13 VAL 135 2.415 -31.459 20.037 1029 1HG2 VAL 135 HG21 VAL 135 0.691 -31.217 18.181 1030 2HG2 VAL 135 HG22 VAL 135 0.789 -29.622 17.433 1031 3HG2 VAL 135 HG23 VAL 135 0.814 -29.775 19.190 1032 H ASN 136 HN ASN 136 5.626 -29.572 19.290 1033 HA ASN 136 HA ASN 136 7.030 -28.348 17.080 1034 1HB ASN 136 HB2 ASN 136 9.073 -29.176 18.312 1035 2HB ASN 136 HB1 ASN 136 8.046 -28.076 19.225 1036 1HD2 ASN 136 HD21 ASN 136 9.550 -29.276 20.837 1037 2HD2 ASN 136 HD22 ASN 136 8.836 -30.644 21.612 1038 H SER 137 HN SER 137 6.078 -29.755 15.439 1039 HA SER 137 HA SER 137 7.103 -32.492 15.408 1040 1HB SER 137 HB1 SER 137 5.207 -32.993 14.324 1041 2HB SER 137 HB2 SER 137 4.700 -31.316 14.522 1042 HG SER 137 HG SER 137 4.878 -31.152 12.448 1043 H ALA 138 HN ALA 138 8.007 -33.316 13.345 1044 HA ALA 138 HA ALA 138 10.200 -31.715 12.529 1045 1HB ALA 138 HB1 ALA 138 10.436 -34.102 12.624 1046 2HB ALA 138 HB2 ALA 138 10.671 -33.575 10.957 1047 3HB ALA 138 HB3 ALA 138 9.147 -34.318 11.440 1048 H THR 139 HN THR 139 7.009 -32.211 11.265 1049 HA THR 139 HA THR 139 7.723 -30.820 8.780 1050 HB THR 139 HB THR 139 6.555 -32.886 8.389 1051 HG1 THR 139 HG1 THR 139 4.976 -32.102 7.119 1052 1HG2 THR 139 HG21 THR 139 4.383 -31.854 10.192 1053 2HG2 THR 139 HG22 THR 139 5.457 -33.215 10.517 1054 3HG2 THR 139 HG23 THR 139 4.293 -33.304 9.195 1055 H GLY 140 HN GLY 140 6.748 -28.916 8.172 1056 1HA GLY 140 HA1 GLY 140 5.273 -27.536 10.319 1057 2HA GLY 140 HA2 GLY 140 6.244 -26.739 9.091 1058 H VAL 141 HN VAL 141 4.612 -25.390 8.375 1059 HA VAL 141 HA VAL 141 2.183 -26.641 7.316 1060 HB VAL 141 HB VAL 141 1.478 -24.209 6.960 1061 1HG1 VAL 141 HG11 VAL 141 1.870 -24.595 9.862 1062 2HG1 VAL 141 HG12 VAL 141 1.070 -25.905 8.993 1063 3HG1 VAL 141 HG13 VAL 141 0.397 -24.276 8.945 1064 1HG2 VAL 141 HG21 VAL 141 3.474 -22.999 7.097 1065 2HG2 VAL 141 HG22 VAL 141 3.984 -23.830 8.566 1066 3HG2 VAL 141 HG23 VAL 141 2.660 -22.666 8.624 1067 HA PRO 142 HA PRO 142 3.932 -26.222 3.234 1068 1HB PRO 142 HB2 PRO 142 1.899 -27.271 1.838 1069 2HB PRO 142 HB1 PRO 142 2.917 -28.272 2.882 1070 1HG PRO 142 HG2 PRO 142 0.191 -27.148 3.399 1071 2HG PRO 142 HG1 PRO 142 0.828 -28.758 3.777 1072 1HD PRO 142 HD1 PRO 142 0.635 -26.705 5.597 1073 2HD PRO 142 HD2 PRO 142 1.782 -28.052 5.730 1074 H THR 143 HN THR 143 2.821 -23.842 4.362 1075 HA THR 143 HA THR 143 1.159 -22.775 2.190 1076 HB THR 143 HB THR 143 1.143 -20.764 3.934 1077 HG1 THR 143 HG1 THR 143 1.116 -21.739 6.066 1078 1HG2 THR 143 HG21 THR 143 -0.895 -21.815 3.323 1079 2HG2 THR 143 HG22 THR 143 -0.809 -21.786 5.084 1080 3HG2 THR 143 HG23 THR 143 -0.471 -23.280 4.210 1081 H VAL 144 HN VAL 144 4.231 -23.213 2.469 1082 HA VAL 144 HA VAL 144 5.225 -20.509 2.126 1083 HB VAL 144 HB VAL 144 6.573 -22.172 3.351 1084 1HG1 VAL 144 HG21 VAL 144 7.250 -24.159 2.515 1085 2HG1 VAL 144 HG22 VAL 144 7.425 -23.534 0.876 1086 3HG1 VAL 144 HG23 VAL 144 5.828 -23.961 1.491 1087 1HG2 VAL 144 HG11 VAL 144 7.446 -20.258 1.661 1088 2HG2 VAL 144 HG12 VAL 144 8.270 -21.670 0.999 1089 3HG2 VAL 144 HG13 VAL 144 8.505 -21.222 2.689 Start of MODEL 28 1 1H GLY 1 HT1 GLY 1 25.685 58.372 -30.675 2 2H GLY 1 HT2 GLY 1 25.034 57.144 -29.713 3 3H GLY 1 HT3 GLY 1 26.231 56.780 -30.851 4 1HA GLY 1 HA1 GLY 1 26.605 57.367 -28.189 5 2HA GLY 1 HA2 GLY 1 27.847 57.200 -29.421 6 HA PRO 2 HA PRO 2 27.493 61.685 -27.915 7 1HB PRO 2 HB2 PRO 2 29.218 61.796 -25.867 8 2HB PRO 2 HB1 PRO 2 27.544 61.275 -25.638 9 1HG PRO 2 HG2 PRO 2 30.033 59.627 -25.865 10 2HG PRO 2 HG1 PRO 2 28.659 59.431 -24.763 11 1HD PRO 2 HD2 PRO 2 29.008 57.983 -27.077 12 2HD PRO 2 HD1 PRO 2 27.435 58.276 -26.311 13 H LEU 3 HN LEU 3 28.920 60.586 -30.052 14 HA LEU 3 HA LEU 3 31.705 61.330 -29.788 15 1HB LEU 3 HB1 LEU 3 30.082 60.384 -32.151 16 2HB LEU 3 HB2 LEU 3 31.800 60.725 -32.214 17 HG LEU 3 HG LEU 3 30.854 58.776 -30.173 18 1HD1 LEU 3 HD21 LEU 3 29.737 58.327 -32.461 19 2HD1 LEU 3 HD22 LEU 3 30.564 57.006 -31.635 20 3HD1 LEU 3 HD23 LEU 3 31.355 57.846 -32.969 21 1HD2 LEU 3 HD11 LEU 3 33.051 57.748 -31.366 22 2HD2 LEU 3 HD12 LEU 3 33.093 58.841 -29.982 23 3HD2 LEU 3 HD13 LEU 3 33.319 59.473 -31.612 24 H GLY 4 HN GLY 4 29.182 62.284 -32.131 25 1HA GLY 4 HA2 GLY 4 30.540 64.859 -32.456 26 2HA GLY 4 HA1 GLY 4 29.299 64.202 -33.513 27 H SER 5 HN SER 5 27.444 63.531 -31.423 28 HA SER 5 HA SER 5 26.380 66.202 -30.954 29 1HB SER 5 HB1 SER 5 25.241 63.440 -30.992 30 2HB SER 5 HB2 SER 5 24.412 64.673 -30.040 31 HG SER 5 HG SER 5 24.579 64.370 -32.759 32 H ALA 6 HN ALA 6 27.829 66.844 -29.291 33 HA ALA 6 HA ALA 6 27.695 65.371 -26.770 34 1HB ALA 6 HB1 ALA 6 29.425 67.046 -26.041 35 2HB ALA 6 HB2 ALA 6 29.422 67.653 -27.697 36 3HB ALA 6 HB3 ALA 6 29.904 65.989 -27.368 37 H ALA 7 HN ALA 7 25.789 65.811 -25.787 38 HA ALA 7 HA ALA 7 24.898 68.595 -25.594 39 1HB ALA 7 HB1 ALA 7 23.568 66.010 -25.625 40 2HB ALA 7 HB2 ALA 7 22.938 67.614 -26.003 41 3HB ALA 7 HB3 ALA 7 22.993 67.059 -24.330 42 H ALA 8 HN ALA 8 26.833 68.901 -24.135 43 HA ALA 8 HA ALA 8 27.712 69.291 -22.074 44 1HB ALA 8 HB1 ALA 8 26.225 70.447 -20.908 45 2HB ALA 8 HB2 ALA 8 25.443 68.954 -20.388 46 3HB ALA 8 HB3 ALA 8 24.929 69.745 -21.878 47 H ALA 9 HN ALA 9 27.229 68.326 -19.559 48 HA ALA 9 HA ALA 9 27.414 65.402 -19.851 49 1HB ALA 9 HB1 ALA 9 29.071 66.488 -17.715 50 2HB ALA 9 HB2 ALA 9 29.568 67.015 -19.324 51 3HB ALA 9 HB3 ALA 9 29.455 65.293 -18.954 52 H THR 10 HN THR 10 25.138 66.967 -19.069 53 HA THR 10 HA THR 10 24.758 65.871 -16.375 54 HB THR 10 HB THR 10 25.103 68.129 -15.835 55 HG1 THR 10 HG1 THR 10 23.115 67.364 -15.006 56 1HG2 THR 10 HG21 THR 10 23.216 69.142 -17.913 57 2HG2 THR 10 HG22 THR 10 24.921 68.881 -18.286 58 3HG2 THR 10 HG23 THR 10 24.459 70.007 -17.010 59 HA PRO 11 HA PRO 11 21.124 64.254 -18.364 60 1HB PRO 11 HB1 PRO 11 19.854 63.321 -16.158 61 2HB PRO 11 HB2 PRO 11 21.254 62.511 -16.872 62 1HG PRO 11 HG2 PRO 11 21.130 64.359 -14.518 63 2HG PRO 11 HG1 PRO 11 22.029 62.842 -14.701 64 1HD PRO 11 HD2 PRO 11 23.196 65.271 -14.977 65 2HD PRO 11 HD1 PRO 11 23.726 63.847 -15.896 66 H ALA 12 HN ALA 12 19.165 65.052 -18.903 67 HA ALA 12 HA ALA 12 18.326 67.543 -17.734 68 1HB ALA 12 HB1 ALA 12 18.035 67.500 -20.035 69 2HB ALA 12 HB2 ALA 12 16.403 67.225 -19.425 70 3HB ALA 12 HB3 ALA 12 17.362 65.870 -20.021 71 H VAL 13 HN VAL 13 17.642 64.253 -17.191 72 HA VAL 13 HA VAL 13 15.088 64.870 -15.878 73 HB VAL 13 HB VAL 13 16.254 62.133 -16.374 74 1HG1 VAL 13 HG21 VAL 13 13.982 61.360 -16.010 75 2HG1 VAL 13 HG22 VAL 13 13.433 63.021 -15.784 76 3HG1 VAL 13 HG23 VAL 13 14.539 62.291 -14.620 77 1HG2 VAL 13 HG11 VAL 13 14.515 63.851 -18.115 78 2HG2 VAL 13 HG12 VAL 13 14.505 62.091 -18.239 79 3HG2 VAL 13 HG13 VAL 13 15.995 62.988 -18.539 80 H ARG 14 HN ARG 14 15.969 65.868 -14.025 81 HA ARG 14 HA ARG 14 17.683 64.235 -12.310 82 1HB ARG 14 HB2 ARG 14 17.357 67.048 -12.756 83 2HB ARG 14 HB1 ARG 14 17.051 66.699 -11.060 84 1HG ARG 14 HG2 ARG 14 19.320 65.240 -11.590 85 2HG ARG 14 HG1 ARG 14 19.548 66.708 -12.544 86 1HD ARG 14 HD1 ARG 14 18.549 67.097 -9.798 87 2HD ARG 14 HD2 ARG 14 20.199 66.493 -9.937 88 HE ARG 14 HE ARG 14 19.228 69.112 -10.698 89 1HH1 ARG 14 HH11 ARG 14 21.792 66.764 -10.940 90 2HH1 ARG 14 HH12 ARG 14 22.993 67.932 -11.379 91 1HH2 ARG 14 HH21 ARG 14 20.805 70.656 -11.275 92 2HH2 ARG 14 HH22 ARG 14 22.433 70.143 -11.570 93 H THR 15 HN THR 15 17.037 63.364 -10.412 94 HA THR 15 HA THR 15 14.182 63.589 -9.766 95 HB THR 15 HB THR 15 15.007 61.322 -10.232 96 HG1 THR 15 HG1 THR 15 14.541 60.554 -7.897 97 1HG2 THR 15 HG21 THR 15 16.395 60.502 -8.041 98 2HG2 THR 15 HG22 THR 15 17.121 62.074 -8.375 99 3HG2 THR 15 HG23 THR 15 17.090 60.833 -9.628 100 H VAL 16 HN VAL 16 13.480 64.000 -7.671 101 HA VAL 16 HA VAL 16 15.492 65.272 -5.946 102 HB VAL 16 HB VAL 16 13.457 66.302 -4.821 103 1HG1 VAL 16 HG21 VAL 16 14.593 67.851 -6.052 104 2HG1 VAL 16 HG22 VAL 16 13.081 67.817 -6.959 105 3HG1 VAL 16 HG23 VAL 16 14.479 66.914 -7.542 106 1HG2 VAL 16 HG11 VAL 16 12.023 64.515 -6.229 107 2HG2 VAL 16 HG12 VAL 16 11.912 65.911 -7.302 108 3HG2 VAL 16 HG13 VAL 16 11.366 66.039 -5.630 109 HA PRO 17 HA PRO 17 14.950 61.959 -3.036 110 1HB PRO 17 HB2 PRO 17 16.110 63.098 -0.879 111 2HB PRO 17 HB1 PRO 17 17.045 62.530 -2.268 112 1HG PRO 17 HG1 PRO 17 16.156 65.310 -1.589 113 2HG PRO 17 HG2 PRO 17 17.734 64.755 -2.178 114 1HD PRO 17 HD2 PRO 17 15.873 65.881 -3.801 115 2HD PRO 17 HD1 PRO 17 17.019 64.649 -4.365 116 H GLN 18 HN GLN 18 13.340 64.892 -2.950 117 HA GLN 18 HA GLN 18 12.125 64.680 -0.365 118 1HB GLN 18 HB1 GLN 18 11.791 66.424 -2.759 119 2HB GLN 18 HB2 GLN 18 10.460 66.343 -1.613 120 1HG GLN 18 HG2 GLN 18 11.997 67.005 0.188 121 2HG GLN 18 HG1 GLN 18 13.297 67.139 -0.996 122 1HE2 GLN 18 HE21 GLN 18 10.107 68.384 -0.159 123 2HE2 GLN 18 HE22 GLN 18 10.339 69.953 -0.845 124 H TYR 19 HN TYR 19 9.969 64.130 0.111 125 HA TYR 19 HA TYR 19 8.968 61.921 -1.407 126 1HB TYR 19 HB1 TYR 19 8.132 63.328 1.103 127 2HB TYR 19 HB2 TYR 19 7.019 62.208 0.325 128 HD1 TYR 19 HD1 TYR 19 9.687 62.517 2.623 129 HD2 TYR 19 HD2 TYR 19 7.974 59.836 -0.202 130 HE1 TYR 19 HE1 TYR 19 10.815 60.637 3.734 131 HE2 TYR 19 HE2 TYR 19 9.098 57.947 0.902 132 HH TYR 19 HH TYR 19 10.010 57.445 3.217 133 H LYS 20 HN LYS 20 6.583 61.804 -1.954 134 HA LYS 20 HA LYS 20 5.869 64.231 -3.441 135 1HB LYS 20 HB2 LYS 20 4.829 61.412 -3.789 136 2HB LYS 20 HB1 LYS 20 4.499 62.782 -4.841 137 1HG LYS 20 HG1 LYS 20 6.920 62.899 -5.366 138 2HG LYS 20 HG2 LYS 20 7.154 61.432 -4.414 139 1HD LYS 20 HD2 LYS 20 5.013 61.109 -6.325 140 2HD LYS 20 HD1 LYS 20 6.513 61.593 -7.121 141 1HE LYS 20 HE2 LYS 20 6.612 59.260 -7.082 142 2HE LYS 20 HE1 LYS 20 7.626 59.759 -5.729 143 1HZ LYS 20 HZ1 LYS 20 5.715 59.367 -4.254 144 2HZ LYS 20 HZ2 LYS 20 6.211 57.963 -5.054 145 3HZ LYS 20 HZ3 LYS 20 4.826 58.785 -5.570 146 H TYR 21 HN TYR 21 4.330 65.480 -2.638 147 HA TYR 21 HA TYR 21 2.722 64.714 -0.427 148 1HB TYR 21 HB2 TYR 21 2.478 67.097 -2.278 149 2HB TYR 21 HB1 TYR 21 1.628 66.911 -0.747 150 HD1 TYR 21 HD1 TYR 21 3.225 66.420 1.324 151 HD2 TYR 21 HD2 TYR 21 4.432 68.323 -2.285 152 HE1 TYR 21 HE1 TYR 21 5.118 67.450 2.508 153 HE2 TYR 21 HE2 TYR 21 6.330 69.357 -1.111 154 HH TYR 21 HH TYR 21 7.023 69.941 1.111 155 H ALA 22 HN ALA 22 0.506 64.349 -0.304 156 HA ALA 22 HA ALA 22 -0.621 62.967 -2.544 157 1HB ALA 22 HB1 ALA 22 -1.856 63.690 0.111 158 2HB ALA 22 HB2 ALA 22 -1.004 62.192 -0.266 159 3HB ALA 22 HB3 ALA 22 -2.530 62.565 -1.068 160 H ALA 23 HN ALA 23 -1.007 64.370 -4.218 161 HA ALA 23 HA ALA 23 -2.457 66.836 -3.795 162 1HB ALA 23 HB1 ALA 23 -0.615 66.491 -5.506 163 2HB ALA 23 HB2 ALA 23 -2.078 67.297 -6.072 164 3HB ALA 23 HB3 ALA 23 -1.804 65.598 -6.455 165 H GLY 24 HN GLY 24 -4.560 66.619 -3.301 166 1HA GLY 24 HA1 GLY 24 -6.157 64.561 -4.626 167 2HA GLY 24 HA2 GLY 24 -6.661 65.547 -3.262 168 H VAL 25 HN VAL 25 -6.316 65.396 -6.732 169 HA VAL 25 HA VAL 25 -7.791 67.925 -6.999 170 HB VAL 25 HB VAL 25 -7.196 67.466 -9.526 171 1HG1 VAL 25 HG11 VAL 25 -4.860 68.548 -8.937 172 2HG1 VAL 25 HG12 VAL 25 -5.590 68.673 -7.336 173 3HG1 VAL 25 HG13 VAL 25 -6.368 69.436 -8.723 174 1HG2 VAL 25 HG21 VAL 25 -4.640 66.514 -9.080 175 2HG2 VAL 25 HG22 VAL 25 -5.968 65.630 -9.830 176 3HG2 VAL 25 HG23 VAL 25 -5.659 65.458 -8.102 177 H ARG 26 HN ARG 26 -7.675 64.701 -8.527 178 HA ARG 26 HA ARG 26 -10.506 64.981 -9.224 179 1HB ARG 26 HB2 ARG 26 -8.477 64.138 -10.765 180 2HB ARG 26 HB1 ARG 26 -8.954 62.594 -10.071 181 1HG ARG 26 HG2 ARG 26 -10.220 62.653 -11.982 182 2HG ARG 26 HG1 ARG 26 -11.346 63.320 -10.798 183 1HD ARG 26 HD2 ARG 26 -9.583 65.248 -12.179 184 2HD ARG 26 HD1 ARG 26 -10.833 64.481 -13.159 185 HE ARG 26 HE ARG 26 -11.952 65.434 -10.752 186 1HH1 ARG 26 HH11 ARG 26 -10.672 66.568 -13.788 187 2HH1 ARG 26 HH12 ARG 26 -11.636 68.006 -13.805 188 1HH2 ARG 26 HH21 ARG 26 -13.224 67.326 -10.765 189 2HH2 ARG 26 HH22 ARG 26 -13.087 68.437 -12.086 190 H ASN 27 HN ASN 27 -11.645 62.692 -9.203 191 HA ASN 27 HA ASN 27 -11.587 61.854 -6.424 192 1HB ASN 27 HB2 ASN 27 -13.531 61.647 -8.661 193 2HB ASN 27 HB1 ASN 27 -13.587 60.385 -7.434 194 1HD2 ASN 27 HD21 ASN 27 -14.394 60.830 -5.453 195 2HD2 ASN 27 HD22 ASN 27 -15.077 62.355 -5.010 196 HA PRO 28 HA PRO 28 -10.820 57.590 -8.612 197 1HB PRO 28 HB2 PRO 28 -9.801 58.314 -11.272 198 2HB PRO 28 HB1 PRO 28 -11.040 57.138 -10.829 199 1HG PRO 28 HG2 PRO 28 -11.653 59.443 -12.067 200 2HG PRO 28 HG1 PRO 28 -12.732 58.705 -10.869 201 1HD PRO 28 HD2 PRO 28 -10.824 60.994 -10.546 202 2HD PRO 28 HD1 PRO 28 -12.480 60.814 -9.929 203 H GLN 29 HN GLN 29 -9.139 58.074 -7.019 204 HA GLN 29 HA GLN 29 -6.547 58.885 -8.065 205 1HB GLN 29 HB1 GLN 29 -7.691 59.445 -5.719 206 2HB GLN 29 HB2 GLN 29 -6.873 57.959 -5.255 207 1HG GLN 29 HG1 GLN 29 -4.741 58.878 -5.904 208 2HG GLN 29 HG2 GLN 29 -5.524 60.337 -6.511 209 1HE2 GLN 29 HE21 GLN 29 -3.473 60.039 -4.463 210 2HE2 GLN 29 HE22 GLN 29 -4.122 60.749 -3.028 211 H GLN 30 HN GLN 30 -8.037 56.064 -6.514 212 HA GLN 30 HA GLN 30 -5.643 54.475 -6.880 213 1HB GLN 30 HB1 GLN 30 -8.143 54.249 -5.386 214 2HB GLN 30 HB2 GLN 30 -7.667 52.737 -6.147 215 1HG GLN 30 HG2 GLN 30 -6.628 52.561 -4.119 216 2HG GLN 30 HG1 GLN 30 -5.343 53.267 -5.098 217 1HE2 GLN 30 HE21 GLN 30 -6.719 53.418 -2.183 218 2HE2 GLN 30 HE22 GLN 30 -6.430 55.073 -1.779 219 H HIS 31 HN HIS 31 -6.078 52.157 -7.775 220 HA HIS 31 HA HIS 31 -7.737 52.318 -10.194 221 1HB HIS 31 HB2 HIS 31 -5.118 52.678 -10.434 222 2HB HIS 31 HB1 HIS 31 -5.102 50.919 -10.351 223 HD2 HIS 31 HD2 HIS 31 -4.454 50.543 -12.988 224 HE1 HIS 31 HE1 HIS 31 -7.925 52.400 -14.541 225 HE2 HIS 31 HE2 HIS 31 -5.877 51.016 -15.106 226 H LEU 32 HN LEU 32 -8.968 51.085 -8.366 227 HA LEU 32 HA LEU 32 -8.183 48.288 -8.175 228 1HB LEU 32 HB1 LEU 32 -10.160 48.098 -6.684 229 2HB LEU 32 HB2 LEU 32 -8.979 49.275 -6.146 230 HG LEU 32 HG LEU 32 -10.992 50.538 -7.789 231 1HD1 LEU 32 HD11 LEU 32 -11.923 48.513 -5.929 232 2HD1 LEU 32 HD12 LEU 32 -12.810 49.417 -7.156 233 3HD1 LEU 32 HD13 LEU 32 -12.555 50.117 -5.557 234 1HD2 LEU 32 HD21 LEU 32 -10.261 52.155 -6.459 235 2HD2 LEU 32 HD22 LEU 32 -9.462 50.990 -5.403 236 3HD2 LEU 32 HD23 LEU 32 -11.155 51.408 -5.134 237 H ASN 33 HN ASN 33 -9.124 46.640 -9.238 238 HA ASN 33 HA ASN 33 -11.067 47.327 -11.307 239 1HB ASN 33 HB2 ASN 33 -8.828 45.712 -11.328 240 2HB ASN 33 HB1 ASN 33 -10.145 44.548 -11.218 241 1HD2 ASN 33 HD21 ASN 33 -10.781 43.833 -13.105 242 2HD2 ASN 33 HD22 ASN 33 -10.801 44.724 -14.586 243 H ALA 34 HN ALA 34 -12.410 45.051 -11.761 244 HA ALA 34 HA ALA 34 -14.324 45.027 -9.630 245 1HB ALA 34 HB1 ALA 34 -14.748 44.824 -12.164 246 2HB ALA 34 HB2 ALA 34 -15.717 43.842 -11.065 247 3HB ALA 34 HB3 ALA 34 -14.365 43.118 -11.936 248 H GLN 35 HN GLN 35 -14.331 43.744 -7.915 249 HA GLN 35 HA GLN 35 -12.606 41.376 -7.921 250 1HB GLN 35 HB1 GLN 35 -13.730 43.088 -5.721 251 2HB GLN 35 HB2 GLN 35 -13.094 41.484 -5.387 252 1HG GLN 35 HG1 GLN 35 -11.261 43.033 -6.993 253 2HG GLN 35 HG2 GLN 35 -11.671 43.858 -5.489 254 1HE2 GLN 35 HE21 GLN 35 -9.373 43.494 -5.058 255 2HE2 GLN 35 HE22 GLN 35 -8.893 41.994 -4.349 256 HA PRO 36 HA PRO 36 -16.853 39.695 -6.176 257 1HB PRO 36 HB2 PRO 36 -18.751 41.648 -7.325 258 2HB PRO 36 HB1 PRO 36 -18.734 40.905 -5.724 259 1HG PRO 36 HG1 PRO 36 -18.073 43.474 -6.068 260 2HG PRO 36 HG2 PRO 36 -17.245 42.457 -4.873 261 1HD PRO 36 HD2 PRO 36 -16.330 43.322 -7.589 262 2HD PRO 36 HD1 PRO 36 -15.406 43.187 -6.078 263 H GLN 37 HN GLN 37 -17.263 37.993 -7.420 264 HA GLN 37 HA GLN 37 -17.373 38.289 -10.308 265 1HB GLN 37 HB2 GLN 37 -17.391 35.839 -8.537 266 2HB GLN 37 HB1 GLN 37 -17.399 35.794 -10.295 267 1HG GLN 37 HG1 GLN 37 -15.259 37.406 -9.774 268 2HG GLN 37 HG2 GLN 37 -15.201 36.261 -8.434 269 1HE2 GLN 37 HE21 GLN 37 -13.726 36.765 -11.125 270 2HE2 GLN 37 HE22 GLN 37 -13.552 35.168 -11.763 271 H VAL 38 HN VAL 38 -19.071 37.431 -11.605 272 HA VAL 38 HA VAL 38 -21.684 37.801 -10.391 273 HB VAL 38 HB VAL 38 -22.512 37.616 -12.746 274 1HG1 VAL 38 HG11 VAL 38 -21.538 39.739 -11.473 275 2HG1 VAL 38 HG12 VAL 38 -22.128 39.823 -13.132 276 3HG1 VAL 38 HG13 VAL 38 -20.398 39.690 -12.817 277 1HG2 VAL 38 HG21 VAL 38 -20.244 38.096 -14.246 278 2HG2 VAL 38 HG22 VAL 38 -21.171 36.596 -14.205 279 3HG2 VAL 38 HG23 VAL 38 -19.763 36.789 -13.163 280 H THR 39 HN THR 39 -19.737 35.254 -11.799 281 HA THR 39 HA THR 39 -21.945 33.354 -11.375 282 HB THR 39 HB THR 39 -19.577 32.439 -12.876 283 HG1 THR 39 HG1 THR 39 -21.015 33.719 -14.657 284 1HG2 THR 39 HG21 THR 39 -21.769 32.085 -14.462 285 2HG2 THR 39 HG22 THR 39 -22.447 31.966 -12.838 286 3HG2 THR 39 HG23 THR 39 -21.121 30.907 -13.320 287 H MET 40 HN MET 40 -21.793 32.369 -9.478 288 HA MET 40 HA MET 40 -19.185 31.898 -8.269 289 1HB MET 40 HB2 MET 40 -21.927 31.287 -7.151 290 2HB MET 40 HB1 MET 40 -20.410 31.318 -6.261 291 1HG MET 40 HG2 MET 40 -20.237 33.664 -6.448 292 2HG MET 40 HG1 MET 40 -21.523 33.735 -7.649 293 1HE MET 40 HE1 MET 40 -21.307 34.614 -3.647 294 2HE MET 40 HE2 MET 40 -22.454 35.664 -4.479 295 3HE MET 40 HE3 MET 40 -20.885 35.321 -5.207 296 H GLN 41 HN GLN 41 -21.715 30.214 -9.892 297 HA GLN 41 HA GLN 41 -21.987 28.062 -10.568 298 1HB GLN 41 HB2 GLN 41 -19.016 27.890 -10.034 299 2HB GLN 41 HB1 GLN 41 -19.954 26.739 -10.976 300 1HG GLN 41 HG1 GLN 41 -20.428 29.321 -12.040 301 2HG GLN 41 HG2 GLN 41 -18.688 29.124 -11.834 302 1HE2 GLN 41 HE21 GLN 41 -17.601 27.588 -13.027 303 2HE2 GLN 41 HE22 GLN 41 -18.311 26.784 -14.382 304 H GLN 42 HN GLN 42 -21.415 25.667 -9.894 305 HA GLN 42 HA GLN 42 -21.566 25.524 -6.959 306 1HB GLN 42 HB2 GLN 42 -23.545 24.782 -8.802 307 2HB GLN 42 HB1 GLN 42 -22.844 23.272 -8.237 308 1HG GLN 42 HG2 GLN 42 -23.150 24.611 -5.900 309 2HG GLN 42 HG1 GLN 42 -24.519 25.221 -6.831 310 1HE2 GLN 42 HE21 GLN 42 -23.075 22.456 -5.327 311 2HE2 GLN 42 HE22 GLN 42 -24.446 21.411 -5.454 312 HA PRO 43 HA PRO 43 -19.354 21.460 -8.466 313 1HB PRO 43 HB1 PRO 43 -18.620 22.102 -11.249 314 2HB PRO 43 HB2 PRO 43 -19.308 20.618 -10.582 315 1HG PRO 43 HG1 PRO 43 -20.764 22.268 -12.109 316 2HG PRO 43 HG2 PRO 43 -21.479 21.398 -10.738 317 1HD PRO 43 HD2 PRO 43 -20.595 24.256 -10.917 318 2HD PRO 43 HD1 PRO 43 -22.054 23.573 -10.167 319 H ALA 44 HN ALA 44 -17.852 22.436 -7.059 320 HA ALA 44 HA ALA 44 -15.974 24.392 -7.832 321 1HB ALA 44 HB1 ALA 44 -16.178 22.481 -5.547 322 2HB ALA 44 HB2 ALA 44 -16.233 24.244 -5.546 323 3HB ALA 44 HB3 ALA 44 -14.698 23.410 -5.788 324 H VAL 45 HN VAL 45 -13.561 23.987 -7.751 325 HA VAL 45 HA VAL 45 -12.950 21.681 -9.469 326 HB VAL 45 HB VAL 45 -10.719 23.348 -9.496 327 1HG1 VAL 45 HG21 VAL 45 -12.233 22.052 -11.291 328 2HG1 VAL 45 HG22 VAL 45 -11.025 23.259 -11.734 329 3HG1 VAL 45 HG23 VAL 45 -12.727 23.712 -11.631 330 1HG2 VAL 45 HG11 VAL 45 -12.165 25.080 -8.413 331 2HG2 VAL 45 HG12 VAL 45 -13.177 25.053 -9.857 332 3HG2 VAL 45 HG13 VAL 45 -11.490 25.555 -9.971 333 H HIS 46 HN HIS 46 -12.398 20.050 -8.128 334 HA HIS 46 HA HIS 46 -10.562 20.566 -5.914 335 1HB HIS 46 HB1 HIS 46 -12.758 18.943 -6.095 336 2HB HIS 46 HB2 HIS 46 -11.451 17.798 -6.377 337 HD2 HIS 46 HD2 HIS 46 -10.337 16.834 -4.142 338 HE1 HIS 46 HE1 HIS 46 -11.711 19.851 -1.509 339 HE2 HIS 46 HE2 HIS 46 -10.461 17.650 -1.682 340 H VAL 47 HN VAL 47 -8.570 19.550 -5.696 341 HA VAL 47 HA VAL 47 -7.448 18.514 -8.210 342 HB VAL 47 HB VAL 47 -5.233 19.075 -7.230 343 1HG1 VAL 47 HG11 VAL 47 -7.331 21.008 -7.936 344 2HG1 VAL 47 HG12 VAL 47 -5.718 20.782 -8.614 345 3HG1 VAL 47 HG13 VAL 47 -5.927 21.692 -7.117 346 1HG2 VAL 47 HG21 VAL 47 -4.959 19.716 -5.113 347 2HG2 VAL 47 HG22 VAL 47 -6.631 19.224 -4.847 348 3HG2 VAL 47 HG23 VAL 47 -6.256 20.905 -5.227 349 H GLN 48 HN GLN 48 -5.531 16.979 -7.815 350 HA GLN 48 HA GLN 48 -6.509 14.819 -6.124 351 1HB GLN 48 HB2 GLN 48 -4.563 15.016 -8.390 352 2HB GLN 48 HB1 GLN 48 -4.468 13.645 -7.293 353 1HG GLN 48 HG1 GLN 48 -6.104 12.637 -8.376 354 2HG GLN 48 HG2 GLN 48 -7.181 13.995 -8.053 355 1HE2 GLN 48 HE21 GLN 48 -4.417 13.260 -10.160 356 2HE2 GLN 48 HE22 GLN 48 -5.113 13.934 -11.590 357 H GLY 49 HN GLY 49 -5.539 16.948 -4.651 358 1HA GLY 49 HA2 GLY 49 -2.800 16.357 -3.879 359 2HA GLY 49 HA1 GLY 49 -3.820 17.628 -3.221 360 H GLN 50 HN GLN 50 -4.677 14.218 -3.462 361 HA GLN 50 HA GLN 50 -4.925 14.159 -0.538 362 1HB GLN 50 HB2 GLN 50 -6.384 12.884 -2.774 363 2HB GLN 50 HB1 GLN 50 -6.147 11.883 -1.348 364 1HG GLN 50 HG1 GLN 50 -7.089 14.599 -0.786 365 2HG GLN 50 HG2 GLN 50 -8.209 13.604 -1.717 366 1HE2 GLN 50 HE21 GLN 50 -7.966 11.159 -0.738 367 2HE2 GLN 50 HE22 GLN 50 -8.349 11.105 0.946 368 H GLU 51 HN GLU 51 -2.425 13.964 -0.860 369 HA GLU 51 HA GLU 51 -1.550 11.258 -1.444 370 1HB GLU 51 HB2 GLU 51 -0.353 13.797 -1.549 371 2HB GLU 51 HB1 GLU 51 0.485 12.934 -0.267 372 1HG GLU 51 HG2 GLU 51 1.569 11.640 -1.708 373 2HG GLU 51 HG1 GLU 51 0.106 11.298 -2.631 374 HA PRO 52 HA PRO 52 -2.062 10.160 2.870 375 1HB PRO 52 HB2 PRO 52 -1.263 7.588 2.656 376 2HB PRO 52 HB1 PRO 52 -2.845 8.139 2.091 377 1HG PRO 52 HG2 PRO 52 -0.341 7.639 0.525 378 2HG PRO 52 HG1 PRO 52 -2.013 7.194 0.133 379 1HD PRO 52 HD1 PRO 52 -0.768 9.361 -0.937 380 2HD PRO 52 HD2 PRO 52 -2.518 9.295 -0.654 381 H LEU 53 HN LEU 53 -0.512 8.463 4.237 382 HA LEU 53 HA LEU 53 2.017 9.896 4.469 383 1HB LEU 53 HB2 LEU 53 0.205 8.844 6.266 384 2HB LEU 53 HB1 LEU 53 1.493 7.661 6.276 385 HG LEU 53 HG LEU 53 1.508 9.553 8.026 386 1HD1 LEU 53 HD11 LEU 53 3.512 8.734 8.395 387 2HD1 LEU 53 HD12 LEU 53 4.174 9.668 7.043 388 3HD1 LEU 53 HD13 LEU 53 3.522 8.049 6.769 389 1HD2 LEU 53 HD21 LEU 53 1.907 11.649 7.449 390 2HD2 LEU 53 HD22 LEU 53 1.487 11.167 5.803 391 3HD2 LEU 53 HD23 LEU 53 3.175 11.184 6.314 392 H THR 54 HN THR 54 4.088 8.861 4.382 393 HA THR 54 HA THR 54 4.345 6.060 3.962 394 HB THR 54 HB THR 54 5.262 7.492 1.525 395 HG1 THR 54 HG1 THR 54 2.818 6.579 1.046 396 1HG2 THR 54 HG21 THR 54 4.401 4.756 2.253 397 2HG2 THR 54 HG22 THR 54 5.773 5.300 1.288 398 3HG2 THR 54 HG23 THR 54 4.153 5.297 0.594 399 H ALA 55 HN ALA 55 6.661 5.678 2.853 400 HA ALA 55 HA ALA 55 8.567 6.351 4.703 401 1HB ALA 55 HB1 ALA 55 10.140 5.329 3.330 402 2HB ALA 55 HB2 ALA 55 9.329 5.850 1.852 403 3HB ALA 55 HB3 ALA 55 8.617 4.581 2.847 404 H SER 56 HN SER 56 8.308 7.808 1.445 405 HA SER 56 HA SER 56 10.387 9.580 1.571 406 1HB SER 56 HB1 SER 56 7.679 10.171 0.351 407 2HB SER 56 HB2 SER 56 9.209 10.939 -0.076 408 HG SER 56 HG SER 56 9.933 8.786 -0.673 409 H MET 57 HN MET 57 7.237 9.865 3.050 410 HA MET 57 HA MET 57 7.569 12.580 3.896 411 1HB MET 57 HB1 MET 57 5.637 10.405 4.702 412 2HB MET 57 HB2 MET 57 5.540 12.059 5.285 413 1HG MET 57 HG2 MET 57 4.871 12.877 3.253 414 2HG MET 57 HG1 MET 57 5.687 11.590 2.363 415 1HE MET 57 HE1 MET 57 4.498 9.369 1.542 416 2HE MET 57 HE2 MET 57 4.153 10.913 0.761 417 3HE MET 57 HE3 MET 57 2.841 9.780 1.091 418 H LEU 58 HN LEU 58 7.947 9.405 5.354 419 HA LEU 58 HA LEU 58 8.515 10.150 7.989 420 1HB LEU 58 HB1 LEU 58 9.294 7.858 6.223 421 2HB LEU 58 HB2 LEU 58 10.010 7.999 7.817 422 HG LEU 58 HG LEU 58 8.219 7.067 8.764 423 1HD1 LEU 58 HD11 LEU 58 5.999 7.927 8.633 424 2HD1 LEU 58 HD12 LEU 58 6.352 8.768 7.124 425 3HD1 LEU 58 HD13 LEU 58 7.103 9.303 8.627 426 1HD2 LEU 58 HD21 LEU 58 7.069 5.578 7.462 427 2HD2 LEU 58 HD22 LEU 58 8.402 5.987 6.379 428 3HD2 LEU 58 HD23 LEU 58 6.819 6.739 6.158 429 H ALA 59 HN ALA 59 10.486 9.981 5.102 430 HA ALA 59 HA ALA 59 12.984 10.518 6.342 431 1HB ALA 59 HB1 ALA 59 13.268 9.510 4.306 432 2HB ALA 59 HB2 ALA 59 13.500 11.198 3.847 433 3HB ALA 59 HB3 ALA 59 11.948 10.411 3.556 434 H SER 60 HN SER 60 10.356 12.481 5.297 435 HA SER 60 HA SER 60 11.761 14.906 4.880 436 1HB SER 60 HB2 SER 60 8.867 14.549 5.694 437 2HB SER 60 HB1 SER 60 9.576 15.978 4.944 438 HG SER 60 HG SER 60 9.424 15.048 3.067 439 H ALA 61 HN ALA 61 11.269 13.173 7.685 440 HA ALA 61 HA ALA 61 11.798 15.565 9.313 441 1HB ALA 61 HB1 ALA 61 10.284 13.478 10.697 442 2HB ALA 61 HB2 ALA 61 9.403 14.256 9.383 443 3HB ALA 61 HB3 ALA 61 10.067 15.229 10.695 444 HA PRO 62 HA PRO 62 14.942 12.045 9.788 445 1HB PRO 62 HB1 PRO 62 16.716 14.432 9.774 446 2HB PRO 62 HB2 PRO 62 16.936 12.855 9.007 447 1HG PRO 62 HG2 PRO 62 16.253 14.988 7.563 448 2HG PRO 62 HG1 PRO 62 15.566 13.390 7.212 449 1HD PRO 62 HD1 PRO 62 14.322 15.730 8.595 450 2HD PRO 62 HD2 PRO 62 13.589 14.555 7.484 451 HA PRO 63 HA PRO 63 16.009 14.009 13.915 452 1HB PRO 63 HB2 PRO 63 16.262 16.635 14.270 453 2HB PRO 63 HB1 PRO 63 17.433 15.744 13.293 454 1HG PRO 63 HG2 PRO 63 15.271 17.586 12.439 455 2HG PRO 63 HG1 PRO 63 16.817 17.227 11.655 456 1HD PRO 63 HD2 PRO 63 14.244 16.118 11.058 457 2HD PRO 63 HD1 PRO 63 15.803 15.718 10.310 458 H GLN 64 HN GLN 64 13.130 14.188 12.743 459 HA GLN 64 HA GLN 64 11.948 15.395 15.152 460 1HB GLN 64 HB1 GLN 64 11.693 16.735 12.978 461 2HB GLN 64 HB2 GLN 64 10.587 15.468 12.469 462 1HG GLN 64 HG2 GLN 64 8.944 16.452 13.564 463 2HG GLN 64 HG1 GLN 64 9.833 16.274 15.075 464 1HE2 GLN 64 HE21 GLN 64 8.078 18.425 14.153 465 2HE2 GLN 64 HE22 GLN 64 9.023 19.869 14.226 466 H GLU 65 HN GLU 65 10.026 13.983 12.601 467 HA GLU 65 HA GLU 65 9.277 11.843 14.467 468 1HB GLU 65 HB1 GLU 65 7.560 12.333 12.122 469 2HB GLU 65 HB2 GLU 65 7.123 12.064 13.802 470 1HG GLU 65 HG2 GLU 65 8.418 14.605 13.528 471 2HG GLU 65 HG1 GLU 65 7.088 14.473 12.378 472 H GLN 66 HN GLN 66 11.601 11.467 12.921 473 HA GLN 66 HA GLN 66 11.049 9.955 10.571 474 1HB GLN 66 HB1 GLN 66 13.337 10.942 11.874 475 2HB GLN 66 HB2 GLN 66 13.532 9.194 11.817 476 1HG GLN 66 HG1 GLN 66 12.785 9.553 9.310 477 2HG GLN 66 HG2 GLN 66 13.418 11.168 9.614 478 1HE2 GLN 66 HE22 GLN 66 14.779 10.133 7.771 479 2HE2 GLN 66 HE21 GLN 66 16.263 9.412 8.284 480 H LYS 67 HN LYS 67 11.046 9.257 13.929 481 HA LYS 67 HA LYS 67 10.522 6.424 13.330 482 1HB LYS 67 HB1 LYS 67 11.830 7.088 15.921 483 2HB LYS 67 HB2 LYS 67 11.960 5.637 14.937 484 1HG LYS 67 HG2 LYS 67 13.831 6.358 13.996 485 2HG LYS 67 HG1 LYS 67 13.088 7.898 13.561 486 1HD LYS 67 HD1 LYS 67 13.786 8.936 15.498 487 2HD LYS 67 HD2 LYS 67 13.911 7.418 16.390 488 1HE LYS 67 HE2 LYS 67 15.746 7.105 14.364 489 2HE LYS 67 HE1 LYS 67 15.898 8.812 14.778 490 1HZ LYS 67 HZ1 LYS 67 15.759 7.115 17.083 491 2HZ LYS 67 HZ2 LYS 67 16.884 8.317 16.695 492 3HZ LYS 67 HZ3 LYS 67 17.079 6.749 16.091 493 H GLN 68 HN GLN 68 8.739 8.729 13.815 494 HA GLN 68 HA GLN 68 7.297 7.591 16.113 495 1HB GLN 68 HB2 GLN 68 8.296 9.596 16.955 496 2HB GLN 68 HB1 GLN 68 7.797 10.510 15.539 497 1HG GLN 68 HG2 GLN 68 5.932 11.095 16.563 498 2HG GLN 68 HG1 GLN 68 5.473 9.399 16.718 499 1HE2 GLN 68 HE22 GLN 68 5.155 11.751 18.517 500 2HE2 GLN 68 HE21 GLN 68 5.824 11.249 20.029 501 H MET 69 HN MET 69 6.937 9.837 13.354 502 HA MET 69 HA MET 69 4.097 9.488 13.297 503 1HB MET 69 HB2 MET 69 4.078 11.058 11.544 504 2HB MET 69 HB1 MET 69 5.388 11.565 12.601 505 1HG MET 69 HG2 MET 69 6.889 11.370 10.983 506 2HG MET 69 HG1 MET 69 6.318 9.760 10.546 507 1HE MET 69 HE1 MET 69 6.729 13.338 9.154 508 2HE MET 69 HE2 MET 69 6.464 12.653 7.551 509 3HE MET 69 HE3 MET 69 7.561 11.857 8.679 510 H LEU 70 HN LEU 70 6.070 7.181 12.698 511 HA LEU 70 HA LEU 70 5.224 6.418 10.016 512 1HB LEU 70 HB1 LEU 70 6.543 4.246 11.166 513 2HB LEU 70 HB2 LEU 70 7.220 5.421 10.057 514 HG LEU 70 HG LEU 70 7.232 5.823 13.040 515 1HD1 LEU 70 HD11 LEU 70 8.420 3.722 12.349 516 2HD1 LEU 70 HD12 LEU 70 9.425 4.930 13.149 517 3HD1 LEU 70 HD13 LEU 70 9.506 4.735 11.398 518 1HD2 LEU 70 HD21 LEU 70 9.269 7.228 12.241 519 2HD2 LEU 70 HD22 LEU 70 7.633 7.867 12.073 520 3HD2 LEU 70 HD23 LEU 70 8.458 7.168 10.678 521 H GLY 71 HN GLY 71 4.557 5.676 13.347 522 1HA GLY 71 HA2 GLY 71 2.393 3.915 12.432 523 2HA GLY 71 HA1 GLY 71 3.424 3.401 13.755 524 H GLU 72 HN GLU 72 3.004 6.744 13.721 525 HA GLU 72 HA GLU 72 0.726 6.571 15.582 526 1HB GLU 72 HB1 GLU 72 3.279 8.151 15.898 527 2HB GLU 72 HB2 GLU 72 1.838 8.456 16.859 528 1HG GLU 72 HG1 GLU 72 2.337 5.693 17.016 529 2HG GLU 72 HG2 GLU 72 3.886 6.506 17.242 530 H ARG 73 HN ARG 73 1.878 7.894 12.749 531 HA ARG 73 HA ARG 73 -0.098 10.074 12.898 532 1HB ARG 73 HB1 ARG 73 2.540 10.549 12.736 533 2HB ARG 73 HB2 ARG 73 2.180 10.362 11.027 534 1HG ARG 73 HG1 ARG 73 0.392 12.127 12.588 535 2HG ARG 73 HG2 ARG 73 2.035 12.698 12.291 536 1HD ARG 73 HD2 ARG 73 1.735 12.407 9.902 537 2HD ARG 73 HD1 ARG 73 0.120 11.749 10.165 538 HE ARG 73 HE ARG 73 0.794 14.504 10.954 539 1HH1 ARG 73 HH11 ARG 73 -1.189 12.227 9.213 540 2HH1 ARG 73 HH12 ARG 73 -2.366 13.411 8.749 541 1HH2 ARG 73 HH22 ARG 73 -0.750 16.067 10.348 542 2HH2 ARG 73 HH21 ARG 73 -2.116 15.594 9.393 543 H LEU 74 HN LEU 74 1.066 7.313 11.306 544 HA LEU 74 HA LEU 74 -0.092 7.820 8.734 545 1HB LEU 74 HB1 LEU 74 1.489 5.780 10.028 546 2HB LEU 74 HB2 LEU 74 0.180 5.059 9.109 547 HG LEU 74 HG LEU 74 1.714 7.154 7.736 548 1HD1 LEU 74 HD11 LEU 74 3.669 5.984 7.423 549 2HD1 LEU 74 HD12 LEU 74 2.954 4.452 7.927 550 3HD1 LEU 74 HD13 LEU 74 3.320 5.691 9.129 551 1HD2 LEU 74 HD21 LEU 74 1.456 5.576 5.872 552 2HD2 LEU 74 HD22 LEU 74 -0.086 5.966 6.636 553 3HD2 LEU 74 HD23 LEU 74 0.700 4.422 6.972 554 H PHE 75 HN PHE 75 -1.242 6.828 11.747 555 HA PHE 75 HA PHE 75 -3.188 4.970 11.240 556 1HB PHE 75 HB1 PHE 75 -2.671 5.668 13.497 557 2HB PHE 75 HB2 PHE 75 -3.311 7.278 13.187 558 HD1 PHE 75 HD1 PHE 75 -4.784 4.003 12.239 559 HD2 PHE 75 HD2 PHE 75 -5.055 7.460 14.709 560 HE1 PHE 75 HE1 PHE 75 -7.004 3.273 13.018 561 HE2 PHE 75 HE2 PHE 75 -7.273 6.736 15.489 562 HZ PHE 75 HZ PHE 75 -8.251 4.640 14.643 563 HA PRO 76 HA PRO 76 -6.447 8.415 10.211 564 1HB PRO 76 HB1 PRO 76 -4.779 10.701 9.382 565 2HB PRO 76 HB2 PRO 76 -6.198 10.668 10.433 566 1HG PRO 76 HG2 PRO 76 -3.743 11.085 11.418 567 2HG PRO 76 HG1 PRO 76 -4.957 10.153 12.314 568 1HD PRO 76 HD1 PRO 76 -2.635 9.174 10.693 569 2HD PRO 76 HD2 PRO 76 -3.228 8.603 12.266 570 H LEU 77 HN LEU 77 -3.624 7.554 8.569 571 HA LEU 77 HA LEU 77 -4.692 8.321 5.957 572 1HB LEU 77 HB1 LEU 77 -2.003 7.295 6.836 573 2HB LEU 77 HB2 LEU 77 -2.446 7.442 5.150 574 HG LEU 77 HG LEU 77 -1.296 9.403 5.485 575 1HD1 LEU 77 HD21 LEU 77 -3.945 10.437 6.422 576 2HD1 LEU 77 HD22 LEU 77 -3.758 9.767 4.801 577 3HD1 LEU 77 HD23 LEU 77 -2.798 11.162 5.295 578 1HD2 LEU 77 HD11 LEU 77 -1.059 10.557 7.477 579 2HD2 LEU 77 HD12 LEU 77 -1.191 8.874 7.990 580 3HD2 LEU 77 HD13 LEU 77 -2.582 9.948 8.126 581 H ILE 78 HN ILE 78 -3.792 5.442 7.818 582 HA ILE 78 HA ILE 78 -4.097 3.551 5.771 583 HB ILE 78 HB ILE 78 -4.944 2.913 8.560 584 1HG1 ILE 78 HG12 ILE 78 -2.862 4.309 8.661 585 2HG1 ILE 78 HG11 ILE 78 -2.665 2.674 9.282 586 1HG2 ILE 78 HG21 ILE 78 -4.478 1.455 6.209 587 2HG2 ILE 78 HG22 ILE 78 -4.828 0.829 7.820 588 3HG2 ILE 78 HG23 ILE 78 -3.155 1.059 7.310 589 1HD1 ILE 78 HD11 ILE 78 -1.995 3.173 6.441 590 2HD1 ILE 78 HD12 ILE 78 -1.279 2.053 7.602 591 3HD1 ILE 78 HD13 ILE 78 -0.899 3.774 7.684 592 H GLN 79 HN GLN 79 -6.422 4.981 7.997 593 HA GLN 79 HA GLN 79 -8.637 3.411 7.634 594 1HB GLN 79 HB1 GLN 79 -8.185 6.281 8.226 595 2HB GLN 79 HB2 GLN 79 -9.804 5.845 7.703 596 1HG GLN 79 HG2 GLN 79 -9.907 4.173 9.508 597 2HG GLN 79 HG1 GLN 79 -8.312 4.694 10.051 598 1HE2 GLN 79 HE21 GLN 79 -10.641 4.728 11.629 599 2HE2 GLN 79 HE22 GLN 79 -11.000 6.372 12.020 600 H ALA 80 HN ALA 80 -7.071 5.411 5.349 601 HA ALA 80 HA ALA 80 -9.298 5.638 3.521 602 1HB ALA 80 HB1 ALA 80 -7.738 6.754 2.051 603 2HB ALA 80 HB2 ALA 80 -6.381 6.251 3.058 604 3HB ALA 80 HB3 ALA 80 -7.568 7.396 3.685 605 H MET 81 HN MET 81 -6.275 3.793 3.749 606 HA MET 81 HA MET 81 -6.570 2.414 1.277 607 1HB MET 81 HB1 MET 81 -5.123 1.217 3.616 608 2HB MET 81 HB2 MET 81 -4.689 1.175 1.913 609 1HG MET 81 HG1 MET 81 -4.600 3.863 2.580 610 2HG MET 81 HG2 MET 81 -3.925 3.038 3.980 611 1HE MET 81 HE1 MET 81 -1.633 2.823 4.239 612 2HE MET 81 HE2 MET 81 -0.492 2.170 3.064 613 3HE MET 81 HE3 MET 81 -1.811 1.163 3.667 614 H HIS 82 HN HIS 82 -7.380 1.673 4.611 615 HA HIS 82 HA HIS 82 -8.995 -0.616 3.707 616 1HB HIS 82 HB2 HIS 82 -7.786 -0.328 6.455 617 2HB HIS 82 HB1 HIS 82 -8.367 -1.790 5.672 618 HD2 HIS 82 HD2 HIS 82 -6.609 -1.479 2.901 619 HE1 HIS 82 HE1 HIS 82 -3.374 -1.620 5.607 620 HE2 HIS 82 HE2 HIS 82 -4.064 -1.869 3.179 621 HA PRO 83 HA PRO 83 -12.597 1.425 5.279 622 1HB PRO 83 HB1 PRO 83 -13.371 -1.247 6.333 623 2HB PRO 83 HB2 PRO 83 -14.268 -0.150 5.277 624 1HG PRO 83 HG2 PRO 83 -13.123 -2.344 4.295 625 2HG PRO 83 HG1 PRO 83 -13.112 -0.826 3.378 626 1HD PRO 83 HD2 PRO 83 -10.914 -2.114 4.945 627 2HD PRO 83 HD1 PRO 83 -10.837 -1.232 3.406 628 H THR 84 HN THR 84 -11.180 2.466 6.905 629 HA THR 84 HA THR 84 -10.472 2.961 9.013 630 HB THR 84 HB THR 84 -12.319 2.941 10.695 631 HG1 THR 84 HG1 THR 84 -14.415 2.315 9.570 632 1HG2 THR 84 HG21 THR 84 -13.231 4.762 9.821 633 2HG2 THR 84 HG22 THR 84 -13.821 3.893 8.403 634 3HG2 THR 84 HG23 THR 84 -12.162 4.489 8.445 635 H LEU 85 HN LEU 85 -9.814 0.284 8.167 636 HA LEU 85 HA LEU 85 -10.168 -1.399 10.505 637 1HB LEU 85 HB1 LEU 85 -9.372 -1.752 7.720 638 2HB LEU 85 HB2 LEU 85 -8.371 -2.670 8.830 639 HG LEU 85 HG LEU 85 -11.311 -2.864 9.196 640 1HD1 LEU 85 HD21 LEU 85 -11.223 -4.770 7.466 641 2HD1 LEU 85 HD22 LEU 85 -9.830 -3.906 6.813 642 3HD1 LEU 85 HD23 LEU 85 -11.404 -3.113 6.889 643 1HD2 LEU 85 HD11 LEU 85 -9.758 -5.298 9.081 644 2HD2 LEU 85 HD12 LEU 85 -10.733 -4.643 10.396 645 3HD2 LEU 85 HD13 LEU 85 -9.058 -4.129 10.200 646 H ALA 86 HN ALA 86 -8.288 1.128 9.994 647 HA ALA 86 HA ALA 86 -5.675 0.187 10.587 648 1HB ALA 86 HB1 ALA 86 -6.279 2.374 9.495 649 2HB ALA 86 HB2 ALA 86 -5.054 2.462 10.762 650 3HB ALA 86 HB3 ALA 86 -6.711 2.962 11.100 651 H GLY 87 HN GLY 87 -7.998 -0.516 12.467 652 1HA GLY 87 HA2 GLY 87 -7.755 0.722 14.930 653 2HA GLY 87 HA1 GLY 87 -8.206 -0.961 14.707 654 H LYS 88 HN LYS 88 -5.506 -1.390 13.365 655 HA LYS 88 HA LYS 88 -3.541 -0.916 15.374 656 1HB LYS 88 HB1 LYS 88 -4.866 -2.724 16.456 657 2HB LYS 88 HB2 LYS 88 -4.516 -3.764 15.087 658 1HG LYS 88 HG2 LYS 88 -3.068 -4.253 16.988 659 2HG LYS 88 HG1 LYS 88 -2.142 -3.680 15.594 660 1HD LYS 88 HD1 LYS 88 -2.775 -1.375 17.018 661 2HD LYS 88 HD2 LYS 88 -2.353 -2.563 18.254 662 1HE LYS 88 HE1 LYS 88 -0.332 -3.065 16.688 663 2HE LYS 88 HE2 LYS 88 -0.682 -1.478 16.016 664 1HZ LYS 88 HZ1 LYS 88 0.875 -1.930 18.165 665 2HZ LYS 88 HZ2 LYS 88 -0.598 -1.540 18.900 666 3HZ LYS 88 HZ3 LYS 88 0.121 -0.456 17.818 667 H ILE 89 HN ILE 89 -3.923 -0.685 12.454 668 HA ILE 89 HA ILE 89 -2.152 -2.661 11.329 669 HB ILE 89 HB ILE 89 -3.228 -0.157 10.047 670 1HG1 ILE 89 HG11 ILE 89 -4.157 -3.014 9.689 671 2HG1 ILE 89 HG12 ILE 89 -4.903 -1.912 10.840 672 1HG2 ILE 89 HG21 ILE 89 -1.881 -0.626 8.345 673 2HG2 ILE 89 HG22 ILE 89 -2.604 -2.229 8.206 674 3HG2 ILE 89 HG23 ILE 89 -1.204 -1.980 9.252 675 1HD1 ILE 89 HD11 ILE 89 -4.682 -0.863 8.120 676 2HD1 ILE 89 HD12 ILE 89 -6.033 -0.828 9.253 677 3HD1 ILE 89 HD13 ILE 89 -5.723 -2.277 8.297 678 H THR 90 HN THR 90 -1.819 0.757 10.617 679 HA THR 90 HA THR 90 0.927 0.789 10.466 680 HB THR 90 HB THR 90 -1.207 2.707 10.493 681 HG1 THR 90 HG1 THR 90 0.749 2.073 8.994 682 1HG2 THR 90 HG21 THR 90 0.663 4.571 11.056 683 2HG2 THR 90 HG22 THR 90 0.997 3.365 12.297 684 3HG2 THR 90 HG23 THR 90 -0.617 4.064 12.160 685 H GLY 91 HN GLY 91 -1.098 1.375 13.316 686 1HA GLY 91 HA2 GLY 91 0.903 2.226 15.083 687 2HA GLY 91 HA1 GLY 91 -0.560 1.367 15.552 688 H MET 92 HN MET 92 0.064 -0.929 13.871 689 HA MET 92 HA MET 92 1.819 -2.299 15.732 690 1HB MET 92 HB2 MET 92 0.280 -3.863 15.268 691 2HB MET 92 HB1 MET 92 -0.226 -3.060 13.792 692 1HG MET 92 HG2 MET 92 1.162 -4.288 12.484 693 2HG MET 92 HG1 MET 92 2.349 -4.516 13.763 694 1HE MET 92 HE1 MET 92 -0.221 -5.726 11.684 695 2HE MET 92 HE2 MET 92 -1.521 -5.836 12.876 696 3HE MET 92 HE3 MET 92 -0.733 -7.303 12.289 697 H LEU 93 HN LEU 93 1.957 -0.880 12.616 698 HA LEU 93 HA LEU 93 4.122 -2.269 11.508 699 1HB LEU 93 HB2 LEU 93 2.875 0.381 11.112 700 2HB LEU 93 HB1 LEU 93 4.466 0.131 10.427 701 HG LEU 93 HG LEU 93 2.624 -0.296 8.816 702 1HD1 LEU 93 HD11 LEU 93 4.611 -2.368 9.597 703 2HD1 LEU 93 HD12 LEU 93 4.512 -1.389 8.132 704 3HD1 LEU 93 HD13 LEU 93 3.426 -2.761 8.350 705 1HD2 LEU 93 HD21 LEU 93 1.796 -2.860 9.626 706 2HD2 LEU 93 HD22 LEU 93 0.820 -1.400 9.475 707 3HD2 LEU 93 HD23 LEU 93 1.580 -1.795 11.020 708 H LEU 94 HN LEU 94 3.999 -0.467 14.282 709 HA LEU 94 HA LEU 94 6.865 0.188 14.152 710 1HB LEU 94 HB1 LEU 94 4.554 1.486 15.412 711 2HB LEU 94 HB2 LEU 94 5.932 1.308 16.480 712 HG LEU 94 HG LEU 94 7.339 2.560 14.947 713 1HD1 LEU 94 HD11 LEU 94 4.894 2.718 13.186 714 2HD1 LEU 94 HD12 LEU 94 6.378 1.828 12.839 715 3HD1 LEU 94 HD13 LEU 94 6.406 3.590 12.924 716 1HD2 LEU 94 HD21 LEU 94 6.412 4.704 15.266 717 2HD2 LEU 94 HD22 LEU 94 5.822 3.718 16.605 718 3HD2 LEU 94 HD23 LEU 94 4.763 4.079 15.241 719 H GLU 95 HN GLU 95 5.554 -2.405 14.517 720 HA GLU 95 HA GLU 95 7.091 -3.375 16.707 721 1HB GLU 95 HB2 GLU 95 5.442 -3.971 18.256 722 2HB GLU 95 HB1 GLU 95 4.984 -2.344 17.772 723 1HG GLU 95 HG1 GLU 95 3.212 -3.128 16.435 724 2HG GLU 95 HG2 GLU 95 3.799 -4.788 16.496 725 H ILE 96 HN ILE 96 5.621 -3.755 13.800 726 HA ILE 96 HA ILE 96 4.741 -6.417 13.779 727 HB ILE 96 HB ILE 96 5.057 -6.424 11.388 728 1HG1 ILE 96 HG12 ILE 96 7.271 -5.448 11.247 729 2HG1 ILE 96 HG11 ILE 96 6.154 -4.583 10.201 730 1HG2 ILE 96 HG21 ILE 96 3.147 -5.295 11.490 731 2HG2 ILE 96 HG22 ILE 96 4.119 -3.890 11.045 732 3HG2 ILE 96 HG23 ILE 96 3.745 -4.205 12.742 733 1HD1 ILE 96 HD11 ILE 96 6.072 -3.199 12.594 734 2HD1 ILE 96 HD12 ILE 96 6.901 -2.724 11.110 735 3HD1 ILE 96 HD13 ILE 96 7.770 -3.610 12.362 736 H ASP 97 HN ASP 97 6.355 -7.375 11.546 737 HA ASP 97 HA ASP 97 8.195 -9.020 12.855 738 1HB ASP 97 HB1 ASP 97 7.047 -9.055 10.441 739 2HB ASP 97 HB2 ASP 97 8.595 -8.356 9.973 740 H ASN 98 HN ASN 98 8.398 -5.782 12.362 741 HA ASN 98 HA ASN 98 10.024 -4.284 12.812 742 1HB ASN 98 HB1 ASN 98 11.714 -6.754 13.116 743 2HB ASN 98 HB2 ASN 98 12.410 -5.140 13.211 744 1HD2 ASN 98 HD22 ASN 98 10.260 -7.430 14.708 745 2HD2 ASN 98 HD21 ASN 98 10.169 -6.642 16.243 746 H SER 99 HN SER 99 10.463 -6.670 10.343 747 HA SER 99 HA SER 99 12.376 -5.144 8.832 748 1HB SER 99 HB2 SER 99 12.615 -7.097 7.773 749 2HB SER 99 HB1 SER 99 11.266 -7.765 8.695 750 HG SER 99 HG SER 99 10.491 -7.911 6.712 751 H GLU 100 HN GLU 100 8.924 -5.435 9.047 752 HA GLU 100 HA GLU 100 8.350 -3.942 6.660 753 1HB GLU 100 HB1 GLU 100 6.402 -4.218 8.903 754 2HB GLU 100 HB2 GLU 100 6.121 -4.244 7.170 755 1HG GLU 100 HG1 GLU 100 7.737 -6.436 7.609 756 2HG GLU 100 HG2 GLU 100 6.642 -6.425 8.993 757 H LEU 101 HN LEU 101 9.151 -3.245 9.922 758 HA LEU 101 HA LEU 101 8.122 -0.561 9.952 759 1HB LEU 101 HB1 LEU 101 8.352 -1.461 12.090 760 2HB LEU 101 HB2 LEU 101 9.903 -2.188 11.727 761 HG LEU 101 HG LEU 101 10.484 0.478 11.508 762 1HD1 LEU 101 HD11 LEU 101 8.129 0.163 13.244 763 2HD1 LEU 101 HD12 LEU 101 8.724 1.580 12.379 764 3HD1 LEU 101 HD13 LEU 101 9.454 1.113 13.916 765 1HD2 LEU 101 HD21 LEU 101 11.672 -1.390 12.721 766 2HD2 LEU 101 HD22 LEU 101 10.621 -1.048 14.095 767 3HD2 LEU 101 HD23 LEU 101 11.725 0.192 13.500 768 H LEU 102 HN LEU 102 10.961 -2.177 8.867 769 HA LEU 102 HA LEU 102 12.550 0.249 8.637 770 1HB LEU 102 HB2 LEU 102 13.006 -2.632 8.485 771 2HB LEU 102 HB1 LEU 102 13.843 -1.742 7.227 772 HG LEU 102 HG LEU 102 14.759 -0.264 9.112 773 1HD1 LEU 102 HD21 LEU 102 14.396 -2.557 10.938 774 2HD1 LEU 102 HD22 LEU 102 12.996 -1.516 10.685 775 3HD1 LEU 102 HD23 LEU 102 14.506 -0.832 11.286 776 1HD2 LEU 102 HD11 LEU 102 15.583 -3.162 8.992 777 2HD2 LEU 102 HD12 LEU 102 16.571 -1.820 9.571 778 3HD2 LEU 102 HD13 LEU 102 16.097 -1.898 7.874 779 H HIS 103 HN HIS 103 11.120 -2.162 6.469 780 HA HIS 103 HA HIS 103 11.906 -0.930 4.088 781 1HB HIS 103 HB2 HIS 103 10.689 -3.254 4.654 782 2HB HIS 103 HB1 HIS 103 9.277 -2.328 4.155 783 HD2 HIS 103 HD2 HIS 103 10.670 -4.842 2.401 784 HE1 HIS 103 HE1 HIS 103 11.430 -1.682 -0.311 785 HE2 HIS 103 HE2 HIS 103 11.278 -4.199 -0.038 786 H MET 104 HN MET 104 8.900 -0.598 5.963 787 HA MET 104 HA MET 104 7.483 1.046 4.281 788 1HB MET 104 HB2 MET 104 6.235 1.765 6.243 789 2HB MET 104 HB1 MET 104 6.583 0.043 6.354 790 1HG MET 104 HG1 MET 104 7.850 0.296 8.180 791 2HG MET 104 HG2 MET 104 8.590 1.773 7.574 792 1HE MET 104 HE1 MET 104 5.174 0.416 8.307 793 2HE MET 104 HE2 MET 104 4.551 1.953 7.702 794 3HE MET 104 HE3 MET 104 4.414 1.562 9.419 795 H LEU 105 HN LEU 105 10.082 1.959 6.495 796 HA LEU 105 HA LEU 105 9.670 4.795 5.963 797 1HB LEU 105 HB1 LEU 105 12.077 3.708 7.367 798 2HB LEU 105 HB2 LEU 105 11.260 5.241 7.601 799 HG LEU 105 HG LEU 105 10.100 2.586 8.421 800 1HD1 LEU 105 HD11 LEU 105 11.729 4.588 9.965 801 2HD1 LEU 105 HD12 LEU 105 12.033 2.863 9.757 802 3HD1 LEU 105 HD13 LEU 105 10.674 3.406 10.740 803 1HD2 LEU 105 HD21 LEU 105 8.684 4.097 9.840 804 2HD2 LEU 105 HD22 LEU 105 8.389 4.183 8.102 805 3HD2 LEU 105 HD23 LEU 105 9.325 5.447 8.901 806 H GLU 106 HN GLU 106 11.080 2.223 4.492 807 HA GLU 106 HA GLU 106 13.231 3.816 3.338 808 1HB GLU 106 HB2 GLU 106 12.793 0.881 3.791 809 2HB GLU 106 HB1 GLU 106 13.966 1.414 2.583 810 1HG GLU 106 HG2 GLU 106 13.939 2.029 5.518 811 2HG GLU 106 HG1 GLU 106 15.068 0.972 4.668 812 H SER 107 HN SER 107 10.162 2.716 2.508 813 HA SER 107 HA SER 107 10.725 3.259 -0.316 814 1HB SER 107 HB2 SER 107 10.706 0.692 0.418 815 2HB SER 107 HB1 SER 107 8.971 0.921 0.214 816 HG SER 107 HG SER 107 10.906 0.688 -1.667 817 HA PRO 108 HA PRO 108 6.862 5.411 -0.009 818 1HB PRO 108 HB2 PRO 108 6.670 5.346 -2.916 819 2HB PRO 108 HB1 PRO 108 6.985 6.720 -1.854 820 1HG PRO 108 HG1 PRO 108 8.864 5.682 -3.511 821 2HG PRO 108 HG2 PRO 108 9.261 6.450 -1.963 822 1HD PRO 108 HD2 PRO 108 9.064 3.538 -2.638 823 2HD PRO 108 HD1 PRO 108 10.264 4.384 -1.636 824 H GLU 109 HN GLU 109 7.221 2.293 -1.054 825 HA GLU 109 HA GLU 109 4.308 1.936 -1.396 826 1HB GLU 109 HB2 GLU 109 6.586 0.477 -2.757 827 2HB GLU 109 HB1 GLU 109 4.909 -0.057 -2.818 828 1HG GLU 109 HG1 GLU 109 4.272 1.656 -4.200 829 2HG GLU 109 HG2 GLU 109 5.567 2.721 -3.654 830 H SER 110 HN SER 110 7.180 1.072 0.241 831 HA SER 110 HA SER 110 6.452 -1.478 1.214 832 1HB SER 110 HB2 SER 110 8.026 -0.772 3.155 833 2HB SER 110 HB1 SER 110 8.721 -0.889 1.528 834 HG SER 110 HG SER 110 7.631 1.530 2.471 835 H LEU 111 HN LEU 111 6.191 1.748 2.578 836 HA LEU 111 HA LEU 111 4.959 1.264 4.954 837 1HB LEU 111 HB1 LEU 111 5.692 3.427 3.759 838 2HB LEU 111 HB2 LEU 111 4.073 3.448 3.080 839 HG LEU 111 HG LEU 111 3.910 4.891 4.879 840 1HD1 LEU 111 HD21 LEU 111 2.099 3.345 5.022 841 2HD1 LEU 111 HD22 LEU 111 2.643 3.713 6.658 842 3HD1 LEU 111 HD23 LEU 111 3.094 2.185 5.902 843 1HD2 LEU 111 HD11 LEU 111 5.255 4.939 6.660 844 2HD2 LEU 111 HD12 LEU 111 6.213 3.771 5.751 845 3HD2 LEU 111 HD13 LEU 111 5.070 3.214 6.977 846 H ARG 112 HN ARG 112 3.617 1.021 1.732 847 HA ARG 112 HA ARG 112 0.933 0.596 2.748 848 1HB ARG 112 HB1 ARG 112 2.121 0.789 -0.009 849 2HB ARG 112 HB2 ARG 112 0.437 0.321 0.267 850 1HG ARG 112 HG2 ARG 112 -0.101 2.380 1.203 851 2HG ARG 112 HG1 ARG 112 1.598 2.776 1.484 852 1HD ARG 112 HD1 ARG 112 1.362 2.371 -1.277 853 2HD ARG 112 HD2 ARG 112 -0.066 3.298 -0.818 854 HE ARG 112 HE ARG 112 2.591 4.218 0.021 855 1HH1 ARG 112 HH12 ARG 112 -0.321 4.673 -1.839 856 2HH1 ARG 112 HH11 ARG 112 0.020 6.330 -2.209 857 1HH2 ARG 112 HH21 ARG 112 3.048 6.399 -0.462 858 2HH2 ARG 112 HH22 ARG 112 1.935 7.310 -1.427 859 H SER 113 HN SER 113 3.019 -1.219 0.518 860 HA SER 113 HA SER 113 1.621 -3.596 0.499 861 1HB SER 113 HB1 SER 113 4.592 -3.069 0.291 862 2HB SER 113 HB2 SER 113 3.887 -4.667 0.045 863 HG SER 113 HG SER 113 3.223 -4.067 -1.854 864 H LYS 114 HN LYS 114 3.657 -2.234 2.941 865 HA LYS 114 HA LYS 114 3.836 -4.675 4.492 866 1HB LYS 114 HB1 LYS 114 4.662 -1.850 5.169 867 2HB LYS 114 HB2 LYS 114 4.939 -3.249 6.196 868 1HG LYS 114 HG1 LYS 114 6.060 -2.827 3.435 869 2HG LYS 114 HG2 LYS 114 6.941 -2.657 4.956 870 1HD LYS 114 HD1 LYS 114 7.113 -4.902 5.267 871 2HD LYS 114 HD2 LYS 114 5.564 -5.236 4.491 872 1HE LYS 114 HE2 LYS 114 8.070 -4.415 3.029 873 2HE LYS 114 HE1 LYS 114 7.525 -6.081 3.220 874 1HZ LYS 114 HZ1 LYS 114 6.912 -4.907 1.081 875 2HZ LYS 114 HZ2 LYS 114 5.809 -4.008 1.995 876 3HZ LYS 114 HZ3 LYS 114 5.655 -5.690 1.897 877 H VAL 115 HN VAL 115 2.053 -1.598 4.578 878 HA VAL 115 HA VAL 115 0.780 -2.138 7.066 879 HB VAL 115 HB VAL 115 0.408 -0.139 4.908 880 1HG1 VAL 115 HG11 VAL 115 -1.826 -1.189 6.532 881 2HG1 VAL 115 HG12 VAL 115 -1.849 -0.352 4.979 882 3HG1 VAL 115 HG13 VAL 115 -1.667 0.565 6.475 883 1HG2 VAL 115 HG21 VAL 115 0.907 -0.229 7.835 884 2HG2 VAL 115 HG22 VAL 115 0.140 1.211 7.163 885 3HG2 VAL 115 HG23 VAL 115 1.722 0.698 6.574 886 H ASP 116 HN ASP 116 -0.636 -2.175 3.770 887 HA ASP 116 HA ASP 116 -2.991 -3.445 4.328 888 1HB ASP 116 HB1 ASP 116 -1.968 -2.583 2.068 889 2HB ASP 116 HB2 ASP 116 -1.483 -4.265 1.873 890 H GLU 117 HN GLU 117 0.193 -4.927 3.991 891 HA GLU 117 HA GLU 117 -0.796 -7.621 4.071 892 1HB GLU 117 HB1 GLU 117 1.840 -6.305 3.987 893 2HB GLU 117 HB2 GLU 117 1.809 -7.834 4.856 894 1HG GLU 117 HG2 GLU 117 0.703 -8.833 2.828 895 2HG GLU 117 HG1 GLU 117 1.070 -7.326 1.989 896 H ALA 118 HN ALA 118 0.537 -5.343 6.416 897 HA ALA 118 HA ALA 118 0.633 -7.114 8.614 898 1HB ALA 118 HB1 ALA 118 1.657 -4.756 8.377 899 2HB ALA 118 HB2 ALA 118 1.045 -5.267 9.950 900 3HB ALA 118 HB3 ALA 118 0.081 -4.192 8.934 901 H VAL 119 HN VAL 119 -1.906 -5.549 6.958 902 HA VAL 119 HA VAL 119 -3.878 -5.508 8.992 903 HB VAL 119 HB VAL 119 -4.208 -5.703 6.006 904 1HG1 VAL 119 HG11 VAL 119 -6.146 -4.908 8.176 905 2HG1 VAL 119 HG12 VAL 119 -6.261 -6.318 7.122 906 3HG1 VAL 119 HG13 VAL 119 -6.425 -4.695 6.447 907 1HG2 VAL 119 HG21 VAL 119 -4.773 -3.149 7.078 908 2HG2 VAL 119 HG22 VAL 119 -3.500 -3.615 5.950 909 3HG2 VAL 119 HG23 VAL 119 -3.200 -3.666 7.686 910 H ALA 120 HN ALA 120 -3.016 -7.770 6.426 911 HA ALA 120 HA ALA 120 -4.948 -9.752 6.960 912 1HB ALA 120 HB1 ALA 120 -3.973 -10.754 5.215 913 2HB ALA 120 HB2 ALA 120 -2.414 -10.816 6.039 914 3HB ALA 120 HB3 ALA 120 -2.880 -9.369 5.139 915 H VAL 121 HN VAL 121 -1.977 -8.835 8.445 916 HA VAL 121 HA VAL 121 -1.703 -11.241 10.020 917 HB VAL 121 HB VAL 121 -0.169 -8.668 9.808 918 1HG1 VAL 121 HG21 VAL 121 -0.375 -10.329 12.152 919 2HG1 VAL 121 HG22 VAL 121 0.458 -8.788 11.926 920 3HG1 VAL 121 HG23 VAL 121 1.276 -10.300 11.529 921 1HG2 VAL 121 HG11 VAL 121 1.531 -9.956 8.905 922 2HG2 VAL 121 HG12 VAL 121 0.081 -10.735 8.268 923 3HG2 VAL 121 HG13 VAL 121 0.934 -11.445 9.640 924 H LEU 122 HN LEU 122 -2.945 -7.994 10.348 925 HA LEU 122 HA LEU 122 -3.207 -8.037 13.191 926 1HB LEU 122 HB2 LEU 122 -3.478 -5.866 12.796 927 2HB LEU 122 HB1 LEU 122 -3.615 -6.164 11.076 928 HG LEU 122 HG LEU 122 -6.131 -6.823 12.021 929 1HD1 LEU 122 HD11 LEU 122 -6.472 -4.436 13.215 930 2HD1 LEU 122 HD12 LEU 122 -4.863 -4.853 13.805 931 3HD1 LEU 122 HD13 LEU 122 -6.218 -5.944 14.095 932 1HD2 LEU 122 HD21 LEU 122 -6.848 -4.816 10.897 933 2HD2 LEU 122 HD22 LEU 122 -5.536 -5.562 9.984 934 3HD2 LEU 122 HD23 LEU 122 -5.219 -4.145 10.985 935 H GLN 123 HN GLN 123 -5.206 -8.891 10.458 936 HA GLN 123 HA GLN 123 -7.601 -9.337 11.946 937 1HB GLN 123 HB1 GLN 123 -6.663 -10.041 9.176 938 2HB GLN 123 HB2 GLN 123 -8.171 -10.694 9.803 939 1HG GLN 123 HG1 GLN 123 -7.542 -7.755 9.664 940 2HG GLN 123 HG2 GLN 123 -8.410 -8.645 8.411 941 1HE2 GLN 123 HE21 GLN 123 -9.923 -10.330 10.041 942 2HE2 GLN 123 HE22 GLN 123 -11.089 -9.376 10.888 943 H ALA 124 HN ALA 124 -4.767 -11.173 11.146 944 HA ALA 124 HA ALA 124 -5.920 -13.696 12.024 945 1HB ALA 124 HB1 ALA 124 -3.666 -14.602 11.503 946 2HB ALA 124 HB2 ALA 124 -3.160 -12.974 11.048 947 3HB ALA 124 HB3 ALA 124 -4.432 -13.791 10.137 948 H HIS 125 HN HIS 125 -4.576 -11.029 13.505 949 HA HIS 125 HA HIS 125 -3.662 -12.661 15.780 950 1HB HIS 125 HB1 HIS 125 -2.331 -10.526 14.345 951 2HB HIS 125 HB2 HIS 125 -2.498 -10.125 16.051 952 HD2 HIS 125 HD2 HIS 125 -1.145 -13.233 14.010 953 HE1 HIS 125 HE1 HIS 125 1.139 -12.663 17.529 954 HE2 HIS 125 HE2 HIS 125 0.873 -14.050 15.422 955 H GLN 126 HN GLN 126 -6.217 -10.992 14.878 956 HA GLN 126 HA GLN 126 -6.528 -9.145 17.045 957 1HB GLN 126 HB1 GLN 126 -8.125 -10.034 14.735 958 2HB GLN 126 HB2 GLN 126 -9.065 -9.554 16.142 959 1HG GLN 126 HG1 GLN 126 -8.027 -7.383 16.155 960 2HG GLN 126 HG2 GLN 126 -6.950 -7.853 14.839 961 1HE2 GLN 126 HE22 GLN 126 -9.783 -6.314 15.611 962 2HE2 GLN 126 HE21 GLN 126 -10.523 -6.299 14.050 963 H ALA 127 HN ALA 127 -9.301 -11.104 16.603 964 HA ALA 127 HA ALA 127 -9.038 -12.083 19.347 965 1HB ALA 127 HB1 ALA 127 -11.233 -11.211 17.694 966 2HB ALA 127 HB2 ALA 127 -11.164 -11.445 19.441 967 3HB ALA 127 HB3 ALA 127 -11.551 -12.803 18.385 968 H LYS 128 HN LYS 128 -7.604 -13.261 17.027 969 HA LYS 128 HA LYS 128 -8.871 -15.884 16.786 970 1HB LYS 128 HB2 LYS 128 -6.308 -15.592 15.438 971 2HB LYS 128 HB1 LYS 128 -7.874 -16.042 14.781 972 1HG LYS 128 HG1 LYS 128 -7.049 -13.207 15.357 973 2HG LYS 128 HG2 LYS 128 -6.875 -13.993 13.785 974 1HD LYS 128 HD1 LYS 128 -9.515 -13.831 15.215 975 2HD LYS 128 HD2 LYS 128 -8.944 -12.556 14.136 976 1HE LYS 128 HE2 LYS 128 -8.563 -14.599 12.505 977 2HE LYS 128 HE1 LYS 128 -9.809 -15.333 13.513 978 1HZ LYS 128 HZ1 LYS 128 -11.359 -14.139 12.501 979 2HZ LYS 128 HZ2 LYS 128 -10.188 -13.606 11.402 980 3HZ LYS 128 HZ3 LYS 128 -10.533 -12.691 12.783 981 H GLU 129 HN GLU 129 -6.202 -17.106 16.239 982 HA GLU 129 HA GLU 129 -5.632 -17.855 18.983 983 1HB GLU 129 HB2 GLU 129 -5.830 -19.388 16.847 984 2HB GLU 129 HB1 GLU 129 -4.137 -18.961 16.640 985 1HG GLU 129 HG1 GLU 129 -3.531 -19.961 18.683 986 2HG GLU 129 HG2 GLU 129 -5.211 -20.097 19.201 987 H ALA 130 HN ALA 130 -4.882 -15.286 18.701 988 HA ALA 130 HA ALA 130 -2.054 -15.166 18.042 989 1HB ALA 130 HB1 ALA 130 -3.680 -13.337 17.459 990 2HB ALA 130 HB2 ALA 130 -2.222 -12.817 18.303 991 3HB ALA 130 HB3 ALA 130 -3.748 -12.955 19.179 992 H ALA 131 HN ALA 131 -3.267 -16.663 20.414 993 HA ALA 131 HA ALA 131 -2.213 -15.290 22.721 994 1HB ALA 131 HB1 ALA 131 -3.502 -17.959 22.285 995 2HB ALA 131 HB2 ALA 131 -4.086 -16.583 23.219 996 3HB ALA 131 HB3 ALA 131 -2.742 -17.551 23.823 997 H GLN 132 HN GLN 132 -0.765 -16.850 20.239 998 HA GLN 132 HA GLN 132 1.158 -18.434 21.665 999 1HB GLN 132 HB2 GLN 132 0.846 -17.545 18.814 1000 2HB GLN 132 HB1 GLN 132 2.337 -18.308 19.349 1001 1HG GLN 132 HG2 GLN 132 -0.103 -19.736 20.111 1002 2HG GLN 132 HG1 GLN 132 0.176 -19.622 18.375 1003 1HE2 GLN 132 HE21 GLN 132 2.863 -19.765 18.174 1004 2HE2 GLN 132 HE22 GLN 132 3.433 -21.290 18.753 1005 H LYS 133 HN LYS 133 2.576 -17.466 22.969 1006 HA LYS 133 HA LYS 133 3.427 -14.782 22.702 1007 1HB LYS 133 HB1 LYS 133 3.866 -16.992 24.530 1008 2HB LYS 133 HB2 LYS 133 5.349 -16.091 24.251 1009 1HG LYS 133 HG2 LYS 133 4.047 -14.003 24.790 1010 2HG LYS 133 HG1 LYS 133 2.738 -15.060 25.321 1011 1HD LYS 133 HD2 LYS 133 4.049 -15.977 27.057 1012 2HD LYS 133 HD1 LYS 133 5.536 -15.295 26.396 1013 1HE LYS 133 HE1 LYS 133 5.109 -13.830 28.111 1014 2HE LYS 133 HE2 LYS 133 4.308 -13.019 26.766 1015 1HZ LYS 133 HZ1 LYS 133 2.661 -12.951 28.309 1016 2HZ LYS 133 HZ2 LYS 133 3.141 -14.379 29.077 1017 3HZ LYS 133 HZ3 LYS 133 2.292 -14.450 27.617 1018 H ALA 134 HN ALA 134 4.615 -17.785 21.432 1019 HA ALA 134 HA ALA 134 7.258 -16.947 20.833 1020 1HB ALA 134 HB1 ALA 134 5.901 -19.329 20.725 1021 2HB ALA 134 HB2 ALA 134 7.534 -19.045 20.123 1022 3HB ALA 134 HB3 ALA 134 6.160 -18.947 19.023 1023 H VAL 135 HN VAL 135 8.146 -16.552 18.704 1024 HA VAL 135 HA VAL 135 6.369 -14.854 17.119 1025 HB VAL 135 HB VAL 135 8.520 -14.162 15.980 1026 1HG1 VAL 135 HG21 VAL 135 7.548 -13.535 18.634 1027 2HG1 VAL 135 HG22 VAL 135 8.137 -12.461 17.365 1028 3HG1 VAL 135 HG23 VAL 135 9.276 -13.220 18.477 1029 1HG2 VAL 135 HG11 VAL 135 9.915 -15.395 18.328 1030 2HG2 VAL 135 HG12 VAL 135 10.601 -14.778 16.825 1031 3HG2 VAL 135 HG13 VAL 135 9.696 -16.292 16.826 1032 H ASN 136 HN ASN 136 6.951 -14.842 14.684 1033 HA ASN 136 HA ASN 136 6.242 -17.367 13.627 1034 1HB ASN 136 HB1 ASN 136 6.948 -16.127 11.406 1035 2HB ASN 136 HB2 ASN 136 5.494 -15.652 12.278 1036 1HD2 ASN 136 HD22 ASN 136 8.852 -14.856 11.680 1037 2HD2 ASN 136 HD21 ASN 136 8.729 -13.187 12.109 1038 H SER 137 HN SER 137 7.444 -18.624 12.057 1039 HA SER 137 HA SER 137 10.269 -18.804 12.802 1040 1HB SER 137 HB1 SER 137 8.435 -20.762 12.703 1041 2HB SER 137 HB2 SER 137 9.023 -20.855 11.044 1042 HG SER 137 HG SER 137 11.072 -20.635 12.792 1043 H ALA 138 HN ALA 138 11.892 -18.406 11.420 1044 HA ALA 138 HA ALA 138 11.286 -17.171 8.896 1045 1HB ALA 138 HB1 ALA 138 13.670 -17.501 10.596 1046 2HB ALA 138 HB2 ALA 138 13.091 -16.092 9.708 1047 3HB ALA 138 HB3 ALA 138 13.971 -17.366 8.863 1048 H THR 139 HN THR 139 10.412 -18.739 7.562 1049 HA THR 139 HA THR 139 12.084 -21.072 6.949 1050 HB THR 139 HB THR 139 10.088 -22.008 5.879 1051 HG1 THR 139 HG1 THR 139 9.168 -20.014 5.202 1052 1HG2 THR 139 HG21 THR 139 9.897 -21.069 8.683 1053 2HG2 THR 139 HG22 THR 139 9.974 -22.708 8.037 1054 3HG2 THR 139 HG23 THR 139 8.473 -21.787 7.932 1055 H GLY 140 HN GLY 140 11.300 -18.009 5.785 1056 1HA GLY 140 HA2 GLY 140 11.623 -18.677 2.971 1057 2HA GLY 140 HA1 GLY 140 11.324 -17.078 3.637 1058 H VAL 141 HN VAL 141 13.219 -16.248 5.032 1059 HA VAL 141 HA VAL 141 15.655 -16.616 3.443 1060 HB VAL 141 HB VAL 141 15.191 -14.427 5.455 1061 1HG1 VAL 141 HG21 VAL 141 16.759 -13.275 3.745 1062 2HG1 VAL 141 HG22 VAL 141 17.115 -14.920 3.218 1063 3HG1 VAL 141 HG23 VAL 141 17.436 -14.439 4.884 1064 1HG2 VAL 141 HG11 VAL 141 14.666 -13.090 3.277 1065 2HG2 VAL 141 HG12 VAL 141 13.391 -14.004 4.082 1066 3HG2 VAL 141 HG13 VAL 141 14.187 -14.668 2.655 1067 HA PRO 142 HA PRO 142 17.603 -16.712 3.337 1068 1HB PRO 142 HB1 PRO 142 19.605 -18.486 3.331 1069 2HB PRO 142 HB2 PRO 142 19.728 -16.965 4.222 1070 1HG PRO 142 HG1 PRO 142 19.127 -19.715 5.232 1071 2HG PRO 142 HG2 PRO 142 20.150 -18.458 5.948 1072 1HD PRO 142 HD2 PRO 142 17.551 -18.996 6.715 1073 2HD PRO 142 HD1 PRO 142 18.382 -17.452 6.981 1074 H THR 143 HN THR 143 17.840 -18.057 1.394 1075 HA THR 143 HA THR 143 15.815 -20.131 1.334 1076 HB THR 143 HB THR 143 16.180 -20.068 -1.121 1077 HG1 THR 143 HG1 THR 143 17.660 -18.681 -1.984 1078 1HG2 THR 143 HG21 THR 143 15.984 -17.231 -0.204 1079 2HG2 THR 143 HG22 THR 143 14.689 -18.388 0.099 1080 3HG2 THR 143 HG23 THR 143 15.177 -18.025 -1.556 1081 H VAL 144 HN VAL 144 16.595 -21.858 -0.572 1082 HA VAL 144 HA VAL 144 18.770 -23.302 0.754 1083 HB VAL 144 HB VAL 144 16.649 -24.504 0.477 1084 1HG1 VAL 144 HG21 VAL 144 15.492 -24.007 -1.377 1085 2HG1 VAL 144 HG22 VAL 144 16.477 -25.257 -2.137 1086 3HG1 VAL 144 HG23 VAL 144 16.941 -23.562 -2.280 1087 1HG2 VAL 144 HG11 VAL 144 18.011 -26.260 0.502 1088 2HG2 VAL 144 HG12 VAL 144 19.230 -25.402 -0.440 1089 3HG2 VAL 144 HG13 VAL 144 17.932 -26.271 -1.260 Start of MODEL 29 1 1H GLY 1 HT1 GLY 1 -10.865 -31.233 -51.903 2 2H GLY 1 HT2 GLY 1 -9.440 -31.156 -52.812 3 3H GLY 1 HT3 GLY 1 -10.578 -29.910 -52.917 4 1HA GLY 1 HA1 GLY 1 -9.811 -28.865 -51.125 5 2HA GLY 1 HA2 GLY 1 -9.715 -30.371 -50.226 6 HA PRO 2 HA PRO 2 -5.538 -29.733 -52.711 7 1HB PRO 2 HB2 PRO 2 -4.931 -27.085 -53.042 8 2HB PRO 2 HB1 PRO 2 -5.684 -28.084 -54.288 9 1HG PRO 2 HG2 PRO 2 -6.950 -26.158 -52.378 10 2HG PRO 2 HG1 PRO 2 -7.283 -26.408 -54.103 11 1HD PRO 2 HD1 PRO 2 -8.876 -27.423 -52.185 12 2HD PRO 2 HD2 PRO 2 -8.578 -28.285 -53.709 13 H LEU 3 HN LEU 3 -6.756 -27.434 -50.336 14 HA LEU 3 HA LEU 3 -4.182 -27.461 -48.938 15 1HB LEU 3 HB2 LEU 3 -6.648 -25.824 -48.339 16 2HB LEU 3 HB1 LEU 3 -5.060 -25.620 -47.623 17 HG LEU 3 HG LEU 3 -5.373 -25.353 -50.588 18 1HD1 LEU 3 HD11 LEU 3 -6.773 -23.756 -48.686 19 2HD1 LEU 3 HD12 LEU 3 -6.708 -23.591 -50.440 20 3HD1 LEU 3 HD13 LEU 3 -5.507 -22.782 -49.434 21 1HD2 LEU 3 HD21 LEU 3 -3.371 -24.279 -50.500 22 2HD2 LEU 3 HD22 LEU 3 -3.195 -25.306 -49.077 23 3HD2 LEU 3 HD23 LEU 3 -3.668 -23.617 -48.892 24 H GLY 4 HN GLY 4 -4.551 -27.323 -46.411 25 1HA GLY 4 HA2 GLY 4 -6.092 -29.735 -45.728 26 2HA GLY 4 HA1 GLY 4 -4.721 -29.113 -44.822 27 H SER 5 HN SER 5 -5.164 -26.711 -44.078 28 HA SER 5 HA SER 5 -7.737 -26.798 -42.665 29 1HB SER 5 HB2 SER 5 -6.160 -26.606 -40.994 30 2HB SER 5 HB1 SER 5 -5.042 -25.692 -42.006 31 HG SER 5 HG SER 5 -6.905 -24.787 -40.284 32 H ALA 6 HN ALA 6 -8.968 -24.860 -42.408 33 HA ALA 6 HA ALA 6 -8.341 -22.635 -44.186 34 1HB ALA 6 HB1 ALA 6 -10.212 -22.773 -45.522 35 2HB ALA 6 HB2 ALA 6 -11.095 -23.772 -44.368 36 3HB ALA 6 HB3 ALA 6 -9.794 -24.475 -45.328 37 H ALA 7 HN ALA 7 -8.187 -22.556 -41.474 38 HA ALA 7 HA ALA 7 -10.229 -20.604 -40.837 39 1HB ALA 7 HB1 ALA 7 -9.983 -22.425 -38.594 40 2HB ALA 7 HB2 ALA 7 -10.657 -23.211 -40.022 41 3HB ALA 7 HB3 ALA 7 -11.427 -21.766 -39.363 42 H ALA 8 HN ALA 8 -7.114 -21.673 -40.756 43 HA ALA 8 HA ALA 8 -6.277 -19.497 -39.071 44 1HB ALA 8 HB1 ALA 8 -6.302 -20.729 -37.188 45 2HB ALA 8 HB2 ALA 8 -4.784 -21.365 -37.821 46 3HB ALA 8 HB3 ALA 8 -6.284 -22.260 -38.063 47 H ALA 9 HN ALA 9 -5.777 -21.854 -41.441 48 HA ALA 9 HA ALA 9 -4.142 -22.241 -42.969 49 1HB ALA 9 HB1 ALA 9 -3.670 -20.309 -43.941 50 2HB ALA 9 HB2 ALA 9 -2.458 -19.980 -42.703 51 3HB ALA 9 HB3 ALA 9 -4.122 -19.445 -42.471 52 H THR 10 HN THR 10 -1.910 -20.277 -41.129 53 HA THR 10 HA THR 10 -0.016 -20.743 -39.971 54 HB THR 10 HB THR 10 -1.113 -23.502 -39.455 55 HG1 THR 10 HG1 THR 10 -2.560 -22.687 -38.172 56 1HG2 THR 10 HG21 THR 10 0.998 -23.394 -38.506 57 2HG2 THR 10 HG22 THR 10 -0.085 -22.986 -37.175 58 3HG2 THR 10 HG23 THR 10 0.798 -21.712 -38.015 59 HA PRO 11 HA PRO 11 1.889 -20.712 -39.649 60 1HB PRO 11 HB2 PRO 11 4.176 -19.904 -40.787 61 2HB PRO 11 HB1 PRO 11 4.067 -21.447 -39.931 62 1HG PRO 11 HG1 PRO 11 3.981 -20.900 -42.875 63 2HG PRO 11 HG2 PRO 11 4.841 -22.180 -42.002 64 1HD PRO 11 HD2 PRO 11 2.433 -22.539 -43.268 65 2HD PRO 11 HD1 PRO 11 2.983 -23.515 -41.893 66 H ALA 12 HN ALA 12 2.434 -18.354 -39.814 67 HA ALA 12 HA ALA 12 0.706 -17.114 -41.783 68 1HB ALA 12 HB1 ALA 12 1.425 -15.007 -40.463 69 2HB ALA 12 HB2 ALA 12 2.093 -16.163 -39.309 70 3HB ALA 12 HB3 ALA 12 0.370 -16.189 -39.687 71 H VAL 13 HN VAL 13 4.123 -16.945 -40.828 72 HA VAL 13 HA VAL 13 4.784 -15.162 -42.996 73 HB VAL 13 HB VAL 13 7.158 -15.604 -42.250 74 1HG1 VAL 13 HG11 VAL 13 6.924 -13.832 -40.918 75 2HG1 VAL 13 HG12 VAL 13 5.928 -14.729 -39.772 76 3HG1 VAL 13 HG13 VAL 13 5.188 -13.981 -41.188 77 1HG2 VAL 13 HG21 VAL 13 7.162 -17.678 -41.224 78 2HG2 VAL 13 HG22 VAL 13 5.679 -17.352 -40.327 79 3HG2 VAL 13 HG23 VAL 13 7.189 -16.579 -39.845 80 H ARG 14 HN ARG 14 6.827 -15.832 -44.319 81 HA ARG 14 HA ARG 14 6.162 -18.373 -45.615 82 1HB ARG 14 HB2 ARG 14 6.980 -15.785 -46.554 83 2HB ARG 14 HB1 ARG 14 8.143 -16.989 -47.088 84 1HG ARG 14 HG2 ARG 14 6.331 -18.296 -48.083 85 2HG ARG 14 HG1 ARG 14 5.168 -17.080 -47.552 86 1HD ARG 14 HD2 ARG 14 5.520 -16.364 -49.690 87 2HD ARG 14 HD1 ARG 14 6.789 -15.461 -48.862 88 HE ARG 14 HE ARG 14 7.334 -18.030 -50.198 89 1HH1 ARG 14 HH11 ARG 14 8.034 -14.660 -49.651 90 2HH1 ARG 14 HH12 ARG 14 9.478 -14.673 -50.607 91 1HH2 ARG 14 HH21 ARG 14 9.232 -18.055 -51.459 92 2HH2 ARG 14 HH22 ARG 14 10.159 -16.602 -51.635 93 H THR 15 HN THR 15 7.195 -19.723 -44.072 94 HA THR 15 HA THR 15 10.137 -19.576 -44.093 95 HB THR 15 HB THR 15 9.806 -21.190 -42.055 96 HG1 THR 15 HG1 THR 15 7.811 -20.497 -40.950 97 1HG2 THR 15 HG21 THR 15 10.638 -18.805 -41.985 98 2HG2 THR 15 HG22 THR 15 9.875 -19.428 -40.521 99 3HG2 THR 15 HG23 THR 15 8.979 -18.350 -41.592 100 H VAL 16 HN VAL 16 8.190 -20.846 -46.024 101 HA VAL 16 HA VAL 16 8.846 -23.665 -45.745 102 HB VAL 16 HB VAL 16 7.397 -24.030 -47.692 103 1HG1 VAL 16 HG21 VAL 16 6.137 -22.340 -45.536 104 2HG1 VAL 16 HG22 VAL 16 6.475 -24.068 -45.429 105 3HG1 VAL 16 HG23 VAL 16 5.294 -23.471 -46.595 106 1HG2 VAL 16 HG11 VAL 16 7.805 -21.883 -48.825 107 2HG2 VAL 16 HG12 VAL 16 6.873 -21.063 -47.572 108 3HG2 VAL 16 HG13 VAL 16 6.085 -22.228 -48.637 109 HA PRO 17 HA PRO 17 11.061 -22.350 -49.929 110 1HB PRO 17 HB1 PRO 17 12.331 -19.856 -48.985 111 2HB PRO 17 HB2 PRO 17 11.577 -20.215 -50.542 112 1HG PRO 17 HG1 PRO 17 10.392 -18.605 -48.769 113 2HG PRO 17 HG2 PRO 17 9.449 -19.724 -49.773 114 1HD PRO 17 HD2 PRO 17 10.278 -19.987 -46.905 115 2HD PRO 17 HD1 PRO 17 8.719 -20.371 -47.665 116 H GLN 18 HN GLN 18 13.512 -22.113 -50.302 117 HA GLN 18 HA GLN 18 14.833 -23.711 -48.324 118 1HB GLN 18 HB2 GLN 18 15.395 -22.761 -51.057 119 2HB GLN 18 HB1 GLN 18 16.816 -22.978 -50.045 120 1HG GLN 18 HG2 GLN 18 15.619 -25.287 -49.524 121 2HG GLN 18 HG1 GLN 18 14.917 -24.982 -51.113 122 1HE2 GLN 18 HE21 GLN 18 16.484 -24.451 -52.847 123 2HE2 GLN 18 HE22 GLN 18 17.998 -25.284 -52.850 124 H TYR 19 HN TYR 19 17.420 -22.845 -48.299 125 HA TYR 19 HA TYR 19 17.394 -20.893 -46.270 126 1HB TYR 19 HB1 TYR 19 19.829 -21.554 -47.913 127 2HB TYR 19 HB2 TYR 19 19.742 -21.116 -46.210 128 HD1 TYR 19 HD1 TYR 19 19.857 -23.803 -48.556 129 HD2 TYR 19 HD2 TYR 19 18.627 -22.780 -44.615 130 HE1 TYR 19 HE1 TYR 19 19.842 -26.185 -47.950 131 HE2 TYR 19 HE2 TYR 19 18.610 -25.160 -43.996 132 HH TYR 19 HH TYR 19 18.492 -27.320 -44.987 133 H LYS 20 HN LYS 20 16.743 -18.870 -46.662 134 HA LYS 20 HA LYS 20 17.602 -17.532 -49.119 135 1HB LYS 20 HB2 LYS 20 15.231 -17.459 -47.537 136 2HB LYS 20 HB1 LYS 20 15.947 -15.854 -47.516 137 1HG LYS 20 HG2 LYS 20 14.668 -15.656 -49.377 138 2HG LYS 20 HG1 LYS 20 16.132 -16.306 -50.118 139 1HD LYS 20 HD2 LYS 20 14.328 -18.374 -49.134 140 2HD LYS 20 HD1 LYS 20 13.599 -17.348 -50.370 141 1HE LYS 20 HE2 LYS 20 16.152 -17.864 -51.324 142 2HE LYS 20 HE1 LYS 20 15.630 -19.397 -50.624 143 1HZ LYS 20 HZ1 LYS 20 13.619 -18.096 -52.224 144 2HZ LYS 20 HZ2 LYS 20 14.139 -19.706 -52.239 145 3HZ LYS 20 HZ3 LYS 20 15.000 -18.530 -53.097 146 H TYR 21 HN TYR 21 19.501 -16.541 -48.978 147 HA TYR 21 HA TYR 21 20.554 -15.581 -46.485 148 1HB TYR 21 HB2 TYR 21 21.670 -16.393 -48.871 149 2HB TYR 21 HB1 TYR 21 21.893 -14.647 -48.920 150 HD1 TYR 21 HD1 TYR 21 23.298 -13.525 -47.262 151 HD2 TYR 21 HD2 TYR 21 22.844 -17.755 -47.261 152 HE1 TYR 21 HE1 TYR 21 25.256 -13.727 -45.788 153 HE2 TYR 21 HE2 TYR 21 24.800 -17.970 -45.786 154 HH TYR 21 HH TYR 21 27.028 -15.686 -45.340 155 H ALA 22 HN ALA 22 18.921 -14.055 -45.902 156 HA ALA 22 HA ALA 22 18.584 -11.701 -47.569 157 1HB ALA 22 HB1 ALA 22 17.278 -12.747 -45.104 158 2HB ALA 22 HB2 ALA 22 16.560 -12.235 -46.632 159 3HB ALA 22 HB3 ALA 22 17.147 -11.030 -45.485 160 H ALA 23 HN ALA 23 19.608 -9.818 -47.306 161 HA ALA 23 HA ALA 23 21.784 -9.596 -45.486 162 1HB ALA 23 HB1 ALA 23 21.789 -7.178 -46.353 163 2HB ALA 23 HB2 ALA 23 20.512 -7.717 -47.443 164 3HB ALA 23 HB3 ALA 23 22.103 -8.476 -47.504 165 H GLY 24 HN GLY 24 21.698 -9.052 -43.413 166 1HA GLY 24 HA1 GLY 24 19.303 -7.686 -42.407 167 2HA GLY 24 HA2 GLY 24 20.456 -8.588 -41.436 168 H VAL 25 HN VAL 25 20.765 -5.892 -43.749 169 HA VAL 25 HA VAL 25 22.620 -4.569 -41.953 170 HB VAL 25 HB VAL 25 23.123 -4.583 -44.341 171 1HG1 VAL 25 HG11 VAL 25 20.456 -3.232 -44.551 172 2HG1 VAL 25 HG12 VAL 25 21.072 -4.622 -45.445 173 3HG1 VAL 25 HG13 VAL 25 21.694 -3.008 -45.787 174 1HG2 VAL 25 HG21 VAL 25 23.024 -1.895 -44.546 175 2HG2 VAL 25 HG22 VAL 25 24.211 -2.766 -43.575 176 3HG2 VAL 25 HG23 VAL 25 22.770 -2.092 -42.812 177 H ARG 26 HN ARG 26 19.318 -4.230 -43.054 178 HA ARG 26 HA ARG 26 19.010 -1.641 -41.770 179 1HB ARG 26 HB1 ARG 26 17.208 -3.396 -43.417 180 2HB ARG 26 HB2 ARG 26 16.561 -2.032 -42.516 181 1HG ARG 26 HG2 ARG 26 18.197 -0.572 -43.721 182 2HG ARG 26 HG1 ARG 26 18.593 -1.965 -44.731 183 1HD ARG 26 HD1 ARG 26 15.902 -0.636 -44.453 184 2HD ARG 26 HD2 ARG 26 16.965 -0.586 -45.858 185 HE ARG 26 HE ARG 26 16.511 -3.239 -45.472 186 1HH1 ARG 26 HH11 ARG 26 14.460 -0.452 -45.876 187 2HH1 ARG 26 HH12 ARG 26 13.179 -1.342 -46.629 188 1HH2 ARG 26 HH21 ARG 26 14.830 -4.420 -46.463 189 2HH2 ARG 26 HH22 ARG 26 13.390 -3.598 -46.963 190 H ASN 27 HN ASN 27 18.872 -1.661 -39.620 191 HA ASN 27 HA ASN 27 17.577 -3.879 -38.248 192 1HB ASN 27 HB2 ASN 27 19.547 -1.837 -37.558 193 2HB ASN 27 HB1 ASN 27 18.308 -2.023 -36.318 194 1HD2 ASN 27 HD21 ASN 27 21.224 -2.770 -36.535 195 2HD2 ASN 27 HD22 ASN 27 21.271 -4.430 -36.055 196 HA PRO 28 HA PRO 28 13.776 -1.675 -37.718 197 1HB PRO 28 HB2 PRO 28 12.666 -3.117 -35.738 198 2HB PRO 28 HB1 PRO 28 12.881 -3.771 -37.366 199 1HG PRO 28 HG1 PRO 28 14.540 -4.205 -34.912 200 2HG PRO 28 HG2 PRO 28 14.017 -5.381 -36.131 201 1HD PRO 28 HD1 PRO 28 16.507 -4.248 -36.082 202 2HD PRO 28 HD2 PRO 28 15.723 -4.840 -37.560 203 H GLN 29 HN GLN 29 16.262 -0.897 -36.050 204 HA GLN 29 HA GLN 29 15.252 -0.116 -33.496 205 1HB GLN 29 HB1 GLN 29 17.763 0.191 -35.008 206 2HB GLN 29 HB2 GLN 29 17.410 1.504 -33.891 207 1HG GLN 29 HG1 GLN 29 17.227 -1.331 -32.973 208 2HG GLN 29 HG2 GLN 29 18.796 -0.534 -33.095 209 1HE2 GLN 29 HE21 GLN 29 19.389 -0.092 -31.088 210 2HE2 GLN 29 HE22 GLN 29 18.426 0.723 -29.907 211 H GLN 30 HN GLN 30 13.538 1.227 -33.506 212 HA GLN 30 HA GLN 30 13.498 3.515 -35.314 213 1HB GLN 30 HB1 GLN 30 11.517 1.848 -34.423 214 2HB GLN 30 HB2 GLN 30 11.310 3.240 -33.370 215 1HG GLN 30 HG1 GLN 30 11.481 4.550 -35.653 216 2HG GLN 30 HG2 GLN 30 10.935 3.003 -36.302 217 1HE2 GLN 30 HE21 GLN 30 10.180 5.062 -33.507 218 2HE2 GLN 30 HE22 GLN 30 8.465 4.990 -33.703 219 H HIS 31 HN HIS 31 12.347 3.351 -31.967 220 HA HIS 31 HA HIS 31 12.567 4.787 -30.218 221 1HB HIS 31 HB2 HIS 31 14.971 3.808 -30.593 222 2HB HIS 31 HB1 HIS 31 15.349 5.442 -31.127 223 HD2 HIS 31 HD2 HIS 31 17.029 5.288 -28.739 224 HE1 HIS 31 HE1 HIS 31 13.725 6.179 -26.249 225 HE2 HIS 31 HE2 HIS 31 16.253 6.035 -26.378 226 H LEU 32 HN LEU 32 11.239 5.954 -32.232 227 HA LEU 32 HA LEU 32 12.411 8.456 -33.017 228 1HB LEU 32 HB2 LEU 32 10.143 6.888 -33.752 229 2HB LEU 32 HB1 LEU 32 9.584 8.497 -33.333 230 HG LEU 32 HG LEU 32 11.720 9.068 -34.942 231 1HD1 LEU 32 HD21 LEU 32 10.526 6.459 -35.812 232 2HD1 LEU 32 HD22 LEU 32 12.224 6.917 -35.686 233 3HD1 LEU 32 HD23 LEU 32 11.224 7.587 -36.975 234 1HD2 LEU 32 HD11 LEU 32 8.924 8.594 -35.949 235 2HD2 LEU 32 HD12 LEU 32 10.110 9.753 -36.548 236 3HD2 LEU 32 HD13 LEU 32 9.382 9.978 -34.958 237 H ASN 33 HN ASN 33 12.574 10.165 -31.744 238 HA ASN 33 HA ASN 33 10.900 10.385 -29.372 239 1HB ASN 33 HB1 ASN 33 12.848 12.528 -29.969 240 2HB ASN 33 HB2 ASN 33 12.558 11.654 -28.468 241 1HD2 ASN 33 HD21 ASN 33 14.653 12.100 -31.009 242 2HD2 ASN 33 HD22 ASN 33 15.640 10.699 -30.793 243 H ALA 34 HN ALA 34 8.987 10.742 -30.785 244 HA ALA 34 HA ALA 34 8.783 13.239 -32.196 245 1HB ALA 34 HB1 ALA 34 6.635 12.563 -32.825 246 2HB ALA 34 HB2 ALA 34 6.462 11.502 -31.428 247 3HB ALA 34 HB3 ALA 34 7.558 11.062 -32.737 248 H GLN 35 HN GLN 35 9.421 14.590 -30.351 249 HA GLN 35 HA GLN 35 7.535 14.863 -28.178 250 1HB GLN 35 HB2 GLN 35 9.910 15.161 -27.726 251 2HB GLN 35 HB1 GLN 35 9.989 16.479 -28.887 252 1HG GLN 35 HG2 GLN 35 7.943 17.047 -26.988 253 2HG GLN 35 HG1 GLN 35 9.417 16.602 -26.130 254 1HE2 GLN 35 HE21 GLN 35 7.780 19.028 -27.814 255 2HE2 GLN 35 HE22 GLN 35 9.061 20.183 -27.891 256 HA PRO 36 HA PRO 36 6.725 19.089 -30.406 257 1HB PRO 36 HB1 PRO 36 7.439 19.276 -33.018 258 2HB PRO 36 HB2 PRO 36 8.505 19.760 -31.693 259 1HG PRO 36 HG2 PRO 36 8.479 17.215 -33.273 260 2HG PRO 36 HG1 PRO 36 9.862 18.205 -32.771 261 1HD PRO 36 HD1 PRO 36 9.145 15.952 -31.462 262 2HD PRO 36 HD2 PRO 36 9.859 17.346 -30.628 263 H GLN 37 HN GLN 37 6.442 15.982 -31.880 264 HA GLN 37 HA GLN 37 4.232 16.628 -33.593 265 1HB GLN 37 HB1 GLN 37 5.991 14.478 -33.324 266 2HB GLN 37 HB2 GLN 37 4.424 13.823 -32.867 267 1HG GLN 37 HG2 GLN 37 3.694 15.106 -35.082 268 2HG GLN 37 HG1 GLN 37 5.385 14.805 -35.484 269 1HE2 GLN 37 HE21 GLN 37 5.021 13.315 -37.064 270 2HE2 GLN 37 HE22 GLN 37 4.350 11.751 -36.766 271 H VAL 38 HN VAL 38 2.350 17.233 -32.742 272 HA VAL 38 HA VAL 38 1.438 16.037 -30.231 273 HB VAL 38 HB VAL 38 -0.057 18.204 -31.652 274 1HG1 VAL 38 HG11 VAL 38 0.383 18.218 -28.737 275 2HG1 VAL 38 HG12 VAL 38 -0.562 16.870 -29.370 276 3HG1 VAL 38 HG13 VAL 38 -1.082 18.528 -29.667 277 1HG2 VAL 38 HG21 VAL 38 2.643 18.411 -30.497 278 2HG2 VAL 38 HG22 VAL 38 1.491 19.640 -29.970 279 3HG2 VAL 38 HG23 VAL 38 1.834 19.430 -31.687 280 H THR 39 HN THR 39 0.742 14.013 -30.930 281 HA THR 39 HA THR 39 -1.493 14.000 -32.846 282 HB THR 39 HB THR 39 0.052 11.572 -31.954 283 HG1 THR 39 HG1 THR 39 1.008 13.610 -33.367 284 1HG2 THR 39 HG21 THR 39 -0.705 10.536 -33.908 285 2HG2 THR 39 HG22 THR 39 -1.266 12.059 -34.598 286 3HG2 THR 39 HG23 THR 39 -2.117 11.343 -33.229 287 H MET 40 HN MET 40 -0.407 12.279 -29.915 288 HA MET 40 HA MET 40 -3.190 11.700 -29.251 289 1HB MET 40 HB2 MET 40 -2.274 10.211 -27.541 290 2HB MET 40 HB1 MET 40 -1.565 9.866 -29.112 291 1HG MET 40 HG2 MET 40 -0.144 11.735 -27.290 292 2HG MET 40 HG1 MET 40 -0.097 10.008 -26.941 293 1HE MET 40 HE1 MET 40 1.980 8.395 -29.465 294 2HE MET 40 HE2 MET 40 0.817 8.309 -28.141 295 3HE MET 40 HE3 MET 40 2.444 8.922 -27.847 296 H GLN 41 HN GLN 41 -3.774 11.881 -26.877 297 HA GLN 41 HA GLN 41 -3.232 14.602 -26.035 298 1HB GLN 41 HB2 GLN 41 -5.136 12.471 -25.070 299 2HB GLN 41 HB1 GLN 41 -4.938 14.003 -24.230 300 1HG GLN 41 HG2 GLN 41 -5.458 15.080 -26.502 301 2HG GLN 41 HG1 GLN 41 -6.061 13.485 -26.954 302 1HE2 GLN 41 HE21 GLN 41 -7.260 12.627 -24.691 303 2HE2 GLN 41 HE22 GLN 41 -8.589 13.652 -24.286 304 H GLN 42 HN GLN 42 -2.560 15.170 -23.901 305 HA GLN 42 HA GLN 42 -0.914 13.096 -22.607 306 1HB GLN 42 HB1 GLN 42 -0.340 15.912 -23.334 307 2HB GLN 42 HB2 GLN 42 0.260 15.377 -21.770 308 1HG GLN 42 HG2 GLN 42 1.733 13.885 -22.687 309 2HG GLN 42 HG1 GLN 42 0.782 13.684 -24.159 310 1HE2 GLN 42 HE22 GLN 42 1.029 15.124 -25.839 311 2HE2 GLN 42 HE21 GLN 42 2.327 16.262 -25.912 312 HA PRO 43 HA PRO 43 -4.191 14.069 -19.521 313 1HB PRO 43 HB1 PRO 43 -2.861 11.690 -18.323 314 2HB PRO 43 HB2 PRO 43 -4.582 12.034 -18.528 315 1HG PRO 43 HG1 PRO 43 -3.356 10.278 -20.107 316 2HG PRO 43 HG2 PRO 43 -4.577 11.386 -20.759 317 1HD PRO 43 HD1 PRO 43 -1.599 11.500 -20.983 318 2HD PRO 43 HD2 PRO 43 -2.838 11.918 -22.185 319 H ALA 44 HN ALA 44 -3.849 15.531 -17.984 320 HA ALA 44 HA ALA 44 -1.188 15.870 -16.865 321 1HB ALA 44 HB1 ALA 44 -3.609 17.537 -17.116 322 2HB ALA 44 HB2 ALA 44 -1.908 17.964 -17.305 323 3HB ALA 44 HB3 ALA 44 -2.608 17.820 -15.692 324 H VAL 45 HN VAL 45 -0.976 14.117 -15.468 325 HA VAL 45 HA VAL 45 -2.887 13.936 -13.248 326 HB VAL 45 HB VAL 45 -1.442 11.830 -12.725 327 1HG1 VAL 45 HG11 VAL 45 -3.291 10.810 -13.405 328 2HG1 VAL 45 HG12 VAL 45 -2.865 11.080 -15.095 329 3HG1 VAL 45 HG13 VAL 45 -3.779 12.301 -14.209 330 1HG2 VAL 45 HG21 VAL 45 -0.165 12.775 -15.076 331 2HG2 VAL 45 HG22 VAL 45 -0.961 11.249 -15.461 332 3HG2 VAL 45 HG23 VAL 45 0.197 11.329 -14.134 333 H HIS 46 HN HIS 46 -2.239 15.630 -11.943 334 HA HIS 46 HA HIS 46 0.530 15.932 -11.180 335 1HB HIS 46 HB1 HIS 46 -1.952 17.462 -10.886 336 2HB HIS 46 HB2 HIS 46 -0.928 17.515 -9.454 337 HD2 HIS 46 HD2 HIS 46 0.323 17.670 -13.188 338 HE1 HIS 46 HE1 HIS 46 1.462 21.183 -11.120 339 HE2 HIS 46 HE2 HIS 46 1.631 19.908 -13.305 340 H VAL 47 HN VAL 47 1.334 14.396 -9.887 341 HA VAL 47 HA VAL 47 -0.272 13.539 -7.576 342 HB VAL 47 HB VAL 47 0.496 11.792 -9.253 343 1HG1 VAL 47 HG11 VAL 47 2.737 12.617 -9.659 344 2HG1 VAL 47 HG12 VAL 47 2.805 10.981 -9.003 345 3HG1 VAL 47 HG13 VAL 47 3.162 12.362 -7.966 346 1HG2 VAL 47 HG21 VAL 47 -0.227 10.754 -7.379 347 2HG2 VAL 47 HG22 VAL 47 0.802 11.712 -6.316 348 3HG2 VAL 47 HG23 VAL 47 1.485 10.362 -7.222 349 H GLN 48 HN GLN 48 1.580 15.918 -7.982 350 HA GLN 48 HA GLN 48 3.858 15.520 -6.338 351 1HB GLN 48 HB2 GLN 48 3.058 17.498 -8.017 352 2HB GLN 48 HB1 GLN 48 2.714 18.241 -6.461 353 1HG GLN 48 HG1 GLN 48 4.845 18.926 -6.650 354 2HG GLN 48 HG2 GLN 48 5.180 17.334 -5.970 355 1HE2 GLN 48 HE22 GLN 48 6.541 16.086 -7.036 356 2HE2 GLN 48 HE21 GLN 48 7.008 16.274 -8.688 357 H GLY 49 HN GLY 49 0.546 16.499 -5.717 358 1HA GLY 49 HA2 GLY 49 1.100 17.139 -2.939 359 2HA GLY 49 HA1 GLY 49 -0.467 17.202 -3.733 360 H GLN 50 HN GLN 50 1.946 15.010 -2.373 361 HA GLN 50 HA GLN 50 0.085 12.796 -2.338 362 1HB GLN 50 HB2 GLN 50 2.922 13.139 -1.375 363 2HB GLN 50 HB1 GLN 50 2.001 11.670 -1.083 364 1HG GLN 50 HG2 GLN 50 1.686 11.455 -3.540 365 2HG GLN 50 HG1 GLN 50 2.773 12.829 -3.748 366 1HE2 GLN 50 HE21 GLN 50 2.543 9.560 -2.469 367 2HE2 GLN 50 HE22 GLN 50 4.221 9.179 -2.635 368 H GLU 51 HN GLU 51 -1.540 12.997 -0.921 369 HA GLU 51 HA GLU 51 -1.234 14.274 1.622 370 1HB GLU 51 HB2 GLU 51 -3.405 13.346 -0.013 371 2HB GLU 51 HB1 GLU 51 -3.604 12.738 1.625 372 1HG GLU 51 HG2 GLU 51 -3.556 14.944 2.528 373 2HG GLU 51 HG1 GLU 51 -3.106 15.628 0.966 374 HA PRO 52 HA PRO 52 -1.762 9.641 3.192 375 1HB PRO 52 HB1 PRO 52 -0.559 7.848 1.463 376 2HB PRO 52 HB2 PRO 52 -2.298 8.110 1.599 377 1HG PRO 52 HG2 PRO 52 -0.362 9.221 -0.387 378 2HG PRO 52 HG1 PRO 52 -2.018 8.635 -0.639 379 1HD PRO 52 HD1 PRO 52 -1.469 11.253 -0.536 380 2HD PRO 52 HD2 PRO 52 -2.965 10.597 0.160 381 H LEU 53 HN LEU 53 -0.210 8.829 4.528 382 HA LEU 53 HA LEU 53 2.422 10.000 4.333 383 1HB LEU 53 HB2 LEU 53 0.779 9.319 6.421 384 2HB LEU 53 HB1 LEU 53 1.951 8.013 6.439 385 HG LEU 53 HG LEU 53 3.527 10.283 6.212 386 1HD1 LEU 53 HD21 LEU 53 2.376 11.321 8.475 387 2HD1 LEU 53 HD22 LEU 53 0.985 10.982 7.445 388 3HD1 LEU 53 HD23 LEU 53 2.285 12.019 6.857 389 1HD2 LEU 53 HD11 LEU 53 2.730 8.530 8.506 390 2HD2 LEU 53 HD12 LEU 53 3.870 9.858 8.724 391 3HD2 LEU 53 HD13 LEU 53 4.240 8.554 7.595 392 H THR 54 HN THR 54 4.381 8.870 4.252 393 HA THR 54 HA THR 54 4.496 6.033 4.003 394 HB THR 54 HB THR 54 5.610 6.996 1.525 395 HG1 THR 54 HG1 THR 54 4.056 8.155 0.764 396 1HG2 THR 54 HG21 THR 54 3.430 5.033 2.158 397 2HG2 THR 54 HG22 THR 54 5.120 4.684 1.792 398 3HG2 THR 54 HG23 THR 54 4.060 5.328 0.538 399 H ALA 55 HN ALA 55 6.862 5.640 2.779 400 HA ALA 55 HA ALA 55 8.748 6.355 4.671 401 1HB ALA 55 HB1 ALA 55 9.179 4.521 3.221 402 2HB ALA 55 HB2 ALA 55 10.451 5.715 2.959 403 3HB ALA 55 HB3 ALA 55 9.134 5.559 1.796 404 H SER 56 HN SER 56 7.837 8.023 1.704 405 HA SER 56 HA SER 56 9.936 9.894 1.633 406 1HB SER 56 HB1 SER 56 7.162 10.626 0.754 407 2HB SER 56 HB2 SER 56 8.708 11.012 0.001 408 HG SER 56 HG SER 56 7.130 9.134 -0.738 409 H MET 57 HN MET 57 6.734 10.008 3.145 410 HA MET 57 HA MET 57 6.875 12.602 4.196 411 1HB MET 57 HB1 MET 57 5.399 10.113 5.011 412 2HB MET 57 HB2 MET 57 5.295 11.570 5.982 413 1HG MET 57 HG1 MET 57 3.583 10.962 4.018 414 2HG MET 57 HG2 MET 57 3.950 12.612 4.517 415 1HE MET 57 HE1 MET 57 5.353 10.459 0.727 416 2HE MET 57 HE2 MET 57 3.727 10.299 1.392 417 3HE MET 57 HE3 MET 57 5.117 9.719 2.311 418 H LEU 58 HN LEU 58 7.888 9.484 5.482 419 HA LEU 58 HA LEU 58 8.689 10.276 8.037 420 1HB LEU 58 HB1 LEU 58 9.549 8.088 6.171 421 2HB LEU 58 HB2 LEU 58 10.349 8.298 7.715 422 HG LEU 58 HG LEU 58 8.765 7.111 8.729 423 1HD1 LEU 58 HD11 LEU 58 7.485 9.269 8.851 424 2HD1 LEU 58 HD12 LEU 58 6.503 7.805 8.928 425 3HD1 LEU 58 HD13 LEU 58 6.589 8.733 7.429 426 1HD2 LEU 58 HD21 LEU 58 7.390 5.703 7.456 427 2HD2 LEU 58 HD22 LEU 58 8.776 6.048 6.417 428 3HD2 LEU 58 HD23 LEU 58 7.242 6.882 6.153 429 H ALA 59 HN ALA 59 10.529 10.065 5.016 430 HA ALA 59 HA ALA 59 12.956 11.054 6.132 431 1HB ALA 59 HB1 ALA 59 13.661 11.278 3.752 432 2HB ALA 59 HB2 ALA 59 12.036 10.784 3.278 433 3HB ALA 59 HB3 ALA 59 13.066 9.676 4.183 434 H SER 60 HN SER 60 10.098 12.604 5.589 435 HA SER 60 HA SER 60 11.205 15.105 4.623 436 1HB SER 60 HB1 SER 60 8.901 14.228 3.994 437 2HB SER 60 HB2 SER 60 8.400 14.634 5.635 438 HG SER 60 HG SER 60 8.222 16.245 3.740 439 H ALA 61 HN ALA 61 11.015 13.571 7.566 440 HA ALA 61 HA ALA 61 11.309 16.132 8.985 441 1HB ALA 61 HB1 ALA 61 10.008 15.351 10.840 442 2HB ALA 61 HB2 ALA 61 9.825 13.759 10.103 443 3HB ALA 61 HB3 ALA 61 9.048 15.164 9.372 444 HA PRO 62 HA PRO 62 14.597 13.148 10.343 445 1HB PRO 62 HB2 PRO 62 16.479 13.278 8.454 446 2HB PRO 62 HB1 PRO 62 15.014 12.320 8.209 447 1HG PRO 62 HG2 PRO 62 15.806 14.895 6.992 448 2HG PRO 62 HG1 PRO 62 14.696 13.658 6.382 449 1HD PRO 62 HD1 PRO 62 14.062 16.097 7.793 450 2HD PRO 62 HD2 PRO 62 12.947 14.894 7.112 451 HA PRO 63 HA PRO 63 15.101 13.051 11.951 452 1HB PRO 63 HB2 PRO 63 16.227 13.377 14.350 453 2HB PRO 63 HB1 PRO 63 17.196 12.881 12.958 454 1HG PRO 63 HG2 PRO 63 17.114 15.480 14.362 455 2HG PRO 63 HG1 PRO 63 18.410 14.771 13.387 456 1HD PRO 63 HD1 PRO 63 16.409 16.700 12.590 457 2HD PRO 63 HD2 PRO 63 17.767 16.062 11.641 458 H GLN 64 HN GLN 64 13.102 12.955 12.839 459 HA GLN 64 HA GLN 64 12.276 14.499 15.053 460 1HB GLN 64 HB1 GLN 64 12.213 16.125 12.996 461 2HB GLN 64 HB2 GLN 64 10.728 15.268 12.608 462 1HG GLN 64 HG1 GLN 64 10.509 15.892 15.311 463 2HG GLN 64 HG2 GLN 64 11.207 17.327 14.562 464 1HE2 GLN 64 HE21 GLN 64 10.025 17.206 12.069 465 2HE2 GLN 64 HE22 GLN 64 8.325 17.463 12.234 466 H GLU 65 HN GLU 65 10.147 13.802 12.337 467 HA GLU 65 HA GLU 65 8.721 11.894 14.014 468 1HB GLU 65 HB1 GLU 65 7.911 12.940 11.301 469 2HB GLU 65 HB2 GLU 65 6.885 12.163 12.499 470 1HG GLU 65 HG2 GLU 65 8.284 14.736 13.106 471 2HG GLU 65 HG1 GLU 65 6.757 14.710 12.223 472 H GLN 66 HN GLN 66 11.276 11.599 12.149 473 HA GLN 66 HA GLN 66 10.768 9.745 10.158 474 1HB GLN 66 HB1 GLN 66 13.055 10.720 11.571 475 2HB GLN 66 HB2 GLN 66 13.176 8.970 11.458 476 1HG GLN 66 HG1 GLN 66 12.480 9.538 8.932 477 2HG GLN 66 HG2 GLN 66 13.330 11.025 9.354 478 1HE2 GLN 66 HE22 GLN 66 15.233 9.976 11.096 479 2HE2 GLN 66 HE21 GLN 66 16.330 8.995 10.191 480 H LYS 67 HN LYS 67 11.463 9.155 13.590 481 HA LYS 67 HA LYS 67 10.392 6.433 13.260 482 1HB LYS 67 HB2 LYS 67 11.742 5.907 15.329 483 2HB LYS 67 HB1 LYS 67 12.673 6.257 13.881 484 1HG LYS 67 HG2 LYS 67 13.563 8.144 14.737 485 2HG LYS 67 HG1 LYS 67 12.102 8.552 15.639 486 1HD LYS 67 HD1 LYS 67 13.593 8.030 17.330 487 2HD LYS 67 HD2 LYS 67 12.739 6.502 17.101 488 1HE LYS 67 HE2 LYS 67 14.620 5.900 15.480 489 2HE LYS 67 HE1 LYS 67 15.491 7.266 16.173 490 1HZ LYS 67 HZ1 LYS 67 15.816 6.192 18.117 491 2HZ LYS 67 HZ2 LYS 67 15.670 4.818 17.140 492 3HZ LYS 67 HZ3 LYS 67 14.348 5.353 18.050 493 H GLN 68 HN GLN 68 8.679 8.604 13.638 494 HA GLN 68 HA GLN 68 7.556 7.911 16.253 495 1HB GLN 68 HB1 GLN 68 8.046 10.702 15.224 496 2HB GLN 68 HB2 GLN 68 6.891 10.349 16.503 497 1HG GLN 68 HG2 GLN 68 8.888 9.184 17.658 498 2HG GLN 68 HG1 GLN 68 9.868 10.131 16.539 499 1HE2 GLN 68 HE22 GLN 68 6.834 11.051 18.076 500 2HE2 GLN 68 HE21 GLN 68 7.482 12.374 18.979 501 H MET 69 HN MET 69 6.935 9.830 13.308 502 HA MET 69 HA MET 69 4.102 9.377 13.517 503 1HB MET 69 HB2 MET 69 3.870 10.810 11.648 504 2HB MET 69 HB1 MET 69 5.163 11.486 12.626 505 1HG MET 69 HG2 MET 69 6.777 11.008 11.084 506 2HG MET 69 HG1 MET 69 5.887 9.638 10.415 507 1HE MET 69 HE1 MET 69 7.085 12.056 8.055 508 2HE MET 69 HE2 MET 69 7.431 12.446 9.739 509 3HE MET 69 HE3 MET 69 6.493 13.565 8.751 510 H LEU 70 HN LEU 70 6.449 7.332 12.624 511 HA LEU 70 HA LEU 70 5.467 6.326 10.150 512 1HB LEU 70 HB1 LEU 70 6.728 4.172 11.305 513 2HB LEU 70 HB2 LEU 70 7.466 5.357 10.257 514 HG LEU 70 HG LEU 70 8.380 6.563 12.117 515 1HD1 LEU 70 HD21 LEU 70 6.252 5.780 13.565 516 2HD1 LEU 70 HD22 LEU 70 7.743 6.397 14.276 517 3HD1 LEU 70 HD23 LEU 70 7.469 4.658 14.173 518 1HD2 LEU 70 HD11 LEU 70 8.719 3.583 12.360 519 2HD2 LEU 70 HD12 LEU 70 9.751 4.764 13.168 520 3HD2 LEU 70 HD13 LEU 70 9.694 4.702 11.406 521 H GLY 71 HN GLY 71 4.863 5.502 13.534 522 1HA GLY 71 HA2 GLY 71 2.595 3.891 12.594 523 2HA GLY 71 HA1 GLY 71 3.682 3.226 13.796 524 H GLU 72 HN GLU 72 2.906 6.615 13.830 525 HA GLU 72 HA GLU 72 0.922 6.199 15.947 526 1HB GLU 72 HB1 GLU 72 3.251 8.112 16.211 527 2HB GLU 72 HB2 GLU 72 1.989 7.826 17.402 528 1HG GLU 72 HG2 GLU 72 3.027 5.313 16.960 529 2HG GLU 72 HG1 GLU 72 4.442 6.363 16.893 530 H ARG 73 HN ARG 73 1.801 7.691 13.126 531 HA ARG 73 HA ARG 73 -0.209 9.811 13.519 532 1HB ARG 73 HB1 ARG 73 2.138 10.676 13.392 533 2HB ARG 73 HB2 ARG 73 2.245 10.011 11.770 534 1HG ARG 73 HG2 ARG 73 1.329 11.840 10.934 535 2HG ARG 73 HG1 ARG 73 -0.104 11.609 11.941 536 1HD ARG 73 HD1 ARG 73 1.840 12.559 13.680 537 2HD ARG 73 HD2 ARG 73 2.060 13.508 12.211 538 HE ARG 73 HE ARG 73 -0.272 14.171 12.403 539 1HH1 ARG 73 HH21 ARG 73 1.206 12.729 15.211 540 2HH1 ARG 73 HH22 ARG 73 0.080 13.433 16.323 541 1HH2 ARG 73 HH12 ARG 73 -1.756 15.101 13.860 542 2HH2 ARG 73 HH11 ARG 73 -1.603 14.782 15.555 543 H LEU 74 HN LEU 74 1.008 7.229 11.626 544 HA LEU 74 HA LEU 74 -0.310 7.882 9.183 545 1HB LEU 74 HB1 LEU 74 1.368 5.752 10.222 546 2HB LEU 74 HB2 LEU 74 0.083 5.133 9.200 547 HG LEU 74 HG LEU 74 1.571 7.438 8.127 548 1HD1 LEU 74 HD11 LEU 74 3.568 6.381 7.689 549 2HD1 LEU 74 HD12 LEU 74 2.893 4.772 7.953 550 3HD1 LEU 74 HD13 LEU 74 3.215 5.829 9.328 551 1HD2 LEU 74 HD21 LEU 74 -0.147 6.388 6.815 552 2HD2 LEU 74 HD22 LEU 74 0.610 4.807 7.018 553 3HD2 LEU 74 HD23 LEU 74 1.420 6.057 6.075 554 H PHE 75 HN PHE 75 -1.425 6.666 12.134 555 HA PHE 75 HA PHE 75 -3.277 4.760 11.514 556 1HB PHE 75 HB1 PHE 75 -2.953 5.295 13.799 557 2HB PHE 75 HB2 PHE 75 -3.414 6.975 13.550 558 HD1 PHE 75 HD1 PHE 75 -5.127 3.880 12.409 559 HD2 PHE 75 HD2 PHE 75 -5.229 7.299 14.945 560 HE1 PHE 75 HE1 PHE 75 -7.447 3.343 13.041 561 HE2 PHE 75 HE2 PHE 75 -7.547 6.768 15.577 562 HZ PHE 75 HZ PHE 75 -8.659 4.788 14.625 563 HA PRO 76 HA PRO 76 -6.679 8.076 10.491 564 1HB PRO 76 HB2 PRO 76 -5.078 10.462 9.813 565 2HB PRO 76 HB1 PRO 76 -6.554 10.335 10.776 566 1HG PRO 76 HG1 PRO 76 -4.184 10.831 11.918 567 2HG PRO 76 HG2 PRO 76 -5.403 9.818 12.714 568 1HD PRO 76 HD1 PRO 76 -2.938 9.002 11.221 569 2HD PRO 76 HD2 PRO 76 -3.611 8.344 12.727 570 H LEU 77 HN LEU 77 -3.669 7.577 8.976 571 HA LEU 77 HA LEU 77 -4.666 8.274 6.325 572 1HB LEU 77 HB1 LEU 77 -1.964 7.389 7.323 573 2HB LEU 77 HB2 LEU 77 -2.327 7.587 5.624 574 HG LEU 77 HG LEU 77 -1.381 9.613 6.015 575 1HD1 LEU 77 HD21 LEU 77 -3.029 11.347 6.304 576 2HD1 LEU 77 HD22 LEU 77 -4.152 10.206 7.045 577 3HD1 LEU 77 HD23 LEU 77 -3.721 10.040 5.343 578 1HD2 LEU 77 HD11 LEU 77 -1.984 8.950 8.774 579 2HD2 LEU 77 HD12 LEU 77 -2.134 10.673 8.431 580 3HD2 LEU 77 HD13 LEU 77 -0.620 9.833 8.090 581 H ILE 78 HN ILE 78 -4.001 5.463 8.294 582 HA ILE 78 HA ILE 78 -3.903 3.574 6.182 583 HB ILE 78 HB ILE 78 -4.889 2.894 8.924 584 1HG1 ILE 78 HG12 ILE 78 -2.859 4.303 9.149 585 2HG1 ILE 78 HG11 ILE 78 -2.583 2.642 9.663 586 1HG2 ILE 78 HG21 ILE 78 -3.235 0.911 8.158 587 2HG2 ILE 78 HG22 ILE 78 -3.815 1.465 6.587 588 3HG2 ILE 78 HG23 ILE 78 -4.965 0.936 7.817 589 1HD1 ILE 78 HD11 ILE 78 -1.875 3.584 6.909 590 2HD1 ILE 78 HD12 ILE 78 -1.314 2.147 7.764 591 3HD1 ILE 78 HD13 ILE 78 -0.776 3.746 8.278 592 H GLN 79 HN GLN 79 -6.517 4.853 8.168 593 HA GLN 79 HA GLN 79 -8.588 3.156 7.486 594 1HB GLN 79 HB1 GLN 79 -8.366 5.994 8.309 595 2HB GLN 79 HB2 GLN 79 -9.873 5.545 7.525 596 1HG GLN 79 HG1 GLN 79 -10.140 3.728 9.185 597 2HG GLN 79 HG2 GLN 79 -8.692 4.314 10.003 598 1HE2 GLN 79 HE21 GLN 79 -11.752 5.593 8.736 599 2HE2 GLN 79 HE22 GLN 79 -12.086 6.609 10.094 600 H ALA 80 HN ALA 80 -6.832 5.336 5.548 601 HA ALA 80 HA ALA 80 -8.791 5.659 3.464 602 1HB ALA 80 HB1 ALA 80 -5.888 6.186 3.035 603 2HB ALA 80 HB2 ALA 80 -6.791 7.211 4.153 604 3HB ALA 80 HB3 ALA 80 -7.295 7.089 2.467 605 H MET 81 HN MET 81 -5.894 3.693 4.003 606 HA MET 81 HA MET 81 -5.876 2.570 1.367 607 1HB MET 81 HB1 MET 81 -4.641 1.161 3.701 608 2HB MET 81 HB2 MET 81 -4.054 1.304 2.052 609 1HG MET 81 HG2 MET 81 -2.951 3.203 2.471 610 2HG MET 81 HG1 MET 81 -4.206 3.832 3.529 611 1HE MET 81 HE1 MET 81 -1.056 2.568 2.925 612 2HE MET 81 HE2 MET 81 -0.795 1.186 3.993 613 3HE MET 81 HE3 MET 81 -0.256 2.797 4.481 614 H HIS 82 HN HIS 82 -6.825 1.360 4.551 615 HA HIS 82 HA HIS 82 -8.370 -0.772 3.237 616 1HB HIS 82 HB2 HIS 82 -6.784 -0.616 5.742 617 2HB HIS 82 HB1 HIS 82 -8.258 -1.567 5.813 618 HD2 HIS 82 HD2 HIS 82 -5.432 -1.477 3.049 619 HE1 HIS 82 HE1 HIS 82 -6.174 -5.452 4.295 620 HE2 HIS 82 HE2 HIS 82 -4.835 -3.981 2.723 621 HA PRO 83 HA PRO 83 -12.186 1.006 4.594 622 1HB PRO 83 HB2 PRO 83 -13.531 -1.246 5.438 623 2HB PRO 83 HB1 PRO 83 -13.399 -0.732 3.755 624 1HG PRO 83 HG1 PRO 83 -11.820 -2.790 5.240 625 2HG PRO 83 HG2 PRO 83 -12.443 -2.835 3.580 626 1HD PRO 83 HD1 PRO 83 -9.861 -2.314 4.103 627 2HD PRO 83 HD2 PRO 83 -10.717 -1.523 2.762 628 H THR 84 HN THR 84 -11.031 2.039 6.378 629 HA THR 84 HA THR 84 -10.508 2.464 8.554 630 HB THR 84 HB THR 84 -12.972 2.935 8.343 631 HG1 THR 84 HG1 THR 84 -11.458 2.810 10.486 632 1HG2 THR 84 HG21 THR 84 -13.162 0.134 9.140 633 2HG2 THR 84 HG22 THR 84 -14.333 1.174 8.329 634 3HG2 THR 84 HG23 THR 84 -14.163 1.237 10.083 635 H LEU 85 HN LEU 85 -9.710 -0.180 7.661 636 HA LEU 85 HA LEU 85 -10.179 -1.994 9.847 637 1HB LEU 85 HB1 LEU 85 -9.053 -2.111 7.202 638 2HB LEU 85 HB2 LEU 85 -7.957 -2.859 8.347 639 HG LEU 85 HG LEU 85 -9.445 -4.515 7.355 640 1HD1 LEU 85 HD21 LEU 85 -8.688 -4.919 9.614 641 2HD1 LEU 85 HD22 LEU 85 -10.345 -5.492 9.428 642 3HD1 LEU 85 HD23 LEU 85 -10.027 -3.972 10.261 643 1HD2 LEU 85 HD11 LEU 85 -11.849 -3.528 8.731 644 2HD2 LEU 85 HD12 LEU 85 -11.677 -4.317 7.162 645 3HD2 LEU 85 HD13 LEU 85 -11.338 -2.594 7.326 646 H ALA 86 HN ALA 86 -8.433 0.720 9.698 647 HA ALA 86 HA ALA 86 -5.894 -0.014 10.719 648 1HB ALA 86 HB1 ALA 86 -6.711 2.227 9.695 649 2HB ALA 86 HB2 ALA 86 -5.494 2.249 10.971 650 3HB ALA 86 HB3 ALA 86 -7.177 2.614 11.351 651 H GLY 87 HN GLY 87 -6.100 1.993 12.989 652 1HA GLY 87 HA2 GLY 87 -6.796 2.051 15.225 653 2HA GLY 87 HA1 GLY 87 -7.725 0.582 14.950 654 H LYS 88 HN LYS 88 -5.131 -0.416 13.600 655 HA LYS 88 HA LYS 88 -3.341 -0.757 15.834 656 1HB LYS 88 HB1 LYS 88 -5.020 -2.458 16.326 657 2HB LYS 88 HB2 LYS 88 -4.870 -3.109 14.703 658 1HG LYS 88 HG2 LYS 88 -3.681 -4.510 16.254 659 2HG LYS 88 HG1 LYS 88 -2.528 -3.702 15.186 660 1HD LYS 88 HD1 LYS 88 -2.838 -1.978 17.358 661 2HD LYS 88 HD2 LYS 88 -2.756 -3.594 18.064 662 1HE LYS 88 HE1 LYS 88 -0.740 -3.879 16.415 663 2HE LYS 88 HE2 LYS 88 -0.717 -2.122 16.448 664 1HZ LYS 88 HZ1 LYS 88 -0.811 -2.538 19.024 665 2HZ LYS 88 HZ2 LYS 88 0.658 -2.586 18.187 666 3HZ LYS 88 HZ3 LYS 88 -0.129 -4.025 18.597 667 H ILE 89 HN ILE 89 -4.127 -1.121 12.470 668 HA ILE 89 HA ILE 89 -2.135 -2.662 11.483 669 HB ILE 89 HB ILE 89 -3.141 -0.124 10.223 670 1HG1 ILE 89 HG11 ILE 89 -4.050 -2.969 9.754 671 2HG1 ILE 89 HG12 ILE 89 -4.836 -1.901 10.911 672 1HG2 ILE 89 HG21 ILE 89 -1.062 -1.860 9.453 673 2HG2 ILE 89 HG22 ILE 89 -1.788 -0.553 8.514 674 3HG2 ILE 89 HG23 ILE 89 -2.425 -2.192 8.383 675 1HD1 ILE 89 HD11 ILE 89 -5.345 -0.338 9.093 676 2HD1 ILE 89 HD12 ILE 89 -6.054 -1.933 8.836 677 3HD1 ILE 89 HD13 ILE 89 -4.606 -1.457 7.948 678 H THR 90 HN THR 90 -1.725 0.776 10.880 679 HA THR 90 HA THR 90 1.033 0.711 10.660 680 HB THR 90 HB THR 90 -1.039 2.683 10.697 681 HG1 THR 90 HG1 THR 90 0.817 2.021 9.158 682 1HG2 THR 90 HG21 THR 90 0.772 4.543 11.276 683 2HG2 THR 90 HG22 THR 90 1.237 3.314 12.454 684 3HG2 THR 90 HG23 THR 90 -0.410 3.946 12.445 685 H GLY 91 HN GLY 91 -0.934 1.362 13.535 686 1HA GLY 91 HA2 GLY 91 1.096 2.143 15.286 687 2HA GLY 91 HA1 GLY 91 -0.372 1.298 15.763 688 H MET 92 HN MET 92 0.199 -1.009 14.068 689 HA MET 92 HA MET 92 1.941 -2.401 15.900 690 1HB MET 92 HB2 MET 92 0.421 -3.962 15.424 691 2HB MET 92 HB1 MET 92 -0.184 -3.052 14.050 692 1HG MET 92 HG1 MET 92 2.325 -4.288 13.451 693 2HG MET 92 HG2 MET 92 1.153 -5.450 14.039 694 1HE MET 92 HE1 MET 92 -0.959 -6.258 11.265 695 2HE MET 92 HE2 MET 92 -1.547 -5.503 12.751 696 3HE MET 92 HE3 MET 92 -0.185 -6.627 12.805 697 H LEU 93 HN LEU 93 2.062 -1.010 12.752 698 HA LEU 93 HA LEU 93 4.170 -2.446 11.607 699 1HB LEU 93 HB2 LEU 93 2.971 0.222 11.248 700 2HB LEU 93 HB1 LEU 93 4.570 -0.005 10.580 701 HG LEU 93 HG LEU 93 2.746 -0.393 8.936 702 1HD1 LEU 93 HD11 LEU 93 4.812 -2.374 9.654 703 2HD1 LEU 93 HD12 LEU 93 4.555 -1.492 8.148 704 3HD1 LEU 93 HD13 LEU 93 3.575 -2.912 8.517 705 1HD2 LEU 93 HD21 LEU 93 0.970 -1.624 9.419 706 2HD2 LEU 93 HD22 LEU 93 1.598 -1.831 11.060 707 3HD2 LEU 93 HD23 LEU 93 1.989 -3.012 9.805 708 H LEU 94 HN LEU 94 4.125 -0.557 14.361 709 HA LEU 94 HA LEU 94 7.004 0.030 14.214 710 1HB LEU 94 HB1 LEU 94 4.703 1.252 15.586 711 2HB LEU 94 HB2 LEU 94 6.128 1.076 16.589 712 HG LEU 94 HG LEU 94 7.423 2.474 15.146 713 1HD1 LEU 94 HD11 LEU 94 6.630 1.660 12.998 714 2HD1 LEU 94 HD12 LEU 94 6.529 3.420 13.068 715 3HD1 LEU 94 HD13 LEU 94 5.072 2.442 13.257 716 1HD2 LEU 94 HD21 LEU 94 6.517 4.220 16.155 717 2HD2 LEU 94 HD22 LEU 94 5.009 3.331 16.376 718 3HD2 LEU 94 HD23 LEU 94 5.265 4.284 14.914 719 H GLU 95 HN GLU 95 5.694 -2.600 14.570 720 HA GLU 95 HA GLU 95 7.279 -3.584 16.719 721 1HB GLU 95 HB2 GLU 95 5.661 -4.137 18.322 722 2HB GLU 95 HB1 GLU 95 5.239 -2.499 17.845 723 1HG GLU 95 HG1 GLU 95 3.399 -3.226 16.574 724 2HG GLU 95 HG2 GLU 95 3.946 -4.902 16.598 725 H ILE 96 HN ILE 96 5.695 -4.013 13.855 726 HA ILE 96 HA ILE 96 4.763 -6.664 14.002 727 HB ILE 96 HB ILE 96 4.917 -6.787 11.617 728 1HG1 ILE 96 HG12 ILE 96 7.215 -5.838 11.469 729 2HG1 ILE 96 HG11 ILE 96 6.101 -5.255 10.240 730 1HG2 ILE 96 HG21 ILE 96 3.841 -4.360 12.866 731 2HG2 ILE 96 HG22 ILE 96 3.055 -5.568 11.847 732 3HG2 ILE 96 HG23 ILE 96 4.041 -4.299 11.111 733 1HD1 ILE 96 HD11 ILE 96 7.719 -3.736 11.858 734 2HD1 ILE 96 HD12 ILE 96 6.111 -3.558 12.564 735 3HD1 ILE 96 HD13 ILE 96 6.378 -3.164 10.863 736 H ASP 97 HN ASP 97 6.292 -7.664 11.694 737 HA ASP 97 HA ASP 97 8.158 -9.333 12.883 738 1HB ASP 97 HB1 ASP 97 7.005 -9.352 10.536 739 2HB ASP 97 HB2 ASP 97 8.404 -8.406 10.033 740 H ASN 98 HN ASN 98 8.327 -6.052 12.377 741 HA ASN 98 HA ASN 98 9.916 -4.529 12.869 742 1HB ASN 98 HB1 ASN 98 11.776 -6.891 13.167 743 2HB ASN 98 HB2 ASN 98 12.211 -5.223 13.523 744 1HD2 ASN 98 HD21 ASN 98 11.116 -4.148 15.244 745 2HD2 ASN 98 HD22 ASN 98 10.442 -5.057 16.548 746 H SER 99 HN SER 99 10.296 -6.893 10.416 747 HA SER 99 HA SER 99 12.315 -5.463 8.939 748 1HB SER 99 HB2 SER 99 12.445 -7.384 7.801 749 2HB SER 99 HB1 SER 99 11.131 -8.029 8.787 750 HG SER 99 HG SER 99 10.871 -7.940 6.382 751 H GLU 100 HN GLU 100 8.844 -5.628 9.109 752 HA GLU 100 HA GLU 100 8.294 -4.123 6.752 753 1HB GLU 100 HB1 GLU 100 6.637 -4.634 9.209 754 2HB GLU 100 HB2 GLU 100 6.048 -3.833 7.771 755 1HG GLU 100 HG2 GLU 100 5.318 -5.957 7.435 756 2HG GLU 100 HG1 GLU 100 6.852 -5.971 6.561 757 H LEU 101 HN LEU 101 8.927 -3.370 10.104 758 HA LEU 101 HA LEU 101 8.186 -0.641 10.021 759 1HB LEU 101 HB1 LEU 101 8.477 -1.914 12.112 760 2HB LEU 101 HB2 LEU 101 10.193 -2.053 11.790 761 HG LEU 101 HG LEU 101 9.301 -0.272 13.482 762 1HD1 LEU 101 HD21 LEU 101 11.646 -0.610 12.711 763 2HD1 LEU 101 HD22 LEU 101 11.241 1.060 13.109 764 3HD1 LEU 101 HD23 LEU 101 11.332 0.553 11.423 765 1HD2 LEU 101 HD11 LEU 101 7.690 0.827 12.105 766 2HD2 LEU 101 HD12 LEU 101 8.887 1.115 10.843 767 3HD2 LEU 101 HD13 LEU 101 9.021 1.948 12.391 768 H LEU 102 HN LEU 102 11.014 -2.399 9.054 769 HA LEU 102 HA LEU 102 12.676 -0.047 8.781 770 1HB LEU 102 HB2 LEU 102 12.988 -2.950 8.562 771 2HB LEU 102 HB1 LEU 102 13.882 -2.060 7.342 772 HG LEU 102 HG LEU 102 14.790 -0.671 9.333 773 1HD1 LEU 102 HD21 LEU 102 13.271 -1.462 11.032 774 2HD1 LEU 102 HD22 LEU 102 14.915 -1.956 11.437 775 3HD1 LEU 102 HD23 LEU 102 13.784 -3.128 10.760 776 1HD2 LEU 102 HD11 LEU 102 16.125 -3.102 9.802 777 2HD2 LEU 102 HD12 LEU 102 16.600 -1.792 8.720 778 3HD2 LEU 102 HD13 LEU 102 15.612 -3.122 8.114 779 H HIS 103 HN HIS 103 11.132 -2.387 6.599 780 HA HIS 103 HA HIS 103 11.971 -1.238 4.203 781 1HB HIS 103 HB1 HIS 103 10.508 -3.442 4.924 782 2HB HIS 103 HB2 HIS 103 9.285 -2.433 4.165 783 HD2 HIS 103 HD2 HIS 103 12.384 -4.552 3.249 784 HE1 HIS 103 HE1 HIS 103 10.718 -2.983 -0.311 785 HE2 HIS 103 HE2 HIS 103 12.424 -4.591 0.656 786 H MET 104 HN MET 104 8.962 -0.748 6.033 787 HA MET 104 HA MET 104 7.637 0.941 4.331 788 1HB MET 104 HB2 MET 104 6.441 1.764 6.313 789 2HB MET 104 HB1 MET 104 6.653 0.019 6.389 790 1HG MET 104 HG1 MET 104 7.991 0.132 8.191 791 2HG MET 104 HG2 MET 104 8.758 1.623 7.655 792 1HE MET 104 HE1 MET 104 5.271 0.245 8.718 793 2HE MET 104 HE2 MET 104 4.876 1.582 7.637 794 3HE MET 104 HE3 MET 104 4.488 1.693 9.355 795 H LEU 105 HN LEU 105 10.256 1.765 6.546 796 HA LEU 105 HA LEU 105 9.929 4.605 6.064 797 1HB LEU 105 HB1 LEU 105 12.279 3.298 7.408 798 2HB LEU 105 HB2 LEU 105 11.685 4.934 7.613 799 HG LEU 105 HG LEU 105 10.251 2.446 8.540 800 1HD1 LEU 105 HD11 LEU 105 11.439 2.523 10.409 801 2HD1 LEU 105 HD12 LEU 105 11.076 4.236 10.619 802 3HD1 LEU 105 HD13 LEU 105 12.470 3.741 9.660 803 1HD2 LEU 105 HD21 LEU 105 9.539 5.300 8.401 804 2HD2 LEU 105 HD22 LEU 105 9.165 4.477 9.916 805 3HD2 LEU 105 HD23 LEU 105 8.512 3.866 8.397 806 H GLU 106 HN GLU 106 11.352 2.032 4.481 807 HA GLU 106 HA GLU 106 13.403 3.742 3.290 808 1HB GLU 106 HB1 GLU 106 14.726 1.902 3.035 809 2HB GLU 106 HB2 GLU 106 13.735 1.329 4.371 810 1HG GLU 106 HG1 GLU 106 13.277 -0.450 3.140 811 2HG GLU 106 HG2 GLU 106 12.310 0.601 2.107 812 H SER 107 HN SER 107 10.318 2.625 2.517 813 HA SER 107 HA SER 107 10.827 3.245 -0.305 814 1HB SER 107 HB2 SER 107 10.736 0.662 0.363 815 2HB SER 107 HB1 SER 107 9.005 0.954 0.217 816 HG SER 107 HG SER 107 10.921 1.589 -1.781 817 HA PRO 108 HA PRO 108 7.057 5.538 0.171 818 1HB PRO 108 HB2 PRO 108 6.521 6.024 -2.434 819 2HB PRO 108 HB1 PRO 108 7.828 6.838 -1.568 820 1HG PRO 108 HG1 PRO 108 7.954 4.490 -3.424 821 2HG PRO 108 HG2 PRO 108 9.022 5.903 -3.335 822 1HD PRO 108 HD1 PRO 108 9.666 3.498 -2.249 823 2HD PRO 108 HD2 PRO 108 10.225 5.042 -1.573 824 H GLU 109 HN GLU 109 7.280 2.439 -0.846 825 HA GLU 109 HA GLU 109 4.361 2.190 -1.170 826 1HB GLU 109 HB2 GLU 109 6.526 0.677 -2.652 827 2HB GLU 109 HB1 GLU 109 4.818 0.254 -2.694 828 1HG GLU 109 HG1 GLU 109 4.257 2.084 -3.966 829 2HG GLU 109 HG2 GLU 109 5.662 3.011 -3.440 830 H SER 110 HN SER 110 7.242 1.184 0.374 831 HA SER 110 HA SER 110 6.437 -1.373 1.298 832 1HB SER 110 HB2 SER 110 8.099 -0.787 3.198 833 2HB SER 110 HB1 SER 110 8.739 -0.879 1.551 834 HG SER 110 HG SER 110 9.454 1.043 2.125 835 H LEU 111 HN LEU 111 6.327 1.850 2.707 836 HA LEU 111 HA LEU 111 5.140 1.380 5.126 837 1HB LEU 111 HB1 LEU 111 5.965 3.527 4.008 838 2HB LEU 111 HB2 LEU 111 4.372 3.637 3.277 839 HG LEU 111 HG LEU 111 4.311 5.094 5.105 840 1HD1 LEU 111 HD21 LEU 111 3.155 2.823 6.589 841 2HD1 LEU 111 HD22 LEU 111 2.524 3.129 4.970 842 3HD1 LEU 111 HD23 LEU 111 2.469 4.398 6.193 843 1HD2 LEU 111 HD11 LEU 111 5.147 4.673 7.276 844 2HD2 LEU 111 HD12 LEU 111 6.403 4.193 6.129 845 3HD2 LEU 111 HD13 LEU 111 5.402 2.966 6.916 846 H ARG 112 HN ARG 112 3.765 1.170 1.938 847 HA ARG 112 HA ARG 112 1.067 0.827 2.989 848 1HB ARG 112 HB1 ARG 112 2.209 1.045 0.206 849 2HB ARG 112 HB2 ARG 112 0.517 0.644 0.515 850 1HG ARG 112 HG2 ARG 112 0.045 2.709 1.381 851 2HG ARG 112 HG1 ARG 112 1.730 3.008 1.823 852 1HD ARG 112 HD2 ARG 112 0.938 4.395 -0.088 853 2HD ARG 112 HD1 ARG 112 2.329 3.381 -0.472 854 HE ARG 112 HE ARG 112 -0.129 2.100 -1.131 855 1HH1 ARG 112 HH12 ARG 112 2.151 4.499 -2.223 856 2HH1 ARG 112 HH11 ARG 112 1.747 4.307 -3.896 857 1HH2 ARG 112 HH21 ARG 112 -0.667 1.842 -3.332 858 2HH2 ARG 112 HH22 ARG 112 0.145 2.798 -4.526 859 H SER 113 HN SER 113 3.021 -0.951 0.601 860 HA SER 113 HA SER 113 1.620 -3.300 0.531 861 1HB SER 113 HB1 SER 113 4.552 -2.701 0.237 862 2HB SER 113 HB2 SER 113 3.975 -4.365 0.158 863 HG SER 113 HG SER 113 3.116 -3.981 -1.732 864 H LYS 114 HN LYS 114 3.688 -2.087 3.034 865 HA LYS 114 HA LYS 114 3.813 -4.603 4.465 866 1HB LYS 114 HB1 LYS 114 4.682 -1.830 5.294 867 2HB LYS 114 HB2 LYS 114 4.940 -3.291 6.237 868 1HG LYS 114 HG1 LYS 114 6.088 -2.688 3.520 869 2HG LYS 114 HG2 LYS 114 6.957 -2.684 5.055 870 1HD LYS 114 HD2 LYS 114 6.673 -5.045 5.305 871 2HD LYS 114 HD1 LYS 114 5.573 -5.111 3.927 872 1HE LYS 114 HE2 LYS 114 7.505 -4.244 2.529 873 2HE LYS 114 HE1 LYS 114 8.533 -4.581 3.922 874 1HZ LYS 114 HZ1 LYS 114 8.717 -6.532 2.792 875 2HZ LYS 114 HZ2 LYS 114 7.164 -6.445 2.128 876 3HZ LYS 114 HZ3 LYS 114 7.368 -6.906 3.742 877 H VAL 115 HN VAL 115 2.108 -1.486 4.721 878 HA VAL 115 HA VAL 115 0.767 -2.133 7.148 879 HB VAL 115 HB VAL 115 0.451 -0.029 5.066 880 1HG1 VAL 115 HG11 VAL 115 -1.585 0.451 6.946 881 2HG1 VAL 115 HG12 VAL 115 -1.821 -1.199 6.375 882 3HG1 VAL 115 HG13 VAL 115 -1.765 0.135 5.218 883 1HG2 VAL 115 HG21 VAL 115 1.593 -0.226 7.589 884 2HG2 VAL 115 HG22 VAL 115 0.130 0.727 7.838 885 3HG2 VAL 115 HG23 VAL 115 1.333 1.249 6.658 886 H ASP 116 HN ASP 116 -0.485 -1.990 3.803 887 HA ASP 116 HA ASP 116 -2.934 -3.153 4.164 888 1HB ASP 116 HB1 ASP 116 -2.246 -2.248 2.020 889 2HB ASP 116 HB2 ASP 116 -1.013 -3.491 1.847 890 H GLU 117 HN GLU 117 0.187 -4.786 3.895 891 HA GLU 117 HA GLU 117 -0.977 -7.424 3.895 892 1HB GLU 117 HB1 GLU 117 1.765 -6.285 3.855 893 2HB GLU 117 HB2 GLU 117 1.594 -7.892 4.547 894 1HG GLU 117 HG2 GLU 117 0.140 -8.090 2.238 895 2HG GLU 117 HG1 GLU 117 1.459 -7.018 1.771 896 H ALA 118 HN ALA 118 0.318 -5.180 6.237 897 HA ALA 118 HA ALA 118 0.466 -7.011 8.406 898 1HB ALA 118 HB1 ALA 118 -0.050 -4.135 8.923 899 2HB ALA 118 HB2 ALA 118 1.456 -4.580 8.118 900 3HB ALA 118 HB3 ALA 118 1.075 -5.246 9.706 901 H VAL 119 HN VAL 119 -2.079 -5.221 6.887 902 HA VAL 119 HA VAL 119 -3.988 -5.257 8.961 903 HB VAL 119 HB VAL 119 -4.607 -5.499 6.034 904 1HG1 VAL 119 HG11 VAL 119 -6.468 -5.876 7.560 905 2HG1 VAL 119 HG12 VAL 119 -6.671 -4.355 6.689 906 3HG1 VAL 119 HG13 VAL 119 -6.129 -4.343 8.366 907 1HG2 VAL 119 HG21 VAL 119 -4.791 -2.821 6.995 908 2HG2 VAL 119 HG22 VAL 119 -3.820 -3.460 5.669 909 3HG2 VAL 119 HG23 VAL 119 -3.169 -3.439 7.308 910 H ALA 120 HN ALA 120 -3.377 -7.442 6.250 911 HA ALA 120 HA ALA 120 -5.284 -9.388 6.837 912 1HB ALA 120 HB1 ALA 120 -3.138 -9.064 5.040 913 2HB ALA 120 HB2 ALA 120 -4.387 -10.312 5.015 914 3HB ALA 120 HB3 ALA 120 -2.869 -10.601 5.867 915 H VAL 121 HN VAL 121 -2.260 -8.606 8.296 916 HA VAL 121 HA VAL 121 -2.044 -11.046 9.824 917 HB VAL 121 HB VAL 121 -0.441 -8.512 9.639 918 1HG1 VAL 121 HG21 VAL 121 0.374 -8.729 11.679 919 2HG1 VAL 121 HG22 VAL 121 0.928 -10.357 11.282 920 3HG1 VAL 121 HG23 VAL 121 -0.677 -10.116 11.972 921 1HG2 VAL 121 HG11 VAL 121 -0.347 -10.655 8.093 922 2HG2 VAL 121 HG12 VAL 121 0.691 -11.246 9.392 923 3HG2 VAL 121 HG13 VAL 121 1.110 -9.762 8.535 924 H LEU 122 HN LEU 122 -3.198 -7.777 10.252 925 HA LEU 122 HA LEU 122 -3.389 -7.890 13.104 926 1HB LEU 122 HB2 LEU 122 -3.596 -5.693 12.790 927 2HB LEU 122 HB1 LEU 122 -3.741 -5.941 11.063 928 HG LEU 122 HG LEU 122 -6.281 -6.528 12.044 929 1HD1 LEU 122 HD11 LEU 122 -4.904 -4.602 13.777 930 2HD1 LEU 122 HD12 LEU 122 -6.342 -5.578 14.077 931 3HD1 LEU 122 HD13 LEU 122 -6.473 -4.073 13.168 932 1HD2 LEU 122 HD21 LEU 122 -6.313 -5.408 10.077 933 2HD2 LEU 122 HD22 LEU 122 -4.979 -4.347 10.531 934 3HD2 LEU 122 HD23 LEU 122 -6.601 -4.039 11.152 935 H GLN 123 HN GLN 123 -5.582 -8.404 10.399 936 HA GLN 123 HA GLN 123 -7.944 -8.767 11.877 937 1HB GLN 123 HB1 GLN 123 -7.071 -9.766 9.166 938 2HB GLN 123 HB2 GLN 123 -8.677 -10.072 9.815 939 1HG GLN 123 HG2 GLN 123 -8.049 -7.285 10.028 940 2HG GLN 123 HG1 GLN 123 -7.788 -7.836 8.375 941 1HE2 GLN 123 HE22 GLN 123 -10.129 -7.596 10.973 942 2HE2 GLN 123 HE21 GLN 123 -11.534 -7.702 9.974 943 H ALA 124 HN ALA 124 -5.354 -10.938 10.922 944 HA ALA 124 HA ALA 124 -6.545 -13.348 11.848 945 1HB ALA 124 HB1 ALA 124 -3.962 -13.930 12.050 946 2HB ALA 124 HB2 ALA 124 -3.821 -12.476 11.062 947 3HB ALA 124 HB3 ALA 124 -4.784 -13.841 10.492 948 H HIS 125 HN HIS 125 -3.629 -11.970 13.267 949 HA HIS 125 HA HIS 125 -3.524 -13.050 15.661 950 1HB HIS 125 HB1 HIS 125 -2.396 -10.804 14.578 951 2HB HIS 125 HB2 HIS 125 -3.289 -10.125 15.934 952 HD2 HIS 125 HD2 HIS 125 -0.079 -10.069 16.089 953 HE1 HIS 125 HE1 HIS 125 -0.550 -13.310 18.771 954 HE2 HIS 125 HE2 HIS 125 1.027 -11.503 17.948 955 H GLN 126 HN GLN 126 -5.871 -10.546 14.857 956 HA GLN 126 HA GLN 126 -6.874 -10.132 17.450 957 1HB GLN 126 HB1 GLN 126 -7.960 -9.699 14.690 958 2HB GLN 126 HB2 GLN 126 -9.008 -9.479 16.084 959 1HG GLN 126 HG1 GLN 126 -7.013 -7.985 16.928 960 2HG GLN 126 HG2 GLN 126 -6.657 -7.887 15.203 961 1HE2 GLN 126 HE21 GLN 126 -7.236 -5.607 16.449 962 2HE2 GLN 126 HE22 GLN 126 -8.814 -5.044 16.026 963 H ALA 127 HN ALA 127 -8.933 -11.588 14.965 964 HA ALA 127 HA ALA 127 -10.022 -13.365 17.008 965 1HB ALA 127 HB1 ALA 127 -11.995 -13.151 15.985 966 2HB ALA 127 HB2 ALA 127 -11.302 -13.390 14.381 967 3HB ALA 127 HB3 ALA 127 -11.237 -11.800 15.142 968 H LYS 128 HN LYS 128 -7.427 -14.054 15.768 969 HA LYS 128 HA LYS 128 -8.143 -16.396 14.155 970 1HB LYS 128 HB2 LYS 128 -5.825 -16.602 13.594 971 2HB LYS 128 HB1 LYS 128 -6.260 -14.906 13.413 972 1HG LYS 128 HG1 LYS 128 -5.142 -14.338 15.435 973 2HG LYS 128 HG2 LYS 128 -4.926 -16.036 15.861 974 1HD LYS 128 HD2 LYS 128 -3.805 -15.626 13.284 975 2HD LYS 128 HD1 LYS 128 -3.204 -14.354 14.351 976 1HE LYS 128 HE2 LYS 128 -1.709 -16.239 14.442 977 2HE LYS 128 HE1 LYS 128 -2.546 -16.085 15.986 978 1HZ LYS 128 HZ1 LYS 128 -4.178 -17.756 14.758 979 2HZ LYS 128 HZ2 LYS 128 -2.843 -18.285 15.651 980 3HZ LYS 128 HZ3 LYS 128 -2.743 -18.176 13.966 981 H GLU 129 HN GLU 129 -5.865 -17.919 14.807 982 HA GLU 129 HA GLU 129 -6.754 -19.106 17.326 983 1HB GLU 129 HB2 GLU 129 -4.876 -20.039 15.153 984 2HB GLU 129 HB1 GLU 129 -5.044 -20.887 16.682 985 1HG GLU 129 HG1 GLU 129 -7.223 -21.542 16.228 986 2HG GLU 129 HG2 GLU 129 -7.437 -20.306 14.989 987 H ALA 130 HN ALA 130 -5.422 -16.547 17.249 988 HA ALA 130 HA ALA 130 -2.694 -16.783 17.895 989 1HB ALA 130 HB1 ALA 130 -4.128 -14.724 17.152 990 2HB ALA 130 HB2 ALA 130 -2.703 -14.507 18.167 991 3HB ALA 130 HB3 ALA 130 -4.310 -14.488 18.890 992 H ALA 131 HN ALA 131 -5.128 -18.050 19.589 993 HA ALA 131 HA ALA 131 -4.610 -17.132 22.239 994 1HB ALA 131 HB1 ALA 131 -6.210 -18.653 22.940 995 2HB ALA 131 HB2 ALA 131 -5.857 -19.782 21.631 996 3HB ALA 131 HB3 ALA 131 -6.719 -18.281 21.293 997 H GLN 132 HN GLN 132 -2.678 -18.856 20.234 998 HA GLN 132 HA GLN 132 -1.762 -20.958 21.899 999 1HB GLN 132 HB2 GLN 132 -1.147 -19.885 19.308 1000 2HB GLN 132 HB1 GLN 132 0.347 -20.135 20.200 1001 1HG GLN 132 HG2 GLN 132 -0.512 -22.041 18.748 1002 2HG GLN 132 HG1 GLN 132 -0.003 -22.425 20.392 1003 1HE2 GLN 132 HE21 GLN 132 -2.683 -22.133 18.210 1004 2HE2 GLN 132 HE22 GLN 132 -3.851 -22.922 19.210 1005 H LYS 133 HN LYS 133 -1.213 -17.573 21.906 1006 HA LYS 133 HA LYS 133 1.319 -17.700 23.286 1007 1HB LYS 133 HB1 LYS 133 0.101 -15.782 21.766 1008 2HB LYS 133 HB2 LYS 133 -0.191 -15.175 23.391 1009 1HG LYS 133 HG1 LYS 133 1.805 -14.178 22.969 1010 2HG LYS 133 HG2 LYS 133 2.385 -15.694 23.665 1011 1HD LYS 133 HD1 LYS 133 2.499 -16.594 21.311 1012 2HD LYS 133 HD2 LYS 133 2.206 -14.946 20.754 1013 1HE LYS 133 HE2 LYS 133 4.270 -14.221 21.366 1014 2HE LYS 133 HE1 LYS 133 4.373 -15.330 22.733 1015 1HZ LYS 133 HZ1 LYS 133 4.641 -16.131 19.886 1016 2HZ LYS 133 HZ2 LYS 133 4.846 -17.131 21.235 1017 3HZ LYS 133 HZ3 LYS 133 5.938 -15.873 20.942 1018 H ALA 134 HN ALA 134 -1.577 -18.586 24.286 1019 HA ALA 134 HA ALA 134 -1.565 -17.207 26.860 1020 1HB ALA 134 HB1 ALA 134 -3.622 -17.989 25.270 1021 2HB ALA 134 HB2 ALA 134 -3.759 -17.659 26.998 1022 3HB ALA 134 HB3 ALA 134 -3.555 -19.316 26.430 1023 H VAL 135 HN VAL 135 -1.161 -20.436 25.494 1024 HA VAL 135 HA VAL 135 -0.743 -21.637 28.094 1025 HB VAL 135 HB VAL 135 -0.189 -23.693 26.745 1026 1HG1 VAL 135 HG11 VAL 135 -2.843 -22.731 25.819 1027 2HG1 VAL 135 HG12 VAL 135 -2.540 -22.791 27.556 1028 3HG1 VAL 135 HG13 VAL 135 -2.394 -24.256 26.585 1029 1HG2 VAL 135 HG21 VAL 135 -1.347 -22.340 24.359 1030 2HG2 VAL 135 HG22 VAL 135 -0.282 -23.742 24.457 1031 3HG2 VAL 135 HG23 VAL 135 0.368 -22.122 24.707 1032 H ASN 136 HN ASN 136 1.127 -19.811 26.064 1033 HA ASN 136 HA ASN 136 3.615 -21.246 26.451 1034 1HB ASN 136 HB1 ASN 136 2.672 -19.058 24.777 1035 2HB ASN 136 HB2 ASN 136 4.241 -18.708 25.497 1036 1HD2 ASN 136 HD21 ASN 136 4.840 -18.771 23.183 1037 2HD2 ASN 136 HD22 ASN 136 5.293 -20.296 22.510 1038 H SER 137 HN SER 137 4.902 -21.015 28.148 1039 HA SER 137 HA SER 137 4.319 -18.972 30.124 1040 1HB SER 137 HB1 SER 137 6.060 -20.179 31.470 1041 2HB SER 137 HB2 SER 137 4.718 -21.203 30.959 1042 HG SER 137 HG SER 137 7.382 -21.286 30.247 1043 H ALA 138 HN ALA 138 5.223 -17.036 29.999 1044 HA ALA 138 HA ALA 138 7.607 -16.587 28.436 1045 1HB ALA 138 HB1 ALA 138 7.231 -14.251 28.832 1046 2HB ALA 138 HB2 ALA 138 6.076 -14.609 30.116 1047 3HB ALA 138 HB3 ALA 138 5.687 -15.009 28.443 1048 H THR 139 HN THR 139 8.984 -17.966 29.787 1049 HA THR 139 HA THR 139 9.730 -16.807 32.369 1050 HB THR 139 HB THR 139 9.313 -19.241 32.253 1051 HG1 THR 139 HG1 THR 139 12.025 -19.226 32.689 1052 1HG2 THR 139 HG21 THR 139 11.679 -19.284 30.402 1053 2HG2 THR 139 HG22 THR 139 10.031 -19.800 30.043 1054 3HG2 THR 139 HG23 THR 139 11.004 -20.700 31.208 1055 H GLY 140 HN GLY 140 10.405 -15.742 29.605 1056 1HA GLY 140 HA1 GLY 140 13.253 -16.073 29.355 1057 2HA GLY 140 HA2 GLY 140 12.245 -14.969 28.433 1058 H VAL 141 HN VAL 141 14.606 -15.210 30.782 1059 HA VAL 141 HA VAL 141 13.939 -12.658 32.047 1060 HB VAL 141 HB VAL 141 16.371 -14.301 32.685 1061 1HG1 VAL 141 HG11 VAL 141 15.423 -11.870 33.599 1062 2HG1 VAL 141 HG12 VAL 141 16.637 -12.881 34.382 1063 3HG1 VAL 141 HG13 VAL 141 14.943 -13.011 34.855 1064 1HG2 VAL 141 HG21 VAL 141 14.397 -15.788 32.748 1065 2HG2 VAL 141 HG22 VAL 141 13.637 -14.687 33.896 1066 3HG2 VAL 141 HG23 VAL 141 15.118 -15.536 34.338 1067 HA PRO 142 HA PRO 142 16.480 -10.385 29.180 1068 1HB PRO 142 HB1 PRO 142 16.767 -8.534 31.489 1069 2HB PRO 142 HB2 PRO 142 16.240 -8.200 29.836 1070 1HG PRO 142 HG1 PRO 142 14.481 -8.279 31.835 1071 2HG PRO 142 HG2 PRO 142 14.076 -8.935 30.239 1072 1HD PRO 142 HD1 PRO 142 14.826 -10.375 32.748 1073 2HD PRO 142 HD2 PRO 142 13.636 -10.816 31.506 1074 H THR 143 HN THR 143 18.490 -11.036 28.764 1075 HA THR 143 HA THR 143 20.360 -11.559 30.923 1076 HB THR 143 HB THR 143 21.847 -12.199 28.882 1077 HG1 THR 143 HG1 THR 143 20.547 -12.756 27.061 1078 1HG2 THR 143 HG21 THR 143 19.748 -13.639 30.214 1079 2HG2 THR 143 HG22 THR 143 21.324 -14.199 29.651 1080 3HG2 THR 143 HG23 THR 143 19.947 -14.192 28.550 1081 H VAL 144 HN VAL 144 19.843 -8.937 30.974 1082 HA VAL 144 HA VAL 144 20.776 -6.863 30.955 1083 HB VAL 144 HB VAL 144 23.409 -8.179 30.323 1084 1HG1 VAL 144 HG11 VAL 144 22.880 -5.581 30.570 1085 2HG1 VAL 144 HG12 VAL 144 24.393 -6.295 31.129 1086 3HG1 VAL 144 HG13 VAL 144 23.093 -5.972 32.276 1087 1HG2 VAL 144 HG21 VAL 144 22.958 -7.833 33.141 1088 2HG2 VAL 144 HG22 VAL 144 23.429 -9.281 32.253 1089 3HG2 VAL 144 HG23 VAL 144 21.723 -8.880 32.445 Start of MODEL 30 1 1H GLY 1 HT1 GLY 1 31.391 35.450 28.505 2 2H GLY 1 HT2 GLY 1 32.216 35.969 27.123 3 3H GLY 1 HT3 GLY 1 32.991 34.968 28.244 4 1HA GLY 1 HA1 GLY 1 32.444 33.496 26.565 5 2HA GLY 1 HA2 GLY 1 31.162 33.284 27.747 6 HA PRO 2 HA PRO 2 29.560 35.516 23.718 7 1HB PRO 2 HB2 PRO 2 30.367 34.178 21.505 8 2HB PRO 2 HB1 PRO 2 31.257 35.553 22.168 9 1HG PRO 2 HG2 PRO 2 31.779 32.621 22.493 10 2HG PRO 2 HG1 PRO 2 32.930 33.934 22.175 11 1HD PRO 2 HD2 PRO 2 32.561 32.882 24.644 12 2HD PRO 2 HD1 PRO 2 32.993 34.584 24.385 13 H LEU 3 HN LEU 3 27.912 34.688 22.181 14 HA LEU 3 HA LEU 3 26.565 32.407 23.325 15 1HB LEU 3 HB2 LEU 3 25.686 34.726 22.225 16 2HB LEU 3 HB1 LEU 3 25.492 33.636 20.865 17 HG LEU 3 HG LEU 3 24.300 32.144 22.732 18 1HD1 LEU 3 HD11 LEU 3 23.035 34.527 23.707 19 2HD1 LEU 3 HD12 LEU 3 24.755 34.546 24.101 20 3HD1 LEU 3 HD13 LEU 3 23.749 33.189 24.609 21 1HD2 LEU 3 HD21 LEU 3 23.214 32.711 20.704 22 2HD2 LEU 3 HD22 LEU 3 23.132 34.416 21.145 23 3HD2 LEU 3 HD23 LEU 3 22.150 33.235 22.010 24 H GLY 4 HN GLY 4 26.239 30.432 22.412 25 1HA GLY 4 HA2 GLY 4 27.816 29.863 19.991 26 2HA GLY 4 HA1 GLY 4 27.373 28.684 21.215 27 H SER 5 HN SER 5 24.746 30.630 20.637 28 HA SER 5 HA SER 5 23.435 28.533 19.125 29 1HB SER 5 HB2 SER 5 22.604 30.759 20.845 30 2HB SER 5 HB1 SER 5 21.575 30.545 19.429 31 HG SER 5 HG SER 5 20.765 29.227 21.001 32 H ALA 6 HN ALA 6 23.407 32.083 18.791 33 HA ALA 6 HA ALA 6 23.331 33.444 16.969 34 1HB ALA 6 HB1 ALA 6 24.846 33.004 15.197 35 2HB ALA 6 HB2 ALA 6 24.820 31.269 15.517 36 3HB ALA 6 HB3 ALA 6 25.582 32.367 16.668 37 H ALA 7 HN ALA 7 23.102 32.990 14.256 38 HA ALA 7 HA ALA 7 20.390 31.899 14.121 39 1HB ALA 7 HB1 ALA 7 20.285 33.078 11.935 40 2HB ALA 7 HB2 ALA 7 21.919 33.675 12.227 41 3HB ALA 7 HB3 ALA 7 20.602 34.143 13.305 42 H ALA 8 HN ALA 8 22.826 32.088 11.557 43 HA ALA 8 HA ALA 8 23.001 29.196 11.377 44 1HB ALA 8 HB1 ALA 8 22.203 29.031 9.120 45 2HB ALA 8 HB2 ALA 8 21.955 30.775 9.032 46 3HB ALA 8 HB3 ALA 8 20.954 29.795 10.104 47 H ALA 9 HN ALA 9 25.084 28.783 11.103 48 HA ALA 9 HA ALA 9 26.622 30.351 9.172 49 1HB ALA 9 HB1 ALA 9 27.765 29.772 11.888 50 2HB ALA 9 HB2 ALA 9 26.926 31.277 11.515 51 3HB ALA 9 HB3 ALA 9 28.393 30.846 10.639 52 H THR 10 HN THR 10 25.499 27.615 9.302 53 HA THR 10 HA THR 10 27.743 25.850 9.641 54 HB THR 10 HB THR 10 25.482 24.772 8.134 55 HG1 THR 10 HG1 THR 10 24.361 24.938 10.409 56 1HG2 THR 10 HG21 THR 10 25.435 23.390 10.375 57 2HG2 THR 10 HG22 THR 10 27.059 24.057 10.534 58 3HG2 THR 10 HG23 THR 10 26.637 23.092 9.120 59 HA PRO 11 HA PRO 11 25.323 27.685 7.648 60 1HB PRO 11 HB1 PRO 11 24.357 28.386 5.272 61 2HB PRO 11 HB2 PRO 11 25.830 29.135 5.901 62 1HG PRO 11 HG2 PRO 11 25.510 27.028 3.816 63 2HG PRO 11 HG1 PRO 11 26.687 28.349 3.906 64 1HD PRO 11 HD2 PRO 11 27.117 25.669 4.660 65 2HD PRO 11 HD1 PRO 11 28.169 27.049 5.028 66 H ALA 12 HN ALA 12 25.610 24.761 5.984 67 HA ALA 12 HA ALA 12 22.884 24.276 5.330 68 1HB ALA 12 HB1 ALA 12 23.988 22.720 4.176 69 2HB ALA 12 HB2 ALA 12 24.020 21.790 5.674 70 3HB ALA 12 HB3 ALA 12 25.392 22.809 5.239 71 H VAL 13 HN VAL 13 21.546 24.657 7.060 72 HA VAL 13 HA VAL 13 22.052 23.294 9.588 73 HB VAL 13 HB VAL 13 19.654 25.004 8.979 74 1HG1 VAL 13 HG11 VAL 13 19.376 25.161 11.259 75 2HG1 VAL 13 HG12 VAL 13 21.076 24.839 11.598 76 3HG1 VAL 13 HG13 VAL 13 20.010 23.524 11.103 77 1HG2 VAL 13 HG21 VAL 13 21.453 26.617 10.332 78 2HG2 VAL 13 HG22 VAL 13 21.003 26.743 8.632 79 3HG2 VAL 13 HG23 VAL 13 22.433 25.822 9.099 80 H ARG 14 HN ARG 14 21.661 21.138 9.142 81 HA ARG 14 HA ARG 14 19.050 20.400 8.052 82 1HB ARG 14 HB2 ARG 14 21.174 19.343 7.200 83 2HB ARG 14 HB1 ARG 14 21.349 18.577 8.773 84 1HG ARG 14 HG2 ARG 14 19.318 17.340 8.463 85 2HG ARG 14 HG1 ARG 14 18.971 18.208 6.966 86 1HD ARG 14 HD2 ARG 14 21.200 16.256 7.494 87 2HD ARG 14 HD1 ARG 14 19.855 16.080 6.367 88 HE ARG 14 HE ARG 14 22.262 17.672 5.988 89 1HH1 ARG 14 HH11 ARG 14 19.089 16.786 4.849 90 2HH1 ARG 14 HH12 ARG 14 19.370 17.354 3.236 91 1HH2 ARG 14 HH21 ARG 14 22.638 18.422 3.868 92 2HH2 ARG 14 HH22 ARG 14 21.386 18.283 2.679 93 H THR 15 HN THR 15 21.122 19.330 10.755 94 HA THR 15 HA THR 15 18.692 18.619 12.241 95 HB THR 15 HB THR 15 20.448 17.463 13.760 96 HG1 THR 15 HG1 THR 15 22.418 17.710 13.133 97 1HG2 THR 15 HG21 THR 15 19.061 16.034 12.537 98 2HG2 THR 15 HG22 THR 15 20.706 15.535 12.143 99 3HG2 THR 15 HG23 THR 15 19.783 16.512 11.000 100 H VAL 16 HN VAL 16 18.100 20.614 13.060 101 HA VAL 16 HA VAL 16 20.055 22.014 14.743 102 HB VAL 16 HB VAL 16 19.013 23.463 13.137 103 1HG1 VAL 16 HG11 VAL 16 16.720 23.691 12.775 104 2HG1 VAL 16 HG12 VAL 16 16.306 22.894 14.292 105 3HG1 VAL 16 HG13 VAL 16 16.950 21.951 12.948 106 1HG2 VAL 16 HG21 VAL 16 17.506 24.207 15.590 107 2HG2 VAL 16 HG22 VAL 16 18.517 25.199 14.539 108 3HG2 VAL 16 HG23 VAL 16 19.262 24.086 15.688 109 HA PRO 17 HA PRO 17 18.122 20.195 18.330 110 1HB PRO 17 HB2 PRO 17 19.428 22.426 19.765 111 2HB PRO 17 HB1 PRO 17 19.598 20.683 20.000 112 1HG PRO 17 HG1 PRO 17 21.550 22.126 18.877 113 2HG PRO 17 HG2 PRO 17 21.186 20.479 18.327 114 1HD PRO 17 HD2 PRO 17 20.449 23.101 17.082 115 2HD PRO 17 HD1 PRO 17 20.998 21.600 16.308 116 H GLN 18 HN GLN 18 17.927 23.581 17.473 117 HA GLN 18 HA GLN 18 15.819 24.145 19.368 118 1HB GLN 18 HB2 GLN 18 16.739 25.856 17.054 119 2HB GLN 18 HB1 GLN 18 15.835 26.376 18.470 120 1HG GLN 18 HG2 GLN 18 18.693 25.442 18.379 121 2HG GLN 18 HG1 GLN 18 18.109 27.075 18.697 122 1HE2 GLN 18 HE21 GLN 18 18.986 24.108 20.040 123 2HE2 GLN 18 HE22 GLN 18 18.493 24.416 21.667 124 H TYR 19 HN TYR 19 13.738 25.075 18.618 125 HA TYR 19 HA TYR 19 12.511 23.285 16.734 126 1HB TYR 19 HB1 TYR 19 11.172 25.676 17.984 127 2HB TYR 19 HB2 TYR 19 10.445 24.157 17.469 128 HD1 TYR 19 HD1 TYR 19 11.591 26.000 20.235 129 HD2 TYR 19 HD2 TYR 19 11.309 22.022 18.752 130 HE1 TYR 19 HE1 TYR 19 11.786 25.138 22.529 131 HE2 TYR 19 HE2 TYR 19 11.504 21.148 21.043 132 HH TYR 19 HH TYR 19 12.586 22.917 23.599 133 H LYS 20 HN LYS 20 10.853 24.309 15.158 134 HA LYS 20 HA LYS 20 12.321 26.276 13.549 135 1HB LYS 20 HB2 LYS 20 11.343 23.869 12.796 136 2HB LYS 20 HB1 LYS 20 9.969 24.893 12.399 137 1HG LYS 20 HG1 LYS 20 11.201 24.821 10.433 138 2HG LYS 20 HG2 LYS 20 11.664 26.360 11.161 139 1HD LYS 20 HD2 LYS 20 13.441 24.461 12.202 140 2HD LYS 20 HD1 LYS 20 13.303 24.095 10.480 141 1HE LYS 20 HE2 LYS 20 14.008 26.762 11.700 142 2HE LYS 20 HE1 LYS 20 15.109 25.667 10.864 143 1HZ LYS 20 HZ1 LYS 20 13.524 27.674 9.760 144 2HZ LYS 20 HZ2 LYS 20 12.912 26.200 9.197 145 3HZ LYS 20 HZ3 LYS 20 14.540 26.590 8.951 146 H TYR 21 HN TYR 21 11.385 27.786 15.296 147 HA TYR 21 HA TYR 21 8.611 28.451 15.119 148 1HB TYR 21 HB1 TYR 21 10.012 28.851 17.146 149 2HB TYR 21 HB2 TYR 21 10.876 30.102 16.259 150 HD1 TYR 21 HD1 TYR 21 7.446 29.153 17.365 151 HD2 TYR 21 HD2 TYR 21 10.113 32.297 16.317 152 HE1 TYR 21 HE1 TYR 21 5.763 30.806 18.063 153 HE2 TYR 21 HE2 TYR 21 8.439 33.959 17.012 154 HH TYR 21 HH TYR 21 6.380 34.293 17.773 155 H ALA 22 HN ALA 22 11.371 29.215 13.272 156 HA ALA 22 HA ALA 22 10.377 31.732 12.262 157 1HB ALA 22 HB1 ALA 22 12.715 30.020 11.438 158 2HB ALA 22 HB2 ALA 22 12.753 31.473 12.437 159 3HB ALA 22 HB3 ALA 22 12.330 31.587 10.729 160 H ALA 23 HN ALA 23 10.875 28.463 10.940 161 HA ALA 23 HA ALA 23 9.394 29.151 8.537 162 1HB ALA 23 HB1 ALA 23 10.807 27.670 7.679 163 2HB ALA 23 HB2 ALA 23 9.907 26.407 8.519 164 3HB ALA 23 HB3 ALA 23 11.316 27.143 9.283 165 H GLY 24 HN GLY 24 7.250 29.086 8.542 166 1HA GLY 24 HA1 GLY 24 5.890 27.212 10.360 167 2HA GLY 24 HA2 GLY 24 5.175 28.664 9.677 168 H VAL 25 HN VAL 25 6.008 25.329 9.114 169 HA VAL 25 HA VAL 25 4.595 25.403 6.535 170 HB VAL 25 HB VAL 25 6.057 22.959 7.383 171 1HG1 VAL 25 HG21 VAL 25 4.734 23.460 5.186 172 2HG1 VAL 25 HG22 VAL 25 6.255 22.568 5.124 173 3HG1 VAL 25 HG23 VAL 25 6.221 24.283 4.715 174 1HG2 VAL 25 HG11 VAL 25 7.530 25.337 6.267 175 2HG2 VAL 25 HG12 VAL 25 8.205 23.786 6.767 176 3HG2 VAL 25 HG13 VAL 25 7.546 24.890 7.973 177 H ARG 26 HN ARG 26 3.846 24.929 9.626 178 HA ARG 26 HA ARG 26 2.222 22.526 9.222 179 1HB ARG 26 HB2 ARG 26 3.573 22.612 11.260 180 2HB ARG 26 HB1 ARG 26 2.793 24.117 11.729 181 1HG ARG 26 HG1 ARG 26 1.718 22.501 13.006 182 2HG ARG 26 HG2 ARG 26 0.607 22.784 11.664 183 1HD ARG 26 HD2 ARG 26 2.412 20.757 10.864 184 2HD ARG 26 HD1 ARG 26 1.846 20.350 12.482 185 HE ARG 26 HE ARG 26 -0.263 21.110 10.687 186 1HH1 ARG 26 HH11 ARG 26 1.736 18.482 11.801 187 2HH1 ARG 26 HH12 ARG 26 0.599 17.255 11.347 188 1HH2 ARG 26 HH21 ARG 26 -1.764 19.502 10.086 189 2HH2 ARG 26 HH22 ARG 26 -1.390 17.836 10.373 190 H ASN 27 HN ASN 27 1.622 25.541 11.020 191 HA ASN 27 HA ASN 27 -1.159 25.449 10.169 192 1HB ASN 27 HB1 ASN 27 0.043 27.506 12.012 193 2HB ASN 27 HB2 ASN 27 -1.631 26.968 11.912 194 1HD2 ASN 27 HD21 ASN 27 1.157 26.735 13.641 195 2HD2 ASN 27 HD22 ASN 27 0.848 25.259 14.484 196 HA PRO 28 HA PRO 28 0.233 29.932 8.681 197 1HB PRO 28 HB2 PRO 28 3.083 29.310 8.112 198 2HB PRO 28 HB1 PRO 28 2.356 30.796 8.734 199 1HG PRO 28 HG2 PRO 28 3.713 29.175 10.349 200 2HG PRO 28 HG1 PRO 28 2.233 29.978 10.906 201 1HD PRO 28 HD1 PRO 28 2.642 27.144 10.038 202 2HD PRO 28 HD2 PRO 28 1.649 27.785 11.363 203 H GLN 29 HN GLN 29 1.695 26.955 7.487 204 HA GLN 29 HA GLN 29 1.617 27.770 4.732 205 1HB GLN 29 HB2 GLN 29 3.220 26.077 5.804 206 2HB GLN 29 HB1 GLN 29 1.885 24.937 5.722 207 1HG GLN 29 HG1 GLN 29 2.333 26.289 3.196 208 2HG GLN 29 HG2 GLN 29 3.760 25.420 3.760 209 1HE2 GLN 29 HE21 GLN 29 3.284 23.161 4.565 210 2HE2 GLN 29 HE22 GLN 29 2.196 22.217 3.611 211 H GLN 30 HN GLN 30 -0.579 26.313 6.941 212 HA GLN 30 HA GLN 30 -2.307 25.371 4.772 213 1HB GLN 30 HB1 GLN 30 -2.368 24.935 7.759 214 2HB GLN 30 HB2 GLN 30 -3.667 24.420 6.691 215 1HG GLN 30 HG1 GLN 30 -0.950 23.555 5.944 216 2HG GLN 30 HG2 GLN 30 -1.622 22.849 7.413 217 1HE2 GLN 30 HE21 GLN 30 -3.510 21.601 7.276 218 2HE2 GLN 30 HE22 GLN 30 -4.019 20.897 5.783 219 H HIS 31 HN HIS 31 -4.765 25.665 5.451 220 HA HIS 31 HA HIS 31 -5.133 28.557 5.728 221 1HB HIS 31 HB2 HIS 31 -6.811 26.355 4.548 222 2HB HIS 31 HB1 HIS 31 -7.518 27.919 4.943 223 HD2 HIS 31 HD2 HIS 31 -6.522 26.390 1.889 224 HE1 HIS 31 HE1 HIS 31 -4.837 30.260 1.576 225 HE2 HIS 31 HE2 HIS 31 -5.486 28.165 0.304 226 H LEU 32 HN LEU 32 -4.542 27.153 8.075 227 HA LEU 32 HA LEU 32 -7.009 26.636 9.488 228 1HB LEU 32 HB2 LEU 32 -4.348 25.868 9.802 229 2HB LEU 32 HB1 LEU 32 -4.653 26.936 11.158 230 HG LEU 32 HG LEU 32 -6.667 24.818 10.631 231 1HD1 LEU 32 HD11 LEU 32 -4.485 23.885 12.318 232 2HD1 LEU 32 HD12 LEU 32 -4.025 24.078 10.627 233 3HD1 LEU 32 HD13 LEU 32 -5.385 23.042 11.057 234 1HD2 LEU 32 HD21 LEU 32 -5.648 25.131 13.318 235 2HD2 LEU 32 HD22 LEU 32 -7.291 25.318 12.704 236 3HD2 LEU 32 HD23 LEU 32 -6.161 26.671 12.630 237 H ASN 33 HN ASN 33 -5.704 29.397 8.486 238 HA ASN 33 HA ASN 33 -6.127 30.896 10.967 239 1HB ASN 33 HB2 ASN 33 -5.422 32.669 8.890 240 2HB ASN 33 HB1 ASN 33 -4.406 32.115 10.217 241 1HD2 ASN 33 HD21 ASN 33 -2.854 30.590 9.851 242 2HD2 ASN 33 HD22 ASN 33 -2.421 30.038 8.271 243 H ALA 34 HN ALA 34 -8.307 31.057 11.215 244 HA ALA 34 HA ALA 34 -10.005 31.802 8.988 245 1HB ALA 34 HB1 ALA 34 -10.708 31.426 11.895 246 2HB ALA 34 HB2 ALA 34 -10.778 30.174 10.656 247 3HB ALA 34 HB3 ALA 34 -11.842 31.577 10.554 248 H GLN 35 HN GLN 35 -8.386 33.813 9.024 249 HA GLN 35 HA GLN 35 -9.171 35.889 10.862 250 1HB GLN 35 HB2 GLN 35 -6.849 35.503 9.721 251 2HB GLN 35 HB1 GLN 35 -7.560 36.407 8.390 252 1HG GLN 35 HG1 GLN 35 -8.124 38.186 10.127 253 2HG GLN 35 HG2 GLN 35 -7.013 37.323 11.190 254 1HE2 GLN 35 HE21 GLN 35 -5.123 38.276 11.261 255 2HE2 GLN 35 HE22 GLN 35 -4.294 39.009 9.934 256 HA PRO 36 HA PRO 36 -11.229 37.758 6.963 257 1HB PRO 36 HB2 PRO 36 -11.400 36.350 4.687 258 2HB PRO 36 HB1 PRO 36 -9.942 37.257 5.107 259 1HG PRO 36 HG1 PRO 36 -10.499 34.327 5.381 260 2HG PRO 36 HG2 PRO 36 -9.034 35.136 4.797 261 1HD PRO 36 HD2 PRO 36 -9.320 34.156 7.338 262 2HD PRO 36 HD1 PRO 36 -8.246 35.504 6.917 263 H GLN 37 HN GLN 37 -13.405 37.841 6.892 264 HA GLN 37 HA GLN 37 -14.891 35.453 7.647 265 1HB GLN 37 HB2 GLN 37 -15.481 38.389 7.604 266 2HB GLN 37 HB1 GLN 37 -16.814 37.242 7.627 267 1HG GLN 37 HG1 GLN 37 -16.319 36.494 9.740 268 2HG GLN 37 HG2 GLN 37 -14.624 36.965 9.624 269 1HE2 GLN 37 HE21 GLN 37 -14.481 39.477 9.151 270 2HE2 GLN 37 HE22 GLN 37 -15.367 40.446 10.274 271 H VAL 38 HN VAL 38 -13.821 35.381 5.060 272 HA VAL 38 HA VAL 38 -16.089 35.898 3.282 273 HB VAL 38 HB VAL 38 -14.379 35.113 1.507 274 1HG1 VAL 38 HG21 VAL 38 -14.981 37.605 2.662 275 2HG1 VAL 38 HG22 VAL 38 -14.346 37.284 1.048 276 3HG1 VAL 38 HG23 VAL 38 -13.239 37.586 2.387 277 1HG2 VAL 38 HG11 VAL 38 -12.746 34.154 3.022 278 2HG2 VAL 38 HG12 VAL 38 -12.534 35.715 3.815 279 3HG2 VAL 38 HG13 VAL 38 -12.033 35.503 2.138 280 H THR 39 HN THR 39 -17.133 34.068 4.576 281 HA THR 39 HA THR 39 -16.265 31.411 3.761 282 HB THR 39 HB THR 39 -18.780 31.551 5.230 283 HG1 THR 39 HG1 THR 39 -17.780 32.331 7.158 284 1HG2 THR 39 HG21 THR 39 -16.223 30.106 5.394 285 2HG2 THR 39 HG22 THR 39 -17.878 29.523 5.564 286 3HG2 THR 39 HG23 THR 39 -17.091 30.346 6.910 287 H MET 40 HN MET 40 -16.721 31.409 1.555 288 HA MET 40 HA MET 40 -19.395 32.005 0.626 289 1HB MET 40 HB2 MET 40 -17.153 30.747 -0.956 290 2HB MET 40 HB1 MET 40 -18.551 31.616 -1.576 291 1HG MET 40 HG2 MET 40 -17.715 33.692 -0.743 292 2HG MET 40 HG1 MET 40 -16.405 32.877 0.110 293 1HE MET 40 HE1 MET 40 -13.727 32.385 -1.786 294 2HE MET 40 HE2 MET 40 -14.623 31.102 -2.599 295 3HE MET 40 HE3 MET 40 -14.874 31.400 -0.879 296 H GLN 41 HN GLN 41 -18.157 29.478 2.240 297 HA GLN 41 HA GLN 41 -18.702 27.291 2.526 298 1HB GLN 41 HB2 GLN 41 -21.201 28.478 1.382 299 2HB GLN 41 HB1 GLN 41 -21.113 26.739 1.633 300 1HG GLN 41 HG2 GLN 41 -20.228 27.645 4.024 301 2HG GLN 41 HG1 GLN 41 -21.360 28.921 3.576 302 1HE2 GLN 41 HE21 GLN 41 -20.995 25.530 4.288 303 2HE2 GLN 41 HE22 GLN 41 -22.668 25.204 4.563 304 H GLN 42 HN GLN 42 -16.932 27.167 0.763 305 HA GLN 42 HA GLN 42 -17.974 25.435 -1.362 306 1HB GLN 42 HB2 GLN 42 -17.457 27.784 -2.197 307 2HB GLN 42 HB1 GLN 42 -15.768 27.431 -1.856 308 1HG GLN 42 HG2 GLN 42 -15.537 26.208 -3.701 309 2HG GLN 42 HG1 GLN 42 -17.066 25.369 -3.445 310 1HE2 GLN 42 HE21 GLN 42 -15.653 26.807 -5.767 311 2HE2 GLN 42 HE22 GLN 42 -16.908 27.775 -6.453 312 HA PRO 43 HA PRO 43 -14.604 23.239 0.838 313 1HB PRO 43 HB2 PRO 43 -15.582 20.755 0.360 314 2HB PRO 43 HB1 PRO 43 -16.152 21.770 1.691 315 1HG PRO 43 HG1 PRO 43 -17.379 21.305 -1.003 316 2HG PRO 43 HG2 PRO 43 -18.162 21.367 0.588 317 1HD PRO 43 HD2 PRO 43 -18.192 23.456 -1.135 318 2HD PRO 43 HD1 PRO 43 -18.183 23.671 0.628 319 H ALA 44 HN ALA 44 -13.616 20.936 -0.064 320 HA ALA 44 HA ALA 44 -12.146 21.648 -2.350 321 1HB ALA 44 HB1 ALA 44 -12.405 18.782 -1.599 322 2HB ALA 44 HB2 ALA 44 -11.693 19.899 -0.434 323 3HB ALA 44 HB3 ALA 44 -10.972 19.714 -2.032 324 H VAL 45 HN VAL 45 -12.079 20.587 -4.427 325 HA VAL 45 HA VAL 45 -14.770 19.950 -5.391 326 HB VAL 45 HB VAL 45 -13.368 20.071 -7.668 327 1HG1 VAL 45 HG21 VAL 45 -15.282 21.558 -6.488 328 2HG1 VAL 45 HG22 VAL 45 -14.559 21.944 -8.049 329 3HG1 VAL 45 HG23 VAL 45 -13.978 22.740 -6.587 330 1HG2 VAL 45 HG11 VAL 45 -11.969 22.167 -6.047 331 2HG2 VAL 45 HG12 VAL 45 -11.563 21.538 -7.644 332 3HG2 VAL 45 HG13 VAL 45 -11.292 20.546 -6.211 333 H HIS 46 HN HIS 46 -11.629 18.891 -6.657 334 HA HIS 46 HA HIS 46 -12.649 16.131 -6.609 335 1HB HIS 46 HB1 HIS 46 -10.671 17.470 -8.459 336 2HB HIS 46 HB2 HIS 46 -10.959 15.734 -8.439 337 HD2 HIS 46 HD2 HIS 46 -14.009 15.348 -8.677 338 HE1 HIS 46 HE1 HIS 46 -13.979 18.382 -11.630 339 HE2 HIS 46 HE2 HIS 46 -15.300 16.460 -10.634 340 H VAL 47 HN VAL 47 -11.937 15.482 -4.616 341 HA VAL 47 HA VAL 47 -9.154 15.858 -3.875 342 HB VAL 47 HB VAL 47 -11.058 16.089 -2.237 343 1HG1 VAL 47 HG11 VAL 47 -11.066 13.077 -2.333 344 2HG1 VAL 47 HG12 VAL 47 -12.327 14.114 -2.997 345 3HG1 VAL 47 HG13 VAL 47 -12.018 14.103 -1.261 346 1HG2 VAL 47 HG21 VAL 47 -9.796 14.553 -0.500 347 2HG2 VAL 47 HG22 VAL 47 -9.059 16.021 -1.146 348 3HG2 VAL 47 HG23 VAL 47 -8.621 14.447 -1.811 349 H GLN 48 HN GLN 48 -9.793 14.193 -6.178 350 HA GLN 48 HA GLN 48 -9.560 11.449 -5.524 351 1HB GLN 48 HB2 GLN 48 -8.633 12.688 -8.109 352 2HB GLN 48 HB1 GLN 48 -9.265 11.068 -7.846 353 1HG GLN 48 HG2 GLN 48 -11.423 12.331 -7.117 354 2HG GLN 48 HG1 GLN 48 -10.720 13.662 -8.035 355 1HE2 GLN 48 HE21 GLN 48 -11.007 13.697 -10.160 356 2HE2 GLN 48 HE22 GLN 48 -11.631 12.397 -11.109 357 H GLY 49 HN GLY 49 -7.296 14.005 -5.560 358 1HA GLY 49 HA2 GLY 49 -5.023 12.160 -5.787 359 2HA GLY 49 HA1 GLY 49 -4.934 13.912 -5.864 360 H GLN 50 HN GLN 50 -5.879 11.333 -3.593 361 HA GLN 50 HA GLN 50 -5.031 13.005 -1.358 362 1HB GLN 50 HB2 GLN 50 -6.517 10.393 -1.551 363 2HB GLN 50 HB1 GLN 50 -5.899 10.991 -0.018 364 1HG GLN 50 HG1 GLN 50 -7.249 12.990 -0.222 365 2HG GLN 50 HG2 GLN 50 -7.825 12.462 -1.802 366 1HE2 GLN 50 HE21 GLN 50 -8.961 12.909 1.061 367 2HE2 GLN 50 HE22 GLN 50 -9.998 11.542 1.271 368 H GLU 51 HN GLU 51 -2.849 13.011 -1.218 369 HA GLU 51 HA GLU 51 -1.328 10.574 -1.579 370 1HB GLU 51 HB2 GLU 51 -0.222 13.201 -0.618 371 2HB GLU 51 HB1 GLU 51 0.599 11.927 -1.506 372 1HG GLU 51 HG2 GLU 51 -1.671 13.055 -2.941 373 2HG GLU 51 HG1 GLU 51 -0.412 14.233 -2.573 374 HA PRO 52 HA PRO 52 -1.720 9.879 2.868 375 1HB PRO 52 HB1 PRO 52 -0.791 7.194 2.385 376 2HB PRO 52 HB2 PRO 52 -2.414 7.730 2.823 377 1HG PRO 52 HG2 PRO 52 -1.758 6.644 0.390 378 2HG PRO 52 HG1 PRO 52 -3.129 7.734 0.656 379 1HD PRO 52 HD2 PRO 52 -0.421 8.333 -0.467 380 2HD PRO 52 HD1 PRO 52 -2.013 8.949 -0.965 381 H LEU 53 HN LEU 53 -0.169 8.534 4.405 382 HA LEU 53 HA LEU 53 2.422 9.769 4.165 383 1HB LEU 53 HB2 LEU 53 0.859 9.019 6.280 384 2HB LEU 53 HB1 LEU 53 2.046 7.730 6.250 385 HG LEU 53 HG LEU 53 3.537 10.089 6.014 386 1HD1 LEU 53 HD21 LEU 53 1.494 10.381 8.207 387 2HD1 LEU 53 HD22 LEU 53 1.493 11.310 6.708 388 3HD1 LEU 53 HD23 LEU 53 2.832 11.471 7.845 389 1HD2 LEU 53 HD11 LEU 53 3.010 8.558 8.550 390 2HD2 LEU 53 HD12 LEU 53 4.472 9.433 8.087 391 3HD2 LEU 53 HD13 LEU 53 4.028 7.950 7.242 392 H THR 54 HN THR 54 4.433 8.639 4.213 393 HA THR 54 HA THR 54 4.620 5.839 3.876 394 HB THR 54 HB THR 54 5.736 6.710 1.412 395 HG1 THR 54 HG1 THR 54 3.800 7.405 0.384 396 1HG2 THR 54 HG21 THR 54 4.999 4.464 1.713 397 2HG2 THR 54 HG22 THR 54 4.046 5.195 0.421 398 3HG2 THR 54 HG23 THR 54 3.348 4.998 2.028 399 H ALA 55 HN ALA 55 6.981 5.434 2.775 400 HA ALA 55 HA ALA 55 8.826 6.250 4.646 401 1HB ALA 55 HB1 ALA 55 10.560 5.509 3.067 402 2HB ALA 55 HB2 ALA 55 9.342 5.430 1.794 403 3HB ALA 55 HB3 ALA 55 9.224 4.364 3.196 404 H SER 56 HN SER 56 7.675 7.960 1.864 405 HA SER 56 HA SER 56 9.847 9.816 1.678 406 1HB SER 56 HB1 SER 56 7.017 10.050 0.623 407 2HB SER 56 HB2 SER 56 8.386 11.054 0.145 408 HG SER 56 HG SER 56 9.150 9.470 -1.045 409 H MET 57 HN MET 57 6.553 9.977 3.009 410 HA MET 57 HA MET 57 6.648 12.609 3.969 411 1HB MET 57 HB1 MET 57 5.118 10.158 4.805 412 2HB MET 57 HB2 MET 57 4.959 11.660 5.698 413 1HG MET 57 HG1 MET 57 3.370 10.949 3.664 414 2HG MET 57 HG2 MET 57 3.697 12.622 4.114 415 1HE MET 57 HE1 MET 57 5.189 10.376 0.415 416 2HE MET 57 HE2 MET 57 3.713 10.043 1.324 417 3HE MET 57 HE3 MET 57 5.288 9.690 2.037 418 H LEU 58 HN LEU 58 7.663 9.559 5.354 419 HA LEU 58 HA LEU 58 8.302 10.475 7.945 420 1HB LEU 58 HB1 LEU 58 9.535 8.204 6.388 421 2HB LEU 58 HB2 LEU 58 9.566 8.402 8.131 422 HG LEU 58 HG LEU 58 6.940 8.221 6.714 423 1HD1 LEU 58 HD21 LEU 58 7.697 5.651 7.658 424 2HD1 LEU 58 HD22 LEU 58 8.941 6.223 6.544 425 3HD1 LEU 58 HD23 LEU 58 7.257 6.142 6.023 426 1HD2 LEU 58 HD11 LEU 58 6.097 7.704 8.770 427 2HD2 LEU 58 HD12 LEU 58 7.462 8.717 9.247 428 3HD2 LEU 58 HD13 LEU 58 7.598 6.959 9.322 429 H ALA 59 HN ALA 59 10.209 10.078 4.997 430 HA ALA 59 HA ALA 59 12.678 10.926 6.084 431 1HB ALA 59 HB1 ALA 59 13.425 11.123 3.784 432 2HB ALA 59 HB2 ALA 59 11.758 11.039 3.214 433 3HB ALA 59 HB3 ALA 59 12.493 9.641 3.999 434 H SER 60 HN SER 60 9.859 12.621 5.559 435 HA SER 60 HA SER 60 11.072 15.145 4.821 436 1HB SER 60 HB1 SER 60 8.786 14.519 4.047 437 2HB SER 60 HB2 SER 60 8.236 14.576 5.723 438 HG SER 60 HG SER 60 7.789 16.552 4.864 439 H ALA 61 HN ALA 61 10.780 13.375 7.623 440 HA ALA 61 HA ALA 61 11.187 15.787 9.261 441 1HB ALA 61 HB1 ALA 61 9.024 15.244 9.890 442 2HB ALA 61 HB2 ALA 61 9.995 14.416 11.108 443 3HB ALA 61 HB3 ALA 61 9.310 13.508 9.759 444 HA PRO 62 HA PRO 62 14.355 12.544 10.283 445 1HB PRO 62 HB2 PRO 62 16.269 12.870 8.466 446 2HB PRO 62 HB1 PRO 62 14.774 12.027 8.047 447 1HG PRO 62 HG2 PRO 62 15.681 14.753 7.303 448 2HG PRO 62 HG1 PRO 62 14.616 13.644 6.425 449 1HD PRO 62 HD2 PRO 62 13.869 15.828 8.129 450 2HD PRO 62 HD1 PRO 62 12.801 14.694 7.278 451 HA PRO 63 HA PRO 63 15.083 12.060 11.731 452 1HB PRO 63 HB2 PRO 63 16.340 11.929 14.089 453 2HB PRO 63 HB1 PRO 63 17.233 11.763 12.574 454 1HG PRO 63 HG2 PRO 63 17.190 14.004 14.493 455 2HG PRO 63 HG1 PRO 63 18.421 13.573 13.297 456 1HD PRO 63 HD2 PRO 63 16.305 15.538 13.081 457 2HD PRO 63 HD1 PRO 63 17.616 15.192 11.935 458 H GLN 64 HN GLN 64 13.647 14.667 12.145 459 HA GLN 64 HA GLN 64 12.802 15.048 14.754 460 1HB GLN 64 HB1 GLN 64 12.328 16.392 12.558 461 2HB GLN 64 HB2 GLN 64 10.880 15.398 12.485 462 1HG GLN 64 HG2 GLN 64 9.976 16.334 14.388 463 2HG GLN 64 HG1 GLN 64 11.544 16.866 14.994 464 1HE2 GLN 64 HE21 GLN 64 12.549 18.178 12.811 465 2HE2 GLN 64 HE22 GLN 64 11.586 19.573 12.477 466 H GLU 65 HN GLU 65 10.329 13.909 12.527 467 HA GLU 65 HA GLU 65 9.549 11.937 14.558 468 1HB GLU 65 HB1 GLU 65 7.617 12.608 12.436 469 2HB GLU 65 HB2 GLU 65 7.371 12.421 14.166 470 1HG GLU 65 HG2 GLU 65 8.885 14.805 13.321 471 2HG GLU 65 HG1 GLU 65 7.179 14.758 12.877 472 H GLN 66 HN GLN 66 11.570 11.531 12.454 473 HA GLN 66 HA GLN 66 10.656 10.045 10.290 474 1HB GLN 66 HB2 GLN 66 13.158 10.561 11.551 475 2HB GLN 66 HB1 GLN 66 13.041 8.827 11.283 476 1HG GLN 66 HG1 GLN 66 12.248 9.625 8.887 477 2HG GLN 66 HG2 GLN 66 13.190 11.049 9.328 478 1HE2 GLN 66 HE22 GLN 66 13.712 7.635 10.088 479 2HE2 GLN 66 HE21 GLN 66 15.260 7.521 9.328 480 H LYS 67 HN LYS 67 11.403 9.018 13.589 481 HA LYS 67 HA LYS 67 10.146 6.422 13.028 482 1HB LYS 67 HB2 LYS 67 11.250 5.764 15.232 483 2HB LYS 67 HB1 LYS 67 12.316 6.034 13.860 484 1HG LYS 67 HG1 LYS 67 13.480 7.439 15.110 485 2HG LYS 67 HG2 LYS 67 12.079 8.514 15.137 486 1HD LYS 67 HD1 LYS 67 11.245 7.051 17.075 487 2HD LYS 67 HD2 LYS 67 12.902 6.445 17.150 488 1HE LYS 67 HE2 LYS 67 13.766 8.572 17.668 489 2HE LYS 67 HE1 LYS 67 12.271 9.381 17.205 490 1HZ LYS 67 HZ1 LYS 67 12.793 9.036 19.686 491 2HZ LYS 67 HZ2 LYS 67 12.276 7.446 19.424 492 3HZ LYS 67 HZ3 LYS 67 11.221 8.737 19.136 493 H GLN 68 HN GLN 68 8.593 8.771 13.411 494 HA GLN 68 HA GLN 68 7.251 8.081 15.937 495 1HB GLN 68 HB2 GLN 68 8.447 10.264 16.073 496 2HB GLN 68 HB1 GLN 68 7.453 10.852 14.748 497 1HG GLN 68 HG1 GLN 68 6.196 11.658 16.426 498 2HG GLN 68 HG2 GLN 68 5.525 10.028 16.415 499 1HE2 GLN 68 HE21 GLN 68 7.477 12.310 18.110 500 2HE2 GLN 68 HE22 GLN 68 7.680 11.387 19.556 501 H MET 69 HN MET 69 6.768 9.756 12.813 502 HA MET 69 HA MET 69 3.933 9.378 12.905 503 1HB MET 69 HB1 MET 69 5.386 9.977 10.357 504 2HB MET 69 HB2 MET 69 3.822 10.555 10.913 505 1HG MET 69 HG1 MET 69 4.992 11.943 12.599 506 2HG MET 69 HG2 MET 69 6.530 11.434 11.901 507 1HE MET 69 HE1 MET 69 7.689 12.613 10.078 508 2HE MET 69 HE2 MET 69 6.888 13.346 8.687 509 3HE MET 69 HE3 MET 69 6.695 11.622 9.010 510 H LEU 70 HN LEU 70 6.396 7.235 12.262 511 HA LEU 70 HA LEU 70 5.416 5.861 10.005 512 1HB LEU 70 HB1 LEU 70 6.627 3.874 11.390 513 2HB LEU 70 HB2 LEU 70 7.449 5.000 10.335 514 HG LEU 70 HG LEU 70 8.274 6.272 12.160 515 1HD1 LEU 70 HD21 LEU 70 7.544 5.121 14.523 516 2HD1 LEU 70 HD22 LEU 70 6.038 5.063 13.607 517 3HD1 LEU 70 HD23 LEU 70 6.857 6.604 13.862 518 1HD2 LEU 70 HD11 LEU 70 9.321 4.440 13.594 519 2HD2 LEU 70 HD12 LEU 70 9.612 4.375 11.856 520 3HD2 LEU 70 HD13 LEU 70 8.415 3.308 12.592 521 H GLY 71 HN GLY 71 4.576 5.716 13.396 522 1HA GLY 71 HA2 GLY 71 2.301 4.050 12.681 523 2HA GLY 71 HA1 GLY 71 3.393 3.397 13.879 524 H GLU 72 HN GLU 72 2.749 6.828 13.676 525 HA GLU 72 HA GLU 72 0.839 6.677 15.884 526 1HB GLU 72 HB1 GLU 72 3.349 8.360 15.998 527 2HB GLU 72 HB2 GLU 72 2.068 8.338 17.201 528 1HG GLU 72 HG1 GLU 72 2.754 5.698 17.040 529 2HG GLU 72 HG2 GLU 72 4.302 6.510 16.802 530 H ARG 73 HN ARG 73 1.568 7.838 12.942 531 HA ARG 73 HA ARG 73 -0.252 10.109 13.250 532 1HB ARG 73 HB1 ARG 73 2.331 10.663 13.029 533 2HB ARG 73 HB2 ARG 73 2.019 10.360 11.327 534 1HG ARG 73 HG1 ARG 73 0.189 12.196 12.773 535 2HG ARG 73 HG2 ARG 73 1.810 12.770 12.379 536 1HD ARG 73 HD2 ARG 73 1.427 12.740 10.129 537 2HD ARG 73 HD1 ARG 73 0.259 11.424 10.237 538 HE ARG 73 HE ARG 73 -0.965 13.526 11.472 539 1HH1 ARG 73 HH12 ARG 73 0.456 13.009 8.332 540 2HH1 ARG 73 HH11 ARG 73 -0.602 14.120 7.529 541 1HH2 ARG 73 HH22 ARG 73 -2.361 14.989 10.424 542 2HH2 ARG 73 HH21 ARG 73 -2.205 15.246 8.719 543 H LEU 74 HN LEU 74 0.961 7.424 11.529 544 HA LEU 74 HA LEU 74 -0.343 7.900 9.026 545 1HB LEU 74 HB1 LEU 74 1.236 5.783 10.294 546 2HB LEU 74 HB2 LEU 74 -0.026 5.174 9.242 547 HG LEU 74 HG LEU 74 1.680 7.325 8.163 548 1HD1 LEU 74 HD11 LEU 74 3.061 5.516 9.485 549 2HD1 LEU 74 HD12 LEU 74 3.598 6.120 7.916 550 3HD1 LEU 74 HD13 LEU 74 2.766 4.568 8.026 551 1HD2 LEU 74 HD21 LEU 74 1.374 6.109 6.118 552 2HD2 LEU 74 HD22 LEU 74 -0.188 6.255 6.924 553 3HD2 LEU 74 HD23 LEU 74 0.700 4.731 6.989 554 H PHE 75 HN PHE 75 -1.230 6.709 12.095 555 HA PHE 75 HA PHE 75 -3.157 4.882 11.790 556 1HB PHE 75 HB1 PHE 75 -2.346 6.480 13.816 557 2HB PHE 75 HB2 PHE 75 -3.960 7.113 13.550 558 HD1 PHE 75 HD1 PHE 75 -4.606 6.399 15.790 559 HD2 PHE 75 HD2 PHE 75 -3.279 3.593 12.873 560 HE1 PHE 75 HE1 PHE 75 -5.506 4.562 17.155 561 HE2 PHE 75 HE2 PHE 75 -4.176 1.751 14.241 562 HZ PHE 75 HZ PHE 75 -5.292 2.236 16.382 563 HA PRO 76 HA PRO 76 -6.644 7.988 10.655 564 1HB PRO 76 HB1 PRO 76 -5.369 10.530 9.973 565 2HB PRO 76 HB2 PRO 76 -6.675 10.207 11.115 566 1HG PRO 76 HG1 PRO 76 -4.204 10.930 11.922 567 2HG PRO 76 HG2 PRO 76 -5.230 9.837 12.868 568 1HD PRO 76 HD2 PRO 76 -2.947 9.180 11.039 569 2HD PRO 76 HD1 PRO 76 -3.334 8.513 12.640 570 H LEU 77 HN LEU 77 -3.618 7.923 8.995 571 HA LEU 77 HA LEU 77 -4.812 8.615 6.441 572 1HB LEU 77 HB1 LEU 77 -2.002 7.980 7.298 573 2HB LEU 77 HB2 LEU 77 -2.443 8.165 5.611 574 HG LEU 77 HG LEU 77 -2.641 10.274 7.765 575 1HD1 LEU 77 HD11 LEU 77 -0.377 9.840 6.942 576 2HD1 LEU 77 HD12 LEU 77 -0.960 11.433 6.457 577 3HD1 LEU 77 HD13 LEU 77 -0.933 10.110 5.289 578 1HD2 LEU 77 HD21 LEU 77 -4.510 10.324 6.093 579 2HD2 LEU 77 HD22 LEU 77 -3.292 10.583 4.843 580 3HD2 LEU 77 HD23 LEU 77 -3.500 11.769 6.131 581 H ILE 78 HN ILE 78 -3.719 5.747 8.148 582 HA ILE 78 HA ILE 78 -3.676 4.001 5.907 583 HB ILE 78 HB ILE 78 -4.346 3.185 8.714 584 1HG1 ILE 78 HG12 ILE 78 -2.192 4.646 8.325 585 2HG1 ILE 78 HG11 ILE 78 -2.125 3.220 9.354 586 1HG2 ILE 78 HG21 ILE 78 -3.640 1.810 6.217 587 2HG2 ILE 78 HG22 ILE 78 -4.597 1.255 7.593 588 3HG2 ILE 78 HG23 ILE 78 -2.836 1.206 7.668 589 1HD1 ILE 78 HD11 ILE 78 -1.113 1.939 7.614 590 2HD1 ILE 78 HD12 ILE 78 -0.213 3.442 7.814 591 3HD1 ILE 78 HD13 ILE 78 -1.325 3.255 6.458 592 H GLN 79 HN GLN 79 -6.134 5.058 8.185 593 HA GLN 79 HA GLN 79 -8.244 3.384 7.612 594 1HB GLN 79 HB1 GLN 79 -7.926 6.112 8.606 595 2HB GLN 79 HB2 GLN 79 -9.440 5.880 7.745 596 1HG GLN 79 HG1 GLN 79 -10.031 4.048 9.207 597 2HG GLN 79 HG2 GLN 79 -8.479 4.177 10.032 598 1HE2 GLN 79 HE21 GLN 79 -9.484 4.533 12.015 599 2HE2 GLN 79 HE22 GLN 79 -10.235 6.039 12.405 600 H ALA 80 HN ALA 80 -6.628 5.478 5.508 601 HA ALA 80 HA ALA 80 -8.794 5.810 3.609 602 1HB ALA 80 HB1 ALA 80 -5.866 6.514 3.411 603 2HB ALA 80 HB2 ALA 80 -7.177 7.609 3.860 604 3HB ALA 80 HB3 ALA 80 -7.106 6.942 2.229 605 H MET 81 HN MET 81 -5.751 4.008 3.881 606 HA MET 81 HA MET 81 -5.927 2.724 1.337 607 1HB MET 81 HB1 MET 81 -4.520 1.517 3.699 608 2HB MET 81 HB2 MET 81 -4.046 1.493 2.009 609 1HG MET 81 HG1 MET 81 -3.957 4.149 2.548 610 2HG MET 81 HG2 MET 81 -3.499 3.463 4.102 611 1HE MET 81 HE1 MET 81 -1.442 1.094 3.795 612 2HE MET 81 HE2 MET 81 -1.539 2.583 4.742 613 3HE MET 81 HE3 MET 81 -0.092 2.236 3.795 614 H HIS 82 HN HIS 82 -7.188 2.158 4.474 615 HA HIS 82 HA HIS 82 -8.293 -0.453 3.686 616 1HB HIS 82 HB1 HIS 82 -6.824 0.403 5.932 617 2HB HIS 82 HB2 HIS 82 -8.471 0.190 6.507 618 HD2 HIS 82 HD2 HIS 82 -7.419 -1.951 7.980 619 HE1 HIS 82 HE1 HIS 82 -7.118 -4.473 4.618 620 HE2 HIS 82 HE2 HIS 82 -7.085 -4.366 7.139 621 HA PRO 83 HA PRO 83 -12.395 1.240 4.238 622 1HB PRO 83 HB1 PRO 83 -13.806 -0.837 5.191 623 2HB PRO 83 HB2 PRO 83 -13.172 -0.826 3.541 624 1HG PRO 83 HG2 PRO 83 -12.110 -2.200 5.976 625 2HG PRO 83 HG1 PRO 83 -12.217 -2.796 4.311 626 1HD PRO 83 HD2 PRO 83 -9.926 -1.785 5.447 627 2HD PRO 83 HD1 PRO 83 -10.252 -1.797 3.704 628 H THR 84 HN THR 84 -10.680 2.004 6.279 629 HA THR 84 HA THR 84 -10.671 2.922 8.346 630 HB THR 84 HB THR 84 -13.534 2.130 8.784 631 HG1 THR 84 HG1 THR 84 -13.321 2.965 6.630 632 1HG2 THR 84 HG21 THR 84 -12.177 3.448 10.475 633 2HG2 THR 84 HG22 THR 84 -13.736 4.115 9.989 634 3HG2 THR 84 HG23 THR 84 -12.245 4.777 9.318 635 H LEU 85 HN LEU 85 -9.580 0.511 8.226 636 HA LEU 85 HA LEU 85 -10.552 -0.893 10.631 637 1HB LEU 85 HB1 LEU 85 -10.107 -1.891 8.046 638 2HB LEU 85 HB2 LEU 85 -8.773 -2.488 9.016 639 HG LEU 85 HG LEU 85 -11.654 -2.817 9.851 640 1HD1 LEU 85 HD11 LEU 85 -10.788 -5.282 8.996 641 2HD1 LEU 85 HD12 LEU 85 -10.177 -4.188 7.755 642 3HD1 LEU 85 HD13 LEU 85 -11.900 -4.217 8.135 643 1HD2 LEU 85 HD21 LEU 85 -9.479 -4.682 10.602 644 2HD2 LEU 85 HD22 LEU 85 -10.883 -4.144 11.524 645 3HD2 LEU 85 HD23 LEU 85 -9.481 -3.088 11.357 646 H ALA 86 HN ALA 86 -8.291 1.159 9.581 647 HA ALA 86 HA ALA 86 -5.861 0.053 10.638 648 1HB ALA 86 HB1 ALA 86 -6.050 1.832 8.866 649 2HB ALA 86 HB2 ALA 86 -4.899 2.160 10.162 650 3HB ALA 86 HB3 ALA 86 -6.470 2.961 10.154 651 H GLY 87 HN GLY 87 -7.365 -0.491 12.675 652 1HA GLY 87 HA2 GLY 87 -7.229 1.717 14.611 653 2HA GLY 87 HA1 GLY 87 -8.147 0.229 14.820 654 H LYS 88 HN LYS 88 -5.374 -0.691 13.461 655 HA LYS 88 HA LYS 88 -3.639 -0.665 15.771 656 1HB LYS 88 HB1 LYS 88 -5.138 -2.511 16.318 657 2HB LYS 88 HB2 LYS 88 -4.853 -3.239 14.747 658 1HG LYS 88 HG1 LYS 88 -2.338 -3.151 15.590 659 2HG LYS 88 HG2 LYS 88 -3.143 -3.198 17.162 660 1HD LYS 88 HD1 LYS 88 -3.374 -5.397 16.933 661 2HD LYS 88 HD2 LYS 88 -4.431 -5.109 15.548 662 1HE LYS 88 HE2 LYS 88 -2.635 -5.267 14.021 663 2HE LYS 88 HE1 LYS 88 -1.436 -5.155 15.307 664 1HZ LYS 88 HZ1 LYS 88 -3.260 -7.376 15.574 665 2HZ LYS 88 HZ2 LYS 88 -1.576 -7.332 15.729 666 3HZ LYS 88 HZ3 LYS 88 -2.280 -7.451 14.196 667 H ILE 89 HN ILE 89 -4.192 -1.123 12.408 668 HA ILE 89 HA ILE 89 -2.080 -2.589 11.550 669 HB ILE 89 HB ILE 89 -3.046 -0.090 10.171 670 1HG1 ILE 89 HG12 ILE 89 -4.072 -2.911 9.835 671 2HG1 ILE 89 HG11 ILE 89 -4.860 -1.704 10.848 672 1HG2 ILE 89 HG21 ILE 89 -2.461 -1.950 8.255 673 2HG2 ILE 89 HG22 ILE 89 -1.211 -2.255 9.461 674 3HG2 ILE 89 HG23 ILE 89 -1.389 -0.645 8.764 675 1HD1 ILE 89 HD11 ILE 89 -4.400 -0.568 8.288 676 2HD1 ILE 89 HD12 ILE 89 -5.932 -0.917 9.090 677 3HD1 ILE 89 HD13 ILE 89 -5.163 -2.144 8.082 678 H THR 90 HN THR 90 -1.823 0.886 10.966 679 HA THR 90 HA THR 90 0.936 0.922 10.770 680 HB THR 90 HB THR 90 -1.182 2.811 10.756 681 HG1 THR 90 HG1 THR 90 0.644 2.322 9.252 682 1HG2 THR 90 HG21 THR 90 -0.766 4.107 12.525 683 2HG2 THR 90 HG22 THR 90 0.557 4.711 11.522 684 3HG2 THR 90 HG23 THR 90 0.866 3.471 12.743 685 H GLY 91 HN GLY 91 -1.067 1.297 13.664 686 1HA GLY 91 HA2 GLY 91 1.003 2.028 15.453 687 2HA GLY 91 HA1 GLY 91 -0.492 1.208 15.896 688 H MET 92 HN MET 92 0.005 -0.947 14.010 689 HA MET 92 HA MET 92 1.580 -2.692 15.674 690 1HB MET 92 HB1 MET 92 -0.500 -3.205 14.106 691 2HB MET 92 HB2 MET 92 0.752 -3.422 12.895 692 1HG MET 92 HG1 MET 92 1.710 -4.846 14.997 693 2HG MET 92 HG2 MET 92 -0.018 -5.123 15.105 694 1HE MET 92 HE1 MET 92 -0.889 -6.582 11.659 695 2HE MET 92 HE2 MET 92 -0.379 -4.900 11.497 696 3HE MET 92 HE3 MET 92 -1.360 -5.393 12.879 697 H LEU 93 HN LEU 93 1.870 -1.083 12.605 698 HA LEU 93 HA LEU 93 4.118 -2.289 11.556 699 1HB LEU 93 HB2 LEU 93 2.860 0.373 11.286 700 2HB LEU 93 HB1 LEU 93 4.446 0.145 10.586 701 HG LEU 93 HG LEU 93 2.646 -0.204 8.933 702 1HD1 LEU 93 HD11 LEU 93 3.340 -2.591 8.298 703 2HD1 LEU 93 HD12 LEU 93 4.384 -2.520 9.718 704 3HD1 LEU 93 HD13 LEU 93 4.603 -1.364 8.405 705 1HD2 LEU 93 HD21 LEU 93 1.668 -2.053 11.032 706 2HD2 LEU 93 HD22 LEU 93 1.481 -2.558 9.349 707 3HD2 LEU 93 HD23 LEU 93 0.778 -1.036 9.897 708 H LEU 94 HN LEU 94 3.920 -0.602 14.414 709 HA LEU 94 HA LEU 94 6.774 0.102 14.367 710 1HB LEU 94 HB1 LEU 94 4.398 1.228 15.711 711 2HB LEU 94 HB2 LEU 94 5.837 1.122 16.704 712 HG LEU 94 HG LEU 94 7.055 2.571 15.244 713 1HD1 LEU 94 HD11 LEU 94 4.699 2.431 13.368 714 2HD1 LEU 94 HD12 LEU 94 6.263 1.653 13.121 715 3HD1 LEU 94 HD13 LEU 94 6.149 3.413 13.149 716 1HD2 LEU 94 HD21 LEU 94 5.152 4.453 15.001 717 2HD2 LEU 94 HD22 LEU 94 5.956 4.061 16.521 718 3HD2 LEU 94 HD23 LEU 94 4.375 3.371 16.157 719 H GLU 95 HN GLU 95 5.579 -2.550 14.588 720 HA GLU 95 HA GLU 95 7.105 -3.583 16.733 721 1HB GLU 95 HB2 GLU 95 5.439 -4.294 18.264 722 2HB GLU 95 HB1 GLU 95 5.115 -2.596 17.949 723 1HG GLU 95 HG1 GLU 95 3.270 -3.109 16.557 724 2HG GLU 95 HG2 GLU 95 3.693 -4.820 16.518 725 H ILE 96 HN ILE 96 5.607 -3.870 13.849 726 HA ILE 96 HA ILE 96 4.681 -6.523 13.780 727 HB ILE 96 HB ILE 96 4.975 -6.485 11.384 728 1HG1 ILE 96 HG12 ILE 96 7.197 -5.483 11.280 729 2HG1 ILE 96 HG11 ILE 96 6.070 -4.645 10.221 730 1HG2 ILE 96 HG21 ILE 96 3.029 -5.369 11.999 731 2HG2 ILE 96 HG22 ILE 96 3.827 -4.277 10.864 732 3HG2 ILE 96 HG23 ILE 96 3.915 -3.967 12.598 733 1HD1 ILE 96 HD11 ILE 96 6.737 -2.761 11.138 734 2HD1 ILE 96 HD12 ILE 96 7.660 -3.625 12.368 735 3HD1 ILE 96 HD13 ILE 96 5.951 -3.275 12.632 736 H ASP 97 HN ASP 97 6.250 -7.459 11.514 737 HA ASP 97 HA ASP 97 8.093 -9.135 12.779 738 1HB ASP 97 HB1 ASP 97 6.901 -9.130 10.382 739 2HB ASP 97 HB2 ASP 97 8.460 -8.468 9.896 740 H ASN 98 HN ASN 98 8.339 -5.895 12.307 741 HA ASN 98 HA ASN 98 10.006 -4.422 12.701 742 1HB ASN 98 HB1 ASN 98 11.748 -6.877 12.923 743 2HB ASN 98 HB2 ASN 98 12.324 -5.236 13.199 744 1HD2 ASN 98 HD21 ASN 98 11.361 -4.027 14.933 745 2HD2 ASN 98 HD22 ASN 98 10.738 -4.858 16.314 746 H SER 99 HN SER 99 10.319 -6.827 10.241 747 HA SER 99 HA SER 99 12.247 -5.340 8.695 748 1HB SER 99 HB1 SER 99 10.481 -7.463 7.519 749 2HB SER 99 HB2 SER 99 12.157 -7.063 7.134 750 HG SER 99 HG SER 99 11.126 -8.549 9.285 751 H GLU 100 HN GLU 100 8.849 -5.413 9.141 752 HA GLU 100 HA GLU 100 8.239 -3.983 6.693 753 1HB GLU 100 HB1 GLU 100 6.284 -4.231 8.926 754 2HB GLU 100 HB2 GLU 100 6.015 -4.290 7.192 755 1HG GLU 100 HG1 GLU 100 7.472 -6.500 7.452 756 2HG GLU 100 HG2 GLU 100 6.763 -6.442 9.066 757 H LEU 101 HN LEU 101 9.006 -3.351 9.993 758 HA LEU 101 HA LEU 101 8.078 -0.623 10.025 759 1HB LEU 101 HB1 LEU 101 8.218 -1.546 12.162 760 2HB LEU 101 HB2 LEU 101 9.749 -2.332 11.831 761 HG LEU 101 HG LEU 101 10.442 0.307 11.639 762 1HD1 LEU 101 HD11 LEU 101 9.029 0.509 14.158 763 2HD1 LEU 101 HD12 LEU 101 7.926 0.387 12.787 764 3HD1 LEU 101 HD13 LEU 101 9.143 1.664 12.829 765 1HD2 LEU 101 HD21 LEU 101 11.785 -0.148 13.413 766 2HD2 LEU 101 HD22 LEU 101 11.283 -1.792 13.024 767 3HD2 LEU 101 HD23 LEU 101 10.495 -0.917 14.336 768 H LEU 102 HN LEU 102 10.839 -2.382 9.001 769 HA LEU 102 HA LEU 102 12.597 -0.082 8.829 770 1HB LEU 102 HB2 LEU 102 12.833 -3.003 8.167 771 2HB LEU 102 HB1 LEU 102 14.052 -1.866 7.635 772 HG LEU 102 HG LEU 102 13.669 -3.108 10.235 773 1HD1 LEU 102 HD11 LEU 102 15.692 -3.121 8.737 774 2HD1 LEU 102 HD12 LEU 102 15.990 -2.747 10.434 775 3HD1 LEU 102 HD13 LEU 102 15.966 -1.452 9.236 776 1HD2 LEU 102 HD21 LEU 102 12.823 -1.176 11.170 777 2HD2 LEU 102 HD22 LEU 102 13.747 -0.125 10.093 778 3HD2 LEU 102 HD23 LEU 102 14.560 -0.975 11.407 779 H HIS 103 HN HIS 103 11.019 -2.329 6.582 780 HA HIS 103 HA HIS 103 11.962 -1.043 4.258 781 1HB HIS 103 HB1 HIS 103 10.620 -3.382 4.839 782 2HB HIS 103 HB2 HIS 103 9.403 -2.444 3.986 783 HD2 HIS 103 HD2 HIS 103 10.968 -5.128 2.726 784 HE1 HIS 103 HE1 HIS 103 12.546 -2.215 0.092 785 HE2 HIS 103 HE2 HIS 103 12.153 -4.693 0.459 786 H MET 104 HN MET 104 9.033 -0.640 6.193 787 HA MET 104 HA MET 104 7.553 0.945 4.451 788 1HB MET 104 HB2 MET 104 6.335 1.706 6.404 789 2HB MET 104 HB1 MET 104 6.675 -0.011 6.566 790 1HG MET 104 HG1 MET 104 7.983 0.286 8.362 791 2HG MET 104 HG2 MET 104 8.688 1.768 7.725 792 1HE MET 104 HE1 MET 104 4.684 1.890 7.838 793 2HE MET 104 HE2 MET 104 4.500 1.611 9.571 794 3HE MET 104 HE3 MET 104 5.267 0.387 8.553 795 H LEU 105 HN LEU 105 10.182 1.805 6.629 796 HA LEU 105 HA LEU 105 9.893 4.647 6.041 797 1HB LEU 105 HB1 LEU 105 12.232 3.458 7.490 798 2HB LEU 105 HB2 LEU 105 11.511 5.044 7.677 799 HG LEU 105 HG LEU 105 10.137 2.507 8.542 800 1HD1 LEU 105 HD11 LEU 105 11.780 4.405 10.214 801 2HD1 LEU 105 HD12 LEU 105 12.262 2.774 9.747 802 3HD1 LEU 105 HD13 LEU 105 10.868 3.013 10.800 803 1HD2 LEU 105 HD21 LEU 105 9.535 5.387 8.604 804 2HD2 LEU 105 HD22 LEU 105 9.174 4.487 10.080 805 3HD2 LEU 105 HD23 LEU 105 8.452 3.995 8.547 806 H GLU 106 HN GLU 106 11.287 1.935 4.708 807 HA GLU 106 HA GLU 106 13.451 3.456 3.463 808 1HB GLU 106 HB2 GLU 106 13.004 0.540 4.035 809 2HB GLU 106 HB1 GLU 106 14.182 1.036 2.818 810 1HG GLU 106 HG2 GLU 106 14.144 1.774 5.726 811 2HG GLU 106 HG1 GLU 106 15.263 0.664 4.936 812 H SER 107 HN SER 107 10.359 2.546 2.746 813 HA SER 107 HA SER 107 10.881 2.862 -0.106 814 1HB SER 107 HB2 SER 107 10.817 0.343 0.691 815 2HB SER 107 HB1 SER 107 9.075 0.606 0.640 816 HG SER 107 HG SER 107 10.793 0.216 -1.396 817 HA PRO 108 HA PRO 108 7.119 5.204 0.299 818 1HB PRO 108 HB2 PRO 108 6.711 5.762 -2.306 819 2HB PRO 108 HB1 PRO 108 8.004 6.527 -1.373 820 1HG PRO 108 HG1 PRO 108 8.148 4.212 -3.271 821 2HG PRO 108 HG2 PRO 108 9.239 5.603 -3.120 822 1HD PRO 108 HD1 PRO 108 9.786 3.160 -2.051 823 2HD PRO 108 HD2 PRO 108 10.368 4.680 -1.342 824 H GLU 109 HN GLU 109 7.381 2.124 -0.763 825 HA GLU 109 HA GLU 109 4.481 1.896 -1.246 826 1HB GLU 109 HB2 GLU 109 6.682 0.308 -2.594 827 2HB GLU 109 HB1 GLU 109 4.957 0.024 -2.790 828 1HG GLU 109 HG1 GLU 109 4.674 1.807 -4.156 829 2HG GLU 109 HG2 GLU 109 5.947 2.748 -3.377 830 H SER 110 HN SER 110 7.153 1.029 0.605 831 HA SER 110 HA SER 110 6.179 -1.561 1.420 832 1HB SER 110 HB1 SER 110 8.558 0.051 1.918 833 2HB SER 110 HB2 SER 110 7.955 -0.750 3.370 834 HG SER 110 HG SER 110 7.996 -2.341 1.128 835 H LEU 111 HN LEU 111 6.307 1.707 2.724 836 HA LEU 111 HA LEU 111 5.129 1.365 5.187 837 1HB LEU 111 HB1 LEU 111 5.984 3.470 3.995 838 2HB LEU 111 HB2 LEU 111 4.396 3.565 3.256 839 HG LEU 111 HG LEU 111 4.341 5.074 5.043 840 1HD1 LEU 111 HD21 LEU 111 2.604 4.326 6.411 841 2HD1 LEU 111 HD22 LEU 111 3.148 2.651 6.336 842 3HD1 LEU 111 HD23 LEU 111 2.428 3.410 4.916 843 1HD2 LEU 111 HD11 LEU 111 5.343 3.002 6.954 844 2HD2 LEU 111 HD12 LEU 111 5.195 4.743 7.194 845 3HD2 LEU 111 HD13 LEU 111 6.422 4.110 6.092 846 H ARG 112 HN ARG 112 3.653 1.534 1.985 847 HA ARG 112 HA ARG 112 0.992 1.172 2.996 848 1HB ARG 112 HB2 ARG 112 0.808 2.329 1.060 849 2HB ARG 112 HB1 ARG 112 2.255 1.610 0.361 850 1HG ARG 112 HG1 ARG 112 1.108 -0.217 -0.452 851 2HG ARG 112 HG2 ARG 112 -0.234 -0.011 0.674 852 1HD ARG 112 HD2 ARG 112 -0.808 2.109 -0.515 853 2HD ARG 112 HD1 ARG 112 0.409 1.696 -1.723 854 HE ARG 112 HE ARG 112 -1.007 -0.443 -1.948 855 1HH1 ARG 112 HH21 ARG 112 -2.260 2.735 -1.251 856 2HH1 ARG 112 HH22 ARG 112 -3.800 2.427 -1.982 857 1HH2 ARG 112 HH11 ARG 112 -3.030 -0.854 -2.912 858 2HH2 ARG 112 HH12 ARG 112 -4.238 0.387 -2.927 859 H SER 113 HN SER 113 2.928 -0.810 0.738 860 HA SER 113 HA SER 113 1.372 -3.054 0.695 861 1HB SER 113 HB1 SER 113 4.132 -2.431 0.067 862 2HB SER 113 HB2 SER 113 3.982 -4.070 0.700 863 HG SER 113 HG SER 113 3.684 -3.845 -1.620 864 H LYS 114 HN LYS 114 4.037 -2.431 2.964 865 HA LYS 114 HA LYS 114 3.745 -4.780 4.457 866 1HB LYS 114 HB1 LYS 114 4.777 -2.097 5.393 867 2HB LYS 114 HB2 LYS 114 5.025 -3.634 6.210 868 1HG LYS 114 HG1 LYS 114 5.975 -3.052 3.419 869 2HG LYS 114 HG2 LYS 114 6.964 -2.833 4.864 870 1HD LYS 114 HD1 LYS 114 6.353 -5.297 5.366 871 2HD LYS 114 HD2 LYS 114 5.918 -5.368 3.657 872 1HE LYS 114 HE2 LYS 114 8.314 -4.220 3.426 873 2HE LYS 114 HE1 LYS 114 8.576 -5.091 4.936 874 1HZ LYS 114 HZ1 LYS 114 7.458 -6.998 3.469 875 2HZ LYS 114 HZ2 LYS 114 9.129 -6.738 3.527 876 3HZ LYS 114 HZ3 LYS 114 8.220 -6.117 2.242 877 H VAL 115 HN VAL 115 1.992 -1.736 4.563 878 HA VAL 115 HA VAL 115 0.770 -2.278 7.110 879 HB VAL 115 HB VAL 115 0.484 -0.172 5.062 880 1HG1 VAL 115 HG11 VAL 115 -1.844 -1.083 5.231 881 2HG1 VAL 115 HG12 VAL 115 -1.684 0.582 5.789 882 3HG1 VAL 115 HG13 VAL 115 -1.802 -0.731 6.959 883 1HG2 VAL 115 HG21 VAL 115 0.056 0.108 8.001 884 2HG2 VAL 115 HG22 VAL 115 0.787 1.238 6.859 885 3HG2 VAL 115 HG23 VAL 115 1.677 -0.196 7.373 886 H ASP 116 HN ASP 116 -0.439 -2.368 3.742 887 HA ASP 116 HA ASP 116 -2.880 -3.597 4.290 888 1HB ASP 116 HB1 ASP 116 -1.533 -2.778 2.004 889 2HB ASP 116 HB2 ASP 116 -1.681 -4.520 1.794 890 H GLU 117 HN GLU 117 0.342 -4.860 4.143 891 HA GLU 117 HA GLU 117 -0.473 -7.638 4.104 892 1HB GLU 117 HB1 GLU 117 2.139 -6.182 4.263 893 2HB GLU 117 HB2 GLU 117 2.068 -7.858 4.790 894 1HG GLU 117 HG2 GLU 117 1.509 -8.630 2.661 895 2HG GLU 117 HG1 GLU 117 1.041 -7.023 2.105 896 H ALA 118 HN ALA 118 0.436 -5.167 6.396 897 HA ALA 118 HA ALA 118 0.634 -6.884 8.667 898 1HB ALA 118 HB1 ALA 118 -0.068 -3.977 8.808 899 2HB ALA 118 HB2 ALA 118 1.572 -4.514 8.443 900 3HB ALA 118 HB3 ALA 118 0.820 -4.959 9.975 901 H VAL 119 HN VAL 119 -1.842 -5.667 6.766 902 HA VAL 119 HA VAL 119 -3.997 -5.626 8.623 903 HB VAL 119 HB VAL 119 -3.841 -5.921 5.644 904 1HG1 VAL 119 HG11 VAL 119 -6.213 -5.860 5.505 905 2HG1 VAL 119 HG12 VAL 119 -6.370 -5.618 7.245 906 3HG1 VAL 119 HG13 VAL 119 -5.794 -7.163 6.617 907 1HG2 VAL 119 HG21 VAL 119 -5.116 -3.681 7.147 908 2HG2 VAL 119 HG22 VAL 119 -4.332 -3.676 5.564 909 3HG2 VAL 119 HG23 VAL 119 -3.351 -3.766 7.031 910 H ALA 120 HN ALA 120 -2.865 -7.938 6.208 911 HA ALA 120 HA ALA 120 -4.578 -10.064 6.805 912 1HB ALA 120 HB1 ALA 120 -1.958 -10.971 6.026 913 2HB ALA 120 HB2 ALA 120 -2.432 -9.552 5.085 914 3HB ALA 120 HB3 ALA 120 -3.465 -10.986 5.108 915 H VAL 121 HN VAL 121 -1.740 -8.850 8.362 916 HA VAL 121 HA VAL 121 -1.356 -11.166 10.056 917 HB VAL 121 HB VAL 121 -0.004 -8.492 9.789 918 1HG1 VAL 121 HG21 VAL 121 0.747 -8.514 11.864 919 2HG1 VAL 121 HG22 VAL 121 1.424 -10.125 11.619 920 3HG1 VAL 121 HG23 VAL 121 -0.229 -9.943 12.205 921 1HG2 VAL 121 HG11 VAL 121 1.369 -11.137 9.754 922 2HG2 VAL 121 HG12 VAL 121 1.764 -9.649 8.894 923 3HG2 VAL 121 HG13 VAL 121 0.416 -10.648 8.354 924 H LEU 122 HN LEU 122 -2.834 -8.011 10.175 925 HA LEU 122 HA LEU 122 -3.160 -7.926 13.011 926 1HB LEU 122 HB2 LEU 122 -3.492 -5.792 12.513 927 2HB LEU 122 HB1 LEU 122 -3.553 -6.177 10.807 928 HG LEU 122 HG LEU 122 -6.080 -6.843 11.572 929 1HD1 LEU 122 HD11 LEU 122 -5.137 -5.587 13.804 930 2HD1 LEU 122 HD12 LEU 122 -6.837 -5.696 13.341 931 3HD1 LEU 122 HD13 LEU 122 -5.899 -4.260 12.928 932 1HD2 LEU 122 HD21 LEU 122 -6.662 -4.534 10.694 933 2HD2 LEU 122 HD22 LEU 122 -5.682 -5.553 9.641 934 3HD2 LEU 122 HD23 LEU 122 -4.925 -4.256 10.567 935 H GLN 123 HN GLN 123 -4.961 -9.181 10.325 936 HA GLN 123 HA GLN 123 -7.360 -9.655 11.886 937 1HB GLN 123 HB1 GLN 123 -6.570 -10.524 9.096 938 2HB GLN 123 HB2 GLN 123 -8.134 -10.843 9.831 939 1HG GLN 123 HG2 GLN 123 -7.425 -8.037 9.950 940 2HG GLN 123 HG1 GLN 123 -7.446 -8.655 8.299 941 1HE2 GLN 123 HE22 GLN 123 -9.374 -9.499 7.459 942 2HE2 GLN 123 HE21 GLN 123 -10.908 -9.116 8.155 943 H ALA 124 HN ALA 124 -4.415 -11.214 11.069 944 HA ALA 124 HA ALA 124 -5.309 -13.883 11.785 945 1HB ALA 124 HB1 ALA 124 -3.730 -13.796 10.025 946 2HB ALA 124 HB2 ALA 124 -2.870 -14.423 11.431 947 3HB ALA 124 HB3 ALA 124 -2.659 -12.741 10.947 948 H HIS 125 HN HIS 125 -4.400 -11.159 13.455 949 HA HIS 125 HA HIS 125 -3.351 -12.754 15.697 950 1HB HIS 125 HB1 HIS 125 -2.171 -10.564 14.461 951 2HB HIS 125 HB2 HIS 125 -2.914 -9.870 15.899 952 HD2 HIS 125 HD2 HIS 125 -1.558 -10.246 18.202 953 HE1 HIS 125 HE1 HIS 125 1.229 -13.048 16.686 954 HE2 HIS 125 HE2 HIS 125 0.581 -11.631 18.688 955 H GLN 126 HN GLN 126 -5.582 -10.226 14.703 956 HA GLN 126 HA GLN 126 -6.594 -9.559 17.265 957 1HB GLN 126 HB1 GLN 126 -7.464 -9.193 14.460 958 2HB GLN 126 HB2 GLN 126 -8.752 -9.189 15.657 959 1HG GLN 126 HG1 GLN 126 -6.954 -7.531 16.824 960 2HG GLN 126 HG2 GLN 126 -6.670 -7.201 15.116 961 1HE2 GLN 126 HE21 GLN 126 -7.615 -5.223 16.697 962 2HE2 GLN 126 HE22 GLN 126 -9.266 -4.883 16.316 963 H ALA 127 HN ALA 127 -8.536 -11.228 14.836 964 HA ALA 127 HA ALA 127 -9.618 -13.000 16.893 965 1HB ALA 127 HB1 ALA 127 -11.114 -13.768 15.019 966 2HB ALA 127 HB2 ALA 127 -10.392 -12.504 14.022 967 3HB ALA 127 HB3 ALA 127 -11.296 -12.074 15.474 968 H LYS 128 HN LYS 128 -7.086 -13.520 16.706 969 HA LYS 128 HA LYS 128 -6.165 -15.077 14.612 970 1HB LYS 128 HB2 LYS 128 -4.228 -15.380 15.853 971 2HB LYS 128 HB1 LYS 128 -4.874 -13.886 16.515 972 1HG LYS 128 HG1 LYS 128 -5.992 -15.532 18.240 973 2HG LYS 128 HG2 LYS 128 -4.656 -16.574 17.753 974 1HD LYS 128 HD2 LYS 128 -3.512 -14.061 18.154 975 2HD LYS 128 HD1 LYS 128 -4.648 -14.270 19.488 976 1HE LYS 128 HE1 LYS 128 -3.395 -16.730 19.284 977 2HE LYS 128 HE2 LYS 128 -2.100 -15.568 18.995 978 1HZ LYS 128 HZ1 LYS 128 -3.947 -15.410 21.310 979 2HZ LYS 128 HZ2 LYS 128 -2.526 -14.524 21.065 980 3HZ LYS 128 HZ3 LYS 128 -2.444 -16.186 21.367 981 H GLU 129 HN GLU 129 -6.333 -17.057 14.072 982 HA GLU 129 HA GLU 129 -7.954 -18.895 15.651 983 1HB GLU 129 HB1 GLU 129 -7.695 -20.376 13.619 984 2HB GLU 129 HB2 GLU 129 -8.533 -18.858 13.336 985 1HG GLU 129 HG1 GLU 129 -6.731 -17.938 12.182 986 2HG GLU 129 HG2 GLU 129 -5.595 -19.121 12.830 987 H ALA 130 HN ALA 130 -4.855 -17.961 15.543 988 HA ALA 130 HA ALA 130 -3.439 -20.431 15.571 989 1HB ALA 130 HB1 ALA 130 -2.405 -18.284 14.963 990 2HB ALA 130 HB2 ALA 130 -1.540 -19.089 16.274 991 3HB ALA 130 HB3 ALA 130 -2.609 -17.729 16.625 992 H ALA 131 HN ALA 131 -5.523 -19.052 17.779 993 HA ALA 131 HA ALA 131 -4.180 -19.756 20.210 994 1HB ALA 131 HB1 ALA 131 -5.786 -18.553 21.168 995 2HB ALA 131 HB2 ALA 131 -7.052 -19.557 20.463 996 3HB ALA 131 HB3 ALA 131 -6.385 -18.208 19.546 997 H GLN 132 HN GLN 132 -5.677 -21.560 17.833 998 HA GLN 132 HA GLN 132 -7.005 -23.529 19.386 999 1HB GLN 132 HB2 GLN 132 -5.873 -23.615 16.585 1000 2HB GLN 132 HB1 GLN 132 -6.827 -24.911 17.294 1001 1HG GLN 132 HG1 GLN 132 -8.247 -22.476 17.630 1002 2HG GLN 132 HG2 GLN 132 -7.719 -22.589 15.952 1003 1HE2 GLN 132 HE22 GLN 132 -10.292 -23.072 17.703 1004 2HE2 GLN 132 HE21 GLN 132 -10.965 -24.481 16.962 1005 H LYS 133 HN LYS 133 -6.248 -25.248 20.451 1006 HA LYS 133 HA LYS 133 -3.459 -25.559 20.880 1007 1HB LYS 133 HB1 LYS 133 -5.907 -27.070 21.726 1008 2HB LYS 133 HB2 LYS 133 -4.313 -27.754 22.015 1009 1HG LYS 133 HG1 LYS 133 -5.080 -24.999 22.930 1010 2HG LYS 133 HG2 LYS 133 -5.343 -26.443 23.911 1011 1HD LYS 133 HD1 LYS 133 -2.915 -26.942 23.723 1012 2HD LYS 133 HD2 LYS 133 -2.704 -25.402 22.888 1013 1HE LYS 133 HE1 LYS 133 -3.976 -24.494 25.025 1014 2HE LYS 133 HE2 LYS 133 -3.298 -25.953 25.746 1015 1HZ LYS 133 HZ1 LYS 133 -1.573 -24.129 24.207 1016 2HZ LYS 133 HZ2 LYS 133 -1.151 -25.217 25.431 1017 3HZ LYS 133 HZ3 LYS 133 -1.951 -23.778 25.819 1018 H ALA 134 HN ALA 134 -5.606 -26.779 18.524 1019 HA ALA 134 HA ALA 134 -3.969 -29.099 17.895 1020 1HB ALA 134 HB1 ALA 134 -5.675 -29.817 16.533 1021 2HB ALA 134 HB2 ALA 134 -6.219 -28.181 16.166 1022 3HB ALA 134 HB3 ALA 134 -6.567 -28.893 17.742 1023 H VAL 135 HN VAL 135 -2.157 -28.797 16.787 1024 HA VAL 135 HA VAL 135 -1.871 -26.524 15.000 1025 HB VAL 135 HB VAL 135 0.486 -27.453 14.720 1026 1HG1 VAL 135 HG21 VAL 135 0.154 -26.930 17.598 1027 2HG1 VAL 135 HG22 VAL 135 -0.566 -25.737 16.517 1028 3HG1 VAL 135 HG23 VAL 135 1.155 -26.109 16.400 1029 1HG2 VAL 135 HG11 VAL 135 0.680 -29.587 15.400 1030 2HG2 VAL 135 HG12 VAL 135 -0.694 -29.469 16.500 1031 3HG2 VAL 135 HG13 VAL 135 0.887 -28.868 16.997 1032 H ASN 136 HN ASN 136 -3.766 -28.143 13.978 1033 HA ASN 136 HA ASN 136 -2.548 -29.929 12.031 1034 1HB ASN 136 HB2 ASN 136 -5.449 -29.237 12.550 1035 2HB ASN 136 HB1 ASN 136 -4.890 -30.446 11.398 1036 1HD2 ASN 136 HD22 ASN 136 -4.984 -32.436 12.109 1037 2HD2 ASN 136 HD21 ASN 136 -4.835 -32.946 13.753 1038 H SER 137 HN SER 137 -2.435 -26.847 12.084 1039 HA SER 137 HA SER 137 -3.790 -26.042 9.689 1040 1HB SER 137 HB2 SER 137 -2.728 -24.697 11.837 1041 2HB SER 137 HB1 SER 137 -1.549 -24.360 10.570 1042 HG SER 137 HG SER 137 -3.002 -22.835 10.194 1043 H ALA 138 HN ALA 138 -0.303 -26.072 10.464 1044 HA ALA 138 HA ALA 138 0.335 -26.243 7.640 1045 1HB ALA 138 HB1 ALA 138 1.556 -24.938 9.623 1046 2HB ALA 138 HB2 ALA 138 2.402 -25.493 8.178 1047 3HB ALA 138 HB3 ALA 138 2.481 -26.439 9.664 1048 H THR 139 HN THR 139 0.768 -28.217 10.557 1049 HA THR 139 HA THR 139 1.807 -30.417 8.948 1050 HB THR 139 HB THR 139 1.424 -31.125 11.702 1051 HG1 THR 139 HG1 THR 139 3.033 -29.429 12.388 1052 1HG2 THR 139 HG21 THR 139 3.654 -30.919 9.798 1053 2HG2 THR 139 HG22 THR 139 3.215 -32.218 10.909 1054 3HG2 THR 139 HG23 THR 139 4.073 -30.797 11.507 1055 H GLY 140 HN GLY 140 0.051 -31.171 7.804 1056 1HA GLY 140 HA1 GLY 140 -2.350 -31.939 9.298 1057 2HA GLY 140 HA2 GLY 140 -2.202 -31.864 7.549 1058 H VAL 141 HN VAL 141 -3.323 -34.030 8.974 1059 HA VAL 141 HA VAL 141 -1.292 -36.129 8.828 1060 HB VAL 141 HB VAL 141 -4.143 -36.464 9.743 1061 1HG1 VAL 141 HG11 VAL 141 -3.569 -38.606 9.869 1062 2HG1 VAL 141 HG12 VAL 141 -2.360 -38.178 11.079 1063 3HG1 VAL 141 HG13 VAL 141 -1.919 -38.232 9.372 1064 1HG2 VAL 141 HG21 VAL 141 -1.914 -35.133 11.060 1065 2HG2 VAL 141 HG22 VAL 141 -2.581 -36.462 12.008 1066 3HG2 VAL 141 HG23 VAL 141 -3.629 -35.149 11.472 1067 HA PRO 142 HA PRO 142 -4.868 -37.757 5.851 1068 1HB PRO 142 HB2 PRO 142 -5.898 -35.112 4.971 1069 2HB PRO 142 HB1 PRO 142 -6.769 -36.624 5.250 1070 1HG PRO 142 HG2 PRO 142 -6.947 -34.615 6.987 1071 2HG PRO 142 HG1 PRO 142 -6.865 -36.297 7.546 1072 1HD PRO 142 HD1 PRO 142 -4.733 -34.200 7.516 1073 2HD PRO 142 HD2 PRO 142 -5.080 -35.439 8.740 1074 H THR 143 HN THR 143 -3.731 -34.481 4.991 1075 HA THR 143 HA THR 143 -2.571 -35.608 2.535 1076 HB THR 143 HB THR 143 -2.527 -33.272 1.716 1077 HG1 THR 143 HG1 THR 143 -3.845 -31.789 3.057 1078 1HG2 THR 143 HG21 THR 143 -4.889 -34.788 2.215 1079 2HG2 THR 143 HG22 THR 143 -4.520 -33.696 0.880 1080 3HG2 THR 143 HG23 THR 143 -5.246 -33.067 2.358 1081 H VAL 144 HN VAL 144 -0.441 -35.785 2.351 1082 HA VAL 144 HA VAL 144 1.280 -34.896 4.474 1083 HB VAL 144 HB VAL 144 1.694 -37.045 3.408 1084 1HG1 VAL 144 HG11 VAL 144 2.290 -35.454 0.917 1085 2HG1 VAL 144 HG12 VAL 144 0.901 -36.511 1.165 1086 3HG1 VAL 144 HG13 VAL 144 2.528 -37.190 1.115 1087 1HG2 VAL 144 HG21 VAL 144 3.580 -35.843 4.401 1088 2HG2 VAL 144 HG22 VAL 144 3.911 -35.079 2.846 1089 3HG2 VAL 144 HG23 VAL 144 4.090 -36.823 3.027
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